NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
427925 | 2hug | 7241 | cing | 4-filtered-FRED | STAR | entry | full | 804 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2hug # This FRED archive file contains, for PDB entry <2hug>: # # - 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_2hug _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2hug _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all free" _Assembly.Molecular_mass 8046.76 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 $Signal_recognition_particle_43_kDa_protein__chloroplast A . 1 1 2 . 2 $Signal_recognition_particle_54_kDa_protein__chloroplast B . 1 1 stop_ save_ save_Signal_recognition_particle_43_kDa_protein__chloroplast _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Signal recognition particle 43 kDa protein chloroplast" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSQVFEYAEVDEIVEKRGKGKDVEYLVRWKDGGDCEWVKGVHVAEDVAKDYEDGLEY _Entity.Number_of_monomers 57 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 SER . 1 1 3 GLN . 1 1 4 VAL . 1 1 5 PHE . 1 1 6 GLU . 1 1 7 TYR . 1 1 8 ALA . 1 1 9 GLU . 1 1 10 VAL . 1 1 11 ASP . 1 1 12 GLU . 1 1 13 ILE . 1 1 14 VAL . 1 1 15 GLU . 1 1 16 LYS . 1 1 17 ARG . 1 1 18 GLY . 1 1 19 LYS . 1 1 20 GLY . 1 1 21 LYS . 1 1 22 ASP . 1 1 23 VAL . 1 1 24 GLU . 1 1 25 TYR . 1 1 26 LEU . 1 1 27 VAL . 1 1 28 ARG . 1 1 29 TRP . 1 1 30 LYS . 1 1 31 ASP . 1 1 32 GLY . 1 1 33 GLY . 1 1 34 ASP . 1 1 35 CYS . 1 1 36 GLU . 1 1 37 TRP . 1 1 38 VAL . 1 1 39 LYS . 1 1 40 GLY . 1 1 41 VAL . 1 1 42 HIS . 1 1 43 VAL . 1 1 44 ALA . 1 1 45 GLU . 1 1 46 ASP . 1 1 47 VAL . 1 1 48 ALA . 1 1 49 LYS . 1 1 50 ASP . 1 1 51 TYR . 1 1 52 GLU . 1 1 53 ASP . 1 1 54 GLY . 1 1 55 LEU . 1 1 56 GLU . 1 1 57 TYR . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 SER 2 2 1 1 GLN 3 3 1 1 VAL 4 4 1 1 PHE 5 5 1 1 GLU 6 6 1 1 TYR 7 7 1 1 ALA 8 8 1 1 GLU 9 9 1 1 VAL 10 10 1 1 ASP 11 11 1 1 GLU 12 12 1 1 ILE 13 13 1 1 VAL 14 14 1 1 GLU 15 15 1 1 LYS 16 16 1 1 ARG 17 17 1 1 GLY 18 18 1 1 LYS 19 19 1 1 GLY 20 20 1 1 LYS 21 21 1 1 ASP 22 22 1 1 VAL 23 23 1 1 GLU 24 24 1 1 TYR 25 25 1 1 LEU 26 26 1 1 VAL 27 27 1 1 ARG 28 28 1 1 TRP 29 29 1 1 LYS 30 30 1 1 ASP 31 31 1 1 GLY 32 32 1 1 GLY 33 33 1 1 ASP 34 34 1 1 CYS 35 35 1 1 GLU 36 36 1 1 TRP 37 37 1 1 VAL 38 38 1 1 LYS 39 39 1 1 GLY 40 40 1 1 VAL 41 41 1 1 HIS 42 42 1 1 VAL 43 43 1 1 ALA 44 44 1 1 GLU 45 45 1 1 ASP 46 46 1 1 VAL 47 47 1 1 ALA 48 48 1 1 LYS 49 49 1 1 ASP 50 50 1 1 TYR 51 51 1 1 GLU 52 52 1 1 ASP 53 53 1 1 GLY 54 54 1 1 LEU 55 55 1 1 GLU 56 56 1 1 TYR 57 57 1 1 stop_ save_ save_Signal_recognition_particle_54_kDa_protein__chloroplast _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "Signal recognition particle 54 kDa protein chloroplast" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code APPGTARRKRKADS _Entity.Number_of_monomers 14 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 2 2 PRO . 1 2 3 PRO . 1 2 4 GLY . 1 2 5 THR . 1 2 6 ALA . 1 2 7 ARG . 1 2 8 ARG . 1 2 9 LYS . 1 2 10 ARG . 1 2 11 LYS . 1 2 12 ALA . 1 2 13 ASP . 1 2 14 SER . 1 2 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ALA 1 1 1 2 PRO 2 2 1 2 PRO 3 3 1 2 GLY 4 4 1 2 THR 5 5 1 2 ALA 6 6 1 2 ARG 7 7 1 2 ARG 8 8 1 2 LYS 9 9 1 2 ARG 10 10 1 2 LYS 11 11 1 2 ALA 12 12 1 2 ASP 13 13 1 2 SER 14 14 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 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 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 24 GLU H A 24 . HN 1 1 1 1 2 1 1 25 TYR H A 25 . HN 1 1 2 1 1 1 1 2 SER H A 2 . HN 1 1 2 1 2 1 1 3 GLN H A 3 . HN 1 1 3 1 1 1 1 4 VAL H A 4 . HN 1 1 3 1 2 1 1 18 GLY H A 18 . HN 1 1 4 1 1 1 1 56 GLU H A 56 . HN 1 1 4 1 2 1 1 57 TYR H A 57 . HN 1 1 5 1 1 1 1 52 GLU H A 52 . HN 1 1 5 1 2 1 1 53 ASP H A 53 . HN 1 1 6 1 1 1 1 20 GLY H A 20 . HN 1 1 6 1 2 1 1 21 LYS H A 21 . HN 1 1 7 1 1 2 2 10 ARG HG2 B 10 . HG2 1 1 7 1 2 2 2 12 ALA H B 12 . HN 1 1 8 1 1 1 1 13 ILE H A 13 . HN 1 1 8 1 2 1 1 13 ILE HB A 13 . HB 1 1 9 1 1 1 1 14 VAL H A 14 . HN 1 1 9 1 2 1 1 15 GLU HA A 15 . HA 1 1 10 1 1 1 1 17 ARG H A 17 . HN 1 1 10 1 2 1 1 17 ARG HA A 17 . HA 1 1 11 1 1 1 1 17 ARG H A 17 . HN 1 1 11 1 2 1 1 17 ARG QB A 17 . HB2 1 1 12 1 1 1 1 20 GLY HA3 A 20 . HA1 1 1 12 1 2 1 1 21 LYS H A 21 . HN 1 1 13 1 1 1 1 22 ASP H A 22 . HN 1 1 13 1 2 1 1 22 ASP HB2 A 22 . HB2 1 1 14 1 1 1 1 30 LYS H A 30 . HN 1 1 14 1 2 1 1 30 LYS HA A 30 . HA 1 1 15 1 1 1 1 30 LYS H A 30 . HN 1 1 15 1 2 1 1 30 LYS HB3 A 30 . HB2 1 1 16 1 1 1 1 11 ASP H A 11 . HN 1 1 16 1 2 1 1 30 LYS H A 30 . HN 1 1 17 1 1 1 1 29 TRP QB A 29 . HB2 1 1 17 1 2 1 1 30 LYS H A 30 . HN 1 1 18 1 1 1 1 30 LYS HB3 A 30 . HB2 1 1 18 1 2 1 1 31 ASP H A 31 . HN 1 1 19 1 1 1 1 32 GLY HA2 A 32 . HA2 1 1 19 1 2 1 1 33 GLY H A 33 . HN 1 1 20 1 1 1 1 24 GLU HA A 24 . HA 1 1 20 1 2 1 1 40 GLY H A 40 . HN 1 1 21 1 1 1 1 42 HIS H A 42 . HN 1 1 21 1 2 1 1 43 VAL H A 43 . HN 1 1 22 1 1 1 1 42 HIS HA A 42 . HA 1 1 22 1 2 1 1 44 ALA H A 44 . HN 1 1 23 1 1 1 1 45 GLU H A 45 . HN 1 1 23 1 2 1 1 45 GLU HA A 45 . HA 1 1 24 1 1 1 1 45 GLU H A 45 . HN 1 1 24 1 2 2 2 12 ALA MB B 12 . HB2 1 1 25 1 1 1 1 46 ASP H A 46 . HN 1 1 25 1 2 1 1 46 ASP HA A 46 . HA 1 1 26 1 1 1 1 45 GLU HA A 45 . HA 1 1 26 1 2 1 1 46 ASP H A 46 . HN 1 1 27 1 1 1 1 50 ASP H A 50 . HN 1 1 27 1 2 1 1 50 ASP HA A 50 . HA 1 1 28 1 1 1 1 52 GLU H A 52 . HN 1 1 28 1 2 1 1 52 GLU HG2 A 52 . HG2 1 1 29 1 1 1 1 11 ASP H A 11 . HN 1 1 29 1 2 1 1 29 TRP HA A 29 . HA 1 1 30 1 1 1 1 18 GLY H A 18 . HN 1 1 30 1 2 1 1 19 LYS H A 19 . HN 1 1 31 1 1 1 1 21 LYS H A 21 . HN 1 1 31 1 2 1 1 22 ASP H A 22 . HN 1 1 32 1 1 1 1 25 TYR H A 25 . HN 1 1 32 1 2 1 1 40 GLY H A 40 . HN 1 1 33 1 1 1 1 25 TYR H A 25 . HN 1 1 33 1 2 1 1 38 VAL H A 38 . HN 1 1 34 1 1 1 1 27 VAL H A 27 . HN 1 1 34 1 2 1 1 37 TRP HA A 37 . HA 1 1 35 1 1 1 1 38 VAL H A 38 . HN 1 1 35 1 2 1 1 39 LYS H A 39 . HN 1 1 36 1 1 1 1 54 GLY H A 54 . HN 1 1 36 1 2 1 1 55 LEU H A 55 . HN 1 1 37 1 1 1 1 26 LEU HG A 26 . HG 1 1 37 1 2 1 1 27 VAL H A 27 . HN 1 1 38 1 1 1 1 17 ARG H A 17 . HN 1 1 38 1 2 1 1 25 TYR HA A 25 . HA 1 1 39 1 1 1 1 28 ARG H A 28 . HN 1 1 39 1 2 1 1 29 TRP QB A 29 . HB2 1 1 40 1 1 1 1 12 GLU H A 12 . HN 1 1 40 1 2 1 1 28 ARG H A 28 . HN 1 1 41 1 1 1 1 26 LEU HA A 26 . HA 1 1 41 1 2 1 1 38 VAL H A 38 . HN 1 1 42 1 1 1 1 3 GLN H A 3 . HN 1 1 42 1 2 1 1 3 GLN QB A 3 . HB2 1 1 43 1 1 1 1 3 GLN H A 3 . HN 1 1 43 1 2 1 1 4 VAL H A 4 . HN 1 1 44 1 1 1 1 4 VAL H A 4 . HN 1 1 44 1 2 1 1 4 VAL HB A 4 . HB 1 1 45 1 1 1 1 22 ASP HA A 22 . HA 1 1 45 1 2 1 1 23 VAL H A 23 . HN 1 1 46 1 1 1 1 10 VAL HA A 10 . HA 1 1 46 1 2 1 1 12 GLU H A 12 . HN 1 1 47 1 1 1 1 10 VAL H A 10 . HN 1 1 47 1 2 1 1 10 VAL HB A 10 . HB 1 1 48 1 1 2 2 10 ARG H B 10 . HN 1 1 48 1 2 2 2 10 ARG HG3 B 10 . HG1 1 1 49 1 1 2 2 10 ARG HG3 B 10 . HG1 1 1 49 1 2 2 2 11 LYS H B 11 . HN 1 1 50 1 1 2 2 10 ARG H B 10 . HN 1 1 50 1 2 2 2 10 ARG HG2 B 10 . HG2 1 1 51 1 1 2 2 10 ARG HG2 B 10 . HG2 1 1 51 1 2 2 2 11 LYS H B 11 . HN 1 1 52 1 1 1 1 10 VAL H A 10 . HN 1 1 52 1 2 1 1 12 GLU H A 12 . HN 1 1 53 1 1 1 1 14 VAL HB A 14 . HB 1 1 53 1 2 1 1 15 GLU H A 15 . HN 1 1 54 1 1 1 1 15 GLU HA A 15 . HA 1 1 54 1 2 1 1 16 LYS H A 16 . HN 1 1 55 1 1 1 1 15 GLU H A 15 . HN 1 1 55 1 2 1 1 15 GLU HA A 15 . HA 1 1 56 1 1 1 1 15 GLU H A 15 . HN 1 1 56 1 2 1 1 26 LEU H A 26 . HN 1 1 57 1 1 1 1 16 LYS HA A 16 . HA 1 1 57 1 2 1 1 17 ARG H A 17 . HN 1 1 58 1 1 1 1 16 LYS H A 16 . HN 1 1 58 1 2 1 1 17 ARG QB A 17 . HB2 1 1 59 1 1 1 1 17 ARG HA A 17 . HA 1 1 59 1 2 1 1 18 GLY H A 18 . HN 1 1 60 1 1 1 1 17 ARG H A 17 . HN 1 1 60 1 2 1 1 23 VAL HB A 23 . HB 1 1 61 1 1 1 1 17 ARG QB A 17 . HB2 1 1 61 1 2 1 1 18 GLY H A 18 . HN 1 1 62 1 1 1 1 18 GLY H A 18 . HN 1 1 62 1 2 1 1 18 GLY HA2 A 18 . HA2 1 1 63 1 1 1 1 18 GLY H A 18 . HN 1 1 63 1 2 1 1 18 GLY HA3 A 18 . HA1 1 1 64 1 1 1 1 18 GLY HA2 A 18 . HA2 1 1 64 1 2 1 1 19 LYS H A 19 . HN 1 1 65 1 1 1 1 18 GLY HA3 A 18 . HA1 1 1 65 1 2 1 1 19 LYS H A 19 . HN 1 1 66 1 1 1 1 19 LYS H A 19 . HN 1 1 66 1 2 1 1 19 LYS HA A 19 . HA 1 1 67 1 1 1 1 19 LYS HA A 19 . HA 1 1 67 1 2 1 1 20 GLY H A 20 . HN 1 1 68 1 1 1 1 19 LYS HA A 19 . HA 1 1 68 1 2 1 1 21 LYS H A 21 . HN 1 1 69 1 1 1 1 19 LYS HA A 19 . HA 1 1 69 1 2 1 1 23 VAL H A 23 . HN 1 1 70 1 1 1 1 19 LYS H A 19 . HN 1 1 70 1 2 1 1 23 VAL HB A 23 . HB 1 1 71 1 1 1 1 20 GLY H A 20 . HN 1 1 71 1 2 1 1 23 VAL HB A 23 . HB 1 1 72 1 1 1 1 19 LYS H A 19 . HN 1 1 72 1 2 1 1 19 LYS HB2 A 19 . HB2 1 1 73 1 1 1 1 19 LYS H A 19 . HN 1 1 73 1 2 1 1 20 GLY H A 20 . HN 1 1 74 1 1 1 1 20 GLY H A 20 . HN 1 1 74 1 2 1 1 20 GLY HA2 A 20 . HA2 1 1 75 1 1 1 1 20 GLY HA2 A 20 . HA2 1 1 75 1 2 1 1 21 LYS H A 21 . HN 1 1 76 1 1 1 1 20 GLY HA2 A 20 . HA2 1 1 76 1 2 1 1 22 ASP H A 22 . HN 1 1 77 1 1 1 1 20 GLY H A 20 . HN 1 1 77 1 2 1 1 20 GLY HA3 A 20 . HA1 1 1 78 1 1 1 1 20 GLY HA3 A 20 . HA1 1 1 78 1 2 1 1 22 ASP H A 22 . HN 1 1 79 1 1 1 1 20 GLY H A 20 . HN 1 1 79 1 2 1 1 22 ASP H A 22 . HN 1 1 80 1 1 1 1 20 GLY H A 20 . HN 1 1 80 1 2 1 1 23 VAL H A 23 . HN 1 1 81 1 1 1 1 18 GLY HA2 A 18 . HA2 1 1 81 1 2 1 1 22 ASP H A 22 . HN 1 1 82 1 1 1 1 22 ASP H A 22 . HN 1 1 82 1 2 1 1 23 VAL H A 23 . HN 1 1 83 1 1 1 1 22 ASP HB2 A 22 . HB2 1 1 83 1 2 1 1 23 VAL H A 23 . HN 1 1 84 1 1 1 1 21 LYS H A 21 . HN 1 1 84 1 2 1 1 22 ASP HB2 A 22 . HB2 1 1 85 1 1 1 1 24 GLU H A 24 . HN 1 1 85 1 2 1 1 24 GLU HA A 24 . HA 1 1 86 1 1 1 1 24 GLU HA A 24 . HA 1 1 86 1 2 1 1 25 TYR H A 25 . HN 1 1 87 1 1 1 1 24 GLU HA A 24 . HA 1 1 87 1 2 1 1 39 LYS H A 39 . HN 1 1 88 1 1 1 1 24 GLU HA A 24 . HA 1 1 88 1 2 1 1 41 VAL H A 41 . HN 1 1 89 1 1 1 1 24 GLU HA A 24 . HA 1 1 89 1 2 1 1 42 HIS H A 42 . HN 1 1 90 1 1 1 1 21 LYS H A 21 . HN 1 1 90 1 2 1 1 47 VAL HB A 47 . HB 1 1 91 1 1 1 1 24 GLU H A 24 . HN 1 1 91 1 2 1 1 24 GLU HB3 A 24 . HB2 1 1 92 1 1 1 1 24 GLU HB3 A 24 . HB2 1 1 92 1 2 1 1 25 TYR H A 25 . HN 1 1 93 1 1 1 1 25 TYR H A 25 . HN 1 1 93 1 2 1 1 25 TYR HA A 25 . HA 1 1 94 1 1 1 1 25 TYR HA A 25 . HA 1 1 94 1 2 1 1 26 LEU H A 26 . HN 1 1 95 1 1 1 1 25 TYR H A 25 . HN 1 1 95 1 2 1 1 25 TYR HB2 A 25 . HB2 1 1 96 1 1 1 1 25 TYR H A 25 . HN 1 1 96 1 2 1 1 26 LEU H A 26 . HN 1 1 97 1 1 1 1 15 GLU H A 15 . HN 1 1 97 1 2 1 1 26 LEU HA A 26 . HA 1 1 98 1 1 1 1 26 LEU H A 26 . HN 1 1 98 1 2 1 1 26 LEU HG A 26 . HG 1 1 99 1 1 1 1 26 LEU HG A 26 . HG 1 1 99 1 2 1 1 36 GLU H A 36 . HN 1 1 100 1 1 1 1 26 LEU HG A 26 . HG 1 1 100 1 2 1 1 37 TRP H A 37 . HN 1 1 101 1 1 1 1 27 VAL HA A 27 . HA 1 1 101 1 2 1 1 28 ARG H A 28 . HN 1 1 102 1 1 1 1 27 VAL H A 27 . HN 1 1 102 1 2 1 1 27 VAL HB A 27 . HB 1 1 103 1 1 1 1 11 ASP H A 11 . HN 1 1 103 1 2 1 1 28 ARG HB2 A 28 . HB2 1 1 104 1 1 1 1 12 GLU H A 12 . HN 1 1 104 1 2 1 1 28 ARG HB2 A 28 . HB2 1 1 105 1 1 1 1 28 ARG H A 28 . HN 1 1 105 1 2 1 1 28 ARG HB2 A 28 . HB2 1 1 106 1 1 1 1 12 GLU H A 12 . HN 1 1 106 1 2 1 1 30 LYS H A 30 . HN 1 1 107 1 1 1 1 29 TRP H A 29 . HN 1 1 107 1 2 1 1 29 TRP HA A 29 . HA 1 1 108 1 1 1 1 29 TRP HA A 29 . HA 1 1 108 1 2 1 1 30 LYS H A 30 . HN 1 1 109 1 1 1 1 29 TRP HA A 29 . HA 1 1 109 1 2 1 1 31 ASP H A 31 . HN 1 1 110 1 1 1 1 29 TRP H A 29 . HN 1 1 110 1 2 1 1 29 TRP QB A 29 . HB2 1 1 111 1 1 1 1 29 TRP QB A 29 . HB2 1 1 111 1 2 1 1 31 ASP H A 31 . HN 1 1 112 1 1 1 1 29 TRP QB A 29 . HB2 1 1 112 1 2 1 1 32 GLY H A 32 . HN 1 1 113 1 1 1 1 29 TRP QB A 29 . HB2 1 1 113 1 2 1 1 33 GLY H A 33 . HN 1 1 114 1 1 1 1 30 LYS HA A 30 . HA 1 1 114 1 2 1 1 31 ASP H A 31 . HN 1 1 115 1 1 1 1 30 LYS H A 30 . HN 1 1 115 1 2 1 1 31 ASP H A 31 . HN 1 1 116 1 1 1 1 31 ASP HA A 31 . HA 1 1 116 1 2 1 1 32 GLY H A 32 . HN 1 1 117 1 1 1 1 31 ASP H A 31 . HN 1 1 117 1 2 1 1 31 ASP HB2 A 31 . HB2 1 1 118 1 1 1 1 31 ASP HB2 A 31 . HB2 1 1 118 1 2 1 1 32 GLY H A 32 . HN 1 1 119 1 1 1 1 31 ASP H A 31 . HN 1 1 119 1 2 1 1 32 GLY H A 32 . HN 1 1 120 1 1 1 1 32 GLY H A 32 . HN 1 1 120 1 2 1 1 32 GLY HA3 A 32 . HA1 1 1 121 1 1 1 1 32 GLY H A 32 . HN 1 1 121 1 2 1 1 33 GLY H A 33 . HN 1 1 122 1 1 1 1 34 ASP HA A 34 . HA 1 1 122 1 2 1 1 35 CYS H A 35 . HN 1 1 123 1 1 1 1 34 ASP H A 34 . HN 1 1 123 1 2 1 1 34 ASP QB A 34 . HB2 1 1 124 1 1 1 1 33 GLY H A 33 . HN 1 1 124 1 2 1 1 34 ASP H A 34 . HN 1 1 125 1 1 1 1 35 CYS HA A 35 . HA 1 1 125 1 2 1 1 36 GLU H A 36 . HN 1 1 126 1 1 1 1 35 CYS H A 35 . HN 1 1 126 1 2 1 1 35 CYS HB2 A 35 . HB2 1 1 127 1 1 1 1 35 CYS H A 35 . HN 1 1 127 1 2 1 1 36 GLU H A 36 . HN 1 1 128 1 1 1 1 36 GLU HA A 36 . HA 1 1 128 1 2 1 1 37 TRP H A 37 . HN 1 1 129 1 1 1 1 36 GLU H A 36 . HN 1 1 129 1 2 1 1 36 GLU QB A 36 . HB2 1 1 130 1 1 1 1 7 TYR HA A 7 . HA 1 1 130 1 2 1 1 25 TYR H A 25 . HN 1 1 131 1 1 1 1 37 TRP H A 37 . HN 1 1 131 1 2 1 1 37 TRP HA A 37 . HA 1 1 132 1 1 1 1 37 TRP HA A 37 . HA 1 1 132 1 2 1 1 38 VAL H A 38 . HN 1 1 133 1 1 1 1 37 TRP H A 37 . HN 1 1 133 1 2 1 1 37 TRP HB3 A 37 . HB2 1 1 134 1 1 1 1 37 TRP HB3 A 37 . HB2 1 1 134 1 2 1 1 38 VAL H A 38 . HN 1 1 135 1 1 1 1 38 VAL HA A 38 . HA 1 1 135 1 2 1 1 39 LYS H A 39 . HN 1 1 136 1 1 1 1 38 VAL H A 38 . HN 1 1 136 1 2 1 1 38 VAL HB A 38 . HB 1 1 137 1 1 1 1 13 ILE HB A 13 . HB 1 1 137 1 2 1 1 38 VAL H A 38 . HN 1 1 138 1 1 1 1 25 TYR H A 25 . HN 1 1 138 1 2 1 1 39 LYS HA A 39 . HA 1 1 139 1 1 1 1 39 LYS HA A 39 . HA 1 1 139 1 2 1 1 41 VAL H A 41 . HN 1 1 140 1 1 1 1 42 HIS H A 42 . HN 1 1 140 1 2 1 1 43 VAL HA A 43 . HA 1 1 141 1 1 1 1 39 LYS H A 39 . HN 1 1 141 1 2 1 1 39 LYS HB2 A 39 . HB2 1 1 142 1 1 1 1 39 LYS HB2 A 39 . HB2 1 1 142 1 2 1 1 41 VAL H A 41 . HN 1 1 143 1 1 1 1 40 GLY H A 40 . HN 1 1 143 1 2 1 1 41 VAL H A 41 . HN 1 1 144 1 1 1 1 41 VAL H A 41 . HN 1 1 144 1 2 1 1 41 VAL HA A 41 . HA 1 1 145 1 1 1 1 41 VAL HA A 41 . HA 1 1 145 1 2 1 1 42 HIS H A 42 . HN 1 1 146 1 1 1 1 41 VAL H A 41 . HN 1 1 146 1 2 1 1 41 VAL HB A 41 . HB 1 1 147 1 1 1 1 41 VAL HB A 41 . HB 1 1 147 1 2 1 1 42 HIS H A 42 . HN 1 1 148 1 1 1 1 41 VAL H A 41 . HN 1 1 148 1 2 1 1 42 HIS H A 42 . HN 1 1 149 1 1 1 1 42 HIS H A 42 . HN 1 1 149 1 2 1 1 42 HIS HA A 42 . HA 1 1 150 1 1 1 1 42 HIS HA A 42 . HA 1 1 150 1 2 1 1 43 VAL H A 43 . HN 1 1 151 1 1 1 1 42 HIS H A 42 . HN 1 1 151 1 2 1 1 42 HIS HB2 A 42 . HB2 1 1 152 1 1 1 1 42 HIS HB2 A 42 . HB2 1 1 152 1 2 1 1 43 VAL H A 43 . HN 1 1 153 1 1 1 1 43 VAL H A 43 . HN 1 1 153 1 2 1 1 43 VAL HA A 43 . HA 1 1 154 1 1 1 1 43 VAL HA A 43 . HA 1 1 154 1 2 1 1 44 ALA H A 44 . HN 1 1 155 1 1 1 1 43 VAL H A 43 . HN 1 1 155 1 2 1 1 43 VAL HB A 43 . HB 1 1 156 1 1 1 1 43 VAL HB A 43 . HB 1 1 156 1 2 1 1 44 ALA H A 44 . HN 1 1 157 1 1 1 1 43 VAL H A 43 . HN 1 1 157 1 2 1 1 44 ALA H A 44 . HN 1 1 158 1 1 1 1 44 ALA H A 44 . HN 1 1 158 1 2 1 1 44 ALA HA A 44 . HA 1 1 159 1 1 1 1 44 ALA HA A 44 . HA 1 1 159 1 2 1 1 45 GLU H A 45 . HN 1 1 160 1 1 1 1 44 ALA H A 44 . HN 1 1 160 1 2 2 2 12 ALA MB B 12 . HB2 1 1 161 1 1 1 1 47 VAL H A 47 . HN 1 1 161 1 2 2 2 12 ALA MB B 12 . HB2 1 1 162 1 1 1 1 45 GLU HA A 45 . HA 1 1 162 1 2 1 1 48 ALA H A 48 . HN 1 1 163 1 1 1 1 46 ASP HA A 46 . HA 1 1 163 1 2 1 1 47 VAL H A 47 . HN 1 1 164 1 1 1 1 48 ALA H A 48 . HN 1 1 164 1 2 1 1 51 TYR HA A 51 . HA 1 1 165 1 1 1 1 46 ASP HA A 46 . HA 1 1 165 1 2 1 1 49 LYS H A 49 . HN 1 1 166 1 1 1 1 50 ASP H A 50 . HN 1 1 166 1 2 1 1 51 TYR HA A 51 . HA 1 1 167 1 1 1 1 47 VAL H A 47 . HN 1 1 167 1 2 1 1 50 ASP QB A 50 . HB2 1 1 168 1 1 1 1 46 ASP H A 46 . HN 1 1 168 1 2 1 1 47 VAL H A 47 . HN 1 1 169 1 1 1 1 46 ASP H A 46 . HN 1 1 169 1 2 1 1 48 ALA H A 48 . HN 1 1 170 1 1 1 1 47 VAL HA A 47 . HA 1 1 170 1 2 1 1 50 ASP H A 50 . HN 1 1 171 1 1 1 1 47 VAL H A 47 . HN 1 1 171 1 2 1 1 47 VAL HB A 47 . HB 1 1 172 1 1 1 1 47 VAL HB A 47 . HB 1 1 172 1 2 1 1 48 ALA H A 48 . HN 1 1 173 1 1 1 1 48 ALA H A 48 . HN 1 1 173 1 2 1 1 48 ALA HA A 48 . HA 1 1 174 1 1 1 1 48 ALA HA A 48 . HA 1 1 174 1 2 1 1 49 LYS H A 49 . HN 1 1 175 1 1 1 1 48 ALA HA A 48 . HA 1 1 175 1 2 1 1 51 TYR H A 51 . HN 1 1 176 1 1 1 1 48 ALA H A 48 . HN 1 1 176 1 2 1 1 49 LYS H A 49 . HN 1 1 177 1 1 1 1 48 ALA H A 48 . HN 1 1 177 1 2 1 1 50 ASP H A 50 . HN 1 1 178 1 1 1 1 49 LYS H A 49 . HN 1 1 178 1 2 1 1 49 LYS HA A 49 . HA 1 1 179 1 1 1 1 49 LYS HA A 49 . HA 1 1 179 1 2 1 1 50 ASP H A 50 . HN 1 1 180 1 1 1 1 49 LYS HA A 49 . HA 1 1 180 1 2 1 1 53 ASP H A 53 . HN 1 1 181 1 1 1 1 49 LYS H A 49 . HN 1 1 181 1 2 1 1 50 ASP H A 50 . HN 1 1 182 1 1 1 1 50 ASP HA A 50 . HA 1 1 182 1 2 1 1 51 TYR H A 51 . HN 1 1 183 1 1 1 1 50 ASP H A 50 . HN 1 1 183 1 2 1 1 50 ASP QB A 50 . HB2 1 1 184 1 1 1 1 50 ASP QB A 50 . HB2 1 1 184 1 2 1 1 51 TYR H A 51 . HN 1 1 185 1 1 1 1 50 ASP H A 50 . HN 1 1 185 1 2 1 1 51 TYR H A 51 . HN 1 1 186 1 1 1 1 50 ASP H A 50 . HN 1 1 186 1 2 1 1 52 GLU H A 52 . HN 1 1 187 1 1 1 1 51 TYR H A 51 . HN 1 1 187 1 2 1 1 51 TYR HA A 51 . HA 1 1 188 1 1 1 1 51 TYR HA A 51 . HA 1 1 188 1 2 1 1 52 GLU H A 52 . HN 1 1 189 1 1 1 1 51 TYR H A 51 . HN 1 1 189 1 2 1 1 51 TYR QB A 51 . HB2 1 1 190 1 1 1 1 51 TYR QB A 51 . HB2 1 1 190 1 2 1 1 52 GLU H A 52 . HN 1 1 191 1 1 1 1 51 TYR H A 51 . HN 1 1 191 1 2 1 1 52 GLU H A 52 . HN 1 1 192 1 1 1 1 52 GLU HA A 52 . HA 1 1 192 1 2 1 1 53 ASP H A 53 . HN 1 1 193 1 1 1 1 52 GLU H A 52 . HN 1 1 193 1 2 1 1 52 GLU HB2 A 52 . HB2 1 1 194 1 1 1 1 52 GLU H A 52 . HN 1 1 194 1 2 1 1 53 ASP HB2 A 53 . HB2 1 1 195 1 1 1 1 53 ASP H A 53 . HN 1 1 195 1 2 1 1 53 ASP HA A 53 . HA 1 1 196 1 1 1 1 53 ASP HA A 53 . HA 1 1 196 1 2 1 1 54 GLY H A 54 . HN 1 1 197 1 1 1 1 53 ASP HA A 53 . HA 1 1 197 1 2 1 1 55 LEU H A 55 . HN 1 1 198 1 1 1 1 53 ASP H A 53 . HN 1 1 198 1 2 1 1 53 ASP HB2 A 53 . HB2 1 1 199 1 1 1 1 50 ASP QB A 50 . HB2 1 1 199 1 2 1 1 54 GLY H A 54 . HN 1 1 200 1 1 1 1 53 ASP H A 53 . HN 1 1 200 1 2 1 1 54 GLY H A 54 . HN 1 1 201 1 1 1 1 54 GLY H A 54 . HN 1 1 201 1 2 1 1 54 GLY HA2 A 54 . HA2 1 1 202 1 1 1 1 54 GLY HA2 A 54 . HA2 1 1 202 1 2 1 1 55 LEU H A 55 . HN 1 1 203 1 1 1 1 54 GLY H A 54 . HN 1 1 203 1 2 1 1 54 GLY HA3 A 54 . HA1 1 1 204 1 1 1 1 54 GLY HA3 A 54 . HA1 1 1 204 1 2 1 1 55 LEU H A 55 . HN 1 1 205 1 1 1 1 55 LEU H A 55 . HN 1 1 205 1 2 1 1 55 LEU HA A 55 . HA 1 1 206 1 1 1 1 55 LEU H A 55 . HN 1 1 206 1 2 1 1 55 LEU QB A 55 . HB2 1 1 207 1 1 1 1 55 LEU H A 55 . HN 1 1 207 1 2 1 1 56 GLU H A 56 . HN 1 1 208 1 1 1 1 56 GLU H A 56 . HN 1 1 208 1 2 1 1 56 GLU QB A 56 . HB2 1 1 209 1 1 1 1 56 GLU QB A 56 . HB2 1 1 209 1 2 1 1 57 TYR H A 57 . HN 1 1 210 1 1 1 1 56 GLU H A 56 . HN 1 1 210 1 2 1 1 56 GLU HG2 A 56 . HG2 1 1 211 1 1 1 1 56 GLU HG2 A 56 . HG2 1 1 211 1 2 1 1 57 TYR H A 57 . HN 1 1 212 1 1 1 1 57 TYR H A 57 . HN 1 1 212 1 2 1 1 57 TYR HA A 57 . HA 1 1 213 1 1 1 1 57 TYR H A 57 . HN 1 1 213 1 2 1 1 57 TYR HB2 A 57 . HB2 1 1 214 1 1 1 1 36 GLU HA A 36 . HA 1 1 214 1 2 1 1 37 TRP HA A 37 . HA 1 1 215 1 1 1 1 3 GLN HA A 3 . HA 1 1 215 1 2 1 1 4 VAL HA A 4 . HA 1 1 216 1 1 1 1 44 ALA HA A 44 . HA 1 1 216 1 2 2 2 12 ALA MB B 12 . HB2 1 1 217 1 1 1 1 49 LYS HA A 49 . HA 1 1 217 1 2 1 1 53 ASP HB2 A 53 . HB2 1 1 218 1 1 2 2 10 ARG HA B 10 . HA 1 1 218 1 2 2 2 10 ARG HG3 B 10 . HG1 1 1 219 1 1 2 2 10 ARG HA B 10 . HA 1 1 219 1 2 2 2 10 ARG HG2 B 10 . HG2 1 1 220 1 1 1 1 16 LYS HA A 16 . HA 1 1 220 1 2 1 1 25 TYR HA A 25 . HA 1 1 221 1 1 1 1 16 LYS HA A 16 . HA 1 1 221 1 2 1 1 17 ARG QB A 17 . HB2 1 1 222 1 1 1 1 18 GLY HA3 A 18 . HA1 1 1 222 1 2 1 1 23 VAL HA A 23 . HA 1 1 223 1 1 1 1 22 ASP HA A 22 . HA 1 1 223 1 2 1 1 22 ASP HB2 A 22 . HB2 1 1 224 1 1 1 1 7 TYR QB A 7 . HB2 1 1 224 1 2 1 1 25 TYR HA A 25 . HA 1 1 225 1 1 1 1 28 ARG HA A 28 . HA 1 1 225 1 2 1 1 28 ARG HB2 A 28 . HB2 1 1 226 1 1 1 1 28 ARG HA A 28 . HA 1 1 226 1 2 1 1 29 TRP QB A 29 . HB2 1 1 227 1 1 1 1 34 ASP HA A 34 . HA 1 1 227 1 2 1 1 35 CYS HB2 A 35 . HB2 1 1 228 1 1 1 1 11 ASP HB2 A 11 . HB2 1 1 228 1 2 1 1 30 LYS HA A 30 . HA 1 1 229 1 1 1 1 48 ALA HA A 48 . HA 1 1 229 1 2 1 1 51 TYR QB A 51 . HB2 1 1 230 1 1 1 1 52 GLU HA A 52 . HA 1 1 230 1 2 1 1 55 LEU QB A 55 . HB2 1 1 231 1 1 1 1 25 TYR H A 25 . HN 1 1 231 1 2 1 1 38 VAL HB A 38 . HB 1 1 232 1 1 1 1 10 VAL HB A 10 . HB 1 1 232 1 2 1 1 30 LYS H A 30 . HN 1 1 233 1 1 2 2 12 ALA MB B 12 . HB3 1 1 233 1 2 2 2 13 ASP H B 13 . HN 1 1 234 1 1 1 1 4 VAL H A 4 . HN 1 1 234 1 2 1 1 4 VAL HA A 4 . HA 1 1 235 1 1 1 1 7 TYR QB A 7 . HB2 1 1 235 1 2 1 1 13 ILE H A 13 . HN 1 1 236 1 1 1 1 5 PHE HB3 A 5 . HB2 1 1 236 1 2 1 1 19 LYS H A 19 . HN 1 1 237 1 1 2 2 12 ALA H B 12 . HN 1 1 237 1 2 2 2 12 ALA MB B 12 . HB3 1 1 238 1 1 2 2 10 ARG HG3 B 10 . HG1 1 1 238 1 2 2 2 12 ALA H B 12 . HN 1 1 239 1 1 1 1 16 LYS HA A 16 . HA 1 1 239 1 2 1 1 25 TYR H A 25 . HN 1 1 240 1 1 1 1 25 TYR HB2 A 25 . HB2 1 1 240 1 2 1 1 38 VAL HA A 38 . HA 1 1 241 1 1 1 1 23 VAL HA A 23 . HA 1 1 241 1 2 1 1 23 VAL HB A 23 . HB 1 1 242 1 1 1 1 19 LYS HB2 A 19 . HB2 1 1 242 1 2 1 1 45 GLU HA A 45 . HA 1 1 243 1 1 1 1 47 VAL HB A 47 . HB 1 1 243 1 2 1 1 48 ALA HA A 48 . HA 1 1 244 1 1 1 1 19 LYS HA A 19 . HA 1 1 244 1 2 1 1 23 VAL HB A 23 . HB 1 1 245 1 1 1 1 19 LYS HA A 19 . HA 1 1 245 1 2 1 1 19 LYS HB2 A 19 . HB2 1 1 246 1 1 1 1 2 SER HA A 2 . HA 1 1 246 1 2 1 1 56 GLU QB A 56 . HB2 1 1 247 1 1 1 1 36 GLU QB A 36 . HB2 1 1 247 1 2 1 1 38 VAL HA A 38 . HA 1 1 248 1 1 1 1 2 SER HA A 2 . HA 1 1 248 1 2 1 1 3 GLN H A 3 . HN 1 1 249 1 1 1 1 22 ASP H A 22 . HN 1 1 249 1 2 1 1 22 ASP HA A 22 . HA 1 1 250 1 1 2 2 13 ASP H B 13 . HN 1 1 250 1 2 2 2 14 SER HA B 14 . HA 1 1 251 1 1 1 1 28 ARG HA A 28 . HA 1 1 251 1 2 1 1 29 TRP H A 29 . HN 1 1 252 1 1 1 1 28 ARG HA A 28 . HA 1 1 252 1 2 1 1 36 GLU H A 36 . HN 1 1 253 1 1 1 1 4 VAL HA A 4 . HA 1 1 253 1 2 1 1 5 PHE H A 5 . HN 1 1 254 1 1 1 1 9 GLU HA A 9 . HA 1 1 254 1 2 1 1 30 LYS H A 30 . HN 1 1 255 1 1 1 1 3 GLN HA A 3 . HA 1 1 255 1 2 1 1 52 GLU H A 52 . HN 1 1 256 1 1 1 1 13 ILE HA A 13 . HA 1 1 256 1 2 1 1 28 ARG H A 28 . HN 1 1 257 1 1 1 1 15 GLU HA A 15 . HA 1 1 257 1 2 1 1 17 ARG H A 17 . HN 1 1 258 1 1 1 1 25 TYR H A 25 . HN 1 1 258 1 2 1 1 38 VAL HA A 38 . HA 1 1 259 1 1 1 1 2 SER HA A 2 . HA 1 1 259 1 2 1 1 55 LEU QB A 55 . HB2 1 1 260 1 1 2 2 10 ARG HG3 B 10 . HG1 1 1 260 1 2 2 2 12 ALA HA B 12 . HA 1 1 261 1 1 2 2 10 ARG HG2 B 10 . HG2 1 1 261 1 2 2 2 12 ALA HA B 12 . HA 1 1 262 1 1 1 1 50 ASP HA A 50 . HA 1 1 262 1 2 1 1 57 TYR HB2 A 57 . HB2 1 1 263 1 1 1 1 23 VAL HA A 23 . HA 1 1 263 1 2 1 1 25 TYR H A 25 . HN 1 1 264 1 1 1 1 56 GLU HA A 56 . HA 1 1 264 1 2 1 1 57 TYR H A 57 . HN 1 1 265 1 1 1 1 48 ALA HA A 48 . HA 1 1 265 1 2 1 1 52 GLU HA A 52 . HA 1 1 266 1 1 1 1 18 GLY HA3 A 18 . HA1 1 1 266 1 2 1 1 23 VAL HB A 23 . HB 1 1 267 1 1 1 1 47 VAL HA A 47 . HA 1 1 267 1 2 1 1 51 TYR H A 51 . HN 1 1 268 1 1 1 1 5 PHE HB3 A 5 . HB2 1 1 268 1 2 1 1 18 GLY HA2 A 18 . HA2 1 1 269 1 1 1 1 7 TYR QB A 7 . HB2 1 1 269 1 2 1 1 25 TYR HB2 A 25 . HB2 1 1 270 1 1 1 1 4 VAL HB A 4 . HB 1 1 270 1 2 1 1 48 ALA HA A 48 . HA 1 1 271 1 1 1 1 30 LYS HA A 30 . HA 1 1 271 1 2 1 1 30 LYS HB3 A 30 . HB2 1 1 272 1 1 1 1 52 GLU HA A 52 . HA 1 1 272 1 2 1 1 52 GLU HB2 A 52 . HB2 1 1 273 1 1 1 1 13 ILE HB A 13 . HB 1 1 273 1 2 1 1 15 GLU H A 15 . HN 1 1 274 1 1 1 1 23 VAL H A 23 . HN 1 1 274 1 2 1 1 23 VAL HB A 23 . HB 1 1 275 1 1 1 1 13 ILE H A 13 . HN 1 1 275 1 2 1 1 28 ARG HB2 A 28 . HB2 1 1 276 1 1 1 1 47 VAL HB A 47 . HB 1 1 276 1 2 1 1 51 TYR H A 51 . HN 1 1 277 1 1 2 2 9 LYS H B 9 . HN 1 1 277 1 2 2 2 10 ARG HG3 B 10 . HG1 1 1 278 1 1 2 2 9 LYS HA B 9 . HA 1 1 278 1 2 2 2 10 ARG HG3 B 10 . HG1 1 1 279 1 1 1 1 29 TRP HA A 29 . HA 1 1 279 1 2 2 2 6 ALA MB B 6 . HB3 1 1 280 1 1 1 1 19 LYS HA A 19 . HA 1 1 280 1 2 1 1 51 TYR QB A 51 . HB2 1 1 281 1 1 1 1 34 ASP HA A 34 . HA 1 1 281 1 2 1 1 34 ASP QB A 34 . HB2 1 1 282 1 1 1 1 19 LYS HA A 19 . HA 1 1 282 1 2 1 1 22 ASP HB2 A 22 . HB2 1 1 283 1 1 1 1 7 TYR QB A 7 . HB2 1 1 283 1 2 1 1 12 GLU HA A 12 . HA 1 1 284 1 1 1 1 47 VAL H A 47 . HN 1 1 284 1 2 2 2 12 ALA H B 12 . HN 1 1 285 1 1 1 1 14 VAL H A 14 . HN 1 1 285 1 2 1 1 14 VAL HB A 14 . HB 1 1 286 1 1 1 1 11 ASP HA A 11 . HA 1 1 286 1 2 1 1 30 LYS H A 30 . HN 1 1 287 1 1 1 1 47 VAL H A 47 . HN 1 1 287 1 2 1 1 47 VAL HA A 47 . HA 1 1 288 1 1 1 1 47 VAL H A 47 . HN 1 1 288 1 2 1 1 48 ALA H A 48 . HN 1 1 289 1 1 1 1 49 LYS HA A 49 . HA 1 1 289 1 2 1 1 52 GLU H A 52 . HN 1 1 290 1 1 1 1 2 SER HA A 2 . HA 1 1 290 1 2 1 1 51 TYR HA A 51 . HA 1 1 291 1 1 1 1 20 GLY H A 20 . HN 1 1 291 1 2 1 1 45 GLU HA A 45 . HA 1 1 292 1 1 2 2 2 PRO HA B 2 . HA 1 1 292 1 2 2 2 4 GLY H B 4 . HN 1 1 293 1 1 1 1 23 VAL HA A 23 . HA 1 1 293 1 2 1 1 24 GLU H A 24 . HN 1 1 294 1 1 1 1 4 VAL HA A 4 . HA 1 1 294 1 2 1 1 5 PHE HB3 A 5 . HB2 1 1 295 1 1 1 1 45 GLU HA A 45 . HA 1 1 295 1 2 1 1 47 VAL HB A 47 . HB 1 1 296 1 1 1 1 23 VAL HB A 23 . HB 1 1 296 1 2 1 1 24 GLU H A 24 . HN 1 1 297 1 1 1 1 10 VAL H A 10 . HN 1 1 297 1 2 1 1 29 TRP HA A 29 . HA 1 1 298 1 1 1 1 8 ALA HA A 8 . HA 1 1 298 1 2 1 1 38 VAL HB A 38 . HB 1 1 299 1 1 1 1 20 GLY H A 20 . HN 1 1 299 1 2 1 1 44 ALA HA A 44 . HA 1 1 300 1 1 1 1 26 LEU HA A 26 . HA 1 1 300 1 2 1 1 27 VAL H A 27 . HN 1 1 301 1 1 1 1 26 LEU HA A 26 . HA 1 1 301 1 2 1 1 26 LEU HG A 26 . HG 1 1 302 1 1 1 1 9 GLU HA A 9 . HA 1 1 302 1 2 2 2 6 ALA MB B 6 . HB2 1 1 303 1 1 1 1 46 ASP HA A 46 . HA 1 1 303 1 2 1 1 50 ASP QB A 50 . HB2 1 1 304 1 1 1 1 51 TYR QB A 51 . HB2 1 1 304 1 2 1 1 53 ASP HB2 A 53 . HB2 1 1 305 1 1 1 1 14 VAL H A 14 . HN 1 1 305 1 2 1 1 15 GLU H A 15 . HN 1 1 306 1 1 1 1 12 GLU H A 12 . HN 1 1 306 1 2 1 1 29 TRP H A 29 . HN 1 1 307 1 1 2 2 9 LYS HA B 9 . HA 1 1 307 1 2 2 2 11 LYS HA B 11 . HA 1 1 308 1 1 1 1 24 GLU H A 24 . HN 1 1 308 1 2 1 1 40 GLY H A 40 . HN 1 1 309 1 1 1 1 6 GLU H A 6 . HN 1 1 309 1 2 1 1 24 GLU H A 24 . HN 1 1 310 1 1 1 1 9 GLU HA A 9 . HA 1 1 310 1 2 1 1 10 VAL H A 10 . HN 1 1 311 1 1 1 1 11 ASP H A 11 . HN 1 1 311 1 2 1 1 12 GLU H A 12 . HN 1 1 312 1 1 1 1 36 GLU H A 36 . HN 1 1 312 1 2 1 1 37 TRP H A 37 . HN 1 1 313 1 1 1 1 3 GLN HA A 3 . HA 1 1 313 1 2 1 1 4 VAL H A 4 . HN 1 1 314 1 1 1 1 3 GLN QB A 3 . HB2 1 1 314 1 2 1 1 4 VAL H A 4 . HN 1 1 315 1 1 1 1 7 TYR H A 7 . HN 1 1 315 1 2 1 1 7 TYR HA A 7 . HA 1 1 316 1 1 1 1 8 ALA H A 8 . HN 1 1 316 1 2 1 1 9 GLU H A 9 . HN 1 1 317 1 1 1 1 8 ALA HA A 8 . HA 1 1 317 1 2 1 1 9 GLU H A 9 . HN 1 1 318 1 1 1 1 9 GLU H A 9 . HN 1 1 318 1 2 1 1 9 GLU HA A 9 . HA 1 1 319 1 1 1 1 52 GLU HG2 A 52 . HG2 1 1 319 1 2 1 1 53 ASP H A 53 . HN 1 1 320 1 1 1 1 9 GLU HG2 A 9 . HG2 1 1 320 1 2 1 1 10 VAL H A 10 . HN 1 1 321 1 1 1 1 9 GLU H A 9 . HN 1 1 321 1 2 1 1 9 GLU HG2 A 9 . HG2 1 1 322 1 1 1 1 10 VAL HA A 10 . HA 1 1 322 1 2 1 1 11 ASP H A 11 . HN 1 1 323 1 1 1 1 11 ASP H A 11 . HN 1 1 323 1 2 1 1 11 ASP HB2 A 11 . HB2 1 1 324 1 1 1 1 11 ASP HB2 A 11 . HB2 1 1 324 1 2 1 1 12 GLU H A 12 . HN 1 1 325 1 1 1 1 12 GLU H A 12 . HN 1 1 325 1 2 1 1 12 GLU HA A 12 . HA 1 1 326 1 1 1 1 12 GLU H A 12 . HN 1 1 326 1 2 1 1 12 GLU HB3 A 12 . HB2 1 1 327 1 1 1 1 13 ILE HA A 13 . HA 1 1 327 1 2 1 1 14 VAL H A 14 . HN 1 1 328 1 1 1 1 14 VAL H A 14 . HN 1 1 328 1 2 1 1 14 VAL HA A 14 . HA 1 1 329 1 1 1 1 19 LYS HB2 A 19 . HB2 1 1 329 1 2 1 1 20 GLY H A 20 . HN 1 1 330 1 1 1 1 22 ASP HA A 22 . HA 1 1 330 1 2 1 1 41 VAL H A 41 . HN 1 1 331 1 1 1 1 25 TYR HB2 A 25 . HB2 1 1 331 1 2 1 1 26 LEU H A 26 . HN 1 1 332 1 1 1 1 11 ASP H A 11 . HN 1 1 332 1 2 1 1 12 GLU HB3 A 12 . HB2 1 1 333 1 1 1 1 28 ARG H A 28 . HN 1 1 333 1 2 1 1 29 TRP H A 29 . HN 1 1 334 1 1 1 1 29 TRP H A 29 . HN 1 1 334 1 2 1 1 30 LYS H A 30 . HN 1 1 335 1 1 1 1 28 ARG HB2 A 28 . HB2 1 1 335 1 2 1 1 30 LYS H A 30 . HN 1 1 336 1 1 1 1 34 ASP QB A 34 . HB2 1 1 336 1 2 1 1 35 CYS H A 35 . HN 1 1 337 1 1 1 1 36 GLU QB A 36 . HB2 1 1 337 1 2 1 1 37 TRP H A 37 . HN 1 1 338 1 1 1 1 34 ASP QB A 34 . HB2 1 1 338 1 2 1 1 36 GLU H A 36 . HN 1 1 339 1 1 1 1 27 VAL H A 27 . HN 1 1 339 1 2 1 1 37 TRP H A 37 . HN 1 1 340 1 1 1 1 39 LYS HA A 39 . HA 1 1 340 1 2 1 1 40 GLY H A 40 . HN 1 1 341 1 1 1 1 11 ASP HB2 A 11 . HB2 1 1 341 1 2 1 1 29 TRP H A 29 . HN 1 1 342 1 1 1 1 47 VAL HA A 47 . HA 1 1 342 1 2 1 1 48 ALA H A 48 . HN 1 1 343 1 1 1 1 7 TYR QB A 7 . HB2 1 1 343 1 2 1 1 9 GLU H A 9 . HN 1 1 344 1 1 1 1 53 ASP HB2 A 53 . HB2 1 1 344 1 2 1 1 54 GLY H A 54 . HN 1 1 345 1 1 1 1 51 TYR HA A 51 . HA 1 1 345 1 2 1 1 52 GLU HA A 52 . HA 1 1 346 1 1 1 1 2 SER HA A 2 . HA 1 1 346 1 2 1 1 3 GLN HA A 3 . HA 1 1 347 1 1 1 1 56 GLU QB A 56 . HB2 1 1 347 1 2 1 1 56 GLU HG2 A 56 . HG2 1 1 348 1 1 1 1 25 TYR HA A 25 . HA 1 1 348 1 2 1 1 38 VAL HB A 38 . HB 1 1 349 1 1 1 1 13 ILE HA A 13 . HA 1 1 349 1 2 1 1 27 VAL HA A 27 . HA 1 1 350 1 1 1 1 42 HIS HA A 42 . HA 1 1 350 1 2 1 1 43 VAL HA A 43 . HA 1 1 351 1 1 1 1 7 TYR HA A 7 . HA 1 1 351 1 2 1 1 9 GLU HA A 9 . HA 1 1 352 1 1 1 1 8 ALA HA A 8 . HA 1 1 352 1 2 1 1 9 GLU HA A 9 . HA 1 1 353 1 1 1 1 7 TYR HA A 7 . HA 1 1 353 1 2 1 1 25 TYR HA A 25 . HA 1 1 354 1 1 1 1 9 GLU HA A 9 . HA 1 1 354 1 2 1 1 9 GLU HG2 A 9 . HG2 1 1 355 1 1 1 1 17 ARG HA A 17 . HA 1 1 355 1 2 1 1 17 ARG QB A 17 . HB2 1 1 356 1 1 1 1 10 VAL HB A 10 . HB 1 1 356 1 2 1 1 29 TRP HA A 29 . HA 1 1 357 1 1 1 1 9 GLU HG2 A 9 . HG2 1 1 357 1 2 1 1 29 TRP HA A 29 . HA 1 1 358 1 1 1 1 27 VAL HA A 27 . HA 1 1 358 1 2 1 1 27 VAL HB A 27 . HB 1 1 359 1 1 1 1 29 TRP HA A 29 . HA 1 1 359 1 2 1 1 29 TRP QB A 29 . HB2 1 1 360 1 1 1 1 36 GLU HA A 36 . HA 1 1 360 1 2 1 1 36 GLU QB A 36 . HB2 1 1 361 1 1 1 1 26 LEU HA A 26 . HA 1 1 361 1 2 1 1 37 TRP HA A 37 . HA 1 1 362 1 1 1 1 26 LEU HG A 26 . HG 1 1 362 1 2 1 1 37 TRP HA A 37 . HA 1 1 363 1 1 1 1 41 VAL HA A 41 . HA 1 1 363 1 2 1 1 41 VAL HB A 41 . HB 1 1 364 1 1 1 1 42 HIS HA A 42 . HA 1 1 364 1 2 1 1 42 HIS HB2 A 42 . HB2 1 1 365 1 1 1 1 28 ARG HB2 A 28 . HB2 1 1 365 1 2 1 1 30 LYS HA A 30 . HA 1 1 366 1 1 1 1 51 TYR HA A 51 . HA 1 1 366 1 2 1 1 51 TYR QB A 51 . HB2 1 1 367 1 1 1 1 52 GLU HA A 52 . HA 1 1 367 1 2 1 1 53 ASP HB2 A 53 . HB2 1 1 368 1 1 1 1 52 GLU HA A 52 . HA 1 1 368 1 2 1 1 52 GLU HG2 A 52 . HG2 1 1 369 1 1 1 1 53 ASP HA A 53 . HA 1 1 369 1 2 1 1 56 GLU QB A 56 . HB2 1 1 370 1 1 1 1 10 VAL HB A 10 . HB 1 1 370 1 2 1 1 29 TRP H A 29 . HN 1 1 371 1 1 1 1 26 LEU H A 26 . HN 1 1 371 1 2 1 1 38 VAL HB A 38 . HB 1 1 372 1 1 1 1 26 LEU H A 26 . HN 1 1 372 1 2 1 1 27 VAL HB A 27 . HB 1 1 373 1 1 1 1 46 ASP H A 46 . HN 1 1 373 1 2 1 1 47 VAL HB A 47 . HB 1 1 374 1 1 1 1 12 GLU HB3 A 12 . HB2 1 1 374 1 2 1 1 13 ILE H A 13 . HN 1 1 375 1 1 1 1 27 VAL HB A 27 . HB 1 1 375 1 2 1 1 28 ARG H A 28 . HN 1 1 376 1 1 1 1 29 TRP H A 29 . HN 1 1 376 1 2 1 1 32 GLY HA3 A 32 . HA1 1 1 377 1 1 1 1 2 SER H A 2 . HN 1 1 377 1 2 1 1 4 VAL HA A 4 . HA 1 1 378 1 1 1 1 14 VAL HA A 14 . HA 1 1 378 1 2 1 1 26 LEU H A 26 . HN 1 1 379 1 1 1 1 20 GLY H A 20 . HN 1 1 379 1 2 1 1 22 ASP HB2 A 22 . HB2 1 1 380 1 1 1 1 7 TYR QB A 7 . HB2 1 1 380 1 2 1 1 8 ALA H A 8 . HN 1 1 381 1 1 1 1 9 GLU H A 9 . HN 1 1 381 1 2 1 1 12 GLU H A 12 . HN 1 1 382 1 1 1 1 19 LYS H A 19 . HN 1 1 382 1 2 1 1 22 ASP HB2 A 22 . HB2 1 1 383 1 1 1 1 50 ASP H A 50 . HN 1 1 383 1 2 1 1 54 GLY H A 54 . HN 1 1 384 1 1 1 1 44 ALA HA A 44 . HA 1 1 384 1 2 1 1 48 ALA H A 48 . HN 1 1 385 1 1 1 1 23 VAL H A 23 . HN 1 1 385 1 2 1 1 41 VAL H A 41 . HN 1 1 386 1 1 1 1 6 GLU H A 6 . HN 1 1 386 1 2 1 1 23 VAL H A 23 . HN 1 1 387 1 1 1 1 17 ARG HA A 17 . HA 1 1 387 1 2 1 1 23 VAL HB A 23 . HB 1 1 388 1 1 1 1 3 GLN HA A 3 . HA 1 1 388 1 2 1 1 3 GLN QB A 3 . HB2 1 1 389 1 1 1 1 55 LEU HA A 55 . HA 1 1 389 1 2 1 1 55 LEU QB A 55 . HB2 1 1 390 1 1 1 1 8 ALA H A 8 . HN 1 1 390 1 2 1 1 8 ALA HA A 8 . HA 1 1 391 1 1 1 1 12 GLU HA A 12 . HA 1 1 391 1 2 1 1 13 ILE H A 13 . HN 1 1 392 1 1 1 1 43 VAL HA A 43 . HA 1 1 392 1 2 1 1 45 GLU H A 45 . HN 1 1 393 1 1 1 1 32 GLY HA2 A 32 . HA2 1 1 393 1 2 1 1 34 ASP H A 34 . HN 1 1 394 1 1 1 1 2 SER H A 2 . HN 1 1 394 1 2 1 1 51 TYR HA A 51 . HA 1 1 395 1 1 1 1 28 ARG HA A 28 . HA 1 1 395 1 2 1 1 32 GLY HA3 A 32 . HA1 1 1 396 1 1 1 1 11 ASP HA A 11 . HA 1 1 396 1 2 1 1 12 GLU H A 12 . HN 1 1 397 1 1 1 1 2 SER HA A 2 . HA 1 1 397 1 2 1 1 52 GLU HA A 52 . HA 1 1 398 1 1 1 1 14 VAL HA A 14 . HA 1 1 398 1 2 1 1 15 GLU H A 15 . HN 1 1 399 1 1 1 1 31 ASP HA A 31 . HA 1 1 399 1 2 1 1 32 GLY HA3 A 32 . HA1 1 1 400 1 1 1 1 10 VAL HA A 10 . HA 1 1 400 1 2 1 1 27 VAL HB A 27 . HB 1 1 401 1 1 1 1 6 GLU QB A 6 . HB2 1 1 401 1 2 1 1 7 TYR H A 7 . HN 1 1 402 1 1 1 1 7 TYR H A 7 . HN 1 1 402 1 2 1 1 7 TYR QB A 7 . HB2 1 1 403 1 1 1 1 3 GLN QB A 3 . HB2 1 1 403 1 2 1 1 4 VAL HA A 4 . HA 1 1 404 1 1 1 1 54 GLY HA2 A 54 . HA2 1 1 404 1 2 1 1 55 LEU QB A 55 . HB2 1 1 405 1 1 1 1 19 LYS HB2 A 19 . HB2 1 1 405 1 2 1 1 23 VAL H A 23 . HN 1 1 406 1 1 1 1 52 GLU HB2 A 52 . HB2 1 1 406 1 2 1 1 53 ASP H A 53 . HN 1 1 407 1 1 1 1 13 ILE HB A 13 . HB 1 1 407 1 2 1 1 25 TYR H A 25 . HN 1 1 408 1 1 1 1 12 GLU H A 12 . HN 1 1 408 1 2 1 1 29 TRP HA A 29 . HA 1 1 409 1 1 1 1 7 TYR QB A 7 . HB2 1 1 409 1 2 1 1 9 GLU HA A 9 . HA 1 1 410 1 1 1 1 6 GLU QB A 6 . HB2 1 1 410 1 2 1 1 21 LYS HA A 21 . HA 1 1 411 1 1 1 1 10 VAL HA A 10 . HA 1 1 411 1 2 1 1 27 VAL HA A 27 . HA 1 1 412 1 1 1 1 50 ASP QB A 50 . HB2 1 1 412 1 2 1 1 51 TYR QB A 51 . HB2 1 1 413 1 1 1 1 6 GLU H A 6 . HN 1 1 413 1 2 1 1 17 ARG H A 17 . HN 1 1 414 1 1 1 1 11 ASP H A 11 . HN 1 1 414 1 2 1 1 11 ASP HA A 11 . HA 1 1 415 1 1 1 1 17 ARG H A 17 . HN 1 1 415 1 2 1 1 18 GLY H A 18 . HN 1 1 416 1 1 1 1 7 TYR H A 7 . HN 1 1 416 1 2 1 1 9 GLU H A 9 . HN 1 1 417 1 1 1 1 23 VAL H A 23 . HN 1 1 417 1 2 1 1 23 VAL HA A 23 . HA 1 1 418 1 1 1 1 28 ARG HA A 28 . HA 1 1 418 1 2 1 1 30 LYS H A 30 . HN 1 1 419 1 1 1 1 47 VAL H A 47 . HN 1 1 419 1 2 1 1 49 LYS H A 49 . HN 1 1 420 1 1 1 1 13 ILE H A 13 . HN 1 1 420 1 2 1 1 14 VAL HA A 14 . HA 1 1 421 1 1 1 1 9 GLU HA A 9 . HA 1 1 421 1 2 1 1 28 ARG H A 28 . HN 1 1 422 1 1 1 1 43 VAL HA A 43 . HA 1 1 422 1 2 1 1 46 ASP H A 46 . HN 1 1 423 1 1 1 1 12 GLU H A 12 . HN 1 1 423 1 2 1 1 28 ARG HA A 28 . HA 1 1 424 1 1 1 1 12 GLU HB3 A 12 . HB2 1 1 424 1 2 1 1 14 VAL HA A 14 . HA 1 1 425 1 1 1 1 10 VAL H A 10 . HN 1 1 425 1 2 1 1 11 ASP H A 11 . HN 1 1 426 1 1 1 1 22 ASP HA A 22 . HA 1 1 426 1 2 1 1 42 HIS H A 42 . HN 1 1 427 1 1 1 1 11 ASP H A 11 . HN 1 1 427 1 2 1 1 28 ARG HB3 A 28 . HB1 1 1 428 1 1 1 1 46 ASP HA A 46 . HA 1 1 428 1 2 1 1 48 ALA H A 48 . HN 1 1 429 1 1 1 1 46 ASP HA A 46 . HA 1 1 429 1 2 1 1 50 ASP H A 50 . HN 1 1 430 1 1 1 1 46 ASP H A 46 . HN 1 1 430 1 2 1 1 46 ASP QB A 46 . HB% 1 1 431 1 1 1 1 18 GLY HA2 A 18 . HA2 1 1 431 1 2 1 1 19 LYS HA A 19 . HA 1 1 432 1 1 1 1 16 LYS HA A 16 . HA 1 1 432 1 2 1 1 16 LYS QD A 16 . HD% 1 1 433 1 1 1 1 25 TYR HA A 25 . HA 1 1 433 1 2 1 1 37 TRP HB3 A 37 . HB2 1 1 434 1 1 1 1 46 ASP HA A 46 . HA 1 1 434 1 2 1 1 49 LYS QB A 49 . HB% 1 1 435 1 1 1 1 6 GLU H A 6 . HN 1 1 435 1 2 1 1 23 VAL HB A 23 . HB 1 1 436 1 1 1 1 9 GLU HG2 A 9 . HG2 1 1 436 1 2 1 1 11 ASP HA A 11 . HA 1 1 437 1 1 1 1 24 GLU HA A 24 . HA 1 1 437 1 2 1 1 38 VAL HB A 38 . HB 1 1 438 1 1 1 1 28 ARG H A 28 . HN 1 1 438 1 2 1 1 29 TRP HA A 29 . HA 1 1 439 1 1 1 1 21 LYS HA A 21 . HA 1 1 439 1 2 1 1 22 ASP H A 22 . HN 1 1 440 1 1 1 1 2 SER HA A 2 . HA 1 1 440 1 2 1 1 4 VAL H A 4 . HN 1 1 441 1 1 1 1 28 ARG HB2 A 28 . HB2 1 1 441 1 2 1 1 29 TRP QB A 29 . HB2 1 1 442 1 1 1 1 6 GLU QB A 6 . HB2 1 1 442 1 2 1 1 23 VAL H A 23 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.6 2.0 5.3 1 1 2 1 . . . . . 1.8 1.6 2.2 1 1 3 1 . . . . . 3.5 2.0 6.0 1 1 4 1 . . . . . 3.5 2.0 3.8 1 1 5 1 . . . . . 2.7 1.9 3.4 1 1 6 1 . . . . . 1.8 1.8 2.2 1 1 7 1 . . . . . 3.7 2.0 5.1 1 1 8 1 . . . . . 3.2 2.0 4.4 1 1 9 1 . . . . . 3.1 1.9 4.5 1 1 10 1 . . . . . 2.9 1.9 4.0 1 1 11 1 . . . . . 3.4 2.0 3.4 1 1 12 1 . . . . . 1.9 1.6 2.5 1 1 13 1 . . . . . 2.0 1.8 2.5 1 1 14 1 . . . . . 2.9 1.9 3.9 1 1 15 1 . . . . . 2.4 1.9 3.1 1 1 16 1 . . . . . 3.1 2.0 4.3 1 1 17 1 . . . . . . 2.0 4.6 1 1 18 1 . . . . . 4.5 2.0 4.8 1 1 19 1 . . . . . 3.5 2.0 3.8 1 1 20 1 . . . . . 3.3 2.0 3.6 1 1 21 1 . . . . . 2.7 1.9 3.8 1 1 22 1 . . . . . 3.6 2.0 5.0 1 1 23 1 . . . . . 2.5 1.9 3.1 1 1 24 1 . . . . . 3.4 0.0 6.0 1 1 25 1 . . . . . 2.6 1.9 3.3 1 1 26 1 . . . . . 3.1 2.0 4.3 1 1 27 1 . . . . . 2.7 1.9 3.3 1 1 28 1 . . . . . 2.4 2.0 3.0 1 1 29 1 . . . . . 4.0 2.0 5.5 1 1 30 1 . . . . . 3.7 3.3 5.2 1 1 31 1 . . . . . . 1.8 2.2 1 1 32 1 . . . . . 4.9 2.0 5.8 1 1 33 1 . . . . . 3.4 2.0 4.3 1 1 34 1 . . . . . 3.9 2.0 5.0 1 1 35 1 . . . . . 4.7 2.0 5.0 1 1 36 1 . . . . . 2.6 1.9 3.4 1 1 37 1 . . . . . 2.2 1.7 2.8 1 1 38 1 . . . . . 4.0 2.0 5.8 1 1 39 1 . . . . . 5.4 1.8 6.0 1 1 40 1 . . . . . 2.7 2.0 3.4 1 1 41 1 . . . . . 3.4 2.0 4.5 1 1 42 1 . . . . . 2.0 1.8 2.4 1 1 43 1 . . . . . 4.1 2.0 4.5 1 1 44 1 . . . . . 2.5 1.8 3.0 1 1 45 1 . . . . . 2.5 1.8 2.9 1 1 46 1 . . . . . 4.6 2.0 5.0 1 1 47 1 . . . . . 2.1 1.8 2.6 1 1 48 1 . . . . . 3.2 1.9 3.9 1 1 49 1 . . . . . 3.1 1.9 3.3 1 1 50 1 . . . . . 2.8 2.0 2.9 1 1 51 1 . . . . . 3.1 2.0 3.4 1 1 52 1 . . . . . 4.2 2.0 5.0 1 1 53 1 . . . . . 2.6 1.9 3.3 1 1 54 1 . . . . . 2.2 1.8 2.7 1 1 55 1 . . . . . 2.9 1.9 3.8 1 1 56 1 . . . . . 3.0 1.9 3.6 1 1 57 1 . . . . . 2.3 1.8 2.8 1 1 58 1 . . . . . . 2.0 4.3 1 1 59 1 . . . . . 2.3 1.8 2.5 1 1 60 1 . . . . . 4.2 2.0 6.0 1 1 61 1 . . . . . 3.5 2.0 5.0 1 1 62 1 . . . . . 2.5 1.8 3.0 1 1 63 1 . . . . . 2.2 1.7 2.6 1 1 64 1 . . . . . 2.8 1.9 3.8 1 1 65 1 . . . . . 1.8 1.7 2.2 1 1 66 1 . . . . . 2.4 1.8 3.1 1 1 67 1 . . . . . 2.2 2.0 4.3 1 1 68 1 . . . . . 4.7 2.0 5.0 1 1 69 1 . . . . . 4.5 2.0 6.0 1 1 70 1 . . . . . 2.5 1.8 2.5 1 1 71 1 . . . . . 2.9 2.0 5.4 1 1 72 1 . . . . . 2.0 1.7 2.2 1 1 73 1 . . . . . 2.8 2.0 3.6 1 1 74 1 . . . . . 2.1 1.8 2.8 1 1 75 1 . . . . . 2.4 1.8 3.8 1 1 76 1 . . . . . 3.8 2.0 5.0 1 1 77 1 . . . . . 1.8 1.8 2.5 1 1 78 1 . . . . . 3.8 2.0 5.6 1 1 79 1 . . . . . 2.7 2.0 3.6 1 1 80 1 . . . . . 4.1 2.0 5.5 1 1 81 1 . . . . . 4.1 2.0 6.0 1 1 82 1 . . . . . . 2.3 2.5 1 1 83 1 . . . . . 3.5 2.0 4.8 1 1 84 1 . . . . . 4.2 2.0 6.0 1 1 85 1 . . . . . 2.6 1.8 3.3 1 1 86 1 . . . . . 2.1 1.8 2.6 1 1 87 1 . . . . . 4.5 2.0 6.0 1 1 88 1 . . . . . 4.6 2.0 6.0 1 1 89 1 . . . . . 5.0 1.9 6.0 1 1 90 1 . . . . . 3.0 2.0 3.5 1 1 91 1 . . . . . 3.2 2.0 3.3 1 1 92 1 . . . . . 3.6 2.0 4.5 1 1 93 1 . . . . . 3.0 2.0 4.1 1 1 94 1 . . . . . 2.3 1.8 3.0 1 1 95 1 . . . . . 2.4 1.8 3.1 1 1 96 1 . . . . . 4.2 2.3 4.5 1 1 97 1 . . . . . 4.8 1.9 6.0 1 1 98 1 . . . . . 4.1 2.0 5.5 1 1 99 1 . . . . . 3.1 2.0 4.3 1 1 100 1 . . . . . 3.8 2.0 5.3 1 1 101 1 . . . . . 2.1 1.8 2.5 1 1 102 1 . . . . . 3.1 1.9 4.1 1 1 103 1 . . . . . 3.8 2.0 5.0 1 1 104 1 . . . . . 3.0 2.0 3.1 1 1 105 1 . . . . . 2.8 1.9 2.8 1 1 106 1 . . . . . 4.7 2.0 5.0 1 1 107 1 . . . . . 3.0 2.0 3.8 1 1 108 1 . . . . . 2.5 1.9 3.0 1 1 109 1 . . . . . 3.9 2.0 5.0 1 1 110 1 . . . . . 2.7 2.0 3.4 1 1 111 1 . . . . . 4.7 2.0 5.5 1 1 112 1 . . . . . 5.7 1.8 6.0 1 1 113 1 . . . . . 5.6 1.8 6.0 1 1 114 1 . . . . . 3.7 2.0 5.0 1 1 115 1 . . . . . 3.3 2.0 3.3 1 1 116 1 . . . . . 3.3 2.0 4.1 1 1 117 1 . . . . . 3.1 2.0 4.2 1 1 118 1 . . . . . 5.5 1.8 6.0 1 1 119 1 . . . . . 3.6 2.3 4.5 1 1 120 1 . . . . . 2.9 1.9 3.3 1 1 121 1 . . . . . 4.8 2.0 5.0 1 1 122 1 . . . . . 2.8 1.9 3.6 1 1 123 1 . . . . . 3.2 1.9 3.3 1 1 124 1 . . . . . 3.3 2.0 4.5 1 1 125 1 . . . . . 2.6 1.8 3.3 1 1 126 1 . . . . . 3.2 2.0 3.6 1 1 127 1 . . . . . . 2.0 5.0 1 1 128 1 . . . . . 2.5 1.8 3.3 1 1 129 1 . . . . . 2.7 2.0 3.6 1 1 130 1 . . . . . 5.3 1.8 6.0 1 1 131 1 . . . . . 3.0 2.0 3.9 1 1 132 1 . . . . . 2.3 1.8 2.9 1 1 133 1 . . . . . 2.8 1.9 3.6 1 1 134 1 . . . . . 4.5 2.0 6.0 1 1 135 1 . . . . . 2.3 1.8 2.7 1 1 136 1 . . . . . 2.7 1.9 3.6 1 1 137 1 . . . . . 2.4 0.0 6.0 1 1 138 1 . . . . . 4.4 2.0 5.5 1 1 139 1 . . . . . 4.0 2.0 5.0 1 1 140 1 . . . . . 4.3 2.0 5.6 1 1 141 1 . . . . . 2.1 1.7 2.7 1 1 142 1 . . . . . 4.3 2.0 6.0 1 1 143 1 . . . . . 3.0 2.0 3.9 1 1 144 1 . . . . . 2.6 1.8 3.5 1 1 145 1 . . . . . 2.9 1.9 3.6 1 1 146 1 . . . . . 2.7 1.8 3.1 1 1 147 1 . . . . . 3.3 2.0 4.5 1 1 148 1 . . . . . 2.2 1.9 2.8 1 1 149 1 . . . . . 2.6 1.9 3.4 1 1 150 1 . . . . . 2.5 1.8 3.0 1 1 151 1 . . . . . 2.0 2.0 2.5 1 1 152 1 . . . . . 4.1 2.0 6.0 1 1 153 1 . . . . . 2.6 1.9 3.4 1 1 154 1 . . . . . 2.1 1.8 2.4 1 1 155 1 . . . . . 2.5 1.8 2.8 1 1 156 1 . . . . . 4.1 2.0 4.5 1 1 157 1 . . . . . 3.9 2.0 4.5 1 1 158 1 . . . . . 2.6 1.9 3.5 1 1 159 1 . . . . . 2.0 1.8 2.5 1 1 160 1 . . . . . 3.1 0.0 6.0 1 1 161 1 . . . . . 3.1 2.0 4.1 1 1 162 1 . . . . . 3.0 2.0 4.1 1 1 163 1 . . . . . 3.4 2.0 4.3 1 1 164 1 . . . . . 4.5 2.0 6.0 1 1 165 1 . . . . . 3.3 2.0 4.5 1 1 166 1 . . . . . 4.9 1.9 6.0 1 1 167 1 . . . . . 3.8 2.0 5.4 1 1 168 1 . . . . . 2.5 1.8 2.9 1 1 169 1 . . . . . 3.9 2.0 5.0 1 1 170 1 . . . . . 3.7 2.0 4.7 1 1 171 1 . . . . . 2.2 1.8 2.6 1 1 172 1 . . . . . 2.4 1.8 2.8 1 1 173 1 . . . . . 2.8 1.9 3.6 1 1 174 1 . . . . . 3.5 2.0 4.7 1 1 175 1 . . . . . 3.5 2.0 5.0 1 1 176 1 . . . . . 2.6 1.8 3.3 1 1 177 1 . . . . . 3.3 2.0 4.5 1 1 178 1 . . . . . 2.4 1.8 3.1 1 1 179 1 . . . . . 3.2 2.0 4.3 1 1 180 1 . . . . . 3.3 2.0 4.5 1 1 181 1 . . . . . 2.5 1.8 3.1 1 1 182 1 . . . . . 3.5 2.0 4.5 1 1 183 1 . . . . . 2.7 1.9 3.4 1 1 184 1 . . . . . 3.9 2.0 4.5 1 1 185 1 . . . . . 2.5 1.8 3.1 1 1 186 1 . . . . . . 2.0 4.5 1 1 187 1 . . . . . 2.6 1.8 3.4 1 1 188 1 . . . . . 3.5 2.0 4.8 1 1 189 1 . . . . . 2.3 1.8 2.8 1 1 190 1 . . . . . 2.8 2.0 3.8 1 1 191 1 . . . . . 2.8 1.9 3.6 1 1 192 1 . . . . . 3.2 2.0 4.3 1 1 193 1 . . . . . . 2.0 3.5 1 1 194 1 . . . . . 3.7 2.0 5.4 1 1 195 1 . . . . . 2.7 1.9 3.6 1 1 196 1 . . . . . 3.3 2.0 4.7 1 1 197 1 . . . . . 4.0 2.0 5.0 1 1 198 1 . . . . . 2.1 1.8 2.7 1 1 199 1 . . . . . 4.5 2.0 6.0 1 1 200 1 . . . . . 2.4 1.8 3.1 1 1 201 1 . . . . . 2.8 1.9 3.6 1 1 202 1 . . . . . 3.7 2.0 5.4 1 1 203 1 . . . . . 2.3 1.7 2.8 1 1 204 1 . . . . . 2.7 1.9 3.3 1 1 205 1 . . . . . 2.8 1.9 3.8 1 1 206 1 . . . . . 2.2 1.8 2.8 1 1 207 1 . . . . . 2.8 1.9 3.5 1 1 208 1 . . . . . 2.5 1.8 3.1 1 1 209 1 . . . . . 4.0 2.0 4.5 1 1 210 1 . . . . . . 2.0 3.9 1 1 211 1 . . . . . 2.9 1.9 6.0 1 1 212 1 . . . . . 3.0 1.9 3.8 1 1 213 1 . . . . . 2.8 2.0 3.6 1 1 214 1 . . . . . 3.9 2.0 5.8 1 1 215 1 . . . . . 4.2 2.0 6.0 1 1 216 1 . . . . . 2.6 1.7 3.5 1 1 217 1 . . . . . 2.9 2.0 3.9 1 1 218 1 . . . . . 3.7 2.0 5.3 1 1 219 1 . . . . . . 2.0 3.8 1 1 220 1 . . . . . 2.8 1.9 3.4 1 1 221 1 . . . . . 5.1 2.0 6.0 1 1 222 1 . . . . . 2.4 1.7 2.9 1 1 223 1 . . . . . 2.3 1.8 2.9 1 1 224 1 . . . . . 4.4 2.0 6.0 1 1 225 1 . . . . . 3.0 1.9 3.3 1 1 226 1 . . . . . 4.9 2.0 6.0 1 1 227 1 . . . . . 4.0 2.0 5.2 1 1 228 1 . . . . . 1.9 1.6 2.3 1 1 229 1 . . . . . 2.5 2.0 3.1 1 1 230 1 . . . . . 3.2 2.0 3.9 1 1 231 1 . . . . . 2.0 1.6 2.3 1 1 232 1 . . . . . 2.3 1.9 2.8 1 1 233 1 . . . . . 3.6 2.0 5.2 1 1 234 1 . . . . . 2.6 1.8 3.3 1 1 235 1 . . . . . 4.6 2.0 6.0 1 1 236 1 . . . . . 4.3 2.0 6.0 1 1 237 1 . . . . . 2.3 1.8 2.6 1 1 238 1 . . . . . 3.0 2.0 3.8 1 1 239 1 . . . . . 3.6 2.0 5.2 1 1 240 1 . . . . . 4.9 2.0 6.0 1 1 241 1 . . . . . 2.2 1.6 2.4 1 1 242 1 . . . . . 3.3 2.0 4.6 1 1 243 1 . . . . . 3.2 1.9 4.3 1 1 244 1 . . . . . 3.2 0.0 6.0 1 1 245 1 . . . . . 2.5 1.8 2.8 1 1 246 1 . . . . . 4.8 2.0 6.0 1 1 247 1 . . . . . 3.8 2.0 6.0 1 1 248 1 . . . . . 3.7 2.8 4.5 1 1 249 1 . . . . . 2.6 1.8 2.8 1 1 250 1 . . . . . 3.6 2.0 5.2 1 1 251 1 . . . . . 2.1 1.9 2.4 1 1 252 1 . . . . . 3.3 2.0 4.3 1 1 253 1 . . . . . 2.8 2.0 3.5 1 1 254 1 . . . . . 4.3 2.0 6.0 1 1 255 1 . . . . . 3.7 0.0 6.0 1 1 256 1 . . . . . 3.6 2.0 4.0 1 1 257 1 . . . . . 4.5 2.0 6.0 1 1 258 1 . . . . . 4.4 2.0 5.6 1 1 259 1 . . . . . 3.4 2.0 4.8 1 1 260 1 . . . . . 2.9 1.9 3.9 1 1 261 1 . . . . . 2.9 2.0 6.0 1 1 262 1 . . . . . 4.4 2.0 6.0 1 1 263 1 . . . . . 4.1 2.0 6.0 1 1 264 1 . . . . . . 1.8 2.5 1 1 265 1 . . . . . 5.9 1.9 6.0 1 1 266 1 . . . . . 2.3 1.7 2.9 1 1 267 1 . . . . . 3.8 2.0 4.3 1 1 268 1 . . . . . 5.2 1.8 6.0 1 1 269 1 . . . . . 5.4 1.9 6.0 1 1 270 1 . . . . . 4.1 2.0 6.0 1 1 271 1 . . . . . 2.7 1.9 3.3 1 1 272 1 . . . . . 2.9 2.0 3.6 1 1 273 1 . . . . . 3.5 2.0 4.5 1 1 274 1 . . . . . 2.2 1.8 2.8 1 1 275 1 . . . . . 5.2 2.0 6.0 1 1 276 1 . . . . . 4.1 2.0 6.0 1 1 277 1 . . . . . 4.2 2.0 6.0 1 1 278 1 . . . . . 4.7 2.0 6.0 1 1 279 1 . . . . . 3.9 2.0 5.6 1 1 280 1 . . . . . 4.3 2.0 6.0 1 1 281 1 . . . . . 3.1 2.0 4.1 1 1 282 1 . . . . . 3.5 2.0 5.4 1 1 283 1 . . . . . 3.8 0.0 6.0 1 1 284 1 . . . . . 4.3 2.0 6.0 1 1 285 1 . . . . . 3.6 2.0 4.5 1 1 286 1 . . . . . 4.6 2.0 6.0 1 1 287 1 . . . . . 2.8 1.8 3.4 1 1 288 1 . . . . . 2.4 1.8 3.1 1 1 289 1 . . . . . 3.3 2.0 4.6 1 1 290 1 . . . . . 3.4 2.0 4.3 1 1 291 1 . . . . . 4.3 2.0 6.0 1 1 292 1 . . . . . 4.1 2.0 6.0 1 1 293 1 . . . . . 2.2 1.8 2.4 1 1 294 1 . . . . . 3.5 2.0 5.0 1 1 295 1 . . . . . 3.4 2.0 5.4 1 1 296 1 . . . . . 3.7 2.0 5.0 1 1 297 1 . . . . . 4.4 2.0 5.6 1 1 298 1 . . . . . 4.2 2.0 6.0 1 1 299 1 . . . . . 3.9 2.0 5.8 1 1 300 1 . . . . . 2.3 1.8 3.0 1 1 301 1 . . . . . 3.1 1.9 3.4 1 1 302 1 . . . . . 2.4 1.7 3.1 1 1 303 1 . . . . . 2.7 1.9 3.6 1 1 304 1 . . . . . 3.3 0.0 6.0 1 1 305 1 . . . . . 1.9 1.8 2.4 1 1 306 1 . . . . . 4.2 2.0 5.4 1 1 307 1 . . . . . 6.0 1.5 6.0 1 1 308 1 . . . . . 3.9 2.0 5.8 1 1 309 1 . . . . . 5.1 1.9 6.0 1 1 310 1 . . . . . 2.2 1.8 2.8 1 1 311 1 . . . . . 2.0 1.8 2.5 1 1 312 1 . . . . . . 2.8 4.5 1 1 313 1 . . . . . 2.0 1.8 2.5 1 1 314 1 . . . . . 3.8 2.0 5.4 1 1 315 1 . . . . . 3.0 2.0 3.8 1 1 316 1 . . . . . 3.4 2.0 4.5 1 1 317 1 . . . . . 2.9 1.9 3.8 1 1 318 1 . . . . . 2.9 1.9 3.9 1 1 319 1 . . . . . 2.9 2.0 3.9 1 1 320 1 . . . . . 2.3 1.7 3.0 1 1 321 1 . . . . . 4.5 2.0 5.2 1 1 322 1 . . . . . 3.0 1.9 4.0 1 1 323 1 . . . . . 3.0 2.0 4.2 1 1 324 1 . . . . . 3.7 2.0 5.4 1 1 325 1 . . . . . 2.8 1.9 3.8 1 1 326 1 . . . . . 2.9 2.0 3.9 1 1 327 1 . . . . . 2.7 1.8 3.6 1 1 328 1 . . . . . 2.8 1.8 3.8 1 1 329 1 . . . . . 2.3 1.7 3.0 1 1 330 1 . . . . . 3.4 1.9 4.9 1 1 331 1 . . . . . . 2.0 4.3 1 1 332 1 . . . . . 4.8 1.9 6.0 1 1 333 1 . . . . . 4.5 2.8 4.5 1 1 334 1 . . . . . . 1.9 4.0 1 1 335 1 . . . . . 2.8 1.8 6.0 1 1 336 1 . . . . . 3.5 1.9 4.9 1 1 337 1 . . . . . 2.8 2.0 3.8 1 1 338 1 . . . . . 4.2 2.0 6.0 1 1 339 1 . . . . . 6.0 1.3 6.0 1 1 340 1 . . . . . 2.3 1.8 3.0 1 1 341 1 . . . . . 4.6 2.0 5.8 1 1 342 1 . . . . . 3.1 1.9 4.3 1 1 343 1 . . . . . 2.6 1.8 3.4 1 1 344 1 . . . . . 4.3 2.0 6.0 1 1 345 1 . . . . . 4.0 2.0 6.0 1 1 346 1 . . . . . 3.4 2.0 4.7 1 1 347 1 . . . . . 3.0 1.9 4.1 1 1 348 1 . . . . . 4.0 2.0 6.0 1 1 349 1 . . . . . 2.5 1.8 3.3 1 1 350 1 . . . . . 3.1 2.0 4.3 1 1 351 1 . . . . . 3.7 0.0 6.0 1 1 352 1 . . . . . 3.8 2.0 5.6 1 1 353 1 . . . . . 5.2 1.8 6.0 1 1 354 1 . . . . . 3.4 2.0 4.8 1 1 355 1 . . . . . 2.9 1.9 3.1 1 1 356 1 . . . . . 2.1 1.6 2.6 1 1 357 1 . . . . . 2.7 0.0 6.0 1 1 358 1 . . . . . 2.4 1.7 3.1 1 1 359 1 . . . . . 2.8 1.9 3.8 1 1 360 1 . . . . . 2.6 1.8 3.1 1 1 361 1 . . . . . 2.3 1.8 2.9 1 1 362 1 . . . . . 4.2 2.0 6.0 1 1 363 1 . . . . . 2.4 1.7 3.1 1 1 364 1 . . . . . 2.8 1.9 3.8 1 1 365 1 . . . . . 2.2 0.0 6.0 1 1 366 1 . . . . . 2.9 1.9 4.0 1 1 367 1 . . . . . 4.8 2.0 6.0 1 1 368 1 . . . . . 4.0 2.0 4.7 1 1 369 1 . . . . . 4.0 2.0 5.5 1 1 370 1 . . . . . 2.9 1.8 4.0 1 1 371 1 . . . . . 3.2 0.0 6.0 1 1 372 1 . . . . . 3.6 0.0 6.0 1 1 373 1 . . . . . 3.5 2.0 5.0 1 1 374 1 . . . . . 3.2 1.9 3.5 1 1 375 1 . . . . . 3.6 2.0 5.0 1 1 376 1 . . . . . 4.2 2.0 6.0 1 1 377 1 . . . . . 2.8 0.0 6.0 1 1 378 1 . . . . . 4.4 2.0 6.0 1 1 379 1 . . . . . 3.9 2.0 5.8 1 1 380 1 . . . . . 3.4 2.0 4.9 1 1 381 1 . . . . . 4.1 2.0 6.0 1 1 382 1 . . . . . 3.9 2.0 5.8 1 1 383 1 . . . . . 3.2 1.9 4.5 1 1 384 1 . . . . . 3.7 2.0 5.4 1 1 385 1 . . . . . 2.6 0.0 6.0 1 1 386 1 . . . . . 4.5 2.0 6.0 1 1 387 1 . . . . . 2.8 0.0 6.0 1 1 388 1 . . . . . 2.2 1.8 2.8 1 1 389 1 . . . . . 2.6 1.8 3.4 1 1 390 1 . . . . . 2.5 1.9 3.1 1 1 391 1 . . . . . 2.2 1.8 2.8 1 1 392 1 . . . . . 3.2 1.9 4.5 1 1 393 1 . . . . . 4.1 2.0 5.6 1 1 394 1 . . . . . 2.7 0.0 6.0 1 1 395 1 . . . . . 3.8 2.0 6.0 1 1 396 1 . . . . . 2.8 1.9 3.8 1 1 397 1 . . . . . 3.0 0.0 6.0 1 1 398 1 . . . . . 3.0 1.9 3.5 1 1 399 1 . . . . . 3.6 2.0 5.2 1 1 400 1 . . . . . 3.3 2.0 4.6 1 1 401 1 . . . . . 3.6 2.0 5.0 1 1 402 1 . . . . . 2.6 2.0 3.4 1 1 403 1 . . . . . 2.4 0.0 6.0 1 1 404 1 . . . . . 3.7 0.0 6.0 1 1 405 1 . . . . . 3.0 1.9 3.9 1 1 406 1 . . . . . 3.0 1.9 4.1 1 1 407 1 . . . . . 3.7 2.0 5.4 1 1 408 1 . . . . . 4.0 2.0 5.5 1 1 409 1 . . . . . 3.1 0.0 6.0 1 1 410 1 . . . . . 2.2 1.6 2.8 1 1 411 1 . . . . . 4.4 1.9 6.0 1 1 412 1 . . . . . 4.4 2.0 6.0 1 1 413 1 . . . . . 4.1 2.0 6.0 1 1 414 1 . . . . . 3.0 1.9 4.2 1 1 415 1 . . . . . 4.4 2.0 6.0 1 1 416 1 . . . . . 2.6 0.0 6.0 1 1 417 1 . . . . . 2.5 1.8 3.3 1 1 418 1 . . . . . 3.4 1.9 5.0 1 1 419 1 . . . . . 4.1 2.0 5.0 1 1 420 1 . . . . . 2.9 0.0 6.0 1 1 421 1 . . . . . 3.8 2.0 5.6 1 1 422 1 . . . . . 4.4 2.0 6.0 1 1 423 1 . . . . . 4.3 1.9 6.0 1 1 424 1 . . . . . 3.6 0.0 6.0 1 1 425 1 . . . . . 2.4 1.8 3.1 1 1 426 1 . . . . . 5.0 1.9 6.0 1 1 427 1 . . . . . 5.8 1.6 6.0 1 1 428 1 . . . . . 4.3 2.0 4.5 1 1 429 1 . . . . . 4.0 2.0 6.0 1 1 430 1 . . . . . 3.3 1.8 5.0 1 1 431 1 . . . . . 3.7 2.0 5.4 1 1 432 1 . . . . . 4.3 1.9 6.0 1 1 433 1 . . . . . 4.5 1.9 6.0 1 1 434 1 . . . . . 3.1 1.9 4.3 1 1 435 1 . . . . . 2.7 1.8 3.6 1 1 436 1 . . . . . 2.8 1.8 3.8 1 1 437 1 . . . . . 3.2 0.0 6.0 1 1 438 1 . . . . . 3.1 0.0 6.0 1 1 439 1 . . . . . 2.8 1.8 3.8 1 1 440 1 . . . . . 4.1 2.0 6.0 1 1 441 1 . . . . . 4.3 2.0 6.0 1 1 442 1 . . . . . 4.0 2.0 6.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 . . . 1 2 76 1 . . . 1 2 77 1 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 . . . 1 2 81 1 . . . 1 2 82 1 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 . . . 1 2 86 1 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 . . . 1 2 90 1 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 . . . 1 2 95 1 . . . 1 2 96 1 . . . 1 2 97 1 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 105 1 . . . 1 2 106 1 . . . 1 2 107 1 . . . 1 2 108 1 . . . 1 2 109 1 . . . 1 2 110 1 . . . 1 2 111 1 . . . 1 2 112 1 . . . 1 2 113 1 . . . 1 2 114 1 . . . 1 2 115 1 . . . 1 2 116 1 . . . 1 2 117 1 . . . 1 2 118 1 . . . 1 2 119 1 . . . 1 2 120 1 . . . 1 2 121 1 . . . 1 2 122 1 . . . 1 2 123 1 . . . 1 2 124 1 . . . 1 2 125 1 . . . 1 2 126 1 . . . 1 2 127 1 . . . 1 2 128 1 . . . 1 2 129 1 . . . 1 2 130 1 . . . 1 2 131 1 . . . 1 2 132 1 . . . 1 2 133 1 . . . 1 2 134 1 . . . 1 2 135 1 . . . 1 2 136 1 . . . 1 2 137 1 . . . 1 2 138 1 . . . 1 2 139 1 . . . 1 2 140 1 . . . 1 2 141 1 . . . 1 2 142 1 . . . 1 2 143 1 . . . 1 2 144 1 . . . 1 2 145 1 . . . 1 2 146 1 . . . 1 2 147 1 . . . 1 2 148 1 . . . 1 2 149 1 . . . 1 2 150 1 . . . 1 2 151 1 . . . 1 2 152 1 . . . 1 2 153 1 . . . 1 2 154 1 . . . 1 2 155 1 . . . 1 2 156 1 . . . 1 2 157 1 . . . 1 2 158 1 . . . 1 2 159 1 . . . 1 2 160 1 . . . 1 2 161 1 . . . 1 2 162 1 . . . 1 2 163 1 . . . 1 2 164 1 . . . 1 2 165 1 . . . 1 2 166 1 . . . 1 2 167 1 . . . 1 2 168 1 . . . 1 2 169 1 . . . 1 2 170 1 . . . 1 2 171 1 . . . 1 2 172 1 . . . 1 2 173 1 . . . 1 2 174 1 . . . 1 2 175 1 . . . 1 2 176 1 . . . 1 2 177 1 . . . 1 2 178 1 . . . 1 2 179 1 . . . 1 2 180 1 . . . 1 2 181 1 . . . 1 2 182 1 . . . 1 2 183 1 . . . 1 2 184 1 . . . 1 2 185 1 . . . 1 2 186 1 . . . 1 2 187 1 . . . 1 2 188 1 . . . 1 2 189 1 . . . 1 2 190 1 . . . 1 2 191 1 . . . 1 2 192 1 . . . 1 2 193 1 . . . 1 2 194 1 . . . 1 2 195 1 . . . 1 2 196 1 . . . 1 2 197 1 . . . 1 2 198 1 . . . 1 2 199 1 . . . 1 2 200 1 . . . 1 2 201 1 . . . 1 2 202 1 . . . 1 2 203 1 . . . 1 2 204 1 . . . 1 2 205 1 . . . 1 2 206 1 . . . 1 2 207 1 . . . 1 2 208 1 . . . 1 2 209 1 . . . 1 2 210 1 . . . 1 2 211 1 . . . 1 2 212 1 . . . 1 2 213 1 . . . 1 2 214 1 . . . 1 2 215 1 . . . 1 2 216 1 . . . 1 2 217 1 . . . 1 2 218 1 . . . 1 2 219 1 . . . 1 2 220 1 . . . 1 2 221 1 . . . 1 2 222 1 . . . 1 2 223 1 . . . 1 2 224 1 . . . 1 2 225 1 . . . 1 2 226 1 . . . 1 2 227 1 . . . 1 2 228 1 . . . 1 2 229 1 . . . 1 2 230 1 . . . 1 2 231 1 . . . 1 2 232 1 . . . 1 2 233 1 . . . 1 2 234 1 . . . 1 2 235 1 . . . 1 2 236 1 . . . 1 2 237 1 . . . 1 2 238 1 . . . 1 2 239 1 . . . 1 2 240 1 . . . 1 2 241 1 . . . 1 2 242 1 . . . 1 2 243 1 . . . 1 2 244 1 . . . 1 2 245 1 . . . 1 2 246 1 . . . 1 2 247 1 . . . 1 2 248 1 . . . 1 2 249 1 . . . 1 2 250 1 . . . 1 2 251 1 . . . 1 2 252 1 . . . 1 2 253 1 . . . 1 2 254 1 . . . 1 2 255 1 . . . 1 2 256 1 . . . 1 2 257 1 . . . 1 2 258 1 . . . 1 2 259 1 . . . 1 2 260 1 . . . 1 2 261 1 . . . 1 2 262 1 . . . 1 2 263 1 . . . 1 2 264 1 . . . 1 2 265 1 . . . 1 2 266 1 . . . 1 2 267 1 . . . 1 2 268 1 . . . 1 2 269 1 . . . 1 2 270 1 . . . 1 2 271 1 . . . 1 2 272 1 . . . 1 2 273 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 GLY QA A 1 . HA# 1 2 1 1 2 1 1 2 SER H A 2 . HN 1 2 2 1 1 1 1 2 SER H A 2 . HN 1 2 2 1 2 1 1 2 SER HA A 2 . HA 1 2 3 1 1 1 1 2 SER H A 2 . HN 1 2 3 1 2 1 1 2 SER QB A 2 . HB# 1 2 4 1 1 1 1 2 SER QB A 2 . HB# 1 2 4 1 2 1 1 3 GLN H A 3 . HN 1 2 5 1 1 1 1 2 SER QB A 2 . HB# 1 2 5 1 2 1 1 51 TYR QE A 51 . HE# 1 2 6 1 1 1 1 2 SER QB A 2 . HB# 1 2 6 1 2 1 1 51 TYR QD A 51 . HD# 1 2 7 1 1 1 1 2 SER QB A 2 . HB# 1 2 7 1 2 1 1 51 TYR H A 51 . HN 1 2 8 1 1 1 1 3 GLN HA A 3 . HA 1 2 8 1 2 1 1 20 GLY QA A 20 . HA# 1 2 9 1 1 1 1 3 GLN QB A 3 . HB# 1 2 9 1 2 1 1 51 TYR QE A 51 . HE# 1 2 10 1 1 1 1 3 GLN QB A 3 . HB# 1 2 10 1 2 1 1 51 TYR QD A 51 . HD# 1 2 11 1 1 1 1 4 VAL HB A 4 . HB 1 2 11 1 2 1 1 5 PHE H A 5 . HN 1 2 12 1 1 1 1 4 VAL QG A 4 . HG# 1 2 12 1 2 1 1 5 PHE H A 5 . HN 1 2 13 1 1 1 1 5 PHE H A 5 . HN 1 2 13 1 2 1 1 6 GLU H A 6 . HN 1 2 14 1 1 1 1 5 PHE HA A 5 . HA 1 2 14 1 2 1 1 6 GLU H A 6 . HN 1 2 15 1 1 1 1 5 PHE QB A 5 . HB# 1 2 15 1 2 1 1 6 GLU H A 6 . HN 1 2 16 1 1 1 1 5 PHE H A 5 . HN 1 2 16 1 2 1 1 19 LYS QB A 19 . HB# 1 2 17 1 1 1 1 5 PHE HA A 5 . HA 1 2 17 1 2 1 1 18 GLY QA A 18 . HA# 1 2 18 1 1 1 1 5 PHE HA A 5 . HA 1 2 18 1 2 1 1 19 LYS QB A 19 . HB# 1 2 19 1 1 1 1 5 PHE HA A 5 . HA 1 2 19 1 2 1 1 19 LYS QG A 19 . HG# 1 2 20 1 1 1 1 5 PHE HA A 5 . HA 1 2 20 1 2 1 1 19 LYS QD A 19 . HD# 1 2 21 1 1 1 1 5 PHE QE A 5 . HE# 1 2 21 1 2 1 1 51 TYR QB A 51 . HB# 1 2 22 1 1 1 1 3 GLN QB A 3 . HB# 1 2 22 1 2 1 1 5 PHE QE A 5 . HE# 1 2 23 1 1 1 1 3 GLN QG A 3 . HG# 1 2 23 1 2 1 1 5 PHE QD A 5 . HD# 1 2 24 1 1 1 1 5 PHE HA A 5 . HA 1 2 24 1 2 1 1 5 PHE QE A 5 . HE# 1 2 25 1 1 1 1 6 GLU H A 6 . HN 1 2 25 1 2 1 1 6 GLU QG A 6 . HG# 1 2 26 1 1 1 1 6 GLU H A 6 . HN 1 2 26 1 2 1 1 7 TYR H A 7 . HN 1 2 27 1 1 1 1 6 GLU HA A 6 . HA 1 2 27 1 2 1 1 7 TYR H A 7 . HN 1 2 28 1 1 1 1 6 GLU QG A 6 . HG# 1 2 28 1 2 1 1 7 TYR HA A 7 . HA 1 2 29 1 1 1 1 6 GLU H A 6 . HN 1 2 29 1 2 1 1 18 GLY H A 18 . HN 1 2 30 1 1 1 1 7 TYR H A 7 . HN 1 2 30 1 2 1 1 8 ALA H A 8 . HN 1 2 31 1 1 1 1 7 TYR HA A 7 . HA 1 2 31 1 2 1 1 8 ALA H A 8 . HN 1 2 32 1 1 1 1 8 ALA H A 8 . HN 1 2 32 1 2 1 1 8 ALA MB A 8 . HB# 1 2 33 1 1 1 1 8 ALA MB A 8 . HB# 1 2 33 1 2 1 1 9 GLU H A 9 . HN 1 2 34 1 1 1 1 8 ALA MB A 8 . HB# 1 2 34 1 2 1 1 40 GLY H A 40 . HN 1 2 35 1 1 1 1 8 ALA MB A 8 . HB# 1 2 35 1 2 1 1 40 GLY QA A 40 . HA# 1 2 36 1 1 1 1 8 ALA H A 8 . HN 1 2 36 1 2 1 1 24 GLU QB A 24 . HB# 1 2 37 1 1 1 1 8 ALA MB A 8 . HB# 1 2 37 1 2 1 1 25 TYR HA A 25 . HA 1 2 38 1 1 1 1 8 ALA MB A 8 . HB# 1 2 38 1 2 1 1 39 LYS HA A 39 . HA 1 2 39 1 1 1 1 8 ALA MB A 8 . HB# 1 2 39 1 2 1 1 25 TYR QB A 25 . HB# 1 2 40 1 1 1 1 8 ALA MB A 8 . HB# 1 2 40 1 2 1 1 24 GLU QB A 24 . HB# 1 2 41 1 1 1 1 8 ALA MB A 8 . HB# 1 2 41 1 2 1 1 27 VAL HA A 27 . HA 1 2 42 1 1 1 1 8 ALA MB A 8 . HB# 1 2 42 1 2 1 1 27 VAL HB A 27 . HB# 1 2 43 1 1 1 1 8 ALA MB A 8 . HB# 1 2 43 1 2 1 1 27 VAL QG A 27 . HG# 1 2 44 1 1 1 1 9 GLU H A 9 . HN 1 2 44 1 2 1 1 9 GLU QG A 9 . HG# 1 2 45 1 1 1 1 9 GLU H A 9 . HN 1 2 45 1 2 1 1 10 VAL H A 10 . HN 1 2 46 1 1 1 1 9 GLU QB A 9 . HB# 1 2 46 1 2 1 1 10 VAL H A 10 . HN 1 2 47 1 1 1 1 9 GLU QG A 9 . HG# 1 2 47 1 2 1 1 10 VAL HA A 10 . HA 1 2 48 1 1 1 1 9 GLU QG A 9 . HG# 1 2 48 1 2 1 1 26 LEU QB A 26 . HB# 1 2 49 1 1 1 1 9 GLU QB A 9 . HB# 1 2 49 1 2 1 1 26 LEU QB A 26 . HB# 1 2 50 1 1 1 1 9 GLU QB A 9 . HB# 1 2 50 1 2 1 1 26 LEU HG A 26 . HG# 1 2 51 1 1 1 1 9 GLU QG A 9 . HG# 1 2 51 1 2 1 1 26 LEU HG A 26 . HG# 1 2 52 1 1 1 1 10 VAL HB A 10 . HB 1 2 52 1 2 1 1 11 ASP H A 11 . HN 1 2 53 1 1 1 1 10 VAL QG A 10 . HG# 1 2 53 1 2 1 1 11 ASP H A 11 . HN 1 2 54 1 1 1 1 10 VAL QG A 10 . HG# 1 2 54 1 2 1 1 12 GLU H A 12 . HN 1 2 55 1 1 1 1 10 VAL HA A 10 . HA 1 2 55 1 2 1 1 27 VAL QG A 27 . HG# 1 2 56 1 1 1 1 10 VAL QG A 10 . HG# 1 2 56 1 2 1 1 30 LYS H A 30 . HN 1 2 57 1 1 1 1 10 VAL HA A 10 . HA 1 2 57 1 2 1 1 29 TRP HA A 29 . HA 1 2 58 1 1 1 1 10 VAL HA A 10 . HA 1 2 58 1 2 1 1 29 TRP HD1 A 29 . HD1 1 2 59 1 1 1 1 10 VAL QG A 10 . HG# 1 2 59 1 2 1 1 26 LEU HA A 26 . HA 1 2 60 1 1 1 1 10 VAL QG A 10 . HG# 1 2 60 1 2 1 1 28 ARG H A 28 . HN 1 2 61 1 1 1 1 11 ASP QB A 11 . HB# 1 2 61 1 2 1 1 12 GLU H A 12 . HN 1 2 62 1 1 1 1 11 ASP H A 11 . HN 1 2 62 1 2 1 1 27 VAL QG A 27 . HG# 1 2 63 1 1 1 1 11 ASP H A 11 . HN 1 2 63 1 2 1 1 28 ARG QB A 28 . HB# 1 2 64 1 1 1 1 11 ASP HA A 11 . HA 1 2 64 1 2 1 1 28 ARG QB A 28 . HB# 1 2 65 1 1 1 1 11 ASP H A 11 . HN 1 2 65 1 2 1 1 30 LYS HA A 30 . HA 1 2 66 1 1 1 1 11 ASP QB A 11 . HB# 1 2 66 1 2 1 1 30 LYS H A 30 . HN 1 2 67 1 1 1 1 11 ASP QB A 11 . HB# 1 2 67 1 2 1 1 30 LYS HA A 30 . HA 1 2 68 1 1 1 1 11 ASP QB A 11 . HB# 1 2 68 1 2 1 1 29 TRP QB A 29 . HB# 1 2 69 1 1 1 1 11 ASP QB A 11 . HB# 1 2 69 1 2 1 1 28 ARG QB A 28 . HB# 1 2 70 1 1 1 1 12 GLU QB A 12 . HB# 1 2 70 1 2 1 1 13 ILE H A 13 . HN 1 2 71 1 1 1 1 12 GLU H A 12 . HN 1 2 71 1 2 1 1 27 VAL QG A 27 . HG# 1 2 72 1 1 1 1 12 GLU H A 12 . HN 1 2 72 1 2 1 1 28 ARG QB A 28 . HB# 1 2 73 1 1 1 1 12 GLU QB A 12 . HB# 1 2 73 1 2 1 1 29 TRP H A 29 . HN 1 2 74 1 1 1 1 13 ILE H A 13 . HN 1 2 74 1 2 1 1 13 ILE MD A 13 . HD# 1 2 75 1 1 1 1 13 ILE H A 13 . HN 1 2 75 1 2 1 1 13 ILE QG A 13 . HG# 1 2 75 1 2 1 1 13 ILE MG A 13 . HG# 1 2 76 1 1 1 1 8 ALA MB A 8 . HB# 1 2 76 1 2 1 1 13 ILE QG A 13 . HG# 1 2 76 1 2 1 1 13 ILE MG A 13 . HG# 1 2 77 1 1 1 1 13 ILE MD A 13 . HD# 1 2 77 1 2 1 1 14 VAL H A 14 . HN 1 2 78 1 1 1 1 13 ILE HA A 13 . HA 1 2 78 1 2 1 1 26 LEU QD A 26 . HD# 1 2 79 1 1 1 1 13 ILE HA A 13 . HA 1 2 79 1 2 1 1 27 VAL QG A 27 . HG# 1 2 80 1 1 1 1 13 ILE HB A 13 . HB 1 2 80 1 2 1 1 25 TYR HA A 25 . HA 1 2 81 1 1 1 1 13 ILE MD A 13 . HD# 1 2 81 1 2 1 1 25 TYR HA A 25 . HA 1 2 82 1 1 1 1 13 ILE HB A 13 . HB 1 2 82 1 2 1 1 25 TYR QB A 25 . HB# 1 2 83 1 1 1 1 13 ILE MD A 13 . HD# 1 2 83 1 2 1 1 25 TYR QB A 25 . HB# 1 2 84 1 1 1 1 13 ILE MD A 13 . HD# 1 2 84 1 2 1 1 26 LEU H A 26 . HN 1 2 85 1 1 1 1 13 ILE HA A 13 . HA 1 2 85 1 2 1 1 27 VAL HB A 27 . HB 1 2 86 1 1 1 1 13 ILE MD A 13 . HD# 1 2 86 1 2 1 1 27 VAL HB A 27 . HB 1 2 87 1 1 1 1 13 ILE HA A 13 . HA 1 2 87 1 2 1 1 27 VAL H A 27 . HN 1 2 88 1 1 1 1 14 VAL H A 14 . HN 1 2 88 1 2 1 1 14 VAL QG A 14 . HG# 1 2 89 1 1 1 1 14 VAL QG A 14 . HG# 1 2 89 1 2 1 1 15 GLU H A 15 . HN 1 2 90 1 1 1 1 14 VAL QG A 14 . HG# 1 2 90 1 2 1 1 26 LEU H A 26 . HN 1 2 91 1 1 1 1 14 VAL HB A 14 . HB 1 2 91 1 2 1 1 26 LEU QB A 26 . HB# 1 2 92 1 1 1 1 14 VAL HB A 14 . HB 1 2 92 1 2 1 1 26 LEU HG A 26 . HG# 1 2 93 1 1 1 1 15 GLU H A 15 . HN 1 2 93 1 2 1 1 15 GLU QG A 15 . HG# 1 2 94 1 1 1 1 15 GLU H A 15 . HN 1 2 94 1 2 1 1 16 LYS H A 16 . HN 1 2 95 1 1 1 1 15 GLU QB A 15 . HB# 1 2 95 1 2 1 1 16 LYS H A 16 . HN 1 2 96 1 1 1 1 15 GLU QG A 15 . HG# 1 2 96 1 2 1 1 16 LYS H A 16 . HN 1 2 97 1 1 1 1 15 GLU QB A 15 . HB# 1 2 97 1 2 1 1 26 LEU H A 26 . HN 1 2 98 1 1 1 1 16 LYS H A 16 . HN 1 2 98 1 2 1 1 16 LYS QG A 16 . HG# 1 2 99 1 1 1 1 16 LYS H A 16 . HN 1 2 99 1 2 1 1 16 LYS QD A 16 . HD# 1 2 100 1 1 1 1 16 LYS H A 16 . HN 1 2 100 1 2 1 1 16 LYS QE A 16 . HE# 1 2 101 1 1 1 1 16 LYS H A 16 . HN 1 2 101 1 2 1 1 17 ARG H A 17 . HN 1 2 102 1 1 1 1 16 LYS HA A 16 . HA 1 2 102 1 2 1 1 26 LEU H A 26 . HN 1 2 103 1 1 1 1 16 LYS H A 16 . HN 1 2 103 1 2 1 1 26 LEU QB A 26 . HB# 1 2 104 1 1 1 1 17 ARG H A 17 . HN 1 2 104 1 2 1 1 17 ARG QG A 17 . HG# 1 2 105 1 1 1 1 17 ARG H A 17 . HN 1 2 105 1 2 1 1 17 ARG QD A 17 . HD# 1 2 106 1 1 1 1 17 ARG QD A 17 . HD# 1 2 106 1 2 1 1 18 GLY H A 18 . HN 1 2 107 1 1 1 1 17 ARG H A 17 . HN 1 2 107 1 2 1 1 24 GLU H A 24 . HN 1 2 108 1 1 1 1 18 GLY QA A 18 . HA# 1 2 108 1 2 1 1 19 LYS H A 19 . HN 1 2 109 1 1 1 1 18 GLY QA A 18 . HA# 1 2 109 1 2 1 1 23 VAL HA A 23 . HA 1 2 110 1 1 1 1 18 GLY QA A 18 . HA# 1 2 110 1 2 1 1 19 LYS QB A 19 . HB# 1 2 111 1 1 1 1 18 GLY QA A 18 . HA# 1 2 111 1 2 1 1 19 LYS QG A 19 . HG# 1 2 112 1 1 1 1 18 GLY QA A 18 . HA# 1 2 112 1 2 1 1 19 LYS QD A 19 . HD# 1 2 113 1 1 1 1 19 LYS H A 19 . HN 1 2 113 1 2 1 1 19 LYS QD A 19 . HD# 1 2 114 1 1 1 1 19 LYS H A 19 . HN 1 2 114 1 2 1 1 19 LYS QE A 19 . HE# 1 2 115 1 1 1 1 19 LYS H A 19 . HN 1 2 115 1 2 1 1 19 LYS QG A 19 . HG# 1 2 116 1 1 1 1 19 LYS QB A 19 . HB# 1 2 116 1 2 1 1 20 GLY H A 20 . HN 1 2 117 1 1 1 1 19 LYS QG A 19 . HG# 1 2 117 1 2 1 1 20 GLY H A 20 . HN 1 2 118 1 1 1 1 19 LYS QD A 19 . HD# 1 2 118 1 2 1 1 44 ALA H A 44 . HN 1 2 119 1 1 1 1 19 LYS QD A 19 . HD# 1 2 119 1 2 1 1 45 GLU H A 45 . HN 1 2 120 1 1 1 1 19 LYS QD A 19 . HD# 1 2 120 1 2 1 1 46 ASP H A 46 . HN 1 2 121 1 1 1 1 19 LYS QD A 19 . HD# 1 2 121 1 2 1 1 47 VAL H A 47 . HN 1 2 122 1 1 1 1 5 PHE QB A 5 . HB# 1 2 122 1 2 1 1 19 LYS HA A 19 . HA 1 2 123 1 1 1 1 19 LYS QD A 19 . HD# 1 2 123 1 2 1 1 44 ALA HA A 44 . HA 1 2 124 1 1 1 1 19 LYS QB A 19 . HB# 1 2 124 1 2 1 1 42 HIS H A 42 . HN 1 2 125 1 1 1 1 19 LYS QB A 19 . HB# 1 2 125 1 2 1 1 42 HIS HA A 42 . HA 1 2 126 1 1 1 1 19 LYS QD A 19 . HD# 1 2 126 1 2 1 1 42 HIS HA A 42 . HA 1 2 127 1 1 1 1 19 LYS QB A 19 . HB# 1 2 127 1 2 1 1 42 HIS QB A 42 . HB# 1 2 128 1 1 1 1 19 LYS QB A 19 . HB# 1 2 128 1 2 1 1 43 VAL HA A 43 . HA 1 2 129 1 1 1 1 19 LYS QB A 19 . HB# 1 2 129 1 2 1 1 47 VAL HA A 47 . HA 1 2 130 1 1 1 1 20 GLY QA A 20 . HA# 1 2 130 1 2 1 1 21 LYS H A 21 . HN 1 2 131 1 1 1 1 20 GLY QA A 20 . HA# 1 2 131 1 2 1 1 22 ASP H A 22 . HN 1 2 132 1 1 1 1 20 GLY QA A 20 . HA# 1 2 132 1 2 1 1 46 ASP H A 46 . HN 1 2 133 1 1 1 1 21 LYS H A 21 . HN 1 2 133 1 2 1 1 21 LYS QD A 21 . HD# 1 2 134 1 1 1 1 21 LYS QB A 21 . HB# 1 2 134 1 2 1 1 22 ASP H A 22 . HN 1 2 135 1 1 1 1 21 LYS H A 21 . HN 1 2 135 1 2 1 1 23 VAL H A 23 . HN 1 2 136 1 1 1 1 21 LYS QD A 21 . HD# 1 2 136 1 2 1 1 42 HIS QB A 42 . HB# 1 2 137 1 1 1 1 22 ASP QB A 22 . HB# 1 2 137 1 2 1 1 23 VAL H A 23 . HN 1 2 138 1 1 1 1 22 ASP QB A 22 . HB# 1 2 138 1 2 1 1 24 GLU H A 24 . HN 1 2 139 1 1 1 1 19 LYS H A 19 . HN 1 2 139 1 2 1 1 22 ASP QB A 22 . HB# 1 2 140 1 1 1 1 23 VAL H A 23 . HN 1 2 140 1 2 1 1 24 GLU H A 24 . HN 1 2 141 1 1 1 1 23 VAL QG A 23 . HG# 1 2 141 1 2 1 1 24 GLU H A 24 . HN 1 2 142 1 1 1 1 23 VAL QG A 23 . HG# 1 2 142 1 2 1 1 25 TYR H A 25 . HN 1 2 143 1 1 1 1 23 VAL QG A 23 . HG# 1 2 143 1 2 1 1 40 GLY H A 40 . HN 1 2 144 1 1 1 1 17 ARG H A 17 . HN 1 2 144 1 2 1 1 23 VAL QG A 23 . HG# 1 2 145 1 1 1 1 17 ARG H A 17 . HN 1 2 145 1 2 1 1 23 VAL HA A 23 . HA 1 2 146 1 1 1 1 17 ARG H A 17 . HN 1 2 146 1 2 1 1 23 VAL H A 23 . HN 1 2 147 1 1 1 1 20 GLY QA A 20 . HA# 1 2 147 1 2 1 1 23 VAL QG A 23 . HG# 1 2 148 1 1 1 1 20 GLY QA A 20 . HA# 1 2 148 1 2 1 1 23 VAL HB A 23 . HB 1 2 149 1 1 1 1 24 GLU QB A 24 . HB# 1 2 149 1 2 1 1 25 TYR H A 25 . HN 1 2 150 1 1 1 1 25 TYR QB A 25 . HB# 1 2 150 1 2 1 1 26 LEU H A 26 . HN 1 2 151 1 1 1 1 25 TYR H A 25 . HN 1 2 151 1 2 1 1 37 TRP HA A 37 . HA 1 2 152 1 1 1 1 16 LYS H A 16 . HN 1 2 152 1 2 1 1 25 TYR HA A 25 . HA 1 2 153 1 1 1 1 25 TYR HA A 25 . HA 1 2 153 1 2 1 1 38 VAL H A 38 . HN 1 2 154 1 1 1 1 25 TYR HA A 25 . HA 1 2 154 1 2 1 1 25 TYR QE A 25 . HE# 1 2 155 1 1 1 1 16 LYS HA A 16 . HA 1 2 155 1 2 1 1 25 TYR QD A 25 . HD# 1 2 156 1 1 1 1 16 LYS HA A 16 . HA 1 2 156 1 2 1 1 25 TYR QE A 25 . HE# 1 2 157 1 1 1 1 25 TYR QD A 25 . HD# 1 2 157 1 2 1 1 40 GLY QA A 40 . HA# 1 2 158 1 1 1 1 25 TYR QE A 25 . HE# 1 2 158 1 2 1 1 40 GLY QA A 40 . HA# 1 2 159 1 1 1 1 13 ILE HB A 13 . HB 1 2 159 1 2 1 1 25 TYR QD A 25 . HD# 1 2 160 1 1 1 1 13 ILE HB A 13 . HB 1 2 160 1 2 1 1 25 TYR QE A 25 . HE# 1 2 161 1 1 1 1 26 LEU H A 26 . HN 1 2 161 1 2 1 1 27 VAL H A 27 . HN 1 2 162 1 1 1 1 26 LEU H A 26 . HN 1 2 162 1 2 1 1 26 LEU QD A 26 . HD# 1 2 163 1 1 1 1 26 LEU QD A 26 . HD# 1 2 163 1 2 1 1 36 GLU H A 36 . HN 1 2 164 1 1 1 1 15 GLU H A 15 . HN 1 2 164 1 2 1 1 26 LEU HG A 26 . HG 1 2 165 1 1 1 1 26 LEU HG A 26 . HG 1 2 165 1 2 1 1 38 VAL H A 38 . HN 1 2 166 1 1 1 1 26 LEU QD A 26 . HD# 1 2 166 1 2 1 1 38 VAL H A 38 . HN 1 2 167 1 1 1 1 27 VAL QG A 27 . HG# 1 2 167 1 2 1 1 28 ARG H A 28 . HN 1 2 168 1 1 1 1 13 ILE QG A 13 . HG# 1 2 168 1 1 1 1 13 ILE MG A 13 . HG# 1 2 168 1 2 1 1 27 VAL HA A 27 . HA 1 2 169 1 1 1 1 13 ILE MD A 13 . HD# 1 2 169 1 2 1 1 27 VAL HA A 27 . HA 1 2 170 1 1 1 1 25 TYR QB A 25 . HB# 1 2 170 1 2 1 1 27 VAL QG A 27 . HG# 1 2 171 1 1 1 1 28 ARG H A 28 . HN 1 2 171 1 2 1 1 28 ARG QD A 28 . HD# 1 2 172 1 1 1 1 30 LYS H A 30 . HN 1 2 172 1 2 1 1 30 LYS QD A 30 . HD# 1 2 173 1 1 1 1 30 LYS QB A 30 . HB# 1 2 173 1 2 1 1 31 ASP H A 31 . HN 1 2 174 1 1 1 1 30 LYS QB A 30 . HB# 1 2 174 1 2 1 1 32 GLY H A 32 . HN 1 2 175 1 1 1 1 31 ASP QB A 31 . HB# 1 2 175 1 2 1 1 32 GLY H A 32 . HN 1 2 176 1 1 1 1 33 GLY QA A 33 . HA# 1 2 176 1 2 1 1 34 ASP H A 34 . HN 1 2 177 1 1 1 1 34 ASP H A 34 . HN 1 2 177 1 2 1 1 35 CYS H A 35 . HN 1 2 178 1 1 1 1 35 CYS QB A 35 . HB# 1 2 178 1 2 1 1 36 GLU H A 36 . HN 1 2 179 1 1 1 1 36 GLU H A 36 . HN 1 2 179 1 2 1 1 36 GLU QG A 36 . HG# 1 2 180 1 1 1 1 26 LEU QB A 26 . HB# 1 2 180 1 2 1 1 37 TRP HA A 37 . HA 1 2 181 1 1 1 1 26 LEU QD A 26 . HD# 1 2 181 1 2 1 1 37 TRP HA A 37 . HA 1 2 182 1 1 1 1 37 TRP QB A 37 . HB# 1 2 182 1 2 1 1 38 VAL H A 38 . HN 1 2 183 1 1 1 1 37 TRP QB A 37 . HB# 1 2 183 1 2 1 1 39 LYS HA A 39 . HA 1 2 184 1 1 1 1 37 TRP HD1 A 37 . HD1 1 2 184 1 2 1 1 38 VAL H A 38 . HN 1 2 185 1 1 1 1 36 GLU QB A 36 . HB2 1 2 185 1 2 1 1 37 TRP HD1 A 37 . HD1 1 2 186 1 1 1 1 37 TRP HD1 A 37 . HD1 1 2 186 1 2 1 1 38 VAL QG A 38 . HG# 1 2 187 1 1 1 1 13 ILE HB A 13 . HB 1 2 187 1 2 1 1 37 TRP HD1 A 37 . HD1 1 2 188 1 1 1 1 13 ILE QG A 13 . HG# 1 2 188 1 1 1 1 13 ILE MG A 13 . HG# 1 2 188 1 2 1 1 37 TRP HD1 A 37 . HD1 1 2 189 1 1 1 1 38 VAL HB A 38 . HB 1 2 189 1 2 1 1 39 LYS H A 39 . HN 1 2 190 1 1 1 1 38 VAL QG A 38 . HG# 1 2 190 1 2 1 1 39 LYS H A 39 . HN 1 2 191 1 1 1 1 38 VAL QG A 38 . HG# 1 2 191 1 2 1 1 42 HIS H A 42 . HN 1 2 192 1 1 1 1 39 LYS H A 39 . HN 1 2 192 1 2 1 1 39 LYS QD A 39 . HD# 1 2 193 1 1 1 1 39 LYS H A 39 . HN 1 2 193 1 2 1 1 39 LYS QG A 39 . HG# 1 2 194 1 1 1 1 39 LYS QG A 39 . HG# 1 2 194 1 2 1 1 42 HIS H A 42 . HN 1 2 195 1 1 1 1 39 LYS QG A 39 . HG# 1 2 195 1 2 1 1 43 VAL H A 43 . HN 1 2 196 1 1 1 1 39 LYS QB A 39 . HB# 1 2 196 1 2 1 1 41 VAL H A 41 . HN 1 2 197 1 1 1 1 39 LYS HA A 39 . HA 1 2 197 1 2 1 1 42 HIS QB A 42 . HB# 1 2 198 1 1 1 1 40 GLY QA A 40 . HA# 1 2 198 1 2 1 1 41 VAL H A 41 . HN 1 2 199 1 1 1 1 40 GLY QA A 40 . HA# 1 2 199 1 2 1 1 42 HIS H A 42 . HN 1 2 200 1 1 1 1 40 GLY QA A 40 . HA# 1 2 200 1 2 1 1 43 VAL H A 43 . HN 1 2 201 1 1 1 1 24 GLU QG A 24 . HG# 1 2 201 1 2 1 1 40 GLY H A 40 . HN 1 2 202 1 1 1 1 41 VAL QG A 41 . HG# 1 2 202 1 2 1 1 42 HIS H A 42 . HN 1 2 203 1 1 1 1 41 VAL HA A 41 . HA 1 2 203 1 2 1 1 43 VAL H A 43 . HN 1 2 204 1 1 1 1 41 VAL HB A 41 . HB 1 2 204 1 2 1 1 43 VAL H A 43 . HN 1 2 205 1 1 1 1 42 HIS QB A 42 . HB# 1 2 205 1 2 1 1 43 VAL H A 43 . HN 1 2 206 1 1 1 1 42 HIS HA A 42 . HA 1 2 206 1 2 1 1 42 HIS HD2 A 42 . HD2 1 2 207 1 1 1 1 43 VAL H A 43 . HN 1 2 207 1 2 1 1 43 VAL QG A 43 . HG# 1 2 208 1 1 1 1 43 VAL QG A 43 . HG# 1 2 208 1 2 1 1 45 GLU H A 45 . HN 1 2 209 1 1 1 1 43 VAL QG A 43 . HG# 1 2 209 1 2 1 1 46 ASP H A 46 . HN 1 2 210 1 1 1 1 44 ALA MB A 44 . HB# 1 2 210 1 2 1 1 45 GLU H A 45 . HN 1 2 211 1 1 1 1 44 ALA MB A 44 . HB# 1 2 211 1 2 1 1 46 ASP H A 46 . HN 1 2 212 1 1 1 1 44 ALA MB A 44 . HB# 1 2 212 1 2 1 1 47 VAL H A 47 . HN 1 2 213 1 1 1 1 44 ALA HA A 44 . HA 1 2 213 1 2 1 1 47 VAL HB A 47 . HB 1 2 214 1 1 1 1 45 GLU H A 45 . HN 1 2 214 1 2 1 1 45 GLU QG A 45 . HG# 1 2 215 1 1 1 1 45 GLU QG A 45 . HG# 1 2 215 1 2 1 1 46 ASP H A 46 . HN 1 2 216 1 1 1 1 45 GLU H A 45 . HN 1 2 216 1 2 1 1 46 ASP H A 46 . HN 1 2 217 1 1 1 1 45 GLU QB A 45 . HB# 1 2 217 1 2 1 1 46 ASP H A 46 . HN 1 2 218 1 1 1 1 45 GLU HA A 45 . HA 1 2 218 1 2 1 1 47 VAL H A 47 . HN 1 2 219 1 1 1 1 45 GLU HA A 45 . HA 1 2 219 1 2 1 1 48 ALA MB A 48 . HB# 1 2 220 1 1 1 1 45 GLU HA A 45 . HA 1 2 220 1 2 1 1 49 LYS H A 49 . HN 1 2 221 1 1 1 1 45 GLU H A 45 . HN 1 2 221 1 2 1 1 47 VAL H A 47 . HN 1 2 222 1 1 1 1 46 ASP QB A 46 . HB# 1 2 222 1 2 1 1 49 LYS H A 49 . HN 1 2 223 1 1 1 1 47 VAL H A 47 . HN 1 2 223 1 2 1 1 47 VAL QG A 47 . HG# 1 2 224 1 1 1 1 47 VAL QG A 47 . HG# 1 2 224 1 2 1 1 48 ALA H A 48 . HN 1 2 225 1 1 1 1 47 VAL HA A 47 . HA 1 2 225 1 2 1 1 50 ASP QB A 50 . HB# 1 2 226 1 1 1 1 47 VAL QG A 47 . HG# 1 2 226 1 2 1 1 48 ALA HA A 48 . HA 1 2 227 1 1 1 1 48 ALA MB A 48 . HB# 1 2 227 1 2 1 1 49 LYS H A 49 . HN 1 2 228 1 1 1 1 48 ALA MB A 48 . HB# 1 2 228 1 2 1 1 50 ASP H A 50 . HN 1 2 229 1 1 1 1 49 LYS H A 49 . HN 1 2 229 1 2 1 1 49 LYS QG A 49 . HG# 1 2 230 1 1 1 1 49 LYS H A 49 . HN 1 2 230 1 2 1 1 49 LYS QE A 49 . HE# 1 2 231 1 1 1 1 49 LYS QB A 49 . HB# 1 2 231 1 2 1 1 50 ASP H A 50 . HN 1 2 232 1 1 1 1 49 LYS QG A 49 . HG# 1 2 232 1 2 1 1 50 ASP H A 50 . HN 1 2 233 1 1 1 1 49 LYS HA A 49 . HA 1 2 233 1 2 1 1 52 GLU QB A 52 . HB# 1 2 234 1 1 1 1 49 LYS H A 49 . HN 1 2 234 1 2 1 1 51 TYR H A 51 . HN 1 2 235 1 1 1 1 50 ASP QB A 50 . HB# 1 2 235 1 2 1 1 52 GLU H A 52 . HN 1 2 236 1 1 1 1 50 ASP HA A 50 . HA 1 2 236 1 2 1 1 53 ASP QB A 53 . HB# 1 2 237 1 1 1 1 51 TYR HA A 51 . HA 1 2 237 1 2 1 1 54 GLY H A 54 . HN 1 2 238 1 1 1 1 51 TYR QB A 51 . HB# 1 2 238 1 2 1 1 53 ASP H A 53 . HN 1 2 239 1 1 1 1 51 TYR H A 51 . HN 1 2 239 1 2 1 1 53 ASP H A 53 . HN 1 2 240 1 1 1 1 21 LYS QB A 21 . HB# 1 2 240 1 2 1 1 51 TYR QE A 51 . HE# 1 2 241 1 1 1 1 21 LYS QG A 21 . HG# 1 2 241 1 2 1 1 51 TYR QE A 51 . HE# 1 2 242 1 1 1 1 21 LYS QB A 21 . HB# 1 2 242 1 2 1 1 51 TYR QD A 51 . HD# 1 2 243 1 1 1 1 21 LYS QG A 21 . HG# 1 2 243 1 2 1 1 51 TYR QD A 51 . HD# 1 2 244 1 1 1 1 51 TYR QE A 51 . HE# 1 2 244 1 2 1 1 52 GLU H A 52 . HN 1 2 245 1 1 1 1 47 VAL H A 47 . HN 1 2 245 1 2 1 1 51 TYR QE A 51 . HE# 1 2 246 1 1 1 1 52 GLU H A 52 . HN 1 2 246 1 2 1 1 52 GLU QB A 52 . HB# 1 2 247 1 1 1 1 52 GLU H A 52 . HN 1 2 247 1 2 1 1 52 GLU QG A 52 . HG# 1 2 248 1 1 1 1 52 GLU HA A 52 . HA 1 2 248 1 2 1 1 54 GLY H A 54 . HN 1 2 249 1 1 1 1 52 GLU HA A 52 . HA 1 2 249 1 2 1 1 56 GLU H A 56 . HN 1 2 250 1 1 1 1 52 GLU HA A 52 . HA 1 2 250 1 2 1 1 55 LEU H A 55 . HN 1 2 251 1 1 1 1 52 GLU H A 52 . HN 1 2 251 1 2 1 1 54 GLY H A 54 . HN 1 2 252 1 1 1 1 53 ASP HA A 53 . HA 1 2 252 1 2 1 1 57 TYR H A 57 . HN 1 2 253 1 1 1 1 53 ASP QB A 53 . HB# 1 2 253 1 2 1 1 54 GLY H A 54 . HN 1 2 254 1 1 1 1 53 ASP QB A 53 . HB# 1 2 254 1 2 1 1 55 LEU H A 55 . HN 1 2 255 1 1 1 1 53 ASP HA A 53 . HA 1 2 255 1 2 1 1 56 GLU H A 56 . HN 1 2 256 1 1 1 1 53 ASP H A 53 . HN 1 2 256 1 2 1 1 55 LEU H A 55 . HN 1 2 257 1 1 1 1 54 GLY QA A 54 . HA# 1 2 257 1 2 1 1 55 LEU H A 55 . HN 1 2 258 1 1 1 1 54 GLY QA A 54 . HA# 1 2 258 1 2 1 1 57 TYR QB A 57 . HB# 1 2 259 1 1 1 1 54 GLY QA A 54 . HA# 1 2 259 1 2 1 1 57 TYR H A 57 . HN 1 2 260 1 1 1 1 54 GLY QA A 54 . HA# 1 2 260 1 2 1 1 56 GLU H A 56 . HN 1 2 261 1 1 1 1 54 GLY H A 54 . HN 1 2 261 1 2 1 1 56 GLU H A 56 . HN 1 2 262 1 1 1 1 55 LEU HA A 55 . HA 1 2 262 1 2 1 1 56 GLU H A 56 . HN 1 2 263 1 1 1 1 55 LEU QB A 55 . HB# 1 2 263 1 2 1 1 56 GLU H A 56 . HN 1 2 264 1 1 1 1 55 LEU QB A 55 . HB# 1 2 264 1 2 1 1 57 TYR H A 57 . HN 1 2 265 1 1 1 1 55 LEU H A 55 . HN 1 2 265 1 2 1 1 55 LEU QD A 55 . HD# 1 2 266 1 1 1 1 55 LEU QD A 55 . HD# 1 2 266 1 2 1 1 56 GLU H A 56 . HN 1 2 267 1 1 1 1 55 LEU H A 55 . HN 1 2 267 1 2 1 1 57 TYR H A 57 . HN 1 2 268 1 1 1 1 55 LEU HA A 55 . HA 1 2 268 1 2 1 1 57 TYR H A 57 . HN 1 2 269 1 1 1 1 54 GLY H A 54 . HN 1 2 269 1 2 1 1 55 LEU QB A 55 . HB# 1 2 270 1 1 1 1 54 GLY QA A 54 . HA# 1 2 270 1 2 1 1 55 LEU QD A 55 . HD# 1 2 271 1 1 1 1 54 GLY H A 54 . HN 1 2 271 1 2 1 1 55 LEU QD A 55 . HD# 1 2 272 1 1 1 1 56 GLU H A 56 . HN 1 2 272 1 2 1 1 56 GLU QG A 56 . HG# 1 2 273 1 1 1 1 57 TYR HA A 57 . HA 1 2 273 1 2 1 1 57 TYR QD A 57 . HD# 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.5 2.8 5.0 1 2 2 1 . . . . . 4.5 2.8 5.0 1 2 3 1 . . . . . 4.5 2.8 5.5 1 2 4 1 . . . . . 4.5 2.8 5.5 1 2 5 1 . . . . . 5.0 1.8 7.0 1 2 6 1 . . . . . 6.0 1.8 8.0 1 2 7 1 . . . . . 6.0 1.8 7.0 1 2 8 1 . . . . . 6.0 1.8 7.0 1 2 9 1 . . . . . 6.0 2.8 8.0 1 2 10 1 . . . . . 6.0 1.8 8.0 1 2 11 1 . . . . . 4.5 1.8 5.0 1 2 12 1 . . . . . 4.5 1.8 6.0 1 2 13 1 . . . . . 4.5 1.8 5.0 1 2 14 1 . . . . . 4.5 1.8 5.0 1 2 15 1 . . . . . 4.0 1.8 5.0 1 2 16 1 . . . . . 5.0 1.8 6.0 1 2 17 1 . . . . . 5.5 1.8 6.5 1 2 18 1 . . . . . 5.0 1.8 6.0 1 2 19 1 . . . . . 5.0 1.8 6.0 1 2 20 1 . . . . . 5.5 1.8 6.5 1 2 21 1 . . . . . 5.5 1.8 7.5 1 2 22 1 . . . . . 5.5 1.8 7.5 1 2 23 1 . . . . . 5.5 1.8 7.5 1 2 24 1 . . . . . 5.0 1.8 7.0 1 2 25 1 . . . . . 4.5 1.8 5.5 1 2 26 1 . . . . . 4.0 1.8 4.5 1 2 27 1 . . . . . 4.5 1.8 5.0 1 2 28 1 . . . . . 4.5 1.8 5.5 1 2 29 1 . . . . . 6.0 1.8 6.5 1 2 30 1 . . . . . 4.0 1.8 4.5 1 2 31 1 . . . . . 4.0 1.8 4.5 1 2 32 1 . . . . . 4.5 2.3 6.0 1 2 33 1 . . . . . 4.0 1.8 5.0 1 2 34 1 . . . . . 5.0 1.8 6.5 1 2 35 1 . . . . . 5.0 1.8 6.0 1 2 36 1 . . . . . 6.0 1.8 7.0 1 2 37 1 . . . . . 5.0 1.8 6.5 1 2 38 1 . . . . . 5.0 1.8 6.5 1 2 39 1 . . . . . 5.0 1.8 6.5 1 2 40 1 . . . . . 5.0 1.8 6.5 1 2 41 1 . . . . . 5.0 1.8 6.5 1 2 42 1 . . . . . 4.0 1.8 5.5 1 2 43 1 . . . . . 5.0 1.8 6.5 1 2 44 1 . . . . . 4.0 1.8 5.0 1 2 45 1 . . . . . 4.0 1.8 4.5 1 2 46 1 . . . . . 4.0 1.8 5.0 1 2 47 1 . . . . . 5.5 2.3 6.5 1 2 48 1 . . . . . 5.0 1.8 6.0 1 2 49 1 . . . . . 5.5 1.8 6.5 1 2 50 1 . . . . . 5.0 1.8 6.0 1 2 51 1 . . . . . 5.0 1.8 6.0 1 2 52 1 . . . . . 4.0 1.8 4.5 1 2 53 1 . . . . . 4.0 1.8 5.5 1 2 54 1 . . . . . 4.0 1.8 5.5 1 2 55 1 . . . . . 5.0 1.8 6.5 1 2 56 1 . . . . . 5.5 1.8 7.0 1 2 57 1 . . . . . 4.0 1.8 4.5 1 2 58 1 . . . . . 4.0 1.8 4.5 1 2 59 1 . . . . . 5.5 1.8 7.0 1 2 60 1 . . . . . 5.5 1.8 7.0 1 2 61 1 . . . . . 4.5 1.8 5.5 1 2 62 1 . . . . . 5.0 1.8 6.0 1 2 63 1 . . . . . 5.5 1.8 6.5 1 2 64 1 . . . . . 4.5 1.8 5.5 1 2 65 1 . . . . . 5.5 1.8 6.0 1 2 66 1 . . . . . 5.5 1.8 6.0 1 2 67 1 . . . . . 5.0 1.8 6.0 1 2 68 1 . . . . . 5.0 1.8 6.0 1 2 69 1 . . . . . 4.5 1.8 5.5 1 2 70 1 . . . . . 4.0 1.8 5.0 1 2 71 1 . . . . . 4.5 1.8 5.5 1 2 72 1 . . . . . 4.5 1.8 5.5 1 2 73 1 . . . . . 5.0 1.8 6.0 1 2 74 1 . . . . . 4.0 1.8 5.5 1 2 75 1 . . . . . 4.0 1.8 5.5 1 2 76 1 . . . . . 4.0 1.8 5.5 1 2 77 1 . . . . . 4.0 1.8 5.5 1 2 78 1 . . . . . 5.0 1.8 6.0 1 2 79 1 . . . . . 5.0 1.8 6.0 1 2 80 1 . . . . . 5.0 1.8 5.5 1 2 81 1 . . . . . 4.5 1.8 6.0 1 2 82 1 . . . . . 4.5 1.8 5.0 1 2 83 1 . . . . . 4.5 1.8 6.0 1 2 84 1 . . . . . 4.5 1.8 6.0 1 2 85 1 . . . . . 4.5 1.8 5.0 1 2 86 1 . . . . . 4.7 1.8 6.2 1 2 87 1 . . . . . 5.0 1.8 5.5 1 2 88 1 . . . . . 4.0 1.8 5.5 1 2 89 1 . . . . . 4.0 1.8 5.5 1 2 90 1 . . . . . 5.5 1.8 7.0 1 2 91 1 . . . . . 5.5 1.8 6.5 1 2 92 1 . . . . . 5.0 1.8 6.0 1 2 93 1 . . . . . 4.0 1.8 4.5 1 2 94 1 . . . . . 4.5 1.8 5.0 1 2 95 1 . . . . . 5.0 1.8 6.0 1 2 96 1 . . . . . 5.0 1.8 5.5 1 2 97 1 . . . . . 5.5 2.8 6.5 1 2 98 1 . . . . . 4.0 1.8 5.0 1 2 99 1 . . . . . 4.0 1.8 5.0 1 2 100 1 . . . . . 4.0 1.8 5.0 1 2 101 1 . . . . . 5.5 1.8 6.0 1 2 102 1 . . . . . 5.5 1.8 6.0 1 2 103 1 . . . . . 5.5 1.8 6.5 1 2 104 1 . . . . . 4.0 1.8 5.0 1 2 105 1 . . . . . 4.0 1.8 5.0 1 2 106 1 . . . . . 5.0 1.8 6.0 1 2 107 1 . . . . . 5.5 1.8 6.5 1 2 108 1 . . . . . 3.0 1.8 4.0 1 2 109 1 . . . . . 3.5 1.8 4.5 1 2 110 1 . . . . . 5.0 1.8 6.0 1 2 111 1 . . . . . 5.0 1.8 6.0 1 2 112 1 . . . . . 5.0 1.8 6.0 1 2 113 1 . . . . . 4.5 1.8 5.5 1 2 114 1 . . . . . 4.0 2.8 5.0 1 2 115 1 . . . . . 4.0 2.8 5.0 1 2 116 1 . . . . . 4.5 1.8 5.5 1 2 117 1 . . . . . 4.0 1.8 5.0 1 2 118 1 . . . . . 5.0 1.8 6.0 1 2 119 1 . . . . . 5.0 1.8 6.0 1 2 120 1 . . . . . 5.0 1.8 6.0 1 2 121 1 . . . . . 5.0 1.8 5.5 1 2 122 1 . . . . . 5.5 1.8 6.5 1 2 123 1 . . . . . 4.0 1.8 5.0 1 2 124 1 . . . . . 5.5 1.8 6.5 1 2 125 1 . . . . . 5.0 1.8 6.0 1 2 126 1 . . . . . 5.5 1.8 6.5 1 2 127 1 . . . . . 4.5 1.8 5.5 1 2 128 1 . . . . . 4.5 1.8 5.5 1 2 129 1 . . . . . 5.5 1.8 6.5 1 2 130 1 . . . . . 3.0 1.8 4.0 1 2 131 1 . . . . . 4.5 1.8 5.5 1 2 132 1 . . . . . 6.0 1.8 7.0 1 2 133 1 . . . . . 4.5 1.8 5.5 1 2 134 1 . . . . . 4.0 1.8 5.0 1 2 135 1 . . . . . 4.5 1.8 5.0 1 2 136 1 . . . . . 4.5 1.8 5.5 1 2 137 1 . . . . . 4.0 1.8 5.0 1 2 138 1 . . . . . 5.5 2.8 6.5 1 2 139 1 . . . . . 4.5 1.8 5.5 1 2 140 1 . . . . . 4.0 1.8 4.5 1 2 141 1 . . . . . 4.5 1.8 6.0 1 2 142 1 . . . . . 5.0 1.8 6.5 1 2 143 1 . . . . . 5.0 1.8 6.5 1 2 144 1 . . . . . 4.5 1.8 6.0 1 2 145 1 . . . . . 5.5 1.8 6.0 1 2 146 1 . . . . . 5.5 1.8 6.0 1 2 147 1 . . . . . 5.5 1.8 7.0 1 2 148 1 . . . . . 5.0 1.8 6.0 1 2 149 1 . . . . . 4.5 1.8 5.5 1 2 150 1 . . . . . 4.0 1.8 5.0 1 2 151 1 . . . . . 5.0 1.8 5.5 1 2 152 1 . . . . . 5.0 1.8 5.5 1 2 153 1 . . . . . 6.0 1.8 6.5 1 2 154 1 . . . . . 4.5 1.8 6.5 1 2 155 1 . . . . . 4.5 1.8 6.5 1 2 156 1 . . . . . 4.5 1.8 6.5 1 2 157 1 . . . . . 4.5 1.8 6.5 1 2 158 1 . . . . . 4.5 1.8 6.5 1 2 159 1 . . . . . 4.5 1.8 6.5 1 2 160 1 . . . . . 5.0 1.8 7.0 1 2 161 1 . . . . . 4.0 1.8 4.5 1 2 162 1 . . . . . 4.0 1.8 4.5 1 2 163 1 . . . . . 4.5 1.8 5.0 1 2 164 1 . . . . . 4.5 1.8 5.5 1 2 165 1 . . . . . 4.5 1.8 5.5 1 2 166 1 . . . . . 4.5 1.8 5.5 1 2 167 1 . . . . . 4.0 1.8 5.5 1 2 168 1 . . . . . 5.0 1.8 6.0 1 2 169 1 . . . . . 6.0 1.8 7.0 1 2 170 1 . . . . . 5.0 1.8 6.5 1 2 171 1 . . . . . 4.0 1.8 5.0 1 2 172 1 . . . . . 4.0 1.8 5.0 1 2 173 1 . . . . . 4.0 1.8 5.0 1 2 174 1 . . . . . 5.0 2.8 6.0 1 2 175 1 . . . . . 4.5 1.8 5.5 1 2 176 1 . . . . . 4.0 1.8 5.0 1 2 177 1 . . . . . 4.5 1.8 5.0 1 2 178 1 . . . . . 4.0 1.8 5.0 1 2 179 1 . . . . . 4.0 1.8 5.0 1 2 180 1 . . . . . 4.5 1.8 5.5 1 2 181 1 . . . . . 5.5 1.8 6.5 1 2 182 1 . . . . . 4.5 1.8 5.5 1 2 183 1 . . . . . 4.0 1.8 5.0 1 2 184 1 . . . . . 5.0 1.8 5.5 1 2 185 1 . . . . . 5.0 1.8 6.0 1 2 186 1 . . . . . 5.0 1.8 6.0 1 2 187 1 . . . . . 5.5 1.8 6.0 1 2 188 1 . . . . . 5.5 1.8 6.5 1 2 189 1 . . . . . 4.5 1.8 5.0 1 2 190 1 . . . . . 4.5 1.8 6.0 1 2 191 1 . . . . . 5.0 1.8 6.5 1 2 192 1 . . . . . 4.0 1.8 5.0 1 2 193 1 . . . . . 4.0 1.8 5.0 1 2 194 1 . . . . . 5.0 2.3 6.0 1 2 195 1 . . . . . 5.5 1.8 6.5 1 2 196 1 . . . . . 4.5 1.8 5.5 1 2 197 1 . . . . . 5.0 1.8 6.0 1 2 198 1 . . . . . 4.5 1.8 5.5 1 2 199 1 . . . . . 4.5 1.8 5.5 1 2 200 1 . . . . . 5.5 1.8 6.5 1 2 201 1 . . . . . 5.5 1.8 6.5 1 2 202 1 . . . . . 4.5 1.8 6.0 1 2 203 1 . . . . . 4.0 1.8 4.5 1 2 204 1 . . . . . 4.0 1.8 4.5 1 2 205 1 . . . . . 4.0 1.8 5.0 1 2 206 1 . . . . . 4.0 1.8 4.5 1 2 207 1 . . . . . 4.0 1.8 5.5 1 2 208 1 . . . . . 4.5 1.8 6.0 1 2 209 1 . . . . . 4.0 3.3 5.5 1 2 210 1 . . . . . 4.0 1.8 5.0 1 2 211 1 . . . . . 4.5 1.8 5.5 1 2 212 1 . . . . . 4.0 1.8 5.0 1 2 213 1 . . . . . 5.5 1.8 6.0 1 2 214 1 . . . . . 4.5 2.8 5.5 1 2 215 1 . . . . . 4.0 1.8 5.0 1 2 216 1 . . . . . 4.0 1.8 4.5 1 2 217 1 . . . . . 4.0 2.8 5.0 1 2 218 1 . . . . . 4.0 1.8 4.5 1 2 219 1 . . . . . 4.5 1.8 6.0 1 2 220 1 . . . . . 4.5 1.8 5.0 1 2 221 1 . . . . . 4.0 1.8 4.5 1 2 222 1 . . . . . 4.0 2.3 5.0 1 2 223 1 . . . . . 4.0 1.8 5.0 1 2 224 1 . . . . . 4.5 1.8 5.5 1 2 225 1 . . . . . 4.5 1.8 5.5 1 2 226 1 . . . . . 5.0 1.8 6.0 1 2 227 1 . . . . . 3.5 1.8 5.0 1 2 228 1 . . . . . 4.0 1.8 5.5 1 2 229 1 . . . . . 3.5 1.3 4.5 1 2 230 1 . . . . . 4.0 1.8 4.5 1 2 231 1 . . . . . 4.0 1.8 5.0 1 2 232 1 . . . . . 4.0 1.8 5.0 1 2 233 1 . . . . . 4.5 1.8 5.5 1 2 234 1 . . . . . 4.5 1.8 5.0 1 2 235 1 . . . . . 4.5 1.8 5.5 1 2 236 1 . . . . . 4.5 1.8 5.5 1 2 237 1 . . . . . 4.5 1.8 5.0 1 2 238 1 . . . . . 5.0 1.8 6.0 1 2 239 1 . . . . . 4.5 1.8 5.0 1 2 240 1 . . . . . 5.0 1.8 7.0 1 2 241 1 . . . . . 5.0 1.8 7.0 1 2 242 1 . . . . . 5.0 1.8 7.0 1 2 243 1 . . . . . 5.0 1.8 7.0 1 2 244 1 . . . . . 4.5 1.8 6.5 1 2 245 1 . . . . . 5.0 1.8 7.0 1 2 246 1 . . . . . 3.5 1.8 4.5 1 2 247 1 . . . . . 4.5 1.8 5.5 1 2 248 1 . . . . . 4.5 1.8 5.0 1 2 249 1 . . . . . 4.5 1.8 5.0 1 2 250 1 . . . . . 4.5 1.8 5.0 1 2 251 1 . . . . . 4.5 1.8 5.0 1 2 252 1 . . . . . 4.5 1.8 5.0 1 2 253 1 . . . . . 4.0 1.8 5.0 1 2 254 1 . . . . . 4.5 1.8 5.5 1 2 255 1 . . . . . 4.5 1.8 5.0 1 2 256 1 . . . . . 4.0 1.8 4.5 1 2 257 1 . . . . . 4.5 1.8 5.5 1 2 258 1 . . . . . 4.5 1.8 5.5 1 2 259 1 . . . . . 4.5 1.8 5.5 1 2 260 1 . . . . . 4.5 1.8 5.5 1 2 261 1 . . . . . 4.5 1.8 5.0 1 2 262 1 . . . . . 4.5 1.8 5.0 1 2 263 1 . . . . . 4.5 1.8 5.5 1 2 264 1 . . . . . 5.0 1.8 6.0 1 2 265 1 . . . . . 4.5 1.8 6.0 1 2 266 1 . . . . . 4.0 1.8 5.5 1 2 267 1 . . . . . 4.5 1.8 5.0 1 2 268 1 . . . . . 4.5 1.8 5.0 1 2 269 1 . . . . . 5.0 1.8 6.0 1 2 270 1 . . . . . 5.5 1.8 6.5 1 2 271 1 . . . . . 5.5 1.8 6.5 1 2 272 1 . . . . . 4.5 1.8 5.0 1 2 273 1 . . . . . 4.0 1.8 6.0 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 25 1 . . . 1 3 26 1 . . . 1 3 27 1 . . . 1 3 28 1 . . . 1 3 29 1 . . . 1 3 30 1 . . . 1 3 31 1 . . . 1 3 32 1 . . . 1 3 33 1 . . . 1 3 34 1 . . . 1 3 35 1 . . . 1 3 36 1 . . . 1 3 37 1 . . . 1 3 38 1 . . . 1 3 39 1 . . . 1 3 40 1 . . . 1 3 41 1 . . . 1 3 42 1 . . . 1 3 43 1 . . . 1 3 44 1 . . . 1 3 45 1 . . . 1 3 46 1 . . . 1 3 47 1 . . . 1 3 48 1 . . . 1 3 49 1 . . . 1 3 50 1 . . . 1 3 51 1 . . . 1 3 52 1 . . . 1 3 53 1 . . . 1 3 54 1 . . . 1 3 55 1 . . . 1 3 56 1 . . . 1 3 57 1 . . . 1 3 58 1 . . . 1 3 59 1 . . . 1 3 60 1 . . . 1 3 61 1 . . . 1 3 62 1 . . . 1 3 63 1 . . . 1 3 64 1 . . . 1 3 65 1 . . . 1 3 66 1 . . . 1 3 67 1 . . . 1 3 68 1 . . . 1 3 69 1 . . . 1 3 70 1 . . . 1 3 71 1 . . . 1 3 72 1 . . . 1 3 73 1 . . . 1 3 74 1 . . . 1 3 75 1 . . . 1 3 76 1 . . . 1 3 77 1 . . . 1 3 78 1 . . . 1 3 79 1 . . . 1 3 80 1 . . . 1 3 81 1 . . . 1 3 82 1 . . . 1 3 83 1 . . . 1 3 84 1 . . . 1 3 85 1 . . . 1 3 86 1 . . . 1 3 87 1 . . . 1 3 88 1 . . . 1 3 89 1 . . . 1 3 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 2 2 4 GLY QA B 4 . HA# 1 3 1 1 2 2 2 5 THR H B 5 . HN 1 3 2 1 1 2 2 4 GLY H B 4 . HN 1 3 2 1 2 2 2 5 THR H B 5 . HN 1 3 3 1 1 2 2 5 THR H B 5 . HN 1 3 3 1 2 2 2 5 THR HB B 5 . HB 1 3 4 1 1 2 2 5 THR H B 5 . HN 1 3 4 1 2 2 2 5 THR HG1 B 5 . HG# 1 3 4 1 2 2 2 5 THR MG B 5 . HG# 1 3 5 1 1 2 2 5 THR H B 5 . HN 1 3 5 1 2 2 2 6 ALA H B 6 . HN 1 3 6 1 1 2 2 5 THR HA B 5 . HA 1 3 6 1 2 2 2 6 ALA H B 6 . HN 1 3 7 1 1 2 2 5 THR HB B 5 . HB 1 3 7 1 2 2 2 6 ALA H B 6 . HN 1 3 8 1 1 2 2 5 THR HG1 B 5 . HG# 1 3 8 1 1 2 2 5 THR MG B 5 . HG# 1 3 8 1 2 2 2 6 ALA H B 6 . HN 1 3 9 1 1 2 2 6 ALA HA B 6 . HA 1 3 9 1 2 2 2 7 ARG H B 7 . HN 1 3 10 1 1 2 2 6 ALA MB B 6 . HB# 1 3 10 1 2 2 2 7 ARG H B 7 . HN 1 3 11 1 1 2 2 6 ALA H B 6 . HN 1 3 11 1 2 2 2 7 ARG H B 7 . HN 1 3 12 1 1 2 2 7 ARG H B 7 . HN 1 3 12 1 2 2 2 7 ARG QG B 7 . HG# 1 3 13 1 1 2 2 7 ARG H B 7 . HN 1 3 13 1 2 2 2 7 ARG QD B 7 . HD# 1 3 14 1 1 2 2 7 ARG HA B 7 . HA 1 3 14 1 2 2 2 8 ARG H B 8 . HN 1 3 15 1 1 2 2 7 ARG QB B 7 . HB# 1 3 15 1 2 2 2 8 ARG H B 8 . HN 1 3 16 1 1 2 2 7 ARG H B 7 . HN 1 3 16 1 2 2 2 8 ARG H B 8 . HN 1 3 17 1 1 2 2 7 ARG QD B 7 . HD# 1 3 17 1 2 2 2 8 ARG H B 8 . HN 1 3 18 1 1 2 2 7 ARG QG B 7 . HG# 1 3 18 1 2 2 2 8 ARG H B 8 . HN 1 3 19 1 1 2 2 8 ARG H B 8 . HN 1 3 19 1 2 2 2 8 ARG QG B 8 . HG# 1 3 20 1 1 2 2 8 ARG H B 8 . HN 1 3 20 1 2 2 2 8 ARG QD B 8 . HD# 1 3 21 1 1 2 2 8 ARG HA B 8 . HA 1 3 21 1 2 2 2 9 LYS H B 9 . HN 1 3 22 1 1 2 2 8 ARG QB B 8 . HB# 1 3 22 1 2 2 2 9 LYS H B 9 . HN 1 3 23 1 1 2 2 8 ARG H B 8 . HN 1 3 23 1 2 2 2 9 LYS H B 9 . HN 1 3 24 1 1 2 2 8 ARG QD B 8 . HD# 1 3 24 1 2 2 2 9 LYS H B 9 . HN 1 3 25 1 1 2 2 8 ARG QG B 8 . HG# 1 3 25 1 2 2 2 9 LYS H B 9 . HN 1 3 26 1 1 2 2 9 LYS H B 9 . HN 1 3 26 1 2 2 2 9 LYS HA B 9 . HA 1 3 27 1 1 2 2 9 LYS H B 9 . HN 1 3 27 1 2 2 2 9 LYS QB B 9 . HB# 1 3 28 1 1 2 2 9 LYS H B 9 . HN 1 3 28 1 2 2 2 9 LYS QG B 9 . HG# 1 3 29 1 1 2 2 9 LYS H B 9 . HN 1 3 29 1 2 2 2 9 LYS QD B 9 . HD# 1 3 30 1 1 2 2 9 LYS HA B 9 . HA 1 3 30 1 2 2 2 10 ARG H B 10 . HN 1 3 31 1 1 2 2 9 LYS QB B 9 . HB# 1 3 31 1 2 2 2 10 ARG H B 10 . HN 1 3 32 1 1 2 2 9 LYS H B 9 . HN 1 3 32 1 2 2 2 10 ARG H B 10 . HN 1 3 33 1 1 2 2 9 LYS QG B 9 . HG# 1 3 33 1 2 2 2 10 ARG H B 10 . HN 1 3 34 1 1 2 2 9 LYS QD B 9 . HD# 1 3 34 1 2 2 2 10 ARG H B 10 . HN 1 3 35 1 1 2 2 10 ARG H B 10 . HN 1 3 35 1 2 2 2 10 ARG QG B 10 . HG# 1 3 36 1 1 2 2 10 ARG H B 10 . HN 1 3 36 1 2 2 2 10 ARG QD B 10 . HD# 1 3 37 1 1 2 2 10 ARG HA B 10 . HA 1 3 37 1 2 2 2 11 LYS H B 11 . HN 1 3 38 1 1 2 2 10 ARG QB B 10 . HB# 1 3 38 1 2 2 2 11 LYS H B 11 . HN 1 3 39 1 1 2 2 10 ARG H B 10 . HN 1 3 39 1 2 2 2 11 LYS H B 11 . HN 1 3 40 1 1 2 2 10 ARG QD B 10 . HD# 1 3 40 1 2 2 2 11 LYS H B 11 . HN 1 3 41 1 1 2 2 10 ARG QG B 10 . HG# 1 3 41 1 2 2 2 11 LYS H B 11 . HN 1 3 42 1 1 2 2 11 LYS H B 11 . HN 1 3 42 1 2 2 2 11 LYS QG B 11 . HG# 1 3 43 1 1 2 2 11 LYS H B 11 . HN 1 3 43 1 2 2 2 11 LYS QD B 11 . HD# 1 3 44 1 1 2 2 11 LYS HA B 11 . HA 1 3 44 1 2 2 2 12 ALA H B 12 . HN 1 3 45 1 1 2 2 11 LYS QB B 11 . HB# 1 3 45 1 2 2 2 12 ALA H B 12 . HN 1 3 46 1 1 2 2 11 LYS H B 11 . HN 1 3 46 1 2 2 2 12 ALA H B 12 . HN 1 3 47 1 1 2 2 11 LYS QG B 11 . HG# 1 3 47 1 2 2 2 12 ALA H B 12 . HN 1 3 48 1 1 2 2 11 LYS QD B 11 . HD# 1 3 48 1 2 2 2 12 ALA H B 12 . HN 1 3 49 1 1 2 2 11 LYS QB B 11 . HB# 1 3 49 1 2 2 2 13 ASP H B 13 . HN 1 3 50 1 1 2 2 12 ALA HA B 12 . HA 1 3 50 1 2 2 2 13 ASP H B 13 . HN 1 3 51 1 1 2 2 12 ALA H B 12 . HN 1 3 51 1 2 2 2 13 ASP H B 13 . HN 1 3 52 1 1 2 2 12 ALA MB B 12 . HB# 1 3 52 1 2 2 2 14 SER H B 14 . HN 1 3 53 1 1 2 2 13 ASP HA B 13 . HA 1 3 53 1 2 2 2 14 SER H B 14 . HN 1 3 54 1 1 2 2 13 ASP QB B 13 . HB# 1 3 54 1 2 2 2 14 SER H B 14 . HN 1 3 55 1 1 2 2 13 ASP H B 13 . HN 1 3 55 1 2 2 2 14 SER H B 14 . HN 1 3 56 1 1 1 1 6 GLU H A 6 . HN 1 3 56 1 2 2 2 8 ARG QG B 8 . HG# 1 3 57 1 1 1 1 6 GLU H A 6 . HN 1 3 57 1 2 2 2 8 ARG H B 8 . HN 1 3 58 1 1 1 1 8 ALA MB A 8 . HB# 1 3 58 1 2 2 2 8 ARG HA B 8 . HA 1 3 59 1 1 1 1 8 ALA MB A 8 . HB# 1 3 59 1 2 2 2 8 ARG HE B 8 . HE 1 3 60 1 1 1 1 8 ALA MB A 8 . HB# 1 3 60 1 2 2 2 8 ARG QB B 8 . HB# 1 3 61 1 1 1 1 8 ALA MB A 8 . HB# 1 3 61 1 2 2 2 8 ARG QG B 8 . HG# 1 3 62 1 1 1 1 8 ALA H A 8 . HN 1 3 62 1 2 2 2 8 ARG QB B 8 . HB# 1 3 63 1 1 1 1 8 ALA H A 8 . HN 1 3 63 1 2 2 2 8 ARG H B 8 . HN 1 3 64 1 1 1 1 9 GLU H A 9 . HN 1 3 64 1 2 2 2 8 ARG QB B 8 . HB# 1 3 65 1 1 1 1 9 GLU H A 9 . HN 1 3 65 1 2 2 2 8 ARG QD B 8 . HD# 1 3 66 1 1 1 1 9 GLU HA A 9 . HA 1 3 66 1 2 2 2 5 THR HA B 5 . HA 1 3 67 1 1 1 1 10 VAL QG A 10 . HG# 1 3 67 1 2 2 2 5 THR HA B 5 . HA 1 3 68 1 1 1 1 10 VAL QG A 10 . HG# 1 3 68 1 2 2 2 5 THR HB B 5 . HB# 1 3 69 1 1 1 1 10 VAL H A 10 . HN 1 3 69 1 2 2 2 5 THR HA B 5 . HA 1 3 70 1 1 1 1 10 VAL QG A 10 . HG# 1 3 70 1 2 2 2 7 ARG QB B 7 . HB# 1 3 71 1 1 1 1 26 LEU QD A 26 . HD# 1 3 71 1 2 2 2 5 THR H B 5 . HN 1 3 72 1 1 1 1 26 LEU QD A 26 . HD# 1 3 72 1 2 2 2 6 ALA H B 6 . HN 1 3 73 1 1 1 1 38 VAL QG A 38 . HG# 1 3 73 1 2 2 2 8 ARG QB B 8 . HB# 1 3 74 1 1 1 1 38 VAL QG A 38 . HG# 1 3 74 1 2 2 2 8 ARG QG B 8 . HG# 1 3 75 1 1 1 1 22 ASP H A 22 . HN 1 3 75 1 2 2 2 13 ASP QB B 13 . HB# 1 3 76 1 1 1 1 42 HIS QB A 42 . HB# 1 3 76 1 2 2 2 9 LYS QB B 9 . HB# 1 3 77 1 1 1 1 44 ALA MB A 44 . HB# 1 3 77 1 2 2 2 14 SER QB B 14 . HB# 1 3 78 1 1 1 1 44 ALA MB A 44 . HB# 1 3 78 1 2 2 2 14 SER HA B 14 . HA 1 3 79 1 1 1 1 44 ALA MB A 44 . HB# 1 3 79 1 2 2 2 10 ARG HE B 10 . HE 1 3 80 1 1 1 1 44 ALA MB A 44 . HB# 1 3 80 1 2 2 2 10 ARG QB B 10 . HB# 1 3 81 1 1 1 1 44 ALA MB A 44 . HB# 1 3 81 1 2 2 2 10 ARG QG B 10 . HG# 1 3 82 1 1 1 1 44 ALA MB A 44 . HB# 1 3 82 1 2 2 2 10 ARG QD B 10 . HD# 1 3 83 1 1 1 1 44 ALA MB A 44 . HB# 1 3 83 1 2 2 2 11 LYS QB B 11 . HB# 1 3 84 1 1 1 1 44 ALA MB A 44 . HB# 1 3 84 1 2 2 2 11 LYS QG B 11 . HG# 1 3 85 1 1 1 1 44 ALA MB A 44 . HB# 1 3 85 1 2 2 2 11 LYS HA B 11 . HA 1 3 86 1 1 1 1 44 ALA H A 44 . HN 1 3 86 1 2 2 2 11 LYS HA B 11 . HA 1 3 87 1 1 1 1 44 ALA H A 44 . HN 1 3 87 1 2 2 2 11 LYS QB B 11 . HB# 1 3 88 1 1 1 1 47 VAL QG A 47 . HG# 1 3 88 1 2 2 2 14 SER QB B 14 . HB# 1 3 89 1 1 1 1 47 VAL QG A 47 . HG# 1 3 89 1 2 2 2 14 SER HA B 14 . HA 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.5 2.0 5.5 1 3 2 1 . . . . . 5.5 1.8 6.0 1 3 3 1 . . . . . 4.0 1.8 4.5 1 3 4 1 . . . . . 4.0 1.8 5.5 1 3 5 1 . . . . . 4.5 1.8 5.0 1 3 6 1 . . . . . 4.5 1.8 5.0 1 3 7 1 . . . . . 4.5 1.8 5.0 1 3 8 1 . . . . . 4.5 1.8 6.0 1 3 9 1 . . . . . 3.5 1.8 4.0 1 3 10 1 . . . . . 4.5 1.8 5.5 1 3 11 1 . . . . . 4.5 1.8 5.0 1 3 12 1 . . . . . 4.0 1.8 5.0 1 3 13 1 . . . . . 4.0 1.8 5.0 1 3 14 1 . . . . . 4.5 1.8 5.0 1 3 15 1 . . . . . 4.5 1.8 5.5 1 3 16 1 . . . . . 4.5 1.8 5.0 1 3 17 1 . . . . . 4.5 1.8 5.5 1 3 18 1 . . . . . 5.0 1.8 6.0 1 3 19 1 . . . . . 4.0 1.8 5.0 1 3 20 1 . . . . . 4.0 1.8 5.0 1 3 21 1 . . . . . 5.0 1.8 5.5 1 3 22 1 . . . . . 4.5 1.8 5.5 1 3 23 1 . . . . . 4.0 1.8 4.5 1 3 24 1 . . . . . 4.5 1.8 5.5 1 3 25 1 . . . . . 4.0 1.8 5.0 1 3 26 1 . . . . . 4.5 2.8 5.0 1 3 27 1 . . . . . 4.5 2.8 5.5 1 3 28 1 . . . . . 4.5 2.8 5.5 1 3 29 1 . . . . . 4.5 2.8 5.5 1 3 30 1 . . . . . 4.5 2.8 5.0 1 3 31 1 . . . . . 4.0 1.8 5.0 1 3 32 1 . . . . . 4.5 2.8 5.0 1 3 33 1 . . . . . 4.5 2.8 5.5 1 3 34 1 . . . . . 4.5 2.8 5.5 1 3 35 1 . . . . . 4.0 1.8 5.0 1 3 36 1 . . . . . 4.0 1.8 5.0 1 3 37 1 . . . . . 4.0 2.8 4.5 1 3 38 1 . . . . . 4.5 2.8 5.5 1 3 39 1 . . . . . 4.0 1.8 4.5 1 3 40 1 . . . . . 4.5 2.8 5.5 1 3 41 1 . . . . . 4.0 1.8 5.0 1 3 42 1 . . . . . 4.5 1.8 5.5 1 3 43 1 . . . . . 4.5 1.8 5.5 1 3 44 1 . . . . . 3.5 1.8 4.0 1 3 45 1 . . . . . 4.0 1.8 5.0 1 3 46 1 . . . . . 4.5 1.8 5.0 1 3 47 1 . . . . . 4.5 1.8 5.5 1 3 48 1 . . . . . 4.5 1.8 5.5 1 3 49 1 . . . . . 4.0 1.8 5.0 1 3 50 1 . . . . . 4.5 1.8 5.0 1 3 51 1 . . . . . 4.5 1.8 5.0 1 3 52 1 . . . . . 4.5 1.8 6.0 1 3 53 1 . . . . . 4.5 1.8 5.0 1 3 54 1 . . . . . 4.5 1.8 5.5 1 3 55 1 . . . . . 4.5 1.8 5.0 1 3 56 1 . . . . . 6.5 1.8 7.0 1 3 57 1 . . . . . 6.5 1.8 7.0 1 3 58 1 . . . . . 6.0 1.8 7.5 1 3 59 1 . . . . . 5.5 1.8 7.0 1 3 60 1 . . . . . 5.0 1.8 6.5 1 3 61 1 . . . . . 5.0 1.8 6.5 1 3 62 1 . . . . . 6.5 1.8 7.0 1 3 63 1 . . . . . 6.5 1.8 7.0 1 3 64 1 . . . . . 5.5 1.8 6.5 1 3 65 1 . . . . . 5.5 1.8 6.5 1 3 66 1 . . . . . 4.0 2.8 4.5 1 3 67 1 . . . . . 6.0 1.8 7.5 1 3 68 1 . . . . . 5.5 1.8 7.0 1 3 69 1 . . . . . 5.0 1.8 5.5 1 3 70 1 . . . . . 6.0 1.8 7.5 1 3 71 1 . . . . . 5.0 1.8 6.5 1 3 72 1 . . . . . 6.0 1.8 7.5 1 3 73 1 . . . . . 6.0 1.8 7.5 1 3 74 1 . . . . . 6.0 1.8 7.5 1 3 75 1 . . . . . 5.0 1.8 6.0 1 3 76 1 . . . . . 6.0 1.8 7.0 1 3 77 1 . . . . . 5.0 1.8 6.5 1 3 78 1 . . . . . 5.0 1.8 6.5 1 3 79 1 . . . . . 6.0 1.8 7.5 1 3 80 1 . . . . . 6.0 1.8 7.5 1 3 81 1 . . . . . 6.0 1.8 7.5 1 3 82 1 . . . . . 6.0 1.8 7.5 1 3 83 1 . . . . . 6.0 1.8 7.5 1 3 84 1 . . . . . 6.5 1.8 8.0 1 3 85 1 . . . . . 6.0 1.8 7.5 1 3 86 1 . . . . . 6.5 2.3 7.0 1 3 87 1 . . . . . 6.5 1.8 7.0 1 3 88 1 . . . . . 6.0 1.8 7.5 1 3 89 1 . . . . . 6.0 1.8 7.5 1 3 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 11.377 4.840 -5.526 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 10.894 3.577 -6.217 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 9.121 2.585 -6.701 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 8.932 4.250 -6.472 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 9.137 3.231 -5.138 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 11.378 2.725 -5.763 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 11.175 3.623 -7.259 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 9.418 3.399 -6.125 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 12.348 5.458 -5.963 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 SER C C 10.100 6.665 -2.544 1.00 . A A . 2 SER C 1 1 1 11 1 1 2 SER CA C 11.071 6.419 -3.691 1.00 . A A . 2 SER CA 1 1 1 12 1 1 2 SER CB C 11.109 7.637 -4.610 1.00 . A A . 2 SER CB 1 1 1 13 1 1 2 SER H H 9.948 4.676 -4.136 1.00 . A A . 2 SER H 1 1 1 14 1 1 2 SER HA H 12.056 6.263 -3.277 1.00 . A A . 2 SER HA 1 1 1 15 1 1 2 SER HB2 H 11.355 8.512 -4.028 1.00 . A A . 2 SER HB2 1 1 1 16 1 1 2 SER HB3 H 11.861 7.487 -5.369 1.00 . A A . 2 SER HB3 1 1 1 17 1 1 2 SER HG H 9.961 8.467 -5.964 1.00 . A A . 2 SER HG 1 1 1 18 1 1 2 SER N N 10.704 5.219 -4.442 1.00 . A A . 2 SER N 1 1 1 19 1 1 2 SER O O 10.480 7.184 -1.496 1.00 . A A . 2 SER O 1 1 1 20 1 1 2 SER OG O 9.856 7.845 -5.239 1.00 . A A . 2 SER OG 1 1 1 21 1 1 3 GLN C C 7.810 5.236 -0.813 1.00 . A A . 3 GLN C 1 1 1 22 1 1 3 GLN CA C 7.824 6.451 -1.732 1.00 . A A . 3 GLN CA 1 1 1 23 1 1 3 GLN CB C 6.461 6.644 -2.399 1.00 . A A . 3 GLN CB 1 1 1 24 1 1 3 GLN CD C 6.495 4.888 -4.223 1.00 . A A . 3 GLN CD 1 1 1 25 1 1 3 GLN CG C 5.838 5.362 -2.941 1.00 . A A . 3 GLN CG 1 1 1 26 1 1 3 GLN H H 8.589 5.920 -3.615 1.00 . A A . 3 GLN H 1 1 1 27 1 1 3 GLN HA H 8.067 7.328 -1.152 1.00 . A A . 3 GLN HA 1 1 1 28 1 1 3 GLN HB2 H 5.778 7.080 -1.687 1.00 . A A . 3 GLN HB2 1 1 1 29 1 1 3 GLN HB3 H 6.590 7.323 -3.227 1.00 . A A . 3 GLN HB3 1 1 1 30 1 1 3 GLN HE21 H 6.245 2.994 -3.682 1.00 . A A . 3 GLN HE21 1 1 1 31 1 1 3 GLN HE22 H 7.012 3.242 -5.209 1.00 . A A . 3 GLN HE22 1 1 1 32 1 1 3 GLN HG2 H 5.934 4.585 -2.197 1.00 . A A . 3 GLN HG2 1 1 1 33 1 1 3 GLN HG3 H 4.791 5.542 -3.136 1.00 . A A . 3 GLN HG3 1 1 1 34 1 1 3 GLN N N 8.843 6.287 -2.749 1.00 . A A . 3 GLN N 1 1 1 35 1 1 3 GLN NE2 N 6.594 3.575 -4.388 1.00 . A A . 3 GLN NE2 1 1 1 36 1 1 3 GLN O O 7.892 4.097 -1.274 1.00 . A A . 3 GLN O 1 1 1 37 1 1 3 GLN OE1 O 6.922 5.694 -5.050 1.00 . A A . 3 GLN OE1 1 1 1 38 1 1 4 VAL C C 6.304 3.913 1.748 1.00 . A A . 4 VAL C 1 1 1 39 1 1 4 VAL CA C 7.712 4.402 1.457 1.00 . A A . 4 VAL CA 1 1 1 40 1 1 4 VAL CB C 8.374 4.824 2.784 1.00 . A A . 4 VAL CB 1 1 1 41 1 1 4 VAL CG1 C 8.892 3.604 3.529 1.00 . A A . 4 VAL CG1 1 1 1 42 1 1 4 VAL CG2 C 9.494 5.827 2.543 1.00 . A A . 4 VAL CG2 1 1 1 43 1 1 4 VAL H H 7.611 6.404 0.794 1.00 . A A . 4 VAL H 1 1 1 44 1 1 4 VAL HA H 8.284 3.586 1.041 1.00 . A A . 4 VAL HA 1 1 1 45 1 1 4 VAL HB H 7.624 5.297 3.398 1.00 . A A . 4 VAL HB 1 1 1 46 1 1 4 VAL HG11 H 8.095 2.886 3.641 1.00 . A A . 4 VAL HG11 1 1 1 47 1 1 4 VAL HG12 H 9.249 3.903 4.504 1.00 . A A . 4 VAL HG12 1 1 1 48 1 1 4 VAL HG13 H 9.702 3.159 2.970 1.00 . A A . 4 VAL HG13 1 1 1 49 1 1 4 VAL HG21 H 10.029 5.997 3.466 1.00 . A A . 4 VAL HG21 1 1 1 50 1 1 4 VAL HG22 H 9.075 6.759 2.193 1.00 . A A . 4 VAL HG22 1 1 1 51 1 1 4 VAL HG23 H 10.173 5.437 1.800 1.00 . A A . 4 VAL HG23 1 1 1 52 1 1 4 VAL N N 7.706 5.481 0.485 1.00 . A A . 4 VAL N 1 1 1 53 1 1 4 VAL O O 5.918 3.763 2.907 1.00 . A A . 4 VAL O 1 1 1 54 1 1 5 PHE C C 3.400 3.155 -0.470 1.00 . A A . 5 PHE C 1 1 1 55 1 1 5 PHE CA C 4.166 3.164 0.855 1.00 . A A . 5 PHE CA 1 1 1 56 1 1 5 PHE CB C 3.414 4.021 1.867 1.00 . A A . 5 PHE CB 1 1 1 57 1 1 5 PHE CD1 C 3.195 6.222 0.679 1.00 . A A . 5 PHE CD1 1 1 1 58 1 1 5 PHE CD2 C 4.471 6.142 2.692 1.00 . A A . 5 PHE CD2 1 1 1 59 1 1 5 PHE CE1 C 3.456 7.574 0.564 1.00 . A A . 5 PHE CE1 1 1 1 60 1 1 5 PHE CE2 C 4.736 7.493 2.582 1.00 . A A . 5 PHE CE2 1 1 1 61 1 1 5 PHE CG C 3.698 5.491 1.744 1.00 . A A . 5 PHE CG 1 1 1 62 1 1 5 PHE CZ C 4.229 8.210 1.517 1.00 . A A . 5 PHE CZ 1 1 1 63 1 1 5 PHE H H 5.884 3.809 -0.211 1.00 . A A . 5 PHE H 1 1 1 64 1 1 5 PHE HA H 4.226 2.148 1.237 1.00 . A A . 5 PHE HA 1 1 1 65 1 1 5 PHE HB2 H 2.361 3.877 1.728 1.00 . A A . 5 PHE HB2 1 1 1 66 1 1 5 PHE HB3 H 3.688 3.712 2.860 1.00 . A A . 5 PHE HB3 1 1 1 67 1 1 5 PHE HD1 H 2.591 5.726 -0.065 1.00 . A A . 5 PHE HD1 1 1 1 68 1 1 5 PHE HD2 H 4.869 5.581 3.526 1.00 . A A . 5 PHE HD2 1 1 1 69 1 1 5 PHE HE1 H 3.056 8.133 -0.270 1.00 . A A . 5 PHE HE1 1 1 1 70 1 1 5 PHE HE2 H 5.341 7.988 3.329 1.00 . A A . 5 PHE HE2 1 1 1 71 1 1 5 PHE HZ H 4.435 9.266 1.429 1.00 . A A . 5 PHE HZ 1 1 1 72 1 1 5 PHE N N 5.530 3.660 0.692 1.00 . A A . 5 PHE N 1 1 1 73 1 1 5 PHE O O 3.703 3.925 -1.382 1.00 . A A . 5 PHE O 1 1 1 74 1 1 6 GLU C C 0.091 2.064 -1.408 1.00 . A A . 6 GLU C 1 1 1 75 1 1 6 GLU CA C 1.573 2.160 -1.761 1.00 . A A . 6 GLU CA 1 1 1 76 1 1 6 GLU CB C 1.976 0.937 -2.579 1.00 . A A . 6 GLU CB 1 1 1 77 1 1 6 GLU CD C 3.983 2.194 -3.427 1.00 . A A . 6 GLU CD 1 1 1 78 1 1 6 GLU CG C 2.832 1.277 -3.782 1.00 . A A . 6 GLU CG 1 1 1 79 1 1 6 GLU H H 2.237 1.670 0.189 1.00 . A A . 6 GLU H 1 1 1 80 1 1 6 GLU HA H 1.731 3.047 -2.357 1.00 . A A . 6 GLU HA 1 1 1 81 1 1 6 GLU HB2 H 2.528 0.260 -1.946 1.00 . A A . 6 GLU HB2 1 1 1 82 1 1 6 GLU HB3 H 1.083 0.441 -2.928 1.00 . A A . 6 GLU HB3 1 1 1 83 1 1 6 GLU HG2 H 3.230 0.363 -4.197 1.00 . A A . 6 GLU HG2 1 1 1 84 1 1 6 GLU HG3 H 2.212 1.768 -4.518 1.00 . A A . 6 GLU HG3 1 1 1 85 1 1 6 GLU N N 2.405 2.272 -0.563 1.00 . A A . 6 GLU N 1 1 1 86 1 1 6 GLU O O -0.287 1.423 -0.431 1.00 . A A . 6 GLU O 1 1 1 87 1 1 6 GLU OE1 O 4.821 1.797 -2.590 1.00 . A A . 6 GLU OE1 1 1 1 88 1 1 6 GLU OE2 O 4.046 3.310 -3.982 1.00 . A A . 6 GLU OE2 1 1 1 89 1 1 7 TYR C C -2.835 1.520 -2.723 1.00 . A A . 7 TYR C 1 1 1 90 1 1 7 TYR CA C -2.179 2.689 -2.013 1.00 . A A . 7 TYR CA 1 1 1 91 1 1 7 TYR CB C -2.771 3.997 -2.514 1.00 . A A . 7 TYR CB 1 1 1 92 1 1 7 TYR CD1 C -3.088 3.763 -5.014 1.00 . A A . 7 TYR CD1 1 1 1 93 1 1 7 TYR CD2 C -1.365 5.207 -4.228 1.00 . A A . 7 TYR CD2 1 1 1 94 1 1 7 TYR CE1 C -2.751 4.065 -6.320 1.00 . A A . 7 TYR CE1 1 1 1 95 1 1 7 TYR CE2 C -1.021 5.515 -5.529 1.00 . A A . 7 TYR CE2 1 1 1 96 1 1 7 TYR CG C -2.404 4.327 -3.947 1.00 . A A . 7 TYR CG 1 1 1 97 1 1 7 TYR CZ C -1.717 4.942 -6.573 1.00 . A A . 7 TYR CZ 1 1 1 98 1 1 7 TYR H H -0.386 3.196 -2.983 1.00 . A A . 7 TYR H 1 1 1 99 1 1 7 TYR HA H -2.377 2.597 -0.957 1.00 . A A . 7 TYR HA 1 1 1 100 1 1 7 TYR HB2 H -3.836 3.937 -2.441 1.00 . A A . 7 TYR HB2 1 1 1 101 1 1 7 TYR HB3 H -2.422 4.803 -1.896 1.00 . A A . 7 TYR HB3 1 1 1 102 1 1 7 TYR HD1 H -3.896 3.077 -4.814 1.00 . A A . 7 TYR HD1 1 1 1 103 1 1 7 TYR HD2 H -0.820 5.656 -3.408 1.00 . A A . 7 TYR HD2 1 1 1 104 1 1 7 TYR HE1 H -3.297 3.616 -7.137 1.00 . A A . 7 TYR HE1 1 1 1 105 1 1 7 TYR HE2 H -0.210 6.201 -5.726 1.00 . A A . 7 TYR HE2 1 1 1 106 1 1 7 TYR HH H -0.421 5.285 -7.951 1.00 . A A . 7 TYR HH 1 1 1 107 1 1 7 TYR N N -0.744 2.698 -2.222 1.00 . A A . 7 TYR N 1 1 1 108 1 1 7 TYR O O -2.705 1.359 -3.937 1.00 . A A . 7 TYR O 1 1 1 109 1 1 7 TYR OH O -1.377 5.247 -7.871 1.00 . A A . 7 TYR OH 1 1 1 110 1 1 8 ALA C C -5.727 -0.219 -2.521 1.00 . A A . 8 ALA C 1 1 1 111 1 1 8 ALA CA C -4.223 -0.452 -2.514 1.00 . A A . 8 ALA CA 1 1 1 112 1 1 8 ALA CB C -3.887 -1.709 -1.729 1.00 . A A . 8 ALA CB 1 1 1 113 1 1 8 ALA H H -3.570 0.854 -0.982 1.00 . A A . 8 ALA H 1 1 1 114 1 1 8 ALA HA H -3.882 -0.586 -3.531 1.00 . A A . 8 ALA HA 1 1 1 115 1 1 8 ALA HB1 H -3.871 -2.551 -2.398 1.00 . A A . 8 ALA HB1 1 1 1 116 1 1 8 ALA HB2 H -4.635 -1.868 -0.967 1.00 . A A . 8 ALA HB2 1 1 1 117 1 1 8 ALA HB3 H -2.918 -1.598 -1.264 1.00 . A A . 8 ALA HB3 1 1 1 118 1 1 8 ALA N N -3.530 0.694 -1.954 1.00 . A A . 8 ALA N 1 1 1 119 1 1 8 ALA O O -6.490 -1.035 -2.004 1.00 . A A . 8 ALA O 1 1 1 120 1 1 9 GLU C C -8.167 1.029 -4.515 1.00 . A A . 9 GLU C 1 1 1 121 1 1 9 GLU CA C -7.573 1.216 -3.150 1.00 . A A . 9 GLU CA 1 1 1 122 1 1 9 GLU CB C -7.850 2.630 -2.651 1.00 . A A . 9 GLU CB 1 1 1 123 1 1 9 GLU CD C -6.241 3.695 -4.291 1.00 . A A . 9 GLU CD 1 1 1 124 1 1 9 GLU CG C -7.622 3.730 -3.674 1.00 . A A . 9 GLU CG 1 1 1 125 1 1 9 GLU H H -5.508 1.515 -3.508 1.00 . A A . 9 GLU H 1 1 1 126 1 1 9 GLU HA H -8.069 0.534 -2.502 1.00 . A A . 9 GLU HA 1 1 1 127 1 1 9 GLU HB2 H -8.879 2.680 -2.351 1.00 . A A . 9 GLU HB2 1 1 1 128 1 1 9 GLU HB3 H -7.228 2.818 -1.796 1.00 . A A . 9 GLU HB3 1 1 1 129 1 1 9 GLU HG2 H -8.353 3.622 -4.459 1.00 . A A . 9 GLU HG2 1 1 1 130 1 1 9 GLU HG3 H -7.761 4.683 -3.190 1.00 . A A . 9 GLU HG3 1 1 1 131 1 1 9 GLU N N -6.154 0.899 -3.105 1.00 . A A . 9 GLU N 1 1 1 132 1 1 9 GLU O O -7.482 0.698 -5.484 1.00 . A A . 9 GLU O 1 1 1 133 1 1 9 GLU OE1 O -6.020 2.865 -5.198 1.00 . A A . 9 GLU OE1 1 1 1 134 1 1 9 GLU OE2 O -5.384 4.500 -3.872 1.00 . A A . 9 GLU OE2 1 1 1 135 1 1 10 VAL C C -10.541 2.448 -6.402 1.00 . A A . 10 VAL C 1 1 1 136 1 1 10 VAL CA C -10.197 1.096 -5.788 1.00 . A A . 10 VAL CA 1 1 1 137 1 1 10 VAL CB C -11.444 0.243 -5.557 1.00 . A A . 10 VAL CB 1 1 1 138 1 1 10 VAL CG1 C -12.211 0.029 -6.854 1.00 . A A . 10 VAL CG1 1 1 1 139 1 1 10 VAL CG2 C -11.045 -1.084 -4.923 1.00 . A A . 10 VAL CG2 1 1 1 140 1 1 10 VAL H H -9.941 1.509 -3.753 1.00 . A A . 10 VAL H 1 1 1 141 1 1 10 VAL HA H -9.571 0.577 -6.453 1.00 . A A . 10 VAL HA 1 1 1 142 1 1 10 VAL HB H -12.072 0.760 -4.865 1.00 . A A . 10 VAL HB 1 1 1 143 1 1 10 VAL HG11 H -11.789 -0.810 -7.387 1.00 . A A . 10 VAL HG11 1 1 1 144 1 1 10 VAL HG12 H -12.136 0.915 -7.465 1.00 . A A . 10 VAL HG12 1 1 1 145 1 1 10 VAL HG13 H -13.249 -0.168 -6.633 1.00 . A A . 10 VAL HG13 1 1 1 146 1 1 10 VAL HG21 H -10.913 -0.948 -3.857 1.00 . A A . 10 VAL HG21 1 1 1 147 1 1 10 VAL HG22 H -10.119 -1.425 -5.358 1.00 . A A . 10 VAL HG22 1 1 1 148 1 1 10 VAL HG23 H -11.815 -1.818 -5.100 1.00 . A A . 10 VAL HG23 1 1 1 149 1 1 10 VAL N N -9.465 1.245 -4.569 1.00 . A A . 10 VAL N 1 1 1 150 1 1 10 VAL O O -10.728 2.564 -7.614 1.00 . A A . 10 VAL O 1 1 1 151 1 1 11 ASP C C -10.211 5.869 -5.115 1.00 . A A . 11 ASP C 1 1 1 152 1 1 11 ASP CA C -10.887 4.827 -6.013 1.00 . A A . 11 ASP CA 1 1 1 153 1 1 11 ASP CB C -12.410 5.057 -6.079 1.00 . A A . 11 ASP CB 1 1 1 154 1 1 11 ASP CG C -12.799 6.526 -6.144 1.00 . A A . 11 ASP CG 1 1 1 155 1 1 11 ASP H H -10.426 3.310 -4.611 1.00 . A A . 11 ASP H 1 1 1 156 1 1 11 ASP HA H -10.481 4.927 -7.009 1.00 . A A . 11 ASP HA 1 1 1 157 1 1 11 ASP HB2 H -12.790 4.581 -6.965 1.00 . A A . 11 ASP HB2 1 1 1 158 1 1 11 ASP HB3 H -12.879 4.614 -5.212 1.00 . A A . 11 ASP HB3 1 1 1 159 1 1 11 ASP N N -10.591 3.471 -5.560 1.00 . A A . 11 ASP N 1 1 1 160 1 1 11 ASP O O -9.707 6.880 -5.604 1.00 . A A . 11 ASP O 1 1 1 161 1 1 11 ASP OD1 O -12.664 7.128 -7.230 1.00 . A A . 11 ASP OD1 1 1 1 162 1 1 11 ASP OD2 O -13.239 7.070 -5.109 1.00 . A A . 11 ASP OD2 1 1 1 163 1 1 12 GLU C C -9.091 5.882 -1.600 1.00 . A A . 12 GLU C 1 1 1 164 1 1 12 GLU CA C -9.603 6.571 -2.864 1.00 . A A . 12 GLU CA 1 1 1 165 1 1 12 GLU CB C -10.619 7.650 -2.489 1.00 . A A . 12 GLU CB 1 1 1 166 1 1 12 GLU CD C -11.931 9.681 -3.221 1.00 . A A . 12 GLU CD 1 1 1 167 1 1 12 GLU CG C -10.954 8.596 -3.631 1.00 . A A . 12 GLU CG 1 1 1 168 1 1 12 GLU H H -10.580 4.779 -3.475 1.00 . A A . 12 GLU H 1 1 1 169 1 1 12 GLU HA H -8.768 7.041 -3.362 1.00 . A A . 12 GLU HA 1 1 1 170 1 1 12 GLU HB2 H -11.532 7.171 -2.170 1.00 . A A . 12 GLU HB2 1 1 1 171 1 1 12 GLU HB3 H -10.222 8.232 -1.671 1.00 . A A . 12 GLU HB3 1 1 1 172 1 1 12 GLU HG2 H -10.044 9.064 -3.974 1.00 . A A . 12 GLU HG2 1 1 1 173 1 1 12 GLU HG3 H -11.391 8.025 -4.437 1.00 . A A . 12 GLU HG3 1 1 1 174 1 1 12 GLU N N -10.203 5.623 -3.807 1.00 . A A . 12 GLU N 1 1 1 175 1 1 12 GLU O O -9.473 4.760 -1.302 1.00 . A A . 12 GLU O 1 1 1 176 1 1 12 GLU OE1 O -13.154 9.442 -3.306 1.00 . A A . 12 GLU OE1 1 1 1 177 1 1 12 GLU OE2 O -11.472 10.770 -2.815 1.00 . A A . 12 GLU OE2 1 1 1 178 1 1 13 ILE C C -7.781 7.110 1.483 1.00 . A A . 13 ILE C 1 1 1 179 1 1 13 ILE CA C -7.660 6.055 0.384 1.00 . A A . 13 ILE CA 1 1 1 180 1 1 13 ILE CB C -6.165 5.676 0.216 1.00 . A A . 13 ILE CB 1 1 1 181 1 1 13 ILE CD1 C -5.584 7.463 -1.500 1.00 . A A . 13 ILE CD1 1 1 1 182 1 1 13 ILE CG1 C -5.342 6.928 -0.104 1.00 . A A . 13 ILE CG1 1 1 1 183 1 1 13 ILE CG2 C -6.012 4.655 -0.889 1.00 . A A . 13 ILE CG2 1 1 1 184 1 1 13 ILE H H -7.974 7.477 -1.155 1.00 . A A . 13 ILE H 1 1 1 185 1 1 13 ILE HA H -8.219 5.168 0.663 1.00 . A A . 13 ILE HA 1 1 1 186 1 1 13 ILE HB H -5.799 5.224 1.137 1.00 . A A . 13 ILE HB 1 1 1 187 1 1 13 ILE HD11 H -6.064 8.427 -1.438 1.00 . A A . 13 ILE HD11 1 1 1 188 1 1 13 ILE HD12 H -6.223 6.776 -2.041 1.00 . A A . 13 ILE HD12 1 1 1 189 1 1 13 ILE HD13 H -4.642 7.560 -2.018 1.00 . A A . 13 ILE HD13 1 1 1 190 1 1 13 ILE HG12 H -5.597 7.708 0.597 1.00 . A A . 13 ILE HG12 1 1 1 191 1 1 13 ILE HG13 H -4.292 6.701 -0.013 1.00 . A A . 13 ILE HG13 1 1 1 192 1 1 13 ILE HG21 H -6.891 4.671 -1.508 1.00 . A A . 13 ILE HG21 1 1 1 193 1 1 13 ILE HG22 H -5.885 3.672 -0.461 1.00 . A A . 13 ILE HG22 1 1 1 194 1 1 13 ILE HG23 H -5.150 4.904 -1.485 1.00 . A A . 13 ILE HG23 1 1 1 195 1 1 13 ILE N N -8.229 6.579 -0.862 1.00 . A A . 13 ILE N 1 1 1 196 1 1 13 ILE O O -8.478 8.111 1.312 1.00 . A A . 13 ILE O 1 1 1 197 1 1 14 VAL C C -5.838 7.802 4.507 1.00 . A A . 14 VAL C 1 1 1 198 1 1 14 VAL CA C -7.140 7.846 3.713 1.00 . A A . 14 VAL CA 1 1 1 199 1 1 14 VAL CB C -8.340 7.586 4.657 1.00 . A A . 14 VAL CB 1 1 1 200 1 1 14 VAL CG1 C -8.274 8.483 5.887 1.00 . A A . 14 VAL CG1 1 1 1 201 1 1 14 VAL CG2 C -9.651 7.803 3.919 1.00 . A A . 14 VAL CG2 1 1 1 202 1 1 14 VAL H H -6.577 6.072 2.697 1.00 . A A . 14 VAL H 1 1 1 203 1 1 14 VAL HA H -7.252 8.832 3.291 1.00 . A A . 14 VAL HA 1 1 1 204 1 1 14 VAL HB H -8.300 6.558 4.984 1.00 . A A . 14 VAL HB 1 1 1 205 1 1 14 VAL HG11 H -9.130 8.293 6.518 1.00 . A A . 14 VAL HG11 1 1 1 206 1 1 14 VAL HG12 H -8.277 9.518 5.580 1.00 . A A . 14 VAL HG12 1 1 1 207 1 1 14 VAL HG13 H -7.369 8.273 6.438 1.00 . A A . 14 VAL HG13 1 1 1 208 1 1 14 VAL HG21 H -10.473 7.490 4.545 1.00 . A A . 14 VAL HG21 1 1 1 209 1 1 14 VAL HG22 H -9.652 7.225 3.009 1.00 . A A . 14 VAL HG22 1 1 1 210 1 1 14 VAL HG23 H -9.760 8.851 3.678 1.00 . A A . 14 VAL HG23 1 1 1 211 1 1 14 VAL N N -7.107 6.891 2.607 1.00 . A A . 14 VAL N 1 1 1 212 1 1 14 VAL O O -5.234 8.838 4.784 1.00 . A A . 14 VAL O 1 1 1 213 1 1 15 GLU C C -3.039 6.032 4.695 1.00 . A A . 15 GLU C 1 1 1 214 1 1 15 GLU CA C -4.183 6.419 5.625 1.00 . A A . 15 GLU CA 1 1 1 215 1 1 15 GLU CB C -4.372 5.350 6.701 1.00 . A A . 15 GLU CB 1 1 1 216 1 1 15 GLU CD C -3.375 4.115 8.659 1.00 . A A . 15 GLU CD 1 1 1 217 1 1 15 GLU CG C -3.121 5.081 7.519 1.00 . A A . 15 GLU CG 1 1 1 218 1 1 15 GLU H H -5.945 5.814 4.620 1.00 . A A . 15 GLU H 1 1 1 219 1 1 15 GLU HA H -3.943 7.359 6.101 1.00 . A A . 15 GLU HA 1 1 1 220 1 1 15 GLU HB2 H -5.155 5.667 7.375 1.00 . A A . 15 GLU HB2 1 1 1 221 1 1 15 GLU HB3 H -4.670 4.427 6.226 1.00 . A A . 15 GLU HB3 1 1 1 222 1 1 15 GLU HG2 H -2.365 4.661 6.872 1.00 . A A . 15 GLU HG2 1 1 1 223 1 1 15 GLU HG3 H -2.766 6.015 7.929 1.00 . A A . 15 GLU HG3 1 1 1 224 1 1 15 GLU N N -5.415 6.600 4.869 1.00 . A A . 15 GLU N 1 1 1 225 1 1 15 GLU O O -3.251 5.370 3.684 1.00 . A A . 15 GLU O 1 1 1 226 1 1 15 GLU OE1 O -3.559 2.911 8.387 1.00 . A A . 15 GLU OE1 1 1 1 227 1 1 15 GLU OE2 O -3.396 4.565 9.825 1.00 . A A . 15 GLU OE2 1 1 1 228 1 1 16 LYS C C 0.630 6.168 4.998 1.00 . A A . 16 LYS C 1 1 1 229 1 1 16 LYS CA C -0.673 6.161 4.187 1.00 . A A . 16 LYS CA 1 1 1 230 1 1 16 LYS CB C -0.567 7.160 3.036 1.00 . A A . 16 LYS CB 1 1 1 231 1 1 16 LYS CD C -0.531 9.563 2.298 1.00 . A A . 16 LYS CD 1 1 1 232 1 1 16 LYS CE C -0.901 10.987 2.682 1.00 . A A . 16 LYS CE 1 1 1 233 1 1 16 LYS CG C -0.678 8.612 3.475 1.00 . A A . 16 LYS CG 1 1 1 234 1 1 16 LYS H H -1.722 7.033 5.812 1.00 . A A . 16 LYS H 1 1 1 235 1 1 16 LYS HA H -0.834 5.170 3.780 1.00 . A A . 16 LYS HA 1 1 1 236 1 1 16 LYS HB2 H 0.386 7.029 2.548 1.00 . A A . 16 LYS HB2 1 1 1 237 1 1 16 LYS HB3 H -1.358 6.962 2.328 1.00 . A A . 16 LYS HB3 1 1 1 238 1 1 16 LYS HD2 H 0.495 9.548 1.960 1.00 . A A . 16 LYS HD2 1 1 1 239 1 1 16 LYS HD3 H -1.180 9.236 1.499 1.00 . A A . 16 LYS HD3 1 1 1 240 1 1 16 LYS HE2 H -0.304 11.283 3.532 1.00 . A A . 16 LYS HE2 1 1 1 241 1 1 16 LYS HE3 H -0.686 11.640 1.849 1.00 . A A . 16 LYS HE3 1 1 1 242 1 1 16 LYS HG2 H -1.643 8.767 3.932 1.00 . A A . 16 LYS HG2 1 1 1 243 1 1 16 LYS HG3 H 0.102 8.820 4.194 1.00 . A A . 16 LYS HG3 1 1 1 244 1 1 16 LYS HZ1 H -2.565 10.495 3.845 1.00 . A A . 16 LYS HZ1 1 1 1 245 1 1 16 LYS HZ2 H -2.933 10.830 2.229 1.00 . A A . 16 LYS HZ2 1 1 1 246 1 1 16 LYS HZ3 H -2.565 12.093 3.292 1.00 . A A . 16 LYS HZ3 1 1 1 247 1 1 16 LYS N N -1.833 6.481 5.013 1.00 . A A . 16 LYS N 1 1 1 248 1 1 16 LYS NZ N -2.342 11.109 3.037 1.00 . A A . 16 LYS NZ 1 1 1 249 1 1 16 LYS O O 1.287 7.204 5.102 1.00 . A A . 16 LYS O 1 1 1 250 1 1 17 ARG C C 2.783 3.525 6.394 1.00 . A A . 17 ARG C 1 1 1 251 1 1 17 ARG CA C 2.231 4.947 6.372 1.00 . A A . 17 ARG CA 1 1 1 252 1 1 17 ARG CB C 1.956 5.413 7.800 1.00 . A A . 17 ARG CB 1 1 1 253 1 1 17 ARG CD C 2.805 5.548 10.158 1.00 . A A . 17 ARG CD 1 1 1 254 1 1 17 ARG CG C 3.183 5.385 8.695 1.00 . A A . 17 ARG CG 1 1 1 255 1 1 17 ARG CZ C 1.964 7.304 11.657 1.00 . A A . 17 ARG CZ 1 1 1 256 1 1 17 ARG H H 0.473 4.211 5.427 1.00 . A A . 17 ARG H 1 1 1 257 1 1 17 ARG HA H 2.965 5.600 5.923 1.00 . A A . 17 ARG HA 1 1 1 258 1 1 17 ARG HB2 H 1.581 6.424 7.769 1.00 . A A . 17 ARG HB2 1 1 1 259 1 1 17 ARG HB3 H 1.205 4.773 8.236 1.00 . A A . 17 ARG HB3 1 1 1 260 1 1 17 ARG HD2 H 2.078 4.790 10.412 1.00 . A A . 17 ARG HD2 1 1 1 261 1 1 17 ARG HD3 H 3.690 5.414 10.762 1.00 . A A . 17 ARG HD3 1 1 1 262 1 1 17 ARG HE H 2.045 7.444 9.669 1.00 . A A . 17 ARG HE 1 1 1 263 1 1 17 ARG HG2 H 3.692 4.442 8.567 1.00 . A A . 17 ARG HG2 1 1 1 264 1 1 17 ARG HG3 H 3.842 6.194 8.412 1.00 . A A . 17 ARG HG3 1 1 1 265 1 1 17 ARG HH11 H 2.599 5.625 12.587 1.00 . A A . 17 ARG HH11 1 1 1 266 1 1 17 ARG HH12 H 2.005 6.872 13.631 1.00 . A A . 17 ARG HH12 1 1 1 267 1 1 17 ARG HH21 H 1.261 9.092 11.035 1.00 . A A . 17 ARG HH21 1 1 1 268 1 1 17 ARG HH22 H 1.243 8.844 12.748 1.00 . A A . 17 ARG HH22 1 1 1 269 1 1 17 ARG N N 1.005 5.025 5.572 1.00 . A A . 17 ARG N 1 1 1 270 1 1 17 ARG NE N 2.235 6.862 10.434 1.00 . A A . 17 ARG NE 1 1 1 271 1 1 17 ARG NH1 N 2.209 6.537 12.711 1.00 . A A . 17 ARG NH1 1 1 1 272 1 1 17 ARG NH2 N 1.446 8.512 11.827 1.00 . A A . 17 ARG NH2 1 1 1 273 1 1 17 ARG O O 2.458 2.754 7.297 1.00 . A A . 17 ARG O 1 1 1 274 1 1 18 GLY C C 5.477 1.643 4.738 1.00 . A A . 18 GLY C 1 1 1 275 1 1 18 GLY CA C 4.127 1.808 5.401 1.00 . A A . 18 GLY CA 1 1 1 276 1 1 18 GLY H H 3.883 3.808 4.733 1.00 . A A . 18 GLY H 1 1 1 277 1 1 18 GLY HA2 H 4.205 1.460 6.418 1.00 . A A . 18 GLY HA2 1 1 1 278 1 1 18 GLY HA3 H 3.419 1.189 4.885 1.00 . A A . 18 GLY HA3 1 1 1 279 1 1 18 GLY N N 3.612 3.162 5.417 1.00 . A A . 18 GLY N 1 1 1 280 1 1 18 GLY O O 6.390 2.446 4.932 1.00 . A A . 18 GLY O 1 1 1 281 1 1 19 LYS C C 6.583 0.300 1.732 1.00 . A A . 19 LYS C 1 1 1 282 1 1 19 LYS CA C 6.801 0.220 3.250 1.00 . A A . 19 LYS CA 1 1 1 283 1 1 19 LYS CB C 7.179 -1.181 3.692 1.00 . A A . 19 LYS CB 1 1 1 284 1 1 19 LYS CD C 7.965 -2.675 5.512 1.00 . A A . 19 LYS CD 1 1 1 285 1 1 19 LYS CE C 8.438 -2.771 6.954 1.00 . A A . 19 LYS CE 1 1 1 286 1 1 19 LYS CG C 7.602 -1.257 5.143 1.00 . A A . 19 LYS CG 1 1 1 287 1 1 19 LYS H H 4.803 -0.012 3.842 1.00 . A A . 19 LYS H 1 1 1 288 1 1 19 LYS HA H 7.573 0.903 3.541 1.00 . A A . 19 LYS HA 1 1 1 289 1 1 19 LYS HB2 H 6.313 -1.816 3.556 1.00 . A A . 19 LYS HB2 1 1 1 290 1 1 19 LYS HB3 H 7.989 -1.547 3.081 1.00 . A A . 19 LYS HB3 1 1 1 291 1 1 19 LYS HD2 H 7.092 -3.296 5.383 1.00 . A A . 19 LYS HD2 1 1 1 292 1 1 19 LYS HD3 H 8.750 -3.014 4.853 1.00 . A A . 19 LYS HD3 1 1 1 293 1 1 19 LYS HE2 H 7.666 -2.379 7.598 1.00 . A A . 19 LYS HE2 1 1 1 294 1 1 19 LYS HE3 H 8.612 -3.807 7.195 1.00 . A A . 19 LYS HE3 1 1 1 295 1 1 19 LYS HG2 H 8.461 -0.621 5.295 1.00 . A A . 19 LYS HG2 1 1 1 296 1 1 19 LYS HG3 H 6.786 -0.927 5.769 1.00 . A A . 19 LYS HG3 1 1 1 297 1 1 19 LYS HZ1 H 10.453 -2.368 6.570 1.00 . A A . 19 LYS HZ1 1 1 1 298 1 1 19 LYS HZ2 H 9.991 -2.091 8.175 1.00 . A A . 19 LYS HZ2 1 1 1 299 1 1 19 LYS HZ3 H 9.543 -0.997 6.965 1.00 . A A . 19 LYS HZ3 1 1 1 300 1 1 19 LYS N N 5.583 0.573 3.953 1.00 . A A . 19 LYS N 1 1 1 301 1 1 19 LYS NZ N 9.694 -2.003 7.182 1.00 . A A . 19 LYS NZ 1 1 1 302 1 1 19 LYS O O 6.219 1.341 1.220 1.00 . A A . 19 LYS O 1 1 1 303 1 1 20 GLY C C 5.163 -1.198 -0.652 1.00 . A A . 20 GLY C 1 1 1 304 1 1 20 GLY CA C 6.574 -0.772 -0.413 1.00 . A A . 20 GLY CA 1 1 1 305 1 1 20 GLY H H 7.096 -1.603 1.429 1.00 . A A . 20 GLY H 1 1 1 306 1 1 20 GLY HA2 H 6.736 0.220 -0.799 1.00 . A A . 20 GLY HA2 1 1 1 307 1 1 20 GLY HA3 H 7.235 -1.469 -0.891 1.00 . A A . 20 GLY HA3 1 1 1 308 1 1 20 GLY N N 6.809 -0.786 1.005 1.00 . A A . 20 GLY N 1 1 1 309 1 1 20 GLY O O 4.442 -0.646 -1.481 1.00 . A A . 20 GLY O 1 1 1 310 1 1 21 LYS C C 3.008 -3.136 1.510 1.00 . A A . 21 LYS C 1 1 1 311 1 1 21 LYS CA C 3.460 -2.762 0.087 1.00 . A A . 21 LYS CA 1 1 1 312 1 1 21 LYS CB C 3.405 -3.976 -0.838 1.00 . A A . 21 LYS CB 1 1 1 313 1 1 21 LYS CD C 5.153 -3.803 -2.641 1.00 . A A . 21 LYS CD 1 1 1 314 1 1 21 LYS CE C 5.390 -3.654 -4.136 1.00 . A A . 21 LYS CE 1 1 1 315 1 1 21 LYS CG C 3.683 -3.636 -2.296 1.00 . A A . 21 LYS CG 1 1 1 316 1 1 21 LYS H H 5.474 -2.631 0.676 1.00 . A A . 21 LYS H 1 1 1 317 1 1 21 LYS HA H 2.797 -2.000 -0.297 1.00 . A A . 21 LYS HA 1 1 1 318 1 1 21 LYS HB2 H 4.143 -4.693 -0.513 1.00 . A A . 21 LYS HB2 1 1 1 319 1 1 21 LYS HB3 H 2.426 -4.421 -0.774 1.00 . A A . 21 LYS HB3 1 1 1 320 1 1 21 LYS HD2 H 5.725 -3.049 -2.121 1.00 . A A . 21 LYS HD2 1 1 1 321 1 1 21 LYS HD3 H 5.478 -4.785 -2.330 1.00 . A A . 21 LYS HD3 1 1 1 322 1 1 21 LYS HE2 H 6.452 -3.701 -4.326 1.00 . A A . 21 LYS HE2 1 1 1 323 1 1 21 LYS HE3 H 4.897 -4.468 -4.647 1.00 . A A . 21 LYS HE3 1 1 1 324 1 1 21 LYS HG2 H 3.101 -4.286 -2.928 1.00 . A A . 21 LYS HG2 1 1 1 325 1 1 21 LYS HG3 H 3.397 -2.610 -2.473 1.00 . A A . 21 LYS HG3 1 1 1 326 1 1 21 LYS HZ1 H 5.061 -2.279 -5.674 1.00 . A A . 21 LYS HZ1 1 1 1 327 1 1 21 LYS HZ2 H 5.312 -1.567 -4.159 1.00 . A A . 21 LYS HZ2 1 1 1 328 1 1 21 LYS HZ3 H 3.834 -2.311 -4.510 1.00 . A A . 21 LYS HZ3 1 1 1 329 1 1 21 LYS N N 4.796 -2.213 0.104 1.00 . A A . 21 LYS N 1 1 1 330 1 1 21 LYS NZ N 4.862 -2.363 -4.656 1.00 . A A . 21 LYS NZ 1 1 1 331 1 1 21 LYS O O 1.943 -3.723 1.687 1.00 . A A . 21 LYS O 1 1 1 332 1 1 22 ASP C C 2.658 -1.955 4.524 1.00 . A A . 22 ASP C 1 1 1 333 1 1 22 ASP CA C 3.487 -3.065 3.913 1.00 . A A . 22 ASP CA 1 1 1 334 1 1 22 ASP CB C 4.748 -3.228 4.758 1.00 . A A . 22 ASP CB 1 1 1 335 1 1 22 ASP CG C 4.477 -3.950 6.065 1.00 . A A . 22 ASP CG 1 1 1 336 1 1 22 ASP H H 4.629 -2.300 2.342 1.00 . A A . 22 ASP H 1 1 1 337 1 1 22 ASP HA H 2.927 -3.966 3.924 1.00 . A A . 22 ASP HA 1 1 1 338 1 1 22 ASP HB2 H 5.488 -3.774 4.202 1.00 . A A . 22 ASP HB2 1 1 1 339 1 1 22 ASP HB3 H 5.138 -2.249 4.993 1.00 . A A . 22 ASP HB3 1 1 1 340 1 1 22 ASP N N 3.813 -2.772 2.525 1.00 . A A . 22 ASP N 1 1 1 341 1 1 22 ASP O O 2.447 -1.918 5.734 1.00 . A A . 22 ASP O 1 1 1 342 1 1 22 ASP OD1 O 3.291 -4.187 6.373 1.00 . A A . 22 ASP OD1 1 1 1 343 1 1 22 ASP OD2 O 5.447 -4.266 6.785 1.00 . A A . 22 ASP OD2 1 1 1 344 1 1 23 VAL C C -0.061 -0.296 4.177 1.00 . A A . 23 VAL C 1 1 1 345 1 1 23 VAL CA C 1.411 0.056 4.145 1.00 . A A . 23 VAL CA 1 1 1 346 1 1 23 VAL CB C 1.636 1.279 3.255 1.00 . A A . 23 VAL CB 1 1 1 347 1 1 23 VAL CG1 C 0.868 1.170 1.945 1.00 . A A . 23 VAL CG1 1 1 1 348 1 1 23 VAL CG2 C 1.244 2.535 3.991 1.00 . A A . 23 VAL CG2 1 1 1 349 1 1 23 VAL H H 2.435 -1.109 2.752 1.00 . A A . 23 VAL H 1 1 1 350 1 1 23 VAL HA H 1.735 0.308 5.141 1.00 . A A . 23 VAL HA 1 1 1 351 1 1 23 VAL HB H 2.697 1.327 3.034 1.00 . A A . 23 VAL HB 1 1 1 352 1 1 23 VAL HG11 H 0.914 2.114 1.427 1.00 . A A . 23 VAL HG11 1 1 1 353 1 1 23 VAL HG12 H -0.165 0.925 2.142 1.00 . A A . 23 VAL HG12 1 1 1 354 1 1 23 VAL HG13 H 1.309 0.399 1.330 1.00 . A A . 23 VAL HG13 1 1 1 355 1 1 23 VAL HG21 H 1.201 2.327 5.048 1.00 . A A . 23 VAL HG21 1 1 1 356 1 1 23 VAL HG22 H 0.272 2.859 3.654 1.00 . A A . 23 VAL HG22 1 1 1 357 1 1 23 VAL HG23 H 1.972 3.309 3.802 1.00 . A A . 23 VAL HG23 1 1 1 358 1 1 23 VAL N N 2.204 -1.050 3.690 1.00 . A A . 23 VAL N 1 1 1 359 1 1 23 VAL O O -0.546 -1.084 3.365 1.00 . A A . 23 VAL O 1 1 1 360 1 1 24 GLU C C -2.989 1.300 4.823 1.00 . A A . 24 GLU C 1 1 1 361 1 1 24 GLU CA C -2.186 0.070 5.226 1.00 . A A . 24 GLU CA 1 1 1 362 1 1 24 GLU CB C -2.532 -0.324 6.659 1.00 . A A . 24 GLU CB 1 1 1 363 1 1 24 GLU CD C -2.133 0.060 9.124 1.00 . A A . 24 GLU CD 1 1 1 364 1 1 24 GLU CG C -1.801 0.496 7.710 1.00 . A A . 24 GLU CG 1 1 1 365 1 1 24 GLU H H -0.334 0.994 5.649 1.00 . A A . 24 GLU H 1 1 1 366 1 1 24 GLU HA H -2.427 -0.760 4.568 1.00 . A A . 24 GLU HA 1 1 1 367 1 1 24 GLU HB2 H -3.594 -0.190 6.802 1.00 . A A . 24 GLU HB2 1 1 1 368 1 1 24 GLU HB3 H -2.287 -1.363 6.803 1.00 . A A . 24 GLU HB3 1 1 1 369 1 1 24 GLU HG2 H -0.739 0.387 7.558 1.00 . A A . 24 GLU HG2 1 1 1 370 1 1 24 GLU HG3 H -2.077 1.532 7.594 1.00 . A A . 24 GLU HG3 1 1 1 371 1 1 24 GLU N N -0.769 0.325 5.086 1.00 . A A . 24 GLU N 1 1 1 372 1 1 24 GLU O O -3.240 2.186 5.639 1.00 . A A . 24 GLU O 1 1 1 373 1 1 24 GLU OE1 O -1.486 -0.886 9.621 1.00 . A A . 24 GLU OE1 1 1 1 374 1 1 24 GLU OE2 O -3.039 0.664 9.736 1.00 . A A . 24 GLU OE2 1 1 1 375 1 1 25 TYR C C -5.645 2.178 3.268 1.00 . A A . 25 TYR C 1 1 1 376 1 1 25 TYR CA C -4.164 2.453 3.045 1.00 . A A . 25 TYR CA 1 1 1 377 1 1 25 TYR CB C -3.867 2.632 1.555 1.00 . A A . 25 TYR CB 1 1 1 378 1 1 25 TYR CD1 C -1.459 3.298 1.864 1.00 . A A . 25 TYR CD1 1 1 1 379 1 1 25 TYR CD2 C -2.831 4.671 0.493 1.00 . A A . 25 TYR CD2 1 1 1 380 1 1 25 TYR CE1 C -0.389 4.138 1.636 1.00 . A A . 25 TYR CE1 1 1 1 381 1 1 25 TYR CE2 C -1.762 5.518 0.261 1.00 . A A . 25 TYR CE2 1 1 1 382 1 1 25 TYR CG C -2.696 3.549 1.295 1.00 . A A . 25 TYR CG 1 1 1 383 1 1 25 TYR CZ C -0.543 5.244 0.833 1.00 . A A . 25 TYR CZ 1 1 1 384 1 1 25 TYR H H -3.165 0.614 2.964 1.00 . A A . 25 TYR H 1 1 1 385 1 1 25 TYR HA H -3.871 3.349 3.567 1.00 . A A . 25 TYR HA 1 1 1 386 1 1 25 TYR HB2 H -3.635 1.670 1.124 1.00 . A A . 25 TYR HB2 1 1 1 387 1 1 25 TYR HB3 H -4.730 3.044 1.058 1.00 . A A . 25 TYR HB3 1 1 1 388 1 1 25 TYR HD1 H -1.338 2.431 2.492 1.00 . A A . 25 TYR HD1 1 1 1 389 1 1 25 TYR HD2 H -3.786 4.877 0.042 1.00 . A A . 25 TYR HD2 1 1 1 390 1 1 25 TYR HE1 H 0.561 3.924 2.086 1.00 . A A . 25 TYR HE1 1 1 1 391 1 1 25 TYR HE2 H -1.887 6.387 -0.367 1.00 . A A . 25 TYR HE2 1 1 1 392 1 1 25 TYR HH H 0.229 6.992 0.612 1.00 . A A . 25 TYR HH 1 1 1 393 1 1 25 TYR N N -3.390 1.346 3.562 1.00 . A A . 25 TYR N 1 1 1 394 1 1 25 TYR O O -6.005 1.292 4.034 1.00 . A A . 25 TYR O 1 1 1 395 1 1 25 TYR OH O 0.526 6.080 0.601 1.00 . A A . 25 TYR OH 1 1 1 396 1 1 26 LEU C C -8.481 2.675 1.326 1.00 . A A . 26 LEU C 1 1 1 397 1 1 26 LEU CA C -7.930 2.767 2.729 1.00 . A A . 26 LEU CA 1 1 1 398 1 1 26 LEU CB C -8.603 3.909 3.498 1.00 . A A . 26 LEU CB 1 1 1 399 1 1 26 LEU CD1 C -10.489 2.686 4.622 1.00 . A A . 26 LEU CD1 1 1 1 400 1 1 26 LEU CD2 C -10.751 5.098 4.051 1.00 . A A . 26 LEU CD2 1 1 1 401 1 1 26 LEU CG C -10.126 3.777 3.635 1.00 . A A . 26 LEU CG 1 1 1 402 1 1 26 LEU H H -6.156 3.698 2.103 1.00 . A A . 26 LEU H 1 1 1 403 1 1 26 LEU HA H -8.113 1.832 3.231 1.00 . A A . 26 LEU HA 1 1 1 404 1 1 26 LEU HB2 H -8.170 3.952 4.489 1.00 . A A . 26 LEU HB2 1 1 1 405 1 1 26 LEU HB3 H -8.386 4.836 2.989 1.00 . A A . 26 LEU HB3 1 1 1 406 1 1 26 LEU HD11 H -9.752 1.906 4.574 1.00 . A A . 26 LEU HD11 1 1 1 407 1 1 26 LEU HD12 H -11.457 2.278 4.369 1.00 . A A . 26 LEU HD12 1 1 1 408 1 1 26 LEU HD13 H -10.519 3.095 5.621 1.00 . A A . 26 LEU HD13 1 1 1 409 1 1 26 LEU HD21 H -10.845 5.738 3.187 1.00 . A A . 26 LEU HD21 1 1 1 410 1 1 26 LEU HD22 H -10.128 5.577 4.790 1.00 . A A . 26 LEU HD22 1 1 1 411 1 1 26 LEU HD23 H -11.730 4.915 4.470 1.00 . A A . 26 LEU HD23 1 1 1 412 1 1 26 LEU HG H -10.537 3.499 2.678 1.00 . A A . 26 LEU HG 1 1 1 413 1 1 26 LEU N N -6.496 2.963 2.637 1.00 . A A . 26 LEU N 1 1 1 414 1 1 26 LEU O O -7.817 3.082 0.374 1.00 . A A . 26 LEU O 1 1 1 415 1 1 27 VAL C C -11.701 2.317 -0.229 1.00 . A A . 27 VAL C 1 1 1 416 1 1 27 VAL CA C -10.215 2.012 -0.160 1.00 . A A . 27 VAL CA 1 1 1 417 1 1 27 VAL CB C -9.895 0.647 -0.823 1.00 . A A . 27 VAL CB 1 1 1 418 1 1 27 VAL CG1 C -8.628 0.035 -0.236 1.00 . A A . 27 VAL CG1 1 1 1 419 1 1 27 VAL CG2 C -11.044 -0.356 -0.748 1.00 . A A . 27 VAL CG2 1 1 1 420 1 1 27 VAL H H -10.162 1.774 1.939 1.00 . A A . 27 VAL H 1 1 1 421 1 1 27 VAL HA H -9.720 2.754 -0.752 1.00 . A A . 27 VAL HA 1 1 1 422 1 1 27 VAL HB H -9.704 0.863 -1.858 1.00 . A A . 27 VAL HB 1 1 1 423 1 1 27 VAL HG11 H -8.422 -0.905 -0.727 1.00 . A A . 27 VAL HG11 1 1 1 424 1 1 27 VAL HG12 H -8.765 -0.135 0.821 1.00 . A A . 27 VAL HG12 1 1 1 425 1 1 27 VAL HG13 H -7.799 0.709 -0.389 1.00 . A A . 27 VAL HG13 1 1 1 426 1 1 27 VAL HG21 H -11.935 0.084 -1.170 1.00 . A A . 27 VAL HG21 1 1 1 427 1 1 27 VAL HG22 H -11.227 -0.621 0.283 1.00 . A A . 27 VAL HG22 1 1 1 428 1 1 27 VAL HG23 H -10.784 -1.242 -1.308 1.00 . A A . 27 VAL HG23 1 1 1 429 1 1 27 VAL N N -9.667 2.119 1.168 1.00 . A A . 27 VAL N 1 1 1 430 1 1 27 VAL O O -12.537 1.576 0.289 1.00 . A A . 27 VAL O 1 1 1 431 1 1 28 ARG C C -13.789 3.099 -2.336 1.00 . A A . 28 ARG C 1 1 1 432 1 1 28 ARG CA C -13.387 3.799 -1.077 1.00 . A A . 28 ARG CA 1 1 1 433 1 1 28 ARG CB C -13.563 5.302 -1.227 1.00 . A A . 28 ARG CB 1 1 1 434 1 1 28 ARG CD C -13.074 7.586 -0.292 1.00 . A A . 28 ARG CD 1 1 1 435 1 1 28 ARG CG C -12.682 6.117 -0.292 1.00 . A A . 28 ARG CG 1 1 1 436 1 1 28 ARG CZ C -12.372 9.663 0.821 1.00 . A A . 28 ARG CZ 1 1 1 437 1 1 28 ARG H H -11.299 4.030 -1.169 1.00 . A A . 28 ARG H 1 1 1 438 1 1 28 ARG HA H -13.990 3.425 -0.268 1.00 . A A . 28 ARG HA 1 1 1 439 1 1 28 ARG HB2 H -13.325 5.566 -2.244 1.00 . A A . 28 ARG HB2 1 1 1 440 1 1 28 ARG HB3 H -14.594 5.556 -1.029 1.00 . A A . 28 ARG HB3 1 1 1 441 1 1 28 ARG HD2 H -13.092 7.942 -1.311 1.00 . A A . 28 ARG HD2 1 1 1 442 1 1 28 ARG HD3 H -14.059 7.682 0.139 1.00 . A A . 28 ARG HD3 1 1 1 443 1 1 28 ARG HE H -11.294 7.985 0.750 1.00 . A A . 28 ARG HE 1 1 1 444 1 1 28 ARG HG2 H -12.781 5.729 0.709 1.00 . A A . 28 ARG HG2 1 1 1 445 1 1 28 ARG HG3 H -11.655 6.027 -0.613 1.00 . A A . 28 ARG HG3 1 1 1 446 1 1 28 ARG HH11 H -14.192 9.740 -0.053 1.00 . A A . 28 ARG HH11 1 1 1 447 1 1 28 ARG HH12 H -13.681 11.199 0.729 1.00 . A A . 28 ARG HH12 1 1 1 448 1 1 28 ARG HH21 H -10.611 9.898 1.784 1.00 . A A . 28 ARG HH21 1 1 1 449 1 1 28 ARG HH22 H -11.644 11.289 1.773 1.00 . A A . 28 ARG HH22 1 1 1 450 1 1 28 ARG N N -12.013 3.437 -0.853 1.00 . A A . 28 ARG N 1 1 1 451 1 1 28 ARG NE N -12.139 8.400 0.477 1.00 . A A . 28 ARG NE 1 1 1 452 1 1 28 ARG NH1 N -13.508 10.248 0.470 1.00 . A A . 28 ARG NH1 1 1 1 453 1 1 28 ARG NH2 N -11.468 10.339 1.517 1.00 . A A . 28 ARG NH2 1 1 1 454 1 1 28 ARG O O -13.902 3.711 -3.399 1.00 . A A . 28 ARG O 1 1 1 455 1 1 29 TRP C C -15.071 1.615 -4.384 1.00 . A A . 29 TRP C 1 1 1 456 1 1 29 TRP CA C -14.329 0.893 -3.278 1.00 . A A . 29 TRP CA 1 1 1 457 1 1 29 TRP CB C -15.197 -0.227 -2.724 1.00 . A A . 29 TRP CB 1 1 1 458 1 1 29 TRP CD1 C -14.246 -1.762 -4.537 1.00 . A A . 29 TRP CD1 1 1 1 459 1 1 29 TRP CD2 C -15.828 -2.713 -3.271 1.00 . A A . 29 TRP CD2 1 1 1 460 1 1 29 TRP CE2 C -15.393 -3.652 -4.224 1.00 . A A . 29 TRP CE2 1 1 1 461 1 1 29 TRP CE3 C -16.821 -3.086 -2.362 1.00 . A A . 29 TRP CE3 1 1 1 462 1 1 29 TRP CG C -15.082 -1.510 -3.490 1.00 . A A . 29 TRP CG 1 1 1 463 1 1 29 TRP CH2 C -16.888 -5.280 -3.391 1.00 . A A . 29 TRP CH2 1 1 1 464 1 1 29 TRP CZ2 C -15.916 -4.942 -4.294 1.00 . A A . 29 TRP CZ2 1 1 1 465 1 1 29 TRP CZ3 C -17.341 -4.367 -2.431 1.00 . A A . 29 TRP CZ3 1 1 1 466 1 1 29 TRP H H -13.861 1.407 -1.297 1.00 . A A . 29 TRP H 1 1 1 467 1 1 29 TRP HA H -13.414 0.468 -3.677 1.00 . A A . 29 TRP HA 1 1 1 468 1 1 29 TRP HB2 H -14.908 -0.409 -1.703 1.00 . A A . 29 TRP HB2 1 1 1 469 1 1 29 TRP HB3 H -16.231 0.085 -2.749 1.00 . A A . 29 TRP HB3 1 1 1 470 1 1 29 TRP HD1 H -13.550 -1.043 -4.944 1.00 . A A . 29 TRP HD1 1 1 1 471 1 1 29 TRP HE1 H -13.942 -3.464 -5.729 1.00 . A A . 29 TRP HE1 1 1 1 472 1 1 29 TRP HE3 H -17.184 -2.396 -1.615 1.00 . A A . 29 TRP HE3 1 1 1 473 1 1 29 TRP HH2 H -17.322 -6.270 -3.409 1.00 . A A . 29 TRP HH2 1 1 1 474 1 1 29 TRP HZ2 H -15.578 -5.658 -5.027 1.00 . A A . 29 TRP HZ2 1 1 1 475 1 1 29 TRP HZ3 H -18.109 -4.672 -1.737 1.00 . A A . 29 TRP HZ3 1 1 1 476 1 1 29 TRP N N -13.976 1.790 -2.188 1.00 . A A . 29 TRP N 1 1 1 477 1 1 29 TRP NE1 N -14.427 -3.048 -4.986 1.00 . A A . 29 TRP NE1 1 1 1 478 1 1 29 TRP O O -16.286 1.776 -4.332 1.00 . A A . 29 TRP O 1 1 1 479 1 1 30 LYS C C -16.229 2.387 -6.887 1.00 . A A . 30 LYS C 1 1 1 480 1 1 30 LYS CA C -14.807 2.828 -6.519 1.00 . A A . 30 LYS CA 1 1 1 481 1 1 30 LYS CB C -13.895 2.584 -7.718 1.00 . A A . 30 LYS CB 1 1 1 482 1 1 30 LYS CD C -13.154 3.317 -10.003 1.00 . A A . 30 LYS CD 1 1 1 483 1 1 30 LYS CE C -13.367 4.312 -11.132 1.00 . A A . 30 LYS CE 1 1 1 484 1 1 30 LYS CG C -14.165 3.517 -8.887 1.00 . A A . 30 LYS CG 1 1 1 485 1 1 30 LYS H H -13.303 2.047 -5.212 1.00 . A A . 30 LYS H 1 1 1 486 1 1 30 LYS HA H -14.809 3.884 -6.289 1.00 . A A . 30 LYS HA 1 1 1 487 1 1 30 LYS HB2 H -12.871 2.715 -7.408 1.00 . A A . 30 LYS HB2 1 1 1 488 1 1 30 LYS HB3 H -14.032 1.568 -8.058 1.00 . A A . 30 LYS HB3 1 1 1 489 1 1 30 LYS HD2 H -12.160 3.450 -9.603 1.00 . A A . 30 LYS HD2 1 1 1 490 1 1 30 LYS HD3 H -13.256 2.315 -10.393 1.00 . A A . 30 LYS HD3 1 1 1 491 1 1 30 LYS HE2 H -14.353 4.161 -11.546 1.00 . A A . 30 LYS HE2 1 1 1 492 1 1 30 LYS HE3 H -13.295 5.313 -10.732 1.00 . A A . 30 LYS HE3 1 1 1 493 1 1 30 LYS HG2 H -15.153 3.318 -9.272 1.00 . A A . 30 LYS HG2 1 1 1 494 1 1 30 LYS HG3 H -14.109 4.538 -8.541 1.00 . A A . 30 LYS HG3 1 1 1 495 1 1 30 LYS HZ1 H -12.412 3.189 -12.613 1.00 . A A . 30 LYS HZ1 1 1 1 496 1 1 30 LYS HZ2 H -11.401 4.303 -11.838 1.00 . A A . 30 LYS HZ2 1 1 1 497 1 1 30 LYS HZ3 H -12.535 4.837 -12.974 1.00 . A A . 30 LYS HZ3 1 1 1 498 1 1 30 LYS N N -14.285 2.111 -5.341 1.00 . A A . 30 LYS N 1 1 1 499 1 1 30 LYS NZ N -12.358 4.149 -12.215 1.00 . A A . 30 LYS NZ 1 1 1 500 1 1 30 LYS O O -17.052 3.198 -7.309 1.00 . A A . 30 LYS O 1 1 1 501 1 1 31 ASP C C -18.394 -0.099 -5.759 1.00 . A A . 31 ASP C 1 1 1 502 1 1 31 ASP CA C -17.817 0.540 -7.020 1.00 . A A . 31 ASP CA 1 1 1 503 1 1 31 ASP CB C -17.731 -0.495 -8.144 1.00 . A A . 31 ASP CB 1 1 1 504 1 1 31 ASP CG C -16.848 -1.672 -7.781 1.00 . A A . 31 ASP CG 1 1 1 505 1 1 31 ASP H H -15.789 0.495 -6.423 1.00 . A A . 31 ASP H 1 1 1 506 1 1 31 ASP HA H -18.460 1.350 -7.329 1.00 . A A . 31 ASP HA 1 1 1 507 1 1 31 ASP HB2 H -18.722 -0.866 -8.360 1.00 . A A . 31 ASP HB2 1 1 1 508 1 1 31 ASP HB3 H -17.327 -0.023 -9.028 1.00 . A A . 31 ASP HB3 1 1 1 509 1 1 31 ASP N N -16.498 1.094 -6.734 1.00 . A A . 31 ASP N 1 1 1 510 1 1 31 ASP O O -18.742 -1.281 -5.748 1.00 . A A . 31 ASP O 1 1 1 511 1 1 31 ASP OD1 O -15.629 -1.604 -8.048 1.00 . A A . 31 ASP OD1 1 1 1 512 1 1 31 ASP OD2 O -17.373 -2.660 -7.227 1.00 . A A . 31 ASP OD2 1 1 1 513 1 1 32 GLY C C -19.731 1.281 -2.644 1.00 . A A . 32 GLY C 1 1 1 514 1 1 32 GLY CA C -19.001 0.211 -3.431 1.00 . A A . 32 GLY CA 1 1 1 515 1 1 32 GLY H H -18.214 1.636 -4.780 1.00 . A A . 32 GLY H 1 1 1 516 1 1 32 GLY HA2 H -19.676 -0.612 -3.615 1.00 . A A . 32 GLY HA2 1 1 1 517 1 1 32 GLY HA3 H -18.166 -0.140 -2.837 1.00 . A A . 32 GLY HA3 1 1 1 518 1 1 32 GLY N N -18.492 0.700 -4.699 1.00 . A A . 32 GLY N 1 1 1 519 1 1 32 GLY O O -19.876 2.414 -3.104 1.00 . A A . 32 GLY O 1 1 1 520 1 1 33 GLY C C -20.147 2.171 0.677 1.00 . A A . 33 GLY C 1 1 1 521 1 1 33 GLY CA C -20.897 1.863 -0.607 1.00 . A A . 33 GLY CA 1 1 1 522 1 1 33 GLY H H -20.053 -0.001 -1.142 1.00 . A A . 33 GLY H 1 1 1 523 1 1 33 GLY HA2 H -21.039 2.782 -1.157 1.00 . A A . 33 GLY HA2 1 1 1 524 1 1 33 GLY HA3 H -21.865 1.453 -0.357 1.00 . A A . 33 GLY HA3 1 1 1 525 1 1 33 GLY N N -20.191 0.918 -1.451 1.00 . A A . 33 GLY N 1 1 1 526 1 1 33 GLY O O -20.479 3.125 1.382 1.00 . A A . 33 GLY O 1 1 1 527 1 1 34 ASP C C -16.853 1.633 1.858 1.00 . A A . 34 ASP C 1 1 1 528 1 1 34 ASP CA C -18.339 1.558 2.191 1.00 . A A . 34 ASP CA 1 1 1 529 1 1 34 ASP CB C -18.596 0.422 3.183 1.00 . A A . 34 ASP CB 1 1 1 530 1 1 34 ASP CG C -17.743 0.541 4.431 1.00 . A A . 34 ASP CG 1 1 1 531 1 1 34 ASP H H -18.914 0.619 0.386 1.00 . A A . 34 ASP H 1 1 1 532 1 1 34 ASP HA H -18.643 2.492 2.640 1.00 . A A . 34 ASP HA 1 1 1 533 1 1 34 ASP HB2 H -19.635 0.437 3.476 1.00 . A A . 34 ASP HB2 1 1 1 534 1 1 34 ASP HB3 H -18.375 -0.521 2.706 1.00 . A A . 34 ASP HB3 1 1 1 535 1 1 34 ASP N N -19.133 1.364 0.984 1.00 . A A . 34 ASP N 1 1 1 536 1 1 34 ASP O O -16.425 1.222 0.779 1.00 . A A . 34 ASP O 1 1 1 537 1 1 34 ASP OD1 O -18.145 1.276 5.356 1.00 . A A . 34 ASP OD1 1 1 1 538 1 1 34 ASP OD2 O -16.674 -0.103 4.483 1.00 . A A . 34 ASP OD2 1 1 1 539 1 1 35 CYS C C -13.874 1.430 3.609 1.00 . A A . 35 CYS C 1 1 1 540 1 1 35 CYS CA C -14.630 2.287 2.602 1.00 . A A . 35 CYS CA 1 1 1 541 1 1 35 CYS CB C -14.207 3.750 2.744 1.00 . A A . 35 CYS CB 1 1 1 542 1 1 35 CYS H H -16.469 2.466 3.634 1.00 . A A . 35 CYS H 1 1 1 543 1 1 35 CYS HA H -14.394 1.947 1.604 1.00 . A A . 35 CYS HA 1 1 1 544 1 1 35 CYS HB2 H -14.400 4.076 3.755 1.00 . A A . 35 CYS HB2 1 1 1 545 1 1 35 CYS HB3 H -13.150 3.833 2.541 1.00 . A A . 35 CYS HB3 1 1 1 546 1 1 35 CYS HG H -16.288 4.395 1.415 1.00 . A A . 35 CYS HG 1 1 1 547 1 1 35 CYS N N -16.069 2.158 2.793 1.00 . A A . 35 CYS N 1 1 1 548 1 1 35 CYS O O -13.989 1.632 4.818 1.00 . A A . 35 CYS O 1 1 1 549 1 1 35 CYS SG S -15.073 4.880 1.627 1.00 . A A . 35 CYS SG 1 1 1 550 1 1 36 GLU C C -10.845 -0.117 3.911 1.00 . A A . 36 GLU C 1 1 1 551 1 1 36 GLU CA C -12.337 -0.414 3.977 1.00 . A A . 36 GLU CA 1 1 1 552 1 1 36 GLU CB C -12.578 -1.869 3.603 1.00 . A A . 36 GLU CB 1 1 1 553 1 1 36 GLU CD C -14.167 -3.832 3.638 1.00 . A A . 36 GLU CD 1 1 1 554 1 1 36 GLU CG C -13.895 -2.422 4.123 1.00 . A A . 36 GLU CG 1 1 1 555 1 1 36 GLU H H -13.045 0.357 2.138 1.00 . A A . 36 GLU H 1 1 1 556 1 1 36 GLU HA H -12.676 -0.254 4.988 1.00 . A A . 36 GLU HA 1 1 1 557 1 1 36 GLU HB2 H -12.571 -1.960 2.527 1.00 . A A . 36 GLU HB2 1 1 1 558 1 1 36 GLU HB3 H -11.773 -2.458 4.012 1.00 . A A . 36 GLU HB3 1 1 1 559 1 1 36 GLU HG2 H -13.866 -2.429 5.202 1.00 . A A . 36 GLU HG2 1 1 1 560 1 1 36 GLU HG3 H -14.697 -1.780 3.790 1.00 . A A . 36 GLU HG3 1 1 1 561 1 1 36 GLU N N -13.101 0.472 3.109 1.00 . A A . 36 GLU N 1 1 1 562 1 1 36 GLU O O -10.368 0.544 2.993 1.00 . A A . 36 GLU O 1 1 1 563 1 1 36 GLU OE1 O -13.493 -4.766 4.120 1.00 . A A . 36 GLU OE1 1 1 1 564 1 1 36 GLU OE2 O -15.052 -4.001 2.772 1.00 . A A . 36 GLU OE2 1 1 1 565 1 1 37 TRP C C -7.905 -1.497 4.222 1.00 . A A . 37 TRP C 1 1 1 566 1 1 37 TRP CA C -8.677 -0.436 4.991 1.00 . A A . 37 TRP CA 1 1 1 567 1 1 37 TRP CB C -8.241 -0.472 6.458 1.00 . A A . 37 TRP CB 1 1 1 568 1 1 37 TRP CD1 C -8.594 2.038 6.745 1.00 . A A . 37 TRP CD1 1 1 1 569 1 1 37 TRP CD2 C -9.022 0.845 8.588 1.00 . A A . 37 TRP CD2 1 1 1 570 1 1 37 TRP CE2 C -9.253 2.204 8.870 1.00 . A A . 37 TRP CE2 1 1 1 571 1 1 37 TRP CE3 C -9.228 -0.098 9.600 1.00 . A A . 37 TRP CE3 1 1 1 572 1 1 37 TRP CG C -8.605 0.763 7.219 1.00 . A A . 37 TRP CG 1 1 1 573 1 1 37 TRP CH2 C -9.868 1.699 11.094 1.00 . A A . 37 TRP CH2 1 1 1 574 1 1 37 TRP CZ2 C -9.676 2.643 10.122 1.00 . A A . 37 TRP CZ2 1 1 1 575 1 1 37 TRP CZ3 C -9.647 0.338 10.842 1.00 . A A . 37 TRP CZ3 1 1 1 576 1 1 37 TRP H H -10.572 -1.142 5.588 1.00 . A A . 37 TRP H 1 1 1 577 1 1 37 TRP HA H -8.437 0.528 4.582 1.00 . A A . 37 TRP HA 1 1 1 578 1 1 37 TRP HB2 H -8.710 -1.314 6.946 1.00 . A A . 37 TRP HB2 1 1 1 579 1 1 37 TRP HB3 H -7.168 -0.589 6.504 1.00 . A A . 37 TRP HB3 1 1 1 580 1 1 37 TRP HD1 H -8.318 2.304 5.737 1.00 . A A . 37 TRP HD1 1 1 1 581 1 1 37 TRP HE1 H -9.059 3.886 7.629 1.00 . A A . 37 TRP HE1 1 1 1 582 1 1 37 TRP HE3 H -9.062 -1.152 9.425 1.00 . A A . 37 TRP HE3 1 1 1 583 1 1 37 TRP HH2 H -10.195 1.995 12.079 1.00 . A A . 37 TRP HH2 1 1 1 584 1 1 37 TRP HZ2 H -9.851 3.688 10.332 1.00 . A A . 37 TRP HZ2 1 1 1 585 1 1 37 TRP HZ3 H -9.810 -0.375 11.637 1.00 . A A . 37 TRP HZ3 1 1 1 586 1 1 37 TRP N N -10.119 -0.632 4.895 1.00 . A A . 37 TRP N 1 1 1 587 1 1 37 TRP NE1 N -8.985 2.913 7.729 1.00 . A A . 37 TRP NE1 1 1 1 588 1 1 37 TRP O O -8.337 -2.643 4.102 1.00 . A A . 37 TRP O 1 1 1 589 1 1 38 VAL C C -4.930 -2.690 3.926 1.00 . A A . 38 VAL C 1 1 1 590 1 1 38 VAL CA C -5.874 -1.978 2.963 1.00 . A A . 38 VAL CA 1 1 1 591 1 1 38 VAL CB C -5.065 -1.191 1.904 1.00 . A A . 38 VAL CB 1 1 1 592 1 1 38 VAL CG1 C -3.909 -2.011 1.340 1.00 . A A . 38 VAL CG1 1 1 1 593 1 1 38 VAL CG2 C -5.979 -0.718 0.786 1.00 . A A . 38 VAL CG2 1 1 1 594 1 1 38 VAL H H -6.499 -0.147 3.803 1.00 . A A . 38 VAL H 1 1 1 595 1 1 38 VAL HA H -6.482 -2.711 2.460 1.00 . A A . 38 VAL HA 1 1 1 596 1 1 38 VAL HB H -4.656 -0.321 2.382 1.00 . A A . 38 VAL HB 1 1 1 597 1 1 38 VAL HG11 H -3.244 -2.293 2.142 1.00 . A A . 38 VAL HG11 1 1 1 598 1 1 38 VAL HG12 H -3.368 -1.416 0.620 1.00 . A A . 38 VAL HG12 1 1 1 599 1 1 38 VAL HG13 H -4.295 -2.897 0.860 1.00 . A A . 38 VAL HG13 1 1 1 600 1 1 38 VAL HG21 H -5.384 -0.286 -0.007 1.00 . A A . 38 VAL HG21 1 1 1 601 1 1 38 VAL HG22 H -6.659 0.027 1.171 1.00 . A A . 38 VAL HG22 1 1 1 602 1 1 38 VAL HG23 H -6.542 -1.555 0.400 1.00 . A A . 38 VAL HG23 1 1 1 603 1 1 38 VAL N N -6.752 -1.088 3.704 1.00 . A A . 38 VAL N 1 1 1 604 1 1 38 VAL O O -4.744 -2.255 5.062 1.00 . A A . 38 VAL O 1 1 1 605 1 1 39 LYS C C -2.041 -3.962 4.364 1.00 . A A . 39 LYS C 1 1 1 606 1 1 39 LYS CA C -3.438 -4.561 4.301 1.00 . A A . 39 LYS CA 1 1 1 607 1 1 39 LYS CB C -3.369 -6.007 3.806 1.00 . A A . 39 LYS CB 1 1 1 608 1 1 39 LYS CD C -2.377 -8.301 4.060 1.00 . A A . 39 LYS CD 1 1 1 609 1 1 39 LYS CE C -1.438 -9.184 4.866 1.00 . A A . 39 LYS CE 1 1 1 610 1 1 39 LYS CG C -2.427 -6.886 4.614 1.00 . A A . 39 LYS CG 1 1 1 611 1 1 39 LYS H H -4.512 -4.073 2.546 1.00 . A A . 39 LYS H 1 1 1 612 1 1 39 LYS HA H -3.846 -4.553 5.293 1.00 . A A . 39 LYS HA 1 1 1 613 1 1 39 LYS HB2 H -4.358 -6.439 3.853 1.00 . A A . 39 LYS HB2 1 1 1 614 1 1 39 LYS HB3 H -3.034 -6.008 2.779 1.00 . A A . 39 LYS HB3 1 1 1 615 1 1 39 LYS HD2 H -3.369 -8.725 4.091 1.00 . A A . 39 LYS HD2 1 1 1 616 1 1 39 LYS HD3 H -2.031 -8.262 3.038 1.00 . A A . 39 LYS HD3 1 1 1 617 1 1 39 LYS HE2 H -0.451 -8.745 4.853 1.00 . A A . 39 LYS HE2 1 1 1 618 1 1 39 LYS HE3 H -1.795 -9.232 5.885 1.00 . A A . 39 LYS HE3 1 1 1 619 1 1 39 LYS HG2 H -1.436 -6.462 4.580 1.00 . A A . 39 LYS HG2 1 1 1 620 1 1 39 LYS HG3 H -2.773 -6.921 5.637 1.00 . A A . 39 LYS HG3 1 1 1 621 1 1 39 LYS HZ1 H -2.307 -10.998 4.304 1.00 . A A . 39 LYS HZ1 1 1 1 622 1 1 39 LYS HZ2 H -0.730 -11.148 4.897 1.00 . A A . 39 LYS HZ2 1 1 1 623 1 1 39 LYS HZ3 H -0.994 -10.540 3.342 1.00 . A A . 39 LYS HZ3 1 1 1 624 1 1 39 LYS N N -4.338 -3.783 3.466 1.00 . A A . 39 LYS N 1 1 1 625 1 1 39 LYS NZ N -1.362 -10.564 4.314 1.00 . A A . 39 LYS NZ 1 1 1 626 1 1 39 LYS O O -1.272 -4.033 3.407 1.00 . A A . 39 LYS O 1 1 1 627 1 1 40 GLY C C 0.504 -3.692 6.492 1.00 . A A . 40 GLY C 1 1 1 628 1 1 40 GLY CA C -0.419 -2.785 5.716 1.00 . A A . 40 GLY CA 1 1 1 629 1 1 40 GLY H H -2.398 -3.325 6.222 1.00 . A A . 40 GLY H 1 1 1 630 1 1 40 GLY HA2 H 0.026 -2.605 4.754 1.00 . A A . 40 GLY HA2 1 1 1 631 1 1 40 GLY HA3 H -0.521 -1.850 6.242 1.00 . A A . 40 GLY HA3 1 1 1 632 1 1 40 GLY N N -1.727 -3.373 5.513 1.00 . A A . 40 GLY N 1 1 1 633 1 1 40 GLY O O 1.259 -3.245 7.355 1.00 . A A . 40 GLY O 1 1 1 634 1 1 41 VAL C C 2.228 -6.560 5.791 1.00 . A A . 41 VAL C 1 1 1 635 1 1 41 VAL CA C 1.281 -5.965 6.824 1.00 . A A . 41 VAL CA 1 1 1 636 1 1 41 VAL CB C 0.487 -7.123 7.452 1.00 . A A . 41 VAL CB 1 1 1 637 1 1 41 VAL CG1 C 1.274 -7.748 8.595 1.00 . A A . 41 VAL CG1 1 1 1 638 1 1 41 VAL CG2 C -0.886 -6.665 7.925 1.00 . A A . 41 VAL CG2 1 1 1 639 1 1 41 VAL H H -0.232 -5.270 5.528 1.00 . A A . 41 VAL H 1 1 1 640 1 1 41 VAL HA H 1.856 -5.475 7.596 1.00 . A A . 41 VAL HA 1 1 1 641 1 1 41 VAL HB H 0.354 -7.878 6.692 1.00 . A A . 41 VAL HB 1 1 1 642 1 1 41 VAL HG11 H 0.678 -8.519 9.062 1.00 . A A . 41 VAL HG11 1 1 1 643 1 1 41 VAL HG12 H 1.516 -6.989 9.323 1.00 . A A . 41 VAL HG12 1 1 1 644 1 1 41 VAL HG13 H 2.185 -8.181 8.210 1.00 . A A . 41 VAL HG13 1 1 1 645 1 1 41 VAL HG21 H -0.770 -5.896 8.674 1.00 . A A . 41 VAL HG21 1 1 1 646 1 1 41 VAL HG22 H -1.420 -7.503 8.347 1.00 . A A . 41 VAL HG22 1 1 1 647 1 1 41 VAL HG23 H -1.442 -6.269 7.087 1.00 . A A . 41 VAL HG23 1 1 1 648 1 1 41 VAL N N 0.423 -4.976 6.194 1.00 . A A . 41 VAL N 1 1 1 649 1 1 41 VAL O O 3.047 -7.421 6.116 1.00 . A A . 41 VAL O 1 1 1 650 1 1 42 HIS C C 4.354 -6.048 3.575 1.00 . A A . 42 HIS C 1 1 1 651 1 1 42 HIS CA C 2.969 -6.623 3.485 1.00 . A A . 42 HIS CA 1 1 1 652 1 1 42 HIS CB C 2.337 -6.400 2.113 1.00 . A A . 42 HIS CB 1 1 1 653 1 1 42 HIS CD2 C 2.562 -8.637 0.812 1.00 . A A . 42 HIS CD2 1 1 1 654 1 1 42 HIS CE1 C 0.457 -9.244 0.858 1.00 . A A . 42 HIS CE1 1 1 1 655 1 1 42 HIS CG C 1.875 -7.674 1.475 1.00 . A A . 42 HIS CG 1 1 1 656 1 1 42 HIS H H 1.473 -5.388 4.330 1.00 . A A . 42 HIS H 1 1 1 657 1 1 42 HIS HA H 3.067 -7.670 3.653 1.00 . A A . 42 HIS HA 1 1 1 658 1 1 42 HIS HB2 H 1.476 -5.757 2.223 1.00 . A A . 42 HIS HB2 1 1 1 659 1 1 42 HIS HB3 H 3.056 -5.934 1.456 1.00 . A A . 42 HIS HB3 1 1 1 660 1 1 42 HIS HD1 H -0.189 -7.601 1.892 1.00 . A A . 42 HIS HD1 1 1 1 661 1 1 42 HIS HD2 H 3.622 -8.637 0.600 1.00 . A A . 42 HIS HD2 1 1 1 662 1 1 42 HIS HE1 H -0.455 -9.803 0.707 1.00 . A A . 42 HIS HE1 1 1 1 663 1 1 42 HIS HE2 H 1.853 -10.379 -0.119 1.00 . A A . 42 HIS HE2 1 1 1 664 1 1 42 HIS N N 2.121 -6.100 4.541 1.00 . A A . 42 HIS N 1 1 1 665 1 1 42 HIS ND1 N 0.559 -8.086 1.485 1.00 . A A . 42 HIS ND1 1 1 1 666 1 1 42 HIS NE2 N 1.657 -9.600 0.441 1.00 . A A . 42 HIS NE2 1 1 1 667 1 1 42 HIS O O 4.741 -5.170 2.806 1.00 . A A . 42 HIS O 1 1 1 668 1 1 43 VAL C C 7.367 -6.322 3.587 1.00 . A A . 43 VAL C 1 1 1 669 1 1 43 VAL CA C 6.465 -6.208 4.801 1.00 . A A . 43 VAL CA 1 1 1 670 1 1 43 VAL CB C 7.056 -7.034 5.966 1.00 . A A . 43 VAL CB 1 1 1 671 1 1 43 VAL CG1 C 6.947 -8.526 5.682 1.00 . A A . 43 VAL CG1 1 1 1 672 1 1 43 VAL CG2 C 8.502 -6.641 6.239 1.00 . A A . 43 VAL CG2 1 1 1 673 1 1 43 VAL H H 4.682 -7.310 5.075 1.00 . A A . 43 VAL H 1 1 1 674 1 1 43 VAL HA H 6.449 -5.180 5.101 1.00 . A A . 43 VAL HA 1 1 1 675 1 1 43 VAL HB H 6.477 -6.819 6.851 1.00 . A A . 43 VAL HB 1 1 1 676 1 1 43 VAL HG11 H 7.626 -8.794 4.887 1.00 . A A . 43 VAL HG11 1 1 1 677 1 1 43 VAL HG12 H 5.937 -8.763 5.385 1.00 . A A . 43 VAL HG12 1 1 1 678 1 1 43 VAL HG13 H 7.200 -9.080 6.574 1.00 . A A . 43 VAL HG13 1 1 1 679 1 1 43 VAL HG21 H 8.880 -7.217 7.071 1.00 . A A . 43 VAL HG21 1 1 1 680 1 1 43 VAL HG22 H 8.550 -5.591 6.479 1.00 . A A . 43 VAL HG22 1 1 1 681 1 1 43 VAL HG23 H 9.101 -6.837 5.363 1.00 . A A . 43 VAL HG23 1 1 1 682 1 1 43 VAL N N 5.095 -6.609 4.521 1.00 . A A . 43 VAL N 1 1 1 683 1 1 43 VAL O O 8.153 -7.258 3.452 1.00 . A A . 43 VAL O 1 1 1 684 1 1 44 ALA C C 9.274 -4.421 1.807 1.00 . A A . 44 ALA C 1 1 1 685 1 1 44 ALA CA C 8.059 -5.278 1.518 1.00 . A A . 44 ALA CA 1 1 1 686 1 1 44 ALA CB C 7.269 -4.732 0.342 1.00 . A A . 44 ALA CB 1 1 1 687 1 1 44 ALA H H 6.556 -4.661 2.854 1.00 . A A . 44 ALA H 1 1 1 688 1 1 44 ALA HA H 8.392 -6.275 1.284 1.00 . A A . 44 ALA HA 1 1 1 689 1 1 44 ALA HB1 H 6.283 -5.174 0.334 1.00 . A A . 44 ALA HB1 1 1 1 690 1 1 44 ALA HB2 H 7.779 -4.975 -0.576 1.00 . A A . 44 ALA HB2 1 1 1 691 1 1 44 ALA HB3 H 7.181 -3.659 0.433 1.00 . A A . 44 ALA HB3 1 1 1 692 1 1 44 ALA N N 7.234 -5.350 2.703 1.00 . A A . 44 ALA N 1 1 1 693 1 1 44 ALA O O 9.613 -3.514 1.048 1.00 . A A . 44 ALA O 1 1 1 694 1 1 45 GLU C C 12.084 -3.841 2.193 1.00 . A A . 45 GLU C 1 1 1 695 1 1 45 GLU CA C 11.112 -3.991 3.350 1.00 . A A . 45 GLU CA 1 1 1 696 1 1 45 GLU CB C 11.792 -4.707 4.518 1.00 . A A . 45 GLU CB 1 1 1 697 1 1 45 GLU CD C 13.700 -4.730 6.175 1.00 . A A . 45 GLU CD 1 1 1 698 1 1 45 GLU CG C 13.054 -4.014 5.004 1.00 . A A . 45 GLU CG 1 1 1 699 1 1 45 GLU H H 9.618 -5.484 3.455 1.00 . A A . 45 GLU H 1 1 1 700 1 1 45 GLU HA H 10.793 -3.010 3.671 1.00 . A A . 45 GLU HA 1 1 1 701 1 1 45 GLU HB2 H 11.098 -4.764 5.344 1.00 . A A . 45 GLU HB2 1 1 1 702 1 1 45 GLU HB3 H 12.053 -5.708 4.209 1.00 . A A . 45 GLU HB3 1 1 1 703 1 1 45 GLU HG2 H 13.765 -3.976 4.191 1.00 . A A . 45 GLU HG2 1 1 1 704 1 1 45 GLU HG3 H 12.803 -3.009 5.309 1.00 . A A . 45 GLU HG3 1 1 1 705 1 1 45 GLU N N 9.929 -4.727 2.921 1.00 . A A . 45 GLU N 1 1 1 706 1 1 45 GLU O O 12.862 -2.890 2.136 1.00 . A A . 45 GLU O 1 1 1 707 1 1 45 GLU OE1 O 14.502 -5.656 5.936 1.00 . A A . 45 GLU OE1 1 1 1 708 1 1 45 GLU OE2 O 13.402 -4.364 7.332 1.00 . A A . 45 GLU OE2 1 1 1 709 1 1 46 ASP C C 12.380 -3.721 -0.880 1.00 . A A . 46 ASP C 1 1 1 710 1 1 46 ASP CA C 12.883 -4.765 0.097 1.00 . A A . 46 ASP CA 1 1 1 711 1 1 46 ASP CB C 12.922 -6.138 -0.570 1.00 . A A . 46 ASP CB 1 1 1 712 1 1 46 ASP CG C 13.920 -6.201 -1.710 1.00 . A A . 46 ASP CG 1 1 1 713 1 1 46 ASP H H 11.385 -5.530 1.386 1.00 . A A . 46 ASP H 1 1 1 714 1 1 46 ASP HA H 13.879 -4.491 0.410 1.00 . A A . 46 ASP HA 1 1 1 715 1 1 46 ASP HB2 H 13.196 -6.879 0.165 1.00 . A A . 46 ASP HB2 1 1 1 716 1 1 46 ASP HB3 H 11.941 -6.368 -0.959 1.00 . A A . 46 ASP HB3 1 1 1 717 1 1 46 ASP N N 12.025 -4.792 1.272 1.00 . A A . 46 ASP N 1 1 1 718 1 1 46 ASP O O 13.160 -2.962 -1.443 1.00 . A A . 46 ASP O 1 1 1 719 1 1 46 ASP OD1 O 13.550 -5.828 -2.843 1.00 . A A . 46 ASP OD1 1 1 1 720 1 1 46 ASP OD2 O 15.071 -6.622 -1.469 1.00 . A A . 46 ASP OD2 1 1 1 721 1 1 47 VAL C C 10.731 -1.300 -1.428 1.00 . A A . 47 VAL C 1 1 1 722 1 1 47 VAL CA C 10.478 -2.702 -1.969 1.00 . A A . 47 VAL CA 1 1 1 723 1 1 47 VAL CB C 8.963 -2.933 -2.135 1.00 . A A . 47 VAL CB 1 1 1 724 1 1 47 VAL CG1 C 8.348 -1.856 -3.014 1.00 . A A . 47 VAL CG1 1 1 1 725 1 1 47 VAL CG2 C 8.699 -4.314 -2.718 1.00 . A A . 47 VAL CG2 1 1 1 726 1 1 47 VAL H H 10.489 -4.308 -0.592 1.00 . A A . 47 VAL H 1 1 1 727 1 1 47 VAL HA H 10.952 -2.800 -2.935 1.00 . A A . 47 VAL HA 1 1 1 728 1 1 47 VAL HB H 8.499 -2.884 -1.159 1.00 . A A . 47 VAL HB 1 1 1 729 1 1 47 VAL HG11 H 8.659 -0.884 -2.663 1.00 . A A . 47 VAL HG11 1 1 1 730 1 1 47 VAL HG12 H 7.271 -1.927 -2.969 1.00 . A A . 47 VAL HG12 1 1 1 731 1 1 47 VAL HG13 H 8.676 -1.995 -4.032 1.00 . A A . 47 VAL HG13 1 1 1 732 1 1 47 VAL HG21 H 7.635 -4.467 -2.812 1.00 . A A . 47 VAL HG21 1 1 1 733 1 1 47 VAL HG22 H 9.116 -5.066 -2.064 1.00 . A A . 47 VAL HG22 1 1 1 734 1 1 47 VAL HG23 H 9.161 -4.387 -3.691 1.00 . A A . 47 VAL HG23 1 1 1 735 1 1 47 VAL N N 11.069 -3.677 -1.072 1.00 . A A . 47 VAL N 1 1 1 736 1 1 47 VAL O O 11.155 -0.427 -2.150 1.00 . A A . 47 VAL O 1 1 1 737 1 1 48 ALA C C 12.121 0.481 0.726 1.00 . A A . 48 ALA C 1 1 1 738 1 1 48 ALA CA C 10.653 0.096 0.627 1.00 . A A . 48 ALA CA 1 1 1 739 1 1 48 ALA CB C 10.079 -0.081 2.025 1.00 . A A . 48 ALA CB 1 1 1 740 1 1 48 ALA H H 10.160 -1.905 0.328 1.00 . A A . 48 ALA H 1 1 1 741 1 1 48 ALA HA H 10.103 0.888 0.149 1.00 . A A . 48 ALA HA 1 1 1 742 1 1 48 ALA HB1 H 9.024 -0.303 1.955 1.00 . A A . 48 ALA HB1 1 1 1 743 1 1 48 ALA HB2 H 10.218 0.830 2.588 1.00 . A A . 48 ALA HB2 1 1 1 744 1 1 48 ALA HB3 H 10.587 -0.895 2.522 1.00 . A A . 48 ALA HB3 1 1 1 745 1 1 48 ALA N N 10.477 -1.146 -0.135 1.00 . A A . 48 ALA N 1 1 1 746 1 1 48 ALA O O 12.507 1.591 0.360 1.00 . A A . 48 ALA O 1 1 1 747 1 1 49 LYS C C 14.967 0.098 -0.006 1.00 . A A . 49 LYS C 1 1 1 748 1 1 49 LYS CA C 14.370 -0.190 1.362 1.00 . A A . 49 LYS CA 1 1 1 749 1 1 49 LYS CB C 15.069 -1.392 2.000 1.00 . A A . 49 LYS CB 1 1 1 750 1 1 49 LYS CD C 17.222 -2.416 2.795 1.00 . A A . 49 LYS CD 1 1 1 751 1 1 49 LYS CE C 16.533 -2.978 4.028 1.00 . A A . 49 LYS CE 1 1 1 752 1 1 49 LYS CG C 16.539 -1.151 2.301 1.00 . A A . 49 LYS CG 1 1 1 753 1 1 49 LYS H H 12.578 -1.314 1.496 1.00 . A A . 49 LYS H 1 1 1 754 1 1 49 LYS HA H 14.499 0.677 1.993 1.00 . A A . 49 LYS HA 1 1 1 755 1 1 49 LYS HB2 H 14.570 -1.633 2.927 1.00 . A A . 49 LYS HB2 1 1 1 756 1 1 49 LYS HB3 H 14.993 -2.235 1.330 1.00 . A A . 49 LYS HB3 1 1 1 757 1 1 49 LYS HD2 H 17.196 -3.159 2.011 1.00 . A A . 49 LYS HD2 1 1 1 758 1 1 49 LYS HD3 H 18.248 -2.186 3.040 1.00 . A A . 49 LYS HD3 1 1 1 759 1 1 49 LYS HE2 H 15.508 -3.210 3.779 1.00 . A A . 49 LYS HE2 1 1 1 760 1 1 49 LYS HE3 H 17.043 -3.883 4.328 1.00 . A A . 49 LYS HE3 1 1 1 761 1 1 49 LYS HG2 H 17.030 -0.818 1.399 1.00 . A A . 49 LYS HG2 1 1 1 762 1 1 49 LYS HG3 H 16.620 -0.389 3.060 1.00 . A A . 49 LYS HG3 1 1 1 763 1 1 49 LYS HZ1 H 16.056 -1.139 4.896 1.00 . A A . 49 LYS HZ1 1 1 1 764 1 1 49 LYS HZ2 H 17.530 -1.782 5.420 1.00 . A A . 49 LYS HZ2 1 1 1 765 1 1 49 LYS HZ3 H 16.075 -2.428 5.990 1.00 . A A . 49 LYS HZ3 1 1 1 766 1 1 49 LYS N N 12.941 -0.442 1.225 1.00 . A A . 49 LYS N 1 1 1 767 1 1 49 LYS NZ N 16.550 -2.014 5.163 1.00 . A A . 49 LYS NZ 1 1 1 768 1 1 49 LYS O O 15.910 0.876 -0.143 1.00 . A A . 49 LYS O 1 1 1 769 1 1 50 ASP C C 14.045 0.735 -3.069 1.00 . A A . 50 ASP C 1 1 1 770 1 1 50 ASP CA C 14.853 -0.371 -2.387 1.00 . A A . 50 ASP CA 1 1 1 771 1 1 50 ASP CB C 14.713 -1.681 -3.164 1.00 . A A . 50 ASP CB 1 1 1 772 1 1 50 ASP CG C 15.587 -1.717 -4.403 1.00 . A A . 50 ASP CG 1 1 1 773 1 1 50 ASP H H 13.665 -1.162 -0.834 1.00 . A A . 50 ASP H 1 1 1 774 1 1 50 ASP HA H 15.892 -0.082 -2.364 1.00 . A A . 50 ASP HA 1 1 1 775 1 1 50 ASP HB2 H 14.992 -2.505 -2.519 1.00 . A A . 50 ASP HB2 1 1 1 776 1 1 50 ASP HB3 H 13.683 -1.802 -3.467 1.00 . A A . 50 ASP HB3 1 1 1 777 1 1 50 ASP N N 14.408 -0.552 -1.015 1.00 . A A . 50 ASP N 1 1 1 778 1 1 50 ASP O O 14.395 1.185 -4.160 1.00 . A A . 50 ASP O 1 1 1 779 1 1 50 ASP OD1 O 15.118 -1.275 -5.472 1.00 . A A . 50 ASP OD1 1 1 1 780 1 1 50 ASP OD2 O 16.739 -2.187 -4.303 1.00 . A A . 50 ASP OD2 1 1 1 781 1 1 51 TYR C C 12.673 3.574 -2.641 1.00 . A A . 51 TYR C 1 1 1 782 1 1 51 TYR CA C 12.112 2.206 -2.976 1.00 . A A . 51 TYR CA 1 1 1 783 1 1 51 TYR CB C 10.684 2.119 -2.452 1.00 . A A . 51 TYR CB 1 1 1 784 1 1 51 TYR CD1 C 10.158 0.623 -4.442 1.00 . A A . 51 TYR CD1 1 1 1 785 1 1 51 TYR CD2 C 8.334 1.543 -3.209 1.00 . A A . 51 TYR CD2 1 1 1 786 1 1 51 TYR CE1 C 9.270 -0.006 -5.292 1.00 . A A . 51 TYR CE1 1 1 1 787 1 1 51 TYR CE2 C 7.442 0.910 -4.055 1.00 . A A . 51 TYR CE2 1 1 1 788 1 1 51 TYR CG C 9.709 1.412 -3.383 1.00 . A A . 51 TYR CG 1 1 1 789 1 1 51 TYR CZ C 7.915 0.141 -5.095 1.00 . A A . 51 TYR CZ 1 1 1 790 1 1 51 TYR H H 12.723 0.782 -1.566 1.00 . A A . 51 TYR H 1 1 1 791 1 1 51 TYR HA H 12.091 2.056 -4.021 1.00 . A A . 51 TYR HA 1 1 1 792 1 1 51 TYR HB2 H 10.704 1.590 -1.530 1.00 . A A . 51 TYR HB2 1 1 1 793 1 1 51 TYR HB3 H 10.310 3.118 -2.277 1.00 . A A . 51 TYR HB3 1 1 1 794 1 1 51 TYR HD1 H 11.218 0.500 -4.596 1.00 . A A . 51 TYR HD1 1 1 1 795 1 1 51 TYR HD2 H 7.961 2.142 -2.392 1.00 . A A . 51 TYR HD2 1 1 1 796 1 1 51 TYR HE1 H 9.640 -0.613 -6.105 1.00 . A A . 51 TYR HE1 1 1 1 797 1 1 51 TYR HE2 H 6.380 1.025 -3.903 1.00 . A A . 51 TYR HE2 1 1 1 798 1 1 51 TYR HH H 6.342 0.134 -6.201 1.00 . A A . 51 TYR HH 1 1 1 799 1 1 51 TYR N N 12.958 1.168 -2.424 1.00 . A A . 51 TYR N 1 1 1 800 1 1 51 TYR O O 13.062 4.341 -3.521 1.00 . A A . 51 TYR O 1 1 1 801 1 1 51 TYR OH O 7.028 -0.485 -5.942 1.00 . A A . 51 TYR OH 1 1 1 802 1 1 52 GLU C C 14.728 5.085 -0.661 1.00 . A A . 52 GLU C 1 1 1 803 1 1 52 GLU CA C 13.218 5.137 -0.862 1.00 . A A . 52 GLU CA 1 1 1 804 1 1 52 GLU CB C 12.529 5.523 0.452 1.00 . A A . 52 GLU CB 1 1 1 805 1 1 52 GLU CD C 12.301 5.111 2.939 1.00 . A A . 52 GLU CD 1 1 1 806 1 1 52 GLU CG C 12.994 4.708 1.651 1.00 . A A . 52 GLU CG 1 1 1 807 1 1 52 GLU H H 12.410 3.191 -0.697 1.00 . A A . 52 GLU H 1 1 1 808 1 1 52 GLU HA H 12.986 5.875 -1.608 1.00 . A A . 52 GLU HA 1 1 1 809 1 1 52 GLU HB2 H 12.727 6.565 0.654 1.00 . A A . 52 GLU HB2 1 1 1 810 1 1 52 GLU HB3 H 11.464 5.384 0.341 1.00 . A A . 52 GLU HB3 1 1 1 811 1 1 52 GLU HG2 H 12.791 3.666 1.464 1.00 . A A . 52 GLU HG2 1 1 1 812 1 1 52 GLU HG3 H 14.057 4.851 1.776 1.00 . A A . 52 GLU HG3 1 1 1 813 1 1 52 GLU N N 12.717 3.862 -1.344 1.00 . A A . 52 GLU N 1 1 1 814 1 1 52 GLU O O 15.456 5.984 -1.079 1.00 . A A . 52 GLU O 1 1 1 815 1 1 52 GLU OE1 O 12.564 6.229 3.431 1.00 . A A . 52 GLU OE1 1 1 1 816 1 1 52 GLU OE2 O 11.498 4.309 3.458 1.00 . A A . 52 GLU OE2 1 1 1 817 1 1 53 ASP C C 17.337 3.277 -0.957 1.00 . A A . 53 ASP C 1 1 1 818 1 1 53 ASP CA C 16.602 3.833 0.260 1.00 . A A . 53 ASP CA 1 1 1 819 1 1 53 ASP CB C 16.777 2.897 1.457 1.00 . A A . 53 ASP CB 1 1 1 820 1 1 53 ASP CG C 16.916 3.651 2.765 1.00 . A A . 53 ASP CG 1 1 1 821 1 1 53 ASP H H 14.549 3.338 0.288 1.00 . A A . 53 ASP H 1 1 1 822 1 1 53 ASP HA H 17.020 4.796 0.507 1.00 . A A . 53 ASP HA 1 1 1 823 1 1 53 ASP HB2 H 15.913 2.253 1.527 1.00 . A A . 53 ASP HB2 1 1 1 824 1 1 53 ASP HB3 H 17.663 2.296 1.311 1.00 . A A . 53 ASP HB3 1 1 1 825 1 1 53 ASP N N 15.185 4.019 -0.014 1.00 . A A . 53 ASP N 1 1 1 826 1 1 53 ASP O O 18.552 3.430 -1.080 1.00 . A A . 53 ASP O 1 1 1 827 1 1 53 ASP OD1 O 15.882 4.097 3.306 1.00 . A A . 53 ASP OD1 1 1 1 828 1 1 53 ASP OD2 O 18.058 3.796 3.248 1.00 . A A . 53 ASP OD2 1 1 1 829 1 1 54 GLY C C 17.729 3.144 -3.980 1.00 . A A . 54 GLY C 1 1 1 830 1 1 54 GLY CA C 17.207 2.071 -3.044 1.00 . A A . 54 GLY CA 1 1 1 831 1 1 54 GLY H H 15.633 2.537 -1.703 1.00 . A A . 54 GLY H 1 1 1 832 1 1 54 GLY HA2 H 18.028 1.434 -2.751 1.00 . A A . 54 GLY HA2 1 1 1 833 1 1 54 GLY HA3 H 16.474 1.477 -3.567 1.00 . A A . 54 GLY HA3 1 1 1 834 1 1 54 GLY N N 16.597 2.631 -1.852 1.00 . A A . 54 GLY N 1 1 1 835 1 1 54 GLY O O 18.833 3.029 -4.513 1.00 . A A . 54 GLY O 1 1 1 836 1 1 55 LEU C C 18.283 6.234 -4.341 1.00 . A A . 55 LEU C 1 1 1 837 1 1 55 LEU CA C 17.321 5.289 -5.053 1.00 . A A . 55 LEU CA 1 1 1 838 1 1 55 LEU CB C 16.083 6.058 -5.521 1.00 . A A . 55 LEU CB 1 1 1 839 1 1 55 LEU CD1 C 16.138 5.321 -7.916 1.00 . A A . 55 LEU CD1 1 1 1 840 1 1 55 LEU CD2 C 14.833 4.005 -6.238 1.00 . A A . 55 LEU CD2 1 1 1 841 1 1 55 LEU CG C 15.296 5.394 -6.652 1.00 . A A . 55 LEU CG 1 1 1 842 1 1 55 LEU H H 16.064 4.221 -3.728 1.00 . A A . 55 LEU H 1 1 1 843 1 1 55 LEU HA H 17.819 4.870 -5.914 1.00 . A A . 55 LEU HA 1 1 1 844 1 1 55 LEU HB2 H 15.422 6.181 -4.674 1.00 . A A . 55 LEU HB2 1 1 1 845 1 1 55 LEU HB3 H 16.397 7.036 -5.856 1.00 . A A . 55 LEU HB3 1 1 1 846 1 1 55 LEU HD11 H 16.986 4.673 -7.746 1.00 . A A . 55 LEU HD11 1 1 1 847 1 1 55 LEU HD12 H 16.489 6.310 -8.172 1.00 . A A . 55 LEU HD12 1 1 1 848 1 1 55 LEU HD13 H 15.541 4.929 -8.726 1.00 . A A . 55 LEU HD13 1 1 1 849 1 1 55 LEU HD21 H 14.194 4.082 -5.371 1.00 . A A . 55 LEU HD21 1 1 1 850 1 1 55 LEU HD22 H 15.692 3.396 -5.999 1.00 . A A . 55 LEU HD22 1 1 1 851 1 1 55 LEU HD23 H 14.284 3.551 -7.050 1.00 . A A . 55 LEU HD23 1 1 1 852 1 1 55 LEU HG H 14.421 5.988 -6.870 1.00 . A A . 55 LEU HG 1 1 1 853 1 1 55 LEU N N 16.933 4.189 -4.180 1.00 . A A . 55 LEU N 1 1 1 854 1 1 55 LEU O O 19.406 6.451 -4.796 1.00 . A A . 55 LEU O 1 1 1 855 1 1 56 GLU C C 19.511 6.954 -1.431 1.00 . A A . 56 GLU C 1 1 1 856 1 1 56 GLU CA C 18.660 7.711 -2.446 1.00 . A A . 56 GLU CA 1 1 1 857 1 1 56 GLU CB C 17.784 8.738 -1.730 1.00 . A A . 56 GLU CB 1 1 1 858 1 1 56 GLU CD C 17.818 10.343 -3.679 1.00 . A A . 56 GLU CD 1 1 1 859 1 1 56 GLU CG C 16.962 9.599 -2.673 1.00 . A A . 56 GLU CG 1 1 1 860 1 1 56 GLU H H 16.929 6.584 -2.911 1.00 . A A . 56 GLU H 1 1 1 861 1 1 56 GLU HA H 19.311 8.226 -3.128 1.00 . A A . 56 GLU HA 1 1 1 862 1 1 56 GLU HB2 H 17.110 8.216 -1.074 1.00 . A A . 56 GLU HB2 1 1 1 863 1 1 56 GLU HB3 H 18.416 9.387 -1.142 1.00 . A A . 56 GLU HB3 1 1 1 864 1 1 56 GLU HG2 H 16.271 8.967 -3.210 1.00 . A A . 56 GLU HG2 1 1 1 865 1 1 56 GLU HG3 H 16.408 10.322 -2.091 1.00 . A A . 56 GLU HG3 1 1 1 866 1 1 56 GLU N N 17.835 6.793 -3.221 1.00 . A A . 56 GLU N 1 1 1 867 1 1 56 GLU O O 19.360 7.132 -0.222 1.00 . A A . 56 GLU O 1 1 1 868 1 1 56 GLU OE1 O 18.281 11.457 -3.357 1.00 . A A . 56 GLU OE1 1 1 1 869 1 1 56 GLU OE2 O 18.027 9.811 -4.790 1.00 . A A . 56 GLU OE2 1 1 1 870 1 1 57 TYR C C 22.572 6.082 -0.772 1.00 . A A . 57 TYR C 1 1 1 871 1 1 57 TYR CA C 21.283 5.324 -1.071 1.00 . A A . 57 TYR CA 1 1 1 872 1 1 57 TYR CB C 21.607 3.980 -1.728 1.00 . A A . 57 TYR CB 1 1 1 873 1 1 57 TYR CD1 C 22.152 2.468 0.221 1.00 . A A . 57 TYR CD1 1 1 1 874 1 1 57 TYR CD2 C 23.891 2.984 -1.324 1.00 . A A . 57 TYR CD2 1 1 1 875 1 1 57 TYR CE1 C 23.027 1.689 0.953 1.00 . A A . 57 TYR CE1 1 1 1 876 1 1 57 TYR CE2 C 24.773 2.206 -0.598 1.00 . A A . 57 TYR CE2 1 1 1 877 1 1 57 TYR CG C 22.568 3.128 -0.928 1.00 . A A . 57 TYR CG 1 1 1 878 1 1 57 TYR CZ C 24.336 1.560 0.539 1.00 . A A . 57 TYR CZ 1 1 1 879 1 1 57 TYR H H 20.478 6.013 -2.904 1.00 . A A . 57 TYR H 1 1 1 880 1 1 57 TYR HA H 20.763 5.144 -0.143 1.00 . A A . 57 TYR HA 1 1 1 881 1 1 57 TYR HB2 H 20.693 3.419 -1.853 1.00 . A A . 57 TYR HB2 1 1 1 882 1 1 57 TYR HB3 H 22.049 4.159 -2.697 1.00 . A A . 57 TYR HB3 1 1 1 883 1 1 57 TYR HD1 H 21.125 2.570 0.543 1.00 . A A . 57 TYR HD1 1 1 1 884 1 1 57 TYR HD2 H 24.231 3.491 -2.215 1.00 . A A . 57 TYR HD2 1 1 1 885 1 1 57 TYR HE1 H 22.684 1.183 1.844 1.00 . A A . 57 TYR HE1 1 1 1 886 1 1 57 TYR HE2 H 25.799 2.106 -0.922 1.00 . A A . 57 TYR HE2 1 1 1 887 1 1 57 TYR HH H 26.039 1.257 1.383 1.00 . A A . 57 TYR HH 1 1 1 888 1 1 57 TYR N N 20.406 6.110 -1.931 1.00 . A A . 57 TYR N 1 1 1 889 1 1 57 TYR O O 23.519 5.979 -1.580 1.00 . A A . 57 TYR O 1 1 1 890 1 1 57 TYR OXT O 22.625 6.770 0.269 1.00 . A A . 57 TYR OXT 1 1 1 891 1 1 57 TYR OH O 25.211 0.784 1.266 1.00 . A A . 57 TYR OH 1 1 1 892 2 2 1 ALA C C -12.190 -10.605 -4.240 1.00 . B B . 1 ALA C 1 1 1 893 2 2 1 ALA CA C -11.793 -10.998 -5.668 1.00 . B B . 1 ALA CA 1 1 1 894 2 2 1 ALA CB C -10.404 -11.622 -5.704 1.00 . B B . 1 ALA CB 1 1 1 895 2 2 1 ALA H1 H -11.623 -10.136 -7.561 1.00 . B B . 1 ALA H1 1 1 1 896 2 2 1 ALA H2 H -11.203 -9.097 -6.299 1.00 . B B . 1 ALA H2 1 1 1 897 2 2 1 ALA H3 H -12.828 -9.443 -6.597 1.00 . B B . 1 ALA H3 1 1 1 898 2 2 1 ALA HA H -12.494 -11.742 -6.020 1.00 . B B . 1 ALA HA 1 1 1 899 2 2 1 ALA HB1 H -10.354 -12.337 -6.512 1.00 . B B . 1 ALA HB1 1 1 1 900 2 2 1 ALA HB2 H -10.210 -12.123 -4.767 1.00 . B B . 1 ALA HB2 1 1 1 901 2 2 1 ALA HB3 H -9.666 -10.850 -5.861 1.00 . B B . 1 ALA HB3 1 1 1 902 2 2 1 ALA N N -11.866 -9.837 -6.594 1.00 . B B . 1 ALA N 1 1 1 903 2 2 1 ALA O O -13.278 -10.961 -3.786 1.00 . B B . 1 ALA O 1 1 1 904 2 2 2 PRO C C -12.627 -8.286 -2.075 1.00 . B B . 2 PRO C 1 1 1 905 2 2 2 PRO CA C -11.645 -9.456 -2.127 1.00 . B B . 2 PRO CA 1 1 1 906 2 2 2 PRO CB C -10.287 -9.033 -1.576 1.00 . B B . 2 PRO CB 1 1 1 907 2 2 2 PRO CD C -9.998 -9.383 -3.922 1.00 . B B . 2 PRO CD 1 1 1 908 2 2 2 PRO CG C -9.547 -8.532 -2.765 1.00 . B B . 2 PRO CG 1 1 1 909 2 2 2 PRO HA H -12.031 -10.281 -1.547 1.00 . B B . 2 PRO HA 1 1 1 910 2 2 2 PRO HB2 H -10.421 -8.259 -0.834 1.00 . B B . 2 PRO HB2 1 1 1 911 2 2 2 PRO HB3 H -9.792 -9.885 -1.134 1.00 . B B . 2 PRO HB3 1 1 1 912 2 2 2 PRO HD2 H -10.066 -8.788 -4.818 1.00 . B B . 2 PRO HD2 1 1 1 913 2 2 2 PRO HD3 H -9.316 -10.207 -4.066 1.00 . B B . 2 PRO HD3 1 1 1 914 2 2 2 PRO HG2 H -9.798 -7.496 -2.942 1.00 . B B . 2 PRO HG2 1 1 1 915 2 2 2 PRO HG3 H -8.484 -8.642 -2.610 1.00 . B B . 2 PRO HG3 1 1 1 916 2 2 2 PRO N N -11.331 -9.867 -3.500 1.00 . B B . 2 PRO N 1 1 1 917 2 2 2 PRO O O -12.280 -7.160 -2.435 1.00 . B B . 2 PRO O 1 1 1 918 2 2 3 PRO C C -14.591 -6.487 -0.418 1.00 . B B . 3 PRO C 1 1 1 919 2 2 3 PRO CA C -14.895 -7.490 -1.527 1.00 . B B . 3 PRO CA 1 1 1 920 2 2 3 PRO CB C -16.171 -8.271 -1.208 1.00 . B B . 3 PRO CB 1 1 1 921 2 2 3 PRO CD C -14.374 -9.847 -1.182 1.00 . B B . 3 PRO CD 1 1 1 922 2 2 3 PRO CG C -15.697 -9.519 -0.548 1.00 . B B . 3 PRO CG 1 1 1 923 2 2 3 PRO HA H -15.016 -6.964 -2.463 1.00 . B B . 3 PRO HA 1 1 1 924 2 2 3 PRO HB2 H -16.798 -7.689 -0.549 1.00 . B B . 3 PRO HB2 1 1 1 925 2 2 3 PRO HB3 H -16.703 -8.488 -2.122 1.00 . B B . 3 PRO HB3 1 1 1 926 2 2 3 PRO HD2 H -13.707 -10.288 -0.455 1.00 . B B . 3 PRO HD2 1 1 1 927 2 2 3 PRO HD3 H -14.512 -10.511 -2.022 1.00 . B B . 3 PRO HD3 1 1 1 928 2 2 3 PRO HG2 H -15.574 -9.349 0.512 1.00 . B B . 3 PRO HG2 1 1 1 929 2 2 3 PRO HG3 H -16.403 -10.317 -0.721 1.00 . B B . 3 PRO HG3 1 1 1 930 2 2 3 PRO N N -13.871 -8.534 -1.626 1.00 . B B . 3 PRO N 1 1 1 931 2 2 3 PRO O O -14.739 -6.791 0.765 1.00 . B B . 3 PRO O 1 1 1 932 2 2 4 GLY C C -12.523 -3.580 -0.154 1.00 . B B . 4 GLY C 1 1 1 933 2 2 4 GLY CA C -13.840 -4.262 0.157 1.00 . B B . 4 GLY CA 1 1 1 934 2 2 4 GLY H H -14.070 -5.107 -1.770 1.00 . B B . 4 GLY H 1 1 1 935 2 2 4 GLY HA2 H -14.627 -3.521 0.158 1.00 . B B . 4 GLY HA2 1 1 1 936 2 2 4 GLY HA3 H -13.778 -4.711 1.137 1.00 . B B . 4 GLY HA3 1 1 1 937 2 2 4 GLY N N -14.165 -5.291 -0.813 1.00 . B B . 4 GLY N 1 1 1 938 2 2 4 GLY O O -12.485 -2.597 -0.893 1.00 . B B . 4 GLY O 1 1 1 939 2 2 5 THR C C -9.454 -4.167 -1.049 1.00 . B B . 5 THR C 1 1 1 940 2 2 5 THR CA C -10.111 -3.557 0.183 1.00 . B B . 5 THR CA 1 1 1 941 2 2 5 THR CB C -9.189 -3.791 1.391 1.00 . B B . 5 THR CB 1 1 1 942 2 2 5 THR CG2 C -9.307 -5.219 1.903 1.00 . B B . 5 THR CG2 1 1 1 943 2 2 5 THR H H -11.542 -4.877 1.002 1.00 . B B . 5 THR H 1 1 1 944 2 2 5 THR HA H -10.211 -2.493 0.037 1.00 . B B . 5 THR HA 1 1 1 945 2 2 5 THR HB H -9.476 -3.114 2.183 1.00 . B B . 5 THR HB 1 1 1 946 2 2 5 THR HG1 H -7.468 -4.296 0.573 1.00 . B B . 5 THR HG1 1 1 1 947 2 2 5 THR HG21 H -9.211 -5.907 1.076 1.00 . B B . 5 THR HG21 1 1 1 948 2 2 5 THR HG22 H -10.270 -5.356 2.374 1.00 . B B . 5 THR HG22 1 1 1 949 2 2 5 THR HG23 H -8.525 -5.409 2.623 1.00 . B B . 5 THR HG23 1 1 1 950 2 2 5 THR N N -11.440 -4.109 0.407 1.00 . B B . 5 THR N 1 1 1 951 2 2 5 THR O O -9.944 -5.149 -1.608 1.00 . B B . 5 THR O 1 1 1 952 2 2 5 THR OG1 O -7.834 -3.528 1.016 1.00 . B B . 5 THR OG1 1 1 1 953 2 2 6 ALA C C -6.109 -4.169 -2.324 1.00 . B B . 6 ALA C 1 1 1 954 2 2 6 ALA CA C -7.602 -4.052 -2.629 1.00 . B B . 6 ALA CA 1 1 1 955 2 2 6 ALA CB C -7.834 -3.120 -3.811 1.00 . B B . 6 ALA CB 1 1 1 956 2 2 6 ALA H H -7.999 -2.799 -0.973 1.00 . B B . 6 ALA H 1 1 1 957 2 2 6 ALA HA H -7.984 -5.029 -2.889 1.00 . B B . 6 ALA HA 1 1 1 958 2 2 6 ALA HB1 H -8.886 -2.869 -3.874 1.00 . B B . 6 ALA HB1 1 1 1 959 2 2 6 ALA HB2 H -7.527 -3.611 -4.722 1.00 . B B . 6 ALA HB2 1 1 1 960 2 2 6 ALA HB3 H -7.257 -2.218 -3.677 1.00 . B B . 6 ALA HB3 1 1 1 961 2 2 6 ALA N N -8.337 -3.577 -1.464 1.00 . B B . 6 ALA N 1 1 1 962 2 2 6 ALA O O -5.657 -3.790 -1.244 1.00 . B B . 6 ALA O 1 1 1 963 2 2 7 ARG C C -3.146 -4.171 -4.241 1.00 . B B . 7 ARG C 1 1 1 964 2 2 7 ARG CA C -3.910 -4.866 -3.113 1.00 . B B . 7 ARG CA 1 1 1 965 2 2 7 ARG CB C -3.556 -6.355 -3.086 1.00 . B B . 7 ARG CB 1 1 1 966 2 2 7 ARG CD C -3.638 -8.575 -4.252 1.00 . B B . 7 ARG CD 1 1 1 967 2 2 7 ARG CG C -3.945 -7.092 -4.355 1.00 . B B . 7 ARG CG 1 1 1 968 2 2 7 ARG CZ C -3.783 -10.586 -5.655 1.00 . B B . 7 ARG CZ 1 1 1 969 2 2 7 ARG H H -5.770 -4.980 -4.121 1.00 . B B . 7 ARG H 1 1 1 970 2 2 7 ARG HA H -3.628 -4.423 -2.171 1.00 . B B . 7 ARG HA 1 1 1 971 2 2 7 ARG HB2 H -2.490 -6.460 -2.948 1.00 . B B . 7 ARG HB2 1 1 1 972 2 2 7 ARG HB3 H -4.065 -6.819 -2.254 1.00 . B B . 7 ARG HB3 1 1 1 973 2 2 7 ARG HD2 H -2.590 -8.698 -4.023 1.00 . B B . 7 ARG HD2 1 1 1 974 2 2 7 ARG HD3 H -4.232 -8.999 -3.456 1.00 . B B . 7 ARG HD3 1 1 1 975 2 2 7 ARG HE H -4.269 -8.746 -6.247 1.00 . B B . 7 ARG HE 1 1 1 976 2 2 7 ARG HG2 H -5.004 -6.965 -4.523 1.00 . B B . 7 ARG HG2 1 1 1 977 2 2 7 ARG HG3 H -3.394 -6.675 -5.184 1.00 . B B . 7 ARG HG3 1 1 1 978 2 2 7 ARG HH11 H -3.126 -10.911 -3.771 1.00 . B B . 7 ARG HH11 1 1 1 979 2 2 7 ARG HH12 H -3.228 -12.319 -4.775 1.00 . B B . 7 ARG HH12 1 1 1 980 2 2 7 ARG HH21 H -4.407 -10.587 -7.576 1.00 . B B . 7 ARG HH21 1 1 1 981 2 2 7 ARG HH22 H -3.955 -12.134 -6.942 1.00 . B B . 7 ARG HH22 1 1 1 982 2 2 7 ARG N N -5.351 -4.697 -3.281 1.00 . B B . 7 ARG N 1 1 1 983 2 2 7 ARG NE N -3.937 -9.278 -5.494 1.00 . B B . 7 ARG NE 1 1 1 984 2 2 7 ARG NH1 N -3.343 -11.333 -4.652 1.00 . B B . 7 ARG NH1 1 1 1 985 2 2 7 ARG NH2 N -4.072 -11.149 -6.820 1.00 . B B . 7 ARG NH2 1 1 1 986 2 2 7 ARG O O -3.400 -4.431 -5.416 1.00 . B B . 7 ARG O 1 1 1 987 2 2 8 ARG C C -0.968 -3.489 -6.014 1.00 . B B . 8 ARG C 1 1 1 988 2 2 8 ARG CA C -1.429 -2.557 -4.889 1.00 . B B . 8 ARG CA 1 1 1 989 2 2 8 ARG CB C -0.217 -1.894 -4.228 1.00 . B B . 8 ARG CB 1 1 1 990 2 2 8 ARG CD C -0.293 0.020 -5.856 1.00 . B B . 8 ARG CD 1 1 1 991 2 2 8 ARG CG C 0.587 -1.012 -5.169 1.00 . B B . 8 ARG CG 1 1 1 992 2 2 8 ARG CZ C -0.042 1.887 -7.437 1.00 . B B . 8 ARG CZ 1 1 1 993 2 2 8 ARG H H -2.051 -3.100 -2.933 1.00 . B B . 8 ARG H 1 1 1 994 2 2 8 ARG HA H -2.060 -1.790 -5.311 1.00 . B B . 8 ARG HA 1 1 1 995 2 2 8 ARG HB2 H -0.560 -1.285 -3.405 1.00 . B B . 8 ARG HB2 1 1 1 996 2 2 8 ARG HB3 H 0.436 -2.665 -3.845 1.00 . B B . 8 ARG HB3 1 1 1 997 2 2 8 ARG HD2 H -0.982 -0.491 -6.512 1.00 . B B . 8 ARG HD2 1 1 1 998 2 2 8 ARG HD3 H -0.848 0.561 -5.104 1.00 . B B . 8 ARG HD3 1 1 1 999 2 2 8 ARG HE H 1.469 0.916 -6.570 1.00 . B B . 8 ARG HE 1 1 1 1000 2 2 8 ARG HG2 H 1.349 -0.500 -4.604 1.00 . B B . 8 ARG HG2 1 1 1 1001 2 2 8 ARG HG3 H 1.050 -1.632 -5.918 1.00 . B B . 8 ARG HG3 1 1 1 1002 2 2 8 ARG HH11 H -1.952 1.357 -7.044 1.00 . B B . 8 ARG HH11 1 1 1 1003 2 2 8 ARG HH12 H -1.761 2.673 -8.154 1.00 . B B . 8 ARG HH12 1 1 1 1004 2 2 8 ARG HH21 H 1.734 2.646 -8.031 1.00 . B B . 8 ARG HH21 1 1 1 1005 2 2 8 ARG HH22 H 0.335 3.405 -8.716 1.00 . B B . 8 ARG HH22 1 1 1 1006 2 2 8 ARG N N -2.213 -3.280 -3.887 1.00 . B B . 8 ARG N 1 1 1 1007 2 2 8 ARG NE N 0.493 0.968 -6.641 1.00 . B B . 8 ARG NE 1 1 1 1008 2 2 8 ARG NH1 N -1.360 1.979 -7.555 1.00 . B B . 8 ARG NH1 1 1 1 1009 2 2 8 ARG NH2 N 0.740 2.713 -8.117 1.00 . B B . 8 ARG NH2 1 1 1 1010 2 2 8 ARG O O -1.281 -3.271 -7.185 1.00 . B B . 8 ARG O 1 1 1 1011 2 2 9 LYS C C 0.511 -6.838 -5.875 1.00 . B B . 9 LYS C 1 1 1 1012 2 2 9 LYS CA C 0.277 -5.512 -6.592 1.00 . B B . 9 LYS CA 1 1 1 1013 2 2 9 LYS CB C 1.575 -5.003 -7.227 1.00 . B B . 9 LYS CB 1 1 1 1014 2 2 9 LYS CD C 2.734 -3.215 -8.560 1.00 . B B . 9 LYS CD 1 1 1 1015 2 2 9 LYS CE C 2.565 -1.928 -9.351 1.00 . B B . 9 LYS CE 1 1 1 1016 2 2 9 LYS CG C 1.411 -3.695 -7.983 1.00 . B B . 9 LYS CG 1 1 1 1017 2 2 9 LYS H H -0.026 -4.643 -4.688 1.00 . B B . 9 LYS H 1 1 1 1018 2 2 9 LYS HA H -0.464 -5.655 -7.359 1.00 . B B . 9 LYS HA 1 1 1 1019 2 2 9 LYS HB2 H 2.310 -4.854 -6.449 1.00 . B B . 9 LYS HB2 1 1 1 1020 2 2 9 LYS HB3 H 1.943 -5.742 -7.920 1.00 . B B . 9 LYS HB3 1 1 1 1021 2 2 9 LYS HD2 H 3.425 -3.039 -7.749 1.00 . B B . 9 LYS HD2 1 1 1 1022 2 2 9 LYS HD3 H 3.129 -3.980 -9.213 1.00 . B B . 9 LYS HD3 1 1 1 1023 2 2 9 LYS HE2 H 3.517 -1.658 -9.782 1.00 . B B . 9 LYS HE2 1 1 1 1024 2 2 9 LYS HE3 H 1.848 -2.098 -10.141 1.00 . B B . 9 LYS HE3 1 1 1 1025 2 2 9 LYS HG2 H 0.711 -3.843 -8.791 1.00 . B B . 9 LYS HG2 1 1 1 1026 2 2 9 LYS HG3 H 1.029 -2.946 -7.308 1.00 . B B . 9 LYS HG3 1 1 1 1027 2 2 9 LYS HZ1 H 2.784 -0.606 -7.750 1.00 . B B . 9 LYS HZ1 1 1 1 1028 2 2 9 LYS HZ2 H 1.181 -1.056 -8.052 1.00 . B B . 9 LYS HZ2 1 1 1 1029 2 2 9 LYS HZ3 H 1.955 0.050 -9.070 1.00 . B B . 9 LYS HZ3 1 1 1 1030 2 2 9 LYS N N -0.233 -4.530 -5.638 1.00 . B B . 9 LYS N 1 1 1 1031 2 2 9 LYS NZ N 2.088 -0.807 -8.495 1.00 . B B . 9 LYS NZ 1 1 1 1032 2 2 9 LYS O O -0.098 -7.096 -4.840 1.00 . B B . 9 LYS O 1 1 1 1033 2 2 10 ARG C C 2.083 -8.717 -4.324 1.00 . B B . 10 ARG C 1 1 1 1034 2 2 10 ARG CA C 1.669 -8.965 -5.774 1.00 . B B . 10 ARG CA 1 1 1 1035 2 2 10 ARG CB C 2.795 -9.688 -6.512 1.00 . B B . 10 ARG CB 1 1 1 1036 2 2 10 ARG CD C 5.266 -9.818 -6.959 1.00 . B B . 10 ARG CD 1 1 1 1037 2 2 10 ARG CG C 4.127 -8.961 -6.432 1.00 . B B . 10 ARG CG 1 1 1 1038 2 2 10 ARG CZ C 6.516 -11.808 -6.226 1.00 . B B . 10 ARG CZ 1 1 1 1039 2 2 10 ARG H H 1.794 -7.481 -7.276 1.00 . B B . 10 ARG H 1 1 1 1040 2 2 10 ARG HA H 0.779 -9.573 -5.791 1.00 . B B . 10 ARG HA 1 1 1 1041 2 2 10 ARG HB2 H 2.919 -10.672 -6.082 1.00 . B B . 10 ARG HB2 1 1 1 1042 2 2 10 ARG HB3 H 2.525 -9.788 -7.552 1.00 . B B . 10 ARG HB3 1 1 1 1043 2 2 10 ARG HD2 H 5.059 -10.079 -7.986 1.00 . B B . 10 ARG HD2 1 1 1 1044 2 2 10 ARG HD3 H 6.182 -9.249 -6.909 1.00 . B B . 10 ARG HD3 1 1 1 1045 2 2 10 ARG HE H 4.688 -11.316 -5.601 1.00 . B B . 10 ARG HE 1 1 1 1046 2 2 10 ARG HG2 H 4.067 -8.059 -7.023 1.00 . B B . 10 ARG HG2 1 1 1 1047 2 2 10 ARG HG3 H 4.326 -8.706 -5.400 1.00 . B B . 10 ARG HG3 1 1 1 1048 2 2 10 ARG HH11 H 7.491 -10.634 -7.550 1.00 . B B . 10 ARG HH11 1 1 1 1049 2 2 10 ARG HH12 H 8.354 -12.041 -7.029 1.00 . B B . 10 ARG HH12 1 1 1 1050 2 2 10 ARG HH21 H 5.815 -13.172 -4.910 1.00 . B B . 10 ARG HH21 1 1 1 1051 2 2 10 ARG HH22 H 7.403 -13.483 -5.528 1.00 . B B . 10 ARG HH22 1 1 1 1052 2 2 10 ARG N N 1.368 -7.695 -6.424 1.00 . B B . 10 ARG N 1 1 1 1053 2 2 10 ARG NE N 5.428 -11.045 -6.182 1.00 . B B . 10 ARG NE 1 1 1 1054 2 2 10 ARG NH1 N 7.538 -11.466 -6.999 1.00 . B B . 10 ARG NH1 1 1 1 1055 2 2 10 ARG NH2 N 6.583 -12.911 -5.495 1.00 . B B . 10 ARG NH2 1 1 1 1056 2 2 10 ARG O O 1.942 -9.588 -3.465 1.00 . B B . 10 ARG O 1 1 1 1057 2 2 11 LYS C C 4.053 -8.116 -2.190 1.00 . B B . 11 LYS C 1 1 1 1058 2 2 11 LYS CA C 3.031 -7.128 -2.734 1.00 . B B . 11 LYS CA 1 1 1 1059 2 2 11 LYS CB C 1.847 -7.024 -1.769 1.00 . B B . 11 LYS CB 1 1 1 1060 2 2 11 LYS CD C -0.037 -5.608 -0.908 1.00 . B B . 11 LYS CD 1 1 1 1061 2 2 11 LYS CE C -1.079 -4.557 -1.255 1.00 . B B . 11 LYS CE 1 1 1 1062 2 2 11 LYS CG C 0.875 -5.901 -2.090 1.00 . B B . 11 LYS CG 1 1 1 1063 2 2 11 LYS H H 2.685 -6.869 -4.796 1.00 . B B . 11 LYS H 1 1 1 1064 2 2 11 LYS HA H 3.498 -6.160 -2.817 1.00 . B B . 11 LYS HA 1 1 1 1065 2 2 11 LYS HB2 H 1.302 -7.956 -1.783 1.00 . B B . 11 LYS HB2 1 1 1 1066 2 2 11 LYS HB3 H 2.231 -6.858 -0.777 1.00 . B B . 11 LYS HB3 1 1 1 1067 2 2 11 LYS HD2 H -0.540 -6.519 -0.622 1.00 . B B . 11 LYS HD2 1 1 1 1068 2 2 11 LYS HD3 H 0.563 -5.250 -0.085 1.00 . B B . 11 LYS HD3 1 1 1 1069 2 2 11 LYS HE2 H -0.573 -3.665 -1.591 1.00 . B B . 11 LYS HE2 1 1 1 1070 2 2 11 LYS HE3 H -1.702 -4.937 -2.051 1.00 . B B . 11 LYS HE3 1 1 1 1071 2 2 11 LYS HG2 H 1.431 -5.010 -2.329 1.00 . B B . 11 LYS HG2 1 1 1 1072 2 2 11 LYS HG3 H 0.271 -6.187 -2.933 1.00 . B B . 11 LYS HG3 1 1 1 1073 2 2 11 LYS HZ1 H -2.410 -5.071 0.272 1.00 . B B . 11 LYS HZ1 1 1 1 1074 2 2 11 LYS HZ2 H -2.659 -3.523 -0.366 1.00 . B B . 11 LYS HZ2 1 1 1 1075 2 2 11 LYS HZ3 H -1.358 -3.809 0.675 1.00 . B B . 11 LYS HZ3 1 1 1 1076 2 2 11 LYS N N 2.591 -7.513 -4.066 1.00 . B B . 11 LYS N 1 1 1 1077 2 2 11 LYS NZ N -1.936 -4.216 -0.087 1.00 . B B . 11 LYS NZ 1 1 1 1078 2 2 11 LYS O O 3.697 -9.197 -1.718 1.00 . B B . 11 LYS O 1 1 1 1079 2 2 12 ALA C C 6.545 -8.440 -0.260 1.00 . B B . 12 ALA C 1 1 1 1080 2 2 12 ALA CA C 6.395 -8.588 -1.769 1.00 . B B . 12 ALA CA 1 1 1 1081 2 2 12 ALA CB C 7.706 -8.240 -2.460 1.00 . B B . 12 ALA CB 1 1 1 1082 2 2 12 ALA H H 5.543 -6.869 -2.657 1.00 . B B . 12 ALA H 1 1 1 1083 2 2 12 ALA HA H 6.147 -9.612 -2.007 1.00 . B B . 12 ALA HA 1 1 1 1084 2 2 12 ALA HB1 H 7.537 -8.130 -3.520 1.00 . B B . 12 ALA HB1 1 1 1 1085 2 2 12 ALA HB2 H 8.423 -9.031 -2.288 1.00 . B B . 12 ALA HB2 1 1 1 1086 2 2 12 ALA HB3 H 8.090 -7.313 -2.055 1.00 . B B . 12 ALA HB3 1 1 1 1087 2 2 12 ALA N N 5.323 -7.739 -2.262 1.00 . B B . 12 ALA N 1 1 1 1088 2 2 12 ALA O O 6.850 -7.360 0.233 1.00 . B B . 12 ALA O 1 1 1 1089 2 2 13 ASP C C 7.335 -10.621 2.422 1.00 . B B . 13 ASP C 1 1 1 1090 2 2 13 ASP CA C 6.444 -9.491 1.925 1.00 . B B . 13 ASP CA 1 1 1 1091 2 2 13 ASP CB C 5.067 -9.577 2.583 1.00 . B B . 13 ASP CB 1 1 1 1092 2 2 13 ASP CG C 4.293 -10.804 2.146 1.00 . B B . 13 ASP CG 1 1 1 1093 2 2 13 ASP H H 6.073 -10.361 0.029 1.00 . B B . 13 ASP H 1 1 1 1094 2 2 13 ASP HA H 6.901 -8.549 2.194 1.00 . B B . 13 ASP HA 1 1 1 1095 2 2 13 ASP HB2 H 5.191 -9.615 3.656 1.00 . B B . 13 ASP HB2 1 1 1 1096 2 2 13 ASP HB3 H 4.495 -8.698 2.323 1.00 . B B . 13 ASP HB3 1 1 1 1097 2 2 13 ASP N N 6.323 -9.524 0.472 1.00 . B B . 13 ASP N 1 1 1 1098 2 2 13 ASP O O 6.936 -11.414 3.274 1.00 . B B . 13 ASP O 1 1 1 1099 2 2 13 ASP OD1 O 3.988 -10.914 0.940 1.00 . B B . 13 ASP OD1 1 1 1 1100 2 2 13 ASP OD2 O 3.995 -11.657 3.009 1.00 . B B . 13 ASP OD2 1 1 1 1101 2 2 14 SER C C 8.938 -13.111 1.998 1.00 . B B . 14 SER C 1 1 1 1102 2 2 14 SER CA C 9.500 -11.718 2.265 1.00 . B B . 14 SER CA 1 1 1 1103 2 2 14 SER CB C 9.864 -11.575 3.744 1.00 . B B . 14 SER CB 1 1 1 1104 2 2 14 SER H H 8.803 -10.026 1.204 1.00 . B B . 14 SER H 1 1 1 1105 2 2 14 SER HA H 10.391 -11.581 1.670 1.00 . B B . 14 SER HA 1 1 1 1106 2 2 14 SER HB2 H 8.962 -11.604 4.338 1.00 . B B . 14 SER HB2 1 1 1 1107 2 2 14 SER HB3 H 10.511 -12.390 4.034 1.00 . B B . 14 SER HB3 1 1 1 1108 2 2 14 SER HG H 10.725 -10.273 4.927 1.00 . B B . 14 SER HG 1 1 1 1109 2 2 14 SER N N 8.546 -10.688 1.880 1.00 . B B . 14 SER N 1 1 1 1110 2 2 14 SER O O 9.194 -13.651 0.900 1.00 . B B . 14 SER O 1 1 1 1111 2 2 14 SER OXT O 8.246 -13.650 2.887 1.00 . B B . 14 SER OXT 1 1 1 1112 2 2 14 SER OG O 10.530 -10.350 3.989 1.00 . B B . 14 SER OG 1 1 2 1113 1 1 1 GLY C C 10.658 4.746 -6.288 1.00 . A A . 1 GLY C 1 1 2 1114 1 1 1 GLY CA C 9.974 3.579 -6.974 1.00 . A A . 1 GLY CA 1 1 2 1115 1 1 1 GLY H1 H 8.091 2.686 -7.123 1.00 . A A . 1 GLY H1 1 1 2 1116 1 1 1 GLY H2 H 8.044 4.301 -6.623 1.00 . A A . 1 GLY H2 1 1 2 1117 1 1 1 GLY H3 H 8.530 3.095 -5.543 1.00 . A A . 1 GLY H3 1 1 2 1118 1 1 1 GLY HA2 H 10.522 2.674 -6.753 1.00 . A A . 1 GLY HA2 1 1 2 1119 1 1 1 GLY HA3 H 9.989 3.745 -8.040 1.00 . A A . 1 GLY HA3 1 1 2 1120 1 1 1 GLY N N 8.561 3.403 -6.535 1.00 . A A . 1 GLY N 1 1 2 1121 1 1 1 GLY O O 11.611 5.311 -6.823 1.00 . A A . 1 GLY O 1 1 2 1122 1 1 2 SER C C 9.965 6.476 -3.060 1.00 . A A . 2 SER C 1 1 2 1123 1 1 2 SER CA C 10.747 6.216 -4.341 1.00 . A A . 2 SER CA 1 1 2 1124 1 1 2 SER CB C 10.781 7.484 -5.193 1.00 . A A . 2 SER CB 1 1 2 1125 1 1 2 SER H H 9.428 4.599 -4.721 1.00 . A A . 2 SER H 1 1 2 1126 1 1 2 SER HA H 11.753 5.954 -4.071 1.00 . A A . 2 SER HA 1 1 2 1127 1 1 2 SER HB2 H 11.168 8.299 -4.601 1.00 . A A . 2 SER HB2 1 1 2 1128 1 1 2 SER HB3 H 11.422 7.323 -6.045 1.00 . A A . 2 SER HB3 1 1 2 1129 1 1 2 SER HG H 9.108 7.087 -6.130 1.00 . A A . 2 SER HG 1 1 2 1130 1 1 2 SER N N 10.177 5.102 -5.100 1.00 . A A . 2 SER N 1 1 2 1131 1 1 2 SER O O 10.531 6.915 -2.058 1.00 . A A . 2 SER O 1 1 2 1132 1 1 2 SER OG O 9.485 7.828 -5.651 1.00 . A A . 2 SER OG 1 1 2 1133 1 1 3 GLN C C 7.822 5.152 -1.063 1.00 . A A . 3 GLN C 1 1 2 1134 1 1 3 GLN CA C 7.832 6.404 -1.923 1.00 . A A . 3 GLN CA 1 1 2 1135 1 1 3 GLN CB C 6.415 6.765 -2.343 1.00 . A A . 3 GLN CB 1 1 2 1136 1 1 3 GLN CD C 4.908 8.387 -3.560 1.00 . A A . 3 GLN CD 1 1 2 1137 1 1 3 GLN CG C 6.314 8.092 -3.074 1.00 . A A . 3 GLN CG 1 1 2 1138 1 1 3 GLN H H 8.264 5.871 -3.914 1.00 . A A . 3 GLN H 1 1 2 1139 1 1 3 GLN HA H 8.243 7.213 -1.355 1.00 . A A . 3 GLN HA 1 1 2 1140 1 1 3 GLN HB2 H 6.049 5.994 -2.991 1.00 . A A . 3 GLN HB2 1 1 2 1141 1 1 3 GLN HB3 H 5.790 6.812 -1.463 1.00 . A A . 3 GLN HB3 1 1 2 1142 1 1 3 GLN HE21 H 5.218 10.338 -3.349 1.00 . A A . 3 GLN HE21 1 1 2 1143 1 1 3 GLN HE22 H 3.657 9.886 -3.931 1.00 . A A . 3 GLN HE22 1 1 2 1144 1 1 3 GLN HG2 H 6.618 8.882 -2.403 1.00 . A A . 3 GLN HG2 1 1 2 1145 1 1 3 GLN HG3 H 6.978 8.070 -3.926 1.00 . A A . 3 GLN HG3 1 1 2 1146 1 1 3 GLN N N 8.669 6.203 -3.090 1.00 . A A . 3 GLN N 1 1 2 1147 1 1 3 GLN NE2 N 4.559 9.665 -3.620 1.00 . A A . 3 GLN NE2 1 1 2 1148 1 1 3 GLN O O 7.813 4.034 -1.577 1.00 . A A . 3 GLN O 1 1 2 1149 1 1 3 GLN OE1 O 4.145 7.474 -3.879 1.00 . A A . 3 GLN OE1 1 1 2 1150 1 1 4 VAL C C 6.390 3.880 1.560 1.00 . A A . 4 VAL C 1 1 2 1151 1 1 4 VAL CA C 7.818 4.232 1.177 1.00 . A A . 4 VAL CA 1 1 2 1152 1 1 4 VAL CB C 8.628 4.554 2.451 1.00 . A A . 4 VAL CB 1 1 2 1153 1 1 4 VAL CG1 C 9.045 3.275 3.157 1.00 . A A . 4 VAL CG1 1 1 2 1154 1 1 4 VAL CG2 C 9.845 5.406 2.118 1.00 . A A . 4 VAL CG2 1 1 2 1155 1 1 4 VAL H H 7.812 6.256 0.594 1.00 . A A . 4 VAL H 1 1 2 1156 1 1 4 VAL HA H 8.271 3.382 0.688 1.00 . A A . 4 VAL HA 1 1 2 1157 1 1 4 VAL HB H 7.995 5.116 3.120 1.00 . A A . 4 VAL HB 1 1 2 1158 1 1 4 VAL HG11 H 9.548 3.522 4.081 1.00 . A A . 4 VAL HG11 1 1 2 1159 1 1 4 VAL HG12 H 9.715 2.715 2.521 1.00 . A A . 4 VAL HG12 1 1 2 1160 1 1 4 VAL HG13 H 8.171 2.682 3.370 1.00 . A A . 4 VAL HG13 1 1 2 1161 1 1 4 VAL HG21 H 10.442 4.902 1.371 1.00 . A A . 4 VAL HG21 1 1 2 1162 1 1 4 VAL HG22 H 10.435 5.556 3.009 1.00 . A A . 4 VAL HG22 1 1 2 1163 1 1 4 VAL HG23 H 9.522 6.363 1.735 1.00 . A A . 4 VAL HG23 1 1 2 1164 1 1 4 VAL N N 7.823 5.345 0.245 1.00 . A A . 4 VAL N 1 1 2 1165 1 1 4 VAL O O 6.076 3.685 2.732 1.00 . A A . 4 VAL O 1 1 2 1166 1 1 5 PHE C C 3.378 3.422 -0.554 1.00 . A A . 5 PHE C 1 1 2 1167 1 1 5 PHE CA C 4.125 3.488 0.777 1.00 . A A . 5 PHE CA 1 1 2 1168 1 1 5 PHE CB C 3.483 4.542 1.677 1.00 . A A . 5 PHE CB 1 1 2 1169 1 1 5 PHE CD1 C 2.982 6.363 0.023 1.00 . A A . 5 PHE CD1 1 1 2 1170 1 1 5 PHE CD2 C 4.474 6.844 1.820 1.00 . A A . 5 PHE CD2 1 1 2 1171 1 1 5 PHE CE1 C 3.133 7.651 -0.453 1.00 . A A . 5 PHE CE1 1 1 2 1172 1 1 5 PHE CE2 C 4.630 8.134 1.349 1.00 . A A . 5 PHE CE2 1 1 2 1173 1 1 5 PHE CG C 3.648 5.945 1.163 1.00 . A A . 5 PHE CG 1 1 2 1174 1 1 5 PHE CZ C 3.959 8.538 0.211 1.00 . A A . 5 PHE CZ 1 1 2 1175 1 1 5 PHE H H 5.833 3.986 -0.355 1.00 . A A . 5 PHE H 1 1 2 1176 1 1 5 PHE HA H 4.080 2.518 1.269 1.00 . A A . 5 PHE HA 1 1 2 1177 1 1 5 PHE HB2 H 2.429 4.341 1.763 1.00 . A A . 5 PHE HB2 1 1 2 1178 1 1 5 PHE HB3 H 3.936 4.492 2.654 1.00 . A A . 5 PHE HB3 1 1 2 1179 1 1 5 PHE HD1 H 2.336 5.671 -0.496 1.00 . A A . 5 PHE HD1 1 1 2 1180 1 1 5 PHE HD2 H 4.998 6.529 2.710 1.00 . A A . 5 PHE HD2 1 1 2 1181 1 1 5 PHE HE1 H 2.608 7.964 -1.342 1.00 . A A . 5 PHE HE1 1 1 2 1182 1 1 5 PHE HE2 H 5.275 8.825 1.870 1.00 . A A . 5 PHE HE2 1 1 2 1183 1 1 5 PHE HZ H 4.079 9.545 -0.159 1.00 . A A . 5 PHE HZ 1 1 2 1184 1 1 5 PHE N N 5.523 3.814 0.557 1.00 . A A . 5 PHE N 1 1 2 1185 1 1 5 PHE O O 3.643 4.211 -1.463 1.00 . A A . 5 PHE O 1 1 2 1186 1 1 6 GLU C C 0.175 2.248 -1.578 1.00 . A A . 6 GLU C 1 1 2 1187 1 1 6 GLU CA C 1.668 2.322 -1.891 1.00 . A A . 6 GLU CA 1 1 2 1188 1 1 6 GLU CB C 2.109 1.068 -2.643 1.00 . A A . 6 GLU CB 1 1 2 1189 1 1 6 GLU CD C 1.734 2.050 -4.936 1.00 . A A . 6 GLU CD 1 1 2 1190 1 1 6 GLU CG C 1.431 0.904 -3.990 1.00 . A A . 6 GLU CG 1 1 2 1191 1 1 6 GLU H H 2.295 1.875 0.084 1.00 . A A . 6 GLU H 1 1 2 1192 1 1 6 GLU HA H 1.849 3.186 -2.513 1.00 . A A . 6 GLU HA 1 1 2 1193 1 1 6 GLU HB2 H 3.176 1.118 -2.804 1.00 . A A . 6 GLU HB2 1 1 2 1194 1 1 6 GLU HB3 H 1.884 0.197 -2.038 1.00 . A A . 6 GLU HB3 1 1 2 1195 1 1 6 GLU HG2 H 1.775 -0.014 -4.440 1.00 . A A . 6 GLU HG2 1 1 2 1196 1 1 6 GLU HG3 H 0.364 0.853 -3.840 1.00 . A A . 6 GLU HG3 1 1 2 1197 1 1 6 GLU N N 2.451 2.480 -0.667 1.00 . A A . 6 GLU N 1 1 2 1198 1 1 6 GLU O O -0.230 1.647 -0.588 1.00 . A A . 6 GLU O 1 1 2 1199 1 1 6 GLU OE1 O 2.778 1.996 -5.619 1.00 . A A . 6 GLU OE1 1 1 2 1200 1 1 6 GLU OE2 O 0.926 3.001 -4.994 1.00 . A A . 6 GLU OE2 1 1 2 1201 1 1 7 TYR C C -2.752 1.616 -2.805 1.00 . A A . 7 TYR C 1 1 2 1202 1 1 7 TYR CA C -2.080 2.841 -2.215 1.00 . A A . 7 TYR CA 1 1 2 1203 1 1 7 TYR CB C -2.691 4.113 -2.789 1.00 . A A . 7 TYR CB 1 1 2 1204 1 1 7 TYR CD1 C -3.240 3.815 -5.237 1.00 . A A . 7 TYR CD1 1 1 2 1205 1 1 7 TYR CD2 C -1.273 5.033 -4.663 1.00 . A A . 7 TYR CD2 1 1 2 1206 1 1 7 TYR CE1 C -2.971 4.006 -6.579 1.00 . A A . 7 TYR CE1 1 1 2 1207 1 1 7 TYR CE2 C -0.997 5.228 -6.002 1.00 . A A . 7 TYR CE2 1 1 2 1208 1 1 7 TYR CG C -2.396 4.324 -4.257 1.00 . A A . 7 TYR CG 1 1 2 1209 1 1 7 TYR CZ C -1.849 4.713 -6.956 1.00 . A A . 7 TYR CZ 1 1 2 1210 1 1 7 TYR H H -0.291 3.283 -3.228 1.00 . A A . 7 TYR H 1 1 2 1211 1 1 7 TYR HA H -2.248 2.826 -1.158 1.00 . A A . 7 TYR HA 1 1 2 1212 1 1 7 TYR HB2 H -3.755 4.071 -2.665 1.00 . A A . 7 TYR HB2 1 1 2 1213 1 1 7 TYR HB3 H -2.305 4.964 -2.247 1.00 . A A . 7 TYR HB3 1 1 2 1214 1 1 7 TYR HD1 H -4.118 3.262 -4.938 1.00 . A A . 7 TYR HD1 1 1 2 1215 1 1 7 TYR HD2 H -0.608 5.434 -3.912 1.00 . A A . 7 TYR HD2 1 1 2 1216 1 1 7 TYR HE1 H -3.638 3.602 -7.326 1.00 . A A . 7 TYR HE1 1 1 2 1217 1 1 7 TYR HE2 H -0.118 5.781 -6.298 1.00 . A A . 7 TYR HE2 1 1 2 1218 1 1 7 TYR HH H -2.378 5.186 -8.743 1.00 . A A . 7 TYR HH 1 1 2 1219 1 1 7 TYR N N -0.648 2.836 -2.438 1.00 . A A . 7 TYR N 1 1 2 1220 1 1 7 TYR O O -2.859 1.462 -4.022 1.00 . A A . 7 TYR O 1 1 2 1221 1 1 7 TYR OH O -1.578 4.906 -8.291 1.00 . A A . 7 TYR OH 1 1 2 1222 1 1 8 ALA C C -5.395 -0.244 -2.271 1.00 . A A . 8 ALA C 1 1 2 1223 1 1 8 ALA CA C -3.890 -0.475 -2.300 1.00 . A A . 8 ALA CA 1 1 2 1224 1 1 8 ALA CB C -3.502 -1.615 -1.366 1.00 . A A . 8 ALA CB 1 1 2 1225 1 1 8 ALA H H -3.070 0.934 -0.953 1.00 . A A . 8 ALA H 1 1 2 1226 1 1 8 ALA HA H -3.585 -0.733 -3.305 1.00 . A A . 8 ALA HA 1 1 2 1227 1 1 8 ALA HB1 H -3.483 -1.258 -0.345 1.00 . A A . 8 ALA HB1 1 1 2 1228 1 1 8 ALA HB2 H -2.523 -1.985 -1.634 1.00 . A A . 8 ALA HB2 1 1 2 1229 1 1 8 ALA HB3 H -4.224 -2.413 -1.450 1.00 . A A . 8 ALA HB3 1 1 2 1230 1 1 8 ALA N N -3.202 0.744 -1.911 1.00 . A A . 8 ALA N 1 1 2 1231 1 1 8 ALA O O -6.142 -1.015 -1.669 1.00 . A A . 8 ALA O 1 1 2 1232 1 1 9 GLU C C -7.815 1.109 -4.345 1.00 . A A . 9 GLU C 1 1 2 1233 1 1 9 GLU CA C -7.232 1.195 -2.960 1.00 . A A . 9 GLU CA 1 1 2 1234 1 1 9 GLU CB C -7.383 2.592 -2.348 1.00 . A A . 9 GLU CB 1 1 2 1235 1 1 9 GLU CD C -6.647 3.931 -4.368 1.00 . A A . 9 GLU CD 1 1 2 1236 1 1 9 GLU CG C -7.721 3.719 -3.320 1.00 . A A . 9 GLU CG 1 1 2 1237 1 1 9 GLU H H -5.189 1.400 -3.396 1.00 . A A . 9 GLU H 1 1 2 1238 1 1 9 GLU HA H -7.779 0.500 -2.358 1.00 . A A . 9 GLU HA 1 1 2 1239 1 1 9 GLU HB2 H -8.151 2.560 -1.598 1.00 . A A . 9 GLU HB2 1 1 2 1240 1 1 9 GLU HB3 H -6.450 2.834 -1.872 1.00 . A A . 9 GLU HB3 1 1 2 1241 1 1 9 GLU HG2 H -8.644 3.477 -3.816 1.00 . A A . 9 GLU HG2 1 1 2 1242 1 1 9 GLU HG3 H -7.847 4.630 -2.762 1.00 . A A . 9 GLU HG3 1 1 2 1243 1 1 9 GLU N N -5.830 0.829 -2.928 1.00 . A A . 9 GLU N 1 1 2 1244 1 1 9 GLU O O -7.109 0.950 -5.341 1.00 . A A . 9 GLU O 1 1 2 1245 1 1 9 GLU OE1 O -5.681 4.672 -4.088 1.00 . A A . 9 GLU OE1 1 1 2 1246 1 1 9 GLU OE2 O -6.773 3.358 -5.471 1.00 . A A . 9 GLU OE2 1 1 2 1247 1 1 10 VAL C C -10.190 2.506 -6.168 1.00 . A A . 10 VAL C 1 1 2 1248 1 1 10 VAL CA C -9.854 1.128 -5.600 1.00 . A A . 10 VAL CA 1 1 2 1249 1 1 10 VAL CB C -11.095 0.267 -5.400 1.00 . A A . 10 VAL CB 1 1 2 1250 1 1 10 VAL CG1 C -11.862 0.110 -6.703 1.00 . A A . 10 VAL CG1 1 1 2 1251 1 1 10 VAL CG2 C -10.681 -1.087 -4.838 1.00 . A A . 10 VAL CG2 1 1 2 1252 1 1 10 VAL H H -9.614 1.346 -3.537 1.00 . A A . 10 VAL H 1 1 2 1253 1 1 10 VAL HA H -9.233 0.631 -6.287 1.00 . A A . 10 VAL HA 1 1 2 1254 1 1 10 VAL HB H -11.716 0.743 -4.675 1.00 . A A . 10 VAL HB 1 1 2 1255 1 1 10 VAL HG11 H -12.920 0.207 -6.518 1.00 . A A . 10 VAL HG11 1 1 2 1256 1 1 10 VAL HG12 H -11.660 -0.866 -7.123 1.00 . A A . 10 VAL HG12 1 1 2 1257 1 1 10 VAL HG13 H -11.545 0.872 -7.399 1.00 . A A . 10 VAL HG13 1 1 2 1258 1 1 10 VAL HG21 H -9.958 -1.545 -5.497 1.00 . A A . 10 VAL HG21 1 1 2 1259 1 1 10 VAL HG22 H -11.544 -1.725 -4.752 1.00 . A A . 10 VAL HG22 1 1 2 1260 1 1 10 VAL HG23 H -10.239 -0.947 -3.860 1.00 . A A . 10 VAL HG23 1 1 2 1261 1 1 10 VAL N N -9.125 1.215 -4.376 1.00 . A A . 10 VAL N 1 1 2 1262 1 1 10 VAL O O -10.196 2.694 -7.384 1.00 . A A . 10 VAL O 1 1 2 1263 1 1 11 ASP C C -10.198 5.900 -4.773 1.00 . A A . 11 ASP C 1 1 2 1264 1 1 11 ASP CA C -10.751 4.835 -5.733 1.00 . A A . 11 ASP CA 1 1 2 1265 1 1 11 ASP CB C -12.266 5.018 -5.917 1.00 . A A . 11 ASP CB 1 1 2 1266 1 1 11 ASP CG C -12.676 6.466 -6.123 1.00 . A A . 11 ASP CG 1 1 2 1267 1 1 11 ASP H H -10.467 3.256 -4.339 1.00 . A A . 11 ASP H 1 1 2 1268 1 1 11 ASP HA H -10.275 4.971 -6.691 1.00 . A A . 11 ASP HA 1 1 2 1269 1 1 11 ASP HB2 H -12.578 4.464 -6.782 1.00 . A A . 11 ASP HB2 1 1 2 1270 1 1 11 ASP HB3 H -12.781 4.637 -5.048 1.00 . A A . 11 ASP HB3 1 1 2 1271 1 1 11 ASP N N -10.450 3.471 -5.291 1.00 . A A . 11 ASP N 1 1 2 1272 1 1 11 ASP O O -9.801 6.979 -5.211 1.00 . A A . 11 ASP O 1 1 2 1273 1 1 11 ASP OD1 O -12.570 6.956 -7.267 1.00 . A A . 11 ASP OD1 1 1 2 1274 1 1 11 ASP OD2 O -13.105 7.108 -5.141 1.00 . A A . 11 ASP OD2 1 1 2 1275 1 1 12 GLU C C -9.144 5.940 -1.234 1.00 . A A . 12 GLU C 1 1 2 1276 1 1 12 GLU CA C -9.692 6.595 -2.494 1.00 . A A . 12 GLU CA 1 1 2 1277 1 1 12 GLU CB C -10.817 7.558 -2.123 1.00 . A A . 12 GLU CB 1 1 2 1278 1 1 12 GLU CD C -9.984 9.487 -3.525 1.00 . A A . 12 GLU CD 1 1 2 1279 1 1 12 GLU CG C -11.146 8.561 -3.216 1.00 . A A . 12 GLU CG 1 1 2 1280 1 1 12 GLU H H -10.417 4.702 -3.176 1.00 . A A . 12 GLU H 1 1 2 1281 1 1 12 GLU HA H -8.896 7.157 -2.960 1.00 . A A . 12 GLU HA 1 1 2 1282 1 1 12 GLU HB2 H -11.709 6.986 -1.907 1.00 . A A . 12 GLU HB2 1 1 2 1283 1 1 12 GLU HB3 H -10.529 8.105 -1.236 1.00 . A A . 12 GLU HB3 1 1 2 1284 1 1 12 GLU HG2 H -11.404 8.021 -4.115 1.00 . A A . 12 GLU HG2 1 1 2 1285 1 1 12 GLU HG3 H -11.989 9.157 -2.899 1.00 . A A . 12 GLU HG3 1 1 2 1286 1 1 12 GLU N N -10.170 5.608 -3.473 1.00 . A A . 12 GLU N 1 1 2 1287 1 1 12 GLU O O -9.463 4.802 -0.939 1.00 . A A . 12 GLU O 1 1 2 1288 1 1 12 GLU OE1 O -9.753 10.431 -2.740 1.00 . A A . 12 GLU OE1 1 1 2 1289 1 1 12 GLU OE2 O -9.306 9.266 -4.549 1.00 . A A . 12 GLU OE2 1 1 2 1290 1 1 13 ILE C C -7.815 7.197 1.864 1.00 . A A . 13 ILE C 1 1 2 1291 1 1 13 ILE CA C -7.747 6.148 0.752 1.00 . A A . 13 ILE CA 1 1 2 1292 1 1 13 ILE CB C -6.275 5.711 0.536 1.00 . A A . 13 ILE CB 1 1 2 1293 1 1 13 ILE CD1 C -5.638 7.736 -0.860 1.00 . A A . 13 ILE CD1 1 1 2 1294 1 1 13 ILE CG1 C -5.355 6.927 0.387 1.00 . A A . 13 ILE CG1 1 1 2 1295 1 1 13 ILE CG2 C -6.188 4.849 -0.702 1.00 . A A . 13 ILE CG2 1 1 2 1296 1 1 13 ILE H H -8.112 7.587 -0.762 1.00 . A A . 13 ILE H 1 1 2 1297 1 1 13 ILE HA H -8.323 5.276 1.043 1.00 . A A . 13 ILE HA 1 1 2 1298 1 1 13 ILE HB H -5.952 5.110 1.385 1.00 . A A . 13 ILE HB 1 1 2 1299 1 1 13 ILE HD11 H -6.395 8.475 -0.646 1.00 . A A . 13 ILE HD11 1 1 2 1300 1 1 13 ILE HD12 H -5.988 7.077 -1.643 1.00 . A A . 13 ILE HD12 1 1 2 1301 1 1 13 ILE HD13 H -4.733 8.228 -1.182 1.00 . A A . 13 ILE HD13 1 1 2 1302 1 1 13 ILE HG12 H -5.486 7.576 1.240 1.00 . A A . 13 ILE HG12 1 1 2 1303 1 1 13 ILE HG13 H -4.329 6.596 0.345 1.00 . A A . 13 ILE HG13 1 1 2 1304 1 1 13 ILE HG21 H -5.723 5.405 -1.502 1.00 . A A . 13 ILE HG21 1 1 2 1305 1 1 13 ILE HG22 H -7.180 4.560 -0.997 1.00 . A A . 13 ILE HG22 1 1 2 1306 1 1 13 ILE HG23 H -5.606 3.966 -0.489 1.00 . A A . 13 ILE HG23 1 1 2 1307 1 1 13 ILE N N -8.328 6.673 -0.483 1.00 . A A . 13 ILE N 1 1 2 1308 1 1 13 ILE O O -8.472 8.227 1.718 1.00 . A A . 13 ILE O 1 1 2 1309 1 1 14 VAL C C -5.770 7.725 4.838 1.00 . A A . 14 VAL C 1 1 2 1310 1 1 14 VAL CA C -7.094 7.854 4.096 1.00 . A A . 14 VAL CA 1 1 2 1311 1 1 14 VAL CB C -8.268 7.613 5.069 1.00 . A A . 14 VAL CB 1 1 2 1312 1 1 14 VAL CG1 C -8.156 8.516 6.289 1.00 . A A . 14 VAL CG1 1 1 2 1313 1 1 14 VAL CG2 C -9.595 7.838 4.362 1.00 . A A . 14 VAL CG2 1 1 2 1314 1 1 14 VAL H H -6.629 6.088 3.027 1.00 . A A . 14 VAL H 1 1 2 1315 1 1 14 VAL HA H -7.176 8.855 3.704 1.00 . A A . 14 VAL HA 1 1 2 1316 1 1 14 VAL HB H -8.231 6.586 5.402 1.00 . A A . 14 VAL HB 1 1 2 1317 1 1 14 VAL HG11 H -8.129 9.548 5.971 1.00 . A A . 14 VAL HG11 1 1 2 1318 1 1 14 VAL HG12 H -7.250 8.282 6.828 1.00 . A A . 14 VAL HG12 1 1 2 1319 1 1 14 VAL HG13 H -9.009 8.360 6.933 1.00 . A A . 14 VAL HG13 1 1 2 1320 1 1 14 VAL HG21 H -10.407 7.649 5.050 1.00 . A A . 14 VAL HG21 1 1 2 1321 1 1 14 VAL HG22 H -9.674 7.167 3.520 1.00 . A A . 14 VAL HG22 1 1 2 1322 1 1 14 VAL HG23 H -9.650 8.859 4.013 1.00 . A A . 14 VAL HG23 1 1 2 1323 1 1 14 VAL N N -7.128 6.929 2.968 1.00 . A A . 14 VAL N 1 1 2 1324 1 1 14 VAL O O -5.055 8.707 5.034 1.00 . A A . 14 VAL O 1 1 2 1325 1 1 15 GLU C C -3.139 5.826 4.936 1.00 . A A . 15 GLU C 1 1 2 1326 1 1 15 GLU CA C -4.203 6.234 5.948 1.00 . A A . 15 GLU CA 1 1 2 1327 1 1 15 GLU CB C -4.398 5.128 6.987 1.00 . A A . 15 GLU CB 1 1 2 1328 1 1 15 GLU CD C -5.640 4.345 9.043 1.00 . A A . 15 GLU CD 1 1 2 1329 1 1 15 GLU CG C -5.458 5.455 8.026 1.00 . A A . 15 GLU CG 1 1 2 1330 1 1 15 GLU H H -6.082 5.769 5.082 1.00 . A A . 15 GLU H 1 1 2 1331 1 1 15 GLU HA H -3.889 7.141 6.443 1.00 . A A . 15 GLU HA 1 1 2 1332 1 1 15 GLU HB2 H -4.688 4.220 6.479 1.00 . A A . 15 GLU HB2 1 1 2 1333 1 1 15 GLU HB3 H -3.462 4.961 7.499 1.00 . A A . 15 GLU HB3 1 1 2 1334 1 1 15 GLU HG2 H -5.168 6.355 8.546 1.00 . A A . 15 GLU HG2 1 1 2 1335 1 1 15 GLU HG3 H -6.399 5.618 7.520 1.00 . A A . 15 GLU HG3 1 1 2 1336 1 1 15 GLU N N -5.455 6.505 5.251 1.00 . A A . 15 GLU N 1 1 2 1337 1 1 15 GLU O O -3.428 5.093 3.999 1.00 . A A . 15 GLU O 1 1 2 1338 1 1 15 GLU OE1 O -4.906 4.340 10.053 1.00 . A A . 15 GLU OE1 1 1 2 1339 1 1 15 GLU OE2 O -6.517 3.483 8.829 1.00 . A A . 15 GLU OE2 1 1 2 1340 1 1 16 LYS C C 0.534 6.044 4.799 1.00 . A A . 16 LYS C 1 1 2 1341 1 1 16 LYS CA C -0.855 5.982 4.152 1.00 . A A . 16 LYS CA 1 1 2 1342 1 1 16 LYS CB C -0.906 6.942 2.965 1.00 . A A . 16 LYS CB 1 1 2 1343 1 1 16 LYS CD C -1.158 9.307 2.150 1.00 . A A . 16 LYS CD 1 1 2 1344 1 1 16 LYS CE C -1.361 10.759 2.555 1.00 . A A . 16 LYS CE 1 1 2 1345 1 1 16 LYS CG C -1.053 8.400 3.367 1.00 . A A . 16 LYS CG 1 1 2 1346 1 1 16 LYS H H -1.732 6.911 5.851 1.00 . A A . 16 LYS H 1 1 2 1347 1 1 16 LYS HA H -1.045 4.973 3.795 1.00 . A A . 16 LYS HA 1 1 2 1348 1 1 16 LYS HB2 H 0.006 6.840 2.399 1.00 . A A . 16 LYS HB2 1 1 2 1349 1 1 16 LYS HB3 H -1.743 6.677 2.336 1.00 . A A . 16 LYS HB3 1 1 2 1350 1 1 16 LYS HD2 H -0.248 9.228 1.575 1.00 . A A . 16 LYS HD2 1 1 2 1351 1 1 16 LYS HD3 H -1.996 8.989 1.547 1.00 . A A . 16 LYS HD3 1 1 2 1352 1 1 16 LYS HE2 H -0.502 11.085 3.121 1.00 . A A . 16 LYS HE2 1 1 2 1353 1 1 16 LYS HE3 H -1.452 11.358 1.661 1.00 . A A . 16 LYS HE3 1 1 2 1354 1 1 16 LYS HG2 H -1.946 8.511 3.962 1.00 . A A . 16 LYS HG2 1 1 2 1355 1 1 16 LYS HG3 H -0.191 8.692 3.949 1.00 . A A . 16 LYS HG3 1 1 2 1356 1 1 16 LYS HZ1 H -2.498 10.395 4.268 1.00 . A A . 16 LYS HZ1 1 1 2 1357 1 1 16 LYS HZ2 H -3.421 10.603 2.865 1.00 . A A . 16 LYS HZ2 1 1 2 1358 1 1 16 LYS HZ3 H -2.714 11.941 3.619 1.00 . A A . 16 LYS HZ3 1 1 2 1359 1 1 16 LYS N N -1.920 6.319 5.094 1.00 . A A . 16 LYS N 1 1 2 1360 1 1 16 LYS NZ N -2.584 10.937 3.385 1.00 . A A . 16 LYS NZ 1 1 2 1361 1 1 16 LYS O O 1.196 7.080 4.742 1.00 . A A . 16 LYS O 1 1 2 1362 1 1 17 ARG C C 2.857 3.503 6.117 1.00 . A A . 17 ARG C 1 1 2 1363 1 1 17 ARG CA C 2.296 4.920 6.055 1.00 . A A . 17 ARG CA 1 1 2 1364 1 1 17 ARG CB C 2.207 5.503 7.465 1.00 . A A . 17 ARG CB 1 1 2 1365 1 1 17 ARG CD C 1.969 7.554 8.888 1.00 . A A . 17 ARG CD 1 1 2 1366 1 1 17 ARG CG C 1.827 6.972 7.492 1.00 . A A . 17 ARG CG 1 1 2 1367 1 1 17 ARG CZ C 3.757 8.100 10.487 1.00 . A A . 17 ARG CZ 1 1 2 1368 1 1 17 ARG H H 0.429 4.133 5.404 1.00 . A A . 17 ARG H 1 1 2 1369 1 1 17 ARG HA H 2.964 5.531 5.467 1.00 . A A . 17 ARG HA 1 1 2 1370 1 1 17 ARG HB2 H 1.462 4.952 8.021 1.00 . A A . 17 ARG HB2 1 1 2 1371 1 1 17 ARG HB3 H 3.164 5.390 7.950 1.00 . A A . 17 ARG HB3 1 1 2 1372 1 1 17 ARG HD2 H 1.590 8.564 8.885 1.00 . A A . 17 ARG HD2 1 1 2 1373 1 1 17 ARG HD3 H 1.390 6.953 9.573 1.00 . A A . 17 ARG HD3 1 1 2 1374 1 1 17 ARG HE H 4.031 7.172 8.742 1.00 . A A . 17 ARG HE 1 1 2 1375 1 1 17 ARG HG2 H 2.473 7.515 6.818 1.00 . A A . 17 ARG HG2 1 1 2 1376 1 1 17 ARG HG3 H 0.800 7.076 7.172 1.00 . A A . 17 ARG HG3 1 1 2 1377 1 1 17 ARG HH11 H 1.901 8.657 11.061 1.00 . A A . 17 ARG HH11 1 1 2 1378 1 1 17 ARG HH12 H 3.171 9.041 12.175 1.00 . A A . 17 ARG HH12 1 1 2 1379 1 1 17 ARG HH21 H 5.711 7.674 10.201 1.00 . A A . 17 ARG HH21 1 1 2 1380 1 1 17 ARG HH22 H 5.337 8.483 11.686 1.00 . A A . 17 ARG HH22 1 1 2 1381 1 1 17 ARG N N 0.979 4.947 5.410 1.00 . A A . 17 ARG N 1 1 2 1382 1 1 17 ARG NE N 3.360 7.571 9.333 1.00 . A A . 17 ARG NE 1 1 2 1383 1 1 17 ARG NH1 N 2.870 8.644 11.309 1.00 . A A . 17 ARG NH1 1 1 2 1384 1 1 17 ARG NH2 N 5.040 8.084 10.819 1.00 . A A . 17 ARG NH2 1 1 2 1385 1 1 17 ARG O O 2.570 2.767 7.061 1.00 . A A . 17 ARG O 1 1 2 1386 1 1 18 GLY C C 5.500 1.586 4.412 1.00 . A A . 18 GLY C 1 1 2 1387 1 1 18 GLY CA C 4.188 1.758 5.143 1.00 . A A . 18 GLY CA 1 1 2 1388 1 1 18 GLY H H 3.891 3.724 4.399 1.00 . A A . 18 GLY H 1 1 2 1389 1 1 18 GLY HA2 H 4.328 1.456 6.169 1.00 . A A . 18 GLY HA2 1 1 2 1390 1 1 18 GLY HA3 H 3.465 1.106 4.693 1.00 . A A . 18 GLY HA3 1 1 2 1391 1 1 18 GLY N N 3.654 3.105 5.124 1.00 . A A . 18 GLY N 1 1 2 1392 1 1 18 GLY O O 6.468 2.303 4.656 1.00 . A A . 18 GLY O 1 1 2 1393 1 1 19 LYS C C 6.288 0.332 1.237 1.00 . A A . 19 LYS C 1 1 2 1394 1 1 19 LYS CA C 6.662 0.245 2.724 1.00 . A A . 19 LYS CA 1 1 2 1395 1 1 19 LYS CB C 7.083 -1.157 3.128 1.00 . A A . 19 LYS CB 1 1 2 1396 1 1 19 LYS CD C 8.018 -2.637 4.888 1.00 . A A . 19 LYS CD 1 1 2 1397 1 1 19 LYS CE C 8.624 -2.711 6.279 1.00 . A A . 19 LYS CE 1 1 2 1398 1 1 19 LYS CG C 7.666 -1.219 4.520 1.00 . A A . 19 LYS CG 1 1 2 1399 1 1 19 LYS H H 4.710 0.033 3.438 1.00 . A A . 19 LYS H 1 1 2 1400 1 1 19 LYS HA H 7.455 0.932 2.938 1.00 . A A . 19 LYS HA 1 1 2 1401 1 1 19 LYS HB2 H 6.204 -1.791 3.094 1.00 . A A . 19 LYS HB2 1 1 2 1402 1 1 19 LYS HB3 H 7.819 -1.530 2.433 1.00 . A A . 19 LYS HB3 1 1 2 1403 1 1 19 LYS HD2 H 7.120 -3.232 4.857 1.00 . A A . 19 LYS HD2 1 1 2 1404 1 1 19 LYS HD3 H 8.729 -3.015 4.166 1.00 . A A . 19 LYS HD3 1 1 2 1405 1 1 19 LYS HE2 H 7.970 -2.194 6.966 1.00 . A A . 19 LYS HE2 1 1 2 1406 1 1 19 LYS HE3 H 8.706 -3.745 6.571 1.00 . A A . 19 LYS HE3 1 1 2 1407 1 1 19 LYS HG2 H 8.559 -0.612 4.556 1.00 . A A . 19 LYS HG2 1 1 2 1408 1 1 19 LYS HG3 H 6.939 -0.841 5.224 1.00 . A A . 19 LYS HG3 1 1 2 1409 1 1 19 LYS HZ1 H 10.362 -2.148 7.293 1.00 . A A . 19 LYS HZ1 1 1 2 1410 1 1 19 LYS HZ2 H 9.908 -1.078 6.062 1.00 . A A . 19 LYS HZ2 1 1 2 1411 1 1 19 LYS HZ3 H 10.617 -2.564 5.673 1.00 . A A . 19 LYS HZ3 1 1 2 1412 1 1 19 LYS N N 5.511 0.587 3.532 1.00 . A A . 19 LYS N 1 1 2 1413 1 1 19 LYS NZ N 9.972 -2.081 6.330 1.00 . A A . 19 LYS NZ 1 1 2 1414 1 1 19 LYS O O 5.853 1.378 0.776 1.00 . A A . 19 LYS O 1 1 2 1415 1 1 20 GLY C C 4.660 -1.233 -0.997 1.00 . A A . 20 GLY C 1 1 2 1416 1 1 20 GLY CA C 6.068 -0.739 -0.898 1.00 . A A . 20 GLY CA 1 1 2 1417 1 1 20 GLY H H 6.803 -1.558 0.868 1.00 . A A . 20 GLY H 1 1 2 1418 1 1 20 GLY HA2 H 6.144 0.260 -1.293 1.00 . A A . 20 GLY HA2 1 1 2 1419 1 1 20 GLY HA3 H 6.709 -1.405 -1.445 1.00 . A A . 20 GLY HA3 1 1 2 1420 1 1 20 GLY N N 6.452 -0.747 0.485 1.00 . A A . 20 GLY N 1 1 2 1421 1 1 20 GLY O O 3.845 -0.734 -1.765 1.00 . A A . 20 GLY O 1 1 2 1422 1 1 21 LYS C C 2.749 -3.148 1.380 1.00 . A A . 21 LYS C 1 1 2 1423 1 1 21 LYS CA C 3.102 -2.860 -0.089 1.00 . A A . 21 LYS CA 1 1 2 1424 1 1 21 LYS CB C 3.059 -4.155 -0.901 1.00 . A A . 21 LYS CB 1 1 2 1425 1 1 21 LYS CD C 4.026 -3.675 -3.172 1.00 . A A . 21 LYS CD 1 1 2 1426 1 1 21 LYS CE C 3.758 -3.695 -4.667 1.00 . A A . 21 LYS CE 1 1 2 1427 1 1 21 LYS CG C 2.760 -3.951 -2.377 1.00 . A A . 21 LYS CG 1 1 2 1428 1 1 21 LYS H H 5.152 -2.622 0.321 1.00 . A A . 21 LYS H 1 1 2 1429 1 1 21 LYS HA H 2.379 -2.165 -0.496 1.00 . A A . 21 LYS HA 1 1 2 1430 1 1 21 LYS HB2 H 4.019 -4.642 -0.819 1.00 . A A . 21 LYS HB2 1 1 2 1431 1 1 21 LYS HB3 H 2.299 -4.800 -0.487 1.00 . A A . 21 LYS HB3 1 1 2 1432 1 1 21 LYS HD2 H 4.407 -2.704 -2.901 1.00 . A A . 21 LYS HD2 1 1 2 1433 1 1 21 LYS HD3 H 4.760 -4.431 -2.937 1.00 . A A . 21 LYS HD3 1 1 2 1434 1 1 21 LYS HE2 H 3.327 -4.650 -4.930 1.00 . A A . 21 LYS HE2 1 1 2 1435 1 1 21 LYS HE3 H 3.058 -2.907 -4.905 1.00 . A A . 21 LYS HE3 1 1 2 1436 1 1 21 LYS HG2 H 2.291 -4.842 -2.765 1.00 . A A . 21 LYS HG2 1 1 2 1437 1 1 21 LYS HG3 H 2.087 -3.112 -2.486 1.00 . A A . 21 LYS HG3 1 1 2 1438 1 1 21 LYS HZ1 H 5.421 -2.565 -5.233 1.00 . A A . 21 LYS HZ1 1 1 2 1439 1 1 21 LYS HZ2 H 4.793 -3.529 -6.473 1.00 . A A . 21 LYS HZ2 1 1 2 1440 1 1 21 LYS HZ3 H 5.695 -4.233 -5.229 1.00 . A A . 21 LYS HZ3 1 1 2 1441 1 1 21 LYS N N 4.409 -2.248 -0.196 1.00 . A A . 21 LYS N 1 1 2 1442 1 1 21 LYS NZ N 5.004 -3.492 -5.456 1.00 . A A . 21 LYS NZ 1 1 2 1443 1 1 21 LYS O O 1.674 -3.667 1.660 1.00 . A A . 21 LYS O 1 1 2 1444 1 1 22 ASP C C 2.629 -1.879 4.371 1.00 . A A . 22 ASP C 1 1 2 1445 1 1 22 ASP CA C 3.407 -3.012 3.738 1.00 . A A . 22 ASP CA 1 1 2 1446 1 1 22 ASP CB C 4.733 -3.150 4.488 1.00 . A A . 22 ASP CB 1 1 2 1447 1 1 22 ASP CG C 4.566 -3.776 5.860 1.00 . A A . 22 ASP CG 1 1 2 1448 1 1 22 ASP H H 4.448 -2.328 2.059 1.00 . A A . 22 ASP H 1 1 2 1449 1 1 22 ASP HA H 2.850 -3.910 3.825 1.00 . A A . 22 ASP HA 1 1 2 1450 1 1 22 ASP HB2 H 5.414 -3.750 3.909 1.00 . A A . 22 ASP HB2 1 1 2 1451 1 1 22 ASP HB3 H 5.157 -2.167 4.622 1.00 . A A . 22 ASP HB3 1 1 2 1452 1 1 22 ASP N N 3.636 -2.774 2.319 1.00 . A A . 22 ASP N 1 1 2 1453 1 1 22 ASP O O 2.495 -1.804 5.590 1.00 . A A . 22 ASP O 1 1 2 1454 1 1 22 ASP OD1 O 3.413 -3.922 6.310 1.00 . A A . 22 ASP OD1 1 1 2 1455 1 1 22 ASP OD2 O 5.591 -4.105 6.491 1.00 . A A . 22 ASP OD2 1 1 2 1456 1 1 23 VAL C C -0.101 -0.188 4.120 1.00 . A A . 23 VAL C 1 1 2 1457 1 1 23 VAL CA C 1.377 0.131 4.013 1.00 . A A . 23 VAL CA 1 1 2 1458 1 1 23 VAL CB C 1.590 1.325 3.084 1.00 . A A . 23 VAL CB 1 1 2 1459 1 1 23 VAL CG1 C 0.865 1.127 1.764 1.00 . A A . 23 VAL CG1 1 1 2 1460 1 1 23 VAL CG2 C 1.149 2.601 3.756 1.00 . A A . 23 VAL CG2 1 1 2 1461 1 1 23 VAL H H 2.296 -1.092 2.594 1.00 . A A . 23 VAL H 1 1 2 1462 1 1 23 VAL HA H 1.747 0.397 4.988 1.00 . A A . 23 VAL HA 1 1 2 1463 1 1 23 VAL HB H 2.650 1.397 2.880 1.00 . A A . 23 VAL HB 1 1 2 1464 1 1 23 VAL HG11 H 0.827 2.064 1.240 1.00 . A A . 23 VAL HG11 1 1 2 1465 1 1 23 VAL HG12 H -0.140 0.778 1.943 1.00 . A A . 23 VAL HG12 1 1 2 1466 1 1 23 VAL HG13 H 1.397 0.402 1.166 1.00 . A A . 23 VAL HG13 1 1 2 1467 1 1 23 VAL HG21 H 1.111 2.443 4.821 1.00 . A A . 23 VAL HG21 1 1 2 1468 1 1 23 VAL HG22 H 0.169 2.877 3.399 1.00 . A A . 23 VAL HG22 1 1 2 1469 1 1 23 VAL HG23 H 1.852 3.390 3.532 1.00 . A A . 23 VAL HG23 1 1 2 1470 1 1 23 VAL N N 2.131 -0.997 3.544 1.00 . A A . 23 VAL N 1 1 2 1471 1 1 23 VAL O O -0.623 -1.038 3.398 1.00 . A A . 23 VAL O 1 1 2 1472 1 1 24 GLU C C -2.968 1.492 4.635 1.00 . A A . 24 GLU C 1 1 2 1473 1 1 24 GLU CA C -2.191 0.321 5.208 1.00 . A A . 24 GLU CA 1 1 2 1474 1 1 24 GLU CB C -2.513 0.156 6.690 1.00 . A A . 24 GLU CB 1 1 2 1475 1 1 24 GLU CD C -2.121 0.957 9.053 1.00 . A A . 24 GLU CD 1 1 2 1476 1 1 24 GLU CG C -1.839 1.186 7.581 1.00 . A A . 24 GLU CG 1 1 2 1477 1 1 24 GLU H H -0.300 1.211 5.510 1.00 . A A . 24 GLU H 1 1 2 1478 1 1 24 GLU HA H -2.471 -0.586 4.684 1.00 . A A . 24 GLU HA 1 1 2 1479 1 1 24 GLU HB2 H -3.581 0.243 6.818 1.00 . A A . 24 GLU HB2 1 1 2 1480 1 1 24 GLU HB3 H -2.201 -0.827 7.007 1.00 . A A . 24 GLU HB3 1 1 2 1481 1 1 24 GLU HG2 H -0.772 1.138 7.423 1.00 . A A . 24 GLU HG2 1 1 2 1482 1 1 24 GLU HG3 H -2.198 2.168 7.309 1.00 . A A . 24 GLU HG3 1 1 2 1483 1 1 24 GLU N N -0.770 0.520 5.003 1.00 . A A . 24 GLU N 1 1 2 1484 1 1 24 GLU O O -3.056 2.557 5.248 1.00 . A A . 24 GLU O 1 1 2 1485 1 1 24 GLU OE1 O -1.394 0.157 9.679 1.00 . A A . 24 GLU OE1 1 1 2 1486 1 1 24 GLU OE2 O -3.068 1.578 9.579 1.00 . A A . 24 GLU OE2 1 1 2 1487 1 1 25 TYR C C -5.777 2.000 2.839 1.00 . A A . 25 TYR C 1 1 2 1488 1 1 25 TYR CA C -4.293 2.320 2.784 1.00 . A A . 25 TYR CA 1 1 2 1489 1 1 25 TYR CB C -3.849 2.438 1.328 1.00 . A A . 25 TYR CB 1 1 2 1490 1 1 25 TYR CD1 C -1.465 3.210 1.650 1.00 . A A . 25 TYR CD1 1 1 2 1491 1 1 25 TYR CD2 C -2.921 4.588 0.370 1.00 . A A . 25 TYR CD2 1 1 2 1492 1 1 25 TYR CE1 C -0.439 4.114 1.473 1.00 . A A . 25 TYR CE1 1 1 2 1493 1 1 25 TYR CE2 C -1.897 5.500 0.191 1.00 . A A . 25 TYR CE2 1 1 2 1494 1 1 25 TYR CG C -2.724 3.428 1.102 1.00 . A A . 25 TYR CG 1 1 2 1495 1 1 25 TYR CZ C -0.662 5.233 0.629 1.00 . A A . 25 TYR CZ 1 1 2 1496 1 1 25 TYR H H -3.450 0.412 3.039 1.00 . A A . 25 TYR H 1 1 2 1497 1 1 25 TYR HA H -4.105 3.255 3.282 1.00 . A A . 25 TYR HA 1 1 2 1498 1 1 25 TYR HB2 H -3.511 1.469 0.988 1.00 . A A . 25 TYR HB2 1 1 2 1499 1 1 25 TYR HB3 H -4.691 2.750 0.729 1.00 . A A . 25 TYR HB3 1 1 2 1500 1 1 25 TYR HD1 H -1.294 2.318 2.218 1.00 . A A . 25 TYR HD1 1 1 2 1501 1 1 25 TYR HD2 H -3.891 4.776 -0.064 1.00 . A A . 25 TYR HD2 1 1 2 1502 1 1 25 TYR HE1 H 0.531 3.921 1.907 1.00 . A A . 25 TYR HE1 1 1 2 1503 1 1 25 TYR HE2 H -2.070 6.397 -0.381 1.00 . A A . 25 TYR HE2 1 1 2 1504 1 1 25 TYR HH H 1.179 5.698 0.406 1.00 . A A . 25 TYR HH 1 1 2 1505 1 1 25 TYR N N -3.531 1.288 3.457 1.00 . A A . 25 TYR N 1 1 2 1506 1 1 25 TYR O O -6.166 0.838 2.863 1.00 . A A . 25 TYR O 1 1 2 1507 1 1 25 TYR OH O 0.358 6.165 0.578 1.00 . A A . 25 TYR OH 1 1 2 1508 1 1 26 LEU C C -8.541 2.746 1.459 1.00 . A A . 26 LEU C 1 1 2 1509 1 1 26 LEU CA C -8.038 2.854 2.877 1.00 . A A . 26 LEU CA 1 1 2 1510 1 1 26 LEU CB C -8.705 4.034 3.588 1.00 . A A . 26 LEU CB 1 1 2 1511 1 1 26 LEU CD1 C -10.907 4.734 4.572 1.00 . A A . 26 LEU CD1 1 1 2 1512 1 1 26 LEU CD2 C -10.496 4.990 2.114 1.00 . A A . 26 LEU CD2 1 1 2 1513 1 1 26 LEU CG C -10.211 4.154 3.353 1.00 . A A . 26 LEU CG 1 1 2 1514 1 1 26 LEU H H -6.240 3.930 2.812 1.00 . A A . 26 LEU H 1 1 2 1515 1 1 26 LEU HA H -8.260 1.937 3.401 1.00 . A A . 26 LEU HA 1 1 2 1516 1 1 26 LEU HB2 H -8.528 3.938 4.649 1.00 . A A . 26 LEU HB2 1 1 2 1517 1 1 26 LEU HB3 H -8.236 4.945 3.245 1.00 . A A . 26 LEU HB3 1 1 2 1518 1 1 26 LEU HD11 H -11.920 5.003 4.314 1.00 . A A . 26 LEU HD11 1 1 2 1519 1 1 26 LEU HD12 H -10.375 5.610 4.908 1.00 . A A . 26 LEU HD12 1 1 2 1520 1 1 26 LEU HD13 H -10.921 3.997 5.360 1.00 . A A . 26 LEU HD13 1 1 2 1521 1 1 26 LEU HD21 H -10.314 4.394 1.230 1.00 . A A . 26 LEU HD21 1 1 2 1522 1 1 26 LEU HD22 H -9.850 5.854 2.105 1.00 . A A . 26 LEU HD22 1 1 2 1523 1 1 26 LEU HD23 H -11.527 5.309 2.125 1.00 . A A . 26 LEU HD23 1 1 2 1524 1 1 26 LEU HG H -10.611 3.172 3.180 1.00 . A A . 26 LEU HG 1 1 2 1525 1 1 26 LEU N N -6.602 3.031 2.845 1.00 . A A . 26 LEU N 1 1 2 1526 1 1 26 LEU O O -7.882 3.206 0.533 1.00 . A A . 26 LEU O 1 1 2 1527 1 1 27 VAL C C -11.709 2.192 -0.185 1.00 . A A . 27 VAL C 1 1 2 1528 1 1 27 VAL CA C -10.206 2.008 -0.074 1.00 . A A . 27 VAL CA 1 1 2 1529 1 1 27 VAL CB C -9.736 0.699 -0.770 1.00 . A A . 27 VAL CB 1 1 2 1530 1 1 27 VAL CG1 C -8.663 -0.019 0.033 1.00 . A A . 27 VAL CG1 1 1 2 1531 1 1 27 VAL CG2 C -10.870 -0.269 -1.120 1.00 . A A . 27 VAL CG2 1 1 2 1532 1 1 27 VAL H H -10.182 1.753 2.025 1.00 . A A . 27 VAL H 1 1 2 1533 1 1 27 VAL HA H -9.764 2.806 -0.638 1.00 . A A . 27 VAL HA 1 1 2 1534 1 1 27 VAL HB H -9.285 1.019 -1.683 1.00 . A A . 27 VAL HB 1 1 2 1535 1 1 27 VAL HG11 H -9.096 -0.420 0.938 1.00 . A A . 27 VAL HG11 1 1 2 1536 1 1 27 VAL HG12 H -7.879 0.679 0.289 1.00 . A A . 27 VAL HG12 1 1 2 1537 1 1 27 VAL HG13 H -8.250 -0.822 -0.557 1.00 . A A . 27 VAL HG13 1 1 2 1538 1 1 27 VAL HG21 H -11.469 0.149 -1.917 1.00 . A A . 27 VAL HG21 1 1 2 1539 1 1 27 VAL HG22 H -11.489 -0.429 -0.253 1.00 . A A . 27 VAL HG22 1 1 2 1540 1 1 27 VAL HG23 H -10.454 -1.211 -1.442 1.00 . A A . 27 VAL HG23 1 1 2 1541 1 1 27 VAL N N -9.695 2.135 1.270 1.00 . A A . 27 VAL N 1 1 2 1542 1 1 27 VAL O O -12.499 1.388 0.309 1.00 . A A . 27 VAL O 1 1 2 1543 1 1 28 ARG C C -13.751 2.871 -2.414 1.00 . A A . 28 ARG C 1 1 2 1544 1 1 28 ARG CA C -13.466 3.550 -1.111 1.00 . A A . 28 ARG CA 1 1 2 1545 1 1 28 ARG CB C -13.738 5.042 -1.228 1.00 . A A . 28 ARG CB 1 1 2 1546 1 1 28 ARG CD C -13.614 7.309 -0.154 1.00 . A A . 28 ARG CD 1 1 2 1547 1 1 28 ARG CG C -13.128 5.870 -0.109 1.00 . A A . 28 ARG CG 1 1 2 1548 1 1 28 ARG CZ C -13.432 9.343 1.217 1.00 . A A . 28 ARG CZ 1 1 2 1549 1 1 28 ARG H H -11.399 3.923 -1.118 1.00 . A A . 28 ARG H 1 1 2 1550 1 1 28 ARG HA H -14.080 3.109 -0.346 1.00 . A A . 28 ARG HA 1 1 2 1551 1 1 28 ARG HB2 H -13.333 5.380 -2.167 1.00 . A A . 28 ARG HB2 1 1 2 1552 1 1 28 ARG HB3 H -14.807 5.203 -1.228 1.00 . A A . 28 ARG HB3 1 1 2 1553 1 1 28 ARG HD2 H -13.366 7.730 -1.117 1.00 . A A . 28 ARG HD2 1 1 2 1554 1 1 28 ARG HD3 H -14.686 7.317 -0.025 1.00 . A A . 28 ARG HD3 1 1 2 1555 1 1 28 ARG HE H -12.239 7.751 1.375 1.00 . A A . 28 ARG HE 1 1 2 1556 1 1 28 ARG HG2 H -13.405 5.436 0.839 1.00 . A A . 28 ARG HG2 1 1 2 1557 1 1 28 ARG HG3 H -12.052 5.858 -0.212 1.00 . A A . 28 ARG HG3 1 1 2 1558 1 1 28 ARG HH11 H -14.924 9.365 -0.147 1.00 . A A . 28 ARG HH11 1 1 2 1559 1 1 28 ARG HH12 H -14.786 10.792 0.825 1.00 . A A . 28 ARG HH12 1 1 2 1560 1 1 28 ARG HH21 H -12.048 9.628 2.662 1.00 . A A . 28 ARG HH21 1 1 2 1561 1 1 28 ARG HH22 H -13.152 10.941 2.422 1.00 . A A . 28 ARG HH22 1 1 2 1562 1 1 28 ARG N N -12.081 3.282 -0.828 1.00 . A A . 28 ARG N 1 1 2 1563 1 1 28 ARG NE N -13.005 8.128 0.891 1.00 . A A . 28 ARG NE 1 1 2 1564 1 1 28 ARG NH1 N -14.465 9.878 0.579 1.00 . A A . 28 ARG NH1 1 1 2 1565 1 1 28 ARG NH2 N -12.827 10.027 2.179 1.00 . A A . 28 ARG NH2 1 1 2 1566 1 1 28 ARG O O -13.770 3.506 -3.468 1.00 . A A . 28 ARG O 1 1 2 1567 1 1 29 TRP C C -14.826 1.440 -4.617 1.00 . A A . 29 TRP C 1 1 2 1568 1 1 29 TRP CA C -14.197 0.695 -3.461 1.00 . A A . 29 TRP CA 1 1 2 1569 1 1 29 TRP CB C -15.107 -0.443 -3.034 1.00 . A A . 29 TRP CB 1 1 2 1570 1 1 29 TRP CD1 C -13.947 -1.924 -4.771 1.00 . A A . 29 TRP CD1 1 1 2 1571 1 1 29 TRP CD2 C -15.420 -3.006 -3.479 1.00 . A A . 29 TRP CD2 1 1 2 1572 1 1 29 TRP CE2 C -14.856 -3.925 -4.384 1.00 . A A . 29 TRP CE2 1 1 2 1573 1 1 29 TRP CE3 C -16.375 -3.460 -2.565 1.00 . A A . 29 TRP CE3 1 1 2 1574 1 1 29 TRP CG C -14.823 -1.732 -3.743 1.00 . A A . 29 TRP CG 1 1 2 1575 1 1 29 TRP CH2 C -16.153 -5.687 -3.495 1.00 . A A . 29 TRP CH2 1 1 2 1576 1 1 29 TRP CZ2 C -15.216 -5.270 -4.401 1.00 . A A . 29 TRP CZ2 1 1 2 1577 1 1 29 TRP CZ3 C -16.732 -4.796 -2.583 1.00 . A A . 29 TRP CZ3 1 1 2 1578 1 1 29 TRP H H -13.935 1.154 -1.425 1.00 . A A . 29 TRP H 1 1 2 1579 1 1 29 TRP HA H -13.249 0.284 -3.782 1.00 . A A . 29 TRP HA 1 1 2 1580 1 1 29 TRP HB2 H -14.983 -0.598 -1.974 1.00 . A A . 29 TRP HB2 1 1 2 1581 1 1 29 TRP HB3 H -16.133 -0.169 -3.235 1.00 . A A . 29 TRP HB3 1 1 2 1582 1 1 29 TRP HD1 H -13.333 -1.144 -5.204 1.00 . A A . 29 TRP HD1 1 1 2 1583 1 1 29 TRP HE1 H -13.415 -3.627 -5.880 1.00 . A A . 29 TRP HE1 1 1 2 1584 1 1 29 TRP HE3 H -16.833 -2.789 -1.854 1.00 . A A . 29 TRP HE3 1 1 2 1585 1 1 29 TRP HH2 H -16.462 -6.722 -3.474 1.00 . A A . 29 TRP HH2 1 1 2 1586 1 1 29 TRP HZ2 H -14.779 -5.971 -5.098 1.00 . A A . 29 TRP HZ2 1 1 2 1587 1 1 29 TRP HZ3 H -17.468 -5.164 -1.884 1.00 . A A . 29 TRP HZ3 1 1 2 1588 1 1 29 TRP N N -13.953 1.560 -2.315 1.00 . A A . 29 TRP N 1 1 2 1589 1 1 29 TRP NE1 N -13.959 -3.240 -5.161 1.00 . A A . 29 TRP NE1 1 1 2 1590 1 1 29 TRP O O -16.040 1.606 -4.678 1.00 . A A . 29 TRP O 1 1 2 1591 1 1 30 LYS C C -15.738 2.241 -7.209 1.00 . A A . 30 LYS C 1 1 2 1592 1 1 30 LYS CA C -14.357 2.677 -6.703 1.00 . A A . 30 LYS CA 1 1 2 1593 1 1 30 LYS CB C -13.337 2.447 -7.818 1.00 . A A . 30 LYS CB 1 1 2 1594 1 1 30 LYS CD C -12.544 3.028 -10.130 1.00 . A A . 30 LYS CD 1 1 2 1595 1 1 30 LYS CE C -12.784 3.883 -11.362 1.00 . A A . 30 LYS CE 1 1 2 1596 1 1 30 LYS CG C -13.580 3.300 -9.052 1.00 . A A . 30 LYS CG 1 1 2 1597 1 1 30 LYS H H -12.977 1.874 -5.265 1.00 . A A . 30 LYS H 1 1 2 1598 1 1 30 LYS HA H -14.382 3.730 -6.462 1.00 . A A . 30 LYS HA 1 1 2 1599 1 1 30 LYS HB2 H -12.354 2.670 -7.440 1.00 . A A . 30 LYS HB2 1 1 2 1600 1 1 30 LYS HB3 H -13.373 1.409 -8.113 1.00 . A A . 30 LYS HB3 1 1 2 1601 1 1 30 LYS HD2 H -11.563 3.249 -9.736 1.00 . A A . 30 LYS HD2 1 1 2 1602 1 1 30 LYS HD3 H -12.595 1.986 -10.409 1.00 . A A . 30 LYS HD3 1 1 2 1603 1 1 30 LYS HE2 H -12.037 3.641 -12.104 1.00 . A A . 30 LYS HE2 1 1 2 1604 1 1 30 LYS HE3 H -13.765 3.659 -11.755 1.00 . A A . 30 LYS HE3 1 1 2 1605 1 1 30 LYS HG2 H -14.560 3.076 -9.445 1.00 . A A . 30 LYS HG2 1 1 2 1606 1 1 30 LYS HG3 H -13.532 4.343 -8.773 1.00 . A A . 30 LYS HG3 1 1 2 1607 1 1 30 LYS HZ1 H -12.858 5.896 -11.919 1.00 . A A . 30 LYS HZ1 1 1 2 1608 1 1 30 LYS HZ2 H -11.770 5.572 -10.664 1.00 . A A . 30 LYS HZ2 1 1 2 1609 1 1 30 LYS HZ3 H -13.433 5.597 -10.357 1.00 . A A . 30 LYS HZ3 1 1 2 1610 1 1 30 LYS N N -13.949 1.943 -5.489 1.00 . A A . 30 LYS N 1 1 2 1611 1 1 30 LYS NZ N -12.705 5.338 -11.054 1.00 . A A . 30 LYS NZ 1 1 2 1612 1 1 30 LYS O O -16.518 3.057 -7.698 1.00 . A A . 30 LYS O 1 1 2 1613 1 1 31 ASP C C -18.008 -0.242 -6.309 1.00 . A A . 31 ASP C 1 1 2 1614 1 1 31 ASP CA C -17.305 0.393 -7.507 1.00 . A A . 31 ASP CA 1 1 2 1615 1 1 31 ASP CB C -17.111 -0.647 -8.612 1.00 . A A . 31 ASP CB 1 1 2 1616 1 1 31 ASP CG C -18.422 -1.251 -9.077 1.00 . A A . 31 ASP CG 1 1 2 1617 1 1 31 ASP H H -15.342 0.343 -6.722 1.00 . A A . 31 ASP H 1 1 2 1618 1 1 31 ASP HA H -17.913 1.204 -7.881 1.00 . A A . 31 ASP HA 1 1 2 1619 1 1 31 ASP HB2 H -16.633 -0.178 -9.460 1.00 . A A . 31 ASP HB2 1 1 2 1620 1 1 31 ASP HB3 H -16.479 -1.442 -8.244 1.00 . A A . 31 ASP HB3 1 1 2 1621 1 1 31 ASP N N -16.020 0.946 -7.093 1.00 . A A . 31 ASP N 1 1 2 1622 1 1 31 ASP O O -18.349 -1.425 -6.328 1.00 . A A . 31 ASP O 1 1 2 1623 1 1 31 ASP OD1 O -19.068 -0.656 -9.965 1.00 . A A . 31 ASP OD1 1 1 2 1624 1 1 31 ASP OD2 O -18.801 -2.320 -8.554 1.00 . A A . 31 ASP OD2 1 1 2 1625 1 1 32 GLY C C -19.690 1.124 -3.364 1.00 . A A . 32 GLY C 1 1 2 1626 1 1 32 GLY CA C -18.858 0.065 -4.060 1.00 . A A . 32 GLY CA 1 1 2 1627 1 1 32 GLY H H -17.937 1.495 -5.318 1.00 . A A . 32 GLY H 1 1 2 1628 1 1 32 GLY HA2 H -19.493 -0.770 -4.313 1.00 . A A . 32 GLY HA2 1 1 2 1629 1 1 32 GLY HA3 H -18.088 -0.271 -3.375 1.00 . A A . 32 GLY HA3 1 1 2 1630 1 1 32 GLY N N -18.219 0.557 -5.266 1.00 . A A . 32 GLY N 1 1 2 1631 1 1 32 GLY O O -20.304 1.971 -4.013 1.00 . A A . 32 GLY O 1 1 2 1632 1 1 33 GLY C C -19.782 2.387 0.047 1.00 . A A . 33 GLY C 1 1 2 1633 1 1 33 GLY CA C -20.468 2.035 -1.260 1.00 . A A . 33 GLY CA 1 1 2 1634 1 1 33 GLY H H -19.205 0.367 -1.578 1.00 . A A . 33 GLY H 1 1 2 1635 1 1 33 GLY HA2 H -20.591 2.934 -1.846 1.00 . A A . 33 GLY HA2 1 1 2 1636 1 1 33 GLY HA3 H -21.441 1.621 -1.044 1.00 . A A . 33 GLY HA3 1 1 2 1637 1 1 33 GLY N N -19.709 1.070 -2.036 1.00 . A A . 33 GLY N 1 1 2 1638 1 1 33 GLY O O -19.685 3.559 0.408 1.00 . A A . 33 GLY O 1 1 2 1639 1 1 34 ASP C C -17.116 1.700 1.810 1.00 . A A . 34 ASP C 1 1 2 1640 1 1 34 ASP CA C -18.620 1.571 2.027 1.00 . A A . 34 ASP CA 1 1 2 1641 1 1 34 ASP CB C -18.913 0.410 2.980 1.00 . A A . 34 ASP CB 1 1 2 1642 1 1 34 ASP CG C -20.389 0.290 3.306 1.00 . A A . 34 ASP CG 1 1 2 1643 1 1 34 ASP H H -19.418 0.454 0.414 1.00 . A A . 34 ASP H 1 1 2 1644 1 1 34 ASP HA H -18.990 2.486 2.462 1.00 . A A . 34 ASP HA 1 1 2 1645 1 1 34 ASP HB2 H -18.589 -0.513 2.523 1.00 . A A . 34 ASP HB2 1 1 2 1646 1 1 34 ASP HB3 H -18.370 0.563 3.900 1.00 . A A . 34 ASP HB3 1 1 2 1647 1 1 34 ASP N N -19.305 1.367 0.755 1.00 . A A . 34 ASP N 1 1 2 1648 1 1 34 ASP O O -16.640 1.676 0.676 1.00 . A A . 34 ASP O 1 1 2 1649 1 1 34 ASP OD1 O -21.157 -0.150 2.425 1.00 . A A . 34 ASP OD1 1 1 2 1650 1 1 34 ASP OD2 O -20.775 0.637 4.441 1.00 . A A . 34 ASP OD2 1 1 2 1651 1 1 35 CYS C C -14.233 1.294 4.006 1.00 . A A . 35 CYS C 1 1 2 1652 1 1 35 CYS CA C -14.918 1.969 2.820 1.00 . A A . 35 CYS CA 1 1 2 1653 1 1 35 CYS CB C -14.523 3.446 2.761 1.00 . A A . 35 CYS CB 1 1 2 1654 1 1 35 CYS H H -16.803 1.848 3.781 1.00 . A A . 35 CYS H 1 1 2 1655 1 1 35 CYS HA H -14.594 1.484 1.911 1.00 . A A . 35 CYS HA 1 1 2 1656 1 1 35 CYS HB2 H -13.449 3.521 2.682 1.00 . A A . 35 CYS HB2 1 1 2 1657 1 1 35 CYS HB3 H -14.976 3.897 1.889 1.00 . A A . 35 CYS HB3 1 1 2 1658 1 1 35 CYS HG H -14.114 5.331 4.429 1.00 . A A . 35 CYS HG 1 1 2 1659 1 1 35 CYS N N -16.370 1.835 2.902 1.00 . A A . 35 CYS N 1 1 2 1660 1 1 35 CYS O O -14.696 1.391 5.142 1.00 . A A . 35 CYS O 1 1 2 1661 1 1 35 CYS SG S -15.036 4.405 4.206 1.00 . A A . 35 CYS SG 1 1 2 1662 1 1 36 GLU C C -10.873 0.200 4.632 1.00 . A A . 36 GLU C 1 1 2 1663 1 1 36 GLU CA C -12.365 -0.080 4.770 1.00 . A A . 36 GLU CA 1 1 2 1664 1 1 36 GLU CB C -12.621 -1.588 4.699 1.00 . A A . 36 GLU CB 1 1 2 1665 1 1 36 GLU CD C -14.639 -1.645 6.217 1.00 . A A . 36 GLU CD 1 1 2 1666 1 1 36 GLU CG C -14.087 -1.964 4.841 1.00 . A A . 36 GLU CG 1 1 2 1667 1 1 36 GLU H H -12.797 0.588 2.808 1.00 . A A . 36 GLU H 1 1 2 1668 1 1 36 GLU HA H -12.702 0.290 5.728 1.00 . A A . 36 GLU HA 1 1 2 1669 1 1 36 GLU HB2 H -12.264 -1.959 3.751 1.00 . A A . 36 GLU HB2 1 1 2 1670 1 1 36 GLU HB3 H -12.070 -2.071 5.493 1.00 . A A . 36 GLU HB3 1 1 2 1671 1 1 36 GLU HG2 H -14.657 -1.417 4.106 1.00 . A A . 36 GLU HG2 1 1 2 1672 1 1 36 GLU HG3 H -14.191 -3.024 4.663 1.00 . A A . 36 GLU HG3 1 1 2 1673 1 1 36 GLU N N -13.121 0.615 3.731 1.00 . A A . 36 GLU N 1 1 2 1674 1 1 36 GLU O O -10.453 0.964 3.763 1.00 . A A . 36 GLU O 1 1 2 1675 1 1 36 GLU OE1 O -14.388 -2.432 7.153 1.00 . A A . 36 GLU OE1 1 1 2 1676 1 1 36 GLU OE2 O -15.322 -0.610 6.357 1.00 . A A . 36 GLU OE2 1 1 2 1677 1 1 37 TRP C C -7.927 -1.443 4.861 1.00 . A A . 37 TRP C 1 1 2 1678 1 1 37 TRP CA C -8.632 -0.239 5.475 1.00 . A A . 37 TRP CA 1 1 2 1679 1 1 37 TRP CB C -8.117 -0.023 6.897 1.00 . A A . 37 TRP CB 1 1 2 1680 1 1 37 TRP CD1 C -9.057 2.358 6.957 1.00 . A A . 37 TRP CD1 1 1 2 1681 1 1 37 TRP CD2 C -8.956 1.363 8.959 1.00 . A A . 37 TRP CD2 1 1 2 1682 1 1 37 TRP CE2 C -9.486 2.657 9.127 1.00 . A A . 37 TRP CE2 1 1 2 1683 1 1 37 TRP CE3 C -8.801 0.547 10.083 1.00 . A A . 37 TRP CE3 1 1 2 1684 1 1 37 TRP CG C -8.689 1.192 7.563 1.00 . A A . 37 TRP CG 1 1 2 1685 1 1 37 TRP CH2 C -9.696 2.332 11.457 1.00 . A A . 37 TRP CH2 1 1 2 1686 1 1 37 TRP CZ2 C -9.860 3.152 10.375 1.00 . A A . 37 TRP CZ2 1 1 2 1687 1 1 37 TRP CZ3 C -9.172 1.040 11.321 1.00 . A A . 37 TRP CZ3 1 1 2 1688 1 1 37 TRP H H -10.468 -1.020 6.164 1.00 . A A . 37 TRP H 1 1 2 1689 1 1 37 TRP HA H -8.414 0.636 4.885 1.00 . A A . 37 TRP HA 1 1 2 1690 1 1 37 TRP HB2 H -8.372 -0.882 7.500 1.00 . A A . 37 TRP HB2 1 1 2 1691 1 1 37 TRP HB3 H -7.045 0.083 6.869 1.00 . A A . 37 TRP HB3 1 1 2 1692 1 1 37 TRP HD1 H -8.976 2.542 5.897 1.00 . A A . 37 TRP HD1 1 1 2 1693 1 1 37 TRP HE1 H -9.864 4.149 7.701 1.00 . A A . 37 TRP HE1 1 1 2 1694 1 1 37 TRP HE3 H -8.400 -0.452 9.999 1.00 . A A . 37 TRP HE3 1 1 2 1695 1 1 37 TRP HH2 H -9.973 2.676 12.443 1.00 . A A . 37 TRP HH2 1 1 2 1696 1 1 37 TRP HZ2 H -10.265 4.145 10.496 1.00 . A A . 37 TRP HZ2 1 1 2 1697 1 1 37 TRP HZ3 H -9.058 0.425 12.201 1.00 . A A . 37 TRP HZ3 1 1 2 1698 1 1 37 TRP N N -10.076 -0.424 5.495 1.00 . A A . 37 TRP N 1 1 2 1699 1 1 37 TRP NE1 N -9.537 3.244 7.890 1.00 . A A . 37 TRP NE1 1 1 2 1700 1 1 37 TRP O O -8.372 -2.580 5.013 1.00 . A A . 37 TRP O 1 1 2 1701 1 1 38 VAL C C -5.006 -2.764 4.535 1.00 . A A . 38 VAL C 1 1 2 1702 1 1 38 VAL CA C -6.045 -2.252 3.552 1.00 . A A . 38 VAL CA 1 1 2 1703 1 1 38 VAL CB C -5.337 -1.792 2.264 1.00 . A A . 38 VAL CB 1 1 2 1704 1 1 38 VAL CG1 C -4.514 -2.927 1.673 1.00 . A A . 38 VAL CG1 1 1 2 1705 1 1 38 VAL CG2 C -6.346 -1.286 1.250 1.00 . A A . 38 VAL CG2 1 1 2 1706 1 1 38 VAL H H -6.526 -0.254 4.062 1.00 . A A . 38 VAL H 1 1 2 1707 1 1 38 VAL HA H -6.720 -3.056 3.301 1.00 . A A . 38 VAL HA 1 1 2 1708 1 1 38 VAL HB H -4.669 -0.982 2.512 1.00 . A A . 38 VAL HB 1 1 2 1709 1 1 38 VAL HG11 H -5.087 -3.841 1.705 1.00 . A A . 38 VAL HG11 1 1 2 1710 1 1 38 VAL HG12 H -3.606 -3.050 2.244 1.00 . A A . 38 VAL HG12 1 1 2 1711 1 1 38 VAL HG13 H -4.267 -2.698 0.651 1.00 . A A . 38 VAL HG13 1 1 2 1712 1 1 38 VAL HG21 H -7.143 -0.770 1.765 1.00 . A A . 38 VAL HG21 1 1 2 1713 1 1 38 VAL HG22 H -6.755 -2.122 0.703 1.00 . A A . 38 VAL HG22 1 1 2 1714 1 1 38 VAL HG23 H -5.861 -0.608 0.565 1.00 . A A . 38 VAL HG23 1 1 2 1715 1 1 38 VAL N N -6.822 -1.185 4.167 1.00 . A A . 38 VAL N 1 1 2 1716 1 1 38 VAL O O -4.656 -2.077 5.494 1.00 . A A . 38 VAL O 1 1 2 1717 1 1 39 LYS C C -2.150 -3.961 5.012 1.00 . A A . 39 LYS C 1 1 2 1718 1 1 39 LYS CA C -3.534 -4.565 5.182 1.00 . A A . 39 LYS CA 1 1 2 1719 1 1 39 LYS CB C -3.482 -6.080 4.975 1.00 . A A . 39 LYS CB 1 1 2 1720 1 1 39 LYS CD C -2.556 -8.299 5.697 1.00 . A A . 39 LYS CD 1 1 2 1721 1 1 39 LYS CE C -3.957 -8.886 5.745 1.00 . A A . 39 LYS CE 1 1 2 1722 1 1 39 LYS CG C -2.571 -6.800 5.953 1.00 . A A . 39 LYS CG 1 1 2 1723 1 1 39 LYS H H -4.823 -4.470 3.513 1.00 . A A . 39 LYS H 1 1 2 1724 1 1 39 LYS HA H -3.856 -4.360 6.181 1.00 . A A . 39 LYS HA 1 1 2 1725 1 1 39 LYS HB2 H -4.480 -6.479 5.086 1.00 . A A . 39 LYS HB2 1 1 2 1726 1 1 39 LYS HB3 H -3.132 -6.282 3.974 1.00 . A A . 39 LYS HB3 1 1 2 1727 1 1 39 LYS HD2 H -2.134 -8.483 4.720 1.00 . A A . 39 LYS HD2 1 1 2 1728 1 1 39 LYS HD3 H -1.948 -8.777 6.450 1.00 . A A . 39 LYS HD3 1 1 2 1729 1 1 39 LYS HE2 H -4.544 -8.449 4.952 1.00 . A A . 39 LYS HE2 1 1 2 1730 1 1 39 LYS HE3 H -3.892 -9.953 5.598 1.00 . A A . 39 LYS HE3 1 1 2 1731 1 1 39 LYS HG2 H -1.567 -6.416 5.845 1.00 . A A . 39 LYS HG2 1 1 2 1732 1 1 39 LYS HG3 H -2.921 -6.619 6.959 1.00 . A A . 39 LYS HG3 1 1 2 1733 1 1 39 LYS HZ1 H -4.076 -9.027 7.827 1.00 . A A . 39 LYS HZ1 1 1 2 1734 1 1 39 LYS HZ2 H -5.580 -9.033 7.052 1.00 . A A . 39 LYS HZ2 1 1 2 1735 1 1 39 LYS HZ3 H -4.712 -7.590 7.200 1.00 . A A . 39 LYS HZ3 1 1 2 1736 1 1 39 LYS N N -4.513 -3.968 4.294 1.00 . A A . 39 LYS N 1 1 2 1737 1 1 39 LYS NZ N -4.629 -8.615 7.047 1.00 . A A . 39 LYS NZ 1 1 2 1738 1 1 39 LYS O O -1.465 -4.200 4.017 1.00 . A A . 39 LYS O 1 1 2 1739 1 1 40 GLY C C 0.589 -3.380 6.715 1.00 . A A . 40 GLY C 1 1 2 1740 1 1 40 GLY CA C -0.449 -2.551 5.992 1.00 . A A . 40 GLY CA 1 1 2 1741 1 1 40 GLY H H -2.369 -2.995 6.743 1.00 . A A . 40 GLY H 1 1 2 1742 1 1 40 GLY HA2 H -0.135 -2.432 4.970 1.00 . A A . 40 GLY HA2 1 1 2 1743 1 1 40 GLY HA3 H -0.511 -1.580 6.459 1.00 . A A . 40 GLY HA3 1 1 2 1744 1 1 40 GLY N N -1.755 -3.171 6.004 1.00 . A A . 40 GLY N 1 1 2 1745 1 1 40 GLY O O 1.415 -2.852 7.461 1.00 . A A . 40 GLY O 1 1 2 1746 1 1 41 VAL C C 2.286 -6.308 6.017 1.00 . A A . 41 VAL C 1 1 2 1747 1 1 41 VAL CA C 1.487 -5.603 7.109 1.00 . A A . 41 VAL CA 1 1 2 1748 1 1 41 VAL CB C 0.811 -6.683 7.973 1.00 . A A . 41 VAL CB 1 1 2 1749 1 1 41 VAL CG1 C 1.776 -7.196 9.030 1.00 . A A . 41 VAL CG1 1 1 2 1750 1 1 41 VAL CG2 C -0.467 -6.158 8.612 1.00 . A A . 41 VAL CG2 1 1 2 1751 1 1 41 VAL H H -0.185 -5.047 5.944 1.00 . A A . 41 VAL H 1 1 2 1752 1 1 41 VAL HA H 2.160 -5.032 7.731 1.00 . A A . 41 VAL HA 1 1 2 1753 1 1 41 VAL HB H 0.558 -7.510 7.326 1.00 . A A . 41 VAL HB 1 1 2 1754 1 1 41 VAL HG11 H 1.282 -7.940 9.637 1.00 . A A . 41 VAL HG11 1 1 2 1755 1 1 41 VAL HG12 H 2.096 -6.376 9.656 1.00 . A A . 41 VAL HG12 1 1 2 1756 1 1 41 VAL HG13 H 2.636 -7.638 8.548 1.00 . A A . 41 VAL HG13 1 1 2 1757 1 1 41 VAL HG21 H -1.165 -5.873 7.840 1.00 . A A . 41 VAL HG21 1 1 2 1758 1 1 41 VAL HG22 H -0.236 -5.299 9.225 1.00 . A A . 41 VAL HG22 1 1 2 1759 1 1 41 VAL HG23 H -0.905 -6.931 9.227 1.00 . A A . 41 VAL HG23 1 1 2 1760 1 1 41 VAL N N 0.527 -4.687 6.512 1.00 . A A . 41 VAL N 1 1 2 1761 1 1 41 VAL O O 3.107 -7.180 6.302 1.00 . A A . 41 VAL O 1 1 2 1762 1 1 42 HIS C C 4.148 -6.015 3.543 1.00 . A A . 42 HIS C 1 1 2 1763 1 1 42 HIS CA C 2.734 -6.530 3.642 1.00 . A A . 42 HIS CA 1 1 2 1764 1 1 42 HIS CB C 1.933 -6.316 2.358 1.00 . A A . 42 HIS CB 1 1 2 1765 1 1 42 HIS CD2 C 1.605 -8.768 1.579 1.00 . A A . 42 HIS CD2 1 1 2 1766 1 1 42 HIS CE1 C -0.584 -8.772 1.451 1.00 . A A . 42 HIS CE1 1 1 2 1767 1 1 42 HIS CG C 1.175 -7.534 1.931 1.00 . A A . 42 HIS CG 1 1 2 1768 1 1 42 HIS H H 1.390 -5.213 4.586 1.00 . A A . 42 HIS H 1 1 2 1769 1 1 42 HIS HA H 2.805 -7.571 3.837 1.00 . A A . 42 HIS HA 1 1 2 1770 1 1 42 HIS HB2 H 1.206 -5.534 2.532 1.00 . A A . 42 HIS HB2 1 1 2 1771 1 1 42 HIS HB3 H 2.596 -6.027 1.556 1.00 . A A . 42 HIS HB3 1 1 2 1772 1 1 42 HIS HD1 H -0.807 -6.823 2.030 1.00 . A A . 42 HIS HD1 1 1 2 1773 1 1 42 HIS HD2 H 2.632 -9.102 1.538 1.00 . A A . 42 HIS HD2 1 1 2 1774 1 1 42 HIS HE1 H -1.604 -9.092 1.296 1.00 . A A . 42 HIS HE1 1 1 2 1775 1 1 42 HIS HE2 H 0.487 -10.479 1.097 1.00 . A A . 42 HIS HE2 1 1 2 1776 1 1 42 HIS N N 2.043 -5.924 4.762 1.00 . A A . 42 HIS N 1 1 2 1777 1 1 42 HIS ND1 N -0.201 -7.569 1.839 1.00 . A A . 42 HIS ND1 1 1 2 1778 1 1 42 HIS NE2 N 0.492 -9.518 1.286 1.00 . A A . 42 HIS NE2 1 1 2 1779 1 1 42 HIS O O 4.487 -5.211 2.677 1.00 . A A . 42 HIS O 1 1 2 1780 1 1 43 VAL C C 7.157 -6.426 3.287 1.00 . A A . 43 VAL C 1 1 2 1781 1 1 43 VAL CA C 6.371 -6.194 4.561 1.00 . A A . 43 VAL CA 1 1 2 1782 1 1 43 VAL CB C 7.045 -6.972 5.711 1.00 . A A . 43 VAL CB 1 1 2 1783 1 1 43 VAL CG1 C 8.510 -6.584 5.848 1.00 . A A . 43 VAL CG1 1 1 2 1784 1 1 43 VAL CG2 C 6.304 -6.745 7.021 1.00 . A A . 43 VAL CG2 1 1 2 1785 1 1 43 VAL H H 4.592 -7.212 5.069 1.00 . A A . 43 VAL H 1 1 2 1786 1 1 43 VAL HA H 6.424 -5.151 4.790 1.00 . A A . 43 VAL HA 1 1 2 1787 1 1 43 VAL HB H 6.998 -8.026 5.479 1.00 . A A . 43 VAL HB 1 1 2 1788 1 1 43 VAL HG11 H 8.896 -6.956 6.785 1.00 . A A . 43 VAL HG11 1 1 2 1789 1 1 43 VAL HG12 H 8.601 -5.510 5.821 1.00 . A A . 43 VAL HG12 1 1 2 1790 1 1 43 VAL HG13 H 9.073 -7.012 5.032 1.00 . A A . 43 VAL HG13 1 1 2 1791 1 1 43 VAL HG21 H 6.595 -5.792 7.437 1.00 . A A . 43 VAL HG21 1 1 2 1792 1 1 43 VAL HG22 H 6.556 -7.531 7.718 1.00 . A A . 43 VAL HG22 1 1 2 1793 1 1 43 VAL HG23 H 5.240 -6.750 6.841 1.00 . A A . 43 VAL HG23 1 1 2 1794 1 1 43 VAL N N 4.965 -6.552 4.442 1.00 . A A . 43 VAL N 1 1 2 1795 1 1 43 VAL O O 7.939 -7.371 3.186 1.00 . A A . 43 VAL O 1 1 2 1796 1 1 44 ALA C C 8.919 -4.740 1.197 1.00 . A A . 44 ALA C 1 1 2 1797 1 1 44 ALA CA C 7.682 -5.614 1.073 1.00 . A A . 44 ALA CA 1 1 2 1798 1 1 44 ALA CB C 6.814 -5.180 -0.099 1.00 . A A . 44 ALA CB 1 1 2 1799 1 1 44 ALA H H 6.278 -4.846 2.444 1.00 . A A . 44 ALA H 1 1 2 1800 1 1 44 ALA HA H 7.991 -6.637 0.919 1.00 . A A . 44 ALA HA 1 1 2 1801 1 1 44 ALA HB1 H 5.878 -5.718 -0.072 1.00 . A A . 44 ALA HB1 1 1 2 1802 1 1 44 ALA HB2 H 7.326 -5.397 -1.024 1.00 . A A . 44 ALA HB2 1 1 2 1803 1 1 44 ALA HB3 H 6.622 -4.120 -0.032 1.00 . A A . 44 ALA HB3 1 1 2 1804 1 1 44 ALA N N 6.946 -5.551 2.317 1.00 . A A . 44 ALA N 1 1 2 1805 1 1 44 ALA O O 9.188 -3.888 0.351 1.00 . A A . 44 ALA O 1 1 2 1806 1 1 45 GLU C C 11.742 -4.069 1.318 1.00 . A A . 45 GLU C 1 1 2 1807 1 1 45 GLU CA C 10.883 -4.207 2.562 1.00 . A A . 45 GLU CA 1 1 2 1808 1 1 45 GLU CB C 11.684 -4.883 3.676 1.00 . A A . 45 GLU CB 1 1 2 1809 1 1 45 GLU CD C 13.766 -4.866 5.105 1.00 . A A . 45 GLU CD 1 1 2 1810 1 1 45 GLU CG C 12.982 -4.167 4.011 1.00 . A A . 45 GLU CG 1 1 2 1811 1 1 45 GLU H H 9.407 -5.687 2.884 1.00 . A A . 45 GLU H 1 1 2 1812 1 1 45 GLU HA H 10.584 -3.223 2.891 1.00 . A A . 45 GLU HA 1 1 2 1813 1 1 45 GLU HB2 H 11.077 -4.919 4.569 1.00 . A A . 45 GLU HB2 1 1 2 1814 1 1 45 GLU HB3 H 11.921 -5.892 3.373 1.00 . A A . 45 GLU HB3 1 1 2 1815 1 1 45 GLU HG2 H 13.596 -4.124 3.124 1.00 . A A . 45 GLU HG2 1 1 2 1816 1 1 45 GLU HG3 H 12.753 -3.164 4.339 1.00 . A A . 45 GLU HG3 1 1 2 1817 1 1 45 GLU N N 9.671 -4.970 2.274 1.00 . A A . 45 GLU N 1 1 2 1818 1 1 45 GLU O O 12.506 -3.114 1.178 1.00 . A A . 45 GLU O 1 1 2 1819 1 1 45 GLU OE1 O 13.488 -4.604 6.294 1.00 . A A . 45 GLU OE1 1 1 2 1820 1 1 45 GLU OE2 O 14.657 -5.676 4.771 1.00 . A A . 45 GLU OE2 1 1 2 1821 1 1 46 ASP C C 11.841 -3.905 -1.722 1.00 . A A . 46 ASP C 1 1 2 1822 1 1 46 ASP CA C 12.370 -5.008 -0.825 1.00 . A A . 46 ASP CA 1 1 2 1823 1 1 46 ASP CB C 12.281 -6.356 -1.537 1.00 . A A . 46 ASP CB 1 1 2 1824 1 1 46 ASP CG C 10.857 -6.728 -1.899 1.00 . A A . 46 ASP CG 1 1 2 1825 1 1 46 ASP H H 11.000 -5.781 0.605 1.00 . A A . 46 ASP H 1 1 2 1826 1 1 46 ASP HA H 13.403 -4.794 -0.593 1.00 . A A . 46 ASP HA 1 1 2 1827 1 1 46 ASP HB2 H 12.865 -6.313 -2.443 1.00 . A A . 46 ASP HB2 1 1 2 1828 1 1 46 ASP HB3 H 12.683 -7.122 -0.891 1.00 . A A . 46 ASP HB3 1 1 2 1829 1 1 46 ASP N N 11.616 -5.034 0.422 1.00 . A A . 46 ASP N 1 1 2 1830 1 1 46 ASP O O 12.609 -3.114 -2.267 1.00 . A A . 46 ASP O 1 1 2 1831 1 1 46 ASP OD1 O 10.395 -6.322 -2.985 1.00 . A A . 46 ASP OD1 1 1 2 1832 1 1 46 ASP OD2 O 10.204 -7.428 -1.096 1.00 . A A . 46 ASP OD2 1 1 2 1833 1 1 47 VAL C C 10.279 -1.446 -2.155 1.00 . A A . 47 VAL C 1 1 2 1834 1 1 47 VAL CA C 9.895 -2.825 -2.674 1.00 . A A . 47 VAL CA 1 1 2 1835 1 1 47 VAL CB C 8.364 -2.971 -2.679 1.00 . A A . 47 VAL CB 1 1 2 1836 1 1 47 VAL CG1 C 7.731 -1.922 -3.576 1.00 . A A . 47 VAL CG1 1 1 2 1837 1 1 47 VAL CG2 C 7.968 -4.369 -3.129 1.00 . A A . 47 VAL CG2 1 1 2 1838 1 1 47 VAL H H 9.960 -4.490 -1.374 1.00 . A A . 47 VAL H 1 1 2 1839 1 1 47 VAL HA H 10.255 -2.935 -3.685 1.00 . A A . 47 VAL HA 1 1 2 1840 1 1 47 VAL HB H 8.003 -2.824 -1.673 1.00 . A A . 47 VAL HB 1 1 2 1841 1 1 47 VAL HG11 H 6.655 -1.994 -3.511 1.00 . A A . 47 VAL HG11 1 1 2 1842 1 1 47 VAL HG12 H 8.042 -2.087 -4.596 1.00 . A A . 47 VAL HG12 1 1 2 1843 1 1 47 VAL HG13 H 8.046 -0.939 -3.257 1.00 . A A . 47 VAL HG13 1 1 2 1844 1 1 47 VAL HG21 H 8.511 -5.100 -2.550 1.00 . A A . 47 VAL HG21 1 1 2 1845 1 1 47 VAL HG22 H 8.204 -4.491 -4.175 1.00 . A A . 47 VAL HG22 1 1 2 1846 1 1 47 VAL HG23 H 6.907 -4.509 -2.980 1.00 . A A . 47 VAL HG23 1 1 2 1847 1 1 47 VAL N N 10.521 -3.844 -1.853 1.00 . A A . 47 VAL N 1 1 2 1848 1 1 47 VAL O O 10.673 -0.592 -2.915 1.00 . A A . 47 VAL O 1 1 2 1849 1 1 48 ALA C C 11.987 0.214 -0.156 1.00 . A A . 48 ALA C 1 1 2 1850 1 1 48 ALA CA C 10.493 -0.062 -0.106 1.00 . A A . 48 ALA CA 1 1 2 1851 1 1 48 ALA CB C 10.047 -0.201 1.342 1.00 . A A . 48 ALA CB 1 1 2 1852 1 1 48 ALA H H 9.835 -2.026 -0.350 1.00 . A A . 48 ALA H 1 1 2 1853 1 1 48 ALA HA H 9.957 0.769 -0.532 1.00 . A A . 48 ALA HA 1 1 2 1854 1 1 48 ALA HB1 H 10.273 0.711 1.877 1.00 . A A . 48 ALA HB1 1 1 2 1855 1 1 48 ALA HB2 H 10.569 -1.026 1.803 1.00 . A A . 48 ALA HB2 1 1 2 1856 1 1 48 ALA HB3 H 8.983 -0.383 1.376 1.00 . A A . 48 ALA HB3 1 1 2 1857 1 1 48 ALA N N 10.160 -1.287 -0.843 1.00 . A A . 48 ALA N 1 1 2 1858 1 1 48 ALA O O 12.418 1.281 -0.594 1.00 . A A . 48 ALA O 1 1 2 1859 1 1 49 LYS C C 14.710 -0.321 -1.111 1.00 . A A . 49 LYS C 1 1 2 1860 1 1 49 LYS CA C 14.225 -0.616 0.297 1.00 . A A . 49 LYS CA 1 1 2 1861 1 1 49 LYS CB C 14.894 -1.889 0.823 1.00 . A A . 49 LYS CB 1 1 2 1862 1 1 49 LYS CD C 17.027 -3.158 1.229 1.00 . A A . 49 LYS CD 1 1 2 1863 1 1 49 LYS CE C 16.799 -3.315 2.723 1.00 . A A . 49 LYS CE 1 1 2 1864 1 1 49 LYS CG C 16.410 -1.871 0.704 1.00 . A A . 49 LYS CG 1 1 2 1865 1 1 49 LYS H H 12.375 -1.590 0.625 1.00 . A A . 49 LYS H 1 1 2 1866 1 1 49 LYS HA H 14.482 0.212 0.939 1.00 . A A . 49 LYS HA 1 1 2 1867 1 1 49 LYS HB2 H 14.636 -2.015 1.863 1.00 . A A . 49 LYS HB2 1 1 2 1868 1 1 49 LYS HB3 H 14.520 -2.735 0.264 1.00 . A A . 49 LYS HB3 1 1 2 1869 1 1 49 LYS HD2 H 16.578 -3.996 0.717 1.00 . A A . 49 LYS HD2 1 1 2 1870 1 1 49 LYS HD3 H 18.089 -3.142 1.036 1.00 . A A . 49 LYS HD3 1 1 2 1871 1 1 49 LYS HE2 H 15.737 -3.277 2.919 1.00 . A A . 49 LYS HE2 1 1 2 1872 1 1 49 LYS HE3 H 17.188 -4.273 3.035 1.00 . A A . 49 LYS HE3 1 1 2 1873 1 1 49 LYS HG2 H 16.680 -1.754 -0.334 1.00 . A A . 49 LYS HG2 1 1 2 1874 1 1 49 LYS HG3 H 16.795 -1.039 1.275 1.00 . A A . 49 LYS HG3 1 1 2 1875 1 1 49 LYS HZ1 H 18.501 -2.274 3.344 1.00 . A A . 49 LYS HZ1 1 1 2 1876 1 1 49 LYS HZ2 H 17.286 -2.363 4.518 1.00 . A A . 49 LYS HZ2 1 1 2 1877 1 1 49 LYS HZ3 H 17.119 -1.308 3.207 1.00 . A A . 49 LYS HZ3 1 1 2 1878 1 1 49 LYS N N 12.777 -0.757 0.297 1.00 . A A . 49 LYS N 1 1 2 1879 1 1 49 LYS NZ N 17.473 -2.239 3.502 1.00 . A A . 49 LYS NZ 1 1 2 1880 1 1 49 LYS O O 15.670 0.416 -1.313 1.00 . A A . 49 LYS O 1 1 2 1881 1 1 50 ASP C C 13.602 0.453 -4.077 1.00 . A A . 50 ASP C 1 1 2 1882 1 1 50 ASP CA C 14.394 -0.710 -3.474 1.00 . A A . 50 ASP CA 1 1 2 1883 1 1 50 ASP CB C 14.194 -2.012 -4.270 1.00 . A A . 50 ASP CB 1 1 2 1884 1 1 50 ASP CG C 12.805 -2.189 -4.874 1.00 . A A . 50 ASP CG 1 1 2 1885 1 1 50 ASP H H 13.294 -1.511 -1.862 1.00 . A A . 50 ASP H 1 1 2 1886 1 1 50 ASP HA H 15.442 -0.453 -3.499 1.00 . A A . 50 ASP HA 1 1 2 1887 1 1 50 ASP HB2 H 14.912 -2.040 -5.071 1.00 . A A . 50 ASP HB2 1 1 2 1888 1 1 50 ASP HB3 H 14.376 -2.845 -3.602 1.00 . A A . 50 ASP HB3 1 1 2 1889 1 1 50 ASP N N 14.041 -0.918 -2.084 1.00 . A A . 50 ASP N 1 1 2 1890 1 1 50 ASP O O 13.945 0.960 -5.144 1.00 . A A . 50 ASP O 1 1 2 1891 1 1 50 ASP OD1 O 12.350 -1.271 -5.588 1.00 . A A . 50 ASP OD1 1 1 2 1892 1 1 50 ASP OD2 O 12.164 -3.230 -4.617 1.00 . A A . 50 ASP OD2 1 1 2 1893 1 1 51 TYR C C 12.378 3.289 -3.629 1.00 . A A . 51 TYR C 1 1 2 1894 1 1 51 TYR CA C 11.704 1.955 -3.863 1.00 . A A . 51 TYR CA 1 1 2 1895 1 1 51 TYR CB C 10.350 1.977 -3.163 1.00 . A A . 51 TYR CB 1 1 2 1896 1 1 51 TYR CD1 C 9.474 0.541 -5.057 1.00 . A A . 51 TYR CD1 1 1 2 1897 1 1 51 TYR CD2 C 7.876 1.563 -3.610 1.00 . A A . 51 TYR CD2 1 1 2 1898 1 1 51 TYR CE1 C 8.451 -0.043 -5.779 1.00 . A A . 51 TYR CE1 1 1 2 1899 1 1 51 TYR CE2 C 6.849 0.982 -4.332 1.00 . A A . 51 TYR CE2 1 1 2 1900 1 1 51 TYR CG C 9.209 1.353 -3.959 1.00 . A A . 51 TYR CG 1 1 2 1901 1 1 51 TYR CZ C 7.106 0.247 -5.415 1.00 . A A . 51 TYR CZ 1 1 2 1902 1 1 51 TYR H H 12.321 0.448 -2.538 1.00 . A A . 51 TYR H 1 1 2 1903 1 1 51 TYR HA H 11.545 1.790 -4.895 1.00 . A A . 51 TYR HA 1 1 2 1904 1 1 51 TYR HB2 H 10.445 1.448 -2.247 1.00 . A A . 51 TYR HB2 1 1 2 1905 1 1 51 TYR HB3 H 10.079 3.002 -2.949 1.00 . A A . 51 TYR HB3 1 1 2 1906 1 1 51 TYR HD1 H 10.497 0.369 -5.350 1.00 . A A . 51 TYR HD1 1 1 2 1907 1 1 51 TYR HD2 H 7.642 2.195 -2.770 1.00 . A A . 51 TYR HD2 1 1 2 1908 1 1 51 TYR HE1 H 8.680 -0.671 -6.628 1.00 . A A . 51 TYR HE1 1 1 2 1909 1 1 51 TYR HE2 H 5.823 1.157 -4.045 1.00 . A A . 51 TYR HE2 1 1 2 1910 1 1 51 TYR HH H 6.330 -1.322 -6.297 1.00 . A A . 51 TYR HH 1 1 2 1911 1 1 51 TYR N N 12.542 0.873 -3.384 1.00 . A A . 51 TYR N 1 1 2 1912 1 1 51 TYR O O 12.660 4.044 -4.560 1.00 . A A . 51 TYR O 1 1 2 1913 1 1 51 TYR OH O 6.122 -0.400 -6.131 1.00 . A A . 51 TYR OH 1 1 2 1914 1 1 52 GLU C C 14.772 4.696 -1.913 1.00 . A A . 52 GLU C 1 1 2 1915 1 1 52 GLU CA C 13.254 4.800 -1.934 1.00 . A A . 52 GLU CA 1 1 2 1916 1 1 52 GLU CB C 12.746 5.202 -0.547 1.00 . A A . 52 GLU CB 1 1 2 1917 1 1 52 GLU CD C 12.805 4.775 1.941 1.00 . A A . 52 GLU CD 1 1 2 1918 1 1 52 GLU CG C 13.242 4.298 0.570 1.00 . A A . 52 GLU CG 1 1 2 1919 1 1 52 GLU H H 12.433 2.869 -1.681 1.00 . A A . 52 GLU H 1 1 2 1920 1 1 52 GLU HA H 12.961 5.552 -2.639 1.00 . A A . 52 GLU HA 1 1 2 1921 1 1 52 GLU HB2 H 13.072 6.210 -0.336 1.00 . A A . 52 GLU HB2 1 1 2 1922 1 1 52 GLU HB3 H 11.666 5.176 -0.550 1.00 . A A . 52 GLU HB3 1 1 2 1923 1 1 52 GLU HG2 H 12.852 3.304 0.411 1.00 . A A . 52 GLU HG2 1 1 2 1924 1 1 52 GLU HG3 H 14.321 4.271 0.541 1.00 . A A . 52 GLU HG3 1 1 2 1925 1 1 52 GLU N N 12.641 3.552 -2.355 1.00 . A A . 52 GLU N 1 1 2 1926 1 1 52 GLU O O 15.477 5.613 -2.333 1.00 . A A . 52 GLU O 1 1 2 1927 1 1 52 GLU OE1 O 13.192 5.897 2.330 1.00 . A A . 52 GLU OE1 1 1 2 1928 1 1 52 GLU OE2 O 12.078 4.025 2.626 1.00 . A A . 52 GLU OE2 1 1 2 1929 1 1 53 ASP C C 17.258 2.727 -2.603 1.00 . A A . 53 ASP C 1 1 2 1930 1 1 53 ASP CA C 16.697 3.334 -1.319 1.00 . A A . 53 ASP CA 1 1 2 1931 1 1 53 ASP CB C 16.979 2.417 -0.132 1.00 . A A . 53 ASP CB 1 1 2 1932 1 1 53 ASP CG C 17.532 3.171 1.062 1.00 . A A . 53 ASP CG 1 1 2 1933 1 1 53 ASP H H 14.645 2.873 -1.115 1.00 . A A . 53 ASP H 1 1 2 1934 1 1 53 ASP HA H 17.177 4.286 -1.148 1.00 . A A . 53 ASP HA 1 1 2 1935 1 1 53 ASP HB2 H 16.053 1.941 0.167 1.00 . A A . 53 ASP HB2 1 1 2 1936 1 1 53 ASP HB3 H 17.693 1.663 -0.425 1.00 . A A . 53 ASP HB3 1 1 2 1937 1 1 53 ASP N N 15.265 3.569 -1.421 1.00 . A A . 53 ASP N 1 1 2 1938 1 1 53 ASP O O 18.415 2.960 -2.952 1.00 . A A . 53 ASP O 1 1 2 1939 1 1 53 ASP OD1 O 18.748 3.452 1.076 1.00 . A A . 53 ASP OD1 1 1 2 1940 1 1 53 ASP OD2 O 16.748 3.479 1.985 1.00 . A A . 53 ASP OD2 1 1 2 1941 1 1 54 GLY C C 17.189 2.350 -5.615 1.00 . A A . 54 GLY C 1 1 2 1942 1 1 54 GLY CA C 16.884 1.331 -4.537 1.00 . A A . 54 GLY CA 1 1 2 1943 1 1 54 GLY H H 15.526 1.797 -2.979 1.00 . A A . 54 GLY H 1 1 2 1944 1 1 54 GLY HA2 H 17.776 0.756 -4.338 1.00 . A A . 54 GLY HA2 1 1 2 1945 1 1 54 GLY HA3 H 16.112 0.667 -4.897 1.00 . A A . 54 GLY HA3 1 1 2 1946 1 1 54 GLY N N 16.438 1.950 -3.302 1.00 . A A . 54 GLY N 1 1 2 1947 1 1 54 GLY O O 18.243 2.300 -6.248 1.00 . A A . 54 GLY O 1 1 2 1948 1 1 55 LEU C C 17.595 5.232 -6.479 1.00 . A A . 55 LEU C 1 1 2 1949 1 1 55 LEU CA C 16.429 4.314 -6.831 1.00 . A A . 55 LEU CA 1 1 2 1950 1 1 55 LEU CB C 15.143 5.130 -6.970 1.00 . A A . 55 LEU CB 1 1 2 1951 1 1 55 LEU CD1 C 15.504 5.716 -9.380 1.00 . A A . 55 LEU CD1 1 1 2 1952 1 1 55 LEU CD2 C 13.898 7.045 -7.998 1.00 . A A . 55 LEU CD2 1 1 2 1953 1 1 55 LEU CG C 15.203 6.264 -7.994 1.00 . A A . 55 LEU CG 1 1 2 1954 1 1 55 LEU H H 15.442 3.263 -5.285 1.00 . A A . 55 LEU H 1 1 2 1955 1 1 55 LEU HA H 16.641 3.829 -7.773 1.00 . A A . 55 LEU HA 1 1 2 1956 1 1 55 LEU HB2 H 14.345 4.459 -7.252 1.00 . A A . 55 LEU HB2 1 1 2 1957 1 1 55 LEU HB3 H 14.908 5.557 -6.007 1.00 . A A . 55 LEU HB3 1 1 2 1958 1 1 55 LEU HD11 H 14.718 5.038 -9.678 1.00 . A A . 55 LEU HD11 1 1 2 1959 1 1 55 LEU HD12 H 16.446 5.187 -9.360 1.00 . A A . 55 LEU HD12 1 1 2 1960 1 1 55 LEU HD13 H 15.563 6.531 -10.085 1.00 . A A . 55 LEU HD13 1 1 2 1961 1 1 55 LEU HD21 H 13.086 6.386 -8.266 1.00 . A A . 55 LEU HD21 1 1 2 1962 1 1 55 LEU HD22 H 13.961 7.849 -8.717 1.00 . A A . 55 LEU HD22 1 1 2 1963 1 1 55 LEU HD23 H 13.720 7.454 -7.015 1.00 . A A . 55 LEU HD23 1 1 2 1964 1 1 55 LEU HG H 15.999 6.942 -7.724 1.00 . A A . 55 LEU HG 1 1 2 1965 1 1 55 LEU N N 16.260 3.277 -5.823 1.00 . A A . 55 LEU N 1 1 2 1966 1 1 55 LEU O O 18.644 5.194 -7.123 1.00 . A A . 55 LEU O 1 1 2 1967 1 1 56 GLU C C 19.343 6.343 -3.965 1.00 . A A . 56 GLU C 1 1 2 1968 1 1 56 GLU CA C 18.447 6.982 -5.020 1.00 . A A . 56 GLU CA 1 1 2 1969 1 1 56 GLU CB C 17.827 8.263 -4.471 1.00 . A A . 56 GLU CB 1 1 2 1970 1 1 56 GLU CD C 16.489 10.351 -4.955 1.00 . A A . 56 GLU CD 1 1 2 1971 1 1 56 GLU CG C 17.007 9.032 -5.495 1.00 . A A . 56 GLU CG 1 1 2 1972 1 1 56 GLU H H 16.550 6.043 -4.979 1.00 . A A . 56 GLU H 1 1 2 1973 1 1 56 GLU HA H 19.046 7.228 -5.878 1.00 . A A . 56 GLU HA 1 1 2 1974 1 1 56 GLU HB2 H 17.183 8.007 -3.648 1.00 . A A . 56 GLU HB2 1 1 2 1975 1 1 56 GLU HB3 H 18.615 8.908 -4.114 1.00 . A A . 56 GLU HB3 1 1 2 1976 1 1 56 GLU HG2 H 17.628 9.232 -6.355 1.00 . A A . 56 GLU HG2 1 1 2 1977 1 1 56 GLU HG3 H 16.165 8.424 -5.792 1.00 . A A . 56 GLU HG3 1 1 2 1978 1 1 56 GLU N N 17.407 6.057 -5.454 1.00 . A A . 56 GLU N 1 1 2 1979 1 1 56 GLU O O 19.404 6.805 -2.826 1.00 . A A . 56 GLU O 1 1 2 1980 1 1 56 GLU OE1 O 15.402 10.354 -4.340 1.00 . A A . 56 GLU OE1 1 1 2 1981 1 1 56 GLU OE2 O 17.171 11.379 -5.148 1.00 . A A . 56 GLU OE2 1 1 2 1982 1 1 57 TYR C C 22.216 5.371 -3.224 1.00 . A A . 57 TYR C 1 1 2 1983 1 1 57 TYR CA C 20.932 4.575 -3.443 1.00 . A A . 57 TYR CA 1 1 2 1984 1 1 57 TYR CB C 21.265 3.187 -3.994 1.00 . A A . 57 TYR CB 1 1 2 1985 1 1 57 TYR CD1 C 21.687 1.732 -1.973 1.00 . A A . 57 TYR CD1 1 1 2 1986 1 1 57 TYR CD2 C 23.537 2.271 -3.377 1.00 . A A . 57 TYR CD2 1 1 2 1987 1 1 57 TYR CE1 C 22.520 0.995 -1.153 1.00 . A A . 57 TYR CE1 1 1 2 1988 1 1 57 TYR CE2 C 24.376 1.537 -2.560 1.00 . A A . 57 TYR CE2 1 1 2 1989 1 1 57 TYR CG C 22.180 2.382 -3.098 1.00 . A A . 57 TYR CG 1 1 2 1990 1 1 57 TYR CZ C 23.862 0.900 -1.450 1.00 . A A . 57 TYR CZ 1 1 2 1991 1 1 57 TYR H H 19.941 4.957 -5.274 1.00 . A A . 57 TYR H 1 1 2 1992 1 1 57 TYR HA H 20.425 4.466 -2.496 1.00 . A A . 57 TYR HA 1 1 2 1993 1 1 57 TYR HB2 H 20.350 2.629 -4.119 1.00 . A A . 57 TYR HB2 1 1 2 1994 1 1 57 TYR HB3 H 21.750 3.296 -4.953 1.00 . A A . 57 TYR HB3 1 1 2 1995 1 1 57 TYR HD1 H 20.634 1.808 -1.742 1.00 . A A . 57 TYR HD1 1 1 2 1996 1 1 57 TYR HD2 H 23.936 2.772 -4.247 1.00 . A A . 57 TYR HD2 1 1 2 1997 1 1 57 TYR HE1 H 22.118 0.498 -0.283 1.00 . A A . 57 TYR HE1 1 1 2 1998 1 1 57 TYR HE2 H 25.428 1.464 -2.795 1.00 . A A . 57 TYR HE2 1 1 2 1999 1 1 57 TYR HH H 24.290 -0.680 -0.443 1.00 . A A . 57 TYR HH 1 1 2 2000 1 1 57 TYR N N 20.036 5.278 -4.353 1.00 . A A . 57 TYR N 1 1 2 2001 1 1 57 TYR O O 22.252 6.188 -2.280 1.00 . A A . 57 TYR O 1 1 2 2002 1 1 57 TYR OXT O 23.174 5.168 -3.998 1.00 . A A . 57 TYR OXT 1 1 2 2003 1 1 57 TYR OH O 24.696 0.168 -0.636 1.00 . A A . 57 TYR OH 1 1 2 2004 2 2 1 ALA C C -13.824 -8.044 5.697 1.00 . B B . 1 ALA C 1 1 2 2005 2 2 1 ALA CA C -13.433 -9.397 6.290 1.00 . B B . 1 ALA CA 1 1 2 2006 2 2 1 ALA CB C -13.032 -10.359 5.182 1.00 . B B . 1 ALA CB 1 1 2 2007 2 2 1 ALA H1 H -14.258 -10.882 7.500 1.00 . B B . 1 ALA H1 1 1 2 2008 2 2 1 ALA H2 H -15.380 -10.124 6.486 1.00 . B B . 1 ALA H2 1 1 2 2009 2 2 1 ALA H3 H -14.805 -9.322 7.860 1.00 . B B . 1 ALA H3 1 1 2 2010 2 2 1 ALA HA H -12.583 -9.264 6.942 1.00 . B B . 1 ALA HA 1 1 2 2011 2 2 1 ALA HB1 H -12.699 -11.290 5.616 1.00 . B B . 1 ALA HB1 1 1 2 2012 2 2 1 ALA HB2 H -12.230 -9.925 4.602 1.00 . B B . 1 ALA HB2 1 1 2 2013 2 2 1 ALA HB3 H -13.881 -10.544 4.540 1.00 . B B . 1 ALA HB3 1 1 2 2014 2 2 1 ALA N N -14.546 -9.971 7.089 1.00 . B B . 1 ALA N 1 1 2 2015 2 2 1 ALA O O -14.945 -7.869 5.220 1.00 . B B . 1 ALA O 1 1 2 2016 2 2 2 PRO C C -13.038 -5.677 3.663 1.00 . B B . 2 PRO C 1 1 2 2017 2 2 2 PRO CA C -13.153 -5.726 5.187 1.00 . B B . 2 PRO CA 1 1 2 2018 2 2 2 PRO CB C -12.047 -4.892 5.830 1.00 . B B . 2 PRO CB 1 1 2 2019 2 2 2 PRO CD C -11.535 -7.191 6.273 1.00 . B B . 2 PRO CD 1 1 2 2020 2 2 2 PRO CG C -10.915 -5.845 6.000 1.00 . B B . 2 PRO CG 1 1 2 2021 2 2 2 PRO HA H -14.115 -5.351 5.495 1.00 . B B . 2 PRO HA 1 1 2 2022 2 2 2 PRO HB2 H -11.782 -4.073 5.177 1.00 . B B . 2 PRO HB2 1 1 2 2023 2 2 2 PRO HB3 H -12.387 -4.509 6.781 1.00 . B B . 2 PRO HB3 1 1 2 2024 2 2 2 PRO HD2 H -10.985 -7.969 5.766 1.00 . B B . 2 PRO HD2 1 1 2 2025 2 2 2 PRO HD3 H -11.568 -7.382 7.336 1.00 . B B . 2 PRO HD3 1 1 2 2026 2 2 2 PRO HG2 H -10.327 -5.881 5.095 1.00 . B B . 2 PRO HG2 1 1 2 2027 2 2 2 PRO HG3 H -10.302 -5.541 6.835 1.00 . B B . 2 PRO HG3 1 1 2 2028 2 2 2 PRO N N -12.899 -7.067 5.721 1.00 . B B . 2 PRO N 1 1 2 2029 2 2 2 PRO O O -11.947 -5.828 3.113 1.00 . B B . 2 PRO O 1 1 2 2030 2 2 3 PRO C C -13.362 -4.220 0.958 1.00 . B B . 3 PRO C 1 1 2 2031 2 2 3 PRO CA C -14.174 -5.397 1.491 1.00 . B B . 3 PRO CA 1 1 2 2032 2 2 3 PRO CB C -15.656 -5.225 1.142 1.00 . B B . 3 PRO CB 1 1 2 2033 2 2 3 PRO CD C -15.509 -5.267 3.526 1.00 . B B . 3 PRO CD 1 1 2 2034 2 2 3 PRO CG C -16.287 -4.687 2.380 1.00 . B B . 3 PRO CG 1 1 2 2035 2 2 3 PRO HA H -13.804 -6.312 1.054 1.00 . B B . 3 PRO HA 1 1 2 2036 2 2 3 PRO HB2 H -15.756 -4.536 0.316 1.00 . B B . 3 PRO HB2 1 1 2 2037 2 2 3 PRO HB3 H -16.077 -6.182 0.870 1.00 . B B . 3 PRO HB3 1 1 2 2038 2 2 3 PRO HD2 H -15.482 -4.573 4.354 1.00 . B B . 3 PRO HD2 1 1 2 2039 2 2 3 PRO HD3 H -15.937 -6.210 3.835 1.00 . B B . 3 PRO HD3 1 1 2 2040 2 2 3 PRO HG2 H -16.219 -3.609 2.388 1.00 . B B . 3 PRO HG2 1 1 2 2041 2 2 3 PRO HG3 H -17.319 -4.999 2.432 1.00 . B B . 3 PRO HG3 1 1 2 2042 2 2 3 PRO N N -14.165 -5.463 2.957 1.00 . B B . 3 PRO N 1 1 2 2043 2 2 3 PRO O O -12.810 -4.282 -0.140 1.00 . B B . 3 PRO O 1 1 2 2044 2 2 4 GLY C C -11.053 -2.248 1.253 1.00 . B B . 4 GLY C 1 1 2 2045 2 2 4 GLY CA C -12.542 -1.978 1.329 1.00 . B B . 4 GLY CA 1 1 2 2046 2 2 4 GLY H H -13.757 -3.154 2.605 1.00 . B B . 4 GLY H 1 1 2 2047 2 2 4 GLY HA2 H -12.891 -1.663 0.356 1.00 . B B . 4 GLY HA2 1 1 2 2048 2 2 4 GLY HA3 H -12.718 -1.183 2.036 1.00 . B B . 4 GLY HA3 1 1 2 2049 2 2 4 GLY N N -13.294 -3.149 1.741 1.00 . B B . 4 GLY N 1 1 2 2050 2 2 4 GLY O O -10.297 -1.872 2.148 1.00 . B B . 4 GLY O 1 1 2 2051 2 2 5 THR C C -8.871 -3.344 -1.494 1.00 . B B . 5 THR C 1 1 2 2052 2 2 5 THR CA C -9.227 -3.236 -0.014 1.00 . B B . 5 THR CA 1 1 2 2053 2 2 5 THR CB C -8.857 -4.555 0.687 1.00 . B B . 5 THR CB 1 1 2 2054 2 2 5 THR CG2 C -9.128 -4.468 2.182 1.00 . B B . 5 THR CG2 1 1 2 2055 2 2 5 THR H H -11.281 -3.158 -0.508 1.00 . B B . 5 THR H 1 1 2 2056 2 2 5 THR HA H -8.642 -2.443 0.425 1.00 . B B . 5 THR HA 1 1 2 2057 2 2 5 THR HB H -7.804 -4.742 0.538 1.00 . B B . 5 THR HB 1 1 2 2058 2 2 5 THR HG1 H -9.208 -5.911 -0.703 1.00 . B B . 5 THR HG1 1 1 2 2059 2 2 5 THR HG21 H -8.830 -5.391 2.655 1.00 . B B . 5 THR HG21 1 1 2 2060 2 2 5 THR HG22 H -10.181 -4.301 2.347 1.00 . B B . 5 THR HG22 1 1 2 2061 2 2 5 THR HG23 H -8.562 -3.650 2.602 1.00 . B B . 5 THR HG23 1 1 2 2062 2 2 5 THR N N -10.633 -2.907 0.178 1.00 . B B . 5 THR N 1 1 2 2063 2 2 5 THR O O -9.745 -3.520 -2.343 1.00 . B B . 5 THR O 1 1 2 2064 2 2 5 THR OG1 O -9.610 -5.638 0.125 1.00 . B B . 5 THR OG1 1 1 2 2065 2 2 6 ALA C C -5.574 -3.416 -3.198 1.00 . B B . 6 ALA C 1 1 2 2066 2 2 6 ALA CA C -7.096 -3.337 -3.165 1.00 . B B . 6 ALA CA 1 1 2 2067 2 2 6 ALA CB C -7.587 -2.155 -3.986 1.00 . B B . 6 ALA CB 1 1 2 2068 2 2 6 ALA H H -6.934 -3.093 -1.069 1.00 . B B . 6 ALA H 1 1 2 2069 2 2 6 ALA HA H -7.502 -4.241 -3.597 1.00 . B B . 6 ALA HA 1 1 2 2070 2 2 6 ALA HB1 H -8.665 -2.119 -3.955 1.00 . B B . 6 ALA HB1 1 1 2 2071 2 2 6 ALA HB2 H -7.261 -2.268 -5.009 1.00 . B B . 6 ALA HB2 1 1 2 2072 2 2 6 ALA HB3 H -7.184 -1.240 -3.578 1.00 . B B . 6 ALA HB3 1 1 2 2073 2 2 6 ALA N N -7.580 -3.240 -1.792 1.00 . B B . 6 ALA N 1 1 2 2074 2 2 6 ALA O O -4.908 -2.506 -3.691 1.00 . B B . 6 ALA O 1 1 2 2075 2 2 7 ARG C C -2.921 -4.328 -3.957 1.00 . B B . 7 ARG C 1 1 2 2076 2 2 7 ARG CA C -3.578 -4.705 -2.631 1.00 . B B . 7 ARG CA 1 1 2 2077 2 2 7 ARG CB C -3.236 -6.154 -2.273 1.00 . B B . 7 ARG CB 1 1 2 2078 2 2 7 ARG CD C -4.862 -6.379 -0.349 1.00 . B B . 7 ARG CD 1 1 2 2079 2 2 7 ARG CG C -3.411 -6.482 -0.795 1.00 . B B . 7 ARG CG 1 1 2 2080 2 2 7 ARG CZ C -6.994 -7.524 -0.788 1.00 . B B . 7 ARG CZ 1 1 2 2081 2 2 7 ARG H H -5.614 -5.216 -2.331 1.00 . B B . 7 ARG H 1 1 2 2082 2 2 7 ARG HA H -3.189 -4.056 -1.860 1.00 . B B . 7 ARG HA 1 1 2 2083 2 2 7 ARG HB2 H -3.871 -6.813 -2.845 1.00 . B B . 7 ARG HB2 1 1 2 2084 2 2 7 ARG HB3 H -2.207 -6.343 -2.540 1.00 . B B . 7 ARG HB3 1 1 2 2085 2 2 7 ARG HD2 H -4.927 -6.673 0.687 1.00 . B B . 7 ARG HD2 1 1 2 2086 2 2 7 ARG HD3 H -5.184 -5.353 -0.451 1.00 . B B . 7 ARG HD3 1 1 2 2087 2 2 7 ARG HE H -5.391 -7.611 -1.970 1.00 . B B . 7 ARG HE 1 1 2 2088 2 2 7 ARG HG2 H -3.067 -7.489 -0.619 1.00 . B B . 7 ARG HG2 1 1 2 2089 2 2 7 ARG HG3 H -2.817 -5.794 -0.213 1.00 . B B . 7 ARG HG3 1 1 2 2090 2 2 7 ARG HH11 H -6.938 -6.461 0.929 1.00 . B B . 7 ARG HH11 1 1 2 2091 2 2 7 ARG HH12 H -8.439 -7.260 0.600 1.00 . B B . 7 ARG HH12 1 1 2 2092 2 2 7 ARG HH21 H -7.360 -8.667 -2.414 1.00 . B B . 7 ARG HH21 1 1 2 2093 2 2 7 ARG HH22 H -8.678 -8.517 -1.302 1.00 . B B . 7 ARG HH22 1 1 2 2094 2 2 7 ARG N N -5.028 -4.513 -2.679 1.00 . B B . 7 ARG N 1 1 2 2095 2 2 7 ARG NE N -5.745 -7.235 -1.138 1.00 . B B . 7 ARG NE 1 1 2 2096 2 2 7 ARG NH1 N -7.499 -7.043 0.339 1.00 . B B . 7 ARG NH1 1 1 2 2097 2 2 7 ARG NH2 N -7.739 -8.299 -1.565 1.00 . B B . 7 ARG NH2 1 1 2 2098 2 2 7 ARG O O -3.369 -4.753 -5.024 1.00 . B B . 7 ARG O 1 1 2 2099 2 2 8 ARG C C -0.869 -4.235 -6.047 1.00 . B B . 8 ARG C 1 1 2 2100 2 2 8 ARG CA C -1.159 -3.083 -5.086 1.00 . B B . 8 ARG CA 1 1 2 2101 2 2 8 ARG CB C 0.149 -2.386 -4.716 1.00 . B B . 8 ARG CB 1 1 2 2102 2 2 8 ARG CD C 0.164 -0.552 -6.436 1.00 . B B . 8 ARG CD 1 1 2 2103 2 2 8 ARG CG C 0.874 -1.791 -5.911 1.00 . B B . 8 ARG CG 1 1 2 2104 2 2 8 ARG CZ C -1.756 0.017 -7.863 1.00 . B B . 8 ARG CZ 1 1 2 2105 2 2 8 ARG H H -1.545 -3.223 -3.007 1.00 . B B . 8 ARG H 1 1 2 2106 2 2 8 ARG HA H -1.797 -2.371 -5.589 1.00 . B B . 8 ARG HA 1 1 2 2107 2 2 8 ARG HB2 H -0.065 -1.591 -4.017 1.00 . B B . 8 ARG HB2 1 1 2 2108 2 2 8 ARG HB3 H 0.805 -3.103 -4.243 1.00 . B B . 8 ARG HB3 1 1 2 2109 2 2 8 ARG HD2 H -0.171 0.037 -5.596 1.00 . B B . 8 ARG HD2 1 1 2 2110 2 2 8 ARG HD3 H 0.862 0.025 -7.023 1.00 . B B . 8 ARG HD3 1 1 2 2111 2 2 8 ARG HE H -1.199 -1.838 -7.387 1.00 . B B . 8 ARG HE 1 1 2 2112 2 2 8 ARG HG2 H 1.878 -1.526 -5.619 1.00 . B B . 8 ARG HG2 1 1 2 2113 2 2 8 ARG HG3 H 0.911 -2.530 -6.698 1.00 . B B . 8 ARG HG3 1 1 2 2114 2 2 8 ARG HH11 H -0.733 1.603 -7.139 1.00 . B B . 8 ARG HH11 1 1 2 2115 2 2 8 ARG HH12 H -2.079 1.990 -8.158 1.00 . B B . 8 ARG HH12 1 1 2 2116 2 2 8 ARG HH21 H -2.974 -1.339 -8.735 1.00 . B B . 8 ARG HH21 1 1 2 2117 2 2 8 ARG HH22 H -3.352 0.319 -9.065 1.00 . B B . 8 ARG HH22 1 1 2 2118 2 2 8 ARG N N -1.861 -3.528 -3.887 1.00 . B B . 8 ARG N 1 1 2 2119 2 2 8 ARG NE N -0.990 -0.889 -7.265 1.00 . B B . 8 ARG NE 1 1 2 2120 2 2 8 ARG NH1 N -1.502 1.309 -7.707 1.00 . B B . 8 ARG NH1 1 1 2 2121 2 2 8 ARG NH2 N -2.778 -0.366 -8.616 1.00 . B B . 8 ARG NH2 1 1 2 2122 2 2 8 ARG O O -1.477 -4.327 -7.115 1.00 . B B . 8 ARG O 1 1 2 2123 2 2 9 LYS C C 0.414 -7.571 -5.780 1.00 . B B . 9 LYS C 1 1 2 2124 2 2 9 LYS CA C 0.431 -6.238 -6.527 1.00 . B B . 9 LYS CA 1 1 2 2125 2 2 9 LYS CB C 1.826 -6.002 -7.114 1.00 . B B . 9 LYS CB 1 1 2 2126 2 2 9 LYS CD C 3.224 -4.541 -8.606 1.00 . B B . 9 LYS CD 1 1 2 2127 2 2 9 LYS CE C 2.963 -5.332 -9.879 1.00 . B B . 9 LYS CE 1 1 2 2128 2 2 9 LYS CG C 2.036 -4.599 -7.657 1.00 . B B . 9 LYS CG 1 1 2 2129 2 2 9 LYS H H 0.482 -5.021 -4.788 1.00 . B B . 9 LYS H 1 1 2 2130 2 2 9 LYS HA H -0.282 -6.286 -7.335 1.00 . B B . 9 LYS HA 1 1 2 2131 2 2 9 LYS HB2 H 2.562 -6.179 -6.342 1.00 . B B . 9 LYS HB2 1 1 2 2132 2 2 9 LYS HB3 H 1.988 -6.701 -7.919 1.00 . B B . 9 LYS HB3 1 1 2 2133 2 2 9 LYS HD2 H 3.413 -3.510 -8.867 1.00 . B B . 9 LYS HD2 1 1 2 2134 2 2 9 LYS HD3 H 4.089 -4.952 -8.107 1.00 . B B . 9 LYS HD3 1 1 2 2135 2 2 9 LYS HE2 H 2.829 -6.371 -9.622 1.00 . B B . 9 LYS HE2 1 1 2 2136 2 2 9 LYS HE3 H 2.062 -4.957 -10.341 1.00 . B B . 9 LYS HE3 1 1 2 2137 2 2 9 LYS HG2 H 1.149 -4.289 -8.187 1.00 . B B . 9 LYS HG2 1 1 2 2138 2 2 9 LYS HG3 H 2.219 -3.930 -6.830 1.00 . B B . 9 LYS HG3 1 1 2 2139 2 2 9 LYS HZ1 H 4.229 -4.220 -11.113 1.00 . B B . 9 LYS HZ1 1 1 2 2140 2 2 9 LYS HZ2 H 3.884 -5.770 -11.701 1.00 . B B . 9 LYS HZ2 1 1 2 2141 2 2 9 LYS HZ3 H 4.967 -5.573 -10.416 1.00 . B B . 9 LYS HZ3 1 1 2 2142 2 2 9 LYS N N 0.055 -5.118 -5.665 1.00 . B B . 9 LYS N 1 1 2 2143 2 2 9 LYS NZ N 4.090 -5.215 -10.844 1.00 . B B . 9 LYS NZ 1 1 2 2144 2 2 9 LYS O O -0.180 -7.693 -4.708 1.00 . B B . 9 LYS O 1 1 2 2145 2 2 10 ARG C C 1.772 -9.861 -4.371 1.00 . B B . 10 ARG C 1 1 2 2146 2 2 10 ARG CA C 1.169 -9.901 -5.773 1.00 . B B . 10 ARG CA 1 1 2 2147 2 2 10 ARG CB C 2.026 -10.801 -6.661 1.00 . B B . 10 ARG CB 1 1 2 2148 2 2 10 ARG CD C 4.326 -11.240 -7.581 1.00 . B B . 10 ARG CD 1 1 2 2149 2 2 10 ARG CG C 3.394 -10.211 -6.962 1.00 . B B . 10 ARG CG 1 1 2 2150 2 2 10 ARG CZ C 6.567 -11.296 -8.592 1.00 . B B . 10 ARG CZ 1 1 2 2151 2 2 10 ARG H H 1.523 -8.408 -7.219 1.00 . B B . 10 ARG H 1 1 2 2152 2 2 10 ARG HA H 0.173 -10.310 -5.716 1.00 . B B . 10 ARG HA 1 1 2 2153 2 2 10 ARG HB2 H 2.167 -11.750 -6.166 1.00 . B B . 10 ARG HB2 1 1 2 2154 2 2 10 ARG HB3 H 1.512 -10.962 -7.596 1.00 . B B . 10 ARG HB3 1 1 2 2155 2 2 10 ARG HD2 H 4.422 -12.074 -6.900 1.00 . B B . 10 ARG HD2 1 1 2 2156 2 2 10 ARG HD3 H 3.898 -11.583 -8.511 1.00 . B B . 10 ARG HD3 1 1 2 2157 2 2 10 ARG HE H 5.873 -9.825 -7.438 1.00 . B B . 10 ARG HE 1 1 2 2158 2 2 10 ARG HG2 H 3.276 -9.389 -7.652 1.00 . B B . 10 ARG HG2 1 1 2 2159 2 2 10 ARG HG3 H 3.829 -9.848 -6.042 1.00 . B B . 10 ARG HG3 1 1 2 2160 2 2 10 ARG HH11 H 5.405 -12.896 -9.011 1.00 . B B . 10 ARG HH11 1 1 2 2161 2 2 10 ARG HH12 H 6.987 -12.921 -9.717 1.00 . B B . 10 ARG HH12 1 1 2 2162 2 2 10 ARG HH21 H 7.958 -9.848 -8.361 1.00 . B B . 10 ARG HH21 1 1 2 2163 2 2 10 ARG HH22 H 8.439 -11.190 -9.345 1.00 . B B . 10 ARG HH22 1 1 2 2164 2 2 10 ARG N N 1.080 -8.570 -6.363 1.00 . B B . 10 ARG N 1 1 2 2165 2 2 10 ARG NE N 5.652 -10.690 -7.842 1.00 . B B . 10 ARG NE 1 1 2 2166 2 2 10 ARG NH1 N 6.297 -12.467 -9.152 1.00 . B B . 10 ARG NH1 1 1 2 2167 2 2 10 ARG NH2 N 7.751 -10.732 -8.781 1.00 . B B . 10 ARG NH2 1 1 2 2168 2 2 10 ARG O O 1.663 -10.826 -3.617 1.00 . B B . 10 ARG O 1 1 2 2169 2 2 11 LYS C C 4.381 -9.311 -2.673 1.00 . B B . 11 LYS C 1 1 2 2170 2 2 11 LYS CA C 3.046 -8.577 -2.726 1.00 . B B . 11 LYS CA 1 1 2 2171 2 2 11 LYS CB C 2.128 -9.070 -1.598 1.00 . B B . 11 LYS CB 1 1 2 2172 2 2 11 LYS CD C -0.296 -9.650 -1.970 1.00 . B B . 11 LYS CD 1 1 2 2173 2 2 11 LYS CE C -1.721 -9.207 -1.689 1.00 . B B . 11 LYS CE 1 1 2 2174 2 2 11 LYS CG C 0.704 -8.538 -1.684 1.00 . B B . 11 LYS CG 1 1 2 2175 2 2 11 LYS H H 2.502 -8.025 -4.687 1.00 . B B . 11 LYS H 1 1 2 2176 2 2 11 LYS HA H 3.229 -7.521 -2.590 1.00 . B B . 11 LYS HA 1 1 2 2177 2 2 11 LYS HB2 H 2.091 -10.147 -1.621 1.00 . B B . 11 LYS HB2 1 1 2 2178 2 2 11 LYS HB3 H 2.547 -8.756 -0.655 1.00 . B B . 11 LYS HB3 1 1 2 2179 2 2 11 LYS HD2 H -0.222 -9.931 -3.008 1.00 . B B . 11 LYS HD2 1 1 2 2180 2 2 11 LYS HD3 H -0.062 -10.501 -1.347 1.00 . B B . 11 LYS HD3 1 1 2 2181 2 2 11 LYS HE2 H -1.807 -8.960 -0.643 1.00 . B B . 11 LYS HE2 1 1 2 2182 2 2 11 LYS HE3 H -1.937 -8.332 -2.285 1.00 . B B . 11 LYS HE3 1 1 2 2183 2 2 11 LYS HG2 H 0.447 -8.073 -0.744 1.00 . B B . 11 LYS HG2 1 1 2 2184 2 2 11 LYS HG3 H 0.650 -7.805 -2.477 1.00 . B B . 11 LYS HG3 1 1 2 2185 2 2 11 LYS HZ1 H -2.636 -10.531 -3.021 1.00 . B B . 11 LYS HZ1 1 1 2 2186 2 2 11 LYS HZ2 H -3.675 -9.933 -1.826 1.00 . B B . 11 LYS HZ2 1 1 2 2187 2 2 11 LYS HZ3 H -2.530 -11.116 -1.438 1.00 . B B . 11 LYS HZ3 1 1 2 2188 2 2 11 LYS N N 2.422 -8.748 -4.034 1.00 . B B . 11 LYS N 1 1 2 2189 2 2 11 LYS NZ N -2.710 -10.272 -2.016 1.00 . B B . 11 LYS NZ 1 1 2 2190 2 2 11 LYS O O 4.443 -10.488 -2.319 1.00 . B B . 11 LYS O 1 1 2 2191 2 2 12 ALA C C 7.078 -9.963 -1.756 1.00 . B B . 12 ALA C 1 1 2 2192 2 2 12 ALA CA C 6.792 -9.173 -3.031 1.00 . B B . 12 ALA CA 1 1 2 2193 2 2 12 ALA CB C 7.827 -8.073 -3.214 1.00 . B B . 12 ALA CB 1 1 2 2194 2 2 12 ALA H H 5.328 -7.669 -3.301 1.00 . B B . 12 ALA H 1 1 2 2195 2 2 12 ALA HA H 6.864 -9.841 -3.877 1.00 . B B . 12 ALA HA 1 1 2 2196 2 2 12 ALA HB1 H 7.589 -7.496 -4.095 1.00 . B B . 12 ALA HB1 1 1 2 2197 2 2 12 ALA HB2 H 8.806 -8.515 -3.326 1.00 . B B . 12 ALA HB2 1 1 2 2198 2 2 12 ALA HB3 H 7.822 -7.427 -2.348 1.00 . B B . 12 ALA HB3 1 1 2 2199 2 2 12 ALA N N 5.448 -8.602 -3.028 1.00 . B B . 12 ALA N 1 1 2 2200 2 2 12 ALA O O 7.918 -10.863 -1.752 1.00 . B B . 12 ALA O 1 1 2 2201 2 2 13 ASP C C 5.368 -11.193 0.926 1.00 . B B . 13 ASP C 1 1 2 2202 2 2 13 ASP CA C 6.570 -10.314 0.597 1.00 . B B . 13 ASP CA 1 1 2 2203 2 2 13 ASP CB C 6.798 -9.301 1.718 1.00 . B B . 13 ASP CB 1 1 2 2204 2 2 13 ASP CG C 6.924 -9.963 3.077 1.00 . B B . 13 ASP CG 1 1 2 2205 2 2 13 ASP H H 5.735 -8.891 -0.728 1.00 . B B . 13 ASP H 1 1 2 2206 2 2 13 ASP HA H 7.445 -10.941 0.507 1.00 . B B . 13 ASP HA 1 1 2 2207 2 2 13 ASP HB2 H 7.706 -8.753 1.521 1.00 . B B . 13 ASP HB2 1 1 2 2208 2 2 13 ASP HB3 H 5.965 -8.612 1.748 1.00 . B B . 13 ASP HB3 1 1 2 2209 2 2 13 ASP N N 6.380 -9.626 -0.676 1.00 . B B . 13 ASP N 1 1 2 2210 2 2 13 ASP O O 5.485 -12.171 1.666 1.00 . B B . 13 ASP O 1 1 2 2211 2 2 13 ASP OD1 O 5.886 -10.141 3.748 1.00 . B B . 13 ASP OD1 1 1 2 2212 2 2 13 ASP OD2 O 8.060 -10.303 3.468 1.00 . B B . 13 ASP OD2 1 1 2 2213 2 2 14 SER C C 2.796 -11.902 2.093 1.00 . B B . 14 SER C 1 1 2 2214 2 2 14 SER CA C 2.987 -11.599 0.609 1.00 . B B . 14 SER CA 1 1 2 2215 2 2 14 SER CB C 3.017 -12.904 -0.189 1.00 . B B . 14 SER CB 1 1 2 2216 2 2 14 SER H H 4.179 -10.046 -0.199 1.00 . B B . 14 SER H 1 1 2 2217 2 2 14 SER HA H 2.158 -11.000 0.267 1.00 . B B . 14 SER HA 1 1 2 2218 2 2 14 SER HB2 H 2.117 -13.465 0.009 1.00 . B B . 14 SER HB2 1 1 2 2219 2 2 14 SER HB3 H 3.077 -12.678 -1.243 1.00 . B B . 14 SER HB3 1 1 2 2220 2 2 14 SER HG H 4.901 -13.419 -0.334 1.00 . B B . 14 SER HG 1 1 2 2221 2 2 14 SER N N 4.211 -10.838 0.377 1.00 . B B . 14 SER N 1 1 2 2222 2 2 14 SER O O 3.304 -12.947 2.552 1.00 . B B . 14 SER O 1 1 2 2223 2 2 14 SER OXT O 2.140 -11.094 2.783 1.00 . B B . 14 SER OXT 1 1 2 2224 2 2 14 SER OG O 4.134 -13.696 0.173 1.00 . B B . 14 SER OG 1 1 3 2225 1 1 1 GLY C C 11.266 4.668 -5.718 1.00 . A A . 1 GLY C 1 1 3 2226 1 1 1 GLY CA C 10.684 3.455 -6.420 1.00 . A A . 1 GLY CA 1 1 3 2227 1 1 1 GLY H1 H 8.749 4.235 -6.537 1.00 . A A . 1 GLY H1 1 1 3 2228 1 1 1 GLY H2 H 8.974 3.150 -5.257 1.00 . A A . 1 GLY H2 1 1 3 2229 1 1 1 GLY H3 H 8.838 2.573 -6.840 1.00 . A A . 1 GLY H3 1 1 3 2230 1 1 1 GLY HA2 H 11.149 2.565 -6.021 1.00 . A A . 1 GLY HA2 1 1 3 2231 1 1 1 GLY HA3 H 10.909 3.522 -7.474 1.00 . A A . 1 GLY HA3 1 1 3 2232 1 1 1 GLY N N 9.208 3.346 -6.251 1.00 . A A . 1 GLY N 1 1 3 2233 1 1 1 GLY O O 12.245 5.250 -6.186 1.00 . A A . 1 GLY O 1 1 3 2234 1 1 2 SER C C 10.236 6.459 -2.619 1.00 . A A . 2 SER C 1 1 3 2235 1 1 2 SER CA C 11.130 6.203 -3.827 1.00 . A A . 2 SER CA 1 1 3 2236 1 1 2 SER CB C 11.177 7.446 -4.712 1.00 . A A . 2 SER CB 1 1 3 2237 1 1 2 SER H H 9.900 4.533 -4.263 1.00 . A A . 2 SER H 1 1 3 2238 1 1 2 SER HA H 12.126 5.990 -3.473 1.00 . A A . 2 SER HA 1 1 3 2239 1 1 2 SER HB2 H 11.498 8.291 -4.123 1.00 . A A . 2 SER HB2 1 1 3 2240 1 1 2 SER HB3 H 11.876 7.284 -5.518 1.00 . A A . 2 SER HB3 1 1 3 2241 1 1 2 SER HG H 10.001 7.983 -6.184 1.00 . A A . 2 SER HG 1 1 3 2242 1 1 2 SER N N 10.667 5.047 -4.591 1.00 . A A . 2 SER N 1 1 3 2243 1 1 2 SER O O 10.702 6.919 -1.578 1.00 . A A . 2 SER O 1 1 3 2244 1 1 2 SER OG O 9.903 7.732 -5.263 1.00 . A A . 2 SER OG 1 1 3 2245 1 1 3 GLN C C 7.951 5.099 -0.811 1.00 . A A . 3 GLN C 1 1 3 2246 1 1 3 GLN CA C 8.006 6.349 -1.676 1.00 . A A . 3 GLN CA 1 1 3 2247 1 1 3 GLN CB C 6.625 6.669 -2.228 1.00 . A A . 3 GLN CB 1 1 3 2248 1 1 3 GLN CD C 6.985 9.169 -2.191 1.00 . A A . 3 GLN CD 1 1 3 2249 1 1 3 GLN CG C 6.568 7.968 -3.016 1.00 . A A . 3 GLN CG 1 1 3 2250 1 1 3 GLN H H 8.628 5.811 -3.616 1.00 . A A . 3 GLN H 1 1 3 2251 1 1 3 GLN HA H 8.341 7.174 -1.080 1.00 . A A . 3 GLN HA 1 1 3 2252 1 1 3 GLN HB2 H 6.331 5.869 -2.879 1.00 . A A . 3 GLN HB2 1 1 3 2253 1 1 3 GLN HB3 H 5.924 6.735 -1.410 1.00 . A A . 3 GLN HB3 1 1 3 2254 1 1 3 GLN HE21 H 5.101 9.473 -1.633 1.00 . A A . 3 GLN HE21 1 1 3 2255 1 1 3 GLN HE22 H 6.259 10.590 -1.004 1.00 . A A . 3 GLN HE22 1 1 3 2256 1 1 3 GLN HG2 H 7.228 7.888 -3.865 1.00 . A A . 3 GLN HG2 1 1 3 2257 1 1 3 GLN HG3 H 5.556 8.120 -3.362 1.00 . A A . 3 GLN HG3 1 1 3 2258 1 1 3 GLN N N 8.950 6.160 -2.762 1.00 . A A . 3 GLN N 1 1 3 2259 1 1 3 GLN NE2 N 6.017 9.808 -1.543 1.00 . A A . 3 GLN NE2 1 1 3 2260 1 1 3 GLN O O 7.944 3.979 -1.322 1.00 . A A . 3 GLN O 1 1 3 2261 1 1 3 GLN OE1 O 8.164 9.521 -2.137 1.00 . A A . 3 GLN OE1 1 1 3 2262 1 1 4 VAL C C 6.434 3.820 1.751 1.00 . A A . 4 VAL C 1 1 3 2263 1 1 4 VAL CA C 7.872 4.178 1.428 1.00 . A A . 4 VAL CA 1 1 3 2264 1 1 4 VAL CB C 8.620 4.490 2.741 1.00 . A A . 4 VAL CB 1 1 3 2265 1 1 4 VAL CG1 C 9.082 3.205 3.408 1.00 . A A . 4 VAL CG1 1 1 3 2266 1 1 4 VAL CG2 C 9.796 5.424 2.493 1.00 . A A . 4 VAL CG2 1 1 3 2267 1 1 4 VAL H H 7.891 6.204 0.851 1.00 . A A . 4 VAL H 1 1 3 2268 1 1 4 VAL HA H 8.347 3.331 0.956 1.00 . A A . 4 VAL HA 1 1 3 2269 1 1 4 VAL HB H 7.933 4.983 3.408 1.00 . A A . 4 VAL HB 1 1 3 2270 1 1 4 VAL HG11 H 9.564 3.439 4.346 1.00 . A A . 4 VAL HG11 1 1 3 2271 1 1 4 VAL HG12 H 9.781 2.696 2.762 1.00 . A A . 4 VAL HG12 1 1 3 2272 1 1 4 VAL HG13 H 8.231 2.567 3.590 1.00 . A A . 4 VAL HG13 1 1 3 2273 1 1 4 VAL HG21 H 10.417 5.018 1.708 1.00 . A A . 4 VAL HG21 1 1 3 2274 1 1 4 VAL HG22 H 10.377 5.520 3.398 1.00 . A A . 4 VAL HG22 1 1 3 2275 1 1 4 VAL HG23 H 9.429 6.394 2.195 1.00 . A A . 4 VAL HG23 1 1 3 2276 1 1 4 VAL N N 7.912 5.293 0.500 1.00 . A A . 4 VAL N 1 1 3 2277 1 1 4 VAL O O 6.064 3.662 2.914 1.00 . A A . 4 VAL O 1 1 3 2278 1 1 5 PHE C C 3.484 3.389 -0.466 1.00 . A A . 5 PHE C 1 1 3 2279 1 1 5 PHE CA C 4.217 3.356 0.874 1.00 . A A . 5 PHE CA 1 1 3 2280 1 1 5 PHE CB C 3.560 4.340 1.841 1.00 . A A . 5 PHE CB 1 1 3 2281 1 1 5 PHE CD1 C 4.808 6.424 0.738 1.00 . A A . 5 PHE CD1 1 1 3 2282 1 1 5 PHE CD2 C 4.666 5.318 2.845 1.00 . A A . 5 PHE CD2 1 1 3 2283 1 1 5 PHE CE1 C 6.156 6.650 0.944 1.00 . A A . 5 PHE CE1 1 1 3 2284 1 1 5 PHE CE2 C 6.013 5.542 3.057 1.00 . A A . 5 PHE CE2 1 1 3 2285 1 1 5 PHE CG C 4.048 5.755 1.686 1.00 . A A . 5 PHE CG 1 1 3 2286 1 1 5 PHE CZ C 4.959 8.366 1.396 1.00 . A A . 5 PHE CZ 1 1 3 2287 1 1 5 PHE H H 5.974 3.835 -0.195 1.00 . A A . 5 PHE H 1 1 3 2288 1 1 5 PHE HA H 4.166 2.352 1.295 1.00 . A A . 5 PHE HA 1 1 3 2289 1 1 5 PHE HB2 H 2.495 4.339 1.675 1.00 . A A . 5 PHE HB2 1 1 3 2290 1 1 5 PHE HB3 H 3.761 4.028 2.847 1.00 . A A . 5 PHE HB3 1 1 3 2291 1 1 5 PHE HD1 H 4.337 6.769 -0.171 1.00 . A A . 5 PHE HD1 1 1 3 2292 1 1 5 PHE HD2 H 4.086 4.795 3.590 1.00 . A A . 5 PHE HD2 1 1 3 2293 1 1 5 PHE HE1 H 6.736 7.172 0.198 1.00 . A A . 5 PHE HE1 1 1 3 2294 1 1 5 PHE HE2 H 6.482 5.198 3.967 1.00 . A A . 5 PHE HE2 1 1 3 2295 1 1 5 PHE HZ H 5.312 9.380 1.283 1.00 . A A . 5 PHE HZ 1 1 3 2296 1 1 5 PHE N N 5.620 3.697 0.708 1.00 . A A . 5 PHE N 1 1 3 2297 1 1 5 PHE O O 3.783 4.217 -1.325 1.00 . A A . 5 PHE O 1 1 3 2298 1 1 6 GLU C C 0.252 2.355 -1.570 1.00 . A A . 6 GLU C 1 1 3 2299 1 1 6 GLU CA C 1.744 2.420 -1.869 1.00 . A A . 6 GLU CA 1 1 3 2300 1 1 6 GLU CB C 2.162 1.217 -2.706 1.00 . A A . 6 GLU CB 1 1 3 2301 1 1 6 GLU CD C 4.440 2.247 -3.008 1.00 . A A . 6 GLU CD 1 1 3 2302 1 1 6 GLU CG C 3.278 1.540 -3.675 1.00 . A A . 6 GLU CG 1 1 3 2303 1 1 6 GLU H H 2.348 1.842 0.076 1.00 . A A . 6 GLU H 1 1 3 2304 1 1 6 GLU HA H 1.944 3.321 -2.432 1.00 . A A . 6 GLU HA 1 1 3 2305 1 1 6 GLU HB2 H 2.491 0.425 -2.048 1.00 . A A . 6 GLU HB2 1 1 3 2306 1 1 6 GLU HB3 H 1.315 0.874 -3.274 1.00 . A A . 6 GLU HB3 1 1 3 2307 1 1 6 GLU HG2 H 3.633 0.623 -4.116 1.00 . A A . 6 GLU HG2 1 1 3 2308 1 1 6 GLU HG3 H 2.880 2.183 -4.446 1.00 . A A . 6 GLU HG3 1 1 3 2309 1 1 6 GLU N N 2.527 2.485 -0.638 1.00 . A A . 6 GLU N 1 1 3 2310 1 1 6 GLU O O -0.162 1.828 -0.542 1.00 . A A . 6 GLU O 1 1 3 2311 1 1 6 GLU OE1 O 5.047 1.654 -2.091 1.00 . A A . 6 GLU OE1 1 1 3 2312 1 1 6 GLU OE2 O 4.742 3.394 -3.399 1.00 . A A . 6 GLU OE2 1 1 3 2313 1 1 7 TYR C C -2.677 1.688 -2.903 1.00 . A A . 7 TYR C 1 1 3 2314 1 1 7 TYR CA C -1.989 2.898 -2.293 1.00 . A A . 7 TYR CA 1 1 3 2315 1 1 7 TYR CB C -2.566 4.186 -2.866 1.00 . A A . 7 TYR CB 1 1 3 2316 1 1 7 TYR CD1 C -3.099 3.898 -5.317 1.00 . A A . 7 TYR CD1 1 1 3 2317 1 1 7 TYR CD2 C -1.124 5.096 -4.729 1.00 . A A . 7 TYR CD2 1 1 3 2318 1 1 7 TYR CE1 C -2.820 4.089 -6.658 1.00 . A A . 7 TYR CE1 1 1 3 2319 1 1 7 TYR CE2 C -0.838 5.291 -6.066 1.00 . A A . 7 TYR CE2 1 1 3 2320 1 1 7 TYR CG C -2.257 4.397 -4.331 1.00 . A A . 7 TYR CG 1 1 3 2321 1 1 7 TYR CZ C -1.689 4.786 -7.026 1.00 . A A . 7 TYR CZ 1 1 3 2322 1 1 7 TYR H H -0.183 3.279 -3.292 1.00 . A A . 7 TYR H 1 1 3 2323 1 1 7 TYR HA H -2.172 2.879 -1.240 1.00 . A A . 7 TYR HA 1 1 3 2324 1 1 7 TYR HB2 H -3.631 4.167 -2.751 1.00 . A A . 7 TYR HB2 1 1 3 2325 1 1 7 TYR HB3 H -2.165 5.026 -2.317 1.00 . A A . 7 TYR HB3 1 1 3 2326 1 1 7 TYR HD1 H -3.984 3.352 -5.025 1.00 . A A . 7 TYR HD1 1 1 3 2327 1 1 7 TYR HD2 H -0.459 5.491 -3.974 1.00 . A A . 7 TYR HD2 1 1 3 2328 1 1 7 TYR HE1 H -3.487 3.694 -7.410 1.00 . A A . 7 TYR HE1 1 1 3 2329 1 1 7 TYR HE2 H 0.048 5.838 -6.355 1.00 . A A . 7 TYR HE2 1 1 3 2330 1 1 7 TYR HH H -2.193 5.296 -8.811 1.00 . A A . 7 TYR HH 1 1 3 2331 1 1 7 TYR N N -0.555 2.882 -2.482 1.00 . A A . 7 TYR N 1 1 3 2332 1 1 7 TYR O O -2.701 1.509 -4.121 1.00 . A A . 7 TYR O 1 1 3 2333 1 1 7 TYR OH O -1.407 4.979 -8.359 1.00 . A A . 7 TYR OH 1 1 3 2334 1 1 8 ALA C C -5.454 -0.045 -2.399 1.00 . A A . 8 ALA C 1 1 3 2335 1 1 8 ALA CA C -3.965 -0.326 -2.447 1.00 . A A . 8 ALA CA 1 1 3 2336 1 1 8 ALA CB C -3.612 -1.511 -1.557 1.00 . A A . 8 ALA CB 1 1 3 2337 1 1 8 ALA H H -3.162 1.061 -1.066 1.00 . A A . 8 ALA H 1 1 3 2338 1 1 8 ALA HA H -3.679 -0.559 -3.462 1.00 . A A . 8 ALA HA 1 1 3 2339 1 1 8 ALA HB1 H -3.433 -1.166 -0.548 1.00 . A A . 8 ALA HB1 1 1 3 2340 1 1 8 ALA HB2 H -2.723 -1.992 -1.934 1.00 . A A . 8 ALA HB2 1 1 3 2341 1 1 8 ALA HB3 H -4.430 -2.215 -1.554 1.00 . A A . 8 ALA HB3 1 1 3 2342 1 1 8 ALA N N -3.239 0.862 -2.027 1.00 . A A . 8 ALA N 1 1 3 2343 1 1 8 ALA O O -6.217 -0.773 -1.764 1.00 . A A . 8 ALA O 1 1 3 2344 1 1 9 GLU C C -7.847 1.348 -4.473 1.00 . A A . 9 GLU C 1 1 3 2345 1 1 9 GLU CA C -7.253 1.420 -3.093 1.00 . A A . 9 GLU CA 1 1 3 2346 1 1 9 GLU CB C -7.382 2.815 -2.479 1.00 . A A . 9 GLU CB 1 1 3 2347 1 1 9 GLU CD C -6.225 4.121 -4.315 1.00 . A A . 9 GLU CD 1 1 3 2348 1 1 9 GLU CG C -7.471 3.971 -3.465 1.00 . A A . 9 GLU CG 1 1 3 2349 1 1 9 GLU H H -5.213 1.558 -3.575 1.00 . A A . 9 GLU H 1 1 3 2350 1 1 9 GLU HA H -7.801 0.730 -2.487 1.00 . A A . 9 GLU HA 1 1 3 2351 1 1 9 GLU HB2 H -8.257 2.842 -1.862 1.00 . A A . 9 GLU HB2 1 1 3 2352 1 1 9 GLU HB3 H -6.519 2.972 -1.858 1.00 . A A . 9 GLU HB3 1 1 3 2353 1 1 9 GLU HG2 H -8.314 3.803 -4.116 1.00 . A A . 9 GLU HG2 1 1 3 2354 1 1 9 GLU HG3 H -7.628 4.882 -2.911 1.00 . A A . 9 GLU HG3 1 1 3 2355 1 1 9 GLU N N -5.863 1.022 -3.078 1.00 . A A . 9 GLU N 1 1 3 2356 1 1 9 GLU O O -7.146 1.264 -5.481 1.00 . A A . 9 GLU O 1 1 3 2357 1 1 9 GLU OE1 O -6.146 3.466 -5.375 1.00 . A A . 9 GLU OE1 1 1 3 2358 1 1 9 GLU OE2 O -5.328 4.894 -3.921 1.00 . A A . 9 GLU OE2 1 1 3 2359 1 1 10 VAL C C -10.318 2.654 -6.233 1.00 . A A . 10 VAL C 1 1 3 2360 1 1 10 VAL CA C -9.887 1.288 -5.717 1.00 . A A . 10 VAL CA 1 1 3 2361 1 1 10 VAL CB C -11.076 0.343 -5.543 1.00 . A A . 10 VAL CB 1 1 3 2362 1 1 10 VAL CG1 C -11.800 0.118 -6.859 1.00 . A A . 10 VAL CG1 1 1 3 2363 1 1 10 VAL CG2 C -10.593 -0.974 -4.948 1.00 . A A . 10 VAL CG2 1 1 3 2364 1 1 10 VAL H H -9.653 1.463 -3.650 1.00 . A A . 10 VAL H 1 1 3 2365 1 1 10 VAL HA H -9.238 0.859 -6.420 1.00 . A A . 10 VAL HA 1 1 3 2366 1 1 10 VAL HB H -11.752 0.788 -4.848 1.00 . A A . 10 VAL HB 1 1 3 2367 1 1 10 VAL HG11 H -11.734 1.010 -7.462 1.00 . A A . 10 VAL HG11 1 1 3 2368 1 1 10 VAL HG12 H -12.838 -0.107 -6.664 1.00 . A A . 10 VAL HG12 1 1 3 2369 1 1 10 VAL HG13 H -11.345 -0.706 -7.386 1.00 . A A . 10 VAL HG13 1 1 3 2370 1 1 10 VAL HG21 H -11.249 -1.773 -5.252 1.00 . A A . 10 VAL HG21 1 1 3 2371 1 1 10 VAL HG22 H -10.586 -0.899 -3.868 1.00 . A A . 10 VAL HG22 1 1 3 2372 1 1 10 VAL HG23 H -9.591 -1.178 -5.298 1.00 . A A . 10 VAL HG23 1 1 3 2373 1 1 10 VAL N N -9.161 1.381 -4.492 1.00 . A A . 10 VAL N 1 1 3 2374 1 1 10 VAL O O -10.544 2.827 -7.430 1.00 . A A . 10 VAL O 1 1 3 2375 1 1 11 ASP C C -10.143 6.056 -4.857 1.00 . A A . 11 ASP C 1 1 3 2376 1 1 11 ASP CA C -10.784 4.982 -5.736 1.00 . A A . 11 ASP CA 1 1 3 2377 1 1 11 ASP CB C -12.306 5.126 -5.675 1.00 . A A . 11 ASP CB 1 1 3 2378 1 1 11 ASP CG C -12.781 6.464 -6.209 1.00 . A A . 11 ASP CG 1 1 3 2379 1 1 11 ASP H H -10.186 3.442 -4.404 1.00 . A A . 11 ASP H 1 1 3 2380 1 1 11 ASP HA H -10.463 5.131 -6.755 1.00 . A A . 11 ASP HA 1 1 3 2381 1 1 11 ASP HB2 H -12.761 4.344 -6.262 1.00 . A A . 11 ASP HB2 1 1 3 2382 1 1 11 ASP HB3 H -12.628 5.035 -4.649 1.00 . A A . 11 ASP HB3 1 1 3 2383 1 1 11 ASP N N -10.391 3.633 -5.341 1.00 . A A . 11 ASP N 1 1 3 2384 1 1 11 ASP O O -9.712 7.096 -5.356 1.00 . A A . 11 ASP O 1 1 3 2385 1 1 11 ASP OD1 O -12.724 7.458 -5.457 1.00 . A A . 11 ASP OD1 1 1 3 2386 1 1 11 ASP OD2 O -13.213 6.515 -7.381 1.00 . A A . 11 ASP OD2 1 1 3 2387 1 1 12 GLU C C -8.968 6.140 -1.361 1.00 . A A . 12 GLU C 1 1 3 2388 1 1 12 GLU CA C -9.528 6.794 -2.617 1.00 . A A . 12 GLU CA 1 1 3 2389 1 1 12 GLU CB C -10.611 7.802 -2.229 1.00 . A A . 12 GLU CB 1 1 3 2390 1 1 12 GLU CD C -9.721 9.757 -3.556 1.00 . A A . 12 GLU CD 1 1 3 2391 1 1 12 GLU CG C -10.897 8.833 -3.307 1.00 . A A . 12 GLU CG 1 1 3 2392 1 1 12 GLU H H -10.345 4.914 -3.225 1.00 . A A . 12 GLU H 1 1 3 2393 1 1 12 GLU HA H -8.730 7.317 -3.120 1.00 . A A . 12 GLU HA 1 1 3 2394 1 1 12 GLU HB2 H -11.526 7.265 -2.022 1.00 . A A . 12 GLU HB2 1 1 3 2395 1 1 12 GLU HB3 H -10.299 8.322 -1.335 1.00 . A A . 12 GLU HB3 1 1 3 2396 1 1 12 GLU HG2 H -11.132 8.319 -4.227 1.00 . A A . 12 GLU HG2 1 1 3 2397 1 1 12 GLU HG3 H -11.746 9.429 -3.001 1.00 . A A . 12 GLU HG3 1 1 3 2398 1 1 12 GLU N N -10.078 5.803 -3.554 1.00 . A A . 12 GLU N 1 1 3 2399 1 1 12 GLU O O -9.275 4.999 -1.070 1.00 . A A . 12 GLU O 1 1 3 2400 1 1 12 GLU OE1 O -8.795 9.354 -4.291 1.00 . A A . 12 GLU OE1 1 1 3 2401 1 1 12 GLU OE2 O -9.727 10.884 -3.017 1.00 . A A . 12 GLU OE2 1 1 3 2402 1 1 13 ILE C C -7.630 7.391 1.740 1.00 . A A . 13 ILE C 1 1 3 2403 1 1 13 ILE CA C -7.575 6.342 0.624 1.00 . A A . 13 ILE CA 1 1 3 2404 1 1 13 ILE CB C -6.108 5.884 0.414 1.00 . A A . 13 ILE CB 1 1 3 2405 1 1 13 ILE CD1 C -5.468 7.897 -0.988 1.00 . A A . 13 ILE CD1 1 1 3 2406 1 1 13 ILE CG1 C -5.176 7.086 0.254 1.00 . A A . 13 ILE CG1 1 1 3 2407 1 1 13 ILE CG2 C -6.029 5.013 -0.816 1.00 . A A . 13 ILE CG2 1 1 3 2408 1 1 13 ILE H H -7.933 7.787 -0.888 1.00 . A A . 13 ILE H 1 1 3 2409 1 1 13 ILE HA H -8.164 5.476 0.913 1.00 . A A . 13 ILE HA 1 1 3 2410 1 1 13 ILE HB H -5.794 5.286 1.266 1.00 . A A . 13 ILE HB 1 1 3 2411 1 1 13 ILE HD11 H -6.200 8.657 -0.761 1.00 . A A . 13 ILE HD11 1 1 3 2412 1 1 13 ILE HD12 H -5.855 7.245 -1.760 1.00 . A A . 13 ILE HD12 1 1 3 2413 1 1 13 ILE HD13 H -4.559 8.365 -1.335 1.00 . A A . 13 ILE HD13 1 1 3 2414 1 1 13 ILE HG12 H -5.285 7.737 1.109 1.00 . A A . 13 ILE HG12 1 1 3 2415 1 1 13 ILE HG13 H -4.155 6.740 0.194 1.00 . A A . 13 ILE HG13 1 1 3 2416 1 1 13 ILE HG21 H -7.021 4.745 -1.122 1.00 . A A . 13 ILE HG21 1 1 3 2417 1 1 13 ILE HG22 H -5.470 4.119 -0.591 1.00 . A A . 13 ILE HG22 1 1 3 2418 1 1 13 ILE HG23 H -5.539 5.553 -1.613 1.00 . A A . 13 ILE HG23 1 1 3 2419 1 1 13 ILE N N -8.152 6.873 -0.609 1.00 . A A . 13 ILE N 1 1 3 2420 1 1 13 ILE O O -8.277 8.429 1.593 1.00 . A A . 13 ILE O 1 1 3 2421 1 1 14 VAL C C -5.599 7.901 4.727 1.00 . A A . 14 VAL C 1 1 3 2422 1 1 14 VAL CA C -6.913 8.041 3.976 1.00 . A A . 14 VAL CA 1 1 3 2423 1 1 14 VAL CB C -8.087 7.809 4.949 1.00 . A A . 14 VAL CB 1 1 3 2424 1 1 14 VAL CG1 C -7.986 8.739 6.151 1.00 . A A . 14 VAL CG1 1 1 3 2425 1 1 14 VAL CG2 C -9.416 8.002 4.236 1.00 . A A . 14 VAL CG2 1 1 3 2426 1 1 14 VAL H H -6.457 6.272 2.908 1.00 . A A . 14 VAL H 1 1 3 2427 1 1 14 VAL HA H -6.985 9.044 3.587 1.00 . A A . 14 VAL HA 1 1 3 2428 1 1 14 VAL HB H -8.040 6.790 5.305 1.00 . A A . 14 VAL HB 1 1 3 2429 1 1 14 VAL HG11 H -8.812 8.551 6.823 1.00 . A A . 14 VAL HG11 1 1 3 2430 1 1 14 VAL HG12 H -8.022 9.765 5.816 1.00 . A A . 14 VAL HG12 1 1 3 2431 1 1 14 VAL HG13 H -7.055 8.560 6.667 1.00 . A A . 14 VAL HG13 1 1 3 2432 1 1 14 VAL HG21 H -9.561 7.204 3.525 1.00 . A A . 14 VAL HG21 1 1 3 2433 1 1 14 VAL HG22 H -9.412 8.951 3.718 1.00 . A A . 14 VAL HG22 1 1 3 2434 1 1 14 VAL HG23 H -10.218 7.991 4.959 1.00 . A A . 14 VAL HG23 1 1 3 2435 1 1 14 VAL N N -6.950 7.117 2.847 1.00 . A A . 14 VAL N 1 1 3 2436 1 1 14 VAL O O -4.839 8.859 4.862 1.00 . A A . 14 VAL O 1 1 3 2437 1 1 15 GLU C C -3.040 5.918 4.979 1.00 . A A . 15 GLU C 1 1 3 2438 1 1 15 GLU CA C -4.107 6.424 5.943 1.00 . A A . 15 GLU CA 1 1 3 2439 1 1 15 GLU CB C -4.352 5.399 7.051 1.00 . A A . 15 GLU CB 1 1 3 2440 1 1 15 GLU CD C -5.009 7.171 8.726 1.00 . A A . 15 GLU CD 1 1 3 2441 1 1 15 GLU CG C -5.378 5.851 8.077 1.00 . A A . 15 GLU CG 1 1 3 2442 1 1 15 GLU H H -5.996 5.977 5.086 1.00 . A A . 15 GLU H 1 1 3 2443 1 1 15 GLU HA H -3.769 7.350 6.383 1.00 . A A . 15 GLU HA 1 1 3 2444 1 1 15 GLU HB2 H -4.701 4.479 6.605 1.00 . A A . 15 GLU HB2 1 1 3 2445 1 1 15 GLU HB3 H -3.420 5.210 7.563 1.00 . A A . 15 GLU HB3 1 1 3 2446 1 1 15 GLU HG2 H -6.333 5.963 7.587 1.00 . A A . 15 GLU HG2 1 1 3 2447 1 1 15 GLU HG3 H -5.455 5.097 8.846 1.00 . A A . 15 GLU HG3 1 1 3 2448 1 1 15 GLU N N -5.340 6.698 5.218 1.00 . A A . 15 GLU N 1 1 3 2449 1 1 15 GLU O O -3.332 5.139 4.084 1.00 . A A . 15 GLU O 1 1 3 2450 1 1 15 GLU OE1 O -4.250 7.155 9.718 1.00 . A A . 15 GLU OE1 1 1 3 2451 1 1 15 GLU OE2 O -5.481 8.222 8.242 1.00 . A A . 15 GLU OE2 1 1 3 2452 1 1 16 LYS C C 0.634 5.995 4.993 1.00 . A A . 16 LYS C 1 1 3 2453 1 1 16 LYS CA C -0.721 5.961 4.271 1.00 . A A . 16 LYS CA 1 1 3 2454 1 1 16 LYS CB C -0.667 6.878 3.048 1.00 . A A . 16 LYS CB 1 1 3 2455 1 1 16 LYS CD C -0.591 9.226 2.148 1.00 . A A . 16 LYS CD 1 1 3 2456 1 1 16 LYS CE C -1.819 9.078 1.265 1.00 . A A . 16 LYS CE 1 1 3 2457 1 1 16 LYS CG C -0.691 8.359 3.394 1.00 . A A . 16 LYS CG 1 1 3 2458 1 1 16 LYS H H -1.632 7.011 5.874 1.00 . A A . 16 LYS H 1 1 3 2459 1 1 16 LYS HA H -0.936 4.945 3.942 1.00 . A A . 16 LYS HA 1 1 3 2460 1 1 16 LYS HB2 H 0.242 6.674 2.503 1.00 . A A . 16 LYS HB2 1 1 3 2461 1 1 16 LYS HB3 H -1.514 6.663 2.413 1.00 . A A . 16 LYS HB3 1 1 3 2462 1 1 16 LYS HD2 H -0.499 10.259 2.447 1.00 . A A . 16 LYS HD2 1 1 3 2463 1 1 16 LYS HD3 H 0.284 8.931 1.587 1.00 . A A . 16 LYS HD3 1 1 3 2464 1 1 16 LYS HE2 H -1.650 9.616 0.343 1.00 . A A . 16 LYS HE2 1 1 3 2465 1 1 16 LYS HE3 H -1.967 8.030 1.047 1.00 . A A . 16 LYS HE3 1 1 3 2466 1 1 16 LYS HG2 H -1.616 8.585 3.903 1.00 . A A . 16 LYS HG2 1 1 3 2467 1 1 16 LYS HG3 H 0.142 8.583 4.043 1.00 . A A . 16 LYS HG3 1 1 3 2468 1 1 16 LYS HZ1 H -3.219 9.112 2.815 1.00 . A A . 16 LYS HZ1 1 1 3 2469 1 1 16 LYS HZ2 H -3.866 9.497 1.298 1.00 . A A . 16 LYS HZ2 1 1 3 2470 1 1 16 LYS HZ3 H -2.921 10.628 2.126 1.00 . A A . 16 LYS HZ3 1 1 3 2471 1 1 16 LYS N N -1.810 6.380 5.149 1.00 . A A . 16 LYS N 1 1 3 2472 1 1 16 LYS NZ N -3.042 9.616 1.922 1.00 . A A . 16 LYS NZ 1 1 3 2473 1 1 16 LYS O O 1.297 7.032 5.026 1.00 . A A . 16 LYS O 1 1 3 2474 1 1 17 ARG C C 2.865 3.385 6.315 1.00 . A A . 17 ARG C 1 1 3 2475 1 1 17 ARG CA C 2.317 4.807 6.297 1.00 . A A . 17 ARG CA 1 1 3 2476 1 1 17 ARG CB C 2.125 5.312 7.728 1.00 . A A . 17 ARG CB 1 1 3 2477 1 1 17 ARG CD C 3.137 5.838 9.962 1.00 . A A . 17 ARG CD 1 1 3 2478 1 1 17 ARG CG C 3.398 5.317 8.557 1.00 . A A . 17 ARG CG 1 1 3 2479 1 1 17 ARG CZ C 4.395 6.340 12.013 1.00 . A A . 17 ARG CZ 1 1 3 2480 1 1 17 ARG H H 0.503 4.057 5.475 1.00 . A A . 17 ARG H 1 1 3 2481 1 1 17 ARG HA H 3.023 5.446 5.789 1.00 . A A . 17 ARG HA 1 1 3 2482 1 1 17 ARG HB2 H 1.742 6.321 7.691 1.00 . A A . 17 ARG HB2 1 1 3 2483 1 1 17 ARG HB3 H 1.401 4.680 8.223 1.00 . A A . 17 ARG HB3 1 1 3 2484 1 1 17 ARG HD2 H 2.749 6.843 9.892 1.00 . A A . 17 ARG HD2 1 1 3 2485 1 1 17 ARG HD3 H 2.405 5.203 10.437 1.00 . A A . 17 ARG HD3 1 1 3 2486 1 1 17 ARG HE H 5.167 5.488 10.382 1.00 . A A . 17 ARG HE 1 1 3 2487 1 1 17 ARG HG2 H 3.780 4.310 8.622 1.00 . A A . 17 ARG HG2 1 1 3 2488 1 1 17 ARG HG3 H 4.128 5.951 8.076 1.00 . A A . 17 ARG HG3 1 1 3 2489 1 1 17 ARG HH11 H 2.441 6.853 12.064 1.00 . A A . 17 ARG HH11 1 1 3 2490 1 1 17 ARG HH12 H 3.339 7.204 13.503 1.00 . A A . 17 ARG HH12 1 1 3 2491 1 1 17 ARG HH21 H 6.359 5.945 12.273 1.00 . A A . 17 ARG HH21 1 1 3 2492 1 1 17 ARG HH22 H 5.567 6.689 13.621 1.00 . A A . 17 ARG HH22 1 1 3 2493 1 1 17 ARG N N 1.044 4.870 5.570 1.00 . A A . 17 ARG N 1 1 3 2494 1 1 17 ARG NE N 4.349 5.855 10.776 1.00 . A A . 17 ARG NE 1 1 3 2495 1 1 17 ARG NH1 N 3.302 6.840 12.573 1.00 . A A . 17 ARG NH1 1 1 3 2496 1 1 17 ARG NH2 N 5.534 6.322 12.691 1.00 . A A . 17 ARG NH2 1 1 3 2497 1 1 17 ARG O O 2.542 2.612 7.217 1.00 . A A . 17 ARG O 1 1 3 2498 1 1 18 GLY C C 5.530 1.495 4.619 1.00 . A A . 18 GLY C 1 1 3 2499 1 1 18 GLY CA C 4.194 1.668 5.305 1.00 . A A . 18 GLY CA 1 1 3 2500 1 1 18 GLY H H 3.972 3.674 4.657 1.00 . A A . 18 GLY H 1 1 3 2501 1 1 18 GLY HA2 H 4.285 1.313 6.319 1.00 . A A . 18 GLY HA2 1 1 3 2502 1 1 18 GLY HA3 H 3.475 1.057 4.795 1.00 . A A . 18 GLY HA3 1 1 3 2503 1 1 18 GLY N N 3.689 3.024 5.333 1.00 . A A . 18 GLY N 1 1 3 2504 1 1 18 GLY O O 6.474 2.252 4.847 1.00 . A A . 18 GLY O 1 1 3 2505 1 1 19 LYS C C 6.488 0.248 1.529 1.00 . A A . 19 LYS C 1 1 3 2506 1 1 19 LYS CA C 6.765 0.109 3.031 1.00 . A A . 19 LYS CA 1 1 3 2507 1 1 19 LYS CB C 7.101 -1.324 3.409 1.00 . A A . 19 LYS CB 1 1 3 2508 1 1 19 LYS CD C 7.842 -2.939 5.128 1.00 . A A . 19 LYS CD 1 1 3 2509 1 1 19 LYS CE C 8.179 -3.172 6.593 1.00 . A A . 19 LYS CE 1 1 3 2510 1 1 19 LYS CG C 7.484 -1.499 4.860 1.00 . A A . 19 LYS CG 1 1 3 2511 1 1 19 LYS H H 4.780 -0.079 3.645 1.00 . A A . 19 LYS H 1 1 3 2512 1 1 19 LYS HA H 7.569 0.754 3.318 1.00 . A A . 19 LYS HA 1 1 3 2513 1 1 19 LYS HB2 H 6.224 -1.928 3.214 1.00 . A A . 19 LYS HB2 1 1 3 2514 1 1 19 LYS HB3 H 7.917 -1.676 2.799 1.00 . A A . 19 LYS HB3 1 1 3 2515 1 1 19 LYS HD2 H 7.003 -3.555 4.852 1.00 . A A . 19 LYS HD2 1 1 3 2516 1 1 19 LYS HD3 H 8.696 -3.199 4.519 1.00 . A A . 19 LYS HD3 1 1 3 2517 1 1 19 LYS HE2 H 7.357 -2.818 7.198 1.00 . A A . 19 LYS HE2 1 1 3 2518 1 1 19 LYS HE3 H 8.313 -4.231 6.756 1.00 . A A . 19 LYS HE3 1 1 3 2519 1 1 19 LYS HG2 H 8.336 -0.872 5.080 1.00 . A A . 19 LYS HG2 1 1 3 2520 1 1 19 LYS HG3 H 6.649 -1.218 5.485 1.00 . A A . 19 LYS HG3 1 1 3 2521 1 1 19 LYS HZ1 H 9.311 -1.435 6.848 1.00 . A A . 19 LYS HZ1 1 1 3 2522 1 1 19 LYS HZ2 H 10.229 -2.798 6.441 1.00 . A A . 19 LYS HZ2 1 1 3 2523 1 1 19 LYS HZ3 H 9.616 -2.627 8.008 1.00 . A A . 19 LYS HZ3 1 1 3 2524 1 1 19 LYS N N 5.582 0.469 3.775 1.00 . A A . 19 LYS N 1 1 3 2525 1 1 19 LYS NZ N 9.420 -2.459 7.001 1.00 . A A . 19 LYS NZ 1 1 3 2526 1 1 19 LYS O O 6.048 1.292 1.076 1.00 . A A . 19 LYS O 1 1 3 2527 1 1 20 GLY C C 5.039 -1.195 -0.873 1.00 . A A . 20 GLY C 1 1 3 2528 1 1 20 GLY CA C 6.450 -0.752 -0.650 1.00 . A A . 20 GLY CA 1 1 3 2529 1 1 20 GLY H H 7.054 -1.618 1.140 1.00 . A A . 20 GLY H 1 1 3 2530 1 1 20 GLY HA2 H 6.592 0.250 -1.018 1.00 . A A . 20 GLY HA2 1 1 3 2531 1 1 20 GLY HA3 H 7.108 -1.430 -1.155 1.00 . A A . 20 GLY HA3 1 1 3 2532 1 1 20 GLY N N 6.726 -0.799 0.756 1.00 . A A . 20 GLY N 1 1 3 2533 1 1 20 GLY O O 4.316 -0.673 -1.718 1.00 . A A . 20 GLY O 1 1 3 2534 1 1 21 LYS C C 2.871 -3.093 1.325 1.00 . A A . 21 LYS C 1 1 3 2535 1 1 21 LYS CA C 3.344 -2.755 -0.102 1.00 . A A . 21 LYS CA 1 1 3 2536 1 1 21 LYS CB C 3.334 -4.015 -0.965 1.00 . A A . 21 LYS CB 1 1 3 2537 1 1 21 LYS CD C 3.270 -2.988 -3.260 1.00 . A A . 21 LYS CD 1 1 3 2538 1 1 21 LYS CE C 4.103 -2.623 -4.476 1.00 . A A . 21 LYS CE 1 1 3 2539 1 1 21 LYS CG C 4.060 -3.849 -2.289 1.00 . A A . 21 LYS CG 1 1 3 2540 1 1 21 LYS H H 5.355 -2.590 0.493 1.00 . A A . 21 LYS H 1 1 3 2541 1 1 21 LYS HA H 2.676 -2.022 -0.535 1.00 . A A . 21 LYS HA 1 1 3 2542 1 1 21 LYS HB2 H 3.810 -4.813 -0.418 1.00 . A A . 21 LYS HB2 1 1 3 2543 1 1 21 LYS HB3 H 2.312 -4.287 -1.170 1.00 . A A . 21 LYS HB3 1 1 3 2544 1 1 21 LYS HD2 H 2.397 -3.535 -3.584 1.00 . A A . 21 LYS HD2 1 1 3 2545 1 1 21 LYS HD3 H 2.963 -2.082 -2.756 1.00 . A A . 21 LYS HD3 1 1 3 2546 1 1 21 LYS HE2 H 3.443 -2.293 -5.264 1.00 . A A . 21 LYS HE2 1 1 3 2547 1 1 21 LYS HE3 H 4.775 -1.820 -4.209 1.00 . A A . 21 LYS HE3 1 1 3 2548 1 1 21 LYS HG2 H 5.016 -3.383 -2.108 1.00 . A A . 21 LYS HG2 1 1 3 2549 1 1 21 LYS HG3 H 4.211 -4.824 -2.728 1.00 . A A . 21 LYS HG3 1 1 3 2550 1 1 21 LYS HZ1 H 5.677 -3.988 -4.301 1.00 . A A . 21 LYS HZ1 1 1 3 2551 1 1 21 LYS HZ2 H 5.310 -3.566 -5.898 1.00 . A A . 21 LYS HZ2 1 1 3 2552 1 1 21 LYS HZ3 H 4.299 -4.624 -5.050 1.00 . A A . 21 LYS HZ3 1 1 3 2553 1 1 21 LYS N N 4.677 -2.193 -0.089 1.00 . A A . 21 LYS N 1 1 3 2554 1 1 21 LYS NZ N 4.903 -3.782 -4.966 1.00 . A A . 21 LYS NZ 1 1 3 2555 1 1 21 LYS O O 1.758 -3.578 1.503 1.00 . A A . 21 LYS O 1 1 3 2556 1 1 22 ASP C C 2.580 -1.957 4.365 1.00 . A A . 22 ASP C 1 1 3 2557 1 1 22 ASP CA C 3.361 -3.084 3.731 1.00 . A A . 22 ASP CA 1 1 3 2558 1 1 22 ASP CB C 4.625 -3.298 4.553 1.00 . A A . 22 ASP CB 1 1 3 2559 1 1 22 ASP CG C 4.344 -3.819 5.951 1.00 . A A . 22 ASP CG 1 1 3 2560 1 1 22 ASP H H 4.525 -2.327 2.170 1.00 . A A . 22 ASP H 1 1 3 2561 1 1 22 ASP HA H 2.781 -3.963 3.739 1.00 . A A . 22 ASP HA 1 1 3 2562 1 1 22 ASP HB2 H 5.277 -3.990 4.052 1.00 . A A . 22 ASP HB2 1 1 3 2563 1 1 22 ASP HB3 H 5.120 -2.355 4.644 1.00 . A A . 22 ASP HB3 1 1 3 2564 1 1 22 ASP N N 3.697 -2.786 2.345 1.00 . A A . 22 ASP N 1 1 3 2565 1 1 22 ASP O O 2.388 -1.919 5.578 1.00 . A A . 22 ASP O 1 1 3 2566 1 1 22 ASP OD1 O 4.119 -2.994 6.858 1.00 . A A . 22 ASP OD1 1 1 3 2567 1 1 22 ASP OD2 O 4.338 -5.054 6.135 1.00 . A A . 22 ASP OD2 1 1 3 2568 1 1 23 VAL C C -0.092 -0.174 4.075 1.00 . A A . 23 VAL C 1 1 3 2569 1 1 23 VAL CA C 1.400 0.098 4.018 1.00 . A A . 23 VAL CA 1 1 3 2570 1 1 23 VAL CB C 1.675 1.303 3.118 1.00 . A A . 23 VAL CB 1 1 3 2571 1 1 23 VAL CG1 C 0.953 1.173 1.785 1.00 . A A . 23 VAL CG1 1 1 3 2572 1 1 23 VAL CG2 C 1.280 2.579 3.815 1.00 . A A . 23 VAL CG2 1 1 3 2573 1 1 23 VAL H H 2.344 -1.107 2.601 1.00 . A A . 23 VAL H 1 1 3 2574 1 1 23 VAL HA H 1.749 0.336 5.006 1.00 . A A . 23 VAL HA 1 1 3 2575 1 1 23 VAL HB H 2.742 1.334 2.929 1.00 . A A . 23 VAL HB 1 1 3 2576 1 1 23 VAL HG11 H 1.453 0.437 1.173 1.00 . A A . 23 VAL HG11 1 1 3 2577 1 1 23 VAL HG12 H 0.965 2.125 1.285 1.00 . A A . 23 VAL HG12 1 1 3 2578 1 1 23 VAL HG13 H -0.070 0.872 1.945 1.00 . A A . 23 VAL HG13 1 1 3 2579 1 1 23 VAL HG21 H 0.319 2.906 3.449 1.00 . A A . 23 VAL HG21 1 1 3 2580 1 1 23 VAL HG22 H 2.019 3.342 3.625 1.00 . A A . 23 VAL HG22 1 1 3 2581 1 1 23 VAL HG23 H 1.214 2.391 4.875 1.00 . A A . 23 VAL HG23 1 1 3 2582 1 1 23 VAL N N 2.141 -1.038 3.546 1.00 . A A . 23 VAL N 1 1 3 2583 1 1 23 VAL O O -0.620 -0.987 3.320 1.00 . A A . 23 VAL O 1 1 3 2584 1 1 24 GLU C C -2.916 1.601 4.521 1.00 . A A . 24 GLU C 1 1 3 2585 1 1 24 GLU CA C -2.196 0.397 5.109 1.00 . A A . 24 GLU CA 1 1 3 2586 1 1 24 GLU CB C -2.572 0.237 6.579 1.00 . A A . 24 GLU CB 1 1 3 2587 1 1 24 GLU CD C -2.346 1.109 8.938 1.00 . A A . 24 GLU CD 1 1 3 2588 1 1 24 GLU CG C -1.938 1.276 7.487 1.00 . A A . 24 GLU CG 1 1 3 2589 1 1 24 GLU H H -0.283 1.211 5.484 1.00 . A A . 24 GLU H 1 1 3 2590 1 1 24 GLU HA H -2.492 -0.495 4.570 1.00 . A A . 24 GLU HA 1 1 3 2591 1 1 24 GLU HB2 H -3.644 0.317 6.668 1.00 . A A . 24 GLU HB2 1 1 3 2592 1 1 24 GLU HB3 H -2.264 -0.742 6.912 1.00 . A A . 24 GLU HB3 1 1 3 2593 1 1 24 GLU HG2 H -0.863 1.189 7.420 1.00 . A A . 24 GLU HG2 1 1 3 2594 1 1 24 GLU HG3 H -2.239 2.259 7.154 1.00 . A A . 24 GLU HG3 1 1 3 2595 1 1 24 GLU N N -0.763 0.547 4.950 1.00 . A A . 24 GLU N 1 1 3 2596 1 1 24 GLU O O -2.914 2.686 5.101 1.00 . A A . 24 GLU O 1 1 3 2597 1 1 24 GLU OE1 O -1.712 0.295 9.642 1.00 . A A . 24 GLU OE1 1 1 3 2598 1 1 24 GLU OE2 O -3.300 1.790 9.369 1.00 . A A . 24 GLU OE2 1 1 3 2599 1 1 25 TYR C C -5.743 2.176 2.723 1.00 . A A . 25 TYR C 1 1 3 2600 1 1 25 TYR CA C -4.247 2.454 2.687 1.00 . A A . 25 TYR CA 1 1 3 2601 1 1 25 TYR CB C -3.778 2.563 1.238 1.00 . A A . 25 TYR CB 1 1 3 2602 1 1 25 TYR CD1 C -1.381 3.284 1.603 1.00 . A A . 25 TYR CD1 1 1 3 2603 1 1 25 TYR CD2 C -2.776 4.668 0.262 1.00 . A A . 25 TYR CD2 1 1 3 2604 1 1 25 TYR CE1 C -0.327 4.155 1.404 1.00 . A A . 25 TYR CE1 1 1 3 2605 1 1 25 TYR CE2 C -1.728 5.540 0.055 1.00 . A A . 25 TYR CE2 1 1 3 2606 1 1 25 TYR CG C -2.623 3.524 1.036 1.00 . A A . 25 TYR CG 1 1 3 2607 1 1 25 TYR CZ C -0.506 5.280 0.628 1.00 . A A . 25 TYR CZ 1 1 3 2608 1 1 25 TYR H H -3.506 0.507 2.973 1.00 . A A . 25 TYR H 1 1 3 2609 1 1 25 TYR HA H -4.037 3.381 3.193 1.00 . A A . 25 TYR HA 1 1 3 2610 1 1 25 TYR HB2 H -3.461 1.588 0.899 1.00 . A A . 25 TYR HB2 1 1 3 2611 1 1 25 TYR HB3 H -4.601 2.900 0.627 1.00 . A A . 25 TYR HB3 1 1 3 2612 1 1 25 TYR HD1 H -1.242 2.403 2.212 1.00 . A A . 25 TYR HD1 1 1 3 2613 1 1 25 TYR HD2 H -3.730 4.871 -0.187 1.00 . A A . 25 TYR HD2 1 1 3 2614 1 1 25 TYR HE1 H 0.630 3.953 1.855 1.00 . A A . 25 TYR HE1 1 1 3 2615 1 1 25 TYR HE2 H -1.870 6.423 -0.551 1.00 . A A . 25 TYR HE2 1 1 3 2616 1 1 25 TYR HH H 1.329 5.645 0.187 1.00 . A A . 25 TYR HH 1 1 3 2617 1 1 25 TYR N N -3.526 1.398 3.368 1.00 . A A . 25 TYR N 1 1 3 2618 1 1 25 TYR O O -6.162 1.026 2.751 1.00 . A A . 25 TYR O 1 1 3 2619 1 1 25 TYR OH O 0.544 6.145 0.421 1.00 . A A . 25 TYR OH 1 1 3 2620 1 1 26 LEU C C -8.489 2.976 1.311 1.00 . A A . 26 LEU C 1 1 3 2621 1 1 26 LEU CA C -7.984 3.089 2.728 1.00 . A A . 26 LEU CA 1 1 3 2622 1 1 26 LEU CB C -8.625 4.295 3.421 1.00 . A A . 26 LEU CB 1 1 3 2623 1 1 26 LEU CD1 C -10.815 5.082 4.368 1.00 . A A . 26 LEU CD1 1 1 3 2624 1 1 26 LEU CD2 C -10.368 5.302 1.914 1.00 . A A . 26 LEU CD2 1 1 3 2625 1 1 26 LEU CG C -10.123 4.468 3.163 1.00 . A A . 26 LEU CG 1 1 3 2626 1 1 26 LEU H H -6.158 4.115 2.667 1.00 . A A . 26 LEU H 1 1 3 2627 1 1 26 LEU HA H -8.236 2.186 3.261 1.00 . A A . 26 LEU HA 1 1 3 2628 1 1 26 LEU HB2 H -8.468 4.198 4.486 1.00 . A A . 26 LEU HB2 1 1 3 2629 1 1 26 LEU HB3 H -8.119 5.186 3.082 1.00 . A A . 26 LEU HB3 1 1 3 2630 1 1 26 LEU HD11 H -11.699 5.612 4.045 1.00 . A A . 26 LEU HD11 1 1 3 2631 1 1 26 LEU HD12 H -10.142 5.769 4.859 1.00 . A A . 26 LEU HD12 1 1 3 2632 1 1 26 LEU HD13 H -11.097 4.300 5.057 1.00 . A A . 26 LEU HD13 1 1 3 2633 1 1 26 LEU HD21 H -10.179 4.700 1.037 1.00 . A A . 26 LEU HD21 1 1 3 2634 1 1 26 LEU HD22 H -9.712 6.156 1.913 1.00 . A A . 26 LEU HD22 1 1 3 2635 1 1 26 LEU HD23 H -11.396 5.638 1.904 1.00 . A A . 26 LEU HD23 1 1 3 2636 1 1 26 LEU HG H -10.551 3.500 2.992 1.00 . A A . 26 LEU HG 1 1 3 2637 1 1 26 LEU N N -6.542 3.227 2.707 1.00 . A A . 26 LEU N 1 1 3 2638 1 1 26 LEU O O -7.814 3.399 0.376 1.00 . A A . 26 LEU O 1 1 3 2639 1 1 27 VAL C C -11.684 2.450 -0.311 1.00 . A A . 27 VAL C 1 1 3 2640 1 1 27 VAL CA C -10.184 2.267 -0.202 1.00 . A A . 27 VAL CA 1 1 3 2641 1 1 27 VAL CB C -9.716 0.958 -0.897 1.00 . A A . 27 VAL CB 1 1 3 2642 1 1 27 VAL CG1 C -8.619 0.260 -0.112 1.00 . A A . 27 VAL CG1 1 1 3 2643 1 1 27 VAL CG2 C -10.846 -0.024 -1.221 1.00 . A A . 27 VAL CG2 1 1 3 2644 1 1 27 VAL H H -10.158 2.039 1.897 1.00 . A A . 27 VAL H 1 1 3 2645 1 1 27 VAL HA H -9.745 3.062 -0.768 1.00 . A A . 27 VAL HA 1 1 3 2646 1 1 27 VAL HB H -9.288 1.274 -1.817 1.00 . A A . 27 VAL HB 1 1 3 2647 1 1 27 VAL HG11 H -7.801 0.947 0.053 1.00 . A A . 27 VAL HG11 1 1 3 2648 1 1 27 VAL HG12 H -8.263 -0.594 -0.672 1.00 . A A . 27 VAL HG12 1 1 3 2649 1 1 27 VAL HG13 H -9.010 -0.071 0.839 1.00 . A A . 27 VAL HG13 1 1 3 2650 1 1 27 VAL HG21 H -11.446 -0.185 -0.343 1.00 . A A . 27 VAL HG21 1 1 3 2651 1 1 27 VAL HG22 H -10.424 -0.963 -1.548 1.00 . A A . 27 VAL HG22 1 1 3 2652 1 1 27 VAL HG23 H -11.463 0.386 -2.007 1.00 . A A . 27 VAL HG23 1 1 3 2653 1 1 27 VAL N N -9.663 2.398 1.136 1.00 . A A . 27 VAL N 1 1 3 2654 1 1 27 VAL O O -12.473 1.636 0.167 1.00 . A A . 27 VAL O 1 1 3 2655 1 1 28 ARG C C -13.751 3.049 -2.465 1.00 . A A . 28 ARG C 1 1 3 2656 1 1 28 ARG CA C -13.447 3.813 -1.212 1.00 . A A . 28 ARG CA 1 1 3 2657 1 1 28 ARG CB C -13.709 5.297 -1.420 1.00 . A A . 28 ARG CB 1 1 3 2658 1 1 28 ARG CD C -15.387 7.157 -1.603 1.00 . A A . 28 ARG CD 1 1 3 2659 1 1 28 ARG CG C -15.185 5.658 -1.455 1.00 . A A . 28 ARG CG 1 1 3 2660 1 1 28 ARG CZ C -14.477 8.984 -2.975 1.00 . A A . 28 ARG CZ 1 1 3 2661 1 1 28 ARG H H -11.380 4.209 -1.198 1.00 . A A . 28 ARG H 1 1 3 2662 1 1 28 ARG HA H -14.054 3.424 -0.411 1.00 . A A . 28 ARG HA 1 1 3 2663 1 1 28 ARG HB2 H -13.237 5.855 -0.625 1.00 . A A . 28 ARG HB2 1 1 3 2664 1 1 28 ARG HB3 H -13.272 5.581 -2.362 1.00 . A A . 28 ARG HB3 1 1 3 2665 1 1 28 ARG HD2 H -16.443 7.358 -1.706 1.00 . A A . 28 ARG HD2 1 1 3 2666 1 1 28 ARG HD3 H -15.011 7.648 -0.718 1.00 . A A . 28 ARG HD3 1 1 3 2667 1 1 28 ARG HE H -14.360 7.046 -3.434 1.00 . A A . 28 ARG HE 1 1 3 2668 1 1 28 ARG HG2 H -15.651 5.157 -2.290 1.00 . A A . 28 ARG HG2 1 1 3 2669 1 1 28 ARG HG3 H -15.648 5.331 -0.534 1.00 . A A . 28 ARG HG3 1 1 3 2670 1 1 28 ARG HH11 H -15.413 9.575 -1.282 1.00 . A A . 28 ARG HH11 1 1 3 2671 1 1 28 ARG HH12 H -14.757 10.851 -2.253 1.00 . A A . 28 ARG HH12 1 1 3 2672 1 1 28 ARG HH21 H -13.492 8.717 -4.718 1.00 . A A . 28 ARG HH21 1 1 3 2673 1 1 28 ARG HH22 H -13.663 10.364 -4.207 1.00 . A A . 28 ARG HH22 1 1 3 2674 1 1 28 ARG N N -12.059 3.553 -0.931 1.00 . A A . 28 ARG N 1 1 3 2675 1 1 28 ARG NE N -14.690 7.688 -2.770 1.00 . A A . 28 ARG NE 1 1 3 2676 1 1 28 ARG NH1 N -14.918 9.876 -2.098 1.00 . A A . 28 ARG NH1 1 1 3 2677 1 1 28 ARG NH2 N -13.824 9.388 -4.055 1.00 . A A . 28 ARG NH2 1 1 3 2678 1 1 28 ARG O O -13.890 3.624 -3.545 1.00 . A A . 28 ARG O 1 1 3 2679 1 1 29 TRP C C -14.826 1.401 -4.515 1.00 . A A . 29 TRP C 1 1 3 2680 1 1 29 TRP CA C -14.064 0.783 -3.363 1.00 . A A . 29 TRP CA 1 1 3 2681 1 1 29 TRP CB C -14.844 -0.396 -2.808 1.00 . A A . 29 TRP CB 1 1 3 2682 1 1 29 TRP CD1 C -13.492 -1.941 -4.336 1.00 . A A . 29 TRP CD1 1 1 3 2683 1 1 29 TRP CD2 C -14.700 -3.009 -2.782 1.00 . A A . 29 TRP CD2 1 1 3 2684 1 1 29 TRP CE2 C -14.009 -3.966 -3.548 1.00 . A A . 29 TRP CE2 1 1 3 2685 1 1 29 TRP CE3 C -15.526 -3.445 -1.743 1.00 . A A . 29 TRP CE3 1 1 3 2686 1 1 29 TRP CG C -14.353 -1.720 -3.300 1.00 . A A . 29 TRP CG 1 1 3 2687 1 1 29 TRP CH2 C -14.936 -5.732 -2.282 1.00 . A A . 29 TRP CH2 1 1 3 2688 1 1 29 TRP CZ2 C -14.121 -5.333 -3.307 1.00 . A A . 29 TRP CZ2 1 1 3 2689 1 1 29 TRP CZ3 C -15.635 -4.801 -1.503 1.00 . A A . 29 TRP CZ3 1 1 3 2690 1 1 29 TRP H H -13.707 1.384 -1.381 1.00 . A A . 29 TRP H 1 1 3 2691 1 1 29 TRP HA H -13.106 0.431 -3.720 1.00 . A A . 29 TRP HA 1 1 3 2692 1 1 29 TRP HB2 H -14.763 -0.381 -1.732 1.00 . A A . 29 TRP HB2 1 1 3 2693 1 1 29 TRP HB3 H -15.882 -0.296 -3.088 1.00 . A A . 29 TRP HB3 1 1 3 2694 1 1 29 TRP HD1 H -13.048 -1.159 -4.938 1.00 . A A . 29 TRP HD1 1 1 3 2695 1 1 29 TRP HE1 H -12.698 -3.701 -5.165 1.00 . A A . 29 TRP HE1 1 1 3 2696 1 1 29 TRP HE3 H -16.073 -2.742 -1.132 1.00 . A A . 29 TRP HE3 1 1 3 2697 1 1 29 TRP HH2 H -15.052 -6.782 -2.060 1.00 . A A . 29 TRP HH2 1 1 3 2698 1 1 29 TRP HZ2 H -13.588 -6.063 -3.898 1.00 . A A . 29 TRP HZ2 1 1 3 2699 1 1 29 TRP HZ3 H -16.270 -5.157 -0.705 1.00 . A A . 29 TRP HZ3 1 1 3 2700 1 1 29 TRP N N -13.826 1.734 -2.288 1.00 . A A . 29 TRP N 1 1 3 2701 1 1 29 TRP NE1 N -13.278 -3.290 -4.490 1.00 . A A . 29 TRP NE1 1 1 3 2702 1 1 29 TRP O O -16.052 1.423 -4.523 1.00 . A A . 29 TRP O 1 1 3 2703 1 1 30 LYS C C -15.945 1.960 -7.091 1.00 . A A . 30 LYS C 1 1 3 2704 1 1 30 LYS CA C -14.617 2.598 -6.667 1.00 . A A . 30 LYS CA 1 1 3 2705 1 1 30 LYS CB C -13.628 2.495 -7.827 1.00 . A A . 30 LYS CB 1 1 3 2706 1 1 30 LYS CD C -13.050 3.114 -10.192 1.00 . A A . 30 LYS CD 1 1 3 2707 1 1 30 LYS CE C -12.812 1.663 -10.576 1.00 . A A . 30 LYS CE 1 1 3 2708 1 1 30 LYS CG C -14.076 3.235 -9.077 1.00 . A A . 30 LYS CG 1 1 3 2709 1 1 30 LYS H H -13.071 1.997 -5.290 1.00 . A A . 30 LYS H 1 1 3 2710 1 1 30 LYS HA H -14.788 3.640 -6.445 1.00 . A A . 30 LYS HA 1 1 3 2711 1 1 30 LYS HB2 H -12.682 2.900 -7.516 1.00 . A A . 30 LYS HB2 1 1 3 2712 1 1 30 LYS HB3 H -13.499 1.454 -8.081 1.00 . A A . 30 LYS HB3 1 1 3 2713 1 1 30 LYS HD2 H -13.410 3.650 -11.058 1.00 . A A . 30 LYS HD2 1 1 3 2714 1 1 30 LYS HD3 H -12.119 3.548 -9.859 1.00 . A A . 30 LYS HD3 1 1 3 2715 1 1 30 LYS HE2 H -12.470 1.125 -9.704 1.00 . A A . 30 LYS HE2 1 1 3 2716 1 1 30 LYS HE3 H -13.742 1.236 -10.920 1.00 . A A . 30 LYS HE3 1 1 3 2717 1 1 30 LYS HG2 H -15.012 2.816 -9.415 1.00 . A A . 30 LYS HG2 1 1 3 2718 1 1 30 LYS HG3 H -14.212 4.280 -8.836 1.00 . A A . 30 LYS HG3 1 1 3 2719 1 1 30 LYS HZ1 H -11.655 0.532 -11.898 1.00 . A A . 30 LYS HZ1 1 1 3 2720 1 1 30 LYS HZ2 H -10.884 1.929 -11.335 1.00 . A A . 30 LYS HZ2 1 1 3 2721 1 1 30 LYS HZ3 H -12.101 2.047 -12.503 1.00 . A A . 30 LYS HZ3 1 1 3 2722 1 1 30 LYS N N -14.057 1.963 -5.453 1.00 . A A . 30 LYS N 1 1 3 2723 1 1 30 LYS NZ N -11.792 1.533 -11.653 1.00 . A A . 30 LYS NZ 1 1 3 2724 1 1 30 LYS O O -16.847 2.644 -7.574 1.00 . A A . 30 LYS O 1 1 3 2725 1 1 31 ASP C C -17.833 -0.734 -5.991 1.00 . A A . 31 ASP C 1 1 3 2726 1 1 31 ASP CA C -17.256 -0.091 -7.249 1.00 . A A . 31 ASP CA 1 1 3 2727 1 1 31 ASP CB C -16.959 -1.164 -8.298 1.00 . A A . 31 ASP CB 1 1 3 2728 1 1 31 ASP CG C -16.441 -0.578 -9.596 1.00 . A A . 31 ASP CG 1 1 3 2729 1 1 31 ASP H H -15.276 0.156 -6.551 1.00 . A A . 31 ASP H 1 1 3 2730 1 1 31 ASP HA H -17.975 0.610 -7.649 1.00 . A A . 31 ASP HA 1 1 3 2731 1 1 31 ASP HB2 H -16.214 -1.843 -7.910 1.00 . A A . 31 ASP HB2 1 1 3 2732 1 1 31 ASP HB3 H -17.865 -1.713 -8.508 1.00 . A A . 31 ASP HB3 1 1 3 2733 1 1 31 ASP N N -16.043 0.646 -6.915 1.00 . A A . 31 ASP N 1 1 3 2734 1 1 31 ASP O O -18.032 -1.948 -5.935 1.00 . A A . 31 ASP O 1 1 3 2735 1 1 31 ASP OD1 O -15.232 -0.272 -9.669 1.00 . A A . 31 ASP OD1 1 1 3 2736 1 1 31 ASP OD2 O -17.244 -0.425 -10.540 1.00 . A A . 31 ASP OD2 1 1 3 2737 1 1 32 GLY C C -19.600 0.571 -3.085 1.00 . A A . 32 GLY C 1 1 3 2738 1 1 32 GLY CA C -18.628 -0.396 -3.728 1.00 . A A . 32 GLY CA 1 1 3 2739 1 1 32 GLY H H -17.934 1.054 -5.101 1.00 . A A . 32 GLY H 1 1 3 2740 1 1 32 GLY HA2 H -19.129 -1.337 -3.900 1.00 . A A . 32 GLY HA2 1 1 3 2741 1 1 32 GLY HA3 H -17.801 -0.556 -3.045 1.00 . A A . 32 GLY HA3 1 1 3 2742 1 1 32 GLY N N -18.099 0.095 -4.986 1.00 . A A . 32 GLY N 1 1 3 2743 1 1 32 GLY O O -20.101 1.489 -3.735 1.00 . A A . 32 GLY O 1 1 3 2744 1 1 33 GLY C C -20.160 1.741 0.213 1.00 . A A . 33 GLY C 1 1 3 2745 1 1 33 GLY CA C -20.773 1.225 -1.073 1.00 . A A . 33 GLY CA 1 1 3 2746 1 1 33 GLY H H -19.437 -0.393 -1.342 1.00 . A A . 33 GLY H 1 1 3 2747 1 1 33 GLY HA2 H -21.034 2.065 -1.700 1.00 . A A . 33 GLY HA2 1 1 3 2748 1 1 33 GLY HA3 H -21.670 0.672 -0.837 1.00 . A A . 33 GLY HA3 1 1 3 2749 1 1 33 GLY N N -19.864 0.360 -1.801 1.00 . A A . 33 GLY N 1 1 3 2750 1 1 33 GLY O O -20.287 2.920 0.541 1.00 . A A . 33 GLY O 1 1 3 2751 1 1 34 ASP C C -17.362 1.486 1.976 1.00 . A A . 34 ASP C 1 1 3 2752 1 1 34 ASP CA C -18.847 1.218 2.197 1.00 . A A . 34 ASP CA 1 1 3 2753 1 1 34 ASP CB C -19.031 0.106 3.231 1.00 . A A . 34 ASP CB 1 1 3 2754 1 1 34 ASP CG C -20.490 -0.205 3.491 1.00 . A A . 34 ASP CG 1 1 3 2755 1 1 34 ASP H H -19.434 -0.075 0.630 1.00 . A A . 34 ASP H 1 1 3 2756 1 1 34 ASP HA H -19.315 2.120 2.561 1.00 . A A . 34 ASP HA 1 1 3 2757 1 1 34 ASP HB2 H -18.548 -0.791 2.874 1.00 . A A . 34 ASP HB2 1 1 3 2758 1 1 34 ASP HB3 H -18.574 0.410 4.162 1.00 . A A . 34 ASP HB3 1 1 3 2759 1 1 34 ASP N N -19.492 0.852 0.943 1.00 . A A . 34 ASP N 1 1 3 2760 1 1 34 ASP O O -16.886 1.493 0.841 1.00 . A A . 34 ASP O 1 1 3 2761 1 1 34 ASP OD1 O -21.116 0.513 4.300 1.00 . A A . 34 ASP OD1 1 1 3 2762 1 1 34 ASP OD2 O -21.011 -1.167 2.886 1.00 . A A . 34 ASP OD2 1 1 3 2763 1 1 35 CYS C C -14.449 1.320 4.130 1.00 . A A . 35 CYS C 1 1 3 2764 1 1 35 CYS CA C -15.202 1.974 2.978 1.00 . A A . 35 CYS CA 1 1 3 2765 1 1 35 CYS CB C -14.944 3.482 2.977 1.00 . A A . 35 CYS CB 1 1 3 2766 1 1 35 CYS H H -17.064 1.683 3.945 1.00 . A A . 35 CYS H 1 1 3 2767 1 1 35 CYS HA H -14.843 1.556 2.049 1.00 . A A . 35 CYS HA 1 1 3 2768 1 1 35 CYS HB2 H -15.517 3.937 2.183 1.00 . A A . 35 CYS HB2 1 1 3 2769 1 1 35 CYS HB3 H -15.262 3.893 3.925 1.00 . A A . 35 CYS HB3 1 1 3 2770 1 1 35 CYS HG H -12.468 2.875 3.020 1.00 . A A . 35 CYS HG 1 1 3 2771 1 1 35 CYS N N -16.632 1.703 3.065 1.00 . A A . 35 CYS N 1 1 3 2772 1 1 35 CYS O O -14.950 1.255 5.251 1.00 . A A . 35 CYS O 1 1 3 2773 1 1 35 CYS SG S -13.211 3.934 2.734 1.00 . A A . 35 CYS SG 1 1 3 2774 1 1 36 GLU C C -10.932 0.449 4.599 1.00 . A A . 36 GLU C 1 1 3 2775 1 1 36 GLU CA C -12.413 0.196 4.862 1.00 . A A . 36 GLU CA 1 1 3 2776 1 1 36 GLU CB C -12.690 -1.309 4.903 1.00 . A A . 36 GLU CB 1 1 3 2777 1 1 36 GLU CD C -14.268 -1.316 6.877 1.00 . A A . 36 GLU CD 1 1 3 2778 1 1 36 GLU CG C -14.078 -1.660 5.412 1.00 . A A . 36 GLU CG 1 1 3 2779 1 1 36 GLU H H -12.895 0.931 2.933 1.00 . A A . 36 GLU H 1 1 3 2780 1 1 36 GLU HA H -12.673 0.625 5.818 1.00 . A A . 36 GLU HA 1 1 3 2781 1 1 36 GLU HB2 H -12.582 -1.712 3.907 1.00 . A A . 36 GLU HB2 1 1 3 2782 1 1 36 GLU HB3 H -11.964 -1.777 5.551 1.00 . A A . 36 GLU HB3 1 1 3 2783 1 1 36 GLU HG2 H -14.809 -1.116 4.832 1.00 . A A . 36 GLU HG2 1 1 3 2784 1 1 36 GLU HG3 H -14.236 -2.722 5.283 1.00 . A A . 36 GLU HG3 1 1 3 2785 1 1 36 GLU N N -13.241 0.842 3.847 1.00 . A A . 36 GLU N 1 1 3 2786 1 1 36 GLU O O -10.570 1.177 3.674 1.00 . A A . 36 GLU O 1 1 3 2787 1 1 36 GLU OE1 O -14.582 -0.146 7.175 1.00 . A A . 36 GLU OE1 1 1 3 2788 1 1 36 GLU OE2 O -14.105 -2.216 7.727 1.00 . A A . 36 GLU OE2 1 1 3 2789 1 1 37 TRP C C -7.988 -1.225 4.667 1.00 . A A . 37 TRP C 1 1 3 2790 1 1 37 TRP CA C -8.639 0.007 5.285 1.00 . A A . 37 TRP CA 1 1 3 2791 1 1 37 TRP CB C -8.021 0.275 6.656 1.00 . A A . 37 TRP CB 1 1 3 2792 1 1 37 TRP CD1 C -9.032 2.626 6.697 1.00 . A A . 37 TRP CD1 1 1 3 2793 1 1 37 TRP CD2 C -8.675 1.746 8.724 1.00 . A A . 37 TRP CD2 1 1 3 2794 1 1 37 TRP CE2 C -9.230 3.030 8.884 1.00 . A A . 37 TRP CE2 1 1 3 2795 1 1 37 TRP CE3 C -8.366 1.001 9.865 1.00 . A A . 37 TRP CE3 1 1 3 2796 1 1 37 TRP CG C -8.558 1.507 7.317 1.00 . A A . 37 TRP CG 1 1 3 2797 1 1 37 TRP CH2 C -9.169 2.831 11.235 1.00 . A A . 37 TRP CH2 1 1 3 2798 1 1 37 TRP CZ2 C -9.481 3.583 10.137 1.00 . A A . 37 TRP CZ2 1 1 3 2799 1 1 37 TRP CZ3 C -8.616 1.550 11.109 1.00 . A A . 37 TRP CZ3 1 1 3 2800 1 1 37 TRP H H -10.426 -0.727 6.134 1.00 . A A . 37 TRP H 1 1 3 2801 1 1 37 TRP HA H -8.457 0.857 4.647 1.00 . A A . 37 TRP HA 1 1 3 2802 1 1 37 TRP HB2 H -8.220 -0.567 7.303 1.00 . A A . 37 TRP HB2 1 1 3 2803 1 1 37 TRP HB3 H -6.955 0.389 6.545 1.00 . A A . 37 TRP HB3 1 1 3 2804 1 1 37 TRP HD1 H -9.076 2.754 5.626 1.00 . A A . 37 TRP HD1 1 1 3 2805 1 1 37 TRP HE1 H -9.818 4.428 7.434 1.00 . A A . 37 TRP HE1 1 1 3 2806 1 1 37 TRP HE3 H -7.939 0.012 9.787 1.00 . A A . 37 TRP HE3 1 1 3 2807 1 1 37 TRP HH2 H -9.347 3.221 12.226 1.00 . A A . 37 TRP HH2 1 1 3 2808 1 1 37 TRP HZ2 H -9.909 4.569 10.252 1.00 . A A . 37 TRP HZ2 1 1 3 2809 1 1 37 TRP HZ3 H -8.382 0.989 12.000 1.00 . A A . 37 TRP HZ3 1 1 3 2810 1 1 37 TRP N N -10.079 -0.158 5.418 1.00 . A A . 37 TRP N 1 1 3 2811 1 1 37 TRP NE1 N -9.439 3.546 7.632 1.00 . A A . 37 TRP NE1 1 1 3 2812 1 1 37 TRP O O -8.491 -2.341 4.801 1.00 . A A . 37 TRP O 1 1 3 2813 1 1 38 VAL C C -5.126 -2.681 4.358 1.00 . A A . 38 VAL C 1 1 3 2814 1 1 38 VAL CA C -6.125 -2.106 3.370 1.00 . A A . 38 VAL CA 1 1 3 2815 1 1 38 VAL CB C -5.369 -1.656 2.106 1.00 . A A . 38 VAL CB 1 1 3 2816 1 1 38 VAL CG1 C -4.600 -2.821 1.499 1.00 . A A . 38 VAL CG1 1 1 3 2817 1 1 38 VAL CG2 C -6.329 -1.065 1.093 1.00 . A A . 38 VAL CG2 1 1 3 2818 1 1 38 VAL H H -6.525 -0.092 3.896 1.00 . A A . 38 VAL H 1 1 3 2819 1 1 38 VAL HA H -6.832 -2.874 3.092 1.00 . A A . 38 VAL HA 1 1 3 2820 1 1 38 VAL HB H -4.660 -0.895 2.386 1.00 . A A . 38 VAL HB 1 1 3 2821 1 1 38 VAL HG11 H -4.241 -2.548 0.524 1.00 . A A . 38 VAL HG11 1 1 3 2822 1 1 38 VAL HG12 H -5.253 -3.678 1.416 1.00 . A A . 38 VAL HG12 1 1 3 2823 1 1 38 VAL HG13 H -3.763 -3.069 2.136 1.00 . A A . 38 VAL HG13 1 1 3 2824 1 1 38 VAL HG21 H -6.740 -1.855 0.486 1.00 . A A . 38 VAL HG21 1 1 3 2825 1 1 38 VAL HG22 H -5.800 -0.365 0.462 1.00 . A A . 38 VAL HG22 1 1 3 2826 1 1 38 VAL HG23 H -7.127 -0.554 1.610 1.00 . A A . 38 VAL HG23 1 1 3 2827 1 1 38 VAL N N -6.863 -1.012 3.989 1.00 . A A . 38 VAL N 1 1 3 2828 1 1 38 VAL O O -4.773 -2.034 5.344 1.00 . A A . 38 VAL O 1 1 3 2829 1 1 39 LYS C C -2.321 -3.982 4.837 1.00 . A A . 39 LYS C 1 1 3 2830 1 1 39 LYS CA C -3.724 -4.546 4.976 1.00 . A A . 39 LYS CA 1 1 3 2831 1 1 39 LYS CB C -3.721 -6.056 4.733 1.00 . A A . 39 LYS CB 1 1 3 2832 1 1 39 LYS CD C -2.881 -8.324 5.407 1.00 . A A . 39 LYS CD 1 1 3 2833 1 1 39 LYS CE C -1.990 -9.103 6.361 1.00 . A A . 39 LYS CE 1 1 3 2834 1 1 39 LYS CG C -2.811 -6.828 5.672 1.00 . A A . 39 LYS CG 1 1 3 2835 1 1 39 LYS H H -4.987 -4.368 3.296 1.00 . A A . 39 LYS H 1 1 3 2836 1 1 39 LYS HA H -4.051 -4.353 5.975 1.00 . A A . 39 LYS HA 1 1 3 2837 1 1 39 LYS HB2 H -4.727 -6.429 4.855 1.00 . A A . 39 LYS HB2 1 1 3 2838 1 1 39 LYS HB3 H -3.399 -6.244 3.719 1.00 . A A . 39 LYS HB3 1 1 3 2839 1 1 39 LYS HD2 H -3.901 -8.654 5.534 1.00 . A A . 39 LYS HD2 1 1 3 2840 1 1 39 LYS HD3 H -2.562 -8.516 4.393 1.00 . A A . 39 LYS HD3 1 1 3 2841 1 1 39 LYS HE2 H -2.036 -10.150 6.102 1.00 . A A . 39 LYS HE2 1 1 3 2842 1 1 39 LYS HE3 H -0.977 -8.752 6.252 1.00 . A A . 39 LYS HE3 1 1 3 2843 1 1 39 LYS HG2 H -1.794 -6.494 5.528 1.00 . A A . 39 LYS HG2 1 1 3 2844 1 1 39 LYS HG3 H -3.115 -6.637 6.691 1.00 . A A . 39 LYS HG3 1 1 3 2845 1 1 39 LYS HZ1 H -1.770 -9.456 8.408 1.00 . A A . 39 LYS HZ1 1 1 3 2846 1 1 39 LYS HZ2 H -3.379 -9.300 7.908 1.00 . A A . 39 LYS HZ2 1 1 3 2847 1 1 39 LYS HZ3 H -2.398 -7.930 8.040 1.00 . A A . 39 LYS HZ3 1 1 3 2848 1 1 39 LYS N N -4.669 -3.895 4.092 1.00 . A A . 39 LYS N 1 1 3 2849 1 1 39 LYS NZ N -2.414 -8.936 7.779 1.00 . A A . 39 LYS NZ 1 1 3 2850 1 1 39 LYS O O -1.610 -4.264 3.872 1.00 . A A . 39 LYS O 1 1 3 2851 1 1 40 GLY C C 0.395 -3.451 6.563 1.00 . A A . 40 GLY C 1 1 3 2852 1 1 40 GLY CA C -0.614 -2.590 5.835 1.00 . A A . 40 GLY CA 1 1 3 2853 1 1 40 GLY H H -2.568 -2.967 6.537 1.00 . A A . 40 GLY H 1 1 3 2854 1 1 40 GLY HA2 H -0.284 -2.468 4.818 1.00 . A A . 40 GLY HA2 1 1 3 2855 1 1 40 GLY HA3 H -0.660 -1.623 6.310 1.00 . A A . 40 GLY HA3 1 1 3 2856 1 1 40 GLY N N -1.936 -3.177 5.822 1.00 . A A . 40 GLY N 1 1 3 2857 1 1 40 GLY O O 1.180 -2.958 7.373 1.00 . A A . 40 GLY O 1 1 3 2858 1 1 41 VAL C C 2.078 -6.391 5.784 1.00 . A A . 41 VAL C 1 1 3 2859 1 1 41 VAL CA C 1.286 -5.688 6.883 1.00 . A A . 41 VAL CA 1 1 3 2860 1 1 41 VAL CB C 0.582 -6.762 7.732 1.00 . A A . 41 VAL CB 1 1 3 2861 1 1 41 VAL CG1 C 1.534 -7.328 8.774 1.00 . A A . 41 VAL CG1 1 1 3 2862 1 1 41 VAL CG2 C -0.676 -6.208 8.390 1.00 . A A . 41 VAL CG2 1 1 3 2863 1 1 41 VAL H H -0.332 -5.079 5.673 1.00 . A A . 41 VAL H 1 1 3 2864 1 1 41 VAL HA H 1.967 -5.138 7.515 1.00 . A A . 41 VAL HA 1 1 3 2865 1 1 41 VAL HB H 0.297 -7.567 7.073 1.00 . A A . 41 VAL HB 1 1 3 2866 1 1 41 VAL HG11 H 2.406 -7.730 8.283 1.00 . A A . 41 VAL HG11 1 1 3 2867 1 1 41 VAL HG12 H 1.037 -8.113 9.324 1.00 . A A . 41 VAL HG12 1 1 3 2868 1 1 41 VAL HG13 H 1.832 -6.544 9.454 1.00 . A A . 41 VAL HG13 1 1 3 2869 1 1 41 VAL HG21 H -1.080 -6.942 9.070 1.00 . A A . 41 VAL HG21 1 1 3 2870 1 1 41 VAL HG22 H -1.408 -5.977 7.631 1.00 . A A . 41 VAL HG22 1 1 3 2871 1 1 41 VAL HG23 H -0.429 -5.309 8.937 1.00 . A A . 41 VAL HG23 1 1 3 2872 1 1 41 VAL N N 0.350 -4.746 6.291 1.00 . A A . 41 VAL N 1 1 3 2873 1 1 41 VAL O O 2.816 -7.339 6.050 1.00 . A A . 41 VAL O 1 1 3 2874 1 1 42 HIS C C 4.061 -6.090 3.409 1.00 . A A . 42 HIS C 1 1 3 2875 1 1 42 HIS CA C 2.614 -6.510 3.414 1.00 . A A . 42 HIS CA 1 1 3 2876 1 1 42 HIS CB C 1.899 -6.138 2.116 1.00 . A A . 42 HIS CB 1 1 3 2877 1 1 42 HIS CD2 C 1.656 -7.901 0.228 1.00 . A A . 42 HIS CD2 1 1 3 2878 1 1 42 HIS CE1 C -0.078 -8.980 1.023 1.00 . A A . 42 HIS CE1 1 1 3 2879 1 1 42 HIS CG C 1.309 -7.311 1.397 1.00 . A A . 42 HIS CG 1 1 3 2880 1 1 42 HIS H H 1.328 -5.153 4.386 1.00 . A A . 42 HIS H 1 1 3 2881 1 1 42 HIS HA H 2.598 -7.564 3.537 1.00 . A A . 42 HIS HA 1 1 3 2882 1 1 42 HIS HB2 H 1.086 -5.460 2.351 1.00 . A A . 42 HIS HB2 1 1 3 2883 1 1 42 HIS HB3 H 2.594 -5.648 1.450 1.00 . A A . 42 HIS HB3 1 1 3 2884 1 1 42 HIS HD1 H -0.265 -7.824 2.701 1.00 . A A . 42 HIS HD1 1 1 3 2885 1 1 42 HIS HD2 H 2.470 -7.610 -0.420 1.00 . A A . 42 HIS HD2 1 1 3 2886 1 1 42 HIS HE1 H -0.884 -9.690 1.135 1.00 . A A . 42 HIS HE1 1 1 3 2887 1 1 42 HIS HE2 H 0.710 -9.464 -0.803 1.00 . A A . 42 HIS HE2 1 1 3 2888 1 1 42 HIS N N 1.919 -5.921 4.545 1.00 . A A . 42 HIS N 1 1 3 2889 1 1 42 HIS ND1 N 0.219 -8.010 1.869 1.00 . A A . 42 HIS ND1 1 1 3 2890 1 1 42 HIS NE2 N 0.778 -8.936 0.020 1.00 . A A . 42 HIS NE2 1 1 3 2891 1 1 42 HIS O O 4.489 -5.273 2.595 1.00 . A A . 42 HIS O 1 1 3 2892 1 1 43 VAL C C 7.058 -6.651 3.269 1.00 . A A . 43 VAL C 1 1 3 2893 1 1 43 VAL CA C 6.219 -6.451 4.517 1.00 . A A . 43 VAL CA 1 1 3 2894 1 1 43 VAL CB C 6.790 -7.323 5.655 1.00 . A A . 43 VAL CB 1 1 3 2895 1 1 43 VAL CG1 C 8.271 -7.041 5.876 1.00 . A A . 43 VAL CG1 1 1 3 2896 1 1 43 VAL CG2 C 6.006 -7.101 6.940 1.00 . A A . 43 VAL CG2 1 1 3 2897 1 1 43 VAL H H 4.364 -7.392 4.886 1.00 . A A . 43 VAL H 1 1 3 2898 1 1 43 VAL HA H 6.312 -5.425 4.812 1.00 . A A . 43 VAL HA 1 1 3 2899 1 1 43 VAL HB H 6.685 -8.361 5.373 1.00 . A A . 43 VAL HB 1 1 3 2900 1 1 43 VAL HG11 H 8.430 -5.975 5.926 1.00 . A A . 43 VAL HG11 1 1 3 2901 1 1 43 VAL HG12 H 8.842 -7.453 5.058 1.00 . A A . 43 VAL HG12 1 1 3 2902 1 1 43 VAL HG13 H 8.589 -7.495 6.802 1.00 . A A . 43 VAL HG13 1 1 3 2903 1 1 43 VAL HG21 H 4.970 -7.362 6.780 1.00 . A A . 43 VAL HG21 1 1 3 2904 1 1 43 VAL HG22 H 6.074 -6.062 7.228 1.00 . A A . 43 VAL HG22 1 1 3 2905 1 1 43 VAL HG23 H 6.416 -7.719 7.725 1.00 . A A . 43 VAL HG23 1 1 3 2906 1 1 43 VAL N N 4.802 -6.722 4.314 1.00 . A A . 43 VAL N 1 1 3 2907 1 1 43 VAL O O 7.799 -7.627 3.147 1.00 . A A . 43 VAL O 1 1 3 2908 1 1 44 ALA C C 8.975 -4.904 1.348 1.00 . A A . 44 ALA C 1 1 3 2909 1 1 44 ALA CA C 7.723 -5.735 1.129 1.00 . A A . 44 ALA CA 1 1 3 2910 1 1 44 ALA CB C 6.918 -5.220 -0.054 1.00 . A A . 44 ALA CB 1 1 3 2911 1 1 44 ALA H H 6.285 -4.993 2.477 1.00 . A A . 44 ALA H 1 1 3 2912 1 1 44 ALA HA H 8.014 -6.756 0.939 1.00 . A A . 44 ALA HA 1 1 3 2913 1 1 44 ALA HB1 H 5.969 -5.732 -0.093 1.00 . A A . 44 ALA HB1 1 1 3 2914 1 1 44 ALA HB2 H 7.465 -5.404 -0.967 1.00 . A A . 44 ALA HB2 1 1 3 2915 1 1 44 ALA HB3 H 6.752 -4.159 0.059 1.00 . A A . 44 ALA HB3 1 1 3 2916 1 1 44 ALA N N 6.932 -5.715 2.341 1.00 . A A . 44 ALA N 1 1 3 2917 1 1 44 ALA O O 9.317 -4.037 0.545 1.00 . A A . 44 ALA O 1 1 3 2918 1 1 45 GLU C C 11.788 -4.291 1.637 1.00 . A A . 45 GLU C 1 1 3 2919 1 1 45 GLU CA C 10.870 -4.464 2.838 1.00 . A A . 45 GLU CA 1 1 3 2920 1 1 45 GLU CB C 11.604 -5.201 3.970 1.00 . A A . 45 GLU CB 1 1 3 2921 1 1 45 GLU CD C 13.113 -7.112 4.667 1.00 . A A . 45 GLU CD 1 1 3 2922 1 1 45 GLU CG C 12.456 -6.382 3.511 1.00 . A A . 45 GLU CG 1 1 3 2923 1 1 45 GLU H H 9.323 -5.898 3.039 1.00 . A A . 45 GLU H 1 1 3 2924 1 1 45 GLU HA H 10.575 -3.486 3.190 1.00 . A A . 45 GLU HA 1 1 3 2925 1 1 45 GLU HB2 H 12.251 -4.499 4.476 1.00 . A A . 45 GLU HB2 1 1 3 2926 1 1 45 GLU HB3 H 10.872 -5.569 4.674 1.00 . A A . 45 GLU HB3 1 1 3 2927 1 1 45 GLU HG2 H 11.833 -7.079 2.974 1.00 . A A . 45 GLU HG2 1 1 3 2928 1 1 45 GLU HG3 H 13.231 -6.013 2.853 1.00 . A A . 45 GLU HG3 1 1 3 2929 1 1 45 GLU N N 9.652 -5.182 2.460 1.00 . A A . 45 GLU N 1 1 3 2930 1 1 45 GLU O O 12.554 -3.330 1.553 1.00 . A A . 45 GLU O 1 1 3 2931 1 1 45 GLU OE1 O 12.476 -8.026 5.231 1.00 . A A . 45 GLU OE1 1 1 3 2932 1 1 45 GLU OE2 O 14.264 -6.767 5.008 1.00 . A A . 45 GLU OE2 1 1 3 2933 1 1 46 ASP C C 12.034 -4.076 -1.403 1.00 . A A . 46 ASP C 1 1 3 2934 1 1 46 ASP CA C 12.512 -5.191 -0.497 1.00 . A A . 46 ASP CA 1 1 3 2935 1 1 46 ASP CB C 12.449 -6.528 -1.230 1.00 . A A . 46 ASP CB 1 1 3 2936 1 1 46 ASP CG C 13.369 -6.571 -2.434 1.00 . A A . 46 ASP CG 1 1 3 2937 1 1 46 ASP H H 11.072 -5.978 0.851 1.00 . A A . 46 ASP H 1 1 3 2938 1 1 46 ASP HA H 13.534 -4.988 -0.214 1.00 . A A . 46 ASP HA 1 1 3 2939 1 1 46 ASP HB2 H 12.736 -7.316 -0.551 1.00 . A A . 46 ASP HB2 1 1 3 2940 1 1 46 ASP HB3 H 11.437 -6.698 -1.565 1.00 . A A . 46 ASP HB3 1 1 3 2941 1 1 46 ASP N N 11.702 -5.235 0.714 1.00 . A A . 46 ASP N 1 1 3 2942 1 1 46 ASP O O 12.834 -3.325 -1.952 1.00 . A A . 46 ASP O 1 1 3 2943 1 1 46 ASP OD1 O 13.013 -5.980 -3.475 1.00 . A A . 46 ASP OD1 1 1 3 2944 1 1 46 ASP OD2 O 14.446 -7.198 -2.337 1.00 . A A . 46 ASP OD2 1 1 3 2945 1 1 47 VAL C C 10.501 -1.556 -1.804 1.00 . A A . 47 VAL C 1 1 3 2946 1 1 47 VAL CA C 10.149 -2.920 -2.381 1.00 . A A . 47 VAL CA 1 1 3 2947 1 1 47 VAL CB C 8.620 -3.066 -2.479 1.00 . A A . 47 VAL CB 1 1 3 2948 1 1 47 VAL CG1 C 8.031 -1.952 -3.324 1.00 . A A . 47 VAL CG1 1 1 3 2949 1 1 47 VAL CG2 C 8.251 -4.426 -3.050 1.00 . A A . 47 VAL CG2 1 1 3 2950 1 1 47 VAL H H 10.129 -4.579 -1.071 1.00 . A A . 47 VAL H 1 1 3 2951 1 1 47 VAL HA H 10.571 -3.007 -3.373 1.00 . A A . 47 VAL HA 1 1 3 2952 1 1 47 VAL HB H 8.208 -2.993 -1.483 1.00 . A A . 47 VAL HB 1 1 3 2953 1 1 47 VAL HG11 H 8.326 -0.996 -2.917 1.00 . A A . 47 VAL HG11 1 1 3 2954 1 1 47 VAL HG12 H 6.953 -2.027 -3.317 1.00 . A A . 47 VAL HG12 1 1 3 2955 1 1 47 VAL HG13 H 8.391 -2.039 -4.338 1.00 . A A . 47 VAL HG13 1 1 3 2956 1 1 47 VAL HG21 H 8.508 -4.458 -4.098 1.00 . A A . 47 VAL HG21 1 1 3 2957 1 1 47 VAL HG22 H 7.190 -4.589 -2.934 1.00 . A A . 47 VAL HG22 1 1 3 2958 1 1 47 VAL HG23 H 8.794 -5.197 -2.523 1.00 . A A . 47 VAL HG23 1 1 3 2959 1 1 47 VAL N N 10.723 -3.961 -1.549 1.00 . A A . 47 VAL N 1 1 3 2960 1 1 47 VAL O O 10.956 -0.687 -2.511 1.00 . A A . 47 VAL O 1 1 3 2961 1 1 48 ALA C C 12.058 0.064 0.343 1.00 . A A . 48 ALA C 1 1 3 2962 1 1 48 ALA CA C 10.567 -0.235 0.295 1.00 . A A . 48 ALA CA 1 1 3 2963 1 1 48 ALA CB C 10.042 -0.429 1.710 1.00 . A A . 48 ALA CB 1 1 3 2964 1 1 48 ALA H H 9.952 -2.191 -0.054 1.00 . A A . 48 ALA H 1 1 3 2965 1 1 48 ALA HA H 10.041 0.600 -0.135 1.00 . A A . 48 ALA HA 1 1 3 2966 1 1 48 ALA HB1 H 10.442 -1.345 2.119 1.00 . A A . 48 ALA HB1 1 1 3 2967 1 1 48 ALA HB2 H 8.964 -0.485 1.687 1.00 . A A . 48 ALA HB2 1 1 3 2968 1 1 48 ALA HB3 H 10.346 0.405 2.325 1.00 . A A . 48 ALA HB3 1 1 3 2969 1 1 48 ALA N N 10.296 -1.436 -0.500 1.00 . A A . 48 ALA N 1 1 3 2970 1 1 48 ALA O O 12.493 1.164 -0.001 1.00 . A A . 48 ALA O 1 1 3 2971 1 1 49 LYS C C 14.846 -0.460 -0.528 1.00 . A A . 49 LYS C 1 1 3 2972 1 1 49 LYS CA C 14.287 -0.766 0.853 1.00 . A A . 49 LYS CA 1 1 3 2973 1 1 49 LYS CB C 14.930 -2.036 1.416 1.00 . A A . 49 LYS CB 1 1 3 2974 1 1 49 LYS CD C 17.027 -3.220 2.132 1.00 . A A . 49 LYS CD 1 1 3 2975 1 1 49 LYS CE C 16.710 -4.467 1.322 1.00 . A A . 49 LYS CE 1 1 3 2976 1 1 49 LYS CG C 16.446 -1.971 1.487 1.00 . A A . 49 LYS CG 1 1 3 2977 1 1 49 LYS H H 12.436 -1.782 1.027 1.00 . A A . 49 LYS H 1 1 3 2978 1 1 49 LYS HA H 14.497 0.064 1.511 1.00 . A A . 49 LYS HA 1 1 3 2979 1 1 49 LYS HB2 H 14.551 -2.205 2.412 1.00 . A A . 49 LYS HB2 1 1 3 2980 1 1 49 LYS HB3 H 14.656 -2.873 0.790 1.00 . A A . 49 LYS HB3 1 1 3 2981 1 1 49 LYS HD2 H 18.098 -3.113 2.203 1.00 . A A . 49 LYS HD2 1 1 3 2982 1 1 49 LYS HD3 H 16.607 -3.328 3.122 1.00 . A A . 49 LYS HD3 1 1 3 2983 1 1 49 LYS HE2 H 17.074 -5.331 1.856 1.00 . A A . 49 LYS HE2 1 1 3 2984 1 1 49 LYS HE3 H 15.638 -4.541 1.206 1.00 . A A . 49 LYS HE3 1 1 3 2985 1 1 49 LYS HG2 H 16.841 -1.879 0.486 1.00 . A A . 49 LYS HG2 1 1 3 2986 1 1 49 LYS HG3 H 16.733 -1.108 2.070 1.00 . A A . 49 LYS HG3 1 1 3 2987 1 1 49 LYS HZ1 H 17.015 -3.593 -0.553 1.00 . A A . 49 LYS HZ1 1 1 3 2988 1 1 49 LYS HZ2 H 17.090 -5.283 -0.563 1.00 . A A . 49 LYS HZ2 1 1 3 2989 1 1 49 LYS HZ3 H 18.377 -4.384 0.065 1.00 . A A . 49 LYS HZ3 1 1 3 2990 1 1 49 LYS N N 12.840 -0.925 0.772 1.00 . A A . 49 LYS N 1 1 3 2991 1 1 49 LYS NZ N 17.342 -4.429 -0.026 1.00 . A A . 49 LYS NZ 1 1 3 2992 1 1 49 LYS O O 15.831 0.259 -0.676 1.00 . A A . 49 LYS O 1 1 3 2993 1 1 50 ASP C C 13.829 0.343 -3.532 1.00 . A A . 50 ASP C 1 1 3 2994 1 1 50 ASP CA C 14.604 -0.824 -2.916 1.00 . A A . 50 ASP CA 1 1 3 2995 1 1 50 ASP CB C 14.372 -2.099 -3.726 1.00 . A A . 50 ASP CB 1 1 3 2996 1 1 50 ASP CG C 15.195 -2.136 -4.999 1.00 . A A . 50 ASP CG 1 1 3 2997 1 1 50 ASP H H 13.427 -1.592 -1.345 1.00 . A A . 50 ASP H 1 1 3 2998 1 1 50 ASP HA H 15.657 -0.586 -2.927 1.00 . A A . 50 ASP HA 1 1 3 2999 1 1 50 ASP HB2 H 14.634 -2.955 -3.119 1.00 . A A . 50 ASP HB2 1 1 3 3000 1 1 50 ASP HB3 H 13.326 -2.160 -3.993 1.00 . A A . 50 ASP HB3 1 1 3 3001 1 1 50 ASP N N 14.206 -1.031 -1.536 1.00 . A A . 50 ASP N 1 1 3 3002 1 1 50 ASP O O 14.139 0.788 -4.637 1.00 . A A . 50 ASP O 1 1 3 3003 1 1 50 ASP OD1 O 16.364 -2.571 -4.937 1.00 . A A . 50 ASP OD1 1 1 3 3004 1 1 50 ASP OD2 O 14.671 -1.728 -6.057 1.00 . A A . 50 ASP OD2 1 1 3 3005 1 1 51 TYR C C 12.632 3.265 -2.940 1.00 . A A . 51 TYR C 1 1 3 3006 1 1 51 TYR CA C 12.004 1.931 -3.297 1.00 . A A . 51 TYR CA 1 1 3 3007 1 1 51 TYR CB C 10.590 1.886 -2.729 1.00 . A A . 51 TYR CB 1 1 3 3008 1 1 51 TYR CD1 C 9.937 0.504 -4.770 1.00 . A A . 51 TYR CD1 1 1 3 3009 1 1 51 TYR CD2 C 8.197 1.403 -3.408 1.00 . A A . 51 TYR CD2 1 1 3 3010 1 1 51 TYR CE1 C 8.993 -0.059 -5.610 1.00 . A A . 51 TYR CE1 1 1 3 3011 1 1 51 TYR CE2 C 7.252 0.837 -4.245 1.00 . A A . 51 TYR CE2 1 1 3 3012 1 1 51 TYR CG C 9.557 1.249 -3.652 1.00 . A A . 51 TYR CG 1 1 3 3013 1 1 51 TYR CZ C 7.654 0.112 -5.343 1.00 . A A . 51 TYR CZ 1 1 3 3014 1 1 51 TYR H H 12.613 0.454 -1.945 1.00 . A A . 51 TYR H 1 1 3 3015 1 1 51 TYR HA H 11.941 1.818 -4.344 1.00 . A A . 51 TYR HA 1 1 3 3016 1 1 51 TYR HB2 H 10.616 1.328 -1.822 1.00 . A A . 51 TYR HB2 1 1 3 3017 1 1 51 TYR HB3 H 10.266 2.894 -2.515 1.00 . A A . 51 TYR HB3 1 1 3 3018 1 1 51 TYR HD1 H 10.983 0.362 -4.981 1.00 . A A . 51 TYR HD1 1 1 3 3019 1 1 51 TYR HD2 H 7.877 1.968 -2.546 1.00 . A A . 51 TYR HD2 1 1 3 3020 1 1 51 TYR HE1 H 9.309 -0.631 -6.469 1.00 . A A . 51 TYR HE1 1 1 3 3021 1 1 51 TYR HE2 H 6.203 0.969 -4.038 1.00 . A A . 51 TYR HE2 1 1 3 3022 1 1 51 TYR HH H 5.998 0.180 -6.318 1.00 . A A . 51 TYR HH 1 1 3 3023 1 1 51 TYR N N 12.816 0.836 -2.812 1.00 . A A . 51 TYR N 1 1 3 3024 1 1 51 TYR O O 13.029 4.041 -3.808 1.00 . A A . 51 TYR O 1 1 3 3025 1 1 51 TYR OH O 6.712 -0.446 -6.176 1.00 . A A . 51 TYR OH 1 1 3 3026 1 1 52 GLU C C 14.797 4.650 -1.005 1.00 . A A . 52 GLU C 1 1 3 3027 1 1 52 GLU CA C 13.283 4.750 -1.121 1.00 . A A . 52 GLU CA 1 1 3 3028 1 1 52 GLU CB C 12.681 5.075 0.249 1.00 . A A . 52 GLU CB 1 1 3 3029 1 1 52 GLU CD C 12.568 4.495 2.709 1.00 . A A . 52 GLU CD 1 1 3 3030 1 1 52 GLU CG C 13.143 4.135 1.353 1.00 . A A . 52 GLU CG 1 1 3 3031 1 1 52 GLU H H 12.415 2.825 -1.003 1.00 . A A . 52 GLU H 1 1 3 3032 1 1 52 GLU HA H 13.032 5.537 -1.811 1.00 . A A . 52 GLU HA 1 1 3 3033 1 1 52 GLU HB2 H 12.959 6.082 0.522 1.00 . A A . 52 GLU HB2 1 1 3 3034 1 1 52 GLU HB3 H 11.606 5.013 0.178 1.00 . A A . 52 GLU HB3 1 1 3 3035 1 1 52 GLU HG2 H 12.837 3.131 1.105 1.00 . A A . 52 GLU HG2 1 1 3 3036 1 1 52 GLU HG3 H 14.221 4.176 1.414 1.00 . A A . 52 GLU HG3 1 1 3 3037 1 1 52 GLU N N 12.722 3.510 -1.637 1.00 . A A . 52 GLU N 1 1 3 3038 1 1 52 GLU O O 15.526 5.577 -1.354 1.00 . A A . 52 GLU O 1 1 3 3039 1 1 52 GLU OE1 O 12.959 5.547 3.259 1.00 . A A . 52 GLU OE1 1 1 3 3040 1 1 52 GLU OE2 O 11.725 3.728 3.219 1.00 . A A . 52 GLU OE2 1 1 3 3041 1 1 53 ASP C C 17.310 2.688 -1.595 1.00 . A A . 53 ASP C 1 1 3 3042 1 1 53 ASP CA C 16.682 3.271 -0.331 1.00 . A A . 53 ASP CA 1 1 3 3043 1 1 53 ASP CB C 16.898 2.328 0.853 1.00 . A A . 53 ASP CB 1 1 3 3044 1 1 53 ASP CG C 17.051 3.073 2.164 1.00 . A A . 53 ASP CG 1 1 3 3045 1 1 53 ASP H H 14.622 2.812 -0.252 1.00 . A A . 53 ASP H 1 1 3 3046 1 1 53 ASP HA H 17.155 4.218 -0.115 1.00 . A A . 53 ASP HA 1 1 3 3047 1 1 53 ASP HB2 H 16.043 1.672 0.936 1.00 . A A . 53 ASP HB2 1 1 3 3048 1 1 53 ASP HB3 H 17.789 1.741 0.683 1.00 . A A . 53 ASP HB3 1 1 3 3049 1 1 53 ASP N N 15.259 3.513 -0.508 1.00 . A A . 53 ASP N 1 1 3 3050 1 1 53 ASP O O 18.527 2.736 -1.770 1.00 . A A . 53 ASP O 1 1 3 3051 1 1 53 ASP OD1 O 16.034 3.583 2.679 1.00 . A A . 53 ASP OD1 1 1 3 3052 1 1 53 ASP OD2 O 18.188 3.147 2.676 1.00 . A A . 53 ASP OD2 1 1 3 3053 1 1 54 GLY C C 17.264 2.614 -4.761 1.00 . A A . 54 GLY C 1 1 3 3054 1 1 54 GLY CA C 16.983 1.562 -3.706 1.00 . A A . 54 GLY CA 1 1 3 3055 1 1 54 GLY H H 15.516 2.118 -2.285 1.00 . A A . 54 GLY H 1 1 3 3056 1 1 54 GLY HA2 H 17.897 1.029 -3.492 1.00 . A A . 54 GLY HA2 1 1 3 3057 1 1 54 GLY HA3 H 16.254 0.865 -4.092 1.00 . A A . 54 GLY HA3 1 1 3 3058 1 1 54 GLY N N 16.477 2.137 -2.474 1.00 . A A . 54 GLY N 1 1 3 3059 1 1 54 GLY O O 18.139 2.434 -5.608 1.00 . A A . 54 GLY O 1 1 3 3060 1 1 55 LEU C C 17.783 5.762 -5.188 1.00 . A A . 55 LEU C 1 1 3 3061 1 1 55 LEU CA C 16.698 4.803 -5.667 1.00 . A A . 55 LEU CA 1 1 3 3062 1 1 55 LEU CB C 15.378 5.555 -5.869 1.00 . A A . 55 LEU CB 1 1 3 3063 1 1 55 LEU CD1 C 16.369 7.582 -6.980 1.00 . A A . 55 LEU CD1 1 1 3 3064 1 1 55 LEU CD2 C 15.547 5.671 -8.367 1.00 . A A . 55 LEU CD2 1 1 3 3065 1 1 55 LEU CG C 15.332 6.474 -7.093 1.00 . A A . 55 LEU CG 1 1 3 3066 1 1 55 LEU H H 15.836 3.799 -4.014 1.00 . A A . 55 LEU H 1 1 3 3067 1 1 55 LEU HA H 17.004 4.371 -6.606 1.00 . A A . 55 LEU HA 1 1 3 3068 1 1 55 LEU HB2 H 14.586 4.826 -5.963 1.00 . A A . 55 LEU HB2 1 1 3 3069 1 1 55 LEU HB3 H 15.191 6.154 -4.990 1.00 . A A . 55 LEU HB3 1 1 3 3070 1 1 55 LEU HD11 H 16.181 8.330 -7.735 1.00 . A A . 55 LEU HD11 1 1 3 3071 1 1 55 LEU HD12 H 17.356 7.166 -7.123 1.00 . A A . 55 LEU HD12 1 1 3 3072 1 1 55 LEU HD13 H 16.308 8.033 -6.001 1.00 . A A . 55 LEU HD13 1 1 3 3073 1 1 55 LEU HD21 H 15.497 6.329 -9.221 1.00 . A A . 55 LEU HD21 1 1 3 3074 1 1 55 LEU HD22 H 14.777 4.916 -8.450 1.00 . A A . 55 LEU HD22 1 1 3 3075 1 1 55 LEU HD23 H 16.515 5.194 -8.334 1.00 . A A . 55 LEU HD23 1 1 3 3076 1 1 55 LEU HG H 14.357 6.936 -7.149 1.00 . A A . 55 LEU HG 1 1 3 3077 1 1 55 LEU N N 16.521 3.716 -4.710 1.00 . A A . 55 LEU N 1 1 3 3078 1 1 55 LEU O O 18.826 5.902 -5.826 1.00 . A A . 55 LEU O 1 1 3 3079 1 1 56 GLU C C 19.468 6.646 -2.572 1.00 . A A . 56 GLU C 1 1 3 3080 1 1 56 GLU CA C 18.495 7.362 -3.499 1.00 . A A . 56 GLU CA 1 1 3 3081 1 1 56 GLU CB C 17.779 8.485 -2.742 1.00 . A A . 56 GLU CB 1 1 3 3082 1 1 56 GLU CD C 16.276 9.096 -0.806 1.00 . A A . 56 GLU CD 1 1 3 3083 1 1 56 GLU CG C 16.794 7.985 -1.699 1.00 . A A . 56 GLU CG 1 1 3 3084 1 1 56 GLU H H 16.681 6.274 -3.598 1.00 . A A . 56 GLU H 1 1 3 3085 1 1 56 GLU HA H 19.053 7.789 -4.319 1.00 . A A . 56 GLU HA 1 1 3 3086 1 1 56 GLU HB2 H 18.518 9.095 -2.244 1.00 . A A . 56 GLU HB2 1 1 3 3087 1 1 56 GLU HB3 H 17.240 9.096 -3.453 1.00 . A A . 56 GLU HB3 1 1 3 3088 1 1 56 GLU HG2 H 15.954 7.533 -2.205 1.00 . A A . 56 GLU HG2 1 1 3 3089 1 1 56 GLU HG3 H 17.283 7.245 -1.083 1.00 . A A . 56 GLU HG3 1 1 3 3090 1 1 56 GLU N N 17.532 6.423 -4.060 1.00 . A A . 56 GLU N 1 1 3 3091 1 1 56 GLU O O 19.582 6.978 -1.392 1.00 . A A . 56 GLU O 1 1 3 3092 1 1 56 GLU OE1 O 17.063 9.613 0.014 1.00 . A A . 56 GLU OE1 1 1 3 3093 1 1 56 GLU OE2 O 15.084 9.448 -0.925 1.00 . A A . 56 GLU OE2 1 1 3 3094 1 1 57 TYR C C 22.483 5.596 -2.307 1.00 . A A . 57 TYR C 1 1 3 3095 1 1 57 TYR CA C 21.135 4.885 -2.353 1.00 . A A . 57 TYR CA 1 1 3 3096 1 1 57 TYR CB C 21.301 3.492 -2.964 1.00 . A A . 57 TYR CB 1 1 3 3097 1 1 57 TYR CD1 C 23.639 2.622 -2.576 1.00 . A A . 57 TYR CD1 1 1 3 3098 1 1 57 TYR CD2 C 21.890 1.799 -1.183 1.00 . A A . 57 TYR CD2 1 1 3 3099 1 1 57 TYR CE1 C 24.552 1.828 -1.907 1.00 . A A . 57 TYR CE1 1 1 3 3100 1 1 57 TYR CE2 C 22.795 1.003 -0.509 1.00 . A A . 57 TYR CE2 1 1 3 3101 1 1 57 TYR CG C 22.295 2.621 -2.228 1.00 . A A . 57 TYR CG 1 1 3 3102 1 1 57 TYR CZ C 24.124 1.019 -0.875 1.00 . A A . 57 TYR CZ 1 1 3 3103 1 1 57 TYR H H 20.023 5.445 -4.064 1.00 . A A . 57 TYR H 1 1 3 3104 1 1 57 TYR HA H 20.758 4.784 -1.346 1.00 . A A . 57 TYR HA 1 1 3 3105 1 1 57 TYR HB2 H 20.348 2.985 -2.953 1.00 . A A . 57 TYR HB2 1 1 3 3106 1 1 57 TYR HB3 H 21.638 3.591 -3.985 1.00 . A A . 57 TYR HB3 1 1 3 3107 1 1 57 TYR HD1 H 23.971 3.255 -3.385 1.00 . A A . 57 TYR HD1 1 1 3 3108 1 1 57 TYR HD2 H 20.847 1.787 -0.899 1.00 . A A . 57 TYR HD2 1 1 3 3109 1 1 57 TYR HE1 H 25.593 1.843 -2.193 1.00 . A A . 57 TYR HE1 1 1 3 3110 1 1 57 TYR HE2 H 22.460 0.370 0.301 1.00 . A A . 57 TYR HE2 1 1 3 3111 1 1 57 TYR HH H 24.679 -0.662 -0.128 1.00 . A A . 57 TYR HH 1 1 3 3112 1 1 57 TYR N N 20.165 5.659 -3.119 1.00 . A A . 57 TYR N 1 1 3 3113 1 1 57 TYR O O 23.313 5.353 -3.209 1.00 . A A . 57 TYR O 1 1 3 3114 1 1 57 TYR OXT O 22.700 6.392 -1.368 1.00 . A A . 57 TYR OXT 1 1 3 3115 1 1 57 TYR OH O 25.029 0.228 -0.205 1.00 . A A . 57 TYR OH 1 1 3 3116 2 2 1 ALA C C -14.189 -8.075 5.232 1.00 . B B . 1 ALA C 1 1 3 3117 2 2 1 ALA CA C -13.703 -9.523 5.251 1.00 . B B . 1 ALA CA 1 1 3 3118 2 2 1 ALA CB C -13.479 -10.020 3.831 1.00 . B B . 1 ALA CB 1 1 3 3119 2 2 1 ALA H1 H -14.333 -11.387 5.941 1.00 . B B . 1 ALA H1 1 1 3 3120 2 2 1 ALA H2 H -15.599 -10.360 5.490 1.00 . B B . 1 ALA H2 1 1 3 3121 2 2 1 ALA H3 H -14.776 -10.099 6.944 1.00 . B B . 1 ALA H3 1 1 3 3122 2 2 1 ALA HA H -12.759 -9.571 5.774 1.00 . B B . 1 ALA HA 1 1 3 3123 2 2 1 ALA HB1 H -13.129 -11.042 3.856 1.00 . B B . 1 ALA HB1 1 1 3 3124 2 2 1 ALA HB2 H -12.741 -9.400 3.344 1.00 . B B . 1 ALA HB2 1 1 3 3125 2 2 1 ALA HB3 H -14.408 -9.973 3.282 1.00 . B B . 1 ALA HB3 1 1 3 3126 2 2 1 ALA N N -14.670 -10.404 5.956 1.00 . B B . 1 ALA N 1 1 3 3127 2 2 1 ALA O O -15.376 -7.816 5.031 1.00 . B B . 1 ALA O 1 1 3 3128 2 2 2 PRO C C -13.790 -5.124 4.034 1.00 . B B . 2 PRO C 1 1 3 3129 2 2 2 PRO CA C -13.618 -5.686 5.447 1.00 . B B . 2 PRO CA 1 1 3 3130 2 2 2 PRO CB C -12.409 -5.049 6.128 1.00 . B B . 2 PRO CB 1 1 3 3131 2 2 2 PRO CD C -11.838 -7.333 5.690 1.00 . B B . 2 PRO CD 1 1 3 3132 2 2 2 PRO CG C -11.271 -5.939 5.770 1.00 . B B . 2 PRO CG 1 1 3 3133 2 2 2 PRO HA H -14.505 -5.495 6.031 1.00 . B B . 2 PRO HA 1 1 3 3134 2 2 2 PRO HB2 H -12.265 -4.048 5.751 1.00 . B B . 2 PRO HB2 1 1 3 3135 2 2 2 PRO HB3 H -12.566 -5.021 7.196 1.00 . B B . 2 PRO HB3 1 1 3 3136 2 2 2 PRO HD2 H -11.386 -7.877 4.873 1.00 . B B . 2 PRO HD2 1 1 3 3137 2 2 2 PRO HD3 H -11.685 -7.856 6.622 1.00 . B B . 2 PRO HD3 1 1 3 3138 2 2 2 PRO HG2 H -10.863 -5.646 4.814 1.00 . B B . 2 PRO HG2 1 1 3 3139 2 2 2 PRO HG3 H -10.510 -5.889 6.534 1.00 . B B . 2 PRO HG3 1 1 3 3140 2 2 2 PRO N N -13.276 -7.111 5.441 1.00 . B B . 2 PRO N 1 1 3 3141 2 2 2 PRO O O -12.848 -5.128 3.243 1.00 . B B . 2 PRO O 1 1 3 3142 2 2 3 PRO C C -14.571 -2.735 2.139 1.00 . B B . 3 PRO C 1 1 3 3143 2 2 3 PRO CA C -15.278 -4.067 2.372 1.00 . B B . 3 PRO CA 1 1 3 3144 2 2 3 PRO CB C -16.795 -3.869 2.388 1.00 . B B . 3 PRO CB 1 1 3 3145 2 2 3 PRO CD C -16.179 -4.582 4.579 1.00 . B B . 3 PRO CD 1 1 3 3146 2 2 3 PRO CG C -17.136 -3.702 3.826 1.00 . B B . 3 PRO CG 1 1 3 3147 2 2 3 PRO HA H -15.010 -4.758 1.585 1.00 . B B . 3 PRO HA 1 1 3 3148 2 2 3 PRO HB2 H -17.054 -2.992 1.813 1.00 . B B . 3 PRO HB2 1 1 3 3149 2 2 3 PRO HB3 H -17.279 -4.738 1.967 1.00 . B B . 3 PRO HB3 1 1 3 3150 2 2 3 PRO HD2 H -15.932 -4.142 5.533 1.00 . B B . 3 PRO HD2 1 1 3 3151 2 2 3 PRO HD3 H -16.598 -5.569 4.713 1.00 . B B . 3 PRO HD3 1 1 3 3152 2 2 3 PRO HG2 H -17.006 -2.670 4.118 1.00 . B B . 3 PRO HG2 1 1 3 3153 2 2 3 PRO HG3 H -18.154 -4.018 4.003 1.00 . B B . 3 PRO HG3 1 1 3 3154 2 2 3 PRO N N -14.996 -4.630 3.699 1.00 . B B . 3 PRO N 1 1 3 3155 2 2 3 PRO O O -15.140 -1.670 2.378 1.00 . B B . 3 PRO O 1 1 3 3156 2 2 4 GLY C C -11.074 -1.838 1.355 1.00 . B B . 4 GLY C 1 1 3 3157 2 2 4 GLY CA C -12.571 -1.590 1.409 1.00 . B B . 4 GLY CA 1 1 3 3158 2 2 4 GLY H H -12.923 -3.677 1.501 1.00 . B B . 4 GLY H 1 1 3 3159 2 2 4 GLY HA2 H -12.890 -1.181 0.462 1.00 . B B . 4 GLY HA2 1 1 3 3160 2 2 4 GLY HA3 H -12.779 -0.871 2.185 1.00 . B B . 4 GLY HA3 1 1 3 3161 2 2 4 GLY N N -13.329 -2.800 1.670 1.00 . B B . 4 GLY N 1 1 3 3162 2 2 4 GLY O O -10.323 -1.338 2.192 1.00 . B B . 4 GLY O 1 1 3 3163 2 2 5 THR C C -8.888 -3.208 -1.267 1.00 . B B . 5 THR C 1 1 3 3164 2 2 5 THR CA C -9.231 -2.930 0.196 1.00 . B B . 5 THR CA 1 1 3 3165 2 2 5 THR CB C -8.822 -4.145 1.048 1.00 . B B . 5 THR CB 1 1 3 3166 2 2 5 THR CG2 C -9.197 -5.951 1.713 1.00 . B B . 5 THR CG2 1 1 3 3167 2 2 5 THR H H -11.293 -2.963 -0.277 1.00 . B B . 5 THR H 1 1 3 3168 2 2 5 THR HA H -8.661 -2.076 0.528 1.00 . B B . 5 THR HA 1 1 3 3169 2 2 5 THR HB H -8.993 -3.909 2.089 1.00 . B B . 5 THR HB 1 1 3 3170 2 2 5 THR HG1 H -8.017 -3.444 0.835 1.00 . B B . 5 THR HG1 1 1 3 3171 2 2 5 THR HG21 H -9.450 -5.806 2.753 1.00 . B B . 5 THR HG21 1 1 3 3172 2 2 5 THR HG22 H -9.152 -7.008 1.498 1.00 . B B . 5 THR HG22 1 1 3 3173 2 2 5 THR HG23 H -9.949 -5.487 1.092 1.00 . B B . 5 THR HG23 1 1 3 3174 2 2 5 THR N N -10.645 -2.612 0.364 1.00 . B B . 5 THR N 1 1 3 3175 2 2 5 THR O O -9.772 -3.290 -2.119 1.00 . B B . 5 THR O 1 1 3 3176 2 2 5 THR OG1 O -7.910 -3.906 1.669 1.00 . B B . 5 THR OG1 1 1 3 3177 2 2 6 ALA C C -5.626 -3.964 -2.884 1.00 . B B . 6 ALA C 1 1 3 3178 2 2 6 ALA CA C -7.117 -3.630 -2.895 1.00 . B B . 6 ALA CA 1 1 3 3179 2 2 6 ALA CB C -7.397 -2.452 -3.815 1.00 . B B . 6 ALA CB 1 1 3 3180 2 2 6 ALA H H -6.940 -3.269 -0.820 1.00 . B B . 6 ALA H 1 1 3 3181 2 2 6 ALA HA H -7.662 -4.486 -3.269 1.00 . B B . 6 ALA HA 1 1 3 3182 2 2 6 ALA HB1 H -8.352 -2.015 -3.564 1.00 . B B . 6 ALA HB1 1 1 3 3183 2 2 6 ALA HB2 H -7.414 -2.791 -4.840 1.00 . B B . 6 ALA HB2 1 1 3 3184 2 2 6 ALA HB3 H -6.621 -1.712 -3.697 1.00 . B B . 6 ALA HB3 1 1 3 3185 2 2 6 ALA N N -7.593 -3.351 -1.545 1.00 . B B . 6 ALA N 1 1 3 3186 2 2 6 ALA O O -5.069 -4.314 -1.844 1.00 . B B . 6 ALA O 1 1 3 3187 2 2 7 ARG C C -2.864 -3.142 -5.077 1.00 . B B . 7 ARG C 1 1 3 3188 2 2 7 ARG CA C -3.556 -4.142 -4.157 1.00 . B B . 7 ARG CA 1 1 3 3189 2 2 7 ARG CB C -3.343 -5.561 -4.683 1.00 . B B . 7 ARG CB 1 1 3 3190 2 2 7 ARG CD C -3.590 -8.024 -4.287 1.00 . B B . 7 ARG CD 1 1 3 3191 2 2 7 ARG CG C -3.654 -6.641 -3.663 1.00 . B B . 7 ARG CG 1 1 3 3192 2 2 7 ARG CZ C -2.150 -9.270 -5.842 1.00 . B B . 7 ARG CZ 1 1 3 3193 2 2 7 ARG H H -5.478 -3.567 -4.840 1.00 . B B . 7 ARG H 1 1 3 3194 2 2 7 ARG HA H -3.124 -4.065 -3.171 1.00 . B B . 7 ARG HA 1 1 3 3195 2 2 7 ARG HB2 H -3.979 -5.714 -5.542 1.00 . B B . 7 ARG HB2 1 1 3 3196 2 2 7 ARG HB3 H -2.312 -5.668 -4.985 1.00 . B B . 7 ARG HB3 1 1 3 3197 2 2 7 ARG HD2 H -3.651 -8.761 -3.501 1.00 . B B . 7 ARG HD2 1 1 3 3198 2 2 7 ARG HD3 H -4.429 -8.141 -4.955 1.00 . B B . 7 ARG HD3 1 1 3 3199 2 2 7 ARG HE H -1.643 -7.566 -4.935 1.00 . B B . 7 ARG HE 1 1 3 3200 2 2 7 ARG HG2 H -2.934 -6.585 -2.860 1.00 . B B . 7 ARG HG2 1 1 3 3201 2 2 7 ARG HG3 H -4.647 -6.477 -3.271 1.00 . B B . 7 ARG HG3 1 1 3 3202 2 2 7 ARG HH11 H -3.961 -10.102 -5.506 1.00 . B B . 7 ARG HH11 1 1 3 3203 2 2 7 ARG HH12 H -2.938 -10.968 -6.604 1.00 . B B . 7 ARG HH12 1 1 3 3204 2 2 7 ARG HH21 H -0.290 -8.695 -6.384 1.00 . B B . 7 ARG HH21 1 1 3 3205 2 2 7 ARG HH22 H -0.850 -10.168 -7.100 1.00 . B B . 7 ARG HH22 1 1 3 3206 2 2 7 ARG N N -4.984 -3.852 -4.043 1.00 . B B . 7 ARG N 1 1 3 3207 2 2 7 ARG NE N -2.354 -8.234 -5.036 1.00 . B B . 7 ARG NE 1 1 3 3208 2 2 7 ARG NH1 N -3.093 -10.189 -5.996 1.00 . B B . 7 ARG NH1 1 1 3 3209 2 2 7 ARG NH2 N -1.003 -9.388 -6.496 1.00 . B B . 7 ARG NH2 1 1 3 3210 2 2 7 ARG O O -3.354 -2.842 -6.165 1.00 . B B . 7 ARG O 1 1 3 3211 2 2 8 ARG C C -0.156 -2.341 -6.517 1.00 . B B . 8 ARG C 1 1 3 3212 2 2 8 ARG CA C -0.960 -1.664 -5.411 1.00 . B B . 8 ARG CA 1 1 3 3213 2 2 8 ARG CB C -0.032 -0.873 -4.491 1.00 . B B . 8 ARG CB 1 1 3 3214 2 2 8 ARG CD C -0.150 -1.318 -2.022 1.00 . B B . 8 ARG CD 1 1 3 3215 2 2 8 ARG CG C -0.693 -0.498 -3.180 1.00 . B B . 8 ARG CG 1 1 3 3216 2 2 8 ARG CZ C -1.009 -2.022 0.174 1.00 . B B . 8 ARG CZ 1 1 3 3217 2 2 8 ARG H H -1.378 -2.906 -3.749 1.00 . B B . 8 ARG H 1 1 3 3218 2 2 8 ARG HA H -1.664 -0.982 -5.864 1.00 . B B . 8 ARG HA 1 1 3 3219 2 2 8 ARG HB2 H 0.842 -1.470 -4.276 1.00 . B B . 8 ARG HB2 1 1 3 3220 2 2 8 ARG HB3 H 0.271 0.035 -4.992 1.00 . B B . 8 ARG HB3 1 1 3 3221 2 2 8 ARG HD2 H -0.172 -2.362 -2.297 1.00 . B B . 8 ARG HD2 1 1 3 3222 2 2 8 ARG HD3 H 0.870 -1.018 -1.830 1.00 . B B . 8 ARG HD3 1 1 3 3223 2 2 8 ARG HE H -1.452 -0.299 -0.726 1.00 . B B . 8 ARG HE 1 1 3 3224 2 2 8 ARG HG2 H -0.527 0.548 -2.983 1.00 . B B . 8 ARG HG2 1 1 3 3225 2 2 8 ARG HG3 H -1.750 -0.680 -3.267 1.00 . B B . 8 ARG HG3 1 1 3 3226 2 2 8 ARG HH11 H 0.272 -3.331 -0.683 1.00 . B B . 8 ARG HH11 1 1 3 3227 2 2 8 ARG HH12 H -0.369 -3.816 0.850 1.00 . B B . 8 ARG HH12 1 1 3 3228 2 2 8 ARG HH21 H -2.303 -0.937 1.284 1.00 . B B . 8 ARG HH21 1 1 3 3229 2 2 8 ARG HH22 H -1.830 -2.456 1.969 1.00 . B B . 8 ARG HH22 1 1 3 3230 2 2 8 ARG N N -1.717 -2.632 -4.631 1.00 . B B . 8 ARG N 1 1 3 3231 2 2 8 ARG NE N -0.939 -1.130 -0.808 1.00 . B B . 8 ARG NE 1 1 3 3232 2 2 8 ARG NH1 N -0.311 -3.149 0.108 1.00 . B B . 8 ARG NH1 1 1 3 3233 2 2 8 ARG NH2 N -1.777 -1.786 1.229 1.00 . B B . 8 ARG NH2 1 1 3 3234 2 2 8 ARG O O 0.034 -1.772 -7.590 1.00 . B B . 8 ARG O 1 1 3 3235 2 2 9 LYS C C 1.046 -5.797 -6.972 1.00 . B B . 9 LYS C 1 1 3 3236 2 2 9 LYS CA C 1.097 -4.292 -7.240 1.00 . B B . 9 LYS CA 1 1 3 3237 2 2 9 LYS CB C 2.549 -3.803 -7.238 1.00 . B B . 9 LYS CB 1 1 3 3238 2 2 9 LYS CD C 4.160 -2.006 -7.938 1.00 . B B . 9 LYS CD 1 1 3 3239 2 2 9 LYS CE C 4.306 -0.590 -8.468 1.00 . B B . 9 LYS CE 1 1 3 3240 2 2 9 LYS CG C 2.703 -2.355 -7.675 1.00 . B B . 9 LYS CG 1 1 3 3241 2 2 9 LYS H H 0.147 -3.963 -5.379 1.00 . B B . 9 LYS H 1 1 3 3242 2 2 9 LYS HA H 0.661 -4.095 -8.209 1.00 . B B . 9 LYS HA 1 1 3 3243 2 2 9 LYS HB2 H 2.945 -3.900 -6.239 1.00 . B B . 9 LYS HB2 1 1 3 3244 2 2 9 LYS HB3 H 3.128 -4.421 -7.907 1.00 . B B . 9 LYS HB3 1 1 3 3245 2 2 9 LYS HD2 H 4.713 -2.092 -7.014 1.00 . B B . 9 LYS HD2 1 1 3 3246 2 2 9 LYS HD3 H 4.560 -2.698 -8.664 1.00 . B B . 9 LYS HD3 1 1 3 3247 2 2 9 LYS HE2 H 3.642 -0.464 -9.310 1.00 . B B . 9 LYS HE2 1 1 3 3248 2 2 9 LYS HE3 H 4.034 0.104 -7.688 1.00 . B B . 9 LYS HE3 1 1 3 3249 2 2 9 LYS HG2 H 2.137 -2.200 -8.581 1.00 . B B . 9 LYS HG2 1 1 3 3250 2 2 9 LYS HG3 H 2.322 -1.711 -6.895 1.00 . B B . 9 LYS HG3 1 1 3 3251 2 2 9 LYS HZ1 H 5.965 -0.933 -9.692 1.00 . B B . 9 LYS HZ1 1 1 3 3252 2 2 9 LYS HZ2 H 6.361 -0.454 -8.118 1.00 . B B . 9 LYS HZ2 1 1 3 3253 2 2 9 LYS HZ3 H 5.780 0.683 -9.227 1.00 . B B . 9 LYS HZ3 1 1 3 3254 2 2 9 LYS N N 0.319 -3.556 -6.253 1.00 . B B . 9 LYS N 1 1 3 3255 2 2 9 LYS NZ N 5.700 -0.304 -8.907 1.00 . B B . 9 LYS NZ 1 1 3 3256 2 2 9 LYS O O 0.289 -6.256 -6.116 1.00 . B B . 9 LYS O 1 1 3 3257 2 2 10 ARG C C 2.115 -8.401 -6.077 1.00 . B B . 10 ARG C 1 1 3 3258 2 2 10 ARG CA C 1.898 -8.011 -7.538 1.00 . B B . 10 ARG CA 1 1 3 3259 2 2 10 ARG CB C 3.017 -8.598 -8.395 1.00 . B B . 10 ARG CB 1 1 3 3260 2 2 10 ARG CD C 5.511 -8.797 -8.645 1.00 . B B . 10 ARG CD 1 1 3 3261 2 2 10 ARG CG C 4.363 -7.935 -8.148 1.00 . B B . 10 ARG CG 1 1 3 3262 2 2 10 ARG CZ C 7.969 -8.838 -8.526 1.00 . B B . 10 ARG CZ 1 1 3 3263 2 2 10 ARG H H 2.441 -6.146 -8.368 1.00 . B B . 10 ARG H 1 1 3 3264 2 2 10 ARG HA H 0.952 -8.413 -7.870 1.00 . B B . 10 ARG HA 1 1 3 3265 2 2 10 ARG HB2 H 3.111 -9.652 -8.177 1.00 . B B . 10 ARG HB2 1 1 3 3266 2 2 10 ARG HB3 H 2.763 -8.474 -9.437 1.00 . B B . 10 ARG HB3 1 1 3 3267 2 2 10 ARG HD2 H 5.431 -9.776 -8.197 1.00 . B B . 10 ARG HD2 1 1 3 3268 2 2 10 ARG HD3 H 5.439 -8.887 -9.719 1.00 . B B . 10 ARG HD3 1 1 3 3269 2 2 10 ARG HE H 6.819 -7.340 -7.882 1.00 . B B . 10 ARG HE 1 1 3 3270 2 2 10 ARG HG2 H 4.386 -6.990 -8.669 1.00 . B B . 10 ARG HG2 1 1 3 3271 2 2 10 ARG HG3 H 4.478 -7.765 -7.087 1.00 . B B . 10 ARG HG3 1 1 3 3272 2 2 10 ARG HH11 H 7.135 -10.478 -9.361 1.00 . B B . 10 ARG HH11 1 1 3 3273 2 2 10 ARG HH12 H 8.865 -10.492 -9.265 1.00 . B B . 10 ARG HH12 1 1 3 3274 2 2 10 ARG HH21 H 9.098 -7.352 -7.749 1.00 . B B . 10 ARG HH21 1 1 3 3275 2 2 10 ARG HH22 H 9.979 -8.719 -8.348 1.00 . B B . 10 ARG HH22 1 1 3 3276 2 2 10 ARG N N 1.856 -6.563 -7.702 1.00 . B B . 10 ARG N 1 1 3 3277 2 2 10 ARG NE N 6.811 -8.225 -8.302 1.00 . B B . 10 ARG NE 1 1 3 3278 2 2 10 ARG NH1 N 7.991 -10.035 -9.097 1.00 . B B . 10 ARG NH1 1 1 3 3279 2 2 10 ARG NH2 N 9.109 -8.255 -8.180 1.00 . B B . 10 ARG NH2 1 1 3 3280 2 2 10 ARG O O 1.768 -9.507 -5.663 1.00 . B B . 10 ARG O 1 1 3 3281 2 2 11 LYS C C 4.261 -8.524 -3.729 1.00 . B B . 11 LYS C 1 1 3 3282 2 2 11 LYS CA C 2.972 -7.723 -3.883 1.00 . B B . 11 LYS CA 1 1 3 3283 2 2 11 LYS CB C 1.808 -8.454 -3.202 1.00 . B B . 11 LYS CB 1 1 3 3284 2 2 11 LYS CD C 0.398 -6.381 -3.425 1.00 . B B . 11 LYS CD 1 1 3 3285 2 2 11 LYS CE C 0.602 -5.937 -1.985 1.00 . B B . 11 LYS CE 1 1 3 3286 2 2 11 LYS CG C 0.439 -7.895 -3.559 1.00 . B B . 11 LYS CG 1 1 3 3287 2 2 11 LYS H H 2.936 -6.617 -5.689 1.00 . B B . 11 LYS H 1 1 3 3288 2 2 11 LYS HA H 3.106 -6.761 -3.410 1.00 . B B . 11 LYS HA 1 1 3 3289 2 2 11 LYS HB2 H 1.834 -9.494 -3.487 1.00 . B B . 11 LYS HB2 1 1 3 3290 2 2 11 LYS HB3 H 1.932 -8.383 -2.132 1.00 . B B . 11 LYS HB3 1 1 3 3291 2 2 11 LYS HD2 H 1.180 -5.954 -4.034 1.00 . B B . 11 LYS HD2 1 1 3 3292 2 2 11 LYS HD3 H -0.563 -6.026 -3.768 1.00 . B B . 11 LYS HD3 1 1 3 3293 2 2 11 LYS HE2 H 1.542 -6.331 -1.631 1.00 . B B . 11 LYS HE2 1 1 3 3294 2 2 11 LYS HE3 H 0.631 -4.858 -1.957 1.00 . B B . 11 LYS HE3 1 1 3 3295 2 2 11 LYS HG2 H 0.208 -8.161 -4.580 1.00 . B B . 11 LYS HG2 1 1 3 3296 2 2 11 LYS HG3 H -0.297 -8.326 -2.898 1.00 . B B . 11 LYS HG3 1 1 3 3297 2 2 11 LYS HZ1 H -0.548 -7.453 -1.120 1.00 . B B . 11 LYS HZ1 1 1 3 3298 2 2 11 LYS HZ2 H -1.402 -6.019 -1.398 1.00 . B B . 11 LYS HZ2 1 1 3 3299 2 2 11 LYS HZ3 H -0.307 -6.116 -0.112 1.00 . B B . 11 LYS HZ3 1 1 3 3300 2 2 11 LYS N N 2.689 -7.482 -5.299 1.00 . B B . 11 LYS N 1 1 3 3301 2 2 11 LYS NZ N -0.490 -6.415 -1.091 1.00 . B B . 11 LYS NZ 1 1 3 3302 2 2 11 LYS O O 4.243 -9.755 -3.697 1.00 . B B . 11 LYS O 1 1 3 3303 2 2 12 ALA C C 6.797 -9.305 -2.246 1.00 . B B . 12 ALA C 1 1 3 3304 2 2 12 ALA CA C 6.691 -8.438 -3.499 1.00 . B B . 12 ALA CA 1 1 3 3305 2 2 12 ALA CB C 7.777 -7.374 -3.487 1.00 . B B . 12 ALA CB 1 1 3 3306 2 2 12 ALA H H 5.322 -6.833 -3.652 1.00 . B B . 12 ALA H 1 1 3 3307 2 2 12 ALA HA H 6.850 -9.062 -4.367 1.00 . B B . 12 ALA HA 1 1 3 3308 2 2 12 ALA HB1 H 7.628 -6.696 -4.314 1.00 . B B . 12 ALA HB1 1 1 3 3309 2 2 12 ALA HB2 H 8.744 -7.844 -3.575 1.00 . B B . 12 ALA HB2 1 1 3 3310 2 2 12 ALA HB3 H 7.729 -6.824 -2.558 1.00 . B B . 12 ALA HB3 1 1 3 3311 2 2 12 ALA N N 5.380 -7.812 -3.633 1.00 . B B . 12 ALA N 1 1 3 3312 2 2 12 ALA O O 7.717 -10.115 -2.125 1.00 . B B . 12 ALA O 1 1 3 3313 2 2 13 ASP C C 4.756 -10.934 -0.043 1.00 . B B . 13 ASP C 1 1 3 3314 2 2 13 ASP CA C 5.888 -9.911 -0.080 1.00 . B B . 13 ASP CA 1 1 3 3315 2 2 13 ASP CB C 5.795 -8.983 1.133 1.00 . B B . 13 ASP CB 1 1 3 3316 2 2 13 ASP CG C 4.461 -8.270 1.222 1.00 . B B . 13 ASP CG 1 1 3 3317 2 2 13 ASP H H 5.149 -8.484 -1.462 1.00 . B B . 13 ASP H 1 1 3 3318 2 2 13 ASP HA H 6.829 -10.439 -0.042 1.00 . B B . 13 ASP HA 1 1 3 3319 2 2 13 ASP HB2 H 5.931 -9.563 2.033 1.00 . B B . 13 ASP HB2 1 1 3 3320 2 2 13 ASP HB3 H 6.576 -8.239 1.069 1.00 . B B . 13 ASP HB3 1 1 3 3321 2 2 13 ASP N N 5.864 -9.138 -1.316 1.00 . B B . 13 ASP N 1 1 3 3322 2 2 13 ASP O O 4.850 -11.948 0.648 1.00 . B B . 13 ASP O 1 1 3 3323 2 2 13 ASP OD1 O 4.331 -7.176 0.631 1.00 . B B . 13 ASP OD1 1 1 3 3324 2 2 13 ASP OD2 O 3.546 -8.803 1.885 1.00 . B B . 13 ASP OD2 1 1 3 3325 2 2 14 SER C C 2.112 -11.988 0.569 1.00 . B B . 14 SER C 1 1 3 3326 2 2 14 SER CA C 2.544 -11.569 -0.835 1.00 . B B . 14 SER CA 1 1 3 3327 2 2 14 SER CB C 2.886 -12.808 -1.664 1.00 . B B . 14 SER CB 1 1 3 3328 2 2 14 SER H H 3.667 -9.837 -1.311 1.00 . B B . 14 SER H 1 1 3 3329 2 2 14 SER HA H 1.726 -11.045 -1.308 1.00 . B B . 14 SER HA 1 1 3 3330 2 2 14 SER HB2 H 3.129 -12.508 -2.673 1.00 . B B . 14 SER HB2 1 1 3 3331 2 2 14 SER HB3 H 3.736 -13.309 -1.224 1.00 . B B . 14 SER HB3 1 1 3 3332 2 2 14 SER HG H 1.575 -13.902 -2.623 1.00 . B B . 14 SER HG 1 1 3 3333 2 2 14 SER N N 3.687 -10.663 -0.785 1.00 . B B . 14 SER N 1 1 3 3334 2 2 14 SER O O 1.267 -11.286 1.163 1.00 . B B . 14 SER O 1 1 3 3335 2 2 14 SER OXT O 2.625 -13.015 1.062 1.00 . B B . 14 SER OXT 1 1 3 3336 2 2 14 SER OG O 1.795 -13.711 -1.708 1.00 . B B . 14 SER OG 1 1 4 3337 1 1 1 GLY C C 10.748 3.983 -6.582 1.00 . A A . 1 GLY C 1 1 4 3338 1 1 1 GLY CA C 10.216 2.648 -7.071 1.00 . A A . 1 GLY CA 1 1 4 3339 1 1 1 GLY H1 H 8.219 3.263 -7.136 1.00 . A A . 1 GLY H1 1 1 4 3340 1 1 1 GLY H2 H 8.624 2.402 -5.737 1.00 . A A . 1 GLY H2 1 1 4 3341 1 1 1 GLY H3 H 8.422 1.585 -7.204 1.00 . A A . 1 GLY H3 1 1 4 3342 1 1 1 GLY HA2 H 10.777 1.854 -6.601 1.00 . A A . 1 GLY HA2 1 1 4 3343 1 1 1 GLY HA3 H 10.356 2.588 -8.140 1.00 . A A . 1 GLY HA3 1 1 4 3344 1 1 1 GLY N N 8.770 2.462 -6.764 1.00 . A A . 1 GLY N 1 1 4 3345 1 1 1 GLY O O 11.621 4.576 -7.216 1.00 . A A . 1 GLY O 1 1 4 3346 1 1 2 SER C C 9.807 6.096 -3.668 1.00 . A A . 2 SER C 1 1 4 3347 1 1 2 SER CA C 10.656 5.728 -4.878 1.00 . A A . 2 SER CA 1 1 4 3348 1 1 2 SER CB C 10.578 6.832 -5.929 1.00 . A A . 2 SER CB 1 1 4 3349 1 1 2 SER H H 9.541 3.928 -4.985 1.00 . A A . 2 SER H 1 1 4 3350 1 1 2 SER HA H 11.681 5.622 -4.556 1.00 . A A . 2 SER HA 1 1 4 3351 1 1 2 SER HB2 H 11.333 6.661 -6.680 1.00 . A A . 2 SER HB2 1 1 4 3352 1 1 2 SER HB3 H 9.602 6.818 -6.388 1.00 . A A . 2 SER HB3 1 1 4 3353 1 1 2 SER HG H 11.224 8.680 -5.989 1.00 . A A . 2 SER HG 1 1 4 3354 1 1 2 SER N N 10.228 4.452 -5.450 1.00 . A A . 2 SER N 1 1 4 3355 1 1 2 SER O O 10.295 6.717 -2.723 1.00 . A A . 2 SER O 1 1 4 3356 1 1 2 SER OG O 10.795 8.107 -5.350 1.00 . A A . 2 SER OG 1 1 4 3357 1 1 3 GLN C C 7.682 4.869 -1.582 1.00 . A A . 3 GLN C 1 1 4 3358 1 1 3 GLN CA C 7.633 5.995 -2.600 1.00 . A A . 3 GLN CA 1 1 4 3359 1 1 3 GLN CB C 6.209 6.177 -3.113 1.00 . A A . 3 GLN CB 1 1 4 3360 1 1 3 GLN CD C 6.887 7.346 -5.245 1.00 . A A . 3 GLN CD 1 1 4 3361 1 1 3 GLN CG C 6.030 7.399 -3.997 1.00 . A A . 3 GLN CG 1 1 4 3362 1 1 3 GLN H H 8.202 5.230 -4.482 1.00 . A A . 3 GLN H 1 1 4 3363 1 1 3 GLN HA H 7.951 6.904 -2.133 1.00 . A A . 3 GLN HA 1 1 4 3364 1 1 3 GLN HB2 H 5.943 5.308 -3.682 1.00 . A A . 3 GLN HB2 1 1 4 3365 1 1 3 GLN HB3 H 5.542 6.265 -2.269 1.00 . A A . 3 GLN HB3 1 1 4 3366 1 1 3 GLN HE21 H 7.025 9.330 -5.266 1.00 . A A . 3 GLN HE21 1 1 4 3367 1 1 3 GLN HE22 H 7.853 8.507 -6.539 1.00 . A A . 3 GLN HE22 1 1 4 3368 1 1 3 GLN HG2 H 4.993 7.465 -4.294 1.00 . A A . 3 GLN HG2 1 1 4 3369 1 1 3 GLN HG3 H 6.297 8.280 -3.431 1.00 . A A . 3 GLN HG3 1 1 4 3370 1 1 3 GLN N N 8.538 5.712 -3.700 1.00 . A A . 3 GLN N 1 1 4 3371 1 1 3 GLN NE2 N 7.296 8.512 -5.733 1.00 . A A . 3 GLN NE2 1 1 4 3372 1 1 3 GLN O O 7.736 3.695 -1.945 1.00 . A A . 3 GLN O 1 1 4 3373 1 1 3 GLN OE1 O 7.181 6.270 -5.766 1.00 . A A . 3 GLN OE1 1 1 4 3374 1 1 4 VAL C C 6.314 3.798 1.137 1.00 . A A . 4 VAL C 1 1 4 3375 1 1 4 VAL CA C 7.717 4.238 0.756 1.00 . A A . 4 VAL CA 1 1 4 3376 1 1 4 VAL CB C 8.443 4.765 2.013 1.00 . A A . 4 VAL CB 1 1 4 3377 1 1 4 VAL CG1 C 9.069 3.614 2.786 1.00 . A A . 4 VAL CG1 1 1 4 3378 1 1 4 VAL CG2 C 9.498 5.801 1.647 1.00 . A A . 4 VAL CG2 1 1 4 3379 1 1 4 VAL H H 7.604 6.175 -0.074 1.00 . A A . 4 VAL H 1 1 4 3380 1 1 4 VAL HA H 8.259 3.381 0.385 1.00 . A A . 4 VAL HA 1 1 4 3381 1 1 4 VAL HB H 7.712 5.238 2.652 1.00 . A A . 4 VAL HB 1 1 4 3382 1 1 4 VAL HG11 H 9.868 3.183 2.203 1.00 . A A . 4 VAL HG11 1 1 4 3383 1 1 4 VAL HG12 H 8.321 2.861 2.978 1.00 . A A . 4 VAL HG12 1 1 4 3384 1 1 4 VAL HG13 H 9.461 3.980 3.724 1.00 . A A . 4 VAL HG13 1 1 4 3385 1 1 4 VAL HG21 H 10.119 5.416 0.853 1.00 . A A . 4 VAL HG21 1 1 4 3386 1 1 4 VAL HG22 H 10.109 6.014 2.513 1.00 . A A . 4 VAL HG22 1 1 4 3387 1 1 4 VAL HG23 H 9.013 6.708 1.318 1.00 . A A . 4 VAL HG23 1 1 4 3388 1 1 4 VAL N N 7.664 5.228 -0.306 1.00 . A A . 4 VAL N 1 1 4 3389 1 1 4 VAL O O 5.950 3.790 2.313 1.00 . A A . 4 VAL O 1 1 4 3390 1 1 5 PHE C C 3.480 2.616 -0.966 1.00 . A A . 5 PHE C 1 1 4 3391 1 1 5 PHE CA C 4.164 2.986 0.354 1.00 . A A . 5 PHE CA 1 1 4 3392 1 1 5 PHE CB C 3.373 4.070 1.083 1.00 . A A . 5 PHE CB 1 1 4 3393 1 1 5 PHE CD1 C 4.664 6.200 -0.042 1.00 . A A . 5 PHE CD1 1 1 4 3394 1 1 5 PHE CD2 C 4.009 4.981 1.901 1.00 . A A . 5 PHE CD2 1 1 4 3395 1 1 5 PHE CE1 C 5.901 6.446 0.524 1.00 . A A . 5 PHE CE1 1 1 4 3396 1 1 5 PHE CE2 C 5.245 5.223 2.472 1.00 . A A . 5 PHE CE2 1 1 4 3397 1 1 5 PHE CG C 3.706 5.467 0.639 1.00 . A A . 5 PHE CG 1 1 4 3398 1 1 5 PHE CZ C 4.321 8.051 -0.175 1.00 . A A . 5 PHE CZ 1 1 4 3399 1 1 5 PHE H H 5.874 3.471 -0.785 1.00 . A A . 5 PHE H 1 1 4 3400 1 1 5 PHE HA H 4.213 2.101 0.988 1.00 . A A . 5 PHE HA 1 1 4 3401 1 1 5 PHE HB2 H 2.321 3.913 0.913 1.00 . A A . 5 PHE HB2 1 1 4 3402 1 1 5 PHE HB3 H 3.578 4.000 2.140 1.00 . A A . 5 PHE HB3 1 1 4 3403 1 1 5 PHE HD1 H 4.438 6.583 -1.026 1.00 . A A . 5 PHE HD1 1 1 4 3404 1 1 5 PHE HD2 H 3.270 4.409 2.441 1.00 . A A . 5 PHE HD2 1 1 4 3405 1 1 5 PHE HE1 H 6.639 7.019 -0.016 1.00 . A A . 5 PHE HE1 1 1 4 3406 1 1 5 PHE HE2 H 5.470 4.840 3.456 1.00 . A A . 5 PHE HE2 1 1 4 3407 1 1 5 PHE HZ H 4.560 9.056 -0.491 1.00 . A A . 5 PHE HZ 1 1 4 3408 1 1 5 PHE N N 5.527 3.437 0.130 1.00 . A A . 5 PHE N 1 1 4 3409 1 1 5 PHE O O 4.059 2.753 -2.043 1.00 . A A . 5 PHE O 1 1 4 3410 1 1 6 GLU C C -0.034 1.847 -1.694 1.00 . A A . 6 GLU C 1 1 4 3411 1 1 6 GLU CA C 1.455 1.718 -2.011 1.00 . A A . 6 GLU CA 1 1 4 3412 1 1 6 GLU CB C 1.797 0.270 -2.377 1.00 . A A . 6 GLU CB 1 1 4 3413 1 1 6 GLU CD C 0.933 0.381 -4.749 1.00 . A A . 6 GLU CD 1 1 4 3414 1 1 6 GLU CG C 0.865 -0.336 -3.415 1.00 . A A . 6 GLU CG 1 1 4 3415 1 1 6 GLU H H 1.824 2.131 0.014 1.00 . A A . 6 GLU H 1 1 4 3416 1 1 6 GLU HA H 1.696 2.364 -2.842 1.00 . A A . 6 GLU HA 1 1 4 3417 1 1 6 GLU HB2 H 2.803 0.242 -2.771 1.00 . A A . 6 GLU HB2 1 1 4 3418 1 1 6 GLU HB3 H 1.754 -0.339 -1.483 1.00 . A A . 6 GLU HB3 1 1 4 3419 1 1 6 GLU HG2 H 1.138 -1.369 -3.565 1.00 . A A . 6 GLU HG2 1 1 4 3420 1 1 6 GLU HG3 H -0.149 -0.282 -3.045 1.00 . A A . 6 GLU HG3 1 1 4 3421 1 1 6 GLU N N 2.242 2.144 -0.860 1.00 . A A . 6 GLU N 1 1 4 3422 1 1 6 GLU O O -0.511 1.272 -0.716 1.00 . A A . 6 GLU O 1 1 4 3423 1 1 6 GLU OE1 O 0.243 1.409 -4.906 1.00 . A A . 6 GLU OE1 1 1 4 3424 1 1 6 GLU OE2 O 1.678 -0.086 -5.636 1.00 . A A . 6 GLU OE2 1 1 4 3425 1 1 7 TYR C C -3.025 1.692 -2.957 1.00 . A A . 7 TYR C 1 1 4 3426 1 1 7 TYR CA C -2.193 2.775 -2.286 1.00 . A A . 7 TYR CA 1 1 4 3427 1 1 7 TYR CB C -2.618 4.153 -2.792 1.00 . A A . 7 TYR CB 1 1 4 3428 1 1 7 TYR CD1 C -1.241 4.656 -4.847 1.00 . A A . 7 TYR CD1 1 1 4 3429 1 1 7 TYR CD2 C -3.557 4.170 -5.137 1.00 . A A . 7 TYR CD2 1 1 4 3430 1 1 7 TYR CE1 C -1.101 4.819 -6.212 1.00 . A A . 7 TYR CE1 1 1 4 3431 1 1 7 TYR CE2 C -3.424 4.330 -6.502 1.00 . A A . 7 TYR CE2 1 1 4 3432 1 1 7 TYR CG C -2.469 4.328 -4.286 1.00 . A A . 7 TYR CG 1 1 4 3433 1 1 7 TYR CZ C -2.194 4.654 -7.035 1.00 . A A . 7 TYR CZ 1 1 4 3434 1 1 7 TYR H H -0.359 3.018 -3.285 1.00 . A A . 7 TYR H 1 1 4 3435 1 1 7 TYR HA H -2.366 2.727 -1.227 1.00 . A A . 7 TYR HA 1 1 4 3436 1 1 7 TYR HB2 H -3.652 4.312 -2.543 1.00 . A A . 7 TYR HB2 1 1 4 3437 1 1 7 TYR HB3 H -2.016 4.907 -2.307 1.00 . A A . 7 TYR HB3 1 1 4 3438 1 1 7 TYR HD1 H -0.385 4.782 -4.201 1.00 . A A . 7 TYR HD1 1 1 4 3439 1 1 7 TYR HD2 H -4.518 3.916 -4.717 1.00 . A A . 7 TYR HD2 1 1 4 3440 1 1 7 TYR HE1 H -0.137 5.072 -6.629 1.00 . A A . 7 TYR HE1 1 1 4 3441 1 1 7 TYR HE2 H -4.281 4.202 -7.147 1.00 . A A . 7 TYR HE2 1 1 4 3442 1 1 7 TYR HH H -1.244 4.398 -8.687 1.00 . A A . 7 TYR HH 1 1 4 3443 1 1 7 TYR N N -0.772 2.584 -2.516 1.00 . A A . 7 TYR N 1 1 4 3444 1 1 7 TYR O O -3.200 1.699 -4.175 1.00 . A A . 7 TYR O 1 1 4 3445 1 1 7 TYR OH O -2.057 4.817 -8.394 1.00 . A A . 7 TYR OH 1 1 4 3446 1 1 8 ALA C C -5.828 0.128 -2.691 1.00 . A A . 8 ALA C 1 1 4 3447 1 1 8 ALA CA C -4.372 -0.312 -2.690 1.00 . A A . 8 ALA CA 1 1 4 3448 1 1 8 ALA CB C -4.204 -1.583 -1.874 1.00 . A A . 8 ALA CB 1 1 4 3449 1 1 8 ALA H H -3.354 0.793 -1.183 1.00 . A A . 8 ALA H 1 1 4 3450 1 1 8 ALA HA H -4.060 -0.511 -3.701 1.00 . A A . 8 ALA HA 1 1 4 3451 1 1 8 ALA HB1 H -4.917 -1.586 -1.064 1.00 . A A . 8 ALA HB1 1 1 4 3452 1 1 8 ALA HB2 H -3.202 -1.627 -1.472 1.00 . A A . 8 ALA HB2 1 1 4 3453 1 1 8 ALA HB3 H -4.375 -2.443 -2.506 1.00 . A A . 8 ALA HB3 1 1 4 3454 1 1 8 ALA N N -3.539 0.759 -2.156 1.00 . A A . 8 ALA N 1 1 4 3455 1 1 8 ALA O O -6.689 -0.542 -2.128 1.00 . A A . 8 ALA O 1 1 4 3456 1 1 9 GLU C C -8.039 1.800 -4.768 1.00 . A A . 9 GLU C 1 1 4 3457 1 1 9 GLU CA C -7.419 1.839 -3.390 1.00 . A A . 9 GLU CA 1 1 4 3458 1 1 9 GLU CB C -7.301 3.267 -2.851 1.00 . A A . 9 GLU CB 1 1 4 3459 1 1 9 GLU CD C -7.370 4.602 -5.010 1.00 . A A . 9 GLU CD 1 1 4 3460 1 1 9 GLU CG C -7.992 4.366 -3.645 1.00 . A A . 9 GLU CG 1 1 4 3461 1 1 9 GLU H H -5.369 1.714 -3.814 1.00 . A A . 9 GLU H 1 1 4 3462 1 1 9 GLU HA H -8.055 1.279 -2.737 1.00 . A A . 9 GLU HA 1 1 4 3463 1 1 9 GLU HB2 H -7.710 3.286 -1.858 1.00 . A A . 9 GLU HB2 1 1 4 3464 1 1 9 GLU HB3 H -6.251 3.515 -2.792 1.00 . A A . 9 GLU HB3 1 1 4 3465 1 1 9 GLU HG2 H -9.021 4.092 -3.774 1.00 . A A . 9 GLU HG2 1 1 4 3466 1 1 9 GLU HG3 H -7.932 5.278 -3.081 1.00 . A A . 9 GLU HG3 1 1 4 3467 1 1 9 GLU N N -6.091 1.254 -3.348 1.00 . A A . 9 GLU N 1 1 4 3468 1 1 9 GLU O O -7.354 1.847 -5.789 1.00 . A A . 9 GLU O 1 1 4 3469 1 1 9 GLU OE1 O -6.279 5.208 -5.068 1.00 . A A . 9 GLU OE1 1 1 4 3470 1 1 9 GLU OE2 O -7.974 4.183 -6.019 1.00 . A A . 9 GLU OE2 1 1 4 3471 1 1 10 VAL C C -10.497 3.080 -6.416 1.00 . A A . 10 VAL C 1 1 4 3472 1 1 10 VAL CA C -10.106 1.674 -5.990 1.00 . A A . 10 VAL CA 1 1 4 3473 1 1 10 VAL CB C -11.347 0.794 -5.864 1.00 . A A . 10 VAL CB 1 1 4 3474 1 1 10 VAL CG1 C -11.999 0.588 -7.223 1.00 . A A . 10 VAL CG1 1 1 4 3475 1 1 10 VAL CG2 C -10.991 -0.537 -5.216 1.00 . A A . 10 VAL CG2 1 1 4 3476 1 1 10 VAL H H -9.829 1.645 -3.913 1.00 . A A . 10 VAL H 1 1 4 3477 1 1 10 VAL HA H -9.481 1.258 -6.726 1.00 . A A . 10 VAL HA 1 1 4 3478 1 1 10 VAL HB H -12.038 1.297 -5.232 1.00 . A A . 10 VAL HB 1 1 4 3479 1 1 10 VAL HG11 H -11.699 1.384 -7.889 1.00 . A A . 10 VAL HG11 1 1 4 3480 1 1 10 VAL HG12 H -13.072 0.599 -7.115 1.00 . A A . 10 VAL HG12 1 1 4 3481 1 1 10 VAL HG13 H -11.687 -0.361 -7.634 1.00 . A A . 10 VAL HG13 1 1 4 3482 1 1 10 VAL HG21 H -11.876 -1.146 -5.123 1.00 . A A . 10 VAL HG21 1 1 4 3483 1 1 10 VAL HG22 H -10.572 -0.358 -4.234 1.00 . A A . 10 VAL HG22 1 1 4 3484 1 1 10 VAL HG23 H -10.265 -1.051 -5.827 1.00 . A A . 10 VAL HG23 1 1 4 3485 1 1 10 VAL N N -9.356 1.706 -4.767 1.00 . A A . 10 VAL N 1 1 4 3486 1 1 10 VAL O O -10.592 3.379 -7.605 1.00 . A A . 10 VAL O 1 1 4 3487 1 1 11 ASP C C -10.365 6.288 -4.751 1.00 . A A . 11 ASP C 1 1 4 3488 1 1 11 ASP CA C -11.083 5.324 -5.696 1.00 . A A . 11 ASP CA 1 1 4 3489 1 1 11 ASP CB C -12.593 5.522 -5.555 1.00 . A A . 11 ASP CB 1 1 4 3490 1 1 11 ASP CG C -13.037 6.909 -5.976 1.00 . A A . 11 ASP CG 1 1 4 3491 1 1 11 ASP H H -10.682 3.624 -4.506 1.00 . A A . 11 ASP H 1 1 4 3492 1 1 11 ASP HA H -10.796 5.553 -6.711 1.00 . A A . 11 ASP HA 1 1 4 3493 1 1 11 ASP HB2 H -13.107 4.799 -6.166 1.00 . A A . 11 ASP HB2 1 1 4 3494 1 1 11 ASP HB3 H -12.871 5.376 -4.522 1.00 . A A . 11 ASP HB3 1 1 4 3495 1 1 11 ASP N N -10.725 3.939 -5.430 1.00 . A A . 11 ASP N 1 1 4 3496 1 1 11 ASP O O -9.869 7.330 -5.181 1.00 . A A . 11 ASP O 1 1 4 3497 1 1 11 ASP OD1 O -13.217 7.131 -7.192 1.00 . A A . 11 ASP OD1 1 1 4 3498 1 1 11 ASP OD2 O -13.201 7.775 -5.091 1.00 . A A . 11 ASP OD2 1 1 4 3499 1 1 12 GLU C C -9.183 6.073 -1.243 1.00 . A A . 12 GLU C 1 1 4 3500 1 1 12 GLU CA C -9.695 6.825 -2.470 1.00 . A A . 12 GLU CA 1 1 4 3501 1 1 12 GLU CB C -10.702 7.891 -2.034 1.00 . A A . 12 GLU CB 1 1 4 3502 1 1 12 GLU CD C -9.742 9.779 -3.411 1.00 . A A . 12 GLU CD 1 1 4 3503 1 1 12 GLU CG C -10.970 8.951 -3.089 1.00 . A A . 12 GLU CG 1 1 4 3504 1 1 12 GLU H H -10.599 5.033 -3.205 1.00 . A A . 12 GLU H 1 1 4 3505 1 1 12 GLU HA H -8.853 7.313 -2.940 1.00 . A A . 12 GLU HA 1 1 4 3506 1 1 12 GLU HB2 H -11.637 7.408 -1.794 1.00 . A A . 12 GLU HB2 1 1 4 3507 1 1 12 GLU HB3 H -10.325 8.380 -1.150 1.00 . A A . 12 GLU HB3 1 1 4 3508 1 1 12 GLU HG2 H -11.305 8.464 -3.993 1.00 . A A . 12 GLU HG2 1 1 4 3509 1 1 12 GLU HG3 H -11.746 9.610 -2.729 1.00 . A A . 12 GLU HG3 1 1 4 3510 1 1 12 GLU N N -10.307 5.937 -3.468 1.00 . A A . 12 GLU N 1 1 4 3511 1 1 12 GLU O O -9.650 4.988 -0.933 1.00 . A A . 12 GLU O 1 1 4 3512 1 1 12 GLU OE1 O -9.429 10.706 -2.636 1.00 . A A . 12 GLU OE1 1 1 4 3513 1 1 12 GLU OE2 O -9.089 9.497 -4.439 1.00 . A A . 12 GLU OE2 1 1 4 3514 1 1 13 ILE C C -7.761 7.101 1.824 1.00 . A A . 13 ILE C 1 1 4 3515 1 1 13 ILE CA C -7.659 6.098 0.669 1.00 . A A . 13 ILE CA 1 1 4 3516 1 1 13 ILE CB C -6.170 5.714 0.454 1.00 . A A . 13 ILE CB 1 1 4 3517 1 1 13 ILE CD1 C -5.536 7.690 -1.017 1.00 . A A . 13 ILE CD1 1 1 4 3518 1 1 13 ILE CG1 C -5.301 6.966 0.293 1.00 . A A . 13 ILE CG1 1 1 4 3519 1 1 13 ILE CG2 C -6.047 4.857 -0.785 1.00 . A A . 13 ILE CG2 1 1 4 3520 1 1 13 ILE H H -7.935 7.572 -0.826 1.00 . A A . 13 ILE H 1 1 4 3521 1 1 13 ILE HA H -8.225 5.197 0.904 1.00 . A A . 13 ILE HA 1 1 4 3522 1 1 13 ILE HB H -5.818 5.132 1.306 1.00 . A A . 13 ILE HB 1 1 4 3523 1 1 13 ILE HD11 H -4.599 7.799 -1.541 1.00 . A A . 13 ILE HD11 1 1 4 3524 1 1 13 ILE HD12 H -5.958 8.663 -0.821 1.00 . A A . 13 ILE HD12 1 1 4 3525 1 1 13 ILE HD13 H -6.224 7.114 -1.626 1.00 . A A . 13 ILE HD13 1 1 4 3526 1 1 13 ILE HG12 H -5.514 7.655 1.097 1.00 . A A . 13 ILE HG12 1 1 4 3527 1 1 13 ILE HG13 H -4.259 6.682 0.334 1.00 . A A . 13 ILE HG13 1 1 4 3528 1 1 13 ILE HG21 H -6.048 3.815 -0.515 1.00 . A A . 13 ILE HG21 1 1 4 3529 1 1 13 ILE HG22 H -5.126 5.096 -1.296 1.00 . A A . 13 ILE HG22 1 1 4 3530 1 1 13 ILE HG23 H -6.881 5.069 -1.431 1.00 . A A . 13 ILE HG23 1 1 4 3531 1 1 13 ILE N N -8.239 6.688 -0.537 1.00 . A A . 13 ILE N 1 1 4 3532 1 1 13 ILE O O -8.489 8.088 1.727 1.00 . A A . 13 ILE O 1 1 4 3533 1 1 14 VAL C C -5.717 7.733 4.792 1.00 . A A . 14 VAL C 1 1 4 3534 1 1 14 VAL CA C -7.044 7.766 4.051 1.00 . A A . 14 VAL CA 1 1 4 3535 1 1 14 VAL CB C -8.187 7.465 5.038 1.00 . A A . 14 VAL CB 1 1 4 3536 1 1 14 VAL CG1 C -9.536 7.720 4.389 1.00 . A A . 14 VAL CG1 1 1 4 3537 1 1 14 VAL CG2 C -8.096 6.055 5.585 1.00 . A A . 14 VAL CG2 1 1 4 3538 1 1 14 VAL H H -6.485 6.042 2.947 1.00 . A A . 14 VAL H 1 1 4 3539 1 1 14 VAL HA H -7.193 8.763 3.665 1.00 . A A . 14 VAL HA 1 1 4 3540 1 1 14 VAL HB H -8.088 8.131 5.861 1.00 . A A . 14 VAL HB 1 1 4 3541 1 1 14 VAL HG11 H -9.646 7.086 3.522 1.00 . A A . 14 VAL HG11 1 1 4 3542 1 1 14 VAL HG12 H -9.600 8.756 4.087 1.00 . A A . 14 VAL HG12 1 1 4 3543 1 1 14 VAL HG13 H -10.322 7.504 5.098 1.00 . A A . 14 VAL HG13 1 1 4 3544 1 1 14 VAL HG21 H -9.084 5.692 5.818 1.00 . A A . 14 VAL HG21 1 1 4 3545 1 1 14 VAL HG22 H -7.494 6.057 6.482 1.00 . A A . 14 VAL HG22 1 1 4 3546 1 1 14 VAL HG23 H -7.639 5.421 4.855 1.00 . A A . 14 VAL HG23 1 1 4 3547 1 1 14 VAL N N -7.035 6.852 2.909 1.00 . A A . 14 VAL N 1 1 4 3548 1 1 14 VAL O O -5.111 8.773 5.052 1.00 . A A . 14 VAL O 1 1 4 3549 1 1 15 GLU C C -2.961 5.828 4.858 1.00 . A A . 15 GLU C 1 1 4 3550 1 1 15 GLU CA C -4.004 6.361 5.828 1.00 . A A . 15 GLU CA 1 1 4 3551 1 1 15 GLU CB C -4.165 5.402 7.009 1.00 . A A . 15 GLU CB 1 1 4 3552 1 1 15 GLU CD C -2.419 6.559 8.424 1.00 . A A . 15 GLU CD 1 1 4 3553 1 1 15 GLU CG C -2.901 5.244 7.840 1.00 . A A . 15 GLU CG 1 1 4 3554 1 1 15 GLU H H -5.812 5.748 4.894 1.00 . A A . 15 GLU H 1 1 4 3555 1 1 15 GLU HA H -3.685 7.326 6.192 1.00 . A A . 15 GLU HA 1 1 4 3556 1 1 15 GLU HB2 H -4.948 5.771 7.653 1.00 . A A . 15 GLU HB2 1 1 4 3557 1 1 15 GLU HB3 H -4.446 4.429 6.634 1.00 . A A . 15 GLU HB3 1 1 4 3558 1 1 15 GLU HG2 H -3.101 4.560 8.650 1.00 . A A . 15 GLU HG2 1 1 4 3559 1 1 15 GLU HG3 H -2.121 4.839 7.211 1.00 . A A . 15 GLU HG3 1 1 4 3560 1 1 15 GLU N N -5.274 6.535 5.129 1.00 . A A . 15 GLU N 1 1 4 3561 1 1 15 GLU O O -3.242 4.932 4.087 1.00 . A A . 15 GLU O 1 1 4 3562 1 1 15 GLU OE1 O -2.850 6.904 9.544 1.00 . A A . 15 GLU OE1 1 1 4 3563 1 1 15 GLU OE2 O -1.610 7.241 7.761 1.00 . A A . 15 GLU OE2 1 1 4 3564 1 1 16 LYS C C 0.685 6.113 4.509 1.00 . A A . 16 LYS C 1 1 4 3565 1 1 16 LYS CA C -0.732 5.928 3.948 1.00 . A A . 16 LYS CA 1 1 4 3566 1 1 16 LYS CB C -0.865 6.701 2.639 1.00 . A A . 16 LYS CB 1 1 4 3567 1 1 16 LYS CD C -1.295 8.924 1.561 1.00 . A A . 16 LYS CD 1 1 4 3568 1 1 16 LYS CE C -0.475 8.491 0.360 1.00 . A A . 16 LYS CE 1 1 4 3569 1 1 16 LYS CG C -0.842 8.211 2.821 1.00 . A A . 16 LYS CG 1 1 4 3570 1 1 16 LYS H H -1.584 7.121 5.486 1.00 . A A . 16 LYS H 1 1 4 3571 1 1 16 LYS HA H -0.910 4.875 3.753 1.00 . A A . 16 LYS HA 1 1 4 3572 1 1 16 LYS HB2 H -0.052 6.424 1.986 1.00 . A A . 16 LYS HB2 1 1 4 3573 1 1 16 LYS HB3 H -1.800 6.432 2.175 1.00 . A A . 16 LYS HB3 1 1 4 3574 1 1 16 LYS HD2 H -2.333 8.691 1.379 1.00 . A A . 16 LYS HD2 1 1 4 3575 1 1 16 LYS HD3 H -1.181 9.989 1.700 1.00 . A A . 16 LYS HD3 1 1 4 3576 1 1 16 LYS HE2 H -0.512 7.414 0.289 1.00 . A A . 16 LYS HE2 1 1 4 3577 1 1 16 LYS HE3 H -0.904 8.926 -0.530 1.00 . A A . 16 LYS HE3 1 1 4 3578 1 1 16 LYS HG2 H -1.503 8.478 3.632 1.00 . A A . 16 LYS HG2 1 1 4 3579 1 1 16 LYS HG3 H 0.165 8.523 3.057 1.00 . A A . 16 LYS HG3 1 1 4 3580 1 1 16 LYS HZ1 H 1.370 8.524 1.341 1.00 . A A . 16 LYS HZ1 1 1 4 3581 1 1 16 LYS HZ2 H 1.005 9.956 0.516 1.00 . A A . 16 LYS HZ2 1 1 4 3582 1 1 16 LYS HZ3 H 1.490 8.583 -0.345 1.00 . A A . 16 LYS HZ3 1 1 4 3583 1 1 16 LYS N N -1.766 6.387 4.871 1.00 . A A . 16 LYS N 1 1 4 3584 1 1 16 LYS NZ N 0.947 8.919 0.476 1.00 . A A . 16 LYS NZ 1 1 4 3585 1 1 16 LYS O O 1.309 7.149 4.285 1.00 . A A . 16 LYS O 1 1 4 3586 1 1 17 ARG C C 3.165 3.837 5.998 1.00 . A A . 17 ARG C 1 1 4 3587 1 1 17 ARG CA C 2.543 5.217 5.796 1.00 . A A . 17 ARG CA 1 1 4 3588 1 1 17 ARG CB C 2.499 5.989 7.116 1.00 . A A . 17 ARG CB 1 1 4 3589 1 1 17 ARG CD C 1.441 6.297 9.376 1.00 . A A . 17 ARG CD 1 1 4 3590 1 1 17 ARG CG C 1.571 5.389 8.163 1.00 . A A . 17 ARG CG 1 1 4 3591 1 1 17 ARG CZ C 0.452 8.469 9.963 1.00 . A A . 17 ARG CZ 1 1 4 3592 1 1 17 ARG H H 0.676 4.300 5.377 1.00 . A A . 17 ARG H 1 1 4 3593 1 1 17 ARG HA H 3.151 5.767 5.093 1.00 . A A . 17 ARG HA 1 1 4 3594 1 1 17 ARG HB2 H 3.495 6.031 7.529 1.00 . A A . 17 ARG HB2 1 1 4 3595 1 1 17 ARG HB3 H 2.162 6.991 6.908 1.00 . A A . 17 ARG HB3 1 1 4 3596 1 1 17 ARG HD2 H 0.860 5.788 10.129 1.00 . A A . 17 ARG HD2 1 1 4 3597 1 1 17 ARG HD3 H 2.429 6.500 9.763 1.00 . A A . 17 ARG HD3 1 1 4 3598 1 1 17 ARG HE H 0.591 7.743 8.108 1.00 . A A . 17 ARG HE 1 1 4 3599 1 1 17 ARG HG2 H 0.594 5.245 7.727 1.00 . A A . 17 ARG HG2 1 1 4 3600 1 1 17 ARG HG3 H 1.967 4.438 8.483 1.00 . A A . 17 ARG HG3 1 1 4 3601 1 1 17 ARG HH11 H 1.155 7.400 11.527 1.00 . A A . 17 ARG HH11 1 1 4 3602 1 1 17 ARG HH12 H 0.455 8.932 11.930 1.00 . A A . 17 ARG HH12 1 1 4 3603 1 1 17 ARG HH21 H -0.335 9.768 8.628 1.00 . A A . 17 ARG HH21 1 1 4 3604 1 1 17 ARG HH22 H -0.391 10.278 10.282 1.00 . A A . 17 ARG HH22 1 1 4 3605 1 1 17 ARG N N 1.198 5.118 5.233 1.00 . A A . 17 ARG N 1 1 4 3606 1 1 17 ARG NE N 0.789 7.563 9.051 1.00 . A A . 17 ARG NE 1 1 4 3607 1 1 17 ARG NH1 N 0.709 8.250 11.244 1.00 . A A . 17 ARG NH1 1 1 4 3608 1 1 17 ARG NH2 N -0.140 9.597 9.593 1.00 . A A . 17 ARG NH2 1 1 4 3609 1 1 17 ARG O O 2.986 3.223 7.048 1.00 . A A . 17 ARG O 1 1 4 3610 1 1 18 GLY C C 5.744 1.786 4.369 1.00 . A A . 18 GLY C 1 1 4 3611 1 1 18 GLY CA C 4.482 2.018 5.165 1.00 . A A . 18 GLY CA 1 1 4 3612 1 1 18 GLY H H 4.038 3.846 4.176 1.00 . A A . 18 GLY H 1 1 4 3613 1 1 18 GLY HA2 H 4.709 1.871 6.210 1.00 . A A . 18 GLY HA2 1 1 4 3614 1 1 18 GLY HA3 H 3.757 1.286 4.872 1.00 . A A . 18 GLY HA3 1 1 4 3615 1 1 18 GLY N N 3.893 3.331 5.003 1.00 . A A . 18 GLY N 1 1 4 3616 1 1 18 GLY O O 6.641 2.626 4.326 1.00 . A A . 18 GLY O 1 1 4 3617 1 1 19 LYS C C 6.517 0.137 1.458 1.00 . A A . 19 LYS C 1 1 4 3618 1 1 19 LYS CA C 6.918 0.184 2.940 1.00 . A A . 19 LYS CA 1 1 4 3619 1 1 19 LYS CB C 7.348 -1.178 3.459 1.00 . A A . 19 LYS CB 1 1 4 3620 1 1 19 LYS CD C 8.294 -2.516 5.318 1.00 . A A . 19 LYS CD 1 1 4 3621 1 1 19 LYS CE C 9.013 -2.495 6.656 1.00 . A A . 19 LYS CE 1 1 4 3622 1 1 19 LYS CG C 8.000 -1.122 4.821 1.00 . A A . 19 LYS CG 1 1 4 3623 1 1 19 LYS H H 5.029 0.006 3.825 1.00 . A A . 19 LYS H 1 1 4 3624 1 1 19 LYS HA H 7.719 0.882 3.073 1.00 . A A . 19 LYS HA 1 1 4 3625 1 1 19 LYS HB2 H 6.463 -1.801 3.532 1.00 . A A . 19 LYS HB2 1 1 4 3626 1 1 19 LYS HB3 H 8.042 -1.628 2.769 1.00 . A A . 19 LYS HB3 1 1 4 3627 1 1 19 LYS HD2 H 7.361 -3.042 5.424 1.00 . A A . 19 LYS HD2 1 1 4 3628 1 1 19 LYS HD3 H 8.911 -3.016 4.587 1.00 . A A . 19 LYS HD3 1 1 4 3629 1 1 19 LYS HE2 H 8.390 -1.986 7.376 1.00 . A A . 19 LYS HE2 1 1 4 3630 1 1 19 LYS HE3 H 9.176 -3.513 6.978 1.00 . A A . 19 LYS HE3 1 1 4 3631 1 1 19 LYS HG2 H 8.925 -0.568 4.749 1.00 . A A . 19 LYS HG2 1 1 4 3632 1 1 19 LYS HG3 H 7.333 -0.633 5.516 1.00 . A A . 19 LYS HG3 1 1 4 3633 1 1 19 LYS HZ1 H 10.943 -2.275 5.886 1.00 . A A . 19 LYS HZ1 1 1 4 3634 1 1 19 LYS HZ2 H 10.791 -1.798 7.502 1.00 . A A . 19 LYS HZ2 1 1 4 3635 1 1 19 LYS HZ3 H 10.187 -0.812 6.267 1.00 . A A . 19 LYS HZ3 1 1 4 3636 1 1 19 LYS N N 5.792 0.614 3.742 1.00 . A A . 19 LYS N 1 1 4 3637 1 1 19 LYS NZ N 10.325 -1.796 6.572 1.00 . A A . 19 LYS NZ 1 1 4 3638 1 1 19 LYS O O 6.138 1.153 0.896 1.00 . A A . 19 LYS O 1 1 4 3639 1 1 20 GLY C C 4.784 -1.657 -0.567 1.00 . A A . 20 GLY C 1 1 4 3640 1 1 20 GLY CA C 6.191 -1.141 -0.548 1.00 . A A . 20 GLY CA 1 1 4 3641 1 1 20 GLY H H 6.936 -1.809 1.276 1.00 . A A . 20 GLY H 1 1 4 3642 1 1 20 GLY HA2 H 6.245 -0.179 -1.029 1.00 . A A . 20 GLY HA2 1 1 4 3643 1 1 20 GLY HA3 H 6.826 -1.846 -1.051 1.00 . A A . 20 GLY HA3 1 1 4 3644 1 1 20 GLY N N 6.607 -1.025 0.820 1.00 . A A . 20 GLY N 1 1 4 3645 1 1 20 GLY O O 3.934 -1.220 -1.342 1.00 . A A . 20 GLY O 1 1 4 3646 1 1 21 LYS C C 2.952 -3.357 2.020 1.00 . A A . 21 LYS C 1 1 4 3647 1 1 21 LYS CA C 3.280 -3.233 0.519 1.00 . A A . 21 LYS CA 1 1 4 3648 1 1 21 LYS CB C 3.271 -4.608 -0.144 1.00 . A A . 21 LYS CB 1 1 4 3649 1 1 21 LYS CD C 2.393 -3.732 -2.332 1.00 . A A . 21 LYS CD 1 1 4 3650 1 1 21 LYS CE C 2.644 -3.614 -3.826 1.00 . A A . 21 LYS CE 1 1 4 3651 1 1 21 LYS CG C 3.471 -4.560 -1.650 1.00 . A A . 21 LYS CG 1 1 4 3652 1 1 21 LYS H H 5.336 -2.925 0.848 1.00 . A A . 21 LYS H 1 1 4 3653 1 1 21 LYS HA H 2.534 -2.608 0.046 1.00 . A A . 21 LYS HA 1 1 4 3654 1 1 21 LYS HB2 H 4.068 -5.200 0.279 1.00 . A A . 21 LYS HB2 1 1 4 3655 1 1 21 LYS HB3 H 2.327 -5.088 0.059 1.00 . A A . 21 LYS HB3 1 1 4 3656 1 1 21 LYS HD2 H 1.435 -4.205 -2.173 1.00 . A A . 21 LYS HD2 1 1 4 3657 1 1 21 LYS HD3 H 2.384 -2.743 -1.897 1.00 . A A . 21 LYS HD3 1 1 4 3658 1 1 21 LYS HE2 H 2.660 -4.604 -4.255 1.00 . A A . 21 LYS HE2 1 1 4 3659 1 1 21 LYS HE3 H 1.840 -3.044 -4.269 1.00 . A A . 21 LYS HE3 1 1 4 3660 1 1 21 LYS HG2 H 4.435 -4.120 -1.861 1.00 . A A . 21 LYS HG2 1 1 4 3661 1 1 21 LYS HG3 H 3.439 -5.566 -2.041 1.00 . A A . 21 LYS HG3 1 1 4 3662 1 1 21 LYS HZ1 H 3.965 -2.003 -3.666 1.00 . A A . 21 LYS HZ1 1 1 4 3663 1 1 21 LYS HZ2 H 4.051 -2.816 -5.148 1.00 . A A . 21 LYS HZ2 1 1 4 3664 1 1 21 LYS HZ3 H 4.729 -3.509 -3.763 1.00 . A A . 21 LYS HZ3 1 1 4 3665 1 1 21 LYS N N 4.572 -2.608 0.323 1.00 . A A . 21 LYS N 1 1 4 3666 1 1 21 LYS NZ N 3.938 -2.938 -4.121 1.00 . A A . 21 LYS NZ 1 1 4 3667 1 1 21 LYS O O 1.889 -3.856 2.381 1.00 . A A . 21 LYS O 1 1 4 3668 1 1 22 ASP C C 2.908 -1.722 4.846 1.00 . A A . 22 ASP C 1 1 4 3669 1 1 22 ASP CA C 3.648 -2.948 4.337 1.00 . A A . 22 ASP CA 1 1 4 3670 1 1 22 ASP CB C 4.979 -3.065 5.074 1.00 . A A . 22 ASP CB 1 1 4 3671 1 1 22 ASP CG C 4.817 -3.591 6.488 1.00 . A A . 22 ASP CG 1 1 4 3672 1 1 22 ASP H H 4.674 -2.483 2.569 1.00 . A A . 22 ASP H 1 1 4 3673 1 1 22 ASP HA H 3.060 -3.809 4.527 1.00 . A A . 22 ASP HA 1 1 4 3674 1 1 22 ASP HB2 H 5.630 -3.725 4.530 1.00 . A A . 22 ASP HB2 1 1 4 3675 1 1 22 ASP HB3 H 5.432 -2.087 5.129 1.00 . A A . 22 ASP HB3 1 1 4 3676 1 1 22 ASP N N 3.860 -2.883 2.894 1.00 . A A . 22 ASP N 1 1 4 3677 1 1 22 ASP O O 2.810 -1.489 6.049 1.00 . A A . 22 ASP O 1 1 4 3678 1 1 22 ASP OD1 O 4.457 -4.777 6.642 1.00 . A A . 22 ASP OD1 1 1 4 3679 1 1 22 ASP OD2 O 5.050 -2.818 7.441 1.00 . A A . 22 ASP OD2 1 1 4 3680 1 1 23 VAL C C 0.192 -0.026 4.220 1.00 . A A . 23 VAL C 1 1 4 3681 1 1 23 VAL CA C 1.680 0.257 4.201 1.00 . A A . 23 VAL CA 1 1 4 3682 1 1 23 VAL CB C 1.968 1.272 3.108 1.00 . A A . 23 VAL CB 1 1 4 3683 1 1 23 VAL CG1 C 1.559 0.675 1.770 1.00 . A A . 23 VAL CG1 1 1 4 3684 1 1 23 VAL CG2 C 1.253 2.580 3.384 1.00 . A A . 23 VAL CG2 1 1 4 3685 1 1 23 VAL H H 2.574 -1.166 2.990 1.00 . A A . 23 VAL H 1 1 4 3686 1 1 23 VAL HA H 1.995 0.656 5.150 1.00 . A A . 23 VAL HA 1 1 4 3687 1 1 23 VAL HB H 3.033 1.455 3.088 1.00 . A A . 23 VAL HB 1 1 4 3688 1 1 23 VAL HG11 H 2.407 0.679 1.101 1.00 . A A . 23 VAL HG11 1 1 4 3689 1 1 23 VAL HG12 H 0.758 1.257 1.345 1.00 . A A . 23 VAL HG12 1 1 4 3690 1 1 23 VAL HG13 H 1.221 -0.340 1.911 1.00 . A A . 23 VAL HG13 1 1 4 3691 1 1 23 VAL HG21 H 1.634 3.346 2.727 1.00 . A A . 23 VAL HG21 1 1 4 3692 1 1 23 VAL HG22 H 1.426 2.867 4.407 1.00 . A A . 23 VAL HG22 1 1 4 3693 1 1 23 VAL HG23 H 0.192 2.455 3.219 1.00 . A A . 23 VAL HG23 1 1 4 3694 1 1 23 VAL N N 2.418 -0.941 3.915 1.00 . A A . 23 VAL N 1 1 4 3695 1 1 23 VAL O O -0.313 -0.798 3.406 1.00 . A A . 23 VAL O 1 1 4 3696 1 1 24 GLU C C -2.703 1.589 4.621 1.00 . A A . 24 GLU C 1 1 4 3697 1 1 24 GLU CA C -1.943 0.420 5.215 1.00 . A A . 24 GLU CA 1 1 4 3698 1 1 24 GLU CB C -2.371 0.219 6.660 1.00 . A A . 24 GLU CB 1 1 4 3699 1 1 24 GLU CD C -2.301 1.080 9.035 1.00 . A A . 24 GLU CD 1 1 4 3700 1 1 24 GLU CG C -1.960 1.355 7.583 1.00 . A A . 24 GLU CG 1 1 4 3701 1 1 24 GLU H H -0.073 1.280 5.694 1.00 . A A . 24 GLU H 1 1 4 3702 1 1 24 GLU HA H -2.176 -0.478 4.655 1.00 . A A . 24 GLU HA 1 1 4 3703 1 1 24 GLU HB2 H -3.448 0.134 6.682 1.00 . A A . 24 GLU HB2 1 1 4 3704 1 1 24 GLU HB3 H -1.939 -0.696 7.028 1.00 . A A . 24 GLU HB3 1 1 4 3705 1 1 24 GLU HG2 H -0.894 1.500 7.502 1.00 . A A . 24 GLU HG2 1 1 4 3706 1 1 24 GLU HG3 H -2.470 2.256 7.274 1.00 . A A . 24 GLU HG3 1 1 4 3707 1 1 24 GLU N N -0.515 0.629 5.114 1.00 . A A . 24 GLU N 1 1 4 3708 1 1 24 GLU O O -2.576 2.727 5.074 1.00 . A A . 24 GLU O 1 1 4 3709 1 1 24 GLU OE1 O -3.488 1.208 9.400 1.00 . A A . 24 GLU OE1 1 1 4 3710 1 1 24 GLU OE2 O -1.379 0.737 9.806 1.00 . A A . 24 GLU OE2 1 1 4 3711 1 1 25 TYR C C -5.758 2.039 3.172 1.00 . A A . 25 TYR C 1 1 4 3712 1 1 25 TYR CA C -4.281 2.302 2.945 1.00 . A A . 25 TYR CA 1 1 4 3713 1 1 25 TYR CB C -3.975 2.309 1.450 1.00 . A A . 25 TYR CB 1 1 4 3714 1 1 25 TYR CD1 C -1.490 2.718 1.319 1.00 . A A . 25 TYR CD1 1 1 4 3715 1 1 25 TYR CD2 C -2.947 4.410 0.503 1.00 . A A . 25 TYR CD2 1 1 4 3716 1 1 25 TYR CE1 C -0.396 3.493 1.001 1.00 . A A . 25 TYR CE1 1 1 4 3717 1 1 25 TYR CE2 C -1.855 5.193 0.182 1.00 . A A . 25 TYR CE2 1 1 4 3718 1 1 25 TYR CG C -2.783 3.160 1.077 1.00 . A A . 25 TYR CG 1 1 4 3719 1 1 25 TYR CZ C -0.602 4.719 0.350 1.00 . A A . 25 TYR CZ 1 1 4 3720 1 1 25 TYR H H -3.544 0.387 3.289 1.00 . A A . 25 TYR H 1 1 4 3721 1 1 25 TYR HA H -4.022 3.252 3.358 1.00 . A A . 25 TYR HA 1 1 4 3722 1 1 25 TYR HB2 H -3.773 1.299 1.128 1.00 . A A . 25 TYR HB2 1 1 4 3723 1 1 25 TYR HB3 H -4.833 2.687 0.914 1.00 . A A . 25 TYR HB3 1 1 4 3724 1 1 25 TYR HD1 H -1.346 1.751 1.757 1.00 . A A . 25 TYR HD1 1 1 4 3725 1 1 25 TYR HD2 H -3.945 4.772 0.306 1.00 . A A . 25 TYR HD2 1 1 4 3726 1 1 25 TYR HE1 H 0.601 3.126 1.199 1.00 . A A . 25 TYR HE1 1 1 4 3727 1 1 25 TYR HE2 H -1.999 6.159 -0.262 1.00 . A A . 25 TYR HE2 1 1 4 3728 1 1 25 TYR HH H 0.351 6.410 0.408 1.00 . A A . 25 TYR HH 1 1 4 3729 1 1 25 TYR N N -3.491 1.300 3.604 1.00 . A A . 25 TYR N 1 1 4 3730 1 1 25 TYR O O -6.140 1.147 3.926 1.00 . A A . 25 TYR O 1 1 4 3731 1 1 25 TYR OH O 0.505 5.509 0.114 1.00 . A A . 25 TYR OH 1 1 4 3732 1 1 26 LEU C C -8.556 2.694 1.195 1.00 . A A . 26 LEU C 1 1 4 3733 1 1 26 LEU CA C -8.009 2.720 2.600 1.00 . A A . 26 LEU CA 1 1 4 3734 1 1 26 LEU CB C -8.608 3.890 3.382 1.00 . A A . 26 LEU CB 1 1 4 3735 1 1 26 LEU CD1 C -10.774 4.596 4.461 1.00 . A A . 26 LEU CD1 1 1 4 3736 1 1 26 LEU CD2 C -10.423 4.957 2.005 1.00 . A A . 26 LEU CD2 1 1 4 3737 1 1 26 LEU CG C -10.113 4.070 3.202 1.00 . A A . 26 LEU CG 1 1 4 3738 1 1 26 LEU H H -6.191 3.549 1.990 1.00 . A A . 26 LEU H 1 1 4 3739 1 1 26 LEU HA H -8.252 1.791 3.090 1.00 . A A . 26 LEU HA 1 1 4 3740 1 1 26 LEU HB2 H -8.406 3.730 4.431 1.00 . A A . 26 LEU HB2 1 1 4 3741 1 1 26 LEU HB3 H -8.113 4.799 3.070 1.00 . A A . 26 LEU HB3 1 1 4 3742 1 1 26 LEU HD11 H -10.761 5.671 4.454 1.00 . A A . 26 LEU HD11 1 1 4 3743 1 1 26 LEU HD12 H -10.241 4.233 5.326 1.00 . A A . 26 LEU HD12 1 1 4 3744 1 1 26 LEU HD13 H -11.797 4.251 4.499 1.00 . A A . 26 LEU HD13 1 1 4 3745 1 1 26 LEU HD21 H -11.460 5.252 2.036 1.00 . A A . 26 LEU HD21 1 1 4 3746 1 1 26 LEU HD22 H -10.234 4.408 1.092 1.00 . A A . 26 LEU HD22 1 1 4 3747 1 1 26 LEU HD23 H -9.799 5.832 2.034 1.00 . A A . 26 LEU HD23 1 1 4 3748 1 1 26 LEU HG H -10.526 3.119 3.006 1.00 . A A . 26 LEU HG 1 1 4 3749 1 1 26 LEU N N -6.571 2.842 2.530 1.00 . A A . 26 LEU N 1 1 4 3750 1 1 26 LEU O O -7.899 3.157 0.275 1.00 . A A . 26 LEU O 1 1 4 3751 1 1 27 VAL C C -11.785 2.401 -0.373 1.00 . A A . 27 VAL C 1 1 4 3752 1 1 27 VAL CA C -10.289 2.127 -0.331 1.00 . A A . 27 VAL CA 1 1 4 3753 1 1 27 VAL CB C -9.935 0.819 -1.078 1.00 . A A . 27 VAL CB 1 1 4 3754 1 1 27 VAL CG1 C -8.665 0.194 -0.520 1.00 . A A . 27 VAL CG1 1 1 4 3755 1 1 27 VAL CG2 C -11.070 -0.207 -1.094 1.00 . A A . 27 VAL CG2 1 1 4 3756 1 1 27 VAL H H -10.238 1.758 1.749 1.00 . A A . 27 VAL H 1 1 4 3757 1 1 27 VAL HA H -9.807 2.918 -0.881 1.00 . A A . 27 VAL HA 1 1 4 3758 1 1 27 VAL HB H -9.731 1.113 -2.089 1.00 . A A . 27 VAL HB 1 1 4 3759 1 1 27 VAL HG11 H -8.508 -0.768 -0.979 1.00 . A A . 27 VAL HG11 1 1 4 3760 1 1 27 VAL HG12 H -8.762 0.072 0.549 1.00 . A A . 27 VAL HG12 1 1 4 3761 1 1 27 VAL HG13 H -7.823 0.836 -0.733 1.00 . A A . 27 VAL HG13 1 1 4 3762 1 1 27 VAL HG21 H -11.515 -0.267 -0.115 1.00 . A A . 27 VAL HG21 1 1 4 3763 1 1 27 VAL HG22 H -10.677 -1.173 -1.373 1.00 . A A . 27 VAL HG22 1 1 4 3764 1 1 27 VAL HG23 H -11.818 0.098 -1.811 1.00 . A A . 27 VAL HG23 1 1 4 3765 1 1 27 VAL N N -9.744 2.157 1.005 1.00 . A A . 27 VAL N 1 1 4 3766 1 1 27 VAL O O -12.598 1.616 0.116 1.00 . A A . 27 VAL O 1 1 4 3767 1 1 28 ARG C C -13.884 3.292 -2.457 1.00 . A A . 28 ARG C 1 1 4 3768 1 1 28 ARG CA C -13.504 3.905 -1.152 1.00 . A A . 28 ARG CA 1 1 4 3769 1 1 28 ARG CB C -13.683 5.419 -1.197 1.00 . A A . 28 ARG CB 1 1 4 3770 1 1 28 ARG CD C -15.247 7.382 -1.052 1.00 . A A . 28 ARG CD 1 1 4 3771 1 1 28 ARG CG C -15.110 5.872 -0.931 1.00 . A A . 28 ARG CG 1 1 4 3772 1 1 28 ARG CZ C -17.009 9.091 -0.933 1.00 . A A . 28 ARG CZ 1 1 4 3773 1 1 28 ARG H H -11.431 4.115 -1.303 1.00 . A A . 28 ARG H 1 1 4 3774 1 1 28 ARG HA H -14.103 3.469 -0.371 1.00 . A A . 28 ARG HA 1 1 4 3775 1 1 28 ARG HB2 H -13.038 5.874 -0.460 1.00 . A A . 28 ARG HB2 1 1 4 3776 1 1 28 ARG HB3 H -13.399 5.764 -2.177 1.00 . A A . 28 ARG HB3 1 1 4 3777 1 1 28 ARG HD2 H -14.607 7.849 -0.319 1.00 . A A . 28 ARG HD2 1 1 4 3778 1 1 28 ARG HD3 H -14.936 7.679 -2.043 1.00 . A A . 28 ARG HD3 1 1 4 3779 1 1 28 ARG HE H -17.286 7.145 -0.600 1.00 . A A . 28 ARG HE 1 1 4 3780 1 1 28 ARG HG2 H -15.766 5.403 -1.649 1.00 . A A . 28 ARG HG2 1 1 4 3781 1 1 28 ARG HG3 H -15.393 5.572 0.067 1.00 . A A . 28 ARG HG3 1 1 4 3782 1 1 28 ARG HH11 H -15.173 9.791 -1.408 1.00 . A A . 28 ARG HH11 1 1 4 3783 1 1 28 ARG HH12 H -16.425 10.986 -1.323 1.00 . A A . 28 ARG HH12 1 1 4 3784 1 1 28 ARG HH21 H -18.942 8.710 -0.484 1.00 . A A . 28 ARG HH21 1 1 4 3785 1 1 28 ARG HH22 H -18.567 10.372 -0.796 1.00 . A A . 28 ARG HH22 1 1 4 3786 1 1 28 ARG N N -12.127 3.533 -0.960 1.00 . A A . 28 ARG N 1 1 4 3787 1 1 28 ARG NE N -16.621 7.825 -0.833 1.00 . A A . 28 ARG NE 1 1 4 3788 1 1 28 ARG NH1 N -16.130 10.034 -1.247 1.00 . A A . 28 ARG NH1 1 1 4 3789 1 1 28 ARG NH2 N -18.276 9.417 -0.721 1.00 . A A . 28 ARG NH2 1 1 4 3790 1 1 28 ARG O O -14.147 3.983 -3.440 1.00 . A A . 28 ARG O 1 1 4 3791 1 1 29 TRP C C -15.025 1.840 -4.618 1.00 . A A . 29 TRP C 1 1 4 3792 1 1 29 TRP CA C -14.166 1.134 -3.583 1.00 . A A . 29 TRP CA 1 1 4 3793 1 1 29 TRP CB C -14.849 -0.128 -3.109 1.00 . A A . 29 TRP CB 1 1 4 3794 1 1 29 TRP CD1 C -14.438 -1.200 -5.393 1.00 . A A . 29 TRP CD1 1 1 4 3795 1 1 29 TRP CD2 C -16.119 -2.129 -4.238 1.00 . A A . 29 TRP CD2 1 1 4 3796 1 1 29 TRP CE2 C -15.992 -2.802 -5.469 1.00 . A A . 29 TRP CE2 1 1 4 3797 1 1 29 TRP CE3 C -17.114 -2.543 -3.345 1.00 . A A . 29 TRP CE3 1 1 4 3798 1 1 29 TRP CG C -15.117 -1.105 -4.211 1.00 . A A . 29 TRP CG 1 1 4 3799 1 1 29 TRP CH2 C -17.780 -4.248 -4.933 1.00 . A A . 29 TRP CH2 1 1 4 3800 1 1 29 TRP CZ2 C -16.818 -3.865 -5.826 1.00 . A A . 29 TRP CZ2 1 1 4 3801 1 1 29 TRP CZ3 C -17.932 -3.598 -3.702 1.00 . A A . 29 TRP CZ3 1 1 4 3802 1 1 29 TRP H H -13.704 1.519 -1.579 1.00 . A A . 29 TRP H 1 1 4 3803 1 1 29 TRP HA H -13.226 0.866 -4.027 1.00 . A A . 29 TRP HA 1 1 4 3804 1 1 29 TRP HB2 H -14.219 -0.615 -2.377 1.00 . A A . 29 TRP HB2 1 1 4 3805 1 1 29 TRP HB3 H -15.778 0.150 -2.648 1.00 . A A . 29 TRP HB3 1 1 4 3806 1 1 29 TRP HD1 H -13.613 -0.558 -5.675 1.00 . A A . 29 TRP HD1 1 1 4 3807 1 1 29 TRP HE1 H -14.644 -2.481 -7.044 1.00 . A A . 29 TRP HE1 1 1 4 3808 1 1 29 TRP HE3 H -17.248 -2.054 -2.392 1.00 . A A . 29 TRP HE3 1 1 4 3809 1 1 29 TRP HH2 H -18.444 -5.066 -5.170 1.00 . A A . 29 TRP HH2 1 1 4 3810 1 1 29 TRP HZ2 H -16.713 -4.378 -6.771 1.00 . A A . 29 TRP HZ2 1 1 4 3811 1 1 29 TRP HZ3 H -18.704 -3.931 -3.025 1.00 . A A . 29 TRP HZ3 1 1 4 3812 1 1 29 TRP N N -13.893 1.965 -2.430 1.00 . A A . 29 TRP N 1 1 4 3813 1 1 29 TRP NE1 N -14.959 -2.217 -6.155 1.00 . A A . 29 TRP NE1 1 1 4 3814 1 1 29 TRP O O -16.251 1.810 -4.556 1.00 . A A . 29 TRP O 1 1 4 3815 1 1 30 LYS C C -16.312 2.683 -7.047 1.00 . A A . 30 LYS C 1 1 4 3816 1 1 30 LYS CA C -14.957 3.272 -6.639 1.00 . A A . 30 LYS CA 1 1 4 3817 1 1 30 LYS CB C -14.029 3.274 -7.857 1.00 . A A . 30 LYS CB 1 1 4 3818 1 1 30 LYS CD C -13.426 4.292 -10.075 1.00 . A A . 30 LYS CD 1 1 4 3819 1 1 30 LYS CE C -13.835 5.274 -11.161 1.00 . A A . 30 LYS CE 1 1 4 3820 1 1 30 LYS CG C -14.408 4.300 -8.914 1.00 . A A . 30 LYS CG 1 1 4 3821 1 1 30 LYS H H -13.346 2.577 -5.416 1.00 . A A . 30 LYS H 1 1 4 3822 1 1 30 LYS HA H -15.104 4.289 -6.312 1.00 . A A . 30 LYS HA 1 1 4 3823 1 1 30 LYS HB2 H -13.019 3.478 -7.533 1.00 . A A . 30 LYS HB2 1 1 4 3824 1 1 30 LYS HB3 H -14.056 2.296 -8.315 1.00 . A A . 30 LYS HB3 1 1 4 3825 1 1 30 LYS HD2 H -12.448 4.564 -9.707 1.00 . A A . 30 LYS HD2 1 1 4 3826 1 1 30 LYS HD3 H -13.391 3.298 -10.495 1.00 . A A . 30 LYS HD3 1 1 4 3827 1 1 30 LYS HE2 H -13.101 5.242 -11.952 1.00 . A A . 30 LYS HE2 1 1 4 3828 1 1 30 LYS HE3 H -14.797 4.978 -11.552 1.00 . A A . 30 LYS HE3 1 1 4 3829 1 1 30 LYS HG2 H -15.395 4.070 -9.288 1.00 . A A . 30 LYS HG2 1 1 4 3830 1 1 30 LYS HG3 H -14.412 5.282 -8.463 1.00 . A A . 30 LYS HG3 1 1 4 3831 1 1 30 LYS HZ1 H -14.217 7.312 -11.410 1.00 . A A . 30 LYS HZ1 1 1 4 3832 1 1 30 LYS HZ2 H -13.005 6.976 -10.278 1.00 . A A . 30 LYS HZ2 1 1 4 3833 1 1 30 LYS HZ3 H -14.630 6.720 -9.880 1.00 . A A . 30 LYS HZ3 1 1 4 3834 1 1 30 LYS N N -14.329 2.524 -5.531 1.00 . A A . 30 LYS N 1 1 4 3835 1 1 30 LYS NZ N -13.929 6.669 -10.647 1.00 . A A . 30 LYS NZ 1 1 4 3836 1 1 30 LYS O O -17.237 3.418 -7.394 1.00 . A A . 30 LYS O 1 1 4 3837 1 1 31 ASP C C -18.147 -0.134 -6.151 1.00 . A A . 31 ASP C 1 1 4 3838 1 1 31 ASP CA C -17.659 0.677 -7.347 1.00 . A A . 31 ASP CA 1 1 4 3839 1 1 31 ASP CB C -17.464 -0.231 -8.564 1.00 . A A . 31 ASP CB 1 1 4 3840 1 1 31 ASP CG C -16.411 -1.296 -8.329 1.00 . A A . 31 ASP CG 1 1 4 3841 1 1 31 ASP H H -15.634 0.826 -6.749 1.00 . A A . 31 ASP H 1 1 4 3842 1 1 31 ASP HA H -18.397 1.430 -7.583 1.00 . A A . 31 ASP HA 1 1 4 3843 1 1 31 ASP HB2 H -18.398 -0.722 -8.793 1.00 . A A . 31 ASP HB2 1 1 4 3844 1 1 31 ASP HB3 H -17.161 0.369 -9.409 1.00 . A A . 31 ASP HB3 1 1 4 3845 1 1 31 ASP N N -16.415 1.359 -7.010 1.00 . A A . 31 ASP N 1 1 4 3846 1 1 31 ASP O O -18.328 -1.349 -6.237 1.00 . A A . 31 ASP O 1 1 4 3847 1 1 31 ASP OD1 O -15.209 -0.961 -8.373 1.00 . A A . 31 ASP OD1 1 1 4 3848 1 1 31 ASP OD2 O -16.789 -2.465 -8.102 1.00 . A A . 31 ASP OD2 1 1 4 3849 1 1 32 GLY C C -19.823 0.712 -3.045 1.00 . A A . 32 GLY C 1 1 4 3850 1 1 32 GLY CA C -18.803 -0.102 -3.817 1.00 . A A . 32 GLY CA 1 1 4 3851 1 1 32 GLY H H -18.211 1.525 -5.032 1.00 . A A . 32 GLY H 1 1 4 3852 1 1 32 GLY HA2 H -19.237 -1.057 -4.072 1.00 . A A . 32 GLY HA2 1 1 4 3853 1 1 32 GLY HA3 H -17.942 -0.266 -3.180 1.00 . A A . 32 GLY HA3 1 1 4 3854 1 1 32 GLY N N -18.358 0.556 -5.031 1.00 . A A . 32 GLY N 1 1 4 3855 1 1 32 GLY O O -20.628 1.435 -3.631 1.00 . A A . 32 GLY O 1 1 4 3856 1 1 33 GLY C C -20.085 1.685 0.462 1.00 . A A . 33 GLY C 1 1 4 3857 1 1 33 GLY CA C -20.705 1.317 -0.873 1.00 . A A . 33 GLY CA 1 1 4 3858 1 1 33 GLY H H -19.119 -0.010 -1.319 1.00 . A A . 33 GLY H 1 1 4 3859 1 1 33 GLY HA2 H -21.006 2.223 -1.380 1.00 . A A . 33 GLY HA2 1 1 4 3860 1 1 33 GLY HA3 H -21.577 0.707 -0.696 1.00 . A A . 33 GLY HA3 1 1 4 3861 1 1 33 GLY N N -19.783 0.587 -1.723 1.00 . A A . 33 GLY N 1 1 4 3862 1 1 33 GLY O O -20.222 2.816 0.928 1.00 . A A . 33 GLY O 1 1 4 3863 1 1 34 ASP C C -17.262 1.210 2.176 1.00 . A A . 34 ASP C 1 1 4 3864 1 1 34 ASP CA C -18.752 0.948 2.365 1.00 . A A . 34 ASP CA 1 1 4 3865 1 1 34 ASP CB C -18.959 -0.261 3.279 1.00 . A A . 34 ASP CB 1 1 4 3866 1 1 34 ASP CG C -20.425 -0.593 3.478 1.00 . A A . 34 ASP CG 1 1 4 3867 1 1 34 ASP H H -19.335 -0.158 0.660 1.00 . A A . 34 ASP H 1 1 4 3868 1 1 34 ASP HA H -19.206 1.817 2.820 1.00 . A A . 34 ASP HA 1 1 4 3869 1 1 34 ASP HB2 H -18.471 -1.120 2.845 1.00 . A A . 34 ASP HB2 1 1 4 3870 1 1 34 ASP HB3 H -18.522 -0.051 4.245 1.00 . A A . 34 ASP HB3 1 1 4 3871 1 1 34 ASP N N -19.402 0.724 1.079 1.00 . A A . 34 ASP N 1 1 4 3872 1 1 34 ASP O O -16.732 1.072 1.074 1.00 . A A . 34 ASP O 1 1 4 3873 1 1 34 ASP OD1 O -21.041 -0.025 4.405 1.00 . A A . 34 ASP OD1 1 1 4 3874 1 1 34 ASP OD2 O -20.957 -1.420 2.707 1.00 . A A . 34 ASP OD2 1 1 4 3875 1 1 35 CYS C C -14.380 0.936 4.128 1.00 . A A . 35 CYS C 1 1 4 3876 1 1 35 CYS CA C -15.157 1.870 3.206 1.00 . A A . 35 CYS CA 1 1 4 3877 1 1 35 CYS CB C -14.889 3.324 3.593 1.00 . A A . 35 CYS CB 1 1 4 3878 1 1 35 CYS H H -17.063 1.679 4.110 1.00 . A A . 35 CYS H 1 1 4 3879 1 1 35 CYS HA H -14.826 1.710 2.191 1.00 . A A . 35 CYS HA 1 1 4 3880 1 1 35 CYS HB2 H -15.216 3.485 4.609 1.00 . A A . 35 CYS HB2 1 1 4 3881 1 1 35 CYS HB3 H -13.828 3.516 3.528 1.00 . A A . 35 CYS HB3 1 1 4 3882 1 1 35 CYS HG H -14.817 5.352 2.049 1.00 . A A . 35 CYS HG 1 1 4 3883 1 1 35 CYS N N -16.588 1.587 3.258 1.00 . A A . 35 CYS N 1 1 4 3884 1 1 35 CYS O O -14.809 0.655 5.246 1.00 . A A . 35 CYS O 1 1 4 3885 1 1 35 CYS SG S -15.732 4.534 2.547 1.00 . A A . 35 CYS SG 1 1 4 3886 1 1 36 GLU C C -10.917 -0.061 4.285 1.00 . A A . 36 GLU C 1 1 4 3887 1 1 36 GLU CA C -12.389 -0.439 4.430 1.00 . A A . 36 GLU CA 1 1 4 3888 1 1 36 GLU CB C -12.607 -1.886 3.986 1.00 . A A . 36 GLU CB 1 1 4 3889 1 1 36 GLU CD C -14.415 -2.533 5.629 1.00 . A A . 36 GLU CD 1 1 4 3890 1 1 36 GLU CG C -14.035 -2.373 4.169 1.00 . A A . 36 GLU CG 1 1 4 3891 1 1 36 GLU H H -12.943 0.730 2.753 1.00 . A A . 36 GLU H 1 1 4 3892 1 1 36 GLU HA H -12.672 -0.343 5.468 1.00 . A A . 36 GLU HA 1 1 4 3893 1 1 36 GLU HB2 H -12.352 -1.972 2.942 1.00 . A A . 36 GLU HB2 1 1 4 3894 1 1 36 GLU HB3 H -11.955 -2.529 4.559 1.00 . A A . 36 GLU HB3 1 1 4 3895 1 1 36 GLU HG2 H -14.705 -1.660 3.714 1.00 . A A . 36 GLU HG2 1 1 4 3896 1 1 36 GLU HG3 H -14.141 -3.331 3.678 1.00 . A A . 36 GLU HG3 1 1 4 3897 1 1 36 GLU N N -13.232 0.463 3.651 1.00 . A A . 36 GLU N 1 1 4 3898 1 1 36 GLU O O -10.577 0.885 3.575 1.00 . A A . 36 GLU O 1 1 4 3899 1 1 36 GLU OE1 O -14.877 -1.542 6.233 1.00 . A A . 36 GLU OE1 1 1 4 3900 1 1 36 GLU OE2 O -14.252 -3.647 6.168 1.00 . A A . 36 GLU OE2 1 1 4 3901 1 1 37 TRP C C -7.851 -1.660 4.217 1.00 . A A . 37 TRP C 1 1 4 3902 1 1 37 TRP CA C -8.614 -0.537 4.914 1.00 . A A . 37 TRP CA 1 1 4 3903 1 1 37 TRP CB C -8.077 -0.363 6.331 1.00 . A A . 37 TRP CB 1 1 4 3904 1 1 37 TRP CD1 C -9.106 1.973 6.541 1.00 . A A . 37 TRP CD1 1 1 4 3905 1 1 37 TRP CD2 C -8.973 0.847 8.473 1.00 . A A . 37 TRP CD2 1 1 4 3906 1 1 37 TRP CE2 C -9.551 2.106 8.727 1.00 . A A . 37 TRP CE2 1 1 4 3907 1 1 37 TRP CE3 C -8.787 -0.036 9.539 1.00 . A A . 37 TRP CE3 1 1 4 3908 1 1 37 TRP CG C -8.698 0.782 7.069 1.00 . A A . 37 TRP CG 1 1 4 3909 1 1 37 TRP CH2 C -9.751 1.614 11.028 1.00 . A A . 37 TRP CH2 1 1 4 3910 1 1 37 TRP CZ2 C -9.945 2.500 10.003 1.00 . A A . 37 TRP CZ2 1 1 4 3911 1 1 37 TRP CZ3 C -9.178 0.356 10.805 1.00 . A A . 37 TRP CZ3 1 1 4 3912 1 1 37 TRP H H -10.370 -1.545 5.511 1.00 . A A . 37 TRP H 1 1 4 3913 1 1 37 TRP HA H -8.465 0.380 4.369 1.00 . A A . 37 TRP HA 1 1 4 3914 1 1 37 TRP HB2 H -8.272 -1.265 6.894 1.00 . A A . 37 TRP HB2 1 1 4 3915 1 1 37 TRP HB3 H -7.016 -0.197 6.284 1.00 . A A . 37 TRP HB3 1 1 4 3916 1 1 37 TRP HD1 H -9.029 2.234 5.496 1.00 . A A . 37 TRP HD1 1 1 4 3917 1 1 37 TRP HE1 H -9.983 3.676 7.404 1.00 . A A . 37 TRP HE1 1 1 4 3918 1 1 37 TRP HE3 H -8.347 -1.012 9.386 1.00 . A A . 37 TRP HE3 1 1 4 3919 1 1 37 TRP HH2 H -10.041 1.878 12.034 1.00 . A A . 37 TRP HH2 1 1 4 3920 1 1 37 TRP HZ2 H -10.389 3.466 10.192 1.00 . A A . 37 TRP HZ2 1 1 4 3921 1 1 37 TRP HZ3 H -9.041 -0.314 11.641 1.00 . A A . 37 TRP HZ3 1 1 4 3922 1 1 37 TRP N N -10.045 -0.805 4.961 1.00 . A A . 37 TRP N 1 1 4 3923 1 1 37 TRP NE1 N -9.623 2.774 7.532 1.00 . A A . 37 TRP NE1 1 1 4 3924 1 1 37 TRP O O -8.298 -2.807 4.192 1.00 . A A . 37 TRP O 1 1 4 3925 1 1 38 VAL C C -4.888 -2.930 3.970 1.00 . A A . 38 VAL C 1 1 4 3926 1 1 38 VAL CA C -5.850 -2.296 2.976 1.00 . A A . 38 VAL CA 1 1 4 3927 1 1 38 VAL CB C -5.022 -1.654 1.846 1.00 . A A . 38 VAL CB 1 1 4 3928 1 1 38 VAL CG1 C -4.366 -2.725 0.989 1.00 . A A . 38 VAL CG1 1 1 4 3929 1 1 38 VAL CG2 C -5.882 -0.727 1.002 1.00 . A A . 38 VAL CG2 1 1 4 3930 1 1 38 VAL H H -6.408 -0.380 3.682 1.00 . A A . 38 VAL H 1 1 4 3931 1 1 38 VAL HA H -6.484 -3.060 2.552 1.00 . A A . 38 VAL HA 1 1 4 3932 1 1 38 VAL HB H -4.238 -1.067 2.293 1.00 . A A . 38 VAL HB 1 1 4 3933 1 1 38 VAL HG11 H -3.612 -2.271 0.365 1.00 . A A . 38 VAL HG11 1 1 4 3934 1 1 38 VAL HG12 H -5.113 -3.196 0.367 1.00 . A A . 38 VAL HG12 1 1 4 3935 1 1 38 VAL HG13 H -3.908 -3.466 1.624 1.00 . A A . 38 VAL HG13 1 1 4 3936 1 1 38 VAL HG21 H -6.441 -1.308 0.287 1.00 . A A . 38 VAL HG21 1 1 4 3937 1 1 38 VAL HG22 H -5.248 -0.027 0.478 1.00 . A A . 38 VAL HG22 1 1 4 3938 1 1 38 VAL HG23 H -6.566 -0.187 1.640 1.00 . A A . 38 VAL HG23 1 1 4 3939 1 1 38 VAL N N -6.694 -1.317 3.652 1.00 . A A . 38 VAL N 1 1 4 3940 1 1 38 VAL O O -4.513 -2.308 4.964 1.00 . A A . 38 VAL O 1 1 4 3941 1 1 39 LYS C C -2.179 -4.253 4.533 1.00 . A A . 39 LYS C 1 1 4 3942 1 1 39 LYS CA C -3.569 -4.865 4.589 1.00 . A A . 39 LYS CA 1 1 4 3943 1 1 39 LYS CB C -3.509 -6.354 4.240 1.00 . A A . 39 LYS CB 1 1 4 3944 1 1 39 LYS CD C -2.643 -8.637 4.843 1.00 . A A . 39 LYS CD 1 1 4 3945 1 1 39 LYS CE C -1.649 -9.420 5.687 1.00 . A A . 39 LYS CE 1 1 4 3946 1 1 39 LYS CG C -2.549 -7.144 5.116 1.00 . A A . 39 LYS CG 1 1 4 3947 1 1 39 LYS H H -4.816 -4.616 2.898 1.00 . A A . 39 LYS H 1 1 4 3948 1 1 39 LYS HA H -3.942 -4.753 5.589 1.00 . A A . 39 LYS HA 1 1 4 3949 1 1 39 LYS HB2 H -4.497 -6.778 4.351 1.00 . A A . 39 LYS HB2 1 1 4 3950 1 1 39 LYS HB3 H -3.195 -6.459 3.213 1.00 . A A . 39 LYS HB3 1 1 4 3951 1 1 39 LYS HD2 H -3.642 -8.974 5.078 1.00 . A A . 39 LYS HD2 1 1 4 3952 1 1 39 LYS HD3 H -2.436 -8.817 3.799 1.00 . A A . 39 LYS HD3 1 1 4 3953 1 1 39 LYS HE2 H -1.823 -9.192 6.728 1.00 . A A . 39 LYS HE2 1 1 4 3954 1 1 39 LYS HE3 H -1.806 -10.475 5.518 1.00 . A A . 39 LYS HE3 1 1 4 3955 1 1 39 LYS HG2 H -1.541 -6.815 4.914 1.00 . A A . 39 LYS HG2 1 1 4 3956 1 1 39 LYS HG3 H -2.789 -6.960 6.153 1.00 . A A . 39 LYS HG3 1 1 4 3957 1 1 39 LYS HZ1 H 0.413 -9.599 5.964 1.00 . A A . 39 LYS HZ1 1 1 4 3958 1 1 39 LYS HZ2 H -0.080 -8.057 5.471 1.00 . A A . 39 LYS HZ2 1 1 4 3959 1 1 39 LYS HZ3 H -0.041 -9.330 4.358 1.00 . A A . 39 LYS HZ3 1 1 4 3960 1 1 39 LYS N N -4.487 -4.166 3.703 1.00 . A A . 39 LYS N 1 1 4 3961 1 1 39 LYS NZ N -0.241 -9.077 5.347 1.00 . A A . 39 LYS NZ 1 1 4 3962 1 1 39 LYS O O -1.349 -4.636 3.710 1.00 . A A . 39 LYS O 1 1 4 3963 1 1 40 GLY C C 0.333 -3.328 6.401 1.00 . A A . 40 GLY C 1 1 4 3964 1 1 40 GLY CA C -0.646 -2.642 5.473 1.00 . A A . 40 GLY CA 1 1 4 3965 1 1 40 GLY H H -2.646 -3.025 6.039 1.00 . A A . 40 GLY H 1 1 4 3966 1 1 40 GLY HA2 H -0.227 -2.640 4.481 1.00 . A A . 40 GLY HA2 1 1 4 3967 1 1 40 GLY HA3 H -0.781 -1.624 5.798 1.00 . A A . 40 GLY HA3 1 1 4 3968 1 1 40 GLY N N -1.936 -3.296 5.423 1.00 . A A . 40 GLY N 1 1 4 3969 1 1 40 GLY O O 1.038 -2.673 7.167 1.00 . A A . 40 GLY O 1 1 4 3970 1 1 41 VAL C C 2.231 -6.206 6.247 1.00 . A A . 41 VAL C 1 1 4 3971 1 1 41 VAL CA C 1.288 -5.431 7.155 1.00 . A A . 41 VAL CA 1 1 4 3972 1 1 41 VAL CB C 0.579 -6.450 8.068 1.00 . A A . 41 VAL CB 1 1 4 3973 1 1 41 VAL CG1 C 1.393 -6.689 9.331 1.00 . A A . 41 VAL CG1 1 1 4 3974 1 1 41 VAL CG2 C -0.836 -6.003 8.412 1.00 . A A . 41 VAL CG2 1 1 4 3975 1 1 41 VAL H H -0.261 -5.118 5.749 1.00 . A A . 41 VAL H 1 1 4 3976 1 1 41 VAL HA H 1.861 -4.752 7.770 1.00 . A A . 41 VAL HA 1 1 4 3977 1 1 41 VAL HB H 0.523 -7.385 7.529 1.00 . A A . 41 VAL HB 1 1 4 3978 1 1 41 VAL HG11 H 2.372 -7.060 9.064 1.00 . A A . 41 VAL HG11 1 1 4 3979 1 1 41 VAL HG12 H 0.890 -7.417 9.950 1.00 . A A . 41 VAL HG12 1 1 4 3980 1 1 41 VAL HG13 H 1.494 -5.762 9.875 1.00 . A A . 41 VAL HG13 1 1 4 3981 1 1 41 VAL HG21 H -1.403 -5.875 7.501 1.00 . A A . 41 VAL HG21 1 1 4 3982 1 1 41 VAL HG22 H -0.797 -5.067 8.947 1.00 . A A . 41 VAL HG22 1 1 4 3983 1 1 41 VAL HG23 H -1.310 -6.752 9.028 1.00 . A A . 41 VAL HG23 1 1 4 3984 1 1 41 VAL N N 0.359 -4.651 6.348 1.00 . A A . 41 VAL N 1 1 4 3985 1 1 41 VAL O O 2.960 -7.088 6.703 1.00 . A A . 41 VAL O 1 1 4 3986 1 1 42 HIS C C 4.455 -6.015 4.008 1.00 . A A . 42 HIS C 1 1 4 3987 1 1 42 HIS CA C 3.055 -6.562 3.997 1.00 . A A . 42 HIS CA 1 1 4 3988 1 1 42 HIS CB C 2.431 -6.522 2.602 1.00 . A A . 42 HIS CB 1 1 4 3989 1 1 42 HIS CD2 C 0.946 -8.575 2.052 1.00 . A A . 42 HIS CD2 1 1 4 3990 1 1 42 HIS CE1 C 2.479 -9.848 1.138 1.00 . A A . 42 HIS CE1 1 1 4 3991 1 1 42 HIS CG C 2.112 -7.884 2.069 1.00 . A A . 42 HIS CG 1 1 4 3992 1 1 42 HIS H H 1.651 -5.143 4.649 1.00 . A A . 42 HIS H 1 1 4 3993 1 1 42 HIS HA H 3.125 -7.577 4.312 1.00 . A A . 42 HIS HA 1 1 4 3994 1 1 42 HIS HB2 H 1.507 -5.962 2.646 1.00 . A A . 42 HIS HB2 1 1 4 3995 1 1 42 HIS HB3 H 3.114 -6.042 1.917 1.00 . A A . 42 HIS HB3 1 1 4 3996 1 1 42 HIS HD1 H 3.998 -8.493 1.352 1.00 . A A . 42 HIS HD1 1 1 4 3997 1 1 42 HIS HD2 H -0.008 -8.232 2.427 1.00 . A A . 42 HIS HD2 1 1 4 3998 1 1 42 HIS HE1 H 2.972 -10.684 0.663 1.00 . A A . 42 HIS HE1 1 1 4 3999 1 1 42 HIS HE2 H 0.567 -10.534 1.399 1.00 . A A . 42 HIS HE2 1 1 4 4000 1 1 42 HIS N N 2.218 -5.876 4.956 1.00 . A A . 42 HIS N 1 1 4 4001 1 1 42 HIS ND1 N 3.052 -8.709 1.488 1.00 . A A . 42 HIS ND1 1 1 4 4002 1 1 42 HIS NE2 N 1.203 -9.791 1.470 1.00 . A A . 42 HIS NE2 1 1 4 4003 1 1 42 HIS O O 4.834 -5.194 3.179 1.00 . A A . 42 HIS O 1 1 4 4004 1 1 43 VAL C C 7.453 -6.426 3.974 1.00 . A A . 43 VAL C 1 1 4 4005 1 1 43 VAL CA C 6.596 -6.141 5.191 1.00 . A A . 43 VAL CA 1 1 4 4006 1 1 43 VAL CB C 7.190 -6.873 6.410 1.00 . A A . 43 VAL CB 1 1 4 4007 1 1 43 VAL CG1 C 8.631 -6.448 6.647 1.00 . A A . 43 VAL CG1 1 1 4 4008 1 1 43 VAL CG2 C 6.341 -6.620 7.647 1.00 . A A . 43 VAL CG2 1 1 4 4009 1 1 43 VAL H H 4.773 -7.132 5.616 1.00 . A A . 43 VAL H 1 1 4 4010 1 1 43 VAL HA H 6.636 -5.087 5.381 1.00 . A A . 43 VAL HA 1 1 4 4011 1 1 43 VAL HB H 7.181 -7.934 6.205 1.00 . A A . 43 VAL HB 1 1 4 4012 1 1 43 VAL HG11 H 8.679 -5.374 6.742 1.00 . A A . 43 VAL HG11 1 1 4 4013 1 1 43 VAL HG12 H 9.243 -6.764 5.816 1.00 . A A . 43 VAL HG12 1 1 4 4014 1 1 43 VAL HG13 H 8.995 -6.905 7.555 1.00 . A A . 43 VAL HG13 1 1 4 4015 1 1 43 VAL HG21 H 6.308 -5.560 7.850 1.00 . A A . 43 VAL HG21 1 1 4 4016 1 1 43 VAL HG22 H 6.775 -7.136 8.492 1.00 . A A . 43 VAL HG22 1 1 4 4017 1 1 43 VAL HG23 H 5.340 -6.986 7.478 1.00 . A A . 43 VAL HG23 1 1 4 4018 1 1 43 VAL N N 5.201 -6.512 4.983 1.00 . A A . 43 VAL N 1 1 4 4019 1 1 43 VAL O O 8.264 -7.352 3.965 1.00 . A A . 43 VAL O 1 1 4 4020 1 1 44 ALA C C 9.230 -4.828 1.815 1.00 . A A . 44 ALA C 1 1 4 4021 1 1 44 ALA CA C 8.024 -5.742 1.727 1.00 . A A . 44 ALA CA 1 1 4 4022 1 1 44 ALA CB C 7.174 -5.413 0.510 1.00 . A A . 44 ALA CB 1 1 4 4023 1 1 44 ALA H H 6.564 -4.931 3.004 1.00 . A A . 44 ALA H 1 1 4 4024 1 1 44 ALA HA H 8.367 -6.762 1.647 1.00 . A A . 44 ALA HA 1 1 4 4025 1 1 44 ALA HB1 H 6.259 -5.984 0.546 1.00 . A A . 44 ALA HB1 1 1 4 4026 1 1 44 ALA HB2 H 7.720 -5.662 -0.386 1.00 . A A . 44 ALA HB2 1 1 4 4027 1 1 44 ALA HB3 H 6.941 -4.358 0.509 1.00 . A A . 44 ALA HB3 1 1 4 4028 1 1 44 ALA N N 7.252 -5.624 2.941 1.00 . A A . 44 ALA N 1 1 4 4029 1 1 44 ALA O O 9.486 -4.021 0.921 1.00 . A A . 44 ALA O 1 1 4 4030 1 1 45 GLU C C 12.004 -4.061 1.888 1.00 . A A . 45 GLU C 1 1 4 4031 1 1 45 GLU CA C 11.164 -4.155 3.151 1.00 . A A . 45 GLU CA 1 1 4 4032 1 1 45 GLU CB C 11.994 -4.744 4.295 1.00 . A A . 45 GLU CB 1 1 4 4033 1 1 45 GLU CD C 11.578 -7.176 3.742 1.00 . A A . 45 GLU CD 1 1 4 4034 1 1 45 GLU CG C 12.615 -6.094 3.970 1.00 . A A . 45 GLU CG 1 1 4 4035 1 1 45 GLU H H 9.710 -5.638 3.574 1.00 . A A . 45 GLU H 1 1 4 4036 1 1 45 GLU HA H 10.838 -3.164 3.425 1.00 . A A . 45 GLU HA 1 1 4 4037 1 1 45 GLU HB2 H 12.789 -4.056 4.538 1.00 . A A . 45 GLU HB2 1 1 4 4038 1 1 45 GLU HB3 H 11.357 -4.865 5.159 1.00 . A A . 45 GLU HB3 1 1 4 4039 1 1 45 GLU HG2 H 13.211 -5.996 3.075 1.00 . A A . 45 GLU HG2 1 1 4 4040 1 1 45 GLU HG3 H 13.249 -6.391 4.792 1.00 . A A . 45 GLU HG3 1 1 4 4041 1 1 45 GLU N N 9.971 -4.966 2.913 1.00 . A A . 45 GLU N 1 1 4 4042 1 1 45 GLU O O 12.722 -3.084 1.671 1.00 . A A . 45 GLU O 1 1 4 4043 1 1 45 GLU OE1 O 11.116 -7.322 2.589 1.00 . A A . 45 GLU OE1 1 1 4 4044 1 1 45 GLU OE2 O 11.229 -7.878 4.713 1.00 . A A . 45 GLU OE2 1 1 4 4045 1 1 46 ASP C C 12.042 -4.112 -1.166 1.00 . A A . 46 ASP C 1 1 4 4046 1 1 46 ASP CA C 12.632 -5.124 -0.199 1.00 . A A . 46 ASP CA 1 1 4 4047 1 1 46 ASP CB C 12.579 -6.523 -0.812 1.00 . A A . 46 ASP CB 1 1 4 4048 1 1 46 ASP CG C 13.209 -7.572 0.084 1.00 . A A . 46 ASP CG 1 1 4 4049 1 1 46 ASP H H 11.328 -5.848 1.310 1.00 . A A . 46 ASP H 1 1 4 4050 1 1 46 ASP HA H 13.661 -4.856 -0.010 1.00 . A A . 46 ASP HA 1 1 4 4051 1 1 46 ASP HB2 H 11.550 -6.794 -0.982 1.00 . A A . 46 ASP HB2 1 1 4 4052 1 1 46 ASP HB3 H 13.107 -6.515 -1.753 1.00 . A A . 46 ASP HB3 1 1 4 4053 1 1 46 ASP N N 11.905 -5.090 1.062 1.00 . A A . 46 ASP N 1 1 4 4054 1 1 46 ASP O O 12.763 -3.317 -1.759 1.00 . A A . 46 ASP O 1 1 4 4055 1 1 46 ASP OD1 O 14.450 -7.704 0.063 1.00 . A A . 46 ASP OD1 1 1 4 4056 1 1 46 ASP OD2 O 12.460 -8.261 0.809 1.00 . A A . 46 ASP OD2 1 1 4 4057 1 1 47 VAL C C 10.339 -1.766 -1.792 1.00 . A A . 47 VAL C 1 1 4 4058 1 1 47 VAL CA C 10.048 -3.202 -2.201 1.00 . A A . 47 VAL CA 1 1 4 4059 1 1 47 VAL CB C 8.527 -3.434 -2.221 1.00 . A A . 47 VAL CB 1 1 4 4060 1 1 47 VAL CG1 C 7.849 -2.452 -3.163 1.00 . A A . 47 VAL CG1 1 1 4 4061 1 1 47 VAL CG2 C 8.216 -4.866 -2.624 1.00 . A A . 47 VAL CG2 1 1 4 4062 1 1 47 VAL H H 10.190 -4.762 -0.777 1.00 . A A . 47 VAL H 1 1 4 4063 1 1 47 VAL HA H 10.432 -3.367 -3.199 1.00 . A A . 47 VAL HA 1 1 4 4064 1 1 47 VAL HB H 8.142 -3.269 -1.225 1.00 . A A . 47 VAL HB 1 1 4 4065 1 1 47 VAL HG11 H 8.063 -1.442 -2.845 1.00 . A A . 47 VAL HG11 1 1 4 4066 1 1 47 VAL HG12 H 6.781 -2.616 -3.146 1.00 . A A . 47 VAL HG12 1 1 4 4067 1 1 47 VAL HG13 H 8.221 -2.601 -4.166 1.00 . A A . 47 VAL HG13 1 1 4 4068 1 1 47 VAL HG21 H 7.161 -5.057 -2.488 1.00 . A A . 47 VAL HG21 1 1 4 4069 1 1 47 VAL HG22 H 8.786 -5.544 -2.008 1.00 . A A . 47 VAL HG22 1 1 4 4070 1 1 47 VAL HG23 H 8.478 -5.012 -3.661 1.00 . A A . 47 VAL HG23 1 1 4 4071 1 1 47 VAL N N 10.721 -4.128 -1.304 1.00 . A A . 47 VAL N 1 1 4 4072 1 1 47 VAL O O 10.589 -0.932 -2.628 1.00 . A A . 47 VAL O 1 1 4 4073 1 1 48 ALA C C 12.028 0.148 0.003 1.00 . A A . 48 ALA C 1 1 4 4074 1 1 48 ALA CA C 10.564 -0.233 0.143 1.00 . A A . 48 ALA CA 1 1 4 4075 1 1 48 ALA CB C 10.190 -0.292 1.617 1.00 . A A . 48 ALA CB 1 1 4 4076 1 1 48 ALA H H 10.088 -2.260 0.073 1.00 . A A . 48 ALA H 1 1 4 4077 1 1 48 ALA HA H 9.950 0.520 -0.320 1.00 . A A . 48 ALA HA 1 1 4 4078 1 1 48 ALA HB1 H 9.122 -0.423 1.711 1.00 . A A . 48 ALA HB1 1 1 4 4079 1 1 48 ALA HB2 H 10.483 0.628 2.101 1.00 . A A . 48 ALA HB2 1 1 4 4080 1 1 48 ALA HB3 H 10.697 -1.123 2.085 1.00 . A A . 48 ALA HB3 1 1 4 4081 1 1 48 ALA N N 10.300 -1.531 -0.487 1.00 . A A . 48 ALA N 1 1 4 4082 1 1 48 ALA O O 12.356 1.195 -0.555 1.00 . A A . 48 ALA O 1 1 4 4083 1 1 49 LYS C C 14.739 -0.334 -1.043 1.00 . A A . 49 LYS C 1 1 4 4084 1 1 49 LYS CA C 14.339 -0.456 0.421 1.00 . A A . 49 LYS CA 1 1 4 4085 1 1 49 LYS CB C 15.131 -1.579 1.092 1.00 . A A . 49 LYS CB 1 1 4 4086 1 1 49 LYS CD C 17.382 -2.506 1.726 1.00 . A A . 49 LYS CD 1 1 4 4087 1 1 49 LYS CE C 17.103 -2.491 3.219 1.00 . A A . 49 LYS CE 1 1 4 4088 1 1 49 LYS CG C 16.637 -1.393 1.006 1.00 . A A . 49 LYS CG 1 1 4 4089 1 1 49 LYS H H 12.591 -1.531 0.944 1.00 . A A . 49 LYS H 1 1 4 4090 1 1 49 LYS HA H 14.547 0.477 0.923 1.00 . A A . 49 LYS HA 1 1 4 4091 1 1 49 LYS HB2 H 14.855 -1.626 2.135 1.00 . A A . 49 LYS HB2 1 1 4 4092 1 1 49 LYS HB3 H 14.878 -2.516 0.620 1.00 . A A . 49 LYS HB3 1 1 4 4093 1 1 49 LYS HD2 H 17.068 -3.456 1.321 1.00 . A A . 49 LYS HD2 1 1 4 4094 1 1 49 LYS HD3 H 18.443 -2.377 1.564 1.00 . A A . 49 LYS HD3 1 1 4 4095 1 1 49 LYS HE2 H 17.383 -1.526 3.616 1.00 . A A . 49 LYS HE2 1 1 4 4096 1 1 49 LYS HE3 H 16.047 -2.651 3.378 1.00 . A A . 49 LYS HE3 1 1 4 4097 1 1 49 LYS HG2 H 16.930 -1.392 -0.033 1.00 . A A . 49 LYS HG2 1 1 4 4098 1 1 49 LYS HG3 H 16.899 -0.447 1.455 1.00 . A A . 49 LYS HG3 1 1 4 4099 1 1 49 LYS HZ1 H 17.599 -4.487 3.581 1.00 . A A . 49 LYS HZ1 1 1 4 4100 1 1 49 LYS HZ2 H 17.667 -3.503 4.957 1.00 . A A . 49 LYS HZ2 1 1 4 4101 1 1 49 LYS HZ3 H 18.889 -3.412 3.790 1.00 . A A . 49 LYS HZ3 1 1 4 4102 1 1 49 LYS N N 12.909 -0.709 0.512 1.00 . A A . 49 LYS N 1 1 4 4103 1 1 49 LYS NZ N 17.868 -3.547 3.937 1.00 . A A . 49 LYS NZ 1 1 4 4104 1 1 49 LYS O O 15.687 0.368 -1.392 1.00 . A A . 49 LYS O 1 1 4 4105 1 1 50 ASP C C 13.401 0.071 -3.987 1.00 . A A . 50 ASP C 1 1 4 4106 1 1 50 ASP CA C 14.251 -1.013 -3.323 1.00 . A A . 50 ASP CA 1 1 4 4107 1 1 50 ASP CB C 13.943 -2.381 -3.936 1.00 . A A . 50 ASP CB 1 1 4 4108 1 1 50 ASP CG C 14.578 -2.560 -5.301 1.00 . A A . 50 ASP CG 1 1 4 4109 1 1 50 ASP H H 13.273 -1.587 -1.547 1.00 . A A . 50 ASP H 1 1 4 4110 1 1 50 ASP HA H 15.295 -0.784 -3.478 1.00 . A A . 50 ASP HA 1 1 4 4111 1 1 50 ASP HB2 H 14.313 -3.157 -3.276 1.00 . A A . 50 ASP HB2 1 1 4 4112 1 1 50 ASP HB3 H 12.872 -2.486 -4.040 1.00 . A A . 50 ASP HB3 1 1 4 4113 1 1 50 ASP N N 14.007 -1.041 -1.893 1.00 . A A . 50 ASP N 1 1 4 4114 1 1 50 ASP O O 13.660 0.467 -5.124 1.00 . A A . 50 ASP O 1 1 4 4115 1 1 50 ASP OD1 O 15.737 -3.021 -5.360 1.00 . A A . 50 ASP OD1 1 1 4 4116 1 1 50 ASP OD2 O 13.917 -2.238 -6.311 1.00 . A A . 50 ASP OD2 1 1 4 4117 1 1 51 TYR C C 12.132 2.942 -3.632 1.00 . A A . 51 TYR C 1 1 4 4118 1 1 51 TYR CA C 11.495 1.574 -3.782 1.00 . A A . 51 TYR CA 1 1 4 4119 1 1 51 TYR CB C 10.151 1.592 -3.057 1.00 . A A . 51 TYR CB 1 1 4 4120 1 1 51 TYR CD1 C 9.279 0.061 -4.880 1.00 . A A . 51 TYR CD1 1 1 4 4121 1 1 51 TYR CD2 C 7.694 0.946 -3.330 1.00 . A A . 51 TYR CD2 1 1 4 4122 1 1 51 TYR CE1 C 8.268 -0.623 -5.527 1.00 . A A . 51 TYR CE1 1 1 4 4123 1 1 51 TYR CE2 C 6.680 0.265 -3.979 1.00 . A A . 51 TYR CE2 1 1 4 4124 1 1 51 TYR CG C 9.016 0.859 -3.767 1.00 . A A . 51 TYR CG 1 1 4 4125 1 1 51 TYR CZ C 6.914 -0.443 -5.058 1.00 . A A . 51 TYR CZ 1 1 4 4126 1 1 51 TYR H H 12.215 0.194 -2.380 1.00 . A A . 51 TYR H 1 1 4 4127 1 1 51 TYR HA H 11.326 1.350 -4.799 1.00 . A A . 51 TYR HA 1 1 4 4128 1 1 51 TYR HB2 H 10.287 1.140 -2.103 1.00 . A A . 51 TYR HB2 1 1 4 4129 1 1 51 TYR HB3 H 9.842 2.617 -2.917 1.00 . A A . 51 TYR HB3 1 1 4 4130 1 1 51 TYR HD1 H 10.292 -0.018 -5.243 1.00 . A A . 51 TYR HD1 1 1 4 4131 1 1 51 TYR HD2 H 7.456 1.562 -2.481 1.00 . A A . 51 TYR HD2 1 1 4 4132 1 1 51 TYR HE1 H 8.496 -1.235 -6.387 1.00 . A A . 51 TYR HE1 1 1 4 4133 1 1 51 TYR HE2 H 5.663 0.346 -3.623 1.00 . A A . 51 TYR HE2 1 1 4 4134 1 1 51 TYR HH H 5.236 -0.603 -5.896 1.00 . A A . 51 TYR HH 1 1 4 4135 1 1 51 TYR N N 12.379 0.547 -3.268 1.00 . A A . 51 TYR N 1 1 4 4136 1 1 51 TYR O O 12.497 3.594 -4.610 1.00 . A A . 51 TYR O 1 1 4 4137 1 1 51 TYR OH O 5.966 -1.201 -5.718 1.00 . A A . 51 TYR OH 1 1 4 4138 1 1 52 GLU C C 14.361 4.590 -1.983 1.00 . A A . 52 GLU C 1 1 4 4139 1 1 52 GLU CA C 12.840 4.659 -2.061 1.00 . A A . 52 GLU CA 1 1 4 4140 1 1 52 GLU CB C 12.274 5.189 -0.738 1.00 . A A . 52 GLU CB 1 1 4 4141 1 1 52 GLU CD C 12.342 5.120 1.790 1.00 . A A . 52 GLU CD 1 1 4 4142 1 1 52 GLU CG C 12.835 4.499 0.498 1.00 . A A . 52 GLU CG 1 1 4 4143 1 1 52 GLU H H 11.994 2.766 -1.644 1.00 . A A . 52 GLU H 1 1 4 4144 1 1 52 GLU HA H 12.558 5.327 -2.851 1.00 . A A . 52 GLU HA 1 1 4 4145 1 1 52 GLU HB2 H 12.495 6.244 -0.663 1.00 . A A . 52 GLU HB2 1 1 4 4146 1 1 52 GLU HB3 H 11.202 5.057 -0.740 1.00 . A A . 52 GLU HB3 1 1 4 4147 1 1 52 GLU HG2 H 12.540 3.460 0.480 1.00 . A A . 52 GLU HG2 1 1 4 4148 1 1 52 GLU HG3 H 13.912 4.566 0.474 1.00 . A A . 52 GLU HG3 1 1 4 4149 1 1 52 GLU N N 12.272 3.360 -2.376 1.00 . A A . 52 GLU N 1 1 4 4150 1 1 52 GLU O O 15.062 5.456 -2.508 1.00 . A A . 52 GLU O 1 1 4 4151 1 1 52 GLU OE1 O 12.670 6.296 2.046 1.00 . A A . 52 GLU OE1 1 1 4 4152 1 1 52 GLU OE2 O 11.628 4.428 2.546 1.00 . A A . 52 GLU OE2 1 1 4 4153 1 1 53 ASP C C 16.899 2.602 -2.337 1.00 . A A . 53 ASP C 1 1 4 4154 1 1 53 ASP CA C 16.291 3.363 -1.154 1.00 . A A . 53 ASP CA 1 1 4 4155 1 1 53 ASP CB C 16.552 2.626 0.164 1.00 . A A . 53 ASP CB 1 1 4 4156 1 1 53 ASP CG C 17.986 2.146 0.306 1.00 . A A . 53 ASP CG 1 1 4 4157 1 1 53 ASP H H 14.242 2.898 -0.935 1.00 . A A . 53 ASP H 1 1 4 4158 1 1 53 ASP HA H 16.748 4.339 -1.102 1.00 . A A . 53 ASP HA 1 1 4 4159 1 1 53 ASP HB2 H 16.339 3.294 0.985 1.00 . A A . 53 ASP HB2 1 1 4 4160 1 1 53 ASP HB3 H 15.892 1.773 0.226 1.00 . A A . 53 ASP HB3 1 1 4 4161 1 1 53 ASP N N 14.858 3.554 -1.322 1.00 . A A . 53 ASP N 1 1 4 4162 1 1 53 ASP O O 18.121 2.496 -2.447 1.00 . A A . 53 ASP O 1 1 4 4163 1 1 53 ASP OD1 O 18.836 2.941 0.760 1.00 . A A . 53 ASP OD1 1 1 4 4164 1 1 53 ASP OD2 O 18.256 0.975 -0.034 1.00 . A A . 53 ASP OD2 1 1 4 4165 1 1 54 GLY C C 16.891 2.268 -5.522 1.00 . A A . 54 GLY C 1 1 4 4166 1 1 54 GLY CA C 16.548 1.347 -4.368 1.00 . A A . 54 GLY CA 1 1 4 4167 1 1 54 GLY H H 15.087 2.177 -3.084 1.00 . A A . 54 GLY H 1 1 4 4168 1 1 54 GLY HA2 H 17.433 0.799 -4.081 1.00 . A A . 54 GLY HA2 1 1 4 4169 1 1 54 GLY HA3 H 15.794 0.647 -4.692 1.00 . A A . 54 GLY HA3 1 1 4 4170 1 1 54 GLY N N 16.052 2.076 -3.216 1.00 . A A . 54 GLY N 1 1 4 4171 1 1 54 GLY O O 17.827 2.007 -6.276 1.00 . A A . 54 GLY O 1 1 4 4172 1 1 55 LEU C C 17.431 5.321 -6.325 1.00 . A A . 55 LEU C 1 1 4 4173 1 1 55 LEU CA C 16.353 4.318 -6.722 1.00 . A A . 55 LEU CA 1 1 4 4174 1 1 55 LEU CB C 15.055 5.055 -7.050 1.00 . A A . 55 LEU CB 1 1 4 4175 1 1 55 LEU CD1 C 15.610 5.601 -9.434 1.00 . A A . 55 LEU CD1 1 1 4 4176 1 1 55 LEU CD2 C 13.885 6.941 -8.216 1.00 . A A . 55 LEU CD2 1 1 4 4177 1 1 55 LEU CG C 15.190 6.171 -8.088 1.00 . A A . 55 LEU CG 1 1 4 4178 1 1 55 LEU H H 15.397 3.499 -5.021 1.00 . A A . 55 LEU H 1 1 4 4179 1 1 55 LEU HA H 16.683 3.777 -7.596 1.00 . A A . 55 LEU HA 1 1 4 4180 1 1 55 LEU HB2 H 14.339 4.334 -7.419 1.00 . A A . 55 LEU HB2 1 1 4 4181 1 1 55 LEU HB3 H 14.669 5.487 -6.139 1.00 . A A . 55 LEU HB3 1 1 4 4182 1 1 55 LEU HD11 H 16.547 5.075 -9.325 1.00 . A A . 55 LEU HD11 1 1 4 4183 1 1 55 LEU HD12 H 15.730 6.406 -10.145 1.00 . A A . 55 LEU HD12 1 1 4 4184 1 1 55 LEU HD13 H 14.853 4.918 -9.788 1.00 . A A . 55 LEU HD13 1 1 4 4185 1 1 55 LEU HD21 H 13.639 7.394 -7.266 1.00 . A A . 55 LEU HD21 1 1 4 4186 1 1 55 LEU HD22 H 13.094 6.266 -8.507 1.00 . A A . 55 LEU HD22 1 1 4 4187 1 1 55 LEU HD23 H 13.993 7.713 -8.964 1.00 . A A . 55 LEU HD23 1 1 4 4188 1 1 55 LEU HG H 15.956 6.862 -7.766 1.00 . A A . 55 LEU HG 1 1 4 4189 1 1 55 LEU N N 16.128 3.349 -5.656 1.00 . A A . 55 LEU N 1 1 4 4190 1 1 55 LEU O O 18.513 5.350 -6.913 1.00 . A A . 55 LEU O 1 1 4 4191 1 1 56 GLU C C 18.991 6.566 -3.782 1.00 . A A . 56 GLU C 1 1 4 4192 1 1 56 GLU CA C 18.070 7.146 -4.849 1.00 . A A . 56 GLU CA 1 1 4 4193 1 1 56 GLU CB C 17.318 8.358 -4.294 1.00 . A A . 56 GLU CB 1 1 4 4194 1 1 56 GLU CD C 15.682 9.248 -2.591 1.00 . A A . 56 GLU CD 1 1 4 4195 1 1 56 GLU CG C 16.367 8.020 -3.157 1.00 . A A . 56 GLU CG 1 1 4 4196 1 1 56 GLU H H 16.249 6.068 -4.896 1.00 . A A . 56 GLU H 1 1 4 4197 1 1 56 GLU HA H 18.670 7.459 -5.690 1.00 . A A . 56 GLU HA 1 1 4 4198 1 1 56 GLU HB2 H 18.037 9.078 -3.932 1.00 . A A . 56 GLU HB2 1 1 4 4199 1 1 56 GLU HB3 H 16.744 8.806 -5.093 1.00 . A A . 56 GLU HB3 1 1 4 4200 1 1 56 GLU HG2 H 15.611 7.343 -3.526 1.00 . A A . 56 GLU HG2 1 1 4 4201 1 1 56 GLU HG3 H 16.925 7.541 -2.367 1.00 . A A . 56 GLU HG3 1 1 4 4202 1 1 56 GLU N N 17.128 6.141 -5.325 1.00 . A A . 56 GLU N 1 1 4 4203 1 1 56 GLU O O 19.027 7.042 -2.648 1.00 . A A . 56 GLU O 1 1 4 4204 1 1 56 GLU OE1 O 16.233 9.855 -1.649 1.00 . A A . 56 GLU OE1 1 1 4 4205 1 1 56 GLU OE2 O 14.593 9.603 -3.091 1.00 . A A . 56 GLU OE2 1 1 4 4206 1 1 57 TYR C C 22.001 5.614 -3.201 1.00 . A A . 57 TYR C 1 1 4 4207 1 1 57 TYR CA C 20.664 4.882 -3.243 1.00 . A A . 57 TYR CA 1 1 4 4208 1 1 57 TYR CB C 20.880 3.426 -3.660 1.00 . A A . 57 TYR CB 1 1 4 4209 1 1 57 TYR CD1 C 23.164 2.636 -2.932 1.00 . A A . 57 TYR CD1 1 1 4 4210 1 1 57 TYR CD2 C 21.274 1.947 -1.652 1.00 . A A . 57 TYR CD2 1 1 4 4211 1 1 57 TYR CE1 C 23.999 1.931 -2.084 1.00 . A A . 57 TYR CE1 1 1 4 4212 1 1 57 TYR CE2 C 22.103 1.242 -0.800 1.00 . A A . 57 TYR CE2 1 1 4 4213 1 1 57 TYR CG C 21.790 2.656 -2.730 1.00 . A A . 57 TYR CG 1 1 4 4214 1 1 57 TYR CZ C 23.464 1.237 -1.021 1.00 . A A . 57 TYR CZ 1 1 4 4215 1 1 57 TYR H H 19.668 5.209 -5.082 1.00 . A A . 57 TYR H 1 1 4 4216 1 1 57 TYR HA H 20.224 4.903 -2.257 1.00 . A A . 57 TYR HA 1 1 4 4217 1 1 57 TYR HB2 H 19.926 2.920 -3.683 1.00 . A A . 57 TYR HB2 1 1 4 4218 1 1 57 TYR HB3 H 21.317 3.403 -4.647 1.00 . A A . 57 TYR HB3 1 1 4 4219 1 1 57 TYR HD1 H 23.581 3.181 -3.765 1.00 . A A . 57 TYR HD1 1 1 4 4220 1 1 57 TYR HD2 H 20.208 1.953 -1.481 1.00 . A A . 57 TYR HD2 1 1 4 4221 1 1 57 TYR HE1 H 25.065 1.928 -2.258 1.00 . A A . 57 TYR HE1 1 1 4 4222 1 1 57 TYR HE2 H 21.683 0.697 0.033 1.00 . A A . 57 TYR HE2 1 1 4 4223 1 1 57 TYR HH H 23.898 -0.319 0.021 1.00 . A A . 57 TYR HH 1 1 4 4224 1 1 57 TYR N N 19.739 5.536 -4.160 1.00 . A A . 57 TYR N 1 1 4 4225 1 1 57 TYR O O 22.150 6.526 -2.362 1.00 . A A . 57 TYR O 1 1 4 4226 1 1 57 TYR OXT O 22.889 5.269 -4.009 1.00 . A A . 57 TYR OXT 1 1 4 4227 1 1 57 TYR OH O 24.291 0.534 -0.176 1.00 . A A . 57 TYR OH 1 1 4 4228 2 2 1 ALA C C -13.906 -8.124 -0.115 1.00 . B B . 1 ALA C 1 1 4 4229 2 2 1 ALA CA C -13.353 -9.527 -0.349 1.00 . B B . 1 ALA CA 1 1 4 4230 2 2 1 ALA CB C -12.725 -9.621 -1.731 1.00 . B B . 1 ALA CB 1 1 4 4231 2 2 1 ALA H1 H -15.154 -10.415 -0.916 1.00 . B B . 1 ALA H1 1 1 4 4232 2 2 1 ALA H2 H -14.853 -10.478 0.747 1.00 . B B . 1 ALA H2 1 1 4 4233 2 2 1 ALA H3 H -14.014 -11.505 -0.303 1.00 . B B . 1 ALA H3 1 1 4 4234 2 2 1 ALA HA H -12.583 -9.724 0.384 1.00 . B B . 1 ALA HA 1 1 4 4235 2 2 1 ALA HB1 H -12.347 -10.621 -1.888 1.00 . B B . 1 ALA HB1 1 1 4 4236 2 2 1 ALA HB2 H -11.912 -8.914 -1.806 1.00 . B B . 1 ALA HB2 1 1 4 4237 2 2 1 ALA HB3 H -13.469 -9.395 -2.481 1.00 . B B . 1 ALA HB3 1 1 4 4238 2 2 1 ALA N N -14.418 -10.552 -0.195 1.00 . B B . 1 ALA N 1 1 4 4239 2 2 1 ALA O O -14.289 -7.435 -1.060 1.00 . B B . 1 ALA O 1 1 4 4240 2 2 2 PRO C C -13.762 -5.240 0.739 1.00 . B B . 2 PRO C 1 1 4 4241 2 2 2 PRO CA C -14.466 -6.355 1.511 1.00 . B B . 2 PRO CA 1 1 4 4242 2 2 2 PRO CB C -14.162 -6.246 3.007 1.00 . B B . 2 PRO CB 1 1 4 4243 2 2 2 PRO CD C -13.523 -8.445 2.341 1.00 . B B . 2 PRO CD 1 1 4 4244 2 2 2 PRO CG C -14.100 -7.656 3.482 1.00 . B B . 2 PRO CG 1 1 4 4245 2 2 2 PRO HA H -15.532 -6.283 1.350 1.00 . B B . 2 PRO HA 1 1 4 4246 2 2 2 PRO HB2 H -13.220 -5.737 3.151 1.00 . B B . 2 PRO HB2 1 1 4 4247 2 2 2 PRO HB3 H -14.953 -5.700 3.499 1.00 . B B . 2 PRO HB3 1 1 4 4248 2 2 2 PRO HD2 H -12.445 -8.475 2.408 1.00 . B B . 2 PRO HD2 1 1 4 4249 2 2 2 PRO HD3 H -13.931 -9.445 2.327 1.00 . B B . 2 PRO HD3 1 1 4 4250 2 2 2 PRO HG2 H -13.459 -7.725 4.348 1.00 . B B . 2 PRO HG2 1 1 4 4251 2 2 2 PRO HG3 H -15.093 -8.009 3.717 1.00 . B B . 2 PRO HG3 1 1 4 4252 2 2 2 PRO N N -13.957 -7.684 1.154 1.00 . B B . 2 PRO N 1 1 4 4253 2 2 2 PRO O O -12.589 -5.365 0.388 1.00 . B B . 2 PRO O 1 1 4 4254 2 2 3 PRO C C -12.853 -2.248 0.529 1.00 . B B . 3 PRO C 1 1 4 4255 2 2 3 PRO CA C -13.915 -2.995 -0.270 1.00 . B B . 3 PRO CA 1 1 4 4256 2 2 3 PRO CB C -15.130 -2.096 -0.512 1.00 . B B . 3 PRO CB 1 1 4 4257 2 2 3 PRO CD C -15.877 -3.900 0.861 1.00 . B B . 3 PRO CD 1 1 4 4258 2 2 3 PRO CG C -16.072 -2.435 0.590 1.00 . B B . 3 PRO CG 1 1 4 4259 2 2 3 PRO HA H -13.499 -3.304 -1.217 1.00 . B B . 3 PRO HA 1 1 4 4260 2 2 3 PRO HB2 H -14.829 -1.060 -0.473 1.00 . B B . 3 PRO HB2 1 1 4 4261 2 2 3 PRO HB3 H -15.557 -2.319 -1.478 1.00 . B B . 3 PRO HB3 1 1 4 4262 2 2 3 PRO HD2 H -16.024 -4.112 1.911 1.00 . B B . 3 PRO HD2 1 1 4 4263 2 2 3 PRO HD3 H -16.550 -4.489 0.256 1.00 . B B . 3 PRO HD3 1 1 4 4264 2 2 3 PRO HG2 H -15.833 -1.854 1.469 1.00 . B B . 3 PRO HG2 1 1 4 4265 2 2 3 PRO HG3 H -17.088 -2.243 0.278 1.00 . B B . 3 PRO HG3 1 1 4 4266 2 2 3 PRO N N -14.474 -4.133 0.468 1.00 . B B . 3 PRO N 1 1 4 4267 2 2 3 PRO O O -13.110 -1.171 1.067 1.00 . B B . 3 PRO O 1 1 4 4268 2 2 4 GLY C C -9.222 -2.421 0.658 1.00 . B B . 4 GLY C 1 1 4 4269 2 2 4 GLY CA C -10.567 -2.210 1.328 1.00 . B B . 4 GLY CA 1 1 4 4270 2 2 4 GLY H H -11.519 -3.689 0.151 1.00 . B B . 4 GLY H 1 1 4 4271 2 2 4 GLY HA2 H -10.754 -1.150 1.409 1.00 . B B . 4 GLY HA2 1 1 4 4272 2 2 4 GLY HA3 H -10.530 -2.632 2.322 1.00 . B B . 4 GLY HA3 1 1 4 4273 2 2 4 GLY N N -11.660 -2.829 0.599 1.00 . B B . 4 GLY N 1 1 4 4274 2 2 4 GLY O O -8.179 -2.174 1.261 1.00 . B B . 4 GLY O 1 1 4 4275 2 2 5 THR C C -8.237 -3.013 -2.837 1.00 . B B . 5 THR C 1 1 4 4276 2 2 5 THR CA C -8.017 -3.140 -1.335 1.00 . B B . 5 THR CA 1 1 4 4277 2 2 5 THR CB C -7.454 -4.539 -1.029 1.00 . B B . 5 THR CB 1 1 4 4278 2 2 5 THR CG2 C -7.539 -6.728 0.051 1.00 . B B . 5 THR CG2 1 1 4 4279 2 2 5 THR H H -10.107 -3.041 -1.023 1.00 . B B . 5 THR H 1 1 4 4280 2 2 5 THR HA H -7.288 -2.405 -1.033 1.00 . B B . 5 THR HA 1 1 4 4281 2 2 5 THR HB H -7.162 -4.573 0.011 1.00 . B B . 5 THR HB 1 1 4 4282 2 2 5 THR HG1 H -6.992 -4.981 1.803 1.00 . B B . 5 THR HG1 1 1 4 4283 2 2 5 THR HG21 H -7.639 -7.130 1.049 1.00 . B B . 5 THR HG21 1 1 4 4284 2 2 5 THR HG22 H -7.280 -7.523 -0.632 1.00 . B B . 5 THR HG22 1 1 4 4285 2 2 5 THR HG23 H -8.476 -6.284 -0.253 1.00 . B B . 5 THR HG23 1 1 4 4286 2 2 5 THR N N -9.245 -2.888 -0.588 1.00 . B B . 5 THR N 1 1 4 4287 2 2 5 THR O O -9.320 -3.317 -3.341 1.00 . B B . 5 THR O 1 1 4 4288 2 2 5 THR OG1 O -6.787 -4.614 0.941 1.00 . B B . 5 THR OG1 1 1 4 4289 2 2 6 ALA C C -5.975 -2.629 -5.715 1.00 . B B . 6 ALA C 1 1 4 4290 2 2 6 ALA CA C -7.312 -2.414 -5.000 1.00 . B B . 6 ALA CA 1 1 4 4291 2 2 6 ALA CB C -7.881 -1.052 -5.345 1.00 . B B . 6 ALA CB 1 1 4 4292 2 2 6 ALA H H -6.381 -2.304 -3.096 1.00 . B B . 6 ALA H 1 1 4 4293 2 2 6 ALA HA H -8.011 -3.158 -5.353 1.00 . B B . 6 ALA HA 1 1 4 4294 2 2 6 ALA HB1 H -8.657 -0.798 -4.641 1.00 . B B . 6 ALA HB1 1 1 4 4295 2 2 6 ALA HB2 H -8.293 -1.074 -6.344 1.00 . B B . 6 ALA HB2 1 1 4 4296 2 2 6 ALA HB3 H -7.099 -0.315 -5.297 1.00 . B B . 6 ALA HB3 1 1 4 4297 2 2 6 ALA N N -7.210 -2.561 -3.552 1.00 . B B . 6 ALA N 1 1 4 4298 2 2 6 ALA O O -5.753 -3.680 -6.316 1.00 . B B . 6 ALA O 1 1 4 4299 2 2 7 ARG C C -2.977 -2.919 -5.815 1.00 . B B . 7 ARG C 1 1 4 4300 2 2 7 ARG CA C -3.794 -1.730 -6.326 1.00 . B B . 7 ARG CA 1 1 4 4301 2 2 7 ARG CB C -3.012 -0.418 -6.193 1.00 . B B . 7 ARG CB 1 1 4 4302 2 2 7 ARG CD C -3.931 0.647 -8.283 1.00 . B B . 7 ARG CD 1 1 4 4303 2 2 7 ARG CG C -3.727 0.790 -6.783 1.00 . B B . 7 ARG CG 1 1 4 4304 2 2 7 ARG CZ C -5.286 -0.684 -9.844 1.00 . B B . 7 ARG CZ 1 1 4 4305 2 2 7 ARG H H -5.298 -0.832 -5.139 1.00 . B B . 7 ARG H 1 1 4 4306 2 2 7 ARG HA H -3.997 -1.899 -7.373 1.00 . B B . 7 ARG HA 1 1 4 4307 2 2 7 ARG HB2 H -2.830 -0.222 -5.148 1.00 . B B . 7 ARG HB2 1 1 4 4308 2 2 7 ARG HB3 H -2.063 -0.525 -6.698 1.00 . B B . 7 ARG HB3 1 1 4 4309 2 2 7 ARG HD2 H -4.172 1.617 -8.694 1.00 . B B . 7 ARG HD2 1 1 4 4310 2 2 7 ARG HD3 H -3.013 0.290 -8.725 1.00 . B B . 7 ARG HD3 1 1 4 4311 2 2 7 ARG HE H -5.551 -0.627 -7.868 1.00 . B B . 7 ARG HE 1 1 4 4312 2 2 7 ARG HG2 H -4.692 0.890 -6.308 1.00 . B B . 7 ARG HG2 1 1 4 4313 2 2 7 ARG HG3 H -3.138 1.674 -6.590 1.00 . B B . 7 ARG HG3 1 1 4 4314 2 2 7 ARG HH11 H -3.809 0.395 -10.704 1.00 . B B . 7 ARG HH11 1 1 4 4315 2 2 7 ARG HH12 H -4.774 -0.544 -11.794 1.00 . B B . 7 ARG HH12 1 1 4 4316 2 2 7 ARG HH21 H -6.830 -1.867 -9.294 1.00 . B B . 7 ARG HH21 1 1 4 4317 2 2 7 ARG HH22 H -6.493 -1.829 -10.993 1.00 . B B . 7 ARG HH22 1 1 4 4318 2 2 7 ARG N N -5.086 -1.636 -5.653 1.00 . B B . 7 ARG N 1 1 4 4319 2 2 7 ARG NE N -5.007 -0.285 -8.608 1.00 . B B . 7 ARG NE 1 1 4 4320 2 2 7 ARG NH1 N -4.564 -0.241 -10.864 1.00 . B B . 7 ARG NH1 1 1 4 4321 2 2 7 ARG NH2 N -6.285 -1.530 -10.061 1.00 . B B . 7 ARG NH2 1 1 4 4322 2 2 7 ARG O O -3.249 -4.058 -6.197 1.00 . B B . 7 ARG O 1 1 4 4323 2 2 8 ARG C C -0.547 -4.546 -5.601 1.00 . B B . 8 ARG C 1 1 4 4324 2 2 8 ARG CA C -1.165 -3.767 -4.441 1.00 . B B . 8 ARG CA 1 1 4 4325 2 2 8 ARG CB C -2.008 -4.691 -3.562 1.00 . B B . 8 ARG CB 1 1 4 4326 2 2 8 ARG CD C -3.240 -4.892 -1.380 1.00 . B B . 8 ARG CD 1 1 4 4327 2 2 8 ARG CG C -2.072 -4.248 -2.109 1.00 . B B . 8 ARG CG 1 1 4 4328 2 2 8 ARG CZ C -4.104 -7.146 -0.919 1.00 . B B . 8 ARG CZ 1 1 4 4329 2 2 8 ARG H H -1.813 -1.766 -4.639 1.00 . B B . 8 ARG H 1 1 4 4330 2 2 8 ARG HA H -0.372 -3.338 -3.847 1.00 . B B . 8 ARG HA 1 1 4 4331 2 2 8 ARG HB2 H -3.016 -4.716 -3.951 1.00 . B B . 8 ARG HB2 1 1 4 4332 2 2 8 ARG HB3 H -1.591 -5.686 -3.596 1.00 . B B . 8 ARG HB3 1 1 4 4333 2 2 8 ARG HD2 H -3.143 -4.688 -0.323 1.00 . B B . 8 ARG HD2 1 1 4 4334 2 2 8 ARG HD3 H -4.157 -4.457 -1.746 1.00 . B B . 8 ARG HD3 1 1 4 4335 2 2 8 ARG HE H -2.677 -6.722 -2.246 1.00 . B B . 8 ARG HE 1 1 4 4336 2 2 8 ARG HG2 H -1.154 -4.528 -1.616 1.00 . B B . 8 ARG HG2 1 1 4 4337 2 2 8 ARG HG3 H -2.187 -3.174 -2.076 1.00 . B B . 8 ARG HG3 1 1 4 4338 2 2 8 ARG HH11 H -4.939 -5.672 0.185 1.00 . B B . 8 ARG HH11 1 1 4 4339 2 2 8 ARG HH12 H -5.549 -7.265 0.489 1.00 . B B . 8 ARG HH12 1 1 4 4340 2 2 8 ARG HH21 H -3.473 -8.821 -1.855 1.00 . B B . 8 ARG HH21 1 1 4 4341 2 2 8 ARG HH22 H -4.715 -9.056 -0.670 1.00 . B B . 8 ARG HH22 1 1 4 4342 2 2 8 ARG N N -1.987 -2.679 -4.948 1.00 . B B . 8 ARG N 1 1 4 4343 2 2 8 ARG NE N -3.285 -6.336 -1.581 1.00 . B B . 8 ARG NE 1 1 4 4344 2 2 8 ARG NH1 N -4.932 -6.654 -0.007 1.00 . B B . 8 ARG NH1 1 1 4 4345 2 2 8 ARG NH2 N -4.097 -8.447 -1.168 1.00 . B B . 8 ARG NH2 1 1 4 4346 2 2 8 ARG O O -0.918 -4.347 -6.757 1.00 . B B . 8 ARG O 1 1 4 4347 2 2 9 LYS C C 1.391 -7.619 -5.835 1.00 . B B . 9 LYS C 1 1 4 4348 2 2 9 LYS CA C 1.059 -6.212 -6.334 1.00 . B B . 9 LYS CA 1 1 4 4349 2 2 9 LYS CB C 2.334 -5.505 -6.798 1.00 . B B . 9 LYS CB 1 1 4 4350 2 2 9 LYS CD C 3.384 -3.458 -7.810 1.00 . B B . 9 LYS CD 1 1 4 4351 2 2 9 LYS CE C 3.150 -2.044 -8.318 1.00 . B B . 9 LYS CE 1 1 4 4352 2 2 9 LYS CG C 2.098 -4.088 -7.297 1.00 . B B . 9 LYS CG 1 1 4 4353 2 2 9 LYS H H 0.665 -5.544 -4.360 1.00 . B B . 9 LYS H 1 1 4 4354 2 2 9 LYS HA H 0.376 -6.289 -7.167 1.00 . B B . 9 LYS HA 1 1 4 4355 2 2 9 LYS HB2 H 3.029 -5.460 -5.972 1.00 . B B . 9 LYS HB2 1 1 4 4356 2 2 9 LYS HB3 H 2.780 -6.074 -7.599 1.00 . B B . 9 LYS HB3 1 1 4 4357 2 2 9 LYS HD2 H 4.104 -3.427 -7.006 1.00 . B B . 9 LYS HD2 1 1 4 4358 2 2 9 LYS HD3 H 3.770 -4.061 -8.618 1.00 . B B . 9 LYS HD3 1 1 4 4359 2 2 9 LYS HE2 H 2.736 -1.451 -7.515 1.00 . B B . 9 LYS HE2 1 1 4 4360 2 2 9 LYS HE3 H 4.097 -1.623 -8.623 1.00 . B B . 9 LYS HE3 1 1 4 4361 2 2 9 LYS HG2 H 1.377 -4.115 -8.100 1.00 . B B . 9 LYS HG2 1 1 4 4362 2 2 9 LYS HG3 H 1.713 -3.490 -6.485 1.00 . B B . 9 LYS HG3 1 1 4 4363 2 2 9 LYS HZ1 H 2.584 -2.598 -10.251 1.00 . B B . 9 LYS HZ1 1 1 4 4364 2 2 9 LYS HZ2 H 2.091 -1.039 -9.812 1.00 . B B . 9 LYS HZ2 1 1 4 4365 2 2 9 LYS HZ3 H 1.282 -2.387 -9.190 1.00 . B B . 9 LYS HZ3 1 1 4 4366 2 2 9 LYS N N 0.401 -5.424 -5.297 1.00 . B B . 9 LYS N 1 1 4 4367 2 2 9 LYS NZ N 2.212 -2.015 -9.473 1.00 . B B . 9 LYS NZ 1 1 4 4368 2 2 9 LYS O O 0.925 -8.034 -4.775 1.00 . B B . 9 LYS O 1 1 4 4369 2 2 10 ARG C C 3.026 -9.783 -4.786 1.00 . B B . 10 ARG C 1 1 4 4370 2 2 10 ARG CA C 2.597 -9.708 -6.246 1.00 . B B . 10 ARG CA 1 1 4 4371 2 2 10 ARG CB C 3.753 -10.158 -7.138 1.00 . B B . 10 ARG CB 1 1 4 4372 2 2 10 ARG CD C 6.115 -9.731 -7.900 1.00 . B B . 10 ARG CD 1 1 4 4373 2 2 10 ARG CG C 4.930 -9.196 -7.114 1.00 . B B . 10 ARG CG 1 1 4 4374 2 2 10 ARG CZ C 8.425 -9.052 -8.405 1.00 . B B . 10 ARG CZ 1 1 4 4375 2 2 10 ARG H H 2.529 -7.969 -7.446 1.00 . B B . 10 ARG H 1 1 4 4376 2 2 10 ARG HA H 1.753 -10.362 -6.402 1.00 . B B . 10 ARG HA 1 1 4 4377 2 2 10 ARG HB2 H 4.097 -11.127 -6.804 1.00 . B B . 10 ARG HB2 1 1 4 4378 2 2 10 ARG HB3 H 3.401 -10.239 -8.157 1.00 . B B . 10 ARG HB3 1 1 4 4379 2 2 10 ARG HD2 H 6.474 -10.631 -7.420 1.00 . B B . 10 ARG HD2 1 1 4 4380 2 2 10 ARG HD3 H 5.791 -9.963 -8.903 1.00 . B B . 10 ARG HD3 1 1 4 4381 2 2 10 ARG HE H 7.017 -7.847 -7.668 1.00 . B B . 10 ARG HE 1 1 4 4382 2 2 10 ARG HG2 H 4.622 -8.256 -7.546 1.00 . B B . 10 ARG HG2 1 1 4 4383 2 2 10 ARG HG3 H 5.230 -9.040 -6.087 1.00 . B B . 10 ARG HG3 1 1 4 4384 2 2 10 ARG HH11 H 8.010 -10.992 -8.788 1.00 . B B . 10 ARG HH11 1 1 4 4385 2 2 10 ARG HH12 H 9.631 -10.495 -9.142 1.00 . B B . 10 ARG HH12 1 1 4 4386 2 2 10 ARG HH21 H 9.149 -7.184 -8.132 1.00 . B B . 10 ARG HH21 1 1 4 4387 2 2 10 ARG HH22 H 10.278 -8.330 -8.769 1.00 . B B . 10 ARG HH22 1 1 4 4388 2 2 10 ARG N N 2.196 -8.350 -6.608 1.00 . B B . 10 ARG N 1 1 4 4389 2 2 10 ARG NE N 7.206 -8.761 -7.965 1.00 . B B . 10 ARG NE 1 1 4 4390 2 2 10 ARG NH1 N 8.712 -10.281 -8.811 1.00 . B B . 10 ARG NH1 1 1 4 4391 2 2 10 ARG NH2 N 9.361 -8.111 -8.438 1.00 . B B . 10 ARG NH2 1 1 4 4392 2 2 10 ARG O O 2.893 -10.821 -4.138 1.00 . B B . 10 ARG O 1 1 4 4393 2 2 11 LYS C C 5.329 -9.324 -2.733 1.00 . B B . 11 LYS C 1 1 4 4394 2 2 11 LYS CA C 4.000 -8.595 -2.893 1.00 . B B . 11 LYS CA 1 1 4 4395 2 2 11 LYS CB C 2.966 -9.191 -1.938 1.00 . B B . 11 LYS CB 1 1 4 4396 2 2 11 LYS CD C 0.584 -9.157 -1.160 1.00 . B B . 11 LYS CD 1 1 4 4397 2 2 11 LYS CE C -0.872 -9.050 -1.589 1.00 . B B . 11 LYS CE 1 1 4 4398 2 2 11 LYS CG C 1.530 -8.867 -2.311 1.00 . B B . 11 LYS CG 1 1 4 4399 2 2 11 LYS H H 3.608 -7.873 -4.842 1.00 . B B . 11 LYS H 1 1 4 4400 2 2 11 LYS HA H 4.144 -7.552 -2.650 1.00 . B B . 11 LYS HA 1 1 4 4401 2 2 11 LYS HB2 H 3.079 -10.264 -1.928 1.00 . B B . 11 LYS HB2 1 1 4 4402 2 2 11 LYS HB3 H 3.152 -8.809 -0.946 1.00 . B B . 11 LYS HB3 1 1 4 4403 2 2 11 LYS HD2 H 0.770 -10.156 -0.799 1.00 . B B . 11 LYS HD2 1 1 4 4404 2 2 11 LYS HD3 H 0.771 -8.446 -0.371 1.00 . B B . 11 LYS HD3 1 1 4 4405 2 2 11 LYS HE2 H -1.500 -9.222 -0.728 1.00 . B B . 11 LYS HE2 1 1 4 4406 2 2 11 LYS HE3 H -1.049 -8.055 -1.971 1.00 . B B . 11 LYS HE3 1 1 4 4407 2 2 11 LYS HG2 H 1.460 -7.820 -2.568 1.00 . B B . 11 LYS HG2 1 1 4 4408 2 2 11 LYS HG3 H 1.244 -9.469 -3.161 1.00 . B B . 11 LYS HG3 1 1 4 4409 2 2 11 LYS HZ1 H -2.217 -9.951 -2.910 1.00 . B B . 11 LYS HZ1 1 1 4 4410 2 2 11 LYS HZ2 H -1.048 -11.009 -2.295 1.00 . B B . 11 LYS HZ2 1 1 4 4411 2 2 11 LYS HZ3 H -0.629 -9.887 -3.489 1.00 . B B . 11 LYS HZ3 1 1 4 4412 2 2 11 LYS N N 3.539 -8.669 -4.274 1.00 . B B . 11 LYS N 1 1 4 4413 2 2 11 LYS NZ N -1.215 -10.043 -2.645 1.00 . B B . 11 LYS NZ 1 1 4 4414 2 2 11 LYS O O 5.370 -10.550 -2.641 1.00 . B B . 11 LYS O 1 1 4 4415 2 2 12 ALA C C 7.878 -9.913 -1.258 1.00 . B B . 12 ALA C 1 1 4 4416 2 2 12 ALA CA C 7.747 -9.127 -2.556 1.00 . B B . 12 ALA CA 1 1 4 4417 2 2 12 ALA CB C 8.796 -8.028 -2.616 1.00 . B B . 12 ALA CB 1 1 4 4418 2 2 12 ALA H H 6.309 -7.587 -2.767 1.00 . B B . 12 ALA H 1 1 4 4419 2 2 12 ALA HA H 7.913 -9.796 -3.389 1.00 . B B . 12 ALA HA 1 1 4 4420 2 2 12 ALA HB1 H 8.587 -7.374 -3.451 1.00 . B B . 12 ALA HB1 1 1 4 4421 2 2 12 ALA HB2 H 9.774 -8.470 -2.740 1.00 . B B . 12 ALA HB2 1 1 4 4422 2 2 12 ALA HB3 H 8.773 -7.460 -1.699 1.00 . B B . 12 ALA HB3 1 1 4 4423 2 2 12 ALA N N 6.412 -8.558 -2.699 1.00 . B B . 12 ALA N 1 1 4 4424 2 2 12 ALA O O 8.688 -10.835 -1.158 1.00 . B B . 12 ALA O 1 1 4 4425 2 2 13 ASP C C 5.808 -10.972 1.282 1.00 . B B . 13 ASP C 1 1 4 4426 2 2 13 ASP CA C 7.108 -10.215 1.030 1.00 . B B . 13 ASP CA 1 1 4 4427 2 2 13 ASP CB C 7.347 -9.199 2.147 1.00 . B B . 13 ASP CB 1 1 4 4428 2 2 13 ASP CG C 7.395 -9.845 3.518 1.00 . B B . 13 ASP CG 1 1 4 4429 2 2 13 ASP H H 6.453 -8.802 -0.404 1.00 . B B . 13 ASP H 1 1 4 4430 2 2 13 ASP HA H 7.925 -10.922 1.018 1.00 . B B . 13 ASP HA 1 1 4 4431 2 2 13 ASP HB2 H 8.287 -8.697 1.973 1.00 . B B . 13 ASP HB2 1 1 4 4432 2 2 13 ASP HB3 H 6.549 -8.471 2.139 1.00 . B B . 13 ASP HB3 1 1 4 4433 2 2 13 ASP N N 7.078 -9.544 -0.264 1.00 . B B . 13 ASP N 1 1 4 4434 2 2 13 ASP O O 4.941 -10.508 2.023 1.00 . B B . 13 ASP O 1 1 4 4435 2 2 13 ASP OD1 O 8.497 -10.255 3.943 1.00 . B B . 13 ASP OD1 1 1 4 4436 2 2 13 ASP OD2 O 6.332 -9.939 4.167 1.00 . B B . 13 ASP OD2 1 1 4 4437 2 2 14 SER C C 4.805 -14.245 1.576 1.00 . B B . 14 SER C 1 1 4 4438 2 2 14 SER CA C 4.485 -12.962 0.816 1.00 . B B . 14 SER CA 1 1 4 4439 2 2 14 SER CB C 3.893 -13.301 -0.554 1.00 . B B . 14 SER CB 1 1 4 4440 2 2 14 SER H H 6.404 -12.455 0.081 1.00 . B B . 14 SER H 1 1 4 4441 2 2 14 SER HA H 3.762 -12.393 1.380 1.00 . B B . 14 SER HA 1 1 4 4442 2 2 14 SER HB2 H 3.611 -12.388 -1.057 1.00 . B B . 14 SER HB2 1 1 4 4443 2 2 14 SER HB3 H 4.631 -13.824 -1.144 1.00 . B B . 14 SER HB3 1 1 4 4444 2 2 14 SER HG H 1.963 -13.570 -0.345 1.00 . B B . 14 SER HG 1 1 4 4445 2 2 14 SER N N 5.679 -12.139 0.660 1.00 . B B . 14 SER N 1 1 4 4446 2 2 14 SER O O 4.723 -14.230 2.821 1.00 . B B . 14 SER O 1 1 4 4447 2 2 14 SER OXT O 5.133 -15.255 0.918 1.00 . B B . 14 SER OXT 1 1 4 4448 2 2 14 SER OG O 2.745 -14.121 -0.424 1.00 . B B . 14 SER OG 1 1 5 4449 1 1 1 GLY C C 11.674 6.149 -5.158 1.00 . A A . 1 GLY C 1 1 5 4450 1 1 1 GLY CA C 11.346 5.047 -6.150 1.00 . A A . 1 GLY CA 1 1 5 4451 1 1 1 GLY H1 H 9.674 5.835 -7.124 1.00 . A A . 1 GLY H1 1 1 5 4452 1 1 1 GLY H2 H 9.311 5.066 -5.664 1.00 . A A . 1 GLY H2 1 1 5 4453 1 1 1 GLY H3 H 9.680 4.145 -7.034 1.00 . A A . 1 GLY H3 1 1 5 4454 1 1 1 GLY HA2 H 11.619 4.092 -5.722 1.00 . A A . 1 GLY HA2 1 1 5 4455 1 1 1 GLY HA3 H 11.928 5.205 -7.046 1.00 . A A . 1 GLY HA3 1 1 5 4456 1 1 1 GLY N N 9.902 5.021 -6.518 1.00 . A A . 1 GLY N 1 1 5 4457 1 1 1 GLY O O 12.634 6.892 -5.355 1.00 . A A . 1 GLY O 1 1 5 4458 1 1 2 SER C C 10.029 7.325 -2.004 1.00 . A A . 2 SER C 1 1 5 4459 1 1 2 SER CA C 11.120 7.298 -3.078 1.00 . A A . 2 SER CA 1 1 5 4460 1 1 2 SER CB C 11.210 8.664 -3.752 1.00 . A A . 2 SER CB 1 1 5 4461 1 1 2 SER H H 10.146 5.628 -3.962 1.00 . A A . 2 SER H 1 1 5 4462 1 1 2 SER HA H 12.067 7.087 -2.602 1.00 . A A . 2 SER HA 1 1 5 4463 1 1 2 SER HB2 H 12.137 8.728 -4.300 1.00 . A A . 2 SER HB2 1 1 5 4464 1 1 2 SER HB3 H 10.381 8.779 -4.433 1.00 . A A . 2 SER HB3 1 1 5 4465 1 1 2 SER HG H 10.274 10.041 -2.722 1.00 . A A . 2 SER HG 1 1 5 4466 1 1 2 SER N N 10.886 6.259 -4.084 1.00 . A A . 2 SER N 1 1 5 4467 1 1 2 SER O O 10.270 7.775 -0.884 1.00 . A A . 2 SER O 1 1 5 4468 1 1 2 SER OG O 11.172 9.710 -2.798 1.00 . A A . 2 SER OG 1 1 5 4469 1 1 3 GLN C C 7.776 5.539 -0.562 1.00 . A A . 3 GLN C 1 1 5 4470 1 1 3 GLN CA C 7.730 6.819 -1.386 1.00 . A A . 3 GLN CA 1 1 5 4471 1 1 3 GLN CB C 6.403 6.926 -2.126 1.00 . A A . 3 GLN CB 1 1 5 4472 1 1 3 GLN CD C 3.884 6.905 -2.006 1.00 . A A . 3 GLN CD 1 1 5 4473 1 1 3 GLN CG C 5.183 6.818 -1.229 1.00 . A A . 3 GLN CG 1 1 5 4474 1 1 3 GLN H H 8.681 6.514 -3.244 1.00 . A A . 3 GLN H 1 1 5 4475 1 1 3 GLN HA H 7.833 7.664 -0.734 1.00 . A A . 3 GLN HA 1 1 5 4476 1 1 3 GLN HB2 H 6.364 7.876 -2.637 1.00 . A A . 3 GLN HB2 1 1 5 4477 1 1 3 GLN HB3 H 6.359 6.139 -2.852 1.00 . A A . 3 GLN HB3 1 1 5 4478 1 1 3 GLN HE21 H 3.868 8.883 -1.807 1.00 . A A . 3 GLN HE21 1 1 5 4479 1 1 3 GLN HE22 H 2.540 8.207 -2.680 1.00 . A A . 3 GLN HE22 1 1 5 4480 1 1 3 GLN HG2 H 5.213 5.870 -0.712 1.00 . A A . 3 GLN HG2 1 1 5 4481 1 1 3 GLN HG3 H 5.210 7.621 -0.507 1.00 . A A . 3 GLN HG3 1 1 5 4482 1 1 3 GLN N N 8.833 6.843 -2.338 1.00 . A A . 3 GLN N 1 1 5 4483 1 1 3 GLN NE2 N 3.380 8.122 -2.183 1.00 . A A . 3 GLN NE2 1 1 5 4484 1 1 3 GLN O O 7.960 4.455 -1.101 1.00 . A A . 3 GLN O 1 1 5 4485 1 1 3 GLN OE1 O 3.340 5.891 -2.444 1.00 . A A . 3 GLN OE1 1 1 5 4486 1 1 4 VAL C C 6.291 3.919 1.898 1.00 . A A . 4 VAL C 1 1 5 4487 1 1 4 VAL CA C 7.669 4.527 1.645 1.00 . A A . 4 VAL CA 1 1 5 4488 1 1 4 VAL CB C 8.292 4.919 2.996 1.00 . A A . 4 VAL CB 1 1 5 4489 1 1 4 VAL CG1 C 8.646 3.681 3.806 1.00 . A A . 4 VAL CG1 1 1 5 4490 1 1 4 VAL CG2 C 9.516 5.797 2.782 1.00 . A A . 4 VAL CG2 1 1 5 4491 1 1 4 VAL H H 7.452 6.567 1.117 1.00 . A A . 4 VAL H 1 1 5 4492 1 1 4 VAL HA H 8.301 3.780 1.189 1.00 . A A . 4 VAL HA 1 1 5 4493 1 1 4 VAL HB H 7.563 5.488 3.554 1.00 . A A . 4 VAL HB 1 1 5 4494 1 1 4 VAL HG11 H 7.760 3.081 3.953 1.00 . A A . 4 VAL HG11 1 1 5 4495 1 1 4 VAL HG12 H 9.042 3.979 4.766 1.00 . A A . 4 VAL HG12 1 1 5 4496 1 1 4 VAL HG13 H 9.389 3.104 3.275 1.00 . A A . 4 VAL HG13 1 1 5 4497 1 1 4 VAL HG21 H 9.950 6.050 3.738 1.00 . A A . 4 VAL HG21 1 1 5 4498 1 1 4 VAL HG22 H 9.224 6.701 2.267 1.00 . A A . 4 VAL HG22 1 1 5 4499 1 1 4 VAL HG23 H 10.242 5.262 2.186 1.00 . A A . 4 VAL HG23 1 1 5 4500 1 1 4 VAL N N 7.612 5.675 0.747 1.00 . A A . 4 VAL N 1 1 5 4501 1 1 4 VAL O O 5.887 3.754 3.049 1.00 . A A . 4 VAL O 1 1 5 4502 1 1 5 PHE C C 3.479 3.043 -0.387 1.00 . A A . 5 PHE C 1 1 5 4503 1 1 5 PHE CA C 4.242 2.973 0.938 1.00 . A A . 5 PHE CA 1 1 5 4504 1 1 5 PHE CB C 3.423 3.659 2.037 1.00 . A A . 5 PHE CB 1 1 5 4505 1 1 5 PHE CD1 C 3.153 5.889 0.916 1.00 . A A . 5 PHE CD1 1 1 5 4506 1 1 5 PHE CD2 C 4.005 5.839 3.141 1.00 . A A . 5 PHE CD2 1 1 5 4507 1 1 5 PHE CE1 C 3.246 7.270 0.910 1.00 . A A . 5 PHE CE1 1 1 5 4508 1 1 5 PHE CE2 C 4.099 7.218 3.141 1.00 . A A . 5 PHE CE2 1 1 5 4509 1 1 5 PHE CG C 3.530 5.159 2.030 1.00 . A A . 5 PHE CG 1 1 5 4510 1 1 5 PHE CZ C 3.718 7.934 2.024 1.00 . A A . 5 PHE CZ 1 1 5 4511 1 1 5 PHE H H 5.950 3.739 -0.070 1.00 . A A . 5 PHE H 1 1 5 4512 1 1 5 PHE HA H 4.380 1.934 1.204 1.00 . A A . 5 PHE HA 1 1 5 4513 1 1 5 PHE HB2 H 2.386 3.401 1.910 1.00 . A A . 5 PHE HB2 1 1 5 4514 1 1 5 PHE HB3 H 3.759 3.306 3.001 1.00 . A A . 5 PHE HB3 1 1 5 4515 1 1 5 PHE HD1 H 2.786 5.371 0.043 1.00 . A A . 5 PHE HD1 1 1 5 4516 1 1 5 PHE HD2 H 4.303 5.283 4.015 1.00 . A A . 5 PHE HD2 1 1 5 4517 1 1 5 PHE HE1 H 2.944 7.828 0.037 1.00 . A A . 5 PHE HE1 1 1 5 4518 1 1 5 PHE HE2 H 4.469 7.735 4.012 1.00 . A A . 5 PHE HE2 1 1 5 4519 1 1 5 PHE HZ H 3.791 9.011 2.020 1.00 . A A . 5 PHE HZ 1 1 5 4520 1 1 5 PHE N N 5.574 3.580 0.822 1.00 . A A . 5 PHE N 1 1 5 4521 1 1 5 PHE O O 3.829 3.819 -1.274 1.00 . A A . 5 PHE O 1 1 5 4522 1 1 6 GLU C C 0.133 2.043 -1.378 1.00 . A A . 6 GLU C 1 1 5 4523 1 1 6 GLU CA C 1.615 2.192 -1.723 1.00 . A A . 6 GLU CA 1 1 5 4524 1 1 6 GLU CB C 2.048 1.045 -2.636 1.00 . A A . 6 GLU CB 1 1 5 4525 1 1 6 GLU CD C 1.415 2.213 -4.783 1.00 . A A . 6 GLU CD 1 1 5 4526 1 1 6 GLU CG C 1.256 0.969 -3.932 1.00 . A A . 6 GLU CG 1 1 5 4527 1 1 6 GLU H H 2.212 1.613 0.227 1.00 . A A . 6 GLU H 1 1 5 4528 1 1 6 GLU HA H 1.759 3.129 -2.241 1.00 . A A . 6 GLU HA 1 1 5 4529 1 1 6 GLU HB2 H 3.091 1.171 -2.885 1.00 . A A . 6 GLU HB2 1 1 5 4530 1 1 6 GLU HB3 H 1.923 0.110 -2.108 1.00 . A A . 6 GLU HB3 1 1 5 4531 1 1 6 GLU HG2 H 1.598 0.117 -4.499 1.00 . A A . 6 GLU HG2 1 1 5 4532 1 1 6 GLU HG3 H 0.209 0.845 -3.692 1.00 . A A . 6 GLU HG3 1 1 5 4533 1 1 6 GLU N N 2.434 2.220 -0.512 1.00 . A A . 6 GLU N 1 1 5 4534 1 1 6 GLU O O -0.227 1.357 -0.426 1.00 . A A . 6 GLU O 1 1 5 4535 1 1 6 GLU OE1 O 0.789 3.243 -4.453 1.00 . A A . 6 GLU OE1 1 1 5 4536 1 1 6 GLU OE2 O 2.165 2.158 -5.781 1.00 . A A . 6 GLU OE2 1 1 5 4537 1 1 7 TYR C C -2.780 1.424 -2.651 1.00 . A A . 7 TYR C 1 1 5 4538 1 1 7 TYR CA C -2.158 2.617 -1.949 1.00 . A A . 7 TYR CA 1 1 5 4539 1 1 7 TYR CB C -2.792 3.912 -2.444 1.00 . A A . 7 TYR CB 1 1 5 4540 1 1 7 TYR CD1 C -2.954 3.637 -4.957 1.00 . A A . 7 TYR CD1 1 1 5 4541 1 1 7 TYR CD2 C -1.464 5.284 -4.094 1.00 . A A . 7 TYR CD2 1 1 5 4542 1 1 7 TYR CE1 C -2.590 3.977 -6.246 1.00 . A A . 7 TYR CE1 1 1 5 4543 1 1 7 TYR CE2 C -1.095 5.630 -5.380 1.00 . A A . 7 TYR CE2 1 1 5 4544 1 1 7 TYR CG C -2.399 4.283 -3.859 1.00 . A A . 7 TYR CG 1 1 5 4545 1 1 7 TYR CZ C -1.660 4.974 -6.452 1.00 . A A . 7 TYR CZ 1 1 5 4546 1 1 7 TYR H H -0.387 3.193 -2.926 1.00 . A A . 7 TYR H 1 1 5 4547 1 1 7 TYR HA H -2.344 2.520 -0.892 1.00 . A A . 7 TYR HA 1 1 5 4548 1 1 7 TYR HB2 H -3.858 3.813 -2.400 1.00 . A A . 7 TYR HB2 1 1 5 4549 1 1 7 TYR HB3 H -2.488 4.719 -1.800 1.00 . A A . 7 TYR HB3 1 1 5 4550 1 1 7 TYR HD1 H -3.683 2.860 -4.794 1.00 . A A . 7 TYR HD1 1 1 5 4551 1 1 7 TYR HD2 H -1.023 5.796 -3.253 1.00 . A A . 7 TYR HD2 1 1 5 4552 1 1 7 TYR HE1 H -3.034 3.463 -7.086 1.00 . A A . 7 TYR HE1 1 1 5 4553 1 1 7 TYR HE2 H -0.366 6.410 -5.541 1.00 . A A . 7 TYR HE2 1 1 5 4554 1 1 7 TYR HH H -0.350 5.492 -7.760 1.00 . A A . 7 TYR HH 1 1 5 4555 1 1 7 TYR N N -0.724 2.671 -2.172 1.00 . A A . 7 TYR N 1 1 5 4556 1 1 7 TYR O O -2.613 1.232 -3.855 1.00 . A A . 7 TYR O 1 1 5 4557 1 1 7 TYR OH O -1.294 5.316 -7.733 1.00 . A A . 7 TYR OH 1 1 5 4558 1 1 8 ALA C C -5.650 -0.346 -2.457 1.00 . A A . 8 ALA C 1 1 5 4559 1 1 8 ALA CA C -4.143 -0.564 -2.414 1.00 . A A . 8 ALA CA 1 1 5 4560 1 1 8 ALA CB C -3.796 -1.788 -1.581 1.00 . A A . 8 ALA CB 1 1 5 4561 1 1 8 ALA H H -3.543 0.796 -0.911 1.00 . A A . 8 ALA H 1 1 5 4562 1 1 8 ALA HA H -3.781 -0.724 -3.419 1.00 . A A . 8 ALA HA 1 1 5 4563 1 1 8 ALA HB1 H -3.866 -2.673 -2.192 1.00 . A A . 8 ALA HB1 1 1 5 4564 1 1 8 ALA HB2 H -4.483 -1.866 -0.753 1.00 . A A . 8 ALA HB2 1 1 5 4565 1 1 8 ALA HB3 H -2.789 -1.691 -1.201 1.00 . A A . 8 ALA HB3 1 1 5 4566 1 1 8 ALA N N -3.479 0.608 -1.876 1.00 . A A . 8 ALA N 1 1 5 4567 1 1 8 ALA O O -6.424 -1.183 -1.995 1.00 . A A . 8 ALA O 1 1 5 4568 1 1 9 GLU C C -8.025 0.957 -4.484 1.00 . A A . 9 GLU C 1 1 5 4569 1 1 9 GLU CA C -7.474 1.131 -3.099 1.00 . A A . 9 GLU CA 1 1 5 4570 1 1 9 GLU CB C -7.722 2.557 -2.612 1.00 . A A . 9 GLU CB 1 1 5 4571 1 1 9 GLU CD C -6.084 3.579 -4.250 1.00 . A A . 9 GLU CD 1 1 5 4572 1 1 9 GLU CG C -7.470 3.641 -3.652 1.00 . A A . 9 GLU CG 1 1 5 4573 1 1 9 GLU H H -5.398 1.416 -3.376 1.00 . A A . 9 GLU H 1 1 5 4574 1 1 9 GLU HA H -8.009 0.459 -2.468 1.00 . A A . 9 GLU HA 1 1 5 4575 1 1 9 GLU HB2 H -8.749 2.632 -2.309 1.00 . A A . 9 GLU HB2 1 1 5 4576 1 1 9 GLU HB3 H -7.089 2.741 -1.762 1.00 . A A . 9 GLU HB3 1 1 5 4577 1 1 9 GLU HG2 H -8.192 3.530 -4.445 1.00 . A A . 9 GLU HG2 1 1 5 4578 1 1 9 GLU HG3 H -7.602 4.602 -3.187 1.00 . A A . 9 GLU HG3 1 1 5 4579 1 1 9 GLU N N -6.060 0.793 -3.015 1.00 . A A . 9 GLU N 1 1 5 4580 1 1 9 GLU O O -7.312 0.620 -5.429 1.00 . A A . 9 GLU O 1 1 5 4581 1 1 9 GLU OE1 O -5.821 2.646 -5.038 1.00 . A A . 9 GLU OE1 1 1 5 4582 1 1 9 GLU OE2 O -5.264 4.464 -3.935 1.00 . A A . 9 GLU OE2 1 1 5 4583 1 1 10 VAL C C -10.494 2.397 -6.366 1.00 . A A . 10 VAL C 1 1 5 4584 1 1 10 VAL CA C -10.002 1.059 -5.831 1.00 . A A . 10 VAL CA 1 1 5 4585 1 1 10 VAL CB C -11.158 0.070 -5.701 1.00 . A A . 10 VAL CB 1 1 5 4586 1 1 10 VAL CG1 C -11.721 -0.283 -7.070 1.00 . A A . 10 VAL CG1 1 1 5 4587 1 1 10 VAL CG2 C -10.699 -1.176 -4.952 1.00 . A A . 10 VAL CG2 1 1 5 4588 1 1 10 VAL H H -9.826 1.458 -3.789 1.00 . A A . 10 VAL H 1 1 5 4589 1 1 10 VAL HA H -9.310 0.661 -6.513 1.00 . A A . 10 VAL HA 1 1 5 4590 1 1 10 VAL HB H -11.925 0.541 -5.125 1.00 . A A . 10 VAL HB 1 1 5 4591 1 1 10 VAL HG11 H -10.943 -0.725 -7.675 1.00 . A A . 10 VAL HG11 1 1 5 4592 1 1 10 VAL HG12 H -12.084 0.612 -7.551 1.00 . A A . 10 VAL HG12 1 1 5 4593 1 1 10 VAL HG13 H -12.532 -0.986 -6.957 1.00 . A A . 10 VAL HG13 1 1 5 4594 1 1 10 VAL HG21 H -11.486 -1.912 -4.956 1.00 . A A . 10 VAL HG21 1 1 5 4595 1 1 10 VAL HG22 H -10.457 -0.911 -3.931 1.00 . A A . 10 VAL HG22 1 1 5 4596 1 1 10 VAL HG23 H -9.823 -1.583 -5.435 1.00 . A A . 10 VAL HG23 1 1 5 4597 1 1 10 VAL N N -9.319 1.194 -4.584 1.00 . A A . 10 VAL N 1 1 5 4598 1 1 10 VAL O O -10.839 2.513 -7.541 1.00 . A A . 10 VAL O 1 1 5 4599 1 1 11 ASP C C -10.226 5.822 -5.103 1.00 . A A . 11 ASP C 1 1 5 4600 1 1 11 ASP CA C -10.943 4.742 -5.903 1.00 . A A . 11 ASP CA 1 1 5 4601 1 1 11 ASP CB C -12.453 4.880 -5.700 1.00 . A A . 11 ASP CB 1 1 5 4602 1 1 11 ASP CG C -13.009 6.139 -6.333 1.00 . A A . 11 ASP CG 1 1 5 4603 1 1 11 ASP H H -10.202 3.263 -4.588 1.00 . A A . 11 ASP H 1 1 5 4604 1 1 11 ASP HA H -10.716 4.871 -6.951 1.00 . A A . 11 ASP HA 1 1 5 4605 1 1 11 ASP HB2 H -12.950 4.029 -6.138 1.00 . A A . 11 ASP HB2 1 1 5 4606 1 1 11 ASP HB3 H -12.665 4.908 -4.641 1.00 . A A . 11 ASP HB3 1 1 5 4607 1 1 11 ASP N N -10.500 3.413 -5.507 1.00 . A A . 11 ASP N 1 1 5 4608 1 1 11 ASP O O -9.779 6.828 -5.656 1.00 . A A . 11 ASP O 1 1 5 4609 1 1 11 ASP OD1 O -13.369 6.094 -7.528 1.00 . A A . 11 ASP OD1 1 1 5 4610 1 1 11 ASP OD2 O -13.086 7.171 -5.633 1.00 . A A . 11 ASP OD2 1 1 5 4611 1 1 12 GLU C C -8.902 5.904 -1.671 1.00 . A A . 12 GLU C 1 1 5 4612 1 1 12 GLU CA C -9.485 6.579 -2.907 1.00 . A A . 12 GLU CA 1 1 5 4613 1 1 12 GLU CB C -10.497 7.641 -2.484 1.00 . A A . 12 GLU CB 1 1 5 4614 1 1 12 GLU CD C -12.050 9.495 -3.200 1.00 . A A . 12 GLU CD 1 1 5 4615 1 1 12 GLU CG C -10.989 8.504 -3.633 1.00 . A A . 12 GLU CG 1 1 5 4616 1 1 12 GLU H H -10.450 4.756 -3.428 1.00 . A A . 12 GLU H 1 1 5 4617 1 1 12 GLU HA H -8.686 7.055 -3.454 1.00 . A A . 12 GLU HA 1 1 5 4618 1 1 12 GLU HB2 H -11.350 7.149 -2.041 1.00 . A A . 12 GLU HB2 1 1 5 4619 1 1 12 GLU HB3 H -10.040 8.283 -1.749 1.00 . A A . 12 GLU HB3 1 1 5 4620 1 1 12 GLU HG2 H -10.151 9.050 -4.041 1.00 . A A . 12 GLU HG2 1 1 5 4621 1 1 12 GLU HG3 H -11.405 7.862 -4.396 1.00 . A A . 12 GLU HG3 1 1 5 4622 1 1 12 GLU N N -10.123 5.608 -3.796 1.00 . A A . 12 GLU N 1 1 5 4623 1 1 12 GLU O O -9.086 4.713 -1.469 1.00 . A A . 12 GLU O 1 1 5 4624 1 1 12 GLU OE1 O -11.683 10.578 -2.699 1.00 . A A . 12 GLU OE1 1 1 5 4625 1 1 12 GLU OE2 O -13.250 9.188 -3.360 1.00 . A A . 12 GLU OE2 1 1 5 4626 1 1 13 ILE C C -7.663 7.218 1.470 1.00 . A A . 13 ILE C 1 1 5 4627 1 1 13 ILE CA C -7.590 6.149 0.378 1.00 . A A . 13 ILE CA 1 1 5 4628 1 1 13 ILE CB C -6.104 5.749 0.179 1.00 . A A . 13 ILE CB 1 1 5 4629 1 1 13 ILE CD1 C -5.611 7.534 -1.560 1.00 . A A . 13 ILE CD1 1 1 5 4630 1 1 13 ILE CG1 C -5.281 6.989 -0.188 1.00 . A A . 13 ILE CG1 1 1 5 4631 1 1 13 ILE CG2 C -5.973 4.693 -0.902 1.00 . A A . 13 ILE CG2 1 1 5 4632 1 1 13 ILE H H -8.059 7.615 -1.080 1.00 . A A . 13 ILE H 1 1 5 4633 1 1 13 ILE HA H -8.155 5.271 0.678 1.00 . A A . 13 ILE HA 1 1 5 4634 1 1 13 ILE HB H -5.719 5.318 1.107 1.00 . A A . 13 ILE HB 1 1 5 4635 1 1 13 ILE HD11 H -6.054 6.753 -2.163 1.00 . A A . 13 ILE HD11 1 1 5 4636 1 1 13 ILE HD12 H -4.707 7.885 -2.035 1.00 . A A . 13 ILE HD12 1 1 5 4637 1 1 13 ILE HD13 H -6.308 8.353 -1.465 1.00 . A A . 13 ILE HD13 1 1 5 4638 1 1 13 ILE HG12 H -5.479 7.769 0.532 1.00 . A A . 13 ILE HG12 1 1 5 4639 1 1 13 ILE HG13 H -4.232 6.748 -0.169 1.00 . A A . 13 ILE HG13 1 1 5 4640 1 1 13 ILE HG21 H -6.907 4.597 -1.420 1.00 . A A . 13 ILE HG21 1 1 5 4641 1 1 13 ILE HG22 H -5.711 3.747 -0.453 1.00 . A A . 13 ILE HG22 1 1 5 4642 1 1 13 ILE HG23 H -5.202 4.986 -1.600 1.00 . A A . 13 ILE HG23 1 1 5 4643 1 1 13 ILE N N -8.187 6.671 -0.853 1.00 . A A . 13 ILE N 1 1 5 4644 1 1 13 ILE O O -8.296 8.256 1.285 1.00 . A A . 13 ILE O 1 1 5 4645 1 1 14 VAL C C -5.713 7.804 4.514 1.00 . A A . 14 VAL C 1 1 5 4646 1 1 14 VAL CA C -7.002 7.928 3.704 1.00 . A A . 14 VAL CA 1 1 5 4647 1 1 14 VAL CB C -8.231 7.760 4.630 1.00 . A A . 14 VAL CB 1 1 5 4648 1 1 14 VAL CG1 C -8.102 8.617 5.886 1.00 . A A . 14 VAL CG1 1 1 5 4649 1 1 14 VAL CG2 C -9.507 8.116 3.884 1.00 . A A . 14 VAL CG2 1 1 5 4650 1 1 14 VAL H H -6.536 6.117 2.704 1.00 . A A . 14 VAL H 1 1 5 4651 1 1 14 VAL HA H -7.039 8.917 3.273 1.00 . A A . 14 VAL HA 1 1 5 4652 1 1 14 VAL HB H -8.293 6.725 4.931 1.00 . A A . 14 VAL HB 1 1 5 4653 1 1 14 VAL HG11 H -7.212 8.332 6.426 1.00 . A A . 14 VAL HG11 1 1 5 4654 1 1 14 VAL HG12 H -8.969 8.468 6.513 1.00 . A A . 14 VAL HG12 1 1 5 4655 1 1 14 VAL HG13 H -8.035 9.658 5.605 1.00 . A A . 14 VAL HG13 1 1 5 4656 1 1 14 VAL HG21 H -9.543 7.576 2.952 1.00 . A A . 14 VAL HG21 1 1 5 4657 1 1 14 VAL HG22 H -9.522 9.178 3.684 1.00 . A A . 14 VAL HG22 1 1 5 4658 1 1 14 VAL HG23 H -10.363 7.852 4.487 1.00 . A A . 14 VAL HG23 1 1 5 4659 1 1 14 VAL N N -7.015 6.967 2.604 1.00 . A A . 14 VAL N 1 1 5 4660 1 1 14 VAL O O -5.053 8.801 4.807 1.00 . A A . 14 VAL O 1 1 5 4661 1 1 15 GLU C C -2.993 5.996 4.712 1.00 . A A . 15 GLU C 1 1 5 4662 1 1 15 GLU CA C -4.155 6.321 5.642 1.00 . A A . 15 GLU CA 1 1 5 4663 1 1 15 GLU CB C -4.381 5.164 6.618 1.00 . A A . 15 GLU CB 1 1 5 4664 1 1 15 GLU CD C -5.282 6.644 8.455 1.00 . A A . 15 GLU CD 1 1 5 4665 1 1 15 GLU CG C -5.512 5.411 7.602 1.00 . A A . 15 GLU CG 1 1 5 4666 1 1 15 GLU H H -5.938 5.826 4.614 1.00 . A A . 15 GLU H 1 1 5 4667 1 1 15 GLU HA H -3.919 7.214 6.200 1.00 . A A . 15 GLU HA 1 1 5 4668 1 1 15 GLU HB2 H -4.613 4.273 6.054 1.00 . A A . 15 GLU HB2 1 1 5 4669 1 1 15 GLU HB3 H -3.474 4.999 7.179 1.00 . A A . 15 GLU HB3 1 1 5 4670 1 1 15 GLU HG2 H -6.431 5.540 7.052 1.00 . A A . 15 GLU HG2 1 1 5 4671 1 1 15 GLU HG3 H -5.600 4.553 8.252 1.00 . A A . 15 GLU HG3 1 1 5 4672 1 1 15 GLU N N -5.366 6.578 4.873 1.00 . A A . 15 GLU N 1 1 5 4673 1 1 15 GLU O O -3.187 5.418 3.647 1.00 . A A . 15 GLU O 1 1 5 4674 1 1 15 GLU OE1 O -4.635 6.519 9.517 1.00 . A A . 15 GLU OE1 1 1 5 4675 1 1 15 GLU OE2 O -5.748 7.734 8.062 1.00 . A A . 15 GLU OE2 1 1 5 4676 1 1 16 LYS C C 0.656 6.071 5.119 1.00 . A A . 16 LYS C 1 1 5 4677 1 1 16 LYS CA C -0.618 6.130 4.271 1.00 . A A . 16 LYS CA 1 1 5 4678 1 1 16 LYS CB C -0.475 7.185 3.171 1.00 . A A . 16 LYS CB 1 1 5 4679 1 1 16 LYS CD C -0.414 9.618 2.548 1.00 . A A . 16 LYS CD 1 1 5 4680 1 1 16 LYS CE C 0.900 9.497 1.793 1.00 . A A . 16 LYS CE 1 1 5 4681 1 1 16 LYS CG C -0.498 8.615 3.688 1.00 . A A . 16 LYS CG 1 1 5 4682 1 1 16 LYS H H -1.694 6.911 5.923 1.00 . A A . 16 LYS H 1 1 5 4683 1 1 16 LYS HA H -0.778 5.163 3.814 1.00 . A A . 16 LYS HA 1 1 5 4684 1 1 16 LYS HB2 H 0.461 7.027 2.655 1.00 . A A . 16 LYS HB2 1 1 5 4685 1 1 16 LYS HB3 H -1.287 7.066 2.469 1.00 . A A . 16 LYS HB3 1 1 5 4686 1 1 16 LYS HD2 H -1.228 9.438 1.862 1.00 . A A . 16 LYS HD2 1 1 5 4687 1 1 16 LYS HD3 H -0.495 10.616 2.953 1.00 . A A . 16 LYS HD3 1 1 5 4688 1 1 16 LYS HE2 H 1.712 9.700 2.475 1.00 . A A . 16 LYS HE2 1 1 5 4689 1 1 16 LYS HE3 H 0.992 8.489 1.414 1.00 . A A . 16 LYS HE3 1 1 5 4690 1 1 16 LYS HG2 H -1.418 8.778 4.229 1.00 . A A . 16 LYS HG2 1 1 5 4691 1 1 16 LYS HG3 H 0.343 8.765 4.348 1.00 . A A . 16 LYS HG3 1 1 5 4692 1 1 16 LYS HZ1 H 0.220 10.251 -0.033 1.00 . A A . 16 LYS HZ1 1 1 5 4693 1 1 16 LYS HZ2 H 1.895 10.367 0.176 1.00 . A A . 16 LYS HZ2 1 1 5 4694 1 1 16 LYS HZ3 H 0.866 11.427 0.997 1.00 . A A . 16 LYS HZ3 1 1 5 4695 1 1 16 LYS N N -1.792 6.411 5.088 1.00 . A A . 16 LYS N 1 1 5 4696 1 1 16 LYS NZ N 0.976 10.453 0.654 1.00 . A A . 16 LYS NZ 1 1 5 4697 1 1 16 LYS O O 1.357 7.073 5.259 1.00 . A A . 16 LYS O 1 1 5 4698 1 1 17 ARG C C 2.654 3.314 6.516 1.00 . A A . 17 ARG C 1 1 5 4699 1 1 17 ARG CA C 2.149 4.752 6.520 1.00 . A A . 17 ARG CA 1 1 5 4700 1 1 17 ARG CB C 1.848 5.194 7.953 1.00 . A A . 17 ARG CB 1 1 5 4701 1 1 17 ARG CD C 2.763 7.517 7.689 1.00 . A A . 17 ARG CD 1 1 5 4702 1 1 17 ARG CG C 1.558 6.680 8.083 1.00 . A A . 17 ARG CG 1 1 5 4703 1 1 17 ARG CZ C 3.396 9.888 7.519 1.00 . A A . 17 ARG CZ 1 1 5 4704 1 1 17 ARG H H 0.390 4.120 5.502 1.00 . A A . 17 ARG H 1 1 5 4705 1 1 17 ARG HA H 2.919 5.390 6.113 1.00 . A A . 17 ARG HA 1 1 5 4706 1 1 17 ARG HB2 H 0.988 4.648 8.312 1.00 . A A . 17 ARG HB2 1 1 5 4707 1 1 17 ARG HB3 H 2.698 4.958 8.575 1.00 . A A . 17 ARG HB3 1 1 5 4708 1 1 17 ARG HD2 H 3.595 7.249 8.323 1.00 . A A . 17 ARG HD2 1 1 5 4709 1 1 17 ARG HD3 H 3.014 7.302 6.662 1.00 . A A . 17 ARG HD3 1 1 5 4710 1 1 17 ARG HE H 1.628 9.222 8.164 1.00 . A A . 17 ARG HE 1 1 5 4711 1 1 17 ARG HG2 H 0.730 6.934 7.438 1.00 . A A . 17 ARG HG2 1 1 5 4712 1 1 17 ARG HG3 H 1.298 6.898 9.110 1.00 . A A . 17 ARG HG3 1 1 5 4713 1 1 17 ARG HH11 H 4.825 8.581 6.938 1.00 . A A . 17 ARG HH11 1 1 5 4714 1 1 17 ARG HH12 H 5.259 10.253 6.825 1.00 . A A . 17 ARG HH12 1 1 5 4715 1 1 17 ARG HH21 H 2.188 11.430 8.020 1.00 . A A . 17 ARG HH21 1 1 5 4716 1 1 17 ARG HH22 H 3.759 11.873 7.440 1.00 . A A . 17 ARG HH22 1 1 5 4717 1 1 17 ARG N N 0.957 4.903 5.682 1.00 . A A . 17 ARG N 1 1 5 4718 1 1 17 ARG NE N 2.507 8.948 7.826 1.00 . A A . 17 ARG NE 1 1 5 4719 1 1 17 ARG NH1 N 4.592 9.546 7.056 1.00 . A A . 17 ARG NH1 1 1 5 4720 1 1 17 ARG NH2 N 3.089 11.168 7.672 1.00 . A A . 17 ARG NH2 1 1 5 4721 1 1 17 ARG O O 2.217 2.502 7.331 1.00 . A A . 17 ARG O 1 1 5 4722 1 1 18 GLY C C 5.491 1.504 5.033 1.00 . A A . 18 GLY C 1 1 5 4723 1 1 18 GLY CA C 4.075 1.636 5.553 1.00 . A A . 18 GLY CA 1 1 5 4724 1 1 18 GLY H H 3.895 3.663 4.979 1.00 . A A . 18 GLY H 1 1 5 4725 1 1 18 GLY HA2 H 4.035 1.213 6.545 1.00 . A A . 18 GLY HA2 1 1 5 4726 1 1 18 GLY HA3 H 3.429 1.064 4.913 1.00 . A A . 18 GLY HA3 1 1 5 4727 1 1 18 GLY N N 3.570 2.990 5.608 1.00 . A A . 18 GLY N 1 1 5 4728 1 1 18 GLY O O 6.407 2.203 5.470 1.00 . A A . 18 GLY O 1 1 5 4729 1 1 19 LYS C C 6.906 0.609 1.988 1.00 . A A . 19 LYS C 1 1 5 4730 1 1 19 LYS CA C 6.927 0.275 3.469 1.00 . A A . 19 LYS CA 1 1 5 4731 1 1 19 LYS CB C 7.188 -1.216 3.673 1.00 . A A . 19 LYS CB 1 1 5 4732 1 1 19 LYS CD C 7.871 -3.046 5.251 1.00 . A A . 19 LYS CD 1 1 5 4733 1 1 19 LYS CE C 8.025 -3.393 6.723 1.00 . A A . 19 LYS CE 1 1 5 4734 1 1 19 LYS CG C 7.743 -1.548 5.047 1.00 . A A . 19 LYS CG 1 1 5 4735 1 1 19 LYS H H 4.851 0.096 3.778 1.00 . A A . 19 LYS H 1 1 5 4736 1 1 19 LYS HA H 7.693 0.835 3.949 1.00 . A A . 19 LYS HA 1 1 5 4737 1 1 19 LYS HB2 H 6.242 -1.741 3.553 1.00 . A A . 19 LYS HB2 1 1 5 4738 1 1 19 LYS HB3 H 7.881 -1.568 2.925 1.00 . A A . 19 LYS HB3 1 1 5 4739 1 1 19 LYS HD2 H 6.987 -3.527 4.865 1.00 . A A . 19 LYS HD2 1 1 5 4740 1 1 19 LYS HD3 H 8.739 -3.397 4.712 1.00 . A A . 19 LYS HD3 1 1 5 4741 1 1 19 LYS HE2 H 7.213 -2.939 7.272 1.00 . A A . 19 LYS HE2 1 1 5 4742 1 1 19 LYS HE3 H 7.978 -4.465 6.835 1.00 . A A . 19 LYS HE3 1 1 5 4743 1 1 19 LYS HG2 H 8.718 -1.096 5.148 1.00 . A A . 19 LYS HG2 1 1 5 4744 1 1 19 LYS HG3 H 7.079 -1.146 5.799 1.00 . A A . 19 LYS HG3 1 1 5 4745 1 1 19 LYS HZ1 H 9.376 -3.127 8.292 1.00 . A A . 19 LYS HZ1 1 1 5 4746 1 1 19 LYS HZ2 H 9.388 -1.871 7.158 1.00 . A A . 19 LYS HZ2 1 1 5 4747 1 1 19 LYS HZ3 H 10.112 -3.354 6.787 1.00 . A A . 19 LYS HZ3 1 1 5 4748 1 1 19 LYS N N 5.645 0.588 4.084 1.00 . A A . 19 LYS N 1 1 5 4749 1 1 19 LYS NZ N 9.315 -2.902 7.279 1.00 . A A . 19 LYS NZ 1 1 5 4750 1 1 19 LYS O O 7.507 1.578 1.524 1.00 . A A . 19 LYS O 1 1 5 4751 1 1 20 GLY C C 4.708 -0.761 -0.462 1.00 . A A . 20 GLY C 1 1 5 4752 1 1 20 GLY CA C 6.023 -0.122 -0.143 1.00 . A A . 20 GLY CA 1 1 5 4753 1 1 20 GLY H H 5.796 -0.981 1.734 1.00 . A A . 20 GLY H 1 1 5 4754 1 1 20 GLY HA2 H 6.016 0.917 -0.428 1.00 . A A . 20 GLY HA2 1 1 5 4755 1 1 20 GLY HA3 H 6.807 -0.647 -0.654 1.00 . A A . 20 GLY HA3 1 1 5 4756 1 1 20 GLY N N 6.214 -0.239 1.274 1.00 . A A . 20 GLY N 1 1 5 4757 1 1 20 GLY O O 3.870 -0.219 -1.178 1.00 . A A . 20 GLY O 1 1 5 4758 1 1 21 LYS C C 2.840 -3.081 1.422 1.00 . A A . 21 LYS C 1 1 5 4759 1 1 21 LYS CA C 3.349 -2.728 0.010 1.00 . A A . 21 LYS CA 1 1 5 4760 1 1 21 LYS CB C 3.620 -4.004 -0.790 1.00 . A A . 21 LYS CB 1 1 5 4761 1 1 21 LYS CD C 4.028 -2.843 -2.989 1.00 . A A . 21 LYS CD 1 1 5 4762 1 1 21 LYS CE C 5.083 -2.453 -4.012 1.00 . A A . 21 LYS CE 1 1 5 4763 1 1 21 LYS CG C 4.585 -3.804 -1.950 1.00 . A A . 21 LYS CG 1 1 5 4764 1 1 21 LYS H H 5.319 -2.319 0.600 1.00 . A A . 21 LYS H 1 1 5 4765 1 1 21 LYS HA H 2.602 -2.134 -0.501 1.00 . A A . 21 LYS HA 1 1 5 4766 1 1 21 LYS HB2 H 4.040 -4.746 -0.127 1.00 . A A . 21 LYS HB2 1 1 5 4767 1 1 21 LYS HB3 H 2.686 -4.374 -1.185 1.00 . A A . 21 LYS HB3 1 1 5 4768 1 1 21 LYS HD2 H 3.208 -3.320 -3.500 1.00 . A A . 21 LYS HD2 1 1 5 4769 1 1 21 LYS HD3 H 3.676 -1.953 -2.490 1.00 . A A . 21 LYS HD3 1 1 5 4770 1 1 21 LYS HE2 H 5.854 -1.884 -3.515 1.00 . A A . 21 LYS HE2 1 1 5 4771 1 1 21 LYS HE3 H 5.513 -3.351 -4.429 1.00 . A A . 21 LYS HE3 1 1 5 4772 1 1 21 LYS HG2 H 5.512 -3.404 -1.570 1.00 . A A . 21 LYS HG2 1 1 5 4773 1 1 21 LYS HG3 H 4.769 -4.759 -2.420 1.00 . A A . 21 LYS HG3 1 1 5 4774 1 1 21 LYS HZ1 H 5.261 -1.360 -5.784 1.00 . A A . 21 LYS HZ1 1 1 5 4775 1 1 21 LYS HZ2 H 4.078 -0.767 -4.729 1.00 . A A . 21 LYS HZ2 1 1 5 4776 1 1 21 LYS HZ3 H 3.785 -2.171 -5.626 1.00 . A A . 21 LYS HZ3 1 1 5 4777 1 1 21 LYS N N 4.557 -1.943 0.110 1.00 . A A . 21 LYS N 1 1 5 4778 1 1 21 LYS NZ N 4.512 -1.630 -5.115 1.00 . A A . 21 LYS NZ 1 1 5 4779 1 1 21 LYS O O 1.712 -3.537 1.578 1.00 . A A . 21 LYS O 1 1 5 4780 1 1 22 ASP C C 2.547 -1.996 4.485 1.00 . A A . 22 ASP C 1 1 5 4781 1 1 22 ASP CA C 3.317 -3.123 3.840 1.00 . A A . 22 ASP CA 1 1 5 4782 1 1 22 ASP CB C 4.572 -3.375 4.675 1.00 . A A . 22 ASP CB 1 1 5 4783 1 1 22 ASP CG C 4.270 -4.052 6.001 1.00 . A A . 22 ASP CG 1 1 5 4784 1 1 22 ASP H H 4.528 -2.423 2.289 1.00 . A A . 22 ASP H 1 1 5 4785 1 1 22 ASP HA H 2.714 -3.995 3.829 1.00 . A A . 22 ASP HA 1 1 5 4786 1 1 22 ASP HB2 H 5.255 -3.984 4.120 1.00 . A A . 22 ASP HB2 1 1 5 4787 1 1 22 ASP HB3 H 5.043 -2.426 4.887 1.00 . A A . 22 ASP HB3 1 1 5 4788 1 1 22 ASP N N 3.669 -2.818 2.457 1.00 . A A . 22 ASP N 1 1 5 4789 1 1 22 ASP O O 2.342 -1.978 5.698 1.00 . A A . 22 ASP O 1 1 5 4790 1 1 22 ASP OD1 O 3.892 -3.342 6.956 1.00 . A A . 22 ASP OD1 1 1 5 4791 1 1 22 ASP OD2 O 4.414 -5.288 6.086 1.00 . A A . 22 ASP OD2 1 1 5 4792 1 1 23 VAL C C -0.107 -0.269 4.227 1.00 . A A . 23 VAL C 1 1 5 4793 1 1 23 VAL CA C 1.370 0.059 4.172 1.00 . A A . 23 VAL CA 1 1 5 4794 1 1 23 VAL CB C 1.595 1.290 3.293 1.00 . A A . 23 VAL CB 1 1 5 4795 1 1 23 VAL CG1 C 0.830 1.180 1.983 1.00 . A A . 23 VAL CG1 1 1 5 4796 1 1 23 VAL CG2 C 1.199 2.543 4.029 1.00 . A A . 23 VAL CG2 1 1 5 4797 1 1 23 VAL H H 2.368 -1.099 2.740 1.00 . A A . 23 VAL H 1 1 5 4798 1 1 23 VAL HA H 1.718 0.287 5.163 1.00 . A A . 23 VAL HA 1 1 5 4799 1 1 23 VAL HB H 2.651 1.346 3.074 1.00 . A A . 23 VAL HB 1 1 5 4800 1 1 23 VAL HG11 H 1.274 0.407 1.373 1.00 . A A . 23 VAL HG11 1 1 5 4801 1 1 23 VAL HG12 H 0.874 2.125 1.463 1.00 . A A . 23 VAL HG12 1 1 5 4802 1 1 23 VAL HG13 H -0.200 0.932 2.179 1.00 . A A . 23 VAL HG13 1 1 5 4803 1 1 23 VAL HG21 H 0.307 2.956 3.582 1.00 . A A . 23 VAL HG21 1 1 5 4804 1 1 23 VAL HG22 H 1.999 3.266 3.969 1.00 . A A . 23 VAL HG22 1 1 5 4805 1 1 23 VAL HG23 H 1.004 2.303 5.063 1.00 . A A . 23 VAL HG23 1 1 5 4806 1 1 23 VAL N N 2.125 -1.061 3.679 1.00 . A A . 23 VAL N 1 1 5 4807 1 1 23 VAL O O -0.612 -1.071 3.441 1.00 . A A . 23 VAL O 1 1 5 4808 1 1 24 GLU C C -3.009 1.374 4.894 1.00 . A A . 24 GLU C 1 1 5 4809 1 1 24 GLU CA C -2.210 0.138 5.305 1.00 . A A . 24 GLU CA 1 1 5 4810 1 1 24 GLU CB C -2.533 -0.244 6.748 1.00 . A A . 24 GLU CB 1 1 5 4811 1 1 24 GLU CD C -1.643 1.895 7.773 1.00 . A A . 24 GLU CD 1 1 5 4812 1 1 24 GLU CG C -1.610 0.380 7.785 1.00 . A A . 24 GLU CG 1 1 5 4813 1 1 24 GLU H H -0.339 1.025 5.701 1.00 . A A . 24 GLU H 1 1 5 4814 1 1 24 GLU HA H -2.469 -0.698 4.658 1.00 . A A . 24 GLU HA 1 1 5 4815 1 1 24 GLU HB2 H -3.544 0.063 6.966 1.00 . A A . 24 GLU HB2 1 1 5 4816 1 1 24 GLU HB3 H -2.465 -1.316 6.837 1.00 . A A . 24 GLU HB3 1 1 5 4817 1 1 24 GLU HG2 H -1.910 0.040 8.766 1.00 . A A . 24 GLU HG2 1 1 5 4818 1 1 24 GLU HG3 H -0.597 0.057 7.589 1.00 . A A . 24 GLU HG3 1 1 5 4819 1 1 24 GLU N N -0.794 0.369 5.141 1.00 . A A . 24 GLU N 1 1 5 4820 1 1 24 GLU O O -3.273 2.260 5.707 1.00 . A A . 24 GLU O 1 1 5 4821 1 1 24 GLU OE1 O -2.542 2.474 8.419 1.00 . A A . 24 GLU OE1 1 1 5 4822 1 1 24 GLU OE2 O -0.772 2.503 7.116 1.00 . A A . 24 GLU OE2 1 1 5 4823 1 1 25 TYR C C -5.650 2.284 3.294 1.00 . A A . 25 TYR C 1 1 5 4824 1 1 25 TYR CA C -4.155 2.529 3.095 1.00 . A A . 25 TYR CA 1 1 5 4825 1 1 25 TYR CB C -3.824 2.679 1.609 1.00 . A A . 25 TYR CB 1 1 5 4826 1 1 25 TYR CD1 C -1.412 3.392 1.862 1.00 . A A . 25 TYR CD1 1 1 5 4827 1 1 25 TYR CD2 C -2.869 4.761 0.582 1.00 . A A . 25 TYR CD2 1 1 5 4828 1 1 25 TYR CE1 C -0.371 4.268 1.617 1.00 . A A . 25 TYR CE1 1 1 5 4829 1 1 25 TYR CE2 C -1.838 5.643 0.333 1.00 . A A . 25 TYR CE2 1 1 5 4830 1 1 25 TYR CG C -2.678 3.627 1.345 1.00 . A A . 25 TYR CG 1 1 5 4831 1 1 25 TYR CZ C -0.592 5.393 0.850 1.00 . A A . 25 TYR CZ 1 1 5 4832 1 1 25 TYR H H -3.168 0.687 3.038 1.00 . A A . 25 TYR H 1 1 5 4833 1 1 25 TYR HA H -3.860 3.423 3.613 1.00 . A A . 25 TYR HA 1 1 5 4834 1 1 25 TYR HB2 H -3.550 1.714 1.212 1.00 . A A . 25 TYR HB2 1 1 5 4835 1 1 25 TYR HB3 H -4.687 3.046 1.081 1.00 . A A . 25 TYR HB3 1 1 5 4836 1 1 25 TYR HD1 H -1.246 2.512 2.462 1.00 . A A . 25 TYR HD1 1 1 5 4837 1 1 25 TYR HD2 H -3.841 4.948 0.175 1.00 . A A . 25 TYR HD2 1 1 5 4838 1 1 25 TYR HE1 H 0.606 4.072 2.025 1.00 . A A . 25 TYR HE1 1 1 5 4839 1 1 25 TYR HE2 H -2.015 6.523 -0.268 1.00 . A A . 25 TYR HE2 1 1 5 4840 1 1 25 TYR HH H 0.960 5.940 -0.135 1.00 . A A . 25 TYR HH 1 1 5 4841 1 1 25 TYR N N -3.397 1.420 3.631 1.00 . A A . 25 TYR N 1 1 5 4842 1 1 25 TYR O O -6.039 1.432 4.083 1.00 . A A . 25 TYR O 1 1 5 4843 1 1 25 TYR OH O 0.437 6.268 0.599 1.00 . A A . 25 TYR OH 1 1 5 4844 1 1 26 LEU C C -8.471 2.797 1.276 1.00 . A A . 26 LEU C 1 1 5 4845 1 1 26 LEU CA C -7.924 2.899 2.687 1.00 . A A . 26 LEU CA 1 1 5 4846 1 1 26 LEU CB C -8.576 4.070 3.437 1.00 . A A . 26 LEU CB 1 1 5 4847 1 1 26 LEU CD1 C -10.541 3.056 4.645 1.00 . A A . 26 LEU CD1 1 1 5 4848 1 1 26 LEU CD2 C -10.688 5.390 3.779 1.00 . A A . 26 LEU CD2 1 1 5 4849 1 1 26 LEU CG C -10.107 4.006 3.544 1.00 . A A . 26 LEU CG 1 1 5 4850 1 1 26 LEU H H -6.113 3.776 2.064 1.00 . A A . 26 LEU H 1 1 5 4851 1 1 26 LEU HA H -8.133 1.977 3.203 1.00 . A A . 26 LEU HA 1 1 5 4852 1 1 26 LEU HB2 H -8.166 4.100 4.438 1.00 . A A . 26 LEU HB2 1 1 5 4853 1 1 26 LEU HB3 H -8.310 4.987 2.932 1.00 . A A . 26 LEU HB3 1 1 5 4854 1 1 26 LEU HD11 H -10.001 2.130 4.552 1.00 . A A . 26 LEU HD11 1 1 5 4855 1 1 26 LEU HD12 H -11.600 2.863 4.558 1.00 . A A . 26 LEU HD12 1 1 5 4856 1 1 26 LEU HD13 H -10.334 3.499 5.608 1.00 . A A . 26 LEU HD13 1 1 5 4857 1 1 26 LEU HD21 H -10.603 5.973 2.875 1.00 . A A . 26 LEU HD21 1 1 5 4858 1 1 26 LEU HD22 H -10.147 5.877 4.576 1.00 . A A . 26 LEU HD22 1 1 5 4859 1 1 26 LEU HD23 H -11.729 5.301 4.052 1.00 . A A . 26 LEU HD23 1 1 5 4860 1 1 26 LEU HG H -10.507 3.633 2.619 1.00 . A A . 26 LEU HG 1 1 5 4861 1 1 26 LEU N N -6.478 3.063 2.617 1.00 . A A . 26 LEU N 1 1 5 4862 1 1 26 LEU O O -7.801 3.187 0.323 1.00 . A A . 26 LEU O 1 1 5 4863 1 1 27 VAL C C -11.714 2.388 -0.261 1.00 . A A . 27 VAL C 1 1 5 4864 1 1 27 VAL CA C -10.223 2.121 -0.202 1.00 . A A . 27 VAL CA 1 1 5 4865 1 1 27 VAL CB C -9.890 0.750 -0.855 1.00 . A A . 27 VAL CB 1 1 5 4866 1 1 27 VAL CG1 C -8.667 0.115 -0.208 1.00 . A A . 27 VAL CG1 1 1 5 4867 1 1 27 VAL CG2 C -11.058 -0.239 -0.840 1.00 . A A . 27 VAL CG2 1 1 5 4868 1 1 27 VAL H H -10.157 1.916 1.897 1.00 . A A . 27 VAL H 1 1 5 4869 1 1 27 VAL HA H -9.751 2.864 -0.810 1.00 . A A . 27 VAL HA 1 1 5 4870 1 1 27 VAL HB H -9.645 0.962 -1.883 1.00 . A A . 27 VAL HB 1 1 5 4871 1 1 27 VAL HG11 H -8.332 -0.715 -0.810 1.00 . A A . 27 VAL HG11 1 1 5 4872 1 1 27 VAL HG12 H -8.925 -0.238 0.780 1.00 . A A . 27 VAL HG12 1 1 5 4873 1 1 27 VAL HG13 H -7.879 0.849 -0.133 1.00 . A A . 27 VAL HG13 1 1 5 4874 1 1 27 VAL HG21 H -11.300 -0.496 0.180 1.00 . A A . 27 VAL HG21 1 1 5 4875 1 1 27 VAL HG22 H -10.780 -1.131 -1.381 1.00 . A A . 27 VAL HG22 1 1 5 4876 1 1 27 VAL HG23 H -11.920 0.211 -1.312 1.00 . A A . 27 VAL HG23 1 1 5 4877 1 1 27 VAL N N -9.663 2.248 1.122 1.00 . A A . 27 VAL N 1 1 5 4878 1 1 27 VAL O O -12.520 1.672 0.333 1.00 . A A . 27 VAL O 1 1 5 4879 1 1 28 ARG C C -13.787 2.985 -2.463 1.00 . A A . 28 ARG C 1 1 5 4880 1 1 28 ARG CA C -13.442 3.747 -1.228 1.00 . A A . 28 ARG CA 1 1 5 4881 1 1 28 ARG CB C -13.664 5.237 -1.445 1.00 . A A . 28 ARG CB 1 1 5 4882 1 1 28 ARG CD C -13.344 7.578 -0.601 1.00 . A A . 28 ARG CD 1 1 5 4883 1 1 28 ARG CG C -12.957 6.118 -0.430 1.00 . A A . 28 ARG CG 1 1 5 4884 1 1 28 ARG CZ C -12.933 9.736 0.501 1.00 . A A . 28 ARG CZ 1 1 5 4885 1 1 28 ARG H H -11.369 3.991 -1.382 1.00 . A A . 28 ARG H 1 1 5 4886 1 1 28 ARG HA H -14.041 3.383 -0.414 1.00 . A A . 28 ARG HA 1 1 5 4887 1 1 28 ARG HB2 H -13.310 5.492 -2.429 1.00 . A A . 28 ARG HB2 1 1 5 4888 1 1 28 ARG HB3 H -14.724 5.442 -1.391 1.00 . A A . 28 ARG HB3 1 1 5 4889 1 1 28 ARG HD2 H -13.091 7.890 -1.602 1.00 . A A . 28 ARG HD2 1 1 5 4890 1 1 28 ARG HD3 H -14.410 7.673 -0.455 1.00 . A A . 28 ARG HD3 1 1 5 4891 1 1 28 ARG HE H -11.954 8.044 0.906 1.00 . A A . 28 ARG HE 1 1 5 4892 1 1 28 ARG HG2 H -13.230 5.796 0.565 1.00 . A A . 28 ARG HG2 1 1 5 4893 1 1 28 ARG HG3 H -11.891 6.018 -0.562 1.00 . A A . 28 ARG HG3 1 1 5 4894 1 1 28 ARG HH11 H -14.385 9.758 -0.906 1.00 . A A . 28 ARG HH11 1 1 5 4895 1 1 28 ARG HH12 H -14.086 11.274 -0.123 1.00 . A A . 28 ARG HH12 1 1 5 4896 1 1 28 ARG HH21 H -11.552 10.038 1.945 1.00 . A A . 28 ARG HH21 1 1 5 4897 1 1 28 ARG HH22 H -12.476 11.433 1.497 1.00 . A A . 28 ARG HH22 1 1 5 4898 1 1 28 ARG N N -12.062 3.431 -0.986 1.00 . A A . 28 ARG N 1 1 5 4899 1 1 28 ARG NE N -12.657 8.444 0.351 1.00 . A A . 28 ARG NE 1 1 5 4900 1 1 28 ARG NH1 N -13.879 10.302 -0.237 1.00 . A A . 28 ARG NH1 1 1 5 4901 1 1 28 ARG NH2 N -12.266 10.462 1.387 1.00 . A A . 28 ARG NH2 1 1 5 4902 1 1 28 ARG O O -14.052 3.563 -3.519 1.00 . A A . 28 ARG O 1 1 5 4903 1 1 29 TRP C C -14.853 1.288 -4.459 1.00 . A A . 29 TRP C 1 1 5 4904 1 1 29 TRP CA C -13.987 0.709 -3.364 1.00 . A A . 29 TRP CA 1 1 5 4905 1 1 29 TRP CB C -14.642 -0.529 -2.793 1.00 . A A . 29 TRP CB 1 1 5 4906 1 1 29 TRP CD1 C -14.216 -1.828 -4.952 1.00 . A A . 29 TRP CD1 1 1 5 4907 1 1 29 TRP CD2 C -16.074 -2.451 -3.866 1.00 . A A . 29 TRP CD2 1 1 5 4908 1 1 29 TRP CE2 C -15.949 -3.233 -5.031 1.00 . A A . 29 TRP CE2 1 1 5 4909 1 1 29 TRP CE3 C -17.169 -2.666 -3.024 1.00 . A A . 29 TRP CE3 1 1 5 4910 1 1 29 TRP CG C -14.955 -1.557 -3.835 1.00 . A A . 29 TRP CG 1 1 5 4911 1 1 29 TRP CH2 C -17.938 -4.402 -4.531 1.00 . A A . 29 TRP CH2 1 1 5 4912 1 1 29 TRP CZ2 C -16.878 -4.213 -5.373 1.00 . A A . 29 TRP CZ2 1 1 5 4913 1 1 29 TRP CZ3 C -18.089 -3.640 -3.365 1.00 . A A . 29 TRP CZ3 1 1 5 4914 1 1 29 TRP H H -13.542 1.313 -1.414 1.00 . A A . 29 TRP H 1 1 5 4915 1 1 29 TRP HA H -13.033 0.435 -3.776 1.00 . A A . 29 TRP HA 1 1 5 4916 1 1 29 TRP HB2 H -13.981 -0.976 -2.063 1.00 . A A . 29 TRP HB2 1 1 5 4917 1 1 29 TRP HB3 H -15.559 -0.233 -2.311 1.00 . A A . 29 TRP HB3 1 1 5 4918 1 1 29 TRP HD1 H -13.298 -1.313 -5.217 1.00 . A A . 29 TRP HD1 1 1 5 4919 1 1 29 TRP HE1 H -14.469 -3.205 -6.518 1.00 . A A . 29 TRP HE1 1 1 5 4920 1 1 29 TRP HE3 H -17.302 -2.088 -2.122 1.00 . A A . 29 TRP HE3 1 1 5 4921 1 1 29 TRP HH2 H -18.683 -5.152 -4.758 1.00 . A A . 29 TRP HH2 1 1 5 4922 1 1 29 TRP HZ2 H -16.776 -4.810 -6.268 1.00 . A A . 29 TRP HZ2 1 1 5 4923 1 1 29 TRP HZ3 H -18.942 -3.821 -2.728 1.00 . A A . 29 TRP HZ3 1 1 5 4924 1 1 29 TRP N N -13.750 1.662 -2.300 1.00 . A A . 29 TRP N 1 1 5 4925 1 1 29 TRP NE1 N -14.807 -2.834 -5.676 1.00 . A A . 29 TRP NE1 1 1 5 4926 1 1 29 TRP O O -16.075 1.273 -4.378 1.00 . A A . 29 TRP O 1 1 5 4927 1 1 30 LYS C C -16.176 1.835 -6.949 1.00 . A A . 30 LYS C 1 1 5 4928 1 1 30 LYS CA C -14.824 2.477 -6.617 1.00 . A A . 30 LYS CA 1 1 5 4929 1 1 30 LYS CB C -13.921 2.383 -7.848 1.00 . A A . 30 LYS CB 1 1 5 4930 1 1 30 LYS CD C -13.515 3.051 -10.236 1.00 . A A . 30 LYS CD 1 1 5 4931 1 1 30 LYS CE C -14.030 3.861 -11.415 1.00 . A A . 30 LYS CE 1 1 5 4932 1 1 30 LYS CG C -14.481 3.102 -9.064 1.00 . A A . 30 LYS CG 1 1 5 4933 1 1 30 LYS H H -13.176 1.911 -5.351 1.00 . A A . 30 LYS H 1 1 5 4934 1 1 30 LYS HA H -14.985 3.520 -6.388 1.00 . A A . 30 LYS HA 1 1 5 4935 1 1 30 LYS HB2 H -12.963 2.812 -7.614 1.00 . A A . 30 LYS HB2 1 1 5 4936 1 1 30 LYS HB3 H -13.789 1.343 -8.104 1.00 . A A . 30 LYS HB3 1 1 5 4937 1 1 30 LYS HD2 H -12.563 3.455 -9.923 1.00 . A A . 30 LYS HD2 1 1 5 4938 1 1 30 LYS HD3 H -13.389 2.023 -10.543 1.00 . A A . 30 LYS HD3 1 1 5 4939 1 1 30 LYS HE2 H -14.148 4.889 -11.105 1.00 . A A . 30 LYS HE2 1 1 5 4940 1 1 30 LYS HE3 H -13.305 3.809 -12.214 1.00 . A A . 30 LYS HE3 1 1 5 4941 1 1 30 LYS HG2 H -15.408 2.629 -9.355 1.00 . A A . 30 LYS HG2 1 1 5 4942 1 1 30 LYS HG3 H -14.667 4.134 -8.806 1.00 . A A . 30 LYS HG3 1 1 5 4943 1 1 30 LYS HZ1 H -15.243 2.363 -12.218 1.00 . A A . 30 LYS HZ1 1 1 5 4944 1 1 30 LYS HZ2 H -15.660 3.924 -12.719 1.00 . A A . 30 LYS HZ2 1 1 5 4945 1 1 30 LYS HZ3 H -16.051 3.403 -11.157 1.00 . A A . 30 LYS HZ3 1 1 5 4946 1 1 30 LYS N N -14.169 1.859 -5.446 1.00 . A A . 30 LYS N 1 1 5 4947 1 1 30 LYS NZ N -15.338 3.351 -11.912 1.00 . A A . 30 LYS NZ 1 1 5 4948 1 1 30 LYS O O -17.107 2.520 -7.372 1.00 . A A . 30 LYS O 1 1 5 4949 1 1 31 ASP C C -18.176 -0.641 -5.726 1.00 . A A . 31 ASP C 1 1 5 4950 1 1 31 ASP CA C -17.516 -0.199 -7.031 1.00 . A A . 31 ASP CA 1 1 5 4951 1 1 31 ASP CB C -17.242 -1.416 -7.916 1.00 . A A . 31 ASP CB 1 1 5 4952 1 1 31 ASP CG C -16.639 -1.034 -9.254 1.00 . A A . 31 ASP CG 1 1 5 4953 1 1 31 ASP H H -15.493 0.025 -6.437 1.00 . A A . 31 ASP H 1 1 5 4954 1 1 31 ASP HA H -18.184 0.472 -7.550 1.00 . A A . 31 ASP HA 1 1 5 4955 1 1 31 ASP HB2 H -16.554 -2.074 -7.407 1.00 . A A . 31 ASP HB2 1 1 5 4956 1 1 31 ASP HB3 H -18.170 -1.939 -8.094 1.00 . A A . 31 ASP HB3 1 1 5 4957 1 1 31 ASP N N -16.274 0.522 -6.762 1.00 . A A . 31 ASP N 1 1 5 4958 1 1 31 ASP O O -18.558 -1.802 -5.574 1.00 . A A . 31 ASP O 1 1 5 4959 1 1 31 ASP OD1 O -17.412 -0.755 -10.195 1.00 . A A . 31 ASP OD1 1 1 5 4960 1 1 31 ASP OD2 O -15.395 -1.014 -9.360 1.00 . A A . 31 ASP OD2 1 1 5 4961 1 1 32 GLY C C -19.613 1.186 -2.895 1.00 . A A . 32 GLY C 1 1 5 4962 1 1 32 GLY CA C -18.909 -0.010 -3.505 1.00 . A A . 32 GLY CA 1 1 5 4963 1 1 32 GLY H H -17.993 1.203 -4.977 1.00 . A A . 32 GLY H 1 1 5 4964 1 1 32 GLY HA2 H -19.624 -0.810 -3.632 1.00 . A A . 32 GLY HA2 1 1 5 4965 1 1 32 GLY HA3 H -18.131 -0.336 -2.829 1.00 . A A . 32 GLY HA3 1 1 5 4966 1 1 32 GLY N N -18.309 0.294 -4.791 1.00 . A A . 32 GLY N 1 1 5 4967 1 1 32 GLY O O -19.925 2.153 -3.589 1.00 . A A . 32 GLY O 1 1 5 4968 1 1 33 GLY C C -20.121 2.315 0.553 1.00 . A A . 33 GLY C 1 1 5 4969 1 1 33 GLY CA C -20.530 2.208 -0.904 1.00 . A A . 33 GLY CA 1 1 5 4970 1 1 33 GLY H H -19.597 0.317 -1.091 1.00 . A A . 33 GLY H 1 1 5 4971 1 1 33 GLY HA2 H -20.287 3.133 -1.404 1.00 . A A . 33 GLY HA2 1 1 5 4972 1 1 33 GLY HA3 H -21.598 2.053 -0.956 1.00 . A A . 33 GLY HA3 1 1 5 4973 1 1 33 GLY N N -19.865 1.116 -1.591 1.00 . A A . 33 GLY N 1 1 5 4974 1 1 33 GLY O O -20.890 2.798 1.384 1.00 . A A . 33 GLY O 1 1 5 4975 1 1 34 ASP C C -16.904 2.177 2.263 1.00 . A A . 34 ASP C 1 1 5 4976 1 1 34 ASP CA C -18.408 1.914 2.236 1.00 . A A . 34 ASP CA 1 1 5 4977 1 1 34 ASP CB C -18.721 0.605 2.963 1.00 . A A . 34 ASP CB 1 1 5 4978 1 1 34 ASP CG C -20.208 0.303 3.000 1.00 . A A . 34 ASP CG 1 1 5 4979 1 1 34 ASP H H -18.339 1.493 0.161 1.00 . A A . 34 ASP H 1 1 5 4980 1 1 34 ASP HA H -18.911 2.726 2.742 1.00 . A A . 34 ASP HA 1 1 5 4981 1 1 34 ASP HB2 H -18.220 -0.208 2.459 1.00 . A A . 34 ASP HB2 1 1 5 4982 1 1 34 ASP HB3 H -18.361 0.670 3.980 1.00 . A A . 34 ASP HB3 1 1 5 4983 1 1 34 ASP N N -18.908 1.865 0.865 1.00 . A A . 34 ASP N 1 1 5 4984 1 1 34 ASP O O -16.266 2.309 1.219 1.00 . A A . 34 ASP O 1 1 5 4985 1 1 34 ASP OD1 O -20.889 0.785 3.929 1.00 . A A . 34 ASP OD1 1 1 5 4986 1 1 34 ASP OD2 O -20.691 -0.416 2.100 1.00 . A A . 34 ASP OD2 1 1 5 4987 1 1 35 CYS C C -14.204 1.239 4.114 1.00 . A A . 35 CYS C 1 1 5 4988 1 1 35 CYS CA C -14.918 2.501 3.642 1.00 . A A . 35 CYS CA 1 1 5 4989 1 1 35 CYS CB C -14.695 3.633 4.647 1.00 . A A . 35 CYS CB 1 1 5 4990 1 1 35 CYS H H -16.909 2.138 4.263 1.00 . A A . 35 CYS H 1 1 5 4991 1 1 35 CYS HA H -14.514 2.794 2.685 1.00 . A A . 35 CYS HA 1 1 5 4992 1 1 35 CYS HB2 H -15.105 3.342 5.602 1.00 . A A . 35 CYS HB2 1 1 5 4993 1 1 35 CYS HB3 H -13.634 3.806 4.753 1.00 . A A . 35 CYS HB3 1 1 5 4994 1 1 35 CYS HG H -15.023 5.528 2.972 1.00 . A A . 35 CYS HG 1 1 5 4995 1 1 35 CYS N N -16.346 2.253 3.469 1.00 . A A . 35 CYS N 1 1 5 4996 1 1 35 CYS O O -14.631 0.596 5.073 1.00 . A A . 35 CYS O 1 1 5 4997 1 1 35 CYS SG S -15.465 5.200 4.177 1.00 . A A . 35 CYS SG 1 1 5 4998 1 1 36 GLU C C -10.851 0.008 3.820 1.00 . A A . 36 GLU C 1 1 5 4999 1 1 36 GLU CA C -12.341 -0.295 3.789 1.00 . A A . 36 GLU CA 1 1 5 5000 1 1 36 GLU CB C -12.589 -1.397 2.769 1.00 . A A . 36 GLU CB 1 1 5 5001 1 1 36 GLU CD C -14.956 -1.986 3.431 1.00 . A A . 36 GLU CD 1 1 5 5002 1 1 36 GLU CG C -14.039 -1.506 2.323 1.00 . A A . 36 GLU CG 1 1 5 5003 1 1 36 GLU H H -12.814 1.455 2.694 1.00 . A A . 36 GLU H 1 1 5 5004 1 1 36 GLU HA H -12.657 -0.634 4.763 1.00 . A A . 36 GLU HA 1 1 5 5005 1 1 36 GLU HB2 H -11.974 -1.196 1.905 1.00 . A A . 36 GLU HB2 1 1 5 5006 1 1 36 GLU HB3 H -12.292 -2.342 3.198 1.00 . A A . 36 GLU HB3 1 1 5 5007 1 1 36 GLU HG2 H -14.376 -0.535 1.993 1.00 . A A . 36 GLU HG2 1 1 5 5008 1 1 36 GLU HG3 H -14.098 -2.204 1.500 1.00 . A A . 36 GLU HG3 1 1 5 5009 1 1 36 GLU N N -13.110 0.894 3.441 1.00 . A A . 36 GLU N 1 1 5 5010 1 1 36 GLU O O -10.333 0.695 2.948 1.00 . A A . 36 GLU O 1 1 5 5011 1 1 36 GLU OE1 O -14.844 -3.164 3.827 1.00 . A A . 36 GLU OE1 1 1 5 5012 1 1 36 GLU OE2 O -15.788 -1.182 3.903 1.00 . A A . 36 GLU OE2 1 1 5 5013 1 1 37 TRP C C -7.927 -1.364 4.215 1.00 . A A . 37 TRP C 1 1 5 5014 1 1 37 TRP CA C -8.729 -0.307 4.956 1.00 . A A . 37 TRP CA 1 1 5 5015 1 1 37 TRP CB C -8.324 -0.300 6.431 1.00 . A A . 37 TRP CB 1 1 5 5016 1 1 37 TRP CD1 C -8.406 2.249 6.431 1.00 . A A . 37 TRP CD1 1 1 5 5017 1 1 37 TRP CD2 C -8.610 1.332 8.461 1.00 . A A . 37 TRP CD2 1 1 5 5018 1 1 37 TRP CE2 C -8.670 2.733 8.593 1.00 . A A . 37 TRP CE2 1 1 5 5019 1 1 37 TRP CE3 C -8.718 0.543 9.609 1.00 . A A . 37 TRP CE3 1 1 5 5020 1 1 37 TRP CG C -8.444 1.046 7.068 1.00 . A A . 37 TRP CG 1 1 5 5021 1 1 37 TRP CH2 C -8.934 2.561 10.934 1.00 . A A . 37 TRP CH2 1 1 5 5022 1 1 37 TRP CZ2 C -8.832 3.359 9.828 1.00 . A A . 37 TRP CZ2 1 1 5 5023 1 1 37 TRP CZ3 C -8.877 1.165 10.833 1.00 . A A . 37 TRP CZ3 1 1 5 5024 1 1 37 TRP H H -10.635 -1.044 5.487 1.00 . A A . 37 TRP H 1 1 5 5025 1 1 37 TRP HA H -8.496 0.653 4.530 1.00 . A A . 37 TRP HA 1 1 5 5026 1 1 37 TRP HB2 H -8.953 -0.986 6.977 1.00 . A A . 37 TRP HB2 1 1 5 5027 1 1 37 TRP HB3 H -7.293 -0.616 6.513 1.00 . A A . 37 TRP HB3 1 1 5 5028 1 1 37 TRP HD1 H -8.290 2.364 5.361 1.00 . A A . 37 TRP HD1 1 1 5 5029 1 1 37 TRP HE1 H -8.550 4.226 7.124 1.00 . A A . 37 TRP HE1 1 1 5 5030 1 1 37 TRP HE3 H -8.677 -0.536 9.552 1.00 . A A . 37 TRP HE3 1 1 5 5031 1 1 37 TRP HH2 H -9.058 3.004 11.911 1.00 . A A . 37 TRP HH2 1 1 5 5032 1 1 37 TRP HZ2 H -8.876 4.433 9.922 1.00 . A A . 37 TRP HZ2 1 1 5 5033 1 1 37 TRP HZ3 H -8.962 0.571 11.732 1.00 . A A . 37 TRP HZ3 1 1 5 5034 1 1 37 TRP N N -10.165 -0.519 4.819 1.00 . A A . 37 TRP N 1 1 5 5035 1 1 37 TRP NE1 N -8.544 3.271 7.339 1.00 . A A . 37 TRP NE1 1 1 5 5036 1 1 37 TRP O O -8.346 -2.514 4.084 1.00 . A A . 37 TRP O 1 1 5 5037 1 1 38 VAL C C -4.943 -2.546 4.011 1.00 . A A . 38 VAL C 1 1 5 5038 1 1 38 VAL CA C -5.854 -1.828 3.021 1.00 . A A . 38 VAL CA 1 1 5 5039 1 1 38 VAL CB C -5.013 -1.014 2.005 1.00 . A A . 38 VAL CB 1 1 5 5040 1 1 38 VAL CG1 C -3.763 -1.761 1.556 1.00 . A A . 38 VAL CG1 1 1 5 5041 1 1 38 VAL CG2 C -5.862 -0.626 0.810 1.00 . A A . 38 VAL CG2 1 1 5 5042 1 1 38 VAL H H -6.515 -0.007 3.852 1.00 . A A . 38 VAL H 1 1 5 5043 1 1 38 VAL HA H -6.439 -2.558 2.482 1.00 . A A . 38 VAL HA 1 1 5 5044 1 1 38 VAL HB H -4.705 -0.108 2.489 1.00 . A A . 38 VAL HB 1 1 5 5045 1 1 38 VAL HG11 H -3.065 -1.822 2.379 1.00 . A A . 38 VAL HG11 1 1 5 5046 1 1 38 VAL HG12 H -3.304 -1.236 0.733 1.00 . A A . 38 VAL HG12 1 1 5 5047 1 1 38 VAL HG13 H -4.033 -2.756 1.245 1.00 . A A . 38 VAL HG13 1 1 5 5048 1 1 38 VAL HG21 H -5.263 -0.064 0.109 1.00 . A A . 38 VAL HG21 1 1 5 5049 1 1 38 VAL HG22 H -6.687 -0.019 1.143 1.00 . A A . 38 VAL HG22 1 1 5 5050 1 1 38 VAL HG23 H -6.237 -1.516 0.328 1.00 . A A . 38 VAL HG23 1 1 5 5051 1 1 38 VAL N N -6.762 -0.949 3.737 1.00 . A A . 38 VAL N 1 1 5 5052 1 1 38 VAL O O -4.755 -2.091 5.140 1.00 . A A . 38 VAL O 1 1 5 5053 1 1 39 LYS C C -2.096 -3.899 4.495 1.00 . A A . 39 LYS C 1 1 5 5054 1 1 39 LYS CA C -3.512 -4.454 4.439 1.00 . A A . 39 LYS CA 1 1 5 5055 1 1 39 LYS CB C -3.495 -5.913 3.977 1.00 . A A . 39 LYS CB 1 1 5 5056 1 1 39 LYS CD C -2.709 -8.265 4.390 1.00 . A A . 39 LYS CD 1 1 5 5057 1 1 39 LYS CE C -1.805 -9.158 5.225 1.00 . A A . 39 LYS CE 1 1 5 5058 1 1 39 LYS CG C -2.605 -6.811 4.820 1.00 . A A . 39 LYS CG 1 1 5 5059 1 1 39 LYS H H -4.552 -3.969 2.664 1.00 . A A . 39 LYS H 1 1 5 5060 1 1 39 LYS HA H -3.925 -4.407 5.428 1.00 . A A . 39 LYS HA 1 1 5 5061 1 1 39 LYS HB2 H -4.501 -6.301 4.017 1.00 . A A . 39 LYS HB2 1 1 5 5062 1 1 39 LYS HB3 H -3.144 -5.951 2.957 1.00 . A A . 39 LYS HB3 1 1 5 5063 1 1 39 LYS HD2 H -3.731 -8.594 4.508 1.00 . A A . 39 LYS HD2 1 1 5 5064 1 1 39 LYS HD3 H -2.421 -8.345 3.352 1.00 . A A . 39 LYS HD3 1 1 5 5065 1 1 39 LYS HE2 H -0.780 -8.860 5.062 1.00 . A A . 39 LYS HE2 1 1 5 5066 1 1 39 LYS HE3 H -2.055 -9.028 6.268 1.00 . A A . 39 LYS HE3 1 1 5 5067 1 1 39 LYS HG2 H -1.581 -6.490 4.713 1.00 . A A . 39 LYS HG2 1 1 5 5068 1 1 39 LYS HG3 H -2.904 -6.728 5.855 1.00 . A A . 39 LYS HG3 1 1 5 5069 1 1 39 LYS HZ1 H -2.935 -10.901 5.010 1.00 . A A . 39 LYS HZ1 1 1 5 5070 1 1 39 LYS HZ2 H -1.328 -11.177 5.463 1.00 . A A . 39 LYS HZ2 1 1 5 5071 1 1 39 LYS HZ3 H -1.696 -10.744 3.870 1.00 . A A . 39 LYS HZ3 1 1 5 5072 1 1 39 LYS N N -4.379 -3.666 3.579 1.00 . A A . 39 LYS N 1 1 5 5073 1 1 39 LYS NZ N -1.952 -10.595 4.866 1.00 . A A . 39 LYS NZ 1 1 5 5074 1 1 39 LYS O O -1.353 -3.942 3.515 1.00 . A A . 39 LYS O 1 1 5 5075 1 1 40 GLY C C 0.541 -3.807 6.502 1.00 . A A . 40 GLY C 1 1 5 5076 1 1 40 GLY CA C -0.415 -2.826 5.864 1.00 . A A . 40 GLY CA 1 1 5 5077 1 1 40 GLY H H -2.388 -3.360 6.394 1.00 . A A . 40 GLY H 1 1 5 5078 1 1 40 GLY HA2 H -0.014 -2.546 4.906 1.00 . A A . 40 GLY HA2 1 1 5 5079 1 1 40 GLY HA3 H -0.487 -1.948 6.490 1.00 . A A . 40 GLY HA3 1 1 5 5080 1 1 40 GLY N N -1.738 -3.379 5.665 1.00 . A A . 40 GLY N 1 1 5 5081 1 1 40 GLY O O 1.354 -3.440 7.351 1.00 . A A . 40 GLY O 1 1 5 5082 1 1 41 VAL C C 2.193 -6.636 5.468 1.00 . A A . 41 VAL C 1 1 5 5083 1 1 41 VAL CA C 1.315 -6.105 6.597 1.00 . A A . 41 VAL CA 1 1 5 5084 1 1 41 VAL CB C 0.542 -7.293 7.199 1.00 . A A . 41 VAL CB 1 1 5 5085 1 1 41 VAL CG1 C 1.403 -8.021 8.220 1.00 . A A . 41 VAL CG1 1 1 5 5086 1 1 41 VAL CG2 C -0.772 -6.843 7.822 1.00 . A A . 41 VAL CG2 1 1 5 5087 1 1 41 VAL H H -0.256 -5.295 5.443 1.00 . A A . 41 VAL H 1 1 5 5088 1 1 41 VAL HA H 1.943 -5.677 7.364 1.00 . A A . 41 VAL HA 1 1 5 5089 1 1 41 VAL HB H 0.324 -7.984 6.399 1.00 . A A . 41 VAL HB 1 1 5 5090 1 1 41 VAL HG11 H 2.312 -8.361 7.749 1.00 . A A . 41 VAL HG11 1 1 5 5091 1 1 41 VAL HG12 H 0.859 -8.871 8.608 1.00 . A A . 41 VAL HG12 1 1 5 5092 1 1 41 VAL HG13 H 1.645 -7.349 9.031 1.00 . A A . 41 VAL HG13 1 1 5 5093 1 1 41 VAL HG21 H -0.571 -6.153 8.628 1.00 . A A . 41 VAL HG21 1 1 5 5094 1 1 41 VAL HG22 H -1.301 -7.703 8.208 1.00 . A A . 41 VAL HG22 1 1 5 5095 1 1 41 VAL HG23 H -1.378 -6.355 7.073 1.00 . A A . 41 VAL HG23 1 1 5 5096 1 1 41 VAL N N 0.434 -5.063 6.097 1.00 . A A . 41 VAL N 1 1 5 5097 1 1 41 VAL O O 3.034 -7.506 5.688 1.00 . A A . 41 VAL O 1 1 5 5098 1 1 42 HIS C C 4.186 -6.027 3.204 1.00 . A A . 42 HIS C 1 1 5 5099 1 1 42 HIS CA C 2.781 -6.556 3.110 1.00 . A A . 42 HIS CA 1 1 5 5100 1 1 42 HIS CB C 2.101 -6.155 1.801 1.00 . A A . 42 HIS CB 1 1 5 5101 1 1 42 HIS CD2 C 0.932 -8.414 1.286 1.00 . A A . 42 HIS CD2 1 1 5 5102 1 1 42 HIS CE1 C 1.441 -8.564 -0.841 1.00 . A A . 42 HIS CE1 1 1 5 5103 1 1 42 HIS CG C 1.667 -7.321 0.966 1.00 . A A . 42 HIS CG 1 1 5 5104 1 1 42 HIS H H 1.328 -5.396 4.129 1.00 . A A . 42 HIS H 1 1 5 5105 1 1 42 HIS HA H 2.850 -7.614 3.162 1.00 . A A . 42 HIS HA 1 1 5 5106 1 1 42 HIS HB2 H 1.218 -5.576 2.029 1.00 . A A . 42 HIS HB2 1 1 5 5107 1 1 42 HIS HB3 H 2.781 -5.556 1.213 1.00 . A A . 42 HIS HB3 1 1 5 5108 1 1 42 HIS HD1 H 2.497 -6.810 -0.902 1.00 . A A . 42 HIS HD1 1 1 5 5109 1 1 42 HIS HD2 H 0.522 -8.648 2.258 1.00 . A A . 42 HIS HD2 1 1 5 5110 1 1 42 HIS HE1 H 1.515 -8.921 -1.857 1.00 . A A . 42 HIS HE1 1 1 5 5111 1 1 42 HIS HE2 H 0.260 -9.976 0.053 1.00 . A A . 42 HIS HE2 1 1 5 5112 1 1 42 HIS N N 1.997 -6.110 4.254 1.00 . A A . 42 HIS N 1 1 5 5113 1 1 42 HIS ND1 N 1.971 -7.446 -0.373 1.00 . A A . 42 HIS ND1 1 1 5 5114 1 1 42 HIS NE2 N 0.807 -9.168 0.145 1.00 . A A . 42 HIS NE2 1 1 5 5115 1 1 42 HIS O O 4.576 -5.122 2.481 1.00 . A A . 42 HIS O 1 1 5 5116 1 1 43 VAL C C 7.238 -6.299 3.170 1.00 . A A . 43 VAL C 1 1 5 5117 1 1 43 VAL CA C 6.327 -6.334 4.382 1.00 . A A . 43 VAL CA 1 1 5 5118 1 1 43 VAL CB C 6.913 -7.303 5.430 1.00 . A A . 43 VAL CB 1 1 5 5119 1 1 43 VAL CG1 C 6.775 -8.742 4.960 1.00 . A A . 43 VAL CG1 1 1 5 5120 1 1 43 VAL CG2 C 8.370 -6.975 5.737 1.00 . A A . 43 VAL CG2 1 1 5 5121 1 1 43 VAL H H 4.529 -7.434 4.564 1.00 . A A . 43 VAL H 1 1 5 5122 1 1 43 VAL HA H 6.324 -5.355 4.814 1.00 . A A . 43 VAL HA 1 1 5 5123 1 1 43 VAL HB H 6.344 -7.191 6.338 1.00 . A A . 43 VAL HB 1 1 5 5124 1 1 43 VAL HG11 H 7.339 -8.879 4.049 1.00 . A A . 43 VAL HG11 1 1 5 5125 1 1 43 VAL HG12 H 5.735 -8.963 4.777 1.00 . A A . 43 VAL HG12 1 1 5 5126 1 1 43 VAL HG13 H 7.156 -9.407 5.722 1.00 . A A . 43 VAL HG13 1 1 5 5127 1 1 43 VAL HG21 H 8.520 -5.908 5.676 1.00 . A A . 43 VAL HG21 1 1 5 5128 1 1 43 VAL HG22 H 9.008 -7.468 5.018 1.00 . A A . 43 VAL HG22 1 1 5 5129 1 1 43 VAL HG23 H 8.615 -7.318 6.730 1.00 . A A . 43 VAL HG23 1 1 5 5130 1 1 43 VAL N N 4.942 -6.686 4.077 1.00 . A A . 43 VAL N 1 1 5 5131 1 1 43 VAL O O 8.144 -7.117 3.038 1.00 . A A . 43 VAL O 1 1 5 5132 1 1 44 ALA C C 8.986 -4.180 1.492 1.00 . A A . 44 ALA C 1 1 5 5133 1 1 44 ALA CA C 7.828 -5.095 1.137 1.00 . A A . 44 ALA CA 1 1 5 5134 1 1 44 ALA CB C 6.999 -4.502 0.009 1.00 . A A . 44 ALA CB 1 1 5 5135 1 1 44 ALA H H 6.255 -4.713 2.488 1.00 . A A . 44 ALA H 1 1 5 5136 1 1 44 ALA HA H 8.217 -6.043 0.816 1.00 . A A . 44 ALA HA 1 1 5 5137 1 1 44 ALA HB1 H 6.050 -5.013 -0.050 1.00 . A A . 44 ALA HB1 1 1 5 5138 1 1 44 ALA HB2 H 7.529 -4.617 -0.924 1.00 . A A . 44 ALA HB2 1 1 5 5139 1 1 44 ALA HB3 H 6.832 -3.454 0.199 1.00 . A A . 44 ALA HB3 1 1 5 5140 1 1 44 ALA N N 7.011 -5.310 2.319 1.00 . A A . 44 ALA N 1 1 5 5141 1 1 44 ALA O O 9.236 -3.178 0.822 1.00 . A A . 44 ALA O 1 1 5 5142 1 1 45 GLU C C 11.765 -3.433 1.889 1.00 . A A . 45 GLU C 1 1 5 5143 1 1 45 GLU CA C 10.828 -3.764 3.040 1.00 . A A . 45 GLU CA 1 1 5 5144 1 1 45 GLU CB C 11.582 -4.533 4.126 1.00 . A A . 45 GLU CB 1 1 5 5145 1 1 45 GLU CD C 12.223 -2.504 5.488 1.00 . A A . 45 GLU CD 1 1 5 5146 1 1 45 GLU CG C 12.713 -3.742 4.763 1.00 . A A . 45 GLU CG 1 1 5 5147 1 1 45 GLU H H 9.452 -5.370 3.021 1.00 . A A . 45 GLU H 1 1 5 5148 1 1 45 GLU HA H 10.449 -2.843 3.456 1.00 . A A . 45 GLU HA 1 1 5 5149 1 1 45 GLU HB2 H 10.885 -4.811 4.903 1.00 . A A . 45 GLU HB2 1 1 5 5150 1 1 45 GLU HB3 H 11.999 -5.430 3.693 1.00 . A A . 45 GLU HB3 1 1 5 5151 1 1 45 GLU HG2 H 13.225 -4.376 5.471 1.00 . A A . 45 GLU HG2 1 1 5 5152 1 1 45 GLU HG3 H 13.403 -3.439 3.989 1.00 . A A . 45 GLU HG3 1 1 5 5153 1 1 45 GLU N N 9.692 -4.544 2.559 1.00 . A A . 45 GLU N 1 1 5 5154 1 1 45 GLU O O 12.477 -2.431 1.916 1.00 . A A . 45 GLU O 1 1 5 5155 1 1 45 GLU OE1 O 11.889 -2.611 6.687 1.00 . A A . 45 GLU OE1 1 1 5 5156 1 1 45 GLU OE2 O 12.171 -1.428 4.857 1.00 . A A . 45 GLU OE2 1 1 5 5157 1 1 46 ASP C C 12.081 -2.900 -1.096 1.00 . A A . 46 ASP C 1 1 5 5158 1 1 46 ASP CA C 12.586 -4.087 -0.301 1.00 . A A . 46 ASP CA 1 1 5 5159 1 1 46 ASP CB C 12.590 -5.340 -1.174 1.00 . A A . 46 ASP CB 1 1 5 5160 1 1 46 ASP CG C 13.497 -5.200 -2.381 1.00 . A A . 46 ASP CG 1 1 5 5161 1 1 46 ASP H H 11.164 -5.077 0.927 1.00 . A A . 46 ASP H 1 1 5 5162 1 1 46 ASP HA H 13.595 -3.877 0.024 1.00 . A A . 46 ASP HA 1 1 5 5163 1 1 46 ASP HB2 H 12.930 -6.178 -0.586 1.00 . A A . 46 ASP HB2 1 1 5 5164 1 1 46 ASP HB3 H 11.586 -5.530 -1.520 1.00 . A A . 46 ASP HB3 1 1 5 5165 1 1 46 ASP N N 11.753 -4.290 0.878 1.00 . A A . 46 ASP N 1 1 5 5166 1 1 46 ASP O O 12.847 -2.016 -1.455 1.00 . A A . 46 ASP O 1 1 5 5167 1 1 46 ASP OD1 O 14.724 -5.368 -2.224 1.00 . A A . 46 ASP OD1 1 1 5 5168 1 1 46 ASP OD2 O 12.979 -4.921 -3.483 1.00 . A A . 46 ASP OD2 1 1 5 5169 1 1 47 VAL C C 10.434 -0.452 -1.393 1.00 . A A . 47 VAL C 1 1 5 5170 1 1 47 VAL CA C 10.184 -1.780 -2.098 1.00 . A A . 47 VAL CA 1 1 5 5171 1 1 47 VAL CB C 8.673 -1.988 -2.281 1.00 . A A . 47 VAL CB 1 1 5 5172 1 1 47 VAL CG1 C 8.097 -0.918 -3.188 1.00 . A A . 47 VAL CG1 1 1 5 5173 1 1 47 VAL CG2 C 8.387 -3.371 -2.842 1.00 . A A . 47 VAL CG2 1 1 5 5174 1 1 47 VAL H H 10.206 -3.578 -0.988 1.00 . A A . 47 VAL H 1 1 5 5175 1 1 47 VAL HA H 10.648 -1.755 -3.074 1.00 . A A . 47 VAL HA 1 1 5 5176 1 1 47 VAL HB H 8.202 -1.908 -1.314 1.00 . A A . 47 VAL HB 1 1 5 5177 1 1 47 VAL HG11 H 7.989 -1.312 -4.188 1.00 . A A . 47 VAL HG11 1 1 5 5178 1 1 47 VAL HG12 H 8.762 -0.068 -3.208 1.00 . A A . 47 VAL HG12 1 1 5 5179 1 1 47 VAL HG13 H 7.132 -0.612 -2.814 1.00 . A A . 47 VAL HG13 1 1 5 5180 1 1 47 VAL HG21 H 8.768 -3.438 -3.849 1.00 . A A . 47 VAL HG21 1 1 5 5181 1 1 47 VAL HG22 H 7.320 -3.542 -2.850 1.00 . A A . 47 VAL HG22 1 1 5 5182 1 1 47 VAL HG23 H 8.865 -4.115 -2.228 1.00 . A A . 47 VAL HG23 1 1 5 5183 1 1 47 VAL N N 10.779 -2.869 -1.343 1.00 . A A . 47 VAL N 1 1 5 5184 1 1 47 VAL O O 10.561 0.572 -2.035 1.00 . A A . 47 VAL O 1 1 5 5185 1 1 48 ALA C C 12.235 0.958 0.825 1.00 . A A . 48 ALA C 1 1 5 5186 1 1 48 ALA CA C 10.759 0.620 0.823 1.00 . A A . 48 ALA CA 1 1 5 5187 1 1 48 ALA CB C 10.298 0.290 2.234 1.00 . A A . 48 ALA CB 1 1 5 5188 1 1 48 ALA H H 10.404 -1.380 0.334 1.00 . A A . 48 ALA H 1 1 5 5189 1 1 48 ALA HA H 10.199 1.472 0.479 1.00 . A A . 48 ALA HA 1 1 5 5190 1 1 48 ALA HB1 H 10.431 1.154 2.868 1.00 . A A . 48 ALA HB1 1 1 5 5191 1 1 48 ALA HB2 H 10.881 -0.532 2.621 1.00 . A A . 48 ALA HB2 1 1 5 5192 1 1 48 ALA HB3 H 9.254 0.014 2.217 1.00 . A A . 48 ALA HB3 1 1 5 5193 1 1 48 ALA N N 10.509 -0.522 -0.065 1.00 . A A . 48 ALA N 1 1 5 5194 1 1 48 ALA O O 12.630 2.071 0.476 1.00 . A A . 48 ALA O 1 1 5 5195 1 1 49 LYS C C 14.949 0.563 -0.173 1.00 . A A . 49 LYS C 1 1 5 5196 1 1 49 LYS CA C 14.493 0.190 1.233 1.00 . A A . 49 LYS CA 1 1 5 5197 1 1 49 LYS CB C 15.217 -1.071 1.711 1.00 . A A . 49 LYS CB 1 1 5 5198 1 1 49 LYS CD C 15.854 -2.542 3.653 1.00 . A A . 49 LYS CD 1 1 5 5199 1 1 49 LYS CE C 15.635 -3.794 2.817 1.00 . A A . 49 LYS CE 1 1 5 5200 1 1 49 LYS CG C 14.984 -1.386 3.180 1.00 . A A . 49 LYS CG 1 1 5 5201 1 1 49 LYS H H 12.686 -0.873 1.504 1.00 . A A . 49 LYS H 1 1 5 5202 1 1 49 LYS HA H 14.708 1.005 1.906 1.00 . A A . 49 LYS HA 1 1 5 5203 1 1 49 LYS HB2 H 14.874 -1.911 1.126 1.00 . A A . 49 LYS HB2 1 1 5 5204 1 1 49 LYS HB3 H 16.278 -0.944 1.556 1.00 . A A . 49 LYS HB3 1 1 5 5205 1 1 49 LYS HD2 H 16.892 -2.252 3.581 1.00 . A A . 49 LYS HD2 1 1 5 5206 1 1 49 LYS HD3 H 15.613 -2.762 4.684 1.00 . A A . 49 LYS HD3 1 1 5 5207 1 1 49 LYS HE2 H 15.779 -4.660 3.445 1.00 . A A . 49 LYS HE2 1 1 5 5208 1 1 49 LYS HE3 H 14.621 -3.787 2.444 1.00 . A A . 49 LYS HE3 1 1 5 5209 1 1 49 LYS HG2 H 15.219 -0.511 3.766 1.00 . A A . 49 LYS HG2 1 1 5 5210 1 1 49 LYS HG3 H 13.946 -1.647 3.322 1.00 . A A . 49 LYS HG3 1 1 5 5211 1 1 49 LYS HZ1 H 16.438 -3.057 1.034 1.00 . A A . 49 LYS HZ1 1 1 5 5212 1 1 49 LYS HZ2 H 16.412 -4.745 1.128 1.00 . A A . 49 LYS HZ2 1 1 5 5213 1 1 49 LYS HZ3 H 17.559 -3.867 2.006 1.00 . A A . 49 LYS HZ3 1 1 5 5214 1 1 49 LYS N N 13.056 -0.010 1.224 1.00 . A A . 49 LYS N 1 1 5 5215 1 1 49 LYS NZ N 16.577 -3.871 1.666 1.00 . A A . 49 LYS NZ 1 1 5 5216 1 1 49 LYS O O 15.967 1.227 -0.364 1.00 . A A . 49 LYS O 1 1 5 5217 1 1 50 ASP C C 13.713 1.644 -2.996 1.00 . A A . 50 ASP C 1 1 5 5218 1 1 50 ASP CA C 14.473 0.396 -2.551 1.00 . A A . 50 ASP CA 1 1 5 5219 1 1 50 ASP CB C 14.105 -0.800 -3.432 1.00 . A A . 50 ASP CB 1 1 5 5220 1 1 50 ASP CG C 14.780 -0.750 -4.790 1.00 . A A . 50 ASP CG 1 1 5 5221 1 1 50 ASP H H 13.401 -0.437 -0.946 1.00 . A A . 50 ASP H 1 1 5 5222 1 1 50 ASP HA H 15.534 0.585 -2.638 1.00 . A A . 50 ASP HA 1 1 5 5223 1 1 50 ASP HB2 H 14.403 -1.713 -2.930 1.00 . A A . 50 ASP HB2 1 1 5 5224 1 1 50 ASP HB3 H 13.035 -0.809 -3.582 1.00 . A A . 50 ASP HB3 1 1 5 5225 1 1 50 ASP N N 14.186 0.105 -1.161 1.00 . A A . 50 ASP N 1 1 5 5226 1 1 50 ASP O O 14.093 2.299 -3.965 1.00 . A A . 50 ASP O 1 1 5 5227 1 1 50 ASP OD1 O 15.938 -1.207 -4.894 1.00 . A A . 50 ASP OD1 1 1 5 5228 1 1 50 ASP OD2 O 14.151 -0.252 -5.748 1.00 . A A . 50 ASP OD2 1 1 5 5229 1 1 51 TYR C C 12.563 4.404 -2.229 1.00 . A A . 51 TYR C 1 1 5 5230 1 1 51 TYR CA C 11.833 3.138 -2.623 1.00 . A A . 51 TYR CA 1 1 5 5231 1 1 51 TYR CB C 10.475 3.162 -1.918 1.00 . A A . 51 TYR CB 1 1 5 5232 1 1 51 TYR CD1 C 9.278 3.147 -4.150 1.00 . A A . 51 TYR CD1 1 1 5 5233 1 1 51 TYR CD2 C 8.216 2.088 -2.299 1.00 . A A . 51 TYR CD2 1 1 5 5234 1 1 51 TYR CE1 C 8.218 2.794 -4.963 1.00 . A A . 51 TYR CE1 1 1 5 5235 1 1 51 TYR CE2 C 7.151 1.737 -3.105 1.00 . A A . 51 TYR CE2 1 1 5 5236 1 1 51 TYR CG C 9.297 2.800 -2.803 1.00 . A A . 51 TYR CG 1 1 5 5237 1 1 51 TYR CZ C 7.115 2.179 -4.417 1.00 . A A . 51 TYR CZ 1 1 5 5238 1 1 51 TYR H H 12.355 1.411 -1.535 1.00 . A A . 51 TYR H 1 1 5 5239 1 1 51 TYR HA H 11.674 3.105 -3.671 1.00 . A A . 51 TYR HA 1 1 5 5240 1 1 51 TYR HB2 H 10.506 2.481 -1.105 1.00 . A A . 51 TYR HB2 1 1 5 5241 1 1 51 TYR HB3 H 10.294 4.156 -1.530 1.00 . A A . 51 TYR HB3 1 1 5 5242 1 1 51 TYR HD1 H 10.110 3.702 -4.561 1.00 . A A . 51 TYR HD1 1 1 5 5243 1 1 51 TYR HD2 H 8.211 1.810 -1.258 1.00 . A A . 51 TYR HD2 1 1 5 5244 1 1 51 TYR HE1 H 8.223 3.073 -6.007 1.00 . A A . 51 TYR HE1 1 1 5 5245 1 1 51 TYR HE2 H 6.318 1.187 -2.691 1.00 . A A . 51 TYR HE2 1 1 5 5246 1 1 51 TYR HH H 6.434 1.428 -6.090 1.00 . A A . 51 TYR HH 1 1 5 5247 1 1 51 TYR N N 12.626 1.968 -2.285 1.00 . A A . 51 TYR N 1 1 5 5248 1 1 51 TYR O O 13.031 5.171 -3.068 1.00 . A A . 51 TYR O 1 1 5 5249 1 1 51 TYR OH O 6.101 1.738 -5.244 1.00 . A A . 51 TYR OH 1 1 5 5250 1 1 52 GLU C C 14.778 5.614 -0.229 1.00 . A A . 52 GLU C 1 1 5 5251 1 1 52 GLU CA C 13.268 5.775 -0.353 1.00 . A A . 52 GLU CA 1 1 5 5252 1 1 52 GLU CB C 12.658 6.097 1.014 1.00 . A A . 52 GLU CB 1 1 5 5253 1 1 52 GLU CD C 12.339 5.399 3.420 1.00 . A A . 52 GLU CD 1 1 5 5254 1 1 52 GLU CG C 13.030 5.105 2.104 1.00 . A A . 52 GLU CG 1 1 5 5255 1 1 52 GLU H H 12.284 3.912 -0.313 1.00 . A A . 52 GLU H 1 1 5 5256 1 1 52 GLU HA H 13.057 6.582 -1.021 1.00 . A A . 52 GLU HA 1 1 5 5257 1 1 52 GLU HB2 H 12.990 7.077 1.321 1.00 . A A . 52 GLU HB2 1 1 5 5258 1 1 52 GLU HB3 H 11.582 6.106 0.919 1.00 . A A . 52 GLU HB3 1 1 5 5259 1 1 52 GLU HG2 H 12.749 4.113 1.782 1.00 . A A . 52 GLU HG2 1 1 5 5260 1 1 52 GLU HG3 H 14.098 5.144 2.259 1.00 . A A . 52 GLU HG3 1 1 5 5261 1 1 52 GLU N N 12.646 4.596 -0.916 1.00 . A A . 52 GLU N 1 1 5 5262 1 1 52 GLU O O 15.542 6.475 -0.665 1.00 . A A . 52 GLU O 1 1 5 5263 1 1 52 GLU OE1 O 12.551 6.501 3.968 1.00 . A A . 52 GLU OE1 1 1 5 5264 1 1 52 GLU OE2 O 11.589 4.526 3.904 1.00 . A A . 52 GLU OE2 1 1 5 5265 1 1 53 ASP C C 17.276 3.840 -0.760 1.00 . A A . 53 ASP C 1 1 5 5266 1 1 53 ASP CA C 16.615 4.238 0.559 1.00 . A A . 53 ASP CA 1 1 5 5267 1 1 53 ASP CB C 16.789 3.149 1.625 1.00 . A A . 53 ASP CB 1 1 5 5268 1 1 53 ASP CG C 18.182 2.542 1.647 1.00 . A A . 53 ASP CG 1 1 5 5269 1 1 53 ASP H H 14.542 3.854 0.681 1.00 . A A . 53 ASP H 1 1 5 5270 1 1 53 ASP HA H 17.077 5.148 0.913 1.00 . A A . 53 ASP HA 1 1 5 5271 1 1 53 ASP HB2 H 16.595 3.579 2.596 1.00 . A A . 53 ASP HB2 1 1 5 5272 1 1 53 ASP HB3 H 16.072 2.365 1.441 1.00 . A A . 53 ASP HB3 1 1 5 5273 1 1 53 ASP N N 15.200 4.508 0.367 1.00 . A A . 53 ASP N 1 1 5 5274 1 1 53 ASP O O 18.482 4.007 -0.932 1.00 . A A . 53 ASP O 1 1 5 5275 1 1 53 ASP OD1 O 19.076 3.132 2.289 1.00 . A A . 53 ASP OD1 1 1 5 5276 1 1 53 ASP OD2 O 18.375 1.476 1.025 1.00 . A A . 53 ASP OD2 1 1 5 5277 1 1 54 GLY C C 17.678 4.081 -3.691 1.00 . A A . 54 GLY C 1 1 5 5278 1 1 54 GLY CA C 17.022 2.919 -2.975 1.00 . A A . 54 GLY CA 1 1 5 5279 1 1 54 GLY H H 15.529 3.197 -1.499 1.00 . A A . 54 GLY H 1 1 5 5280 1 1 54 GLY HA2 H 17.756 2.140 -2.825 1.00 . A A . 54 GLY HA2 1 1 5 5281 1 1 54 GLY HA3 H 16.224 2.534 -3.591 1.00 . A A . 54 GLY HA3 1 1 5 5282 1 1 54 GLY N N 16.483 3.315 -1.689 1.00 . A A . 54 GLY N 1 1 5 5283 1 1 54 GLY O O 18.730 3.927 -4.311 1.00 . A A . 54 GLY O 1 1 5 5284 1 1 55 LEU C C 18.561 7.146 -3.297 1.00 . A A . 55 LEU C 1 1 5 5285 1 1 55 LEU CA C 17.576 6.453 -4.230 1.00 . A A . 55 LEU CA 1 1 5 5286 1 1 55 LEU CB C 16.439 7.413 -4.594 1.00 . A A . 55 LEU CB 1 1 5 5287 1 1 55 LEU CD1 C 14.770 8.183 -6.297 1.00 . A A . 55 LEU CD1 1 1 5 5288 1 1 55 LEU CD2 C 16.470 6.460 -6.921 1.00 . A A . 55 LEU CD2 1 1 5 5289 1 1 55 LEU CG C 15.591 7.003 -5.802 1.00 . A A . 55 LEU CG 1 1 5 5290 1 1 55 LEU H H 16.208 5.301 -3.104 1.00 . A A . 55 LEU H 1 1 5 5291 1 1 55 LEU HA H 18.095 6.160 -5.130 1.00 . A A . 55 LEU HA 1 1 5 5292 1 1 55 LEU HB2 H 15.784 7.498 -3.736 1.00 . A A . 55 LEU HB2 1 1 5 5293 1 1 55 LEU HB3 H 16.867 8.384 -4.796 1.00 . A A . 55 LEU HB3 1 1 5 5294 1 1 55 LEU HD11 H 15.433 8.974 -6.616 1.00 . A A . 55 LEU HD11 1 1 5 5295 1 1 55 LEU HD12 H 14.139 8.543 -5.499 1.00 . A A . 55 LEU HD12 1 1 5 5296 1 1 55 LEU HD13 H 14.156 7.871 -7.129 1.00 . A A . 55 LEU HD13 1 1 5 5297 1 1 55 LEU HD21 H 16.954 5.553 -6.591 1.00 . A A . 55 LEU HD21 1 1 5 5298 1 1 55 LEU HD22 H 17.218 7.195 -7.179 1.00 . A A . 55 LEU HD22 1 1 5 5299 1 1 55 LEU HD23 H 15.860 6.248 -7.786 1.00 . A A . 55 LEU HD23 1 1 5 5300 1 1 55 LEU HG H 14.905 6.222 -5.505 1.00 . A A . 55 LEU HG 1 1 5 5301 1 1 55 LEU N N 17.049 5.249 -3.603 1.00 . A A . 55 LEU N 1 1 5 5302 1 1 55 LEU O O 19.707 7.406 -3.666 1.00 . A A . 55 LEU O 1 1 5 5303 1 1 56 GLU C C 19.695 7.069 -0.259 1.00 . A A . 56 GLU C 1 1 5 5304 1 1 56 GLU CA C 18.938 8.097 -1.090 1.00 . A A . 56 GLU CA 1 1 5 5305 1 1 56 GLU CB C 18.086 8.983 -0.184 1.00 . A A . 56 GLU CB 1 1 5 5306 1 1 56 GLU CD C 16.771 11.125 0.061 1.00 . A A . 56 GLU CD 1 1 5 5307 1 1 56 GLU CG C 17.576 10.240 -0.870 1.00 . A A . 56 GLU CG 1 1 5 5308 1 1 56 GLU H H 17.178 7.214 -1.857 1.00 . A A . 56 GLU H 1 1 5 5309 1 1 56 GLU HA H 19.649 8.714 -1.610 1.00 . A A . 56 GLU HA 1 1 5 5310 1 1 56 GLU HB2 H 17.236 8.413 0.150 1.00 . A A . 56 GLU HB2 1 1 5 5311 1 1 56 GLU HB3 H 18.673 9.278 0.672 1.00 . A A . 56 GLU HB3 1 1 5 5312 1 1 56 GLU HG2 H 18.422 10.803 -1.236 1.00 . A A . 56 GLU HG2 1 1 5 5313 1 1 56 GLU HG3 H 16.949 9.951 -1.701 1.00 . A A . 56 GLU HG3 1 1 5 5314 1 1 56 GLU N N 18.103 7.442 -2.086 1.00 . A A . 56 GLU N 1 1 5 5315 1 1 56 GLU O O 19.535 6.997 0.959 1.00 . A A . 56 GLU O 1 1 5 5316 1 1 56 GLU OE1 O 17.377 11.983 0.736 1.00 . A A . 56 GLU OE1 1 1 5 5317 1 1 56 GLU OE2 O 15.534 10.961 0.113 1.00 . A A . 56 GLU OE2 1 1 5 5318 1 1 57 TYR C C 22.659 5.800 0.179 1.00 . A A . 57 TYR C 1 1 5 5319 1 1 57 TYR CA C 21.310 5.246 -0.267 1.00 . A A . 57 TYR CA 1 1 5 5320 1 1 57 TYR CB C 21.518 4.054 -1.204 1.00 . A A . 57 TYR CB 1 1 5 5321 1 1 57 TYR CD1 C 21.626 1.974 0.222 1.00 . A A . 57 TYR CD1 1 1 5 5322 1 1 57 TYR CD2 C 23.646 2.768 -0.765 1.00 . A A . 57 TYR CD2 1 1 5 5323 1 1 57 TYR CE1 C 22.316 0.927 0.802 1.00 . A A . 57 TYR CE1 1 1 5 5324 1 1 57 TYR CE2 C 24.343 1.724 -0.187 1.00 . A A . 57 TYR CE2 1 1 5 5325 1 1 57 TYR CG C 22.277 2.910 -0.570 1.00 . A A . 57 TYR CG 1 1 5 5326 1 1 57 TYR CZ C 23.675 0.806 0.595 1.00 . A A . 57 TYR CZ 1 1 5 5327 1 1 57 TYR H H 20.602 6.389 -1.902 1.00 . A A . 57 TYR H 1 1 5 5328 1 1 57 TYR HA H 20.762 4.919 0.604 1.00 . A A . 57 TYR HA 1 1 5 5329 1 1 57 TYR HB2 H 20.556 3.679 -1.518 1.00 . A A . 57 TYR HB2 1 1 5 5330 1 1 57 TYR HB3 H 22.072 4.381 -2.071 1.00 . A A . 57 TYR HB3 1 1 5 5331 1 1 57 TYR HD1 H 20.562 2.071 0.382 1.00 . A A . 57 TYR HD1 1 1 5 5332 1 1 57 TYR HD2 H 24.167 3.489 -1.377 1.00 . A A . 57 TYR HD2 1 1 5 5333 1 1 57 TYR HE1 H 21.792 0.208 1.415 1.00 . A A . 57 TYR HE1 1 1 5 5334 1 1 57 TYR HE2 H 25.406 1.630 -0.350 1.00 . A A . 57 TYR HE2 1 1 5 5335 1 1 57 TYR HH H 23.853 -1.044 1.087 1.00 . A A . 57 TYR HH 1 1 5 5336 1 1 57 TYR N N 20.522 6.277 -0.932 1.00 . A A . 57 TYR N 1 1 5 5337 1 1 57 TYR O O 22.742 6.307 1.317 1.00 . A A . 57 TYR O 1 1 5 5338 1 1 57 TYR OXT O 23.620 5.723 -0.615 1.00 . A A . 57 TYR OXT 1 1 5 5339 1 1 57 TYR OH O 24.364 -0.235 1.171 1.00 . A A . 57 TYR OH 1 1 5 5340 2 2 1 ALA C C -16.893 -11.110 0.020 1.00 . B B . 1 ALA C 1 1 5 5341 2 2 1 ALA CA C -16.744 -12.596 0.346 1.00 . B B . 1 ALA CA 1 1 5 5342 2 2 1 ALA CB C -18.028 -13.341 0.004 1.00 . B B . 1 ALA CB 1 1 5 5343 2 2 1 ALA H1 H -17.241 -12.985 2.336 1.00 . B B . 1 ALA H1 1 1 5 5344 2 2 1 ALA H2 H -15.894 -11.980 2.149 1.00 . B B . 1 ALA H2 1 1 5 5345 2 2 1 ALA H3 H -15.755 -13.641 1.858 1.00 . B B . 1 ALA H3 1 1 5 5346 2 2 1 ALA HA H -15.953 -13.005 -0.267 1.00 . B B . 1 ALA HA 1 1 5 5347 2 2 1 ALA HB1 H -18.756 -13.182 0.784 1.00 . B B . 1 ALA HB1 1 1 5 5348 2 2 1 ALA HB2 H -17.819 -14.397 -0.082 1.00 . B B . 1 ALA HB2 1 1 5 5349 2 2 1 ALA HB3 H -18.419 -12.974 -0.934 1.00 . B B . 1 ALA HB3 1 1 5 5350 2 2 1 ALA N N -16.384 -12.816 1.772 1.00 . B B . 1 ALA N 1 1 5 5351 2 2 1 ALA O O -16.369 -10.640 -0.990 1.00 . B B . 1 ALA O 1 1 5 5352 2 2 2 PRO C C -16.527 -8.180 0.268 1.00 . B B . 2 PRO C 1 1 5 5353 2 2 2 PRO CA C -17.814 -8.910 0.646 1.00 . B B . 2 PRO CA 1 1 5 5354 2 2 2 PRO CB C -18.330 -8.419 1.998 1.00 . B B . 2 PRO CB 1 1 5 5355 2 2 2 PRO CD C -18.262 -10.812 2.104 1.00 . B B . 2 PRO CD 1 1 5 5356 2 2 2 PRO CG C -19.013 -9.600 2.593 1.00 . B B . 2 PRO CG 1 1 5 5357 2 2 2 PRO HA H -18.562 -8.734 -0.113 1.00 . B B . 2 PRO HA 1 1 5 5358 2 2 2 PRO HB2 H -17.499 -8.091 2.606 1.00 . B B . 2 PRO HB2 1 1 5 5359 2 2 2 PRO HB3 H -19.019 -7.601 1.847 1.00 . B B . 2 PRO HB3 1 1 5 5360 2 2 2 PRO HD2 H -17.529 -11.121 2.835 1.00 . B B . 2 PRO HD2 1 1 5 5361 2 2 2 PRO HD3 H -18.949 -11.618 1.895 1.00 . B B . 2 PRO HD3 1 1 5 5362 2 2 2 PRO HG2 H -18.969 -9.544 3.671 1.00 . B B . 2 PRO HG2 1 1 5 5363 2 2 2 PRO HG3 H -20.039 -9.637 2.261 1.00 . B B . 2 PRO HG3 1 1 5 5364 2 2 2 PRO N N -17.606 -10.345 0.868 1.00 . B B . 2 PRO N 1 1 5 5365 2 2 2 PRO O O -15.691 -7.896 1.125 1.00 . B B . 2 PRO O 1 1 5 5366 2 2 3 PRO C C -14.947 -5.830 -0.806 1.00 . B B . 3 PRO C 1 1 5 5367 2 2 3 PRO CA C -15.164 -7.161 -1.518 1.00 . B B . 3 PRO CA 1 1 5 5368 2 2 3 PRO CB C -15.467 -6.930 -3.001 1.00 . B B . 3 PRO CB 1 1 5 5369 2 2 3 PRO CD C -17.294 -8.184 -2.118 1.00 . B B . 3 PRO CD 1 1 5 5370 2 2 3 PRO CG C -16.466 -7.977 -3.354 1.00 . B B . 3 PRO CG 1 1 5 5371 2 2 3 PRO HA H -14.276 -7.767 -1.420 1.00 . B B . 3 PRO HA 1 1 5 5372 2 2 3 PRO HB2 H -15.870 -5.937 -3.138 1.00 . B B . 3 PRO HB2 1 1 5 5373 2 2 3 PRO HB3 H -14.562 -7.038 -3.579 1.00 . B B . 3 PRO HB3 1 1 5 5374 2 2 3 PRO HD2 H -18.137 -7.509 -2.111 1.00 . B B . 3 PRO HD2 1 1 5 5375 2 2 3 PRO HD3 H -17.628 -9.209 -2.054 1.00 . B B . 3 PRO HD3 1 1 5 5376 2 2 3 PRO HG2 H -17.086 -7.635 -4.169 1.00 . B B . 3 PRO HG2 1 1 5 5377 2 2 3 PRO HG3 H -15.960 -8.891 -3.623 1.00 . B B . 3 PRO HG3 1 1 5 5378 2 2 3 PRO N N -16.353 -7.867 -1.029 1.00 . B B . 3 PRO N 1 1 5 5379 2 2 3 PRO O O -15.589 -4.830 -1.129 1.00 . B B . 3 PRO O 1 1 5 5380 2 2 4 GLY C C -12.585 -3.839 0.325 1.00 . B B . 4 GLY C 1 1 5 5381 2 2 4 GLY CA C -13.754 -4.608 0.906 1.00 . B B . 4 GLY CA 1 1 5 5382 2 2 4 GLY H H -13.558 -6.649 0.379 1.00 . B B . 4 GLY H 1 1 5 5383 2 2 4 GLY HA2 H -14.629 -3.975 0.892 1.00 . B B . 4 GLY HA2 1 1 5 5384 2 2 4 GLY HA3 H -13.526 -4.868 1.930 1.00 . B B . 4 GLY HA3 1 1 5 5385 2 2 4 GLY N N -14.040 -5.823 0.165 1.00 . B B . 4 GLY N 1 1 5 5386 2 2 4 GLY O O -12.751 -3.051 -0.607 1.00 . B B . 4 GLY O 1 1 5 5387 2 2 5 THR C C -9.518 -4.181 -0.709 1.00 . B B . 5 THR C 1 1 5 5388 2 2 5 THR CA C -10.196 -3.391 0.403 1.00 . B B . 5 THR CA 1 1 5 5389 2 2 5 THR CB C -9.188 -3.173 1.542 1.00 . B B . 5 THR CB 1 1 5 5390 2 2 5 THR CG2 C -8.711 -4.503 2.107 1.00 . B B . 5 THR CG2 1 1 5 5391 2 2 5 THR H H -11.328 -4.696 1.624 1.00 . B B . 5 THR H 1 1 5 5392 2 2 5 THR HA H -10.485 -2.426 0.020 1.00 . B B . 5 THR HA 1 1 5 5393 2 2 5 THR HB H -9.670 -2.614 2.330 1.00 . B B . 5 THR HB 1 1 5 5394 2 2 5 THR HG1 H -7.489 -3.009 0.558 1.00 . B B . 5 THR HG1 1 1 5 5395 2 2 5 THR HG21 H -9.555 -5.052 2.496 1.00 . B B . 5 THR HG21 1 1 5 5396 2 2 5 THR HG22 H -8.001 -4.323 2.900 1.00 . B B . 5 THR HG22 1 1 5 5397 2 2 5 THR HG23 H -8.238 -5.078 1.324 1.00 . B B . 5 THR HG23 1 1 5 5398 2 2 5 THR N N -11.396 -4.067 0.876 1.00 . B B . 5 THR N 1 1 5 5399 2 2 5 THR O O -9.839 -5.346 -0.945 1.00 . B B . 5 THR O 1 1 5 5400 2 2 5 THR OG1 O -8.068 -2.428 1.057 1.00 . B B . 5 THR OG1 1 1 5 5401 2 2 6 ALA C C -6.345 -4.185 -2.206 1.00 . B B . 6 ALA C 1 1 5 5402 2 2 6 ALA CA C -7.846 -4.171 -2.479 1.00 . B B . 6 ALA CA 1 1 5 5403 2 2 6 ALA CB C -8.143 -3.451 -3.786 1.00 . B B . 6 ALA CB 1 1 5 5404 2 2 6 ALA H H -8.359 -2.614 -1.145 1.00 . B B . 6 ALA H 1 1 5 5405 2 2 6 ALA HA H -8.197 -5.189 -2.568 1.00 . B B . 6 ALA HA 1 1 5 5406 2 2 6 ALA HB1 H -9.202 -3.507 -3.995 1.00 . B B . 6 ALA HB1 1 1 5 5407 2 2 6 ALA HB2 H -7.593 -3.921 -4.589 1.00 . B B . 6 ALA HB2 1 1 5 5408 2 2 6 ALA HB3 H -7.845 -2.415 -3.703 1.00 . B B . 6 ALA HB3 1 1 5 5409 2 2 6 ALA N N -8.573 -3.538 -1.387 1.00 . B B . 6 ALA N 1 1 5 5410 2 2 6 ALA O O -5.548 -3.763 -3.043 1.00 . B B . 6 ALA O 1 1 5 5411 2 2 7 ARG C C -3.681 -5.247 -1.776 1.00 . B B . 7 ARG C 1 1 5 5412 2 2 7 ARG CA C -4.562 -4.763 -0.628 1.00 . B B . 7 ARG CA 1 1 5 5413 2 2 7 ARG CB C -4.418 -5.717 0.559 1.00 . B B . 7 ARG CB 1 1 5 5414 2 2 7 ARG CD C -4.753 -8.040 1.468 1.00 . B B . 7 ARG CD 1 1 5 5415 2 2 7 ARG CG C -4.857 -7.140 0.247 1.00 . B B . 7 ARG CG 1 1 5 5416 2 2 7 ARG CZ C -4.351 -10.328 0.647 1.00 . B B . 7 ARG CZ 1 1 5 5417 2 2 7 ARG H H -6.655 -5.004 -0.409 1.00 . B B . 7 ARG H 1 1 5 5418 2 2 7 ARG HA H -4.241 -3.783 -0.330 1.00 . B B . 7 ARG HA 1 1 5 5419 2 2 7 ARG HB2 H -3.383 -5.741 0.866 1.00 . B B . 7 ARG HB2 1 1 5 5420 2 2 7 ARG HB3 H -5.020 -5.349 1.377 1.00 . B B . 7 ARG HB3 1 1 5 5421 2 2 7 ARG HD2 H -3.731 -8.044 1.814 1.00 . B B . 7 ARG HD2 1 1 5 5422 2 2 7 ARG HD3 H -5.393 -7.645 2.243 1.00 . B B . 7 ARG HD3 1 1 5 5423 2 2 7 ARG HE H -6.086 -9.664 1.376 1.00 . B B . 7 ARG HE 1 1 5 5424 2 2 7 ARG HG2 H -5.883 -7.124 -0.090 1.00 . B B . 7 ARG HG2 1 1 5 5425 2 2 7 ARG HG3 H -4.226 -7.537 -0.535 1.00 . B B . 7 ARG HG3 1 1 5 5426 2 2 7 ARG HH11 H -2.752 -9.097 0.523 1.00 . B B . 7 ARG HH11 1 1 5 5427 2 2 7 ARG HH12 H -2.490 -10.713 -0.042 1.00 . B B . 7 ARG HH12 1 1 5 5428 2 2 7 ARG HH21 H -5.745 -11.792 0.633 1.00 . B B . 7 ARG HH21 1 1 5 5429 2 2 7 ARG HH22 H -4.191 -12.243 0.019 1.00 . B B . 7 ARG HH22 1 1 5 5430 2 2 7 ARG N N -5.968 -4.683 -1.029 1.00 . B B . 7 ARG N 1 1 5 5431 2 2 7 ARG NE N -5.161 -9.413 1.172 1.00 . B B . 7 ARG NE 1 1 5 5432 2 2 7 ARG NH1 N -3.095 -10.021 0.351 1.00 . B B . 7 ARG NH1 1 1 5 5433 2 2 7 ARG NH2 N -4.799 -11.555 0.415 1.00 . B B . 7 ARG NH2 1 1 5 5434 2 2 7 ARG O O -4.049 -6.182 -2.488 1.00 . B B . 7 ARG O 1 1 5 5435 2 2 8 ARG C C -1.367 -6.534 -2.938 1.00 . B B . 8 ARG C 1 1 5 5436 2 2 8 ARG CA C -1.616 -5.033 -3.031 1.00 . B B . 8 ARG CA 1 1 5 5437 2 2 8 ARG CB C -0.294 -4.271 -2.959 1.00 . B B . 8 ARG CB 1 1 5 5438 2 2 8 ARG CD C -0.186 -3.677 -5.395 1.00 . B B . 8 ARG CD 1 1 5 5439 2 2 8 ARG CG C 0.521 -4.362 -4.238 1.00 . B B . 8 ARG CG 1 1 5 5440 2 2 8 ARG CZ C 0.165 -3.276 -7.796 1.00 . B B . 8 ARG CZ 1 1 5 5441 2 2 8 ARG H H -2.257 -3.862 -1.387 1.00 . B B . 8 ARG H 1 1 5 5442 2 2 8 ARG HA H -2.097 -4.819 -3.975 1.00 . B B . 8 ARG HA 1 1 5 5443 2 2 8 ARG HB2 H -0.503 -3.229 -2.763 1.00 . B B . 8 ARG HB2 1 1 5 5444 2 2 8 ARG HB3 H 0.298 -4.671 -2.149 1.00 . B B . 8 ARG HB3 1 1 5 5445 2 2 8 ARG HD2 H -1.125 -4.180 -5.577 1.00 . B B . 8 ARG HD2 1 1 5 5446 2 2 8 ARG HD3 H -0.376 -2.649 -5.125 1.00 . B B . 8 ARG HD3 1 1 5 5447 2 2 8 ARG HE H 1.522 -4.054 -6.559 1.00 . B B . 8 ARG HE 1 1 5 5448 2 2 8 ARG HG2 H 1.475 -3.886 -4.080 1.00 . B B . 8 ARG HG2 1 1 5 5449 2 2 8 ARG HG3 H 0.671 -5.403 -4.484 1.00 . B B . 8 ARG HG3 1 1 5 5450 2 2 8 ARG HH11 H -1.667 -2.771 -7.106 1.00 . B B . 8 ARG HH11 1 1 5 5451 2 2 8 ARG HH12 H -1.403 -2.481 -8.792 1.00 . B B . 8 ARG HH12 1 1 5 5452 2 2 8 ARG HH21 H 1.883 -3.675 -8.781 1.00 . B B . 8 ARG HH21 1 1 5 5453 2 2 8 ARG HH22 H 0.616 -2.994 -9.746 1.00 . B B . 8 ARG HH22 1 1 5 5454 2 2 8 ARG N N -2.515 -4.617 -1.965 1.00 . B B . 8 ARG N 1 1 5 5455 2 2 8 ARG NE N 0.609 -3.704 -6.619 1.00 . B B . 8 ARG NE 1 1 5 5456 2 2 8 ARG NH1 N -1.069 -2.803 -7.907 1.00 . B B . 8 ARG NH1 1 1 5 5457 2 2 8 ARG NH2 N 0.952 -3.319 -8.861 1.00 . B B . 8 ARG NH2 1 1 5 5458 2 2 8 ARG O O -1.258 -7.085 -1.842 1.00 . B B . 8 ARG O 1 1 5 5459 2 2 9 LYS C C 0.153 -9.029 -4.934 1.00 . B B . 9 LYS C 1 1 5 5460 2 2 9 LYS CA C -1.070 -8.639 -4.109 1.00 . B B . 9 LYS CA 1 1 5 5461 2 2 9 LYS CB C -2.317 -9.359 -4.645 1.00 . B B . 9 LYS CB 1 1 5 5462 2 2 9 LYS CD C -2.339 -11.127 -2.858 1.00 . B B . 9 LYS CD 1 1 5 5463 2 2 9 LYS CE C -2.596 -12.596 -2.562 1.00 . B B . 9 LYS CE 1 1 5 5464 2 2 9 LYS CG C -2.332 -10.851 -4.354 1.00 . B B . 9 LYS CG 1 1 5 5465 2 2 9 LYS H H -1.325 -6.684 -4.923 1.00 . B B . 9 LYS H 1 1 5 5466 2 2 9 LYS HA H -0.906 -8.958 -3.089 1.00 . B B . 9 LYS HA 1 1 5 5467 2 2 9 LYS HB2 H -3.196 -8.922 -4.192 1.00 . B B . 9 LYS HB2 1 1 5 5468 2 2 9 LYS HB3 H -2.370 -9.226 -5.716 1.00 . B B . 9 LYS HB3 1 1 5 5469 2 2 9 LYS HD2 H -1.381 -10.849 -2.446 1.00 . B B . 9 LYS HD2 1 1 5 5470 2 2 9 LYS HD3 H -3.116 -10.535 -2.397 1.00 . B B . 9 LYS HD3 1 1 5 5471 2 2 9 LYS HE2 H -2.569 -12.745 -1.493 1.00 . B B . 9 LYS HE2 1 1 5 5472 2 2 9 LYS HE3 H -3.573 -12.860 -2.938 1.00 . B B . 9 LYS HE3 1 1 5 5473 2 2 9 LYS HG2 H -3.217 -11.285 -4.794 1.00 . B B . 9 LYS HG2 1 1 5 5474 2 2 9 LYS HG3 H -1.452 -11.302 -4.790 1.00 . B B . 9 LYS HG3 1 1 5 5475 2 2 9 LYS HZ1 H -1.783 -14.474 -2.980 1.00 . B B . 9 LYS HZ1 1 1 5 5476 2 2 9 LYS HZ2 H -0.629 -13.245 -2.840 1.00 . B B . 9 LYS HZ2 1 1 5 5477 2 2 9 LYS HZ3 H -1.589 -13.349 -4.229 1.00 . B B . 9 LYS HZ3 1 1 5 5478 2 2 9 LYS N N -1.276 -7.188 -4.083 1.00 . B B . 9 LYS N 1 1 5 5479 2 2 9 LYS NZ N -1.578 -13.478 -3.198 1.00 . B B . 9 LYS NZ 1 1 5 5480 2 2 9 LYS O O 0.104 -9.972 -5.724 1.00 . B B . 9 LYS O 1 1 5 5481 2 2 10 ARG C C 3.556 -9.076 -4.493 1.00 . B B . 10 ARG C 1 1 5 5482 2 2 10 ARG CA C 2.487 -8.593 -5.469 1.00 . B B . 10 ARG CA 1 1 5 5483 2 2 10 ARG CB C 2.988 -7.360 -6.225 1.00 . B B . 10 ARG CB 1 1 5 5484 2 2 10 ARG CD C 3.981 -5.054 -6.121 1.00 . B B . 10 ARG CD 1 1 5 5485 2 2 10 ARG CG C 3.406 -6.213 -5.321 1.00 . B B . 10 ARG CG 1 1 5 5486 2 2 10 ARG CZ C 5.857 -4.644 -7.660 1.00 . B B . 10 ARG CZ 1 1 5 5487 2 2 10 ARG H H 1.224 -7.537 -4.136 1.00 . B B . 10 ARG H 1 1 5 5488 2 2 10 ARG HA H 2.281 -9.381 -6.177 1.00 . B B . 10 ARG HA 1 1 5 5489 2 2 10 ARG HB2 H 3.840 -7.643 -6.826 1.00 . B B . 10 ARG HB2 1 1 5 5490 2 2 10 ARG HB3 H 2.201 -7.008 -6.877 1.00 . B B . 10 ARG HB3 1 1 5 5491 2 2 10 ARG HD2 H 3.280 -4.789 -6.899 1.00 . B B . 10 ARG HD2 1 1 5 5492 2 2 10 ARG HD3 H 4.119 -4.211 -5.462 1.00 . B B . 10 ARG HD3 1 1 5 5493 2 2 10 ARG HE H 5.698 -6.220 -6.448 1.00 . B B . 10 ARG HE 1 1 5 5494 2 2 10 ARG HG2 H 2.543 -5.865 -4.773 1.00 . B B . 10 ARG HG2 1 1 5 5495 2 2 10 ARG HG3 H 4.157 -6.567 -4.628 1.00 . B B . 10 ARG HG3 1 1 5 5496 2 2 10 ARG HH11 H 4.422 -3.220 -7.677 1.00 . B B . 10 ARG HH11 1 1 5 5497 2 2 10 ARG HH12 H 5.746 -2.952 -8.761 1.00 . B B . 10 ARG HH12 1 1 5 5498 2 2 10 ARG HH21 H 7.445 -5.875 -7.870 1.00 . B B . 10 ARG HH21 1 1 5 5499 2 2 10 ARG HH22 H 7.463 -4.461 -8.871 1.00 . B B . 10 ARG HH22 1 1 5 5500 2 2 10 ARG N N 1.250 -8.297 -4.755 1.00 . B B . 10 ARG N 1 1 5 5501 2 2 10 ARG NE N 5.260 -5.392 -6.736 1.00 . B B . 10 ARG NE 1 1 5 5502 2 2 10 ARG NH1 N 5.295 -3.512 -8.066 1.00 . B B . 10 ARG NH1 1 1 5 5503 2 2 10 ARG NH2 N 7.017 -5.025 -8.176 1.00 . B B . 10 ARG NH2 1 1 5 5504 2 2 10 ARG O O 4.441 -9.851 -4.857 1.00 . B B . 10 ARG O 1 1 5 5505 2 2 11 LYS C C 5.844 -9.012 -2.725 1.00 . B B . 11 LYS C 1 1 5 5506 2 2 11 LYS CA C 4.410 -8.991 -2.201 1.00 . B B . 11 LYS CA 1 1 5 5507 2 2 11 LYS CB C 4.037 -10.355 -1.622 1.00 . B B . 11 LYS CB 1 1 5 5508 2 2 11 LYS CD C 4.042 -9.609 0.773 1.00 . B B . 11 LYS CD 1 1 5 5509 2 2 11 LYS CE C 4.484 -9.933 2.191 1.00 . B B . 11 LYS CE 1 1 5 5510 2 2 11 LYS CG C 4.601 -10.602 -0.234 1.00 . B B . 11 LYS CG 1 1 5 5511 2 2 11 LYS H H 2.742 -7.988 -3.029 1.00 . B B . 11 LYS H 1 1 5 5512 2 2 11 LYS HA H 4.343 -8.251 -1.417 1.00 . B B . 11 LYS HA 1 1 5 5513 2 2 11 LYS HB2 H 2.961 -10.424 -1.564 1.00 . B B . 11 LYS HB2 1 1 5 5514 2 2 11 LYS HB3 H 4.407 -11.126 -2.280 1.00 . B B . 11 LYS HB3 1 1 5 5515 2 2 11 LYS HD2 H 4.386 -8.619 0.519 1.00 . B B . 11 LYS HD2 1 1 5 5516 2 2 11 LYS HD3 H 2.964 -9.638 0.729 1.00 . B B . 11 LYS HD3 1 1 5 5517 2 2 11 LYS HE2 H 5.563 -9.918 2.232 1.00 . B B . 11 LYS HE2 1 1 5 5518 2 2 11 LYS HE3 H 4.090 -9.181 2.858 1.00 . B B . 11 LYS HE3 1 1 5 5519 2 2 11 LYS HG2 H 4.342 -11.602 0.077 1.00 . B B . 11 LYS HG2 1 1 5 5520 2 2 11 LYS HG3 H 5.674 -10.500 -0.269 1.00 . B B . 11 LYS HG3 1 1 5 5521 2 2 11 LYS HZ1 H 4.358 -11.483 3.587 1.00 . B B . 11 LYS HZ1 1 1 5 5522 2 2 11 LYS HZ2 H 4.336 -12.006 1.978 1.00 . B B . 11 LYS HZ2 1 1 5 5523 2 2 11 LYS HZ3 H 2.962 -11.288 2.652 1.00 . B B . 11 LYS HZ3 1 1 5 5524 2 2 11 LYS N N 3.465 -8.610 -3.249 1.00 . B B . 11 LYS N 1 1 5 5525 2 2 11 LYS NZ N 4.002 -11.272 2.633 1.00 . B B . 11 LYS NZ 1 1 5 5526 2 2 11 LYS O O 6.472 -10.067 -2.820 1.00 . B B . 11 LYS O 1 1 5 5527 2 2 12 ALA C C 8.730 -8.333 -2.667 1.00 . B B . 12 ALA C 1 1 5 5528 2 2 12 ALA CA C 7.700 -7.678 -3.579 1.00 . B B . 12 ALA CA 1 1 5 5529 2 2 12 ALA CB C 8.019 -6.203 -3.713 1.00 . B B . 12 ALA CB 1 1 5 5530 2 2 12 ALA H H 5.784 -7.035 -2.964 1.00 . B B . 12 ALA H 1 1 5 5531 2 2 12 ALA HA H 7.748 -8.127 -4.559 1.00 . B B . 12 ALA HA 1 1 5 5532 2 2 12 ALA HB1 H 7.253 -5.717 -4.300 1.00 . B B . 12 ALA HB1 1 1 5 5533 2 2 12 ALA HB2 H 8.978 -6.083 -4.195 1.00 . B B . 12 ALA HB2 1 1 5 5534 2 2 12 ALA HB3 H 8.053 -5.764 -2.724 1.00 . B B . 12 ALA HB3 1 1 5 5535 2 2 12 ALA N N 6.345 -7.832 -3.064 1.00 . B B . 12 ALA N 1 1 5 5536 2 2 12 ALA O O 9.827 -8.684 -3.102 1.00 . B B . 12 ALA O 1 1 5 5537 2 2 13 ASP C C 8.812 -10.478 -0.019 1.00 . B B . 13 ASP C 1 1 5 5538 2 2 13 ASP CA C 9.263 -9.077 -0.416 1.00 . B B . 13 ASP CA 1 1 5 5539 2 2 13 ASP CB C 9.298 -8.172 0.814 1.00 . B B . 13 ASP CB 1 1 5 5540 2 2 13 ASP CG C 10.087 -8.769 1.964 1.00 . B B . 13 ASP CG 1 1 5 5541 2 2 13 ASP H H 7.474 -8.207 -1.122 1.00 . B B . 13 ASP H 1 1 5 5542 2 2 13 ASP HA H 10.250 -9.128 -0.846 1.00 . B B . 13 ASP HA 1 1 5 5543 2 2 13 ASP HB2 H 9.745 -7.224 0.546 1.00 . B B . 13 ASP HB2 1 1 5 5544 2 2 13 ASP HB3 H 8.283 -7.998 1.142 1.00 . B B . 13 ASP HB3 1 1 5 5545 2 2 13 ASP N N 8.367 -8.494 -1.403 1.00 . B B . 13 ASP N 1 1 5 5546 2 2 13 ASP O O 9.452 -11.468 -0.374 1.00 . B B . 13 ASP O 1 1 5 5547 2 2 13 ASP OD1 O 9.501 -9.547 2.746 1.00 . B B . 13 ASP OD1 1 1 5 5548 2 2 13 ASP OD2 O 11.290 -8.457 2.083 1.00 . B B . 13 ASP OD2 1 1 5 5549 2 2 14 SER C C 8.082 -12.463 2.223 1.00 . B B . 14 SER C 1 1 5 5550 2 2 14 SER CA C 7.175 -11.828 1.174 1.00 . B B . 14 SER CA 1 1 5 5551 2 2 14 SER CB C 6.995 -12.782 -0.009 1.00 . B B . 14 SER CB 1 1 5 5552 2 2 14 SER H H 7.256 -9.723 0.977 1.00 . B B . 14 SER H 1 1 5 5553 2 2 14 SER HA H 6.211 -11.636 1.618 1.00 . B B . 14 SER HA 1 1 5 5554 2 2 14 SER HB2 H 6.418 -12.294 -0.780 1.00 . B B . 14 SER HB2 1 1 5 5555 2 2 14 SER HB3 H 7.962 -13.053 -0.402 1.00 . B B . 14 SER HB3 1 1 5 5556 2 2 14 SER HG H 6.190 -14.531 -0.376 1.00 . B B . 14 SER HG 1 1 5 5557 2 2 14 SER N N 7.715 -10.551 0.724 1.00 . B B . 14 SER N 1 1 5 5558 2 2 14 SER O O 8.985 -13.234 1.835 1.00 . B B . 14 SER O 1 1 5 5559 2 2 14 SER OXT O 7.883 -12.184 3.424 1.00 . B B . 14 SER OXT 1 1 5 5560 2 2 14 SER OG O 6.319 -13.963 0.387 1.00 . B B . 14 SER OG 1 1 6 5561 1 1 1 GLY C C 13.432 7.092 -2.361 1.00 . A A . 1 GLY C 1 1 6 5562 1 1 1 GLY CA C 13.221 7.705 -3.734 1.00 . A A . 1 GLY CA 1 1 6 5563 1 1 1 GLY H1 H 12.508 9.531 -3.010 1.00 . A A . 1 GLY H1 1 1 6 5564 1 1 1 GLY H2 H 11.289 8.464 -3.493 1.00 . A A . 1 GLY H2 1 1 6 5565 1 1 1 GLY H3 H 12.205 9.280 -4.655 1.00 . A A . 1 GLY H3 1 1 6 5566 1 1 1 GLY HA2 H 12.868 6.938 -4.407 1.00 . A A . 1 GLY HA2 1 1 6 5567 1 1 1 GLY HA3 H 14.167 8.079 -4.096 1.00 . A A . 1 GLY HA3 1 1 6 5568 1 1 1 GLY N N 12.236 8.823 -3.721 1.00 . A A . 1 GLY N 1 1 6 5569 1 1 1 GLY O O 14.464 6.470 -2.107 1.00 . A A . 1 GLY O 1 1 6 5570 1 1 2 SER C C 11.159 6.377 0.411 1.00 . A A . 2 SER C 1 1 6 5571 1 1 2 SER CA C 12.544 6.725 -0.123 1.00 . A A . 2 SER CA 1 1 6 5572 1 1 2 SER CB C 13.227 7.731 0.805 1.00 . A A . 2 SER CB 1 1 6 5573 1 1 2 SER H H 11.660 7.772 -1.733 1.00 . A A . 2 SER H 1 1 6 5574 1 1 2 SER HA H 13.138 5.822 -0.166 1.00 . A A . 2 SER HA 1 1 6 5575 1 1 2 SER HB2 H 13.192 7.364 1.820 1.00 . A A . 2 SER HB2 1 1 6 5576 1 1 2 SER HB3 H 14.256 7.855 0.503 1.00 . A A . 2 SER HB3 1 1 6 5577 1 1 2 SER HG H 13.046 9.611 1.323 1.00 . A A . 2 SER HG 1 1 6 5578 1 1 2 SER N N 12.457 7.266 -1.474 1.00 . A A . 2 SER N 1 1 6 5579 1 1 2 SER O O 10.897 5.238 0.795 1.00 . A A . 2 SER O 1 1 6 5580 1 1 2 SER OG O 12.581 8.990 0.757 1.00 . A A . 2 SER OG 1 1 6 5581 1 1 3 GLN C C 7.946 7.060 -0.259 1.00 . A A . 3 GLN C 1 1 6 5582 1 1 3 GLN CA C 8.914 7.178 0.912 1.00 . A A . 3 GLN CA 1 1 6 5583 1 1 3 GLN CB C 8.503 8.333 1.816 1.00 . A A . 3 GLN CB 1 1 6 5584 1 1 3 GLN CD C 8.686 9.399 4.107 1.00 . A A . 3 GLN CD 1 1 6 5585 1 1 3 GLN CG C 9.228 8.350 3.153 1.00 . A A . 3 GLN CG 1 1 6 5586 1 1 3 GLN H H 10.550 8.257 0.114 1.00 . A A . 3 GLN H 1 1 6 5587 1 1 3 GLN HA H 8.889 6.269 1.479 1.00 . A A . 3 GLN HA 1 1 6 5588 1 1 3 GLN HB2 H 8.716 9.250 1.306 1.00 . A A . 3 GLN HB2 1 1 6 5589 1 1 3 GLN HB3 H 7.442 8.270 2.006 1.00 . A A . 3 GLN HB3 1 1 6 5590 1 1 3 GLN HE21 H 8.247 10.612 2.591 1.00 . A A . 3 GLN HE21 1 1 6 5591 1 1 3 GLN HE22 H 7.862 11.208 4.165 1.00 . A A . 3 GLN HE22 1 1 6 5592 1 1 3 GLN HG2 H 9.125 7.380 3.615 1.00 . A A . 3 GLN HG2 1 1 6 5593 1 1 3 GLN HG3 H 10.275 8.553 2.976 1.00 . A A . 3 GLN HG3 1 1 6 5594 1 1 3 GLN N N 10.278 7.371 0.432 1.00 . A A . 3 GLN N 1 1 6 5595 1 1 3 GLN NE2 N 8.218 10.519 3.565 1.00 . A A . 3 GLN NE2 1 1 6 5596 1 1 3 GLN O O 7.786 7.998 -1.039 1.00 . A A . 3 GLN O 1 1 6 5597 1 1 3 GLN OE1 O 8.693 9.207 5.323 1.00 . A A . 3 GLN OE1 1 1 6 5598 1 1 4 VAL C C 5.158 4.862 -1.007 1.00 . A A . 4 VAL C 1 1 6 5599 1 1 4 VAL CA C 6.361 5.672 -1.464 1.00 . A A . 4 VAL CA 1 1 6 5600 1 1 4 VAL CB C 7.043 4.944 -2.638 1.00 . A A . 4 VAL CB 1 1 6 5601 1 1 4 VAL CG1 C 6.081 4.792 -3.806 1.00 . A A . 4 VAL CG1 1 1 6 5602 1 1 4 VAL CG2 C 8.301 5.682 -3.066 1.00 . A A . 4 VAL CG2 1 1 6 5603 1 1 4 VAL H H 7.463 5.194 0.279 1.00 . A A . 4 VAL H 1 1 6 5604 1 1 4 VAL HA H 6.016 6.628 -1.815 1.00 . A A . 4 VAL HA 1 1 6 5605 1 1 4 VAL HB H 7.328 3.955 -2.304 1.00 . A A . 4 VAL HB 1 1 6 5606 1 1 4 VAL HG11 H 5.271 4.135 -3.522 1.00 . A A . 4 VAL HG11 1 1 6 5607 1 1 4 VAL HG12 H 6.604 4.376 -4.653 1.00 . A A . 4 VAL HG12 1 1 6 5608 1 1 4 VAL HG13 H 5.682 5.760 -4.071 1.00 . A A . 4 VAL HG13 1 1 6 5609 1 1 4 VAL HG21 H 8.990 5.730 -2.235 1.00 . A A . 4 VAL HG21 1 1 6 5610 1 1 4 VAL HG22 H 8.042 6.684 -3.376 1.00 . A A . 4 VAL HG22 1 1 6 5611 1 1 4 VAL HG23 H 8.765 5.159 -3.888 1.00 . A A . 4 VAL HG23 1 1 6 5612 1 1 4 VAL N N 7.302 5.904 -0.376 1.00 . A A . 4 VAL N 1 1 6 5613 1 1 4 VAL O O 4.014 5.273 -1.201 1.00 . A A . 4 VAL O 1 1 6 5614 1 1 5 PHE C C 3.429 2.485 -1.107 1.00 . A A . 5 PHE C 1 1 6 5615 1 1 5 PHE CA C 4.333 2.853 0.068 1.00 . A A . 5 PHE CA 1 1 6 5616 1 1 5 PHE CB C 3.524 3.550 1.176 1.00 . A A . 5 PHE CB 1 1 6 5617 1 1 5 PHE CD1 C 5.337 4.533 2.614 1.00 . A A . 5 PHE CD1 1 1 6 5618 1 1 5 PHE CD2 C 3.745 6.012 1.629 1.00 . A A . 5 PHE CD2 1 1 6 5619 1 1 5 PHE CE1 C 5.974 5.607 3.205 1.00 . A A . 5 PHE CE1 1 1 6 5620 1 1 5 PHE CE2 C 4.378 7.089 2.218 1.00 . A A . 5 PHE CE2 1 1 6 5621 1 1 5 PHE CG C 4.218 4.722 1.820 1.00 . A A . 5 PHE CG 1 1 6 5622 1 1 5 PHE CZ C 5.494 6.887 3.006 1.00 . A A . 5 PHE CZ 1 1 6 5623 1 1 5 PHE H H 6.344 3.437 -0.269 1.00 . A A . 5 PHE H 1 1 6 5624 1 1 5 PHE HA H 4.770 1.948 0.464 1.00 . A A . 5 PHE HA 1 1 6 5625 1 1 5 PHE HB2 H 2.599 3.907 0.766 1.00 . A A . 5 PHE HB2 1 1 6 5626 1 1 5 PHE HB3 H 3.308 2.833 1.950 1.00 . A A . 5 PHE HB3 1 1 6 5627 1 1 5 PHE HD1 H 5.713 3.534 2.769 1.00 . A A . 5 PHE HD1 1 1 6 5628 1 1 5 PHE HD2 H 2.873 6.170 1.015 1.00 . A A . 5 PHE HD2 1 1 6 5629 1 1 5 PHE HE1 H 6.845 5.447 3.821 1.00 . A A . 5 PHE HE1 1 1 6 5630 1 1 5 PHE HE2 H 4.000 8.089 2.062 1.00 . A A . 5 PHE HE2 1 1 6 5631 1 1 5 PHE HZ H 5.991 7.728 3.468 1.00 . A A . 5 PHE HZ 1 1 6 5632 1 1 5 PHE N N 5.414 3.712 -0.403 1.00 . A A . 5 PHE N 1 1 6 5633 1 1 5 PHE O O 3.730 2.820 -2.253 1.00 . A A . 5 PHE O 1 1 6 5634 1 1 6 GLU C C -0.046 1.526 -1.459 1.00 . A A . 6 GLU C 1 1 6 5635 1 1 6 GLU CA C 1.409 1.392 -1.891 1.00 . A A . 6 GLU CA 1 1 6 5636 1 1 6 GLU CB C 1.696 -0.051 -2.311 1.00 . A A . 6 GLU CB 1 1 6 5637 1 1 6 GLU CD C 1.000 0.393 -4.699 1.00 . A A . 6 GLU CD 1 1 6 5638 1 1 6 GLU CG C 0.861 -0.517 -3.494 1.00 . A A . 6 GLU CG 1 1 6 5639 1 1 6 GLU H H 2.117 1.575 0.099 1.00 . A A . 6 GLU H 1 1 6 5640 1 1 6 GLU HA H 1.578 2.040 -2.738 1.00 . A A . 6 GLU HA 1 1 6 5641 1 1 6 GLU HB2 H 2.739 -0.136 -2.580 1.00 . A A . 6 GLU HB2 1 1 6 5642 1 1 6 GLU HB3 H 1.493 -0.704 -1.476 1.00 . A A . 6 GLU HB3 1 1 6 5643 1 1 6 GLU HG2 H 1.179 -1.510 -3.774 1.00 . A A . 6 GLU HG2 1 1 6 5644 1 1 6 GLU HG3 H -0.178 -0.543 -3.198 1.00 . A A . 6 GLU HG3 1 1 6 5645 1 1 6 GLU N N 2.324 1.801 -0.830 1.00 . A A . 6 GLU N 1 1 6 5646 1 1 6 GLU O O -0.441 1.037 -0.400 1.00 . A A . 6 GLU O 1 1 6 5647 1 1 6 GLU OE1 O 2.029 0.299 -5.398 1.00 . A A . 6 GLU OE1 1 1 6 5648 1 1 6 GLU OE2 O 0.078 1.202 -4.940 1.00 . A A . 6 GLU OE2 1 1 6 5649 1 1 7 TYR C C -3.089 1.339 -2.714 1.00 . A A . 7 TYR C 1 1 6 5650 1 1 7 TYR CA C -2.243 2.399 -2.024 1.00 . A A . 7 TYR CA 1 1 6 5651 1 1 7 TYR CB C -2.666 3.788 -2.508 1.00 . A A . 7 TYR CB 1 1 6 5652 1 1 7 TYR CD1 C -1.155 4.468 -4.419 1.00 . A A . 7 TYR CD1 1 1 6 5653 1 1 7 TYR CD2 C -3.410 3.880 -4.922 1.00 . A A . 7 TYR CD2 1 1 6 5654 1 1 7 TYR CE1 C -0.917 4.714 -5.757 1.00 . A A . 7 TYR CE1 1 1 6 5655 1 1 7 TYR CE2 C -3.178 4.122 -6.263 1.00 . A A . 7 TYR CE2 1 1 6 5656 1 1 7 TYR CG C -2.404 4.047 -3.978 1.00 . A A . 7 TYR CG 1 1 6 5657 1 1 7 TYR CZ C -1.931 4.539 -6.676 1.00 . A A . 7 TYR CZ 1 1 6 5658 1 1 7 TYR H H -0.460 2.563 -3.112 1.00 . A A . 7 TYR H 1 1 6 5659 1 1 7 TYR HA H -2.396 2.335 -0.957 1.00 . A A . 7 TYR HA 1 1 6 5660 1 1 7 TYR HB2 H -3.718 3.905 -2.345 1.00 . A A . 7 TYR HB2 1 1 6 5661 1 1 7 TYR HB3 H -2.134 4.535 -1.943 1.00 . A A . 7 TYR HB3 1 1 6 5662 1 1 7 TYR HD1 H -0.363 4.602 -3.699 1.00 . A A . 7 TYR HD1 1 1 6 5663 1 1 7 TYR HD2 H -4.387 3.555 -4.596 1.00 . A A . 7 TYR HD2 1 1 6 5664 1 1 7 TYR HE1 H 0.061 5.040 -6.080 1.00 . A A . 7 TYR HE1 1 1 6 5665 1 1 7 TYR HE2 H -3.973 3.985 -6.981 1.00 . A A . 7 TYR HE2 1 1 6 5666 1 1 7 TYR HH H -0.866 4.377 -8.268 1.00 . A A . 7 TYR HH 1 1 6 5667 1 1 7 TYR N N -0.835 2.193 -2.294 1.00 . A A . 7 TYR N 1 1 6 5668 1 1 7 TYR O O -3.319 1.417 -3.917 1.00 . A A . 7 TYR O 1 1 6 5669 1 1 7 TYR OH O -1.697 4.782 -8.010 1.00 . A A . 7 TYR OH 1 1 6 5670 1 1 8 ALA C C -5.851 -0.235 -2.532 1.00 . A A . 8 ALA C 1 1 6 5671 1 1 8 ALA CA C -4.403 -0.695 -2.522 1.00 . A A . 8 ALA CA 1 1 6 5672 1 1 8 ALA CB C -4.250 -1.988 -1.728 1.00 . A A . 8 ALA CB 1 1 6 5673 1 1 8 ALA H H -3.373 0.354 -0.986 1.00 . A A . 8 ALA H 1 1 6 5674 1 1 8 ALA HA H -4.079 -0.872 -3.536 1.00 . A A . 8 ALA HA 1 1 6 5675 1 1 8 ALA HB1 H -3.243 -2.061 -1.342 1.00 . A A . 8 ALA HB1 1 1 6 5676 1 1 8 ALA HB2 H -4.452 -2.831 -2.371 1.00 . A A . 8 ALA HB2 1 1 6 5677 1 1 8 ALA HB3 H -4.950 -1.990 -0.906 1.00 . A A . 8 ALA HB3 1 1 6 5678 1 1 8 ALA N N -3.574 0.362 -1.951 1.00 . A A . 8 ALA N 1 1 6 5679 1 1 8 ALA O O -6.729 -0.882 -1.979 1.00 . A A . 8 ALA O 1 1 6 5680 1 1 9 GLU C C -8.028 1.384 -4.635 1.00 . A A . 9 GLU C 1 1 6 5681 1 1 9 GLU CA C -7.374 1.532 -3.282 1.00 . A A . 9 GLU CA 1 1 6 5682 1 1 9 GLU CB C -7.179 3.004 -2.890 1.00 . A A . 9 GLU CB 1 1 6 5683 1 1 9 GLU CD C -7.367 4.160 -5.141 1.00 . A A . 9 GLU CD 1 1 6 5684 1 1 9 GLU CG C -7.917 4.034 -3.731 1.00 . A A . 9 GLU CG 1 1 6 5685 1 1 9 GLU H H -5.326 1.307 -3.674 1.00 . A A . 9 GLU H 1 1 6 5686 1 1 9 GLU HA H -8.032 1.075 -2.568 1.00 . A A . 9 GLU HA 1 1 6 5687 1 1 9 GLU HB2 H -7.507 3.125 -1.869 1.00 . A A . 9 GLU HB2 1 1 6 5688 1 1 9 GLU HB3 H -6.123 3.230 -2.938 1.00 . A A . 9 GLU HB3 1 1 6 5689 1 1 9 GLU HG2 H -8.949 3.747 -3.785 1.00 . A A . 9 GLU HG2 1 1 6 5690 1 1 9 GLU HG3 H -7.835 4.990 -3.248 1.00 . A A . 9 GLU HG3 1 1 6 5691 1 1 9 GLU N N -6.072 0.890 -3.204 1.00 . A A . 9 GLU N 1 1 6 5692 1 1 9 GLU O O -7.378 1.310 -5.677 1.00 . A A . 9 GLU O 1 1 6 5693 1 1 9 GLU OE1 O -6.304 4.794 -5.308 1.00 . A A . 9 GLU OE1 1 1 6 5694 1 1 9 GLU OE2 O -8.002 3.631 -6.077 1.00 . A A . 9 GLU OE2 1 1 6 5695 1 1 10 VAL C C -10.518 2.619 -6.277 1.00 . A A . 10 VAL C 1 1 6 5696 1 1 10 VAL CA C -10.175 1.239 -5.739 1.00 . A A . 10 VAL CA 1 1 6 5697 1 1 10 VAL CB C -11.448 0.465 -5.406 1.00 . A A . 10 VAL CB 1 1 6 5698 1 1 10 VAL CG1 C -12.307 0.294 -6.650 1.00 . A A . 10 VAL CG1 1 1 6 5699 1 1 10 VAL CG2 C -11.095 -0.882 -4.792 1.00 . A A . 10 VAL CG2 1 1 6 5700 1 1 10 VAL H H -9.776 1.415 -3.694 1.00 . A A . 10 VAL H 1 1 6 5701 1 1 10 VAL HA H -9.637 0.699 -6.474 1.00 . A A . 10 VAL HA 1 1 6 5702 1 1 10 VAL HB H -11.992 1.030 -4.676 1.00 . A A . 10 VAL HB 1 1 6 5703 1 1 10 VAL HG11 H -12.139 1.125 -7.318 1.00 . A A . 10 VAL HG11 1 1 6 5704 1 1 10 VAL HG12 H -13.348 0.264 -6.369 1.00 . A A . 10 VAL HG12 1 1 6 5705 1 1 10 VAL HG13 H -12.042 -0.628 -7.147 1.00 . A A . 10 VAL HG13 1 1 6 5706 1 1 10 VAL HG21 H -10.926 -1.604 -5.577 1.00 . A A . 10 VAL HG21 1 1 6 5707 1 1 10 VAL HG22 H -11.905 -1.214 -4.163 1.00 . A A . 10 VAL HG22 1 1 6 5708 1 1 10 VAL HG23 H -10.201 -0.779 -4.197 1.00 . A A . 10 VAL HG23 1 1 6 5709 1 1 10 VAL N N -9.346 1.356 -4.572 1.00 . A A . 10 VAL N 1 1 6 5710 1 1 10 VAL O O -10.611 2.826 -7.486 1.00 . A A . 10 VAL O 1 1 6 5711 1 1 11 ASP C C -10.311 5.945 -4.813 1.00 . A A . 11 ASP C 1 1 6 5712 1 1 11 ASP CA C -11.017 4.937 -5.723 1.00 . A A . 11 ASP CA 1 1 6 5713 1 1 11 ASP CB C -12.525 5.177 -5.653 1.00 . A A . 11 ASP CB 1 1 6 5714 1 1 11 ASP CG C -12.998 4.010 -10.505 1.00 . A A . 11 ASP CG 1 1 6 5715 1 1 11 ASP H H -10.669 3.309 -4.417 1.00 . A A . 11 ASP H 1 1 6 5716 1 1 11 ASP HA H -10.687 5.094 -6.738 1.00 . A A . 11 ASP HA 1 1 6 5717 1 1 11 ASP HB2 H -12.847 5.089 -4.628 1.00 . A A . 11 ASP HB2 1 1 6 5718 1 1 11 ASP HB3 H -13.030 4.434 -6.248 1.00 . A A . 11 ASP HB3 1 1 6 5719 1 1 11 ASP N N -10.708 3.559 -5.360 1.00 . A A . 11 ASP N 1 1 6 5720 1 1 11 ASP O O -9.872 7.000 -5.271 1.00 . A A . 11 ASP O 1 1 6 5721 1 1 11 ASP OD1 O -13.375 3.597 -11.620 1.00 . A A . 11 ASP OD1 1 1 6 5722 1 1 11 ASP OD2 O -13.744 4.625 -9.715 1.00 . A A . 11 ASP OD2 1 1 6 5723 1 1 12 GLU C C -8.970 5.812 -1.378 1.00 . A A . 12 GLU C 1 1 6 5724 1 1 12 GLU CA C -9.580 6.543 -2.567 1.00 . A A . 12 GLU CA 1 1 6 5725 1 1 12 GLU CB C -10.616 7.554 -2.078 1.00 . A A . 12 GLU CB 1 1 6 5726 1 1 12 GLU CD C -12.051 9.559 -2.619 1.00 . A A . 12 GLU CD 1 1 6 5727 1 1 12 GLU CG C -11.013 8.579 -3.127 1.00 . A A . 12 GLU CG 1 1 6 5728 1 1 12 GLU H H -10.479 4.727 -3.226 1.00 . A A . 12 GLU H 1 1 6 5729 1 1 12 GLU HA H -8.790 7.070 -3.081 1.00 . A A . 12 GLU HA 1 1 6 5730 1 1 12 GLU HB2 H -11.504 7.018 -1.779 1.00 . A A . 12 GLU HB2 1 1 6 5731 1 1 12 GLU HB3 H -10.217 8.078 -1.223 1.00 . A A . 12 GLU HB3 1 1 6 5732 1 1 12 GLU HG2 H -10.133 9.132 -3.423 1.00 . A A . 12 GLU HG2 1 1 6 5733 1 1 12 GLU HG3 H -11.416 8.061 -3.984 1.00 . A A . 12 GLU HG3 1 1 6 5734 1 1 12 GLU N N -10.198 5.621 -3.525 1.00 . A A . 12 GLU N 1 1 6 5735 1 1 12 GLU O O -9.186 4.624 -1.196 1.00 . A A . 12 GLU O 1 1 6 5736 1 1 12 GLU OE1 O -11.660 10.575 -2.007 1.00 . A A . 12 GLU OE1 1 1 6 5737 1 1 12 GLU OE2 O -13.257 9.310 -2.832 1.00 . A A . 12 GLU OE2 1 1 6 5738 1 1 13 ILE C C -7.628 6.945 1.764 1.00 . A A . 13 ILE C 1 1 6 5739 1 1 13 ILE CA C -7.545 5.963 0.593 1.00 . A A . 13 ILE CA 1 1 6 5740 1 1 13 ILE CB C -6.060 5.646 0.309 1.00 . A A . 13 ILE CB 1 1 6 5741 1 1 13 ILE CD1 C -5.715 7.569 -1.306 1.00 . A A . 13 ILE CD1 1 1 6 5742 1 1 13 ILE CG1 C -5.298 6.935 0.005 1.00 . A A . 13 ILE CG1 1 1 6 5743 1 1 13 ILE CG2 C -5.949 4.700 -0.868 1.00 . A A . 13 ILE CG2 1 1 6 5744 1 1 13 ILE H H -8.072 7.488 -0.776 1.00 . A A . 13 ILE H 1 1 6 5745 1 1 13 ILE HA H -8.060 5.034 0.840 1.00 . A A . 13 ILE HA 1 1 6 5746 1 1 13 ILE HB H -5.629 5.162 1.178 1.00 . A A . 13 ILE HB 1 1 6 5747 1 1 13 ILE HD11 H -6.300 8.454 -1.107 1.00 . A A . 13 ILE HD11 1 1 6 5748 1 1 13 ILE HD12 H -6.311 6.862 -1.873 1.00 . A A . 13 ILE HD12 1 1 6 5749 1 1 13 ILE HD13 H -4.837 7.834 -1.873 1.00 . A A . 13 ILE HD13 1 1 6 5750 1 1 13 ILE HG12 H -5.479 7.649 0.794 1.00 . A A . 13 ILE HG12 1 1 6 5751 1 1 13 ILE HG13 H -4.241 6.722 -0.048 1.00 . A A . 13 ILE HG13 1 1 6 5752 1 1 13 ILE HG21 H -6.764 4.886 -1.540 1.00 . A A . 13 ILE HG21 1 1 6 5753 1 1 13 ILE HG22 H -5.980 3.679 -0.523 1.00 . A A . 13 ILE HG22 1 1 6 5754 1 1 13 ILE HG23 H -5.021 4.880 -1.381 1.00 . A A . 13 ILE HG23 1 1 6 5755 1 1 13 ILE N N -8.197 6.536 -0.580 1.00 . A A . 13 ILE N 1 1 6 5756 1 1 13 ILE O O -8.333 7.950 1.680 1.00 . A A . 13 ILE O 1 1 6 5757 1 1 14 VAL C C -5.634 7.462 4.804 1.00 . A A . 14 VAL C 1 1 6 5758 1 1 14 VAL CA C -6.931 7.548 4.011 1.00 . A A . 14 VAL CA 1 1 6 5759 1 1 14 VAL CB C -8.115 7.224 4.944 1.00 . A A . 14 VAL CB 1 1 6 5760 1 1 14 VAL CG1 C -8.120 8.148 6.154 1.00 . A A . 14 VAL CG1 1 1 6 5761 1 1 14 VAL CG2 C -9.431 7.323 4.189 1.00 . A A . 14 VAL CG2 1 1 6 5762 1 1 14 VAL H H -6.355 5.858 2.873 1.00 . A A . 14 VAL H 1 1 6 5763 1 1 14 VAL HA H -7.051 8.558 3.655 1.00 . A A . 14 VAL HA 1 1 6 5764 1 1 14 VAL HB H -8.003 6.209 5.296 1.00 . A A . 14 VAL HB 1 1 6 5765 1 1 14 VAL HG11 H -8.956 7.902 6.791 1.00 . A A . 14 VAL HG11 1 1 6 5766 1 1 14 VAL HG12 H -8.208 9.173 5.824 1.00 . A A . 14 VAL HG12 1 1 6 5767 1 1 14 VAL HG13 H -7.198 8.026 6.704 1.00 . A A . 14 VAL HG13 1 1 6 5768 1 1 14 VAL HG21 H -10.251 7.147 4.870 1.00 . A A . 14 VAL HG21 1 1 6 5769 1 1 14 VAL HG22 H -9.450 6.584 3.403 1.00 . A A . 14 VAL HG22 1 1 6 5770 1 1 14 VAL HG23 H -9.526 8.309 3.759 1.00 . A A . 14 VAL HG23 1 1 6 5771 1 1 14 VAL N N -6.911 6.666 2.852 1.00 . A A . 14 VAL N 1 1 6 5772 1 1 14 VAL O O -4.924 8.455 4.963 1.00 . A A . 14 VAL O 1 1 6 5773 1 1 15 GLU C C -2.939 5.620 5.241 1.00 . A A . 15 GLU C 1 1 6 5774 1 1 15 GLU CA C -4.126 6.059 6.097 1.00 . A A . 15 GLU CA 1 1 6 5775 1 1 15 GLU CB C -4.390 5.026 7.194 1.00 . A A . 15 GLU CB 1 1 6 5776 1 1 15 GLU CD C -3.508 3.870 9.260 1.00 . A A . 15 GLU CD 1 1 6 5777 1 1 15 GLU CG C -3.173 4.725 8.052 1.00 . A A . 15 GLU CG 1 1 6 5778 1 1 15 GLU H H -5.934 5.511 5.117 1.00 . A A . 15 GLU H 1 1 6 5779 1 1 15 GLU HA H -3.883 7.000 6.560 1.00 . A A . 15 GLU HA 1 1 6 5780 1 1 15 GLU HB2 H -5.175 5.395 7.838 1.00 . A A . 15 GLU HB2 1 1 6 5781 1 1 15 GLU HB3 H -4.716 4.105 6.733 1.00 . A A . 15 GLU HB3 1 1 6 5782 1 1 15 GLU HG2 H -2.446 4.200 7.451 1.00 . A A . 15 GLU HG2 1 1 6 5783 1 1 15 GLU HG3 H -2.750 5.658 8.395 1.00 . A A . 15 GLU HG3 1 1 6 5784 1 1 15 GLU N N -5.332 6.268 5.297 1.00 . A A . 15 GLU N 1 1 6 5785 1 1 15 GLU O O -2.735 4.432 5.009 1.00 . A A . 15 GLU O 1 1 6 5786 1 1 15 GLU OE1 O -3.696 2.647 9.089 1.00 . A A . 15 GLU OE1 1 1 6 5787 1 1 15 GLU OE2 O -3.583 4.425 10.376 1.00 . A A . 15 GLU OE2 1 1 6 5788 1 1 16 LYS C C 0.322 6.410 4.769 1.00 . A A . 16 LYS C 1 1 6 5789 1 1 16 LYS CA C -0.975 6.300 3.969 1.00 . A A . 16 LYS CA 1 1 6 5790 1 1 16 LYS CB C -0.937 7.271 2.789 1.00 . A A . 16 LYS CB 1 1 6 5791 1 1 16 LYS CD C -1.029 9.648 1.985 1.00 . A A . 16 LYS CD 1 1 6 5792 1 1 16 LYS CE C -1.238 11.101 2.380 1.00 . A A . 16 LYS CE 1 1 6 5793 1 1 16 LYS CG C -1.117 8.724 3.190 1.00 . A A . 16 LYS CG 1 1 6 5794 1 1 16 LYS H H -2.323 7.514 5.061 1.00 . A A . 16 LYS H 1 1 6 5795 1 1 16 LYS HA H -1.079 5.294 3.599 1.00 . A A . 16 LYS HA 1 1 6 5796 1 1 16 LYS HB2 H 0.016 7.173 2.291 1.00 . A A . 16 LYS HB2 1 1 6 5797 1 1 16 LYS HB3 H -1.724 7.010 2.098 1.00 . A A . 16 LYS HB3 1 1 6 5798 1 1 16 LYS HD2 H -0.052 9.545 1.537 1.00 . A A . 16 LYS HD2 1 1 6 5799 1 1 16 LYS HD3 H -1.787 9.365 1.271 1.00 . A A . 16 LYS HD3 1 1 6 5800 1 1 16 LYS HE2 H -0.484 11.377 3.103 1.00 . A A . 16 LYS HE2 1 1 6 5801 1 1 16 LYS HE3 H -1.133 11.718 1.500 1.00 . A A . 16 LYS HE3 1 1 6 5802 1 1 16 LYS HG2 H -2.086 8.843 3.651 1.00 . A A . 16 LYS HG2 1 1 6 5803 1 1 16 LYS HG3 H -0.345 8.993 3.895 1.00 . A A . 16 LYS HG3 1 1 6 5804 1 1 16 LYS HZ1 H -2.687 12.323 3.258 1.00 . A A . 16 LYS HZ1 1 1 6 5805 1 1 16 LYS HZ2 H -2.711 10.724 3.812 1.00 . A A . 16 LYS HZ2 1 1 6 5806 1 1 16 LYS HZ3 H -3.324 11.099 2.281 1.00 . A A . 16 LYS HZ3 1 1 6 5807 1 1 16 LYS N N -2.137 6.588 4.806 1.00 . A A . 16 LYS N 1 1 6 5808 1 1 16 LYS NZ N -2.584 11.328 2.975 1.00 . A A . 16 LYS NZ 1 1 6 5809 1 1 16 LYS O O 0.920 7.483 4.847 1.00 . A A . 16 LYS O 1 1 6 5810 1 1 17 ARG C C 2.602 3.924 6.259 1.00 . A A . 17 ARG C 1 1 6 5811 1 1 17 ARG CA C 1.972 5.309 6.176 1.00 . A A . 17 ARG CA 1 1 6 5812 1 1 17 ARG CB C 1.645 5.814 7.581 1.00 . A A . 17 ARG CB 1 1 6 5813 1 1 17 ARG CD C 2.467 6.306 9.908 1.00 . A A . 17 ARG CD 1 1 6 5814 1 1 17 ARG CG C 2.860 5.916 8.491 1.00 . A A . 17 ARG CG 1 1 6 5815 1 1 17 ARG CZ C 3.540 6.669 12.093 1.00 . A A . 17 ARG CZ 1 1 6 5816 1 1 17 ARG H H 0.295 4.445 5.195 1.00 . A A . 17 ARG H 1 1 6 5817 1 1 17 ARG HA H 2.675 5.984 5.715 1.00 . A A . 17 ARG HA 1 1 6 5818 1 1 17 ARG HB2 H 1.193 6.792 7.501 1.00 . A A . 17 ARG HB2 1 1 6 5819 1 1 17 ARG HB3 H 0.937 5.138 8.037 1.00 . A A . 17 ARG HB3 1 1 6 5820 1 1 17 ARG HD2 H 2.029 7.293 9.887 1.00 . A A . 17 ARG HD2 1 1 6 5821 1 1 17 ARG HD3 H 1.738 5.597 10.273 1.00 . A A . 17 ARG HD3 1 1 6 5822 1 1 17 ARG HE H 4.483 6.048 10.448 1.00 . A A . 17 ARG HE 1 1 6 5823 1 1 17 ARG HG2 H 3.359 4.960 8.518 1.00 . A A . 17 ARG HG2 1 1 6 5824 1 1 17 ARG HG3 H 3.533 6.664 8.095 1.00 . A A . 17 ARG HG3 1 1 6 5825 1 1 17 ARG HH11 H 1.554 7.044 12.049 1.00 . A A . 17 ARG HH11 1 1 6 5826 1 1 17 ARG HH12 H 2.324 7.299 13.579 1.00 . A A . 17 ARG HH12 1 1 6 5827 1 1 17 ARG HH21 H 5.506 6.379 12.462 1.00 . A A . 17 ARG HH21 1 1 6 5828 1 1 17 ARG HH22 H 4.570 6.922 13.814 1.00 . A A . 17 ARG HH22 1 1 6 5829 1 1 17 ARG N N 0.759 5.299 5.361 1.00 . A A . 17 ARG N 1 1 6 5830 1 1 17 ARG NE N 3.614 6.317 10.813 1.00 . A A . 17 ARG NE 1 1 6 5831 1 1 17 ARG NH1 N 2.377 7.034 12.617 1.00 . A A . 17 ARG NH1 1 1 6 5832 1 1 17 ARG NH2 N 4.627 6.655 12.852 1.00 . A A . 17 ARG NH2 1 1 6 5833 1 1 17 ARG O O 2.309 3.172 7.189 1.00 . A A . 17 ARG O 1 1 6 5834 1 1 18 GLY C C 5.444 2.158 4.754 1.00 . A A . 18 GLY C 1 1 6 5835 1 1 18 GLY CA C 4.064 2.255 5.368 1.00 . A A . 18 GLY CA 1 1 6 5836 1 1 18 GLY H H 3.673 4.184 4.579 1.00 . A A . 18 GLY H 1 1 6 5837 1 1 18 GLY HA2 H 4.134 1.967 6.399 1.00 . A A . 18 GLY HA2 1 1 6 5838 1 1 18 GLY HA3 H 3.416 1.559 4.870 1.00 . A A . 18 GLY HA3 1 1 6 5839 1 1 18 GLY N N 3.459 3.569 5.309 1.00 . A A . 18 GLY N 1 1 6 5840 1 1 18 GLY O O 6.287 3.038 4.928 1.00 . A A . 18 GLY O 1 1 6 5841 1 1 19 LYS C C 6.817 0.989 1.871 1.00 . A A . 19 LYS C 1 1 6 5842 1 1 19 LYS CA C 6.931 0.775 3.388 1.00 . A A . 19 LYS CA 1 1 6 5843 1 1 19 LYS CB C 7.305 -0.660 3.734 1.00 . A A . 19 LYS CB 1 1 6 5844 1 1 19 LYS CD C 8.080 -2.299 5.458 1.00 . A A . 19 LYS CD 1 1 6 5845 1 1 19 LYS CE C 8.270 -2.559 6.944 1.00 . A A . 19 LYS CE 1 1 6 5846 1 1 19 LYS CG C 7.683 -0.859 5.189 1.00 . A A . 19 LYS CG 1 1 6 5847 1 1 19 LYS H H 4.920 0.425 3.916 1.00 . A A . 19 LYS H 1 1 6 5848 1 1 19 LYS HA H 7.670 1.436 3.785 1.00 . A A . 19 LYS HA 1 1 6 5849 1 1 19 LYS HB2 H 6.448 -1.280 3.520 1.00 . A A . 19 LYS HB2 1 1 6 5850 1 1 19 LYS HB3 H 8.132 -0.973 3.116 1.00 . A A . 19 LYS HB3 1 1 6 5851 1 1 19 LYS HD2 H 7.303 -2.949 5.084 1.00 . A A . 19 LYS HD2 1 1 6 5852 1 1 19 LYS HD3 H 9.005 -2.507 4.942 1.00 . A A . 19 LYS HD3 1 1 6 5853 1 1 19 LYS HE2 H 7.332 -2.384 7.450 1.00 . A A . 19 LYS HE2 1 1 6 5854 1 1 19 LYS HE3 H 8.565 -3.589 7.081 1.00 . A A . 19 LYS HE3 1 1 6 5855 1 1 19 LYS HG2 H 8.516 -0.215 5.428 1.00 . A A . 19 LYS HG2 1 1 6 5856 1 1 19 LYS HG3 H 6.837 -0.605 5.810 1.00 . A A . 19 LYS HG3 1 1 6 5857 1 1 19 LYS HZ1 H 10.222 -1.823 7.056 1.00 . A A . 19 LYS HZ1 1 1 6 5858 1 1 19 LYS HZ2 H 9.426 -1.886 8.547 1.00 . A A . 19 LYS HZ2 1 1 6 5859 1 1 19 LYS HZ3 H 9.036 -0.678 7.430 1.00 . A A . 19 LYS HZ3 1 1 6 5860 1 1 19 LYS N N 5.658 1.064 4.031 1.00 . A A . 19 LYS N 1 1 6 5861 1 1 19 LYS NZ N 9.311 -1.674 7.535 1.00 . A A . 19 LYS NZ 1 1 6 5862 1 1 19 LYS O O 6.673 2.124 1.419 1.00 . A A . 19 LYS O 1 1 6 5863 1 1 20 GLY C C 5.368 -0.464 -0.664 1.00 . A A . 20 GLY C 1 1 6 5864 1 1 20 GLY CA C 6.750 0.018 -0.336 1.00 . A A . 20 GLY CA 1 1 6 5865 1 1 20 GLY H H 7.119 -0.954 1.468 1.00 . A A . 20 GLY H 1 1 6 5866 1 1 20 GLY HA2 H 6.876 1.039 -0.646 1.00 . A A . 20 GLY HA2 1 1 6 5867 1 1 20 GLY HA3 H 7.467 -0.614 -0.828 1.00 . A A . 20 GLY HA3 1 1 6 5868 1 1 20 GLY N N 6.922 -0.085 1.086 1.00 . A A . 20 GLY N 1 1 6 5869 1 1 20 GLY O O 4.650 0.109 -1.485 1.00 . A A . 20 GLY O 1 1 6 5870 1 1 21 LYS C C 3.251 -2.706 1.268 1.00 . A A . 21 LYS C 1 1 6 5871 1 1 21 LYS CA C 3.715 -2.164 -0.094 1.00 . A A . 21 LYS CA 1 1 6 5872 1 1 21 LYS CB C 3.735 -3.284 -1.133 1.00 . A A . 21 LYS CB 1 1 6 5873 1 1 21 LYS CD C 3.774 -3.923 -3.560 1.00 . A A . 21 LYS CD 1 1 6 5874 1 1 21 LYS CE C 4.987 -4.829 -3.437 1.00 . A A . 21 LYS CE 1 1 6 5875 1 1 21 LYS CG C 3.834 -2.779 -2.563 1.00 . A A . 21 LYS CG 1 1 6 5876 1 1 21 LYS H H 5.701 -1.959 0.589 1.00 . A A . 21 LYS H 1 1 6 5877 1 1 21 LYS HA H 3.019 -1.404 -0.414 1.00 . A A . 21 LYS HA 1 1 6 5878 1 1 21 LYS HB2 H 4.583 -3.926 -0.940 1.00 . A A . 21 LYS HB2 1 1 6 5879 1 1 21 LYS HB3 H 2.828 -3.864 -1.040 1.00 . A A . 21 LYS HB3 1 1 6 5880 1 1 21 LYS HD2 H 2.882 -4.503 -3.375 1.00 . A A . 21 LYS HD2 1 1 6 5881 1 1 21 LYS HD3 H 3.740 -3.514 -4.559 1.00 . A A . 21 LYS HD3 1 1 6 5882 1 1 21 LYS HE2 H 5.103 -5.110 -2.402 1.00 . A A . 21 LYS HE2 1 1 6 5883 1 1 21 LYS HE3 H 4.822 -5.714 -4.034 1.00 . A A . 21 LYS HE3 1 1 6 5884 1 1 21 LYS HG2 H 3.013 -2.104 -2.754 1.00 . A A . 21 LYS HG2 1 1 6 5885 1 1 21 LYS HG3 H 4.771 -2.254 -2.684 1.00 . A A . 21 LYS HG3 1 1 6 5886 1 1 21 LYS HZ1 H 6.143 -3.888 -4.899 1.00 . A A . 21 LYS HZ1 1 1 6 5887 1 1 21 LYS HZ2 H 7.045 -4.797 -3.792 1.00 . A A . 21 LYS HZ2 1 1 6 5888 1 1 21 LYS HZ3 H 6.406 -3.300 -3.336 1.00 . A A . 21 LYS HZ3 1 1 6 5889 1 1 21 LYS N N 5.024 -1.545 0.014 1.00 . A A . 21 LYS N 1 1 6 5890 1 1 21 LYS NZ N 6.232 -4.157 -3.898 1.00 . A A . 21 LYS NZ 1 1 6 5891 1 1 21 LYS O O 2.214 -3.358 1.352 1.00 . A A . 21 LYS O 1 1 6 5892 1 1 22 ASP C C 2.803 -1.862 4.397 1.00 . A A . 22 ASP C 1 1 6 5893 1 1 22 ASP CA C 3.679 -2.869 3.678 1.00 . A A . 22 ASP CA 1 1 6 5894 1 1 22 ASP CB C 4.944 -3.078 4.501 1.00 . A A . 22 ASP CB 1 1 6 5895 1 1 22 ASP CG C 4.688 -3.902 5.747 1.00 . A A . 22 ASP CG 1 1 6 5896 1 1 22 ASP H H 4.799 -1.874 2.231 1.00 . A A . 22 ASP H 1 1 6 5897 1 1 22 ASP HA H 3.154 -3.788 3.583 1.00 . A A . 22 ASP HA 1 1 6 5898 1 1 22 ASP HB2 H 5.687 -3.570 3.897 1.00 . A A . 22 ASP HB2 1 1 6 5899 1 1 22 ASP HB3 H 5.322 -2.115 4.809 1.00 . A A . 22 ASP HB3 1 1 6 5900 1 1 22 ASP N N 4.013 -2.415 2.338 1.00 . A A . 22 ASP N 1 1 6 5901 1 1 22 ASP O O 2.610 -1.936 5.609 1.00 . A A . 22 ASP O 1 1 6 5902 1 1 22 ASP OD1 O 3.571 -4.441 5.881 1.00 . A A . 22 ASP OD1 1 1 6 5903 1 1 22 ASP OD2 O 5.603 -4.004 6.591 1.00 . A A . 22 ASP OD2 1 1 6 5904 1 1 23 VAL C C -0.015 -0.289 4.222 1.00 . A A . 23 VAL C 1 1 6 5905 1 1 23 VAL CA C 1.450 0.114 4.179 1.00 . A A . 23 VAL CA 1 1 6 5906 1 1 23 VAL CB C 1.594 1.367 3.323 1.00 . A A . 23 VAL CB 1 1 6 5907 1 1 23 VAL CG1 C 0.872 1.202 1.994 1.00 . A A . 23 VAL CG1 1 1 6 5908 1 1 23 VAL CG2 C 1.092 2.573 4.075 1.00 . A A . 23 VAL CG2 1 1 6 5909 1 1 23 VAL H H 2.498 -0.904 2.701 1.00 . A A . 23 VAL H 1 1 6 5910 1 1 23 VAL HA H 1.791 0.347 5.173 1.00 . A A . 23 VAL HA 1 1 6 5911 1 1 23 VAL HB H 2.647 1.502 3.127 1.00 . A A . 23 VAL HB 1 1 6 5912 1 1 23 VAL HG11 H 1.331 0.401 1.434 1.00 . A A . 23 VAL HG11 1 1 6 5913 1 1 23 VAL HG12 H 0.942 2.115 1.433 1.00 . A A . 23 VAL HG12 1 1 6 5914 1 1 23 VAL HG13 H -0.166 0.967 2.168 1.00 . A A . 23 VAL HG13 1 1 6 5915 1 1 23 VAL HG21 H 0.074 2.779 3.789 1.00 . A A . 23 VAL HG21 1 1 6 5916 1 1 23 VAL HG22 H 1.710 3.427 3.842 1.00 . A A . 23 VAL HG22 1 1 6 5917 1 1 23 VAL HG23 H 1.132 2.375 5.135 1.00 . A A . 23 VAL HG23 1 1 6 5918 1 1 23 VAL N N 2.284 -0.923 3.642 1.00 . A A . 23 VAL N 1 1 6 5919 1 1 23 VAL O O -0.473 -1.116 3.435 1.00 . A A . 23 VAL O 1 1 6 5920 1 1 24 GLU C C -2.988 1.287 4.873 1.00 . A A . 24 GLU C 1 1 6 5921 1 1 24 GLU CA C -2.160 0.068 5.264 1.00 . A A . 24 GLU CA 1 1 6 5922 1 1 24 GLU CB C -2.484 -0.335 6.700 1.00 . A A . 24 GLU CB 1 1 6 5923 1 1 24 GLU CD C -2.157 0.123 9.162 1.00 . A A . 24 GLU CD 1 1 6 5924 1 1 24 GLU CG C -1.906 0.604 7.746 1.00 . A A . 24 GLU CG 1 1 6 5925 1 1 24 GLU H H -0.330 1.058 5.637 1.00 . A A . 24 GLU H 1 1 6 5926 1 1 24 GLU HA H -2.398 -0.761 4.604 1.00 . A A . 24 GLU HA 1 1 6 5927 1 1 24 GLU HB2 H -3.558 -0.350 6.816 1.00 . A A . 24 GLU HB2 1 1 6 5928 1 1 24 GLU HB3 H -2.101 -1.326 6.879 1.00 . A A . 24 GLU HB3 1 1 6 5929 1 1 24 GLU HG2 H -0.840 0.680 7.593 1.00 . A A . 24 GLU HG2 1 1 6 5930 1 1 24 GLU HG3 H -2.357 1.578 7.627 1.00 . A A . 24 GLU HG3 1 1 6 5931 1 1 24 GLU N N -0.745 0.352 5.106 1.00 . A A . 24 GLU N 1 1 6 5932 1 1 24 GLU O O -3.255 2.163 5.696 1.00 . A A . 24 GLU O 1 1 6 5933 1 1 24 GLU OE1 O -3.288 0.307 9.659 1.00 . A A . 24 GLU OE1 1 1 6 5934 1 1 24 GLU OE2 O -1.223 -0.435 9.774 1.00 . A A . 24 GLU OE2 1 1 6 5935 1 1 25 TYR C C -5.671 2.142 3.284 1.00 . A A . 25 TYR C 1 1 6 5936 1 1 25 TYR CA C -4.184 2.435 3.091 1.00 . A A . 25 TYR CA 1 1 6 5937 1 1 25 TYR CB C -3.869 2.636 1.601 1.00 . A A . 25 TYR CB 1 1 6 5938 1 1 25 TYR CD1 C -1.444 3.280 1.901 1.00 . A A . 25 TYR CD1 1 1 6 5939 1 1 25 TYR CD2 C -2.796 4.640 0.498 1.00 . A A . 25 TYR CD2 1 1 6 5940 1 1 25 TYR CE1 C -0.357 4.099 1.644 1.00 . A A . 25 TYR CE1 1 1 6 5941 1 1 25 TYR CE2 C -1.715 5.458 0.235 1.00 . A A . 25 TYR CE2 1 1 6 5942 1 1 25 TYR CG C -2.680 3.538 1.333 1.00 . A A . 25 TYR CG 1 1 6 5943 1 1 25 TYR CZ C -0.498 5.184 0.810 1.00 . A A . 25 TYR CZ 1 1 6 5944 1 1 25 TYR H H -3.135 0.604 3.016 1.00 . A A . 25 TYR H 1 1 6 5945 1 1 25 TYR HA H -3.925 3.330 3.629 1.00 . A A . 25 TYR HA 1 1 6 5946 1 1 25 TYR HB2 H -3.654 1.675 1.159 1.00 . A A . 25 TYR HB2 1 1 6 5947 1 1 25 TYR HB3 H -4.725 3.063 1.107 1.00 . A A . 25 TYR HB3 1 1 6 5948 1 1 25 TYR HD1 H -1.338 2.431 2.554 1.00 . A A . 25 TYR HD1 1 1 6 5949 1 1 25 TYR HD2 H -3.746 4.856 0.052 1.00 . A A . 25 TYR HD2 1 1 6 5950 1 1 25 TYR HE1 H 0.599 3.885 2.098 1.00 . A A . 25 TYR HE1 1 1 6 5951 1 1 25 TYR HE2 H -1.830 6.311 -0.418 1.00 . A A . 25 TYR HE2 1 1 6 5952 1 1 25 TYR HH H 0.282 6.891 0.395 1.00 . A A . 25 TYR HH 1 1 6 5953 1 1 25 TYR N N -3.385 1.333 3.613 1.00 . A A . 25 TYR N 1 1 6 5954 1 1 25 TYR O O -6.037 1.245 4.034 1.00 . A A . 25 TYR O 1 1 6 5955 1 1 25 TYR OH O 0.583 5.993 0.547 1.00 . A A . 25 TYR OH 1 1 6 5956 1 1 26 LEU C C -8.479 2.584 1.298 1.00 . A A . 26 LEU C 1 1 6 5957 1 1 26 LEU CA C -7.957 2.742 2.705 1.00 . A A . 26 LEU CA 1 1 6 5958 1 1 26 LEU CB C -8.642 3.939 3.378 1.00 . A A . 26 LEU CB 1 1 6 5959 1 1 26 LEU CD1 C -10.850 4.771 4.242 1.00 . A A . 26 LEU CD1 1 1 6 5960 1 1 26 LEU CD2 C -10.377 4.847 1.787 1.00 . A A . 26 LEU CD2 1 1 6 5961 1 1 26 LEU CG C -10.141 4.088 3.088 1.00 . A A . 26 LEU CG 1 1 6 5962 1 1 26 LEU H H -6.169 3.673 2.124 1.00 . A A . 26 LEU H 1 1 6 5963 1 1 26 LEU HA H -8.163 1.844 3.261 1.00 . A A . 26 LEU HA 1 1 6 5964 1 1 26 LEU HB2 H -8.510 3.852 4.446 1.00 . A A . 26 LEU HB2 1 1 6 5965 1 1 26 LEU HB3 H -8.150 4.834 3.047 1.00 . A A . 26 LEU HB3 1 1 6 5966 1 1 26 LEU HD11 H -11.342 5.663 3.883 1.00 . A A . 26 LEU HD11 1 1 6 5967 1 1 26 LEU HD12 H -10.130 5.035 5.000 1.00 . A A . 26 LEU HD12 1 1 6 5968 1 1 26 LEU HD13 H -11.584 4.098 4.660 1.00 . A A . 26 LEU HD13 1 1 6 5969 1 1 26 LEU HD21 H -11.385 5.234 1.777 1.00 . A A . 26 LEU HD21 1 1 6 5970 1 1 26 LEU HD22 H -10.242 4.183 0.945 1.00 . A A . 26 LEU HD22 1 1 6 5971 1 1 26 LEU HD23 H -9.680 5.663 1.714 1.00 . A A . 26 LEU HD23 1 1 6 5972 1 1 26 LEU HG H -10.564 3.113 2.973 1.00 . A A . 26 LEU HG 1 1 6 5973 1 1 26 LEU N N -6.517 2.932 2.645 1.00 . A A . 26 LEU N 1 1 6 5974 1 1 26 LEU O O -7.800 2.948 0.342 1.00 . A A . 26 LEU O 1 1 6 5975 1 1 27 VAL C C -11.696 2.157 -0.282 1.00 . A A . 27 VAL C 1 1 6 5976 1 1 27 VAL CA C -10.199 1.903 -0.192 1.00 . A A . 27 VAL CA 1 1 6 5977 1 1 27 VAL CB C -9.819 0.556 -0.838 1.00 . A A . 27 VAL CB 1 1 6 5978 1 1 27 VAL CG1 C -8.520 0.022 -0.260 1.00 . A A . 27 VAL CG1 1 1 6 5979 1 1 27 VAL CG2 C -10.918 -0.500 -0.738 1.00 . A A . 27 VAL CG2 1 1 6 5980 1 1 27 VAL H H -10.162 1.678 1.908 1.00 . A A . 27 VAL H 1 1 6 5981 1 1 27 VAL HA H -9.719 2.662 -0.781 1.00 . A A . 27 VAL HA 1 1 6 5982 1 1 27 VAL HB H -9.646 0.771 -1.873 1.00 . A A . 27 VAL HB 1 1 6 5983 1 1 27 VAL HG11 H -7.697 0.637 -0.592 1.00 . A A . 27 VAL HG11 1 1 6 5984 1 1 27 VAL HG12 H -8.370 -0.991 -0.591 1.00 . A A . 27 VAL HG12 1 1 6 5985 1 1 27 VAL HG13 H -8.572 0.044 0.819 1.00 . A A . 27 VAL HG13 1 1 6 5986 1 1 27 VAL HG21 H -11.750 -0.215 -1.365 1.00 . A A . 27 VAL HG21 1 1 6 5987 1 1 27 VAL HG22 H -11.250 -0.573 0.287 1.00 . A A . 27 VAL HG22 1 1 6 5988 1 1 27 VAL HG23 H -10.534 -1.454 -1.062 1.00 . A A . 27 VAL HG23 1 1 6 5989 1 1 27 VAL N N -9.669 2.032 1.141 1.00 . A A . 27 VAL N 1 1 6 5990 1 1 27 VAL O O -12.514 1.383 0.218 1.00 . A A . 27 VAL O 1 1 6 5991 1 1 28 ARG C C -13.828 2.953 -2.434 1.00 . A A . 28 ARG C 1 1 6 5992 1 1 28 ARG CA C -13.427 3.603 -1.138 1.00 . A A . 28 ARG CA 1 1 6 5993 1 1 28 ARG CB C -13.643 5.109 -1.215 1.00 . A A . 28 ARG CB 1 1 6 5994 1 1 28 ARG CD C -13.318 7.355 -0.134 1.00 . A A . 28 ARG CD 1 1 6 5995 1 1 28 ARG CG C -12.912 5.889 -0.134 1.00 . A A . 28 ARG CG 1 1 6 5996 1 1 28 ARG CZ C -12.794 9.417 1.097 1.00 . A A . 28 ARG CZ 1 1 6 5997 1 1 28 ARG H H -11.340 3.886 -1.213 1.00 . A A . 28 ARG H 1 1 6 5998 1 1 28 ARG HA H -14.023 3.182 -0.347 1.00 . A A . 28 ARG HA 1 1 6 5999 1 1 28 ARG HB2 H -13.302 5.450 -2.177 1.00 . A A . 28 ARG HB2 1 1 6 6000 1 1 28 ARG HB3 H -14.699 5.315 -1.125 1.00 . A A . 28 ARG HB3 1 1 6 6001 1 1 28 ARG HD2 H -13.157 7.762 -1.121 1.00 . A A . 28 ARG HD2 1 1 6 6002 1 1 28 ARG HD3 H -14.367 7.423 0.113 1.00 . A A . 28 ARG HD3 1 1 6 6003 1 1 28 ARG HE H -11.825 7.686 1.308 1.00 . A A . 28 ARG HE 1 1 6 6004 1 1 28 ARG HG2 H -13.149 5.461 0.828 1.00 . A A . 28 ARG HG2 1 1 6 6005 1 1 28 ARG HG3 H -11.848 5.817 -0.308 1.00 . A A . 28 ARG HG3 1 1 6 6006 1 1 28 ARG HH11 H -14.322 9.572 -0.216 1.00 . A A . 28 ARG HH11 1 1 6 6007 1 1 28 ARG HH12 H -13.950 11.017 0.664 1.00 . A A . 28 ARG HH12 1 1 6 6008 1 1 28 ARG HH21 H -11.327 9.583 2.477 1.00 . A A . 28 ARG HH21 1 1 6 6009 1 1 28 ARG HH22 H -12.247 11.023 2.194 1.00 . A A . 28 ARG HH22 1 1 6 6010 1 1 28 ARG N N -12.040 3.272 -0.907 1.00 . A A . 28 ARG N 1 1 6 6011 1 1 28 ARG NE N -12.553 8.137 0.832 1.00 . A A . 28 ARG NE 1 1 6 6012 1 1 28 ARG NH1 N -13.768 10.054 0.463 1.00 . A A . 28 ARG NH1 1 1 6 6013 1 1 28 ARG NH2 N -12.063 10.060 1.997 1.00 . A A . 28 ARG NH2 1 1 6 6014 1 1 28 ARG O O -13.913 3.604 -3.473 1.00 . A A . 28 ARG O 1 1 6 6015 1 1 29 TRP C C -15.148 1.586 -4.555 1.00 . A A . 29 TRP C 1 1 6 6016 1 1 29 TRP CA C -14.432 0.805 -3.470 1.00 . A A . 29 TRP CA 1 1 6 6017 1 1 29 TRP CB C -15.332 -0.315 -2.972 1.00 . A A . 29 TRP CB 1 1 6 6018 1 1 29 TRP CD1 C -14.170 -1.922 -4.602 1.00 . A A . 29 TRP CD1 1 1 6 6019 1 1 29 TRP CD2 C -15.585 -2.915 -3.178 1.00 . A A . 29 TRP CD2 1 1 6 6020 1 1 29 TRP CE2 C -15.020 -3.900 -4.010 1.00 . A A . 29 TRP CE2 1 1 6 6021 1 1 29 TRP CE3 C -16.505 -3.304 -2.201 1.00 . A A . 29 TRP CE3 1 1 6 6022 1 1 29 TRP CG C -15.027 -1.656 -3.572 1.00 . A A . 29 TRP CG 1 1 6 6023 1 1 29 TRP CH2 C -16.251 -5.602 -2.928 1.00 . A A . 29 TRP CH2 1 1 6 6024 1 1 29 TRP CZ2 C -15.347 -5.250 -3.893 1.00 . A A . 29 TRP CZ2 1 1 6 6025 1 1 29 TRP CZ3 C -16.829 -4.643 -2.087 1.00 . A A . 29 TRP CZ3 1 1 6 6026 1 1 29 TRP H H -13.976 1.232 -1.460 1.00 . A A . 29 TRP H 1 1 6 6027 1 1 29 TRP HA H -13.529 0.374 -3.881 1.00 . A A . 29 TRP HA 1 1 6 6028 1 1 29 TRP HB2 H -15.221 -0.391 -1.902 1.00 . A A . 29 TRP HB2 1 1 6 6029 1 1 29 TRP HB3 H -16.358 -0.070 -3.204 1.00 . A A . 29 TRP HB3 1 1 6 6030 1 1 29 TRP HD1 H -13.588 -1.172 -5.121 1.00 . A A . 29 TRP HD1 1 1 6 6031 1 1 29 TRP HE1 H -13.624 -3.708 -5.564 1.00 . A A . 29 TRP HE1 1 1 6 6032 1 1 29 TRP HE3 H -16.961 -2.580 -1.542 1.00 . A A . 29 TRP HE3 1 1 6 6033 1 1 29 TRP HH2 H -16.534 -6.636 -2.803 1.00 . A A . 29 TRP HH2 1 1 6 6034 1 1 29 TRP HZ2 H -14.911 -6.001 -4.534 1.00 . A A . 29 TRP HZ2 1 1 6 6035 1 1 29 TRP HZ3 H -17.539 -4.962 -1.338 1.00 . A A . 29 TRP HZ3 1 1 6 6036 1 1 29 TRP N N -14.062 1.649 -2.339 1.00 . A A . 29 TRP N 1 1 6 6037 1 1 29 TRP NE1 N -14.159 -3.270 -4.870 1.00 . A A . 29 TRP NE1 1 1 6 6038 1 1 29 TRP O O -16.362 1.756 -4.512 1.00 . A A . 29 TRP O 1 1 6 6039 1 1 30 LYS C C -16.276 2.436 -7.048 1.00 . A A . 30 LYS C 1 1 6 6040 1 1 30 LYS CA C -14.862 2.874 -6.646 1.00 . A A . 30 LYS CA 1 1 6 6041 1 1 30 LYS CB C -13.930 2.691 -7.847 1.00 . A A . 30 LYS CB 1 1 6 6042 1 1 30 LYS CD C -14.243 4.905 -8.996 1.00 . A A . 30 LYS CD 1 1 6 6043 1 1 30 LYS CE C -14.759 5.612 -10.239 1.00 . A A . 30 LYS CE 1 1 6 6044 1 1 30 LYS CG C -14.411 3.399 -9.104 1.00 . A A . 30 LYS CG 1 1 6 6045 1 1 30 LYS H H -13.365 2.043 -5.349 1.00 . A A . 30 LYS H 1 1 6 6046 1 1 30 LYS HA H -14.885 3.918 -6.375 1.00 . A A . 30 LYS HA 1 1 6 6047 1 1 30 LYS HB2 H -12.952 3.071 -7.596 1.00 . A A . 30 LYS HB2 1 1 6 6048 1 1 30 LYS HB3 H -13.851 1.637 -8.065 1.00 . A A . 30 LYS HB3 1 1 6 6049 1 1 30 LYS HD2 H -14.794 5.260 -8.137 1.00 . A A . 30 LYS HD2 1 1 6 6050 1 1 30 LYS HD3 H -13.194 5.132 -8.874 1.00 . A A . 30 LYS HD3 1 1 6 6051 1 1 30 LYS HE2 H -14.226 5.235 -11.099 1.00 . A A . 30 LYS HE2 1 1 6 6052 1 1 30 LYS HE3 H -15.812 5.400 -10.348 1.00 . A A . 30 LYS HE3 1 1 6 6053 1 1 30 LYS HG2 H -13.839 3.043 -9.947 1.00 . A A . 30 LYS HG2 1 1 6 6054 1 1 30 LYS HG3 H -15.456 3.171 -9.254 1.00 . A A . 30 LYS HG3 1 1 6 6055 1 1 30 LYS HZ1 H -15.082 7.471 -9.341 1.00 . A A . 30 LYS HZ1 1 1 6 6056 1 1 30 LYS HZ2 H -14.922 7.541 -11.024 1.00 . A A . 30 LYS HZ2 1 1 6 6057 1 1 30 LYS HZ3 H -13.557 7.310 -10.054 1.00 . A A . 30 LYS HZ3 1 1 6 6058 1 1 30 LYS N N -14.349 2.113 -5.486 1.00 . A A . 30 LYS N 1 1 6 6059 1 1 30 LYS NZ N -14.567 7.087 -10.159 1.00 . A A . 30 LYS NZ 1 1 6 6060 1 1 30 LYS O O -17.095 3.257 -7.459 1.00 . A A . 30 LYS O 1 1 6 6061 1 1 31 ASP C C -18.470 -0.070 -6.025 1.00 . A A . 31 ASP C 1 1 6 6062 1 1 31 ASP CA C -17.860 0.593 -7.258 1.00 . A A . 31 ASP CA 1 1 6 6063 1 1 31 ASP CB C -17.755 -0.420 -8.399 1.00 . A A . 31 ASP CB 1 1 6 6064 1 1 31 ASP CG C -17.210 0.199 -9.672 1.00 . A A . 31 ASP CG 1 1 6 6065 1 1 31 ASP H H -15.840 0.530 -6.629 1.00 . A A . 31 ASP H 1 1 6 6066 1 1 31 ASP HA H -18.494 1.412 -7.565 1.00 . A A . 31 ASP HA 1 1 6 6067 1 1 31 ASP HB2 H -17.098 -1.223 -8.102 1.00 . A A . 31 ASP HB2 1 1 6 6068 1 1 31 ASP HB3 H -18.737 -0.820 -8.607 1.00 . A A . 31 ASP HB3 1 1 6 6069 1 1 31 ASP N N -16.545 1.138 -6.934 1.00 . A A . 31 ASP N 1 1 6 6070 1 1 31 ASP O O -18.842 -1.243 -6.054 1.00 . A A . 31 ASP O 1 1 6 6071 1 1 31 ASP OD1 O -18.016 0.712 -10.476 1.00 . A A . 31 ASP OD1 1 1 6 6072 1 1 31 ASP OD2 O -15.977 0.168 -9.864 1.00 . A A . 31 ASP OD2 1 1 6 6073 1 1 32 GLY C C -19.946 1.199 -2.953 1.00 . A A . 32 GLY C 1 1 6 6074 1 1 32 GLY CA C -19.112 0.177 -3.701 1.00 . A A . 32 GLY CA 1 1 6 6075 1 1 32 GLY H H -18.267 1.629 -4.987 1.00 . A A . 32 GLY H 1 1 6 6076 1 1 32 GLY HA2 H -19.727 -0.683 -3.921 1.00 . A A . 32 GLY HA2 1 1 6 6077 1 1 32 GLY HA3 H -18.291 -0.130 -3.066 1.00 . A A . 32 GLY HA3 1 1 6 6078 1 1 32 GLY N N -18.568 0.697 -4.942 1.00 . A A . 32 GLY N 1 1 6 6079 1 1 32 GLY O O -20.504 2.117 -3.554 1.00 . A A . 32 GLY O 1 1 6 6080 1 1 33 GLY C C -20.227 2.107 0.578 1.00 . A A . 33 GLY C 1 1 6 6081 1 1 33 GLY CA C -20.798 1.956 -0.818 1.00 . A A . 33 GLY CA 1 1 6 6082 1 1 33 GLY H H -19.561 0.284 -1.215 1.00 . A A . 33 GLY H 1 1 6 6083 1 1 33 GLY HA2 H -20.809 2.923 -1.298 1.00 . A A . 33 GLY HA2 1 1 6 6084 1 1 33 GLY HA3 H -21.810 1.591 -0.744 1.00 . A A . 33 GLY HA3 1 1 6 6085 1 1 33 GLY N N -20.028 1.035 -1.636 1.00 . A A . 33 GLY N 1 1 6 6086 1 1 33 GLY O O -20.930 2.517 1.502 1.00 . A A . 33 GLY O 1 1 6 6087 1 1 34 ASP C C -16.794 2.173 1.842 1.00 . A A . 34 ASP C 1 1 6 6088 1 1 34 ASP CA C -18.279 1.875 2.025 1.00 . A A . 34 ASP CA 1 1 6 6089 1 1 34 ASP CB C -18.457 0.578 2.815 1.00 . A A . 34 ASP CB 1 1 6 6090 1 1 34 ASP CG C -19.916 0.249 3.066 1.00 . A A . 34 ASP CG 1 1 6 6091 1 1 34 ASP H H -18.442 1.457 -0.044 1.00 . A A . 34 ASP H 1 1 6 6092 1 1 34 ASP HA H -18.733 2.688 2.573 1.00 . A A . 34 ASP HA 1 1 6 6093 1 1 34 ASP HB2 H -18.014 -0.236 2.264 1.00 . A A . 34 ASP HB2 1 1 6 6094 1 1 34 ASP HB3 H -17.960 0.674 3.770 1.00 . A A . 34 ASP HB3 1 1 6 6095 1 1 34 ASP N N -18.948 1.776 0.732 1.00 . A A . 34 ASP N 1 1 6 6096 1 1 34 ASP O O -16.338 2.436 0.729 1.00 . A A . 34 ASP O 1 1 6 6097 1 1 34 ASP OD1 O -20.456 0.692 4.102 1.00 . A A . 34 ASP OD1 1 1 6 6098 1 1 34 ASP OD2 O -20.519 -0.450 2.225 1.00 . A A . 34 ASP OD2 1 1 6 6099 1 1 35 CYS C C -13.862 1.602 3.954 1.00 . A A . 35 CYS C 1 1 6 6100 1 1 35 CYS CA C -14.610 2.396 2.887 1.00 . A A . 35 CYS CA 1 1 6 6101 1 1 35 CYS CB C -14.343 3.892 3.070 1.00 . A A . 35 CYS CB 1 1 6 6102 1 1 35 CYS H H -16.462 1.918 3.799 1.00 . A A . 35 CYS H 1 1 6 6103 1 1 35 CYS HA H -14.252 2.094 1.915 1.00 . A A . 35 CYS HA 1 1 6 6104 1 1 35 CYS HB2 H -13.279 4.068 3.015 1.00 . A A . 35 CYS HB2 1 1 6 6105 1 1 35 CYS HB3 H -14.834 4.436 2.277 1.00 . A A . 35 CYS HB3 1 1 6 6106 1 1 35 CYS HG H -14.847 3.600 5.553 1.00 . A A . 35 CYS HG 1 1 6 6107 1 1 35 CYS N N -16.044 2.131 2.938 1.00 . A A . 35 CYS N 1 1 6 6108 1 1 35 CYS O O -13.929 1.917 5.142 1.00 . A A . 35 CYS O 1 1 6 6109 1 1 35 CYS SG S -14.930 4.560 4.643 1.00 . A A . 35 CYS SG 1 1 6 6110 1 1 36 GLU C C -10.898 0.072 4.359 1.00 . A A . 36 GLU C 1 1 6 6111 1 1 36 GLU CA C -12.384 -0.278 4.428 1.00 . A A . 36 GLU CA 1 1 6 6112 1 1 36 GLU CB C -12.604 -1.754 4.090 1.00 . A A . 36 GLU CB 1 1 6 6113 1 1 36 GLU CD C -14.967 -1.514 3.226 1.00 . A A . 36 GLU CD 1 1 6 6114 1 1 36 GLU CG C -14.051 -2.198 4.224 1.00 . A A . 36 GLU CG 1 1 6 6115 1 1 36 GLU H H -13.143 0.363 2.559 1.00 . A A . 36 GLU H 1 1 6 6116 1 1 36 GLU HA H -12.738 -0.090 5.432 1.00 . A A . 36 GLU HA 1 1 6 6117 1 1 36 GLU HB2 H -12.290 -1.926 3.075 1.00 . A A . 36 GLU HB2 1 1 6 6118 1 1 36 GLU HB3 H -12.003 -2.360 4.752 1.00 . A A . 36 GLU HB3 1 1 6 6119 1 1 36 GLU HG2 H -14.103 -3.264 4.064 1.00 . A A . 36 GLU HG2 1 1 6 6120 1 1 36 GLU HG3 H -14.393 -1.967 5.222 1.00 . A A . 36 GLU HG3 1 1 6 6121 1 1 36 GLU N N -13.152 0.566 3.518 1.00 . A A . 36 GLU N 1 1 6 6122 1 1 36 GLU O O -10.520 1.076 3.757 1.00 . A A . 36 GLU O 1 1 6 6123 1 1 36 GLU OE1 O -15.122 -2.043 2.106 1.00 . A A . 36 GLU OE1 1 1 6 6124 1 1 36 GLU OE2 O -15.529 -0.452 3.566 1.00 . A A . 36 GLU OE2 1 1 6 6125 1 1 37 TRP C C -7.842 -1.569 4.220 1.00 . A A . 37 TRP C 1 1 6 6126 1 1 37 TRP CA C -8.621 -0.508 4.988 1.00 . A A . 37 TRP CA 1 1 6 6127 1 1 37 TRP CB C -8.120 -0.446 6.430 1.00 . A A . 37 TRP CB 1 1 6 6128 1 1 37 TRP CD1 C -8.734 2.034 6.556 1.00 . A A . 37 TRP CD1 1 1 6 6129 1 1 37 TRP CD2 C -8.720 0.990 8.538 1.00 . A A . 37 TRP CD2 1 1 6 6130 1 1 37 TRP CE2 C -9.068 2.339 8.744 1.00 . A A . 37 TRP CE2 1 1 6 6131 1 1 37 TRP CE3 C -8.648 0.136 9.642 1.00 . A A . 37 TRP CE3 1 1 6 6132 1 1 37 TRP CG C -8.511 0.816 7.132 1.00 . A A . 37 TRP CG 1 1 6 6133 1 1 37 TRP CH2 C -9.265 1.994 11.071 1.00 . A A . 37 TRP CH2 1 1 6 6134 1 1 37 TRP CZ2 C -9.343 2.851 10.009 1.00 . A A . 37 TRP CZ2 1 1 6 6135 1 1 37 TRP CZ3 C -8.921 0.647 10.898 1.00 . A A . 37 TRP CZ3 1 1 6 6136 1 1 37 TRP H H -10.408 -1.541 5.439 1.00 . A A . 37 TRP H 1 1 6 6137 1 1 37 TRP HA H -8.447 0.448 4.524 1.00 . A A . 37 TRP HA 1 1 6 6138 1 1 37 TRP HB2 H -8.529 -1.277 6.984 1.00 . A A . 37 TRP HB2 1 1 6 6139 1 1 37 TRP HB3 H -7.044 -0.512 6.431 1.00 . A A . 37 TRP HB3 1 1 6 6140 1 1 37 TRP HD1 H -8.654 2.230 5.497 1.00 . A A . 37 TRP HD1 1 1 6 6141 1 1 37 TRP HE1 H -9.277 3.899 7.356 1.00 . A A . 37 TRP HE1 1 1 6 6142 1 1 37 TRP HE3 H -8.385 -0.904 9.527 1.00 . A A . 37 TRP HE3 1 1 6 6143 1 1 37 TRP HH2 H -9.469 2.349 12.071 1.00 . A A . 37 TRP HH2 1 1 6 6144 1 1 37 TRP HZ2 H -9.610 3.887 10.161 1.00 . A A . 37 TRP HZ2 1 1 6 6145 1 1 37 TRP HZ3 H -8.870 0.003 11.763 1.00 . A A . 37 TRP HZ3 1 1 6 6146 1 1 37 TRP N N -10.058 -0.756 4.976 1.00 . A A . 37 TRP N 1 1 6 6147 1 1 37 TRP NE1 N -9.070 2.956 7.519 1.00 . A A . 37 TRP NE1 1 1 6 6148 1 1 37 TRP O O -8.269 -2.717 4.099 1.00 . A A . 37 TRP O 1 1 6 6149 1 1 38 VAL C C -4.848 -2.744 3.928 1.00 . A A . 38 VAL C 1 1 6 6150 1 1 38 VAL CA C -5.798 -2.043 2.966 1.00 . A A . 38 VAL CA 1 1 6 6151 1 1 38 VAL CB C -4.992 -1.246 1.919 1.00 . A A . 38 VAL CB 1 1 6 6152 1 1 38 VAL CG1 C -3.910 -2.098 1.270 1.00 . A A . 38 VAL CG1 1 1 6 6153 1 1 38 VAL CG2 C -5.921 -0.661 0.870 1.00 . A A . 38 VAL CG2 1 1 6 6154 1 1 38 VAL H H -6.428 -0.219 3.816 1.00 . A A . 38 VAL H 1 1 6 6155 1 1 38 VAL HA H -6.395 -2.782 2.457 1.00 . A A . 38 VAL HA 1 1 6 6156 1 1 38 VAL HB H -4.515 -0.430 2.425 1.00 . A A . 38 VAL HB 1 1 6 6157 1 1 38 VAL HG11 H -3.410 -1.521 0.506 1.00 . A A . 38 VAL HG11 1 1 6 6158 1 1 38 VAL HG12 H -4.358 -2.974 0.825 1.00 . A A . 38 VAL HG12 1 1 6 6159 1 1 38 VAL HG13 H -3.191 -2.400 2.017 1.00 . A A . 38 VAL HG13 1 1 6 6160 1 1 38 VAL HG21 H -6.468 -1.456 0.391 1.00 . A A . 38 VAL HG21 1 1 6 6161 1 1 38 VAL HG22 H -5.340 -0.127 0.131 1.00 . A A . 38 VAL HG22 1 1 6 6162 1 1 38 VAL HG23 H -6.614 0.020 1.341 1.00 . A A . 38 VAL HG23 1 1 6 6163 1 1 38 VAL N N -6.685 -1.159 3.707 1.00 . A A . 38 VAL N 1 1 6 6164 1 1 38 VAL O O -4.682 -2.316 5.070 1.00 . A A . 38 VAL O 1 1 6 6165 1 1 39 LYS C C -1.923 -3.995 4.371 1.00 . A A . 39 LYS C 1 1 6 6166 1 1 39 LYS CA C -3.323 -4.587 4.306 1.00 . A A . 39 LYS CA 1 1 6 6167 1 1 39 LYS CB C -3.254 -6.034 3.816 1.00 . A A . 39 LYS CB 1 1 6 6168 1 1 39 LYS CD C -3.727 -7.186 5.996 1.00 . A A . 39 LYS CD 1 1 6 6169 1 1 39 LYS CE C -3.486 -8.482 6.754 1.00 . A A . 39 LYS CE 1 1 6 6170 1 1 39 LYS CG C -2.739 -7.015 4.855 1.00 . A A . 39 LYS CG 1 1 6 6171 1 1 39 LYS H H -4.378 -4.103 2.540 1.00 . A A . 39 LYS H 1 1 6 6172 1 1 39 LYS HA H -3.733 -4.575 5.296 1.00 . A A . 39 LYS HA 1 1 6 6173 1 1 39 LYS HB2 H -4.246 -6.347 3.522 1.00 . A A . 39 LYS HB2 1 1 6 6174 1 1 39 LYS HB3 H -2.603 -6.079 2.956 1.00 . A A . 39 LYS HB3 1 1 6 6175 1 1 39 LYS HD2 H -3.619 -6.357 6.680 1.00 . A A . 39 LYS HD2 1 1 6 6176 1 1 39 LYS HD3 H -4.729 -7.196 5.594 1.00 . A A . 39 LYS HD3 1 1 6 6177 1 1 39 LYS HE2 H -3.617 -9.310 6.072 1.00 . A A . 39 LYS HE2 1 1 6 6178 1 1 39 LYS HE3 H -2.473 -8.483 7.127 1.00 . A A . 39 LYS HE3 1 1 6 6179 1 1 39 LYS HG2 H -2.580 -7.974 4.384 1.00 . A A . 39 LYS HG2 1 1 6 6180 1 1 39 LYS HG3 H -1.803 -6.647 5.250 1.00 . A A . 39 LYS HG3 1 1 6 6181 1 1 39 LYS HZ1 H -4.279 -7.882 8.590 1.00 . A A . 39 LYS HZ1 1 1 6 6182 1 1 39 LYS HZ2 H -4.270 -9.558 8.363 1.00 . A A . 39 LYS HZ2 1 1 6 6183 1 1 39 LYS HZ3 H -5.409 -8.602 7.558 1.00 . A A . 39 LYS HZ3 1 1 6 6184 1 1 39 LYS N N -4.224 -3.818 3.464 1.00 . A A . 39 LYS N 1 1 6 6185 1 1 39 LYS NZ N -4.427 -8.642 7.896 1.00 . A A . 39 LYS NZ 1 1 6 6186 1 1 39 LYS O O -1.153 -4.065 3.412 1.00 . A A . 39 LYS O 1 1 6 6187 1 1 40 GLY C C 0.626 -3.802 6.457 1.00 . A A . 40 GLY C 1 1 6 6188 1 1 40 GLY CA C -0.293 -2.842 5.741 1.00 . A A . 40 GLY CA 1 1 6 6189 1 1 40 GLY H H -2.286 -3.352 6.221 1.00 . A A . 40 GLY H 1 1 6 6190 1 1 40 GLY HA2 H 0.147 -2.613 4.787 1.00 . A A . 40 GLY HA2 1 1 6 6191 1 1 40 GLY HA3 H -0.381 -1.938 6.320 1.00 . A A . 40 GLY HA3 1 1 6 6192 1 1 40 GLY N N -1.608 -3.412 5.522 1.00 . A A . 40 GLY N 1 1 6 6193 1 1 40 GLY O O 1.522 -3.396 7.197 1.00 . A A . 40 GLY O 1 1 6 6194 1 1 41 VAL C C 2.148 -6.694 5.760 1.00 . A A . 41 VAL C 1 1 6 6195 1 1 41 VAL CA C 1.210 -6.129 6.820 1.00 . A A . 41 VAL CA 1 1 6 6196 1 1 41 VAL CB C 0.367 -7.284 7.387 1.00 . A A . 41 VAL CB 1 1 6 6197 1 1 41 VAL CG1 C 1.169 -8.086 8.402 1.00 . A A . 41 VAL CG1 1 1 6 6198 1 1 41 VAL CG2 C -0.923 -6.763 8.003 1.00 . A A . 41 VAL CG2 1 1 6 6199 1 1 41 VAL H H -0.358 -5.332 5.656 1.00 . A A . 41 VAL H 1 1 6 6200 1 1 41 VAL HA H 1.793 -5.698 7.621 1.00 . A A . 41 VAL HA 1 1 6 6201 1 1 41 VAL HB H 0.113 -7.941 6.569 1.00 . A A . 41 VAL HB 1 1 6 6202 1 1 41 VAL HG11 H 2.074 -8.449 7.939 1.00 . A A . 41 VAL HG11 1 1 6 6203 1 1 41 VAL HG12 H 0.579 -8.922 8.746 1.00 . A A . 41 VAL HG12 1 1 6 6204 1 1 41 VAL HG13 H 1.421 -7.455 9.240 1.00 . A A . 41 VAL HG13 1 1 6 6205 1 1 41 VAL HG21 H -1.552 -6.352 7.227 1.00 . A A . 41 VAL HG21 1 1 6 6206 1 1 41 VAL HG22 H -0.693 -5.993 8.724 1.00 . A A . 41 VAL HG22 1 1 6 6207 1 1 41 VAL HG23 H -1.440 -7.573 8.494 1.00 . A A . 41 VAL HG23 1 1 6 6208 1 1 41 VAL N N 0.388 -5.083 6.239 1.00 . A A . 41 VAL N 1 1 6 6209 1 1 41 VAL O O 2.975 -7.559 6.047 1.00 . A A . 41 VAL O 1 1 6 6210 1 1 42 HIS C C 4.269 -6.207 3.642 1.00 . A A . 42 HIS C 1 1 6 6211 1 1 42 HIS CA C 2.847 -6.659 3.432 1.00 . A A . 42 HIS CA 1 1 6 6212 1 1 42 HIS CB C 2.289 -6.160 2.101 1.00 . A A . 42 HIS CB 1 1 6 6213 1 1 42 HIS CD2 C 1.106 -8.430 1.679 1.00 . A A . 42 HIS CD2 1 1 6 6214 1 1 42 HIS CE1 C -0.296 -7.771 0.126 1.00 . A A . 42 HIS CE1 1 1 6 6215 1 1 42 HIS CG C 1.324 -7.110 1.465 1.00 . A A . 42 HIS CG 1 1 6 6216 1 1 42 HIS H H 1.346 -5.503 4.348 1.00 . A A . 42 HIS H 1 1 6 6217 1 1 42 HIS HA H 2.843 -7.729 3.441 1.00 . A A . 42 HIS HA 1 1 6 6218 1 1 42 HIS HB2 H 1.765 -5.233 2.275 1.00 . A A . 42 HIS HB2 1 1 6 6219 1 1 42 HIS HB3 H 3.103 -5.993 1.412 1.00 . A A . 42 HIS HB3 1 1 6 6220 1 1 42 HIS HD1 H 0.343 -5.828 0.110 1.00 . A A . 42 HIS HD1 1 1 6 6221 1 1 42 HIS HD2 H 1.632 -9.061 2.379 1.00 . A A . 42 HIS HD2 1 1 6 6222 1 1 42 HIS HE1 H -1.075 -7.771 -0.623 1.00 . A A . 42 HIS HE1 1 1 6 6223 1 1 42 HIS HE2 H -0.341 -9.693 0.832 1.00 . A A . 42 HIS HE2 1 1 6 6224 1 1 42 HIS N N 2.013 -6.202 4.525 1.00 . A A . 42 HIS N 1 1 6 6225 1 1 42 HIS ND1 N 0.431 -6.729 0.485 1.00 . A A . 42 HIS ND1 1 1 6 6226 1 1 42 HIS NE2 N 0.094 -8.815 0.834 1.00 . A A . 42 HIS NE2 1 1 6 6227 1 1 42 HIS O O 4.745 -5.278 2.997 1.00 . A A . 42 HIS O 1 1 6 6228 1 1 43 VAL C C 7.284 -6.693 3.775 1.00 . A A . 43 VAL C 1 1 6 6229 1 1 43 VAL CA C 6.306 -6.607 4.935 1.00 . A A . 43 VAL CA 1 1 6 6230 1 1 43 VAL CB C 6.797 -7.527 6.071 1.00 . A A . 43 VAL CB 1 1 6 6231 1 1 43 VAL CG1 C 8.191 -7.123 6.525 1.00 . A A . 43 VAL CG1 1 1 6 6232 1 1 43 VAL CG2 C 5.824 -7.499 7.239 1.00 . A A . 43 VAL CG2 1 1 6 6233 1 1 43 VAL H H 4.449 -7.621 5.028 1.00 . A A . 43 VAL H 1 1 6 6234 1 1 43 VAL HA H 6.330 -5.603 5.297 1.00 . A A . 43 VAL HA 1 1 6 6235 1 1 43 VAL HB H 6.844 -8.538 5.693 1.00 . A A . 43 VAL HB 1 1 6 6236 1 1 43 VAL HG11 H 8.511 -7.773 7.326 1.00 . A A . 43 VAL HG11 1 1 6 6237 1 1 43 VAL HG12 H 8.174 -6.102 6.878 1.00 . A A . 43 VAL HG12 1 1 6 6238 1 1 43 VAL HG13 H 8.880 -7.205 5.699 1.00 . A A . 43 VAL HG13 1 1 6 6239 1 1 43 VAL HG21 H 6.261 -8.012 8.084 1.00 . A A . 43 VAL HG21 1 1 6 6240 1 1 43 VAL HG22 H 4.906 -7.991 6.956 1.00 . A A . 43 VAL HG22 1 1 6 6241 1 1 43 VAL HG23 H 5.615 -6.474 7.509 1.00 . A A . 43 VAL HG23 1 1 6 6242 1 1 43 VAL N N 4.927 -6.900 4.562 1.00 . A A . 43 VAL N 1 1 6 6243 1 1 43 VAL O O 8.109 -7.604 3.706 1.00 . A A . 43 VAL O 1 1 6 6244 1 1 44 ALA C C 9.247 -4.739 2.125 1.00 . A A . 44 ALA C 1 1 6 6245 1 1 44 ALA CA C 8.091 -5.643 1.741 1.00 . A A . 44 ALA CA 1 1 6 6246 1 1 44 ALA CB C 7.375 -5.139 0.499 1.00 . A A . 44 ALA CB 1 1 6 6247 1 1 44 ALA H H 6.467 -5.070 2.955 1.00 . A A . 44 ALA H 1 1 6 6248 1 1 44 ALA HA H 8.479 -6.627 1.540 1.00 . A A . 44 ALA HA 1 1 6 6249 1 1 44 ALA HB1 H 8.083 -5.045 -0.310 1.00 . A A . 44 ALA HB1 1 1 6 6250 1 1 44 ALA HB2 H 6.930 -4.177 0.705 1.00 . A A . 44 ALA HB2 1 1 6 6251 1 1 44 ALA HB3 H 6.604 -5.842 0.221 1.00 . A A . 44 ALA HB3 1 1 6 6252 1 1 44 ALA N N 7.181 -5.735 2.865 1.00 . A A . 44 ALA N 1 1 6 6253 1 1 44 ALA O O 9.593 -3.800 1.408 1.00 . A A . 44 ALA O 1 1 6 6254 1 1 45 GLU C C 12.016 -4.064 2.745 1.00 . A A . 45 GLU C 1 1 6 6255 1 1 45 GLU CA C 10.954 -4.272 3.809 1.00 . A A . 45 GLU CA 1 1 6 6256 1 1 45 GLU CB C 11.563 -4.974 5.024 1.00 . A A . 45 GLU CB 1 1 6 6257 1 1 45 GLU CD C 11.448 -7.291 4.015 1.00 . A A . 45 GLU CD 1 1 6 6258 1 1 45 GLU CG C 12.323 -6.244 4.678 1.00 . A A . 45 GLU CG 1 1 6 6259 1 1 45 GLU H H 9.524 -5.822 3.773 1.00 . A A . 45 GLU H 1 1 6 6260 1 1 45 GLU HA H 10.573 -3.308 4.114 1.00 . A A . 45 GLU HA 1 1 6 6261 1 1 45 GLU HB2 H 12.245 -4.295 5.512 1.00 . A A . 45 GLU HB2 1 1 6 6262 1 1 45 GLU HB3 H 10.770 -5.231 5.711 1.00 . A A . 45 GLU HB3 1 1 6 6263 1 1 45 GLU HG2 H 13.128 -5.993 4.004 1.00 . A A . 45 GLU HG2 1 1 6 6264 1 1 45 GLU HG3 H 12.732 -6.662 5.586 1.00 . A A . 45 GLU HG3 1 1 6 6265 1 1 45 GLU N N 9.839 -5.044 3.278 1.00 . A A . 45 GLU N 1 1 6 6266 1 1 45 GLU O O 12.804 -3.127 2.819 1.00 . A A . 45 GLU O 1 1 6 6267 1 1 45 GLU OE1 O 11.225 -7.191 2.791 1.00 . A A . 45 GLU OE1 1 1 6 6268 1 1 45 GLU OE2 O 10.983 -8.210 4.723 1.00 . A A . 45 GLU OE2 1 1 6 6269 1 1 46 ASP C C 12.704 -3.602 -0.156 1.00 . A A . 46 ASP C 1 1 6 6270 1 1 46 ASP CA C 13.000 -4.843 0.674 1.00 . A A . 46 ASP CA 1 1 6 6271 1 1 46 ASP CB C 12.954 -6.085 -0.213 1.00 . A A . 46 ASP CB 1 1 6 6272 1 1 46 ASP CG C 13.438 -7.332 0.503 1.00 . A A . 46 ASP CG 1 1 6 6273 1 1 46 ASP H H 11.413 -5.709 1.782 1.00 . A A . 46 ASP H 1 1 6 6274 1 1 46 ASP HA H 13.989 -4.747 1.100 1.00 . A A . 46 ASP HA 1 1 6 6275 1 1 46 ASP HB2 H 11.937 -6.250 -0.534 1.00 . A A . 46 ASP HB2 1 1 6 6276 1 1 46 ASP HB3 H 13.580 -5.922 -1.077 1.00 . A A . 46 ASP HB3 1 1 6 6277 1 1 46 ASP N N 12.044 -4.955 1.765 1.00 . A A . 46 ASP N 1 1 6 6278 1 1 46 ASP O O 13.592 -2.805 -0.434 1.00 . A A . 46 ASP O 1 1 6 6279 1 1 46 ASP OD1 O 14.669 -7.531 0.580 1.00 . A A . 46 ASP OD1 1 1 6 6280 1 1 46 ASP OD2 O 12.587 -8.107 0.987 1.00 . A A . 46 ASP OD2 1 1 6 6281 1 1 47 VAL C C 11.337 -0.979 -0.626 1.00 . A A . 47 VAL C 1 1 6 6282 1 1 47 VAL CA C 11.015 -2.294 -1.331 1.00 . A A . 47 VAL CA 1 1 6 6283 1 1 47 VAL CB C 9.504 -2.348 -1.609 1.00 . A A . 47 VAL CB 1 1 6 6284 1 1 47 VAL CG1 C 9.089 -1.210 -2.526 1.00 . A A . 47 VAL CG1 1 1 6 6285 1 1 47 VAL CG2 C 9.112 -3.690 -2.206 1.00 . A A . 47 VAL CG2 1 1 6 6286 1 1 47 VAL H H 10.770 -4.093 -0.238 1.00 . A A . 47 VAL H 1 1 6 6287 1 1 47 VAL HA H 11.539 -2.330 -2.275 1.00 . A A . 47 VAL HA 1 1 6 6288 1 1 47 VAL HB H 8.987 -2.228 -0.666 1.00 . A A . 47 VAL HB 1 1 6 6289 1 1 47 VAL HG11 H 9.786 -1.136 -3.348 1.00 . A A . 47 VAL HG11 1 1 6 6290 1 1 47 VAL HG12 H 9.084 -0.287 -1.971 1.00 . A A . 47 VAL HG12 1 1 6 6291 1 1 47 VAL HG13 H 8.098 -1.403 -2.911 1.00 . A A . 47 VAL HG13 1 1 6 6292 1 1 47 VAL HG21 H 9.560 -3.795 -3.181 1.00 . A A . 47 VAL HG21 1 1 6 6293 1 1 47 VAL HG22 H 8.037 -3.743 -2.296 1.00 . A A . 47 VAL HG22 1 1 6 6294 1 1 47 VAL HG23 H 9.459 -4.484 -1.564 1.00 . A A . 47 VAL HG23 1 1 6 6295 1 1 47 VAL N N 11.440 -3.438 -0.527 1.00 . A A . 47 VAL N 1 1 6 6296 1 1 47 VAL O O 11.565 0.033 -1.271 1.00 . A A . 47 VAL O 1 1 6 6297 1 1 48 ALA C C 13.129 0.223 1.809 1.00 . A A . 48 ALA C 1 1 6 6298 1 1 48 ALA CA C 11.632 0.089 1.588 1.00 . A A . 48 ALA CA 1 1 6 6299 1 1 48 ALA CB C 10.926 -0.114 2.919 1.00 . A A . 48 ALA CB 1 1 6 6300 1 1 48 ALA H H 11.189 -1.891 1.098 1.00 . A A . 48 ALA H 1 1 6 6301 1 1 48 ALA HA H 11.250 0.991 1.144 1.00 . A A . 48 ALA HA 1 1 6 6302 1 1 48 ALA HB1 H 11.269 -1.032 3.372 1.00 . A A . 48 ALA HB1 1 1 6 6303 1 1 48 ALA HB2 H 9.861 -0.168 2.756 1.00 . A A . 48 ALA HB2 1 1 6 6304 1 1 48 ALA HB3 H 11.149 0.715 3.574 1.00 . A A . 48 ALA HB3 1 1 6 6305 1 1 48 ALA N N 11.352 -1.042 0.701 1.00 . A A . 48 ALA N 1 1 6 6306 1 1 48 ALA O O 13.726 1.256 1.504 1.00 . A A . 48 ALA O 1 1 6 6307 1 1 49 LYS C C 15.887 -0.573 1.270 1.00 . A A . 49 LYS C 1 1 6 6308 1 1 49 LYS CA C 15.165 -0.851 2.580 1.00 . A A . 49 LYS CA 1 1 6 6309 1 1 49 LYS CB C 15.602 -2.205 3.149 1.00 . A A . 49 LYS CB 1 1 6 6310 1 1 49 LYS CD C 17.476 -3.661 3.981 1.00 . A A . 49 LYS CD 1 1 6 6311 1 1 49 LYS CE C 16.779 -3.914 5.308 1.00 . A A . 49 LYS CE 1 1 6 6312 1 1 49 LYS CG C 17.098 -2.306 3.402 1.00 . A A . 49 LYS CG 1 1 6 6313 1 1 49 LYS H H 13.199 -1.622 2.574 1.00 . A A . 49 LYS H 1 1 6 6314 1 1 49 LYS HA H 15.399 -0.071 3.288 1.00 . A A . 49 LYS HA 1 1 6 6315 1 1 49 LYS HB2 H 15.089 -2.370 4.084 1.00 . A A . 49 LYS HB2 1 1 6 6316 1 1 49 LYS HB3 H 15.324 -2.981 2.453 1.00 . A A . 49 LYS HB3 1 1 6 6317 1 1 49 LYS HD2 H 17.187 -4.433 3.283 1.00 . A A . 49 LYS HD2 1 1 6 6318 1 1 49 LYS HD3 H 18.544 -3.691 4.132 1.00 . A A . 49 LYS HD3 1 1 6 6319 1 1 49 LYS HE2 H 15.712 -3.919 5.145 1.00 . A A . 49 LYS HE2 1 1 6 6320 1 1 49 LYS HE3 H 17.090 -4.877 5.684 1.00 . A A . 49 LYS HE3 1 1 6 6321 1 1 49 LYS HG2 H 17.622 -2.166 2.468 1.00 . A A . 49 LYS HG2 1 1 6 6322 1 1 49 LYS HG3 H 17.389 -1.533 4.098 1.00 . A A . 49 LYS HG3 1 1 6 6323 1 1 49 LYS HZ1 H 18.134 -2.855 6.495 1.00 . A A . 49 LYS HZ1 1 1 6 6324 1 1 49 LYS HZ2 H 16.616 -3.069 7.212 1.00 . A A . 49 LYS HZ2 1 1 6 6325 1 1 49 LYS HZ3 H 16.816 -1.933 5.973 1.00 . A A . 49 LYS HZ3 1 1 6 6326 1 1 49 LYS N N 13.732 -0.835 2.344 1.00 . A A . 49 LYS N 1 1 6 6327 1 1 49 LYS NZ N 17.109 -2.870 6.317 1.00 . A A . 49 LYS NZ 1 1 6 6328 1 1 49 LYS O O 16.997 -0.043 1.250 1.00 . A A . 49 LYS O 1 1 6 6329 1 1 50 ASP C C 15.308 0.620 -1.678 1.00 . A A . 50 ASP C 1 1 6 6330 1 1 50 ASP CA C 15.791 -0.724 -1.151 1.00 . A A . 50 ASP CA 1 1 6 6331 1 1 50 ASP CB C 15.387 -1.846 -2.110 1.00 . A A . 50 ASP CB 1 1 6 6332 1 1 50 ASP CG C 16.230 -1.862 -3.370 1.00 . A A . 50 ASP CG 1 1 6 6333 1 1 50 ASP H H 14.369 -1.384 0.253 1.00 . A A . 50 ASP H 1 1 6 6334 1 1 50 ASP HA H 16.868 -0.701 -1.064 1.00 . A A . 50 ASP HA 1 1 6 6335 1 1 50 ASP HB2 H 15.499 -2.798 -1.608 1.00 . A A . 50 ASP HB2 1 1 6 6336 1 1 50 ASP HB3 H 14.353 -1.712 -2.391 1.00 . A A . 50 ASP HB3 1 1 6 6337 1 1 50 ASP N N 15.242 -0.951 0.171 1.00 . A A . 50 ASP N 1 1 6 6338 1 1 50 ASP O O 15.955 1.233 -2.526 1.00 . A A . 50 ASP O 1 1 6 6339 1 1 50 ASP OD1 O 15.856 -1.172 -4.343 1.00 . A A . 50 ASP OD1 1 1 6 6340 1 1 50 ASP OD2 O 17.264 -2.562 -3.383 1.00 . A A . 50 ASP OD2 1 1 6 6341 1 1 51 TYR C C 14.465 3.495 -1.084 1.00 . A A . 51 TYR C 1 1 6 6342 1 1 51 TYR CA C 13.618 2.355 -1.609 1.00 . A A . 51 TYR CA 1 1 6 6343 1 1 51 TYR CB C 12.191 2.594 -1.129 1.00 . A A . 51 TYR CB 1 1 6 6344 1 1 51 TYR CD1 C 11.425 2.960 -3.507 1.00 . A A . 51 TYR CD1 1 1 6 6345 1 1 51 TYR CD2 C 9.891 1.975 -1.973 1.00 . A A . 51 TYR CD2 1 1 6 6346 1 1 51 TYR CE1 C 10.479 2.876 -4.511 1.00 . A A . 51 TYR CE1 1 1 6 6347 1 1 51 TYR CE2 C 8.939 1.890 -2.971 1.00 . A A . 51 TYR CE2 1 1 6 6348 1 1 51 TYR CG C 11.148 2.513 -2.222 1.00 . A A . 51 TYR CG 1 1 6 6349 1 1 51 TYR CZ C 9.221 2.387 -4.226 1.00 . A A . 51 TYR CZ 1 1 6 6350 1 1 51 TYR H H 13.665 0.541 -0.523 1.00 . A A . 51 TYR H 1 1 6 6351 1 1 51 TYR HA H 13.620 2.340 -2.669 1.00 . A A . 51 TYR HA 1 1 6 6352 1 1 51 TYR HB2 H 11.961 1.876 -0.389 1.00 . A A . 51 TYR HB2 1 1 6 6353 1 1 51 TYR HB3 H 12.122 3.580 -0.689 1.00 . A A . 51 TYR HB3 1 1 6 6354 1 1 51 TYR HD1 H 12.397 3.380 -3.717 1.00 . A A . 51 TYR HD1 1 1 6 6355 1 1 51 TYR HD2 H 9.658 1.621 -0.980 1.00 . A A . 51 TYR HD2 1 1 6 6356 1 1 51 TYR HE1 H 10.715 3.229 -5.504 1.00 . A A . 51 TYR HE1 1 1 6 6357 1 1 51 TYR HE2 H 7.969 1.470 -2.756 1.00 . A A . 51 TYR HE2 1 1 6 6358 1 1 51 TYR HH H 8.699 1.901 -6.029 1.00 . A A . 51 TYR HH 1 1 6 6359 1 1 51 TYR N N 14.156 1.076 -1.177 1.00 . A A . 51 TYR N 1 1 6 6360 1 1 51 TYR O O 15.182 4.168 -1.824 1.00 . A A . 51 TYR O 1 1 6 6361 1 1 51 TYR OH O 8.295 2.256 -5.236 1.00 . A A . 51 TYR OH 1 1 6 6362 1 1 52 GLU C C 16.498 4.393 1.207 1.00 . A A . 52 GLU C 1 1 6 6363 1 1 52 GLU CA C 15.049 4.758 0.912 1.00 . A A . 52 GLU CA 1 1 6 6364 1 1 52 GLU CB C 14.323 5.098 2.216 1.00 . A A . 52 GLU CB 1 1 6 6365 1 1 52 GLU CD C 13.511 4.297 4.470 1.00 . A A . 52 GLU CD 1 1 6 6366 1 1 52 GLU CG C 14.194 3.922 3.169 1.00 . A A . 52 GLU CG 1 1 6 6367 1 1 52 GLU H H 13.791 3.080 0.749 1.00 . A A . 52 GLU H 1 1 6 6368 1 1 52 GLU HA H 15.023 5.614 0.271 1.00 . A A . 52 GLU HA 1 1 6 6369 1 1 52 GLU HB2 H 14.864 5.885 2.721 1.00 . A A . 52 GLU HB2 1 1 6 6370 1 1 52 GLU HB3 H 13.331 5.449 1.979 1.00 . A A . 52 GLU HB3 1 1 6 6371 1 1 52 GLU HG2 H 13.615 3.148 2.688 1.00 . A A . 52 GLU HG2 1 1 6 6372 1 1 52 GLU HG3 H 15.180 3.547 3.394 1.00 . A A . 52 GLU HG3 1 1 6 6373 1 1 52 GLU N N 14.355 3.690 0.226 1.00 . A A . 52 GLU N 1 1 6 6374 1 1 52 GLU O O 17.411 5.187 0.977 1.00 . A A . 52 GLU O 1 1 6 6375 1 1 52 GLU OE1 O 14.212 4.743 5.404 1.00 . A A . 52 GLU OE1 1 1 6 6376 1 1 52 GLU OE2 O 12.273 4.147 4.557 1.00 . A A . 52 GLU OE2 1 1 6 6377 1 1 53 ASP C C 18.784 2.192 0.841 1.00 . A A . 53 ASP C 1 1 6 6378 1 1 53 ASP CA C 18.033 2.712 2.064 1.00 . A A . 53 ASP CA 1 1 6 6379 1 1 53 ASP CB C 17.924 1.620 3.127 1.00 . A A . 53 ASP CB 1 1 6 6380 1 1 53 ASP CG C 18.073 2.166 4.535 1.00 . A A . 53 ASP CG 1 1 6 6381 1 1 53 ASP H H 15.934 2.589 1.848 1.00 . A A . 53 ASP H 1 1 6 6382 1 1 53 ASP HA H 18.581 3.546 2.476 1.00 . A A . 53 ASP HA 1 1 6 6383 1 1 53 ASP HB2 H 16.952 1.153 3.047 1.00 . A A . 53 ASP HB2 1 1 6 6384 1 1 53 ASP HB3 H 18.692 0.881 2.960 1.00 . A A . 53 ASP HB3 1 1 6 6385 1 1 53 ASP N N 16.701 3.184 1.714 1.00 . A A . 53 ASP N 1 1 6 6386 1 1 53 ASP O O 20.015 2.182 0.819 1.00 . A A . 53 ASP O 1 1 6 6387 1 1 53 ASP OD1 O 17.131 2.829 5.017 1.00 . A A . 53 ASP OD1 1 1 6 6388 1 1 53 ASP OD2 O 19.133 1.933 5.153 1.00 . A A . 53 ASP OD2 1 1 6 6389 1 1 54 GLY C C 19.156 2.368 -2.287 1.00 . A A . 54 GLY C 1 1 6 6390 1 1 54 GLY CA C 18.670 1.257 -1.380 1.00 . A A . 54 GLY CA 1 1 6 6391 1 1 54 GLY H H 17.065 1.794 -0.105 1.00 . A A . 54 GLY H 1 1 6 6392 1 1 54 GLY HA2 H 19.511 0.640 -1.101 1.00 . A A . 54 GLY HA2 1 1 6 6393 1 1 54 GLY HA3 H 17.957 0.652 -1.919 1.00 . A A . 54 GLY HA3 1 1 6 6394 1 1 54 GLY N N 18.043 1.764 -0.174 1.00 . A A . 54 GLY N 1 1 6 6395 1 1 54 GLY O O 20.325 2.393 -2.675 1.00 . A A . 54 GLY O 1 1 6 6396 1 1 55 LEU C C 19.567 5.356 -2.771 1.00 . A A . 55 LEU C 1 1 6 6397 1 1 55 LEU CA C 18.613 4.410 -3.490 1.00 . A A . 55 LEU CA 1 1 6 6398 1 1 55 LEU CB C 17.356 5.165 -3.924 1.00 . A A . 55 LEU CB 1 1 6 6399 1 1 55 LEU CD1 C 15.106 5.169 -5.031 1.00 . A A . 55 LEU CD1 1 1 6 6400 1 1 55 LEU CD2 C 16.912 3.659 -5.877 1.00 . A A . 55 LEU CD2 1 1 6 6401 1 1 55 LEU CG C 16.307 4.318 -4.647 1.00 . A A . 55 LEU CG 1 1 6 6402 1 1 55 LEU H H 17.344 3.214 -2.290 1.00 . A A . 55 LEU H 1 1 6 6403 1 1 55 LEU HA H 19.107 4.014 -4.365 1.00 . A A . 55 LEU HA 1 1 6 6404 1 1 55 LEU HB2 H 16.899 5.596 -3.045 1.00 . A A . 55 LEU HB2 1 1 6 6405 1 1 55 LEU HB3 H 17.653 5.967 -4.583 1.00 . A A . 55 LEU HB3 1 1 6 6406 1 1 55 LEU HD11 H 14.371 4.552 -5.527 1.00 . A A . 55 LEU HD11 1 1 6 6407 1 1 55 LEU HD12 H 15.423 5.956 -5.699 1.00 . A A . 55 LEU HD12 1 1 6 6408 1 1 55 LEU HD13 H 14.673 5.602 -4.143 1.00 . A A . 55 LEU HD13 1 1 6 6409 1 1 55 LEU HD21 H 17.710 2.997 -5.575 1.00 . A A . 55 LEU HD21 1 1 6 6410 1 1 55 LEU HD22 H 17.305 4.420 -6.535 1.00 . A A . 55 LEU HD22 1 1 6 6411 1 1 55 LEU HD23 H 16.151 3.094 -6.394 1.00 . A A . 55 LEU HD23 1 1 6 6412 1 1 55 LEU HG H 15.964 3.538 -3.983 1.00 . A A . 55 LEU HG 1 1 6 6413 1 1 55 LEU N N 18.261 3.289 -2.628 1.00 . A A . 55 LEU N 1 1 6 6414 1 1 55 LEU O O 20.667 5.630 -3.251 1.00 . A A . 55 LEU O 1 1 6 6415 1 1 56 GLU C C 20.826 5.985 0.154 1.00 . A A . 56 GLU C 1 1 6 6416 1 1 56 GLU CA C 19.955 6.761 -0.824 1.00 . A A . 56 GLU CA 1 1 6 6417 1 1 56 GLU CB C 19.076 7.755 -0.072 1.00 . A A . 56 GLU CB 1 1 6 6418 1 1 56 GLU CD C 17.289 9.534 -0.197 1.00 . A A . 56 GLU CD 1 1 6 6419 1 1 56 GLU CG C 18.167 8.571 -0.974 1.00 . A A . 56 GLU CG 1 1 6 6420 1 1 56 GLU H H 18.248 5.602 -1.288 1.00 . A A . 56 GLU H 1 1 6 6421 1 1 56 GLU HA H 20.595 7.298 -1.498 1.00 . A A . 56 GLU HA 1 1 6 6422 1 1 56 GLU HB2 H 18.463 7.210 0.624 1.00 . A A . 56 GLU HB2 1 1 6 6423 1 1 56 GLU HB3 H 19.710 8.437 0.476 1.00 . A A . 56 GLU HB3 1 1 6 6424 1 1 56 GLU HG2 H 18.776 9.138 -1.662 1.00 . A A . 56 GLU HG2 1 1 6 6425 1 1 56 GLU HG3 H 17.531 7.896 -1.529 1.00 . A A . 56 GLU HG3 1 1 6 6426 1 1 56 GLU N N 19.137 5.852 -1.615 1.00 . A A . 56 GLU N 1 1 6 6427 1 1 56 GLU O O 20.810 6.237 1.359 1.00 . A A . 56 GLU O 1 1 6 6428 1 1 56 GLU OE1 O 17.734 10.675 0.050 1.00 . A A . 56 GLU OE1 1 1 6 6429 1 1 56 GLU OE2 O 16.158 9.148 0.162 1.00 . A A . 56 GLU OE2 1 1 6 6430 1 1 57 TYR C C 23.746 4.963 0.778 1.00 . A A . 57 TYR C 1 1 6 6431 1 1 57 TYR CA C 22.469 4.208 0.423 1.00 . A A . 57 TYR CA 1 1 6 6432 1 1 57 TYR CB C 22.811 2.921 -0.331 1.00 . A A . 57 TYR CB 1 1 6 6433 1 1 57 TYR CD1 C 23.310 1.051 1.291 1.00 . A A . 57 TYR CD1 1 1 6 6434 1 1 57 TYR CD2 C 25.145 2.129 0.219 1.00 . A A . 57 TYR CD2 1 1 6 6435 1 1 57 TYR CE1 C 24.186 0.222 1.966 1.00 . A A . 57 TYR CE1 1 1 6 6436 1 1 57 TYR CE2 C 26.027 1.304 0.890 1.00 . A A . 57 TYR CE2 1 1 6 6437 1 1 57 TYR CG C 23.773 2.017 0.408 1.00 . A A . 57 TYR CG 1 1 6 6438 1 1 57 TYR CZ C 25.543 0.352 1.761 1.00 . A A . 57 TYR CZ 1 1 6 6439 1 1 57 TYR H H 21.544 4.898 -1.351 1.00 . A A . 57 TYR H 1 1 6 6440 1 1 57 TYR HA H 21.949 3.955 1.334 1.00 . A A . 57 TYR HA 1 1 6 6441 1 1 57 TYR HB2 H 21.904 2.364 -0.506 1.00 . A A . 57 TYR HB2 1 1 6 6442 1 1 57 TYR HB3 H 23.258 3.178 -1.280 1.00 . A A . 57 TYR HB3 1 1 6 6443 1 1 57 TYR HD1 H 22.245 0.951 1.449 1.00 . A A . 57 TYR HD1 1 1 6 6444 1 1 57 TYR HD2 H 25.522 2.877 -0.464 1.00 . A A . 57 TYR HD2 1 1 6 6445 1 1 57 TYR HE1 H 23.807 -0.524 2.648 1.00 . A A . 57 TYR HE1 1 1 6 6446 1 1 57 TYR HE2 H 27.091 1.406 0.729 1.00 . A A . 57 TYR HE2 1 1 6 6447 1 1 57 TYR HH H 27.154 0.045 2.765 1.00 . A A . 57 TYR HH 1 1 6 6448 1 1 57 TYR N N 21.582 5.039 -0.383 1.00 . A A . 57 TYR N 1 1 6 6449 1 1 57 TYR O O 24.716 4.886 -0.006 1.00 . A A . 57 TYR O 1 1 6 6450 1 1 57 TYR OXT O 23.765 5.627 1.836 1.00 . A A . 57 TYR OXT 1 1 6 6451 1 1 57 TYR OH O 26.418 -0.473 2.429 1.00 . A A . 57 TYR OH 1 1 6 6452 2 2 1 ALA C C -9.494 -8.111 6.137 1.00 . B B . 1 ALA C 1 1 6 6453 2 2 1 ALA CA C -8.854 -9.327 6.804 1.00 . B B . 1 ALA CA 1 1 6 6454 2 2 1 ALA CB C -9.013 -10.556 5.922 1.00 . B B . 1 ALA CB 1 1 6 6455 2 2 1 ALA H1 H -9.317 -8.744 8.753 1.00 . B B . 1 ALA H1 1 1 6 6456 2 2 1 ALA H2 H -8.986 -10.395 8.591 1.00 . B B . 1 ALA H2 1 1 6 6457 2 2 1 ALA H3 H -10.464 -9.773 8.053 1.00 . B B . 1 ALA H3 1 1 6 6458 2 2 1 ALA HA H -7.798 -9.140 6.929 1.00 . B B . 1 ALA HA 1 1 6 6459 2 2 1 ALA HB1 H -10.064 -10.759 5.775 1.00 . B B . 1 ALA HB1 1 1 6 6460 2 2 1 ALA HB2 H -8.545 -11.404 6.398 1.00 . B B . 1 ALA HB2 1 1 6 6461 2 2 1 ALA HB3 H -8.544 -10.376 4.966 1.00 . B B . 1 ALA HB3 1 1 6 6462 2 2 1 ALA N N -9.446 -9.576 8.143 1.00 . B B . 1 ALA N 1 1 6 6463 2 2 1 ALA O O -10.516 -8.232 5.462 1.00 . B B . 1 ALA O 1 1 6 6464 2 2 2 PRO C C -9.747 -5.838 4.251 1.00 . B B . 2 PRO C 1 1 6 6465 2 2 2 PRO CA C -9.411 -5.681 5.731 1.00 . B B . 2 PRO CA 1 1 6 6466 2 2 2 PRO CB C -8.254 -4.700 5.919 1.00 . B B . 2 PRO CB 1 1 6 6467 2 2 2 PRO CD C -7.671 -6.692 7.110 1.00 . B B . 2 PRO CD 1 1 6 6468 2 2 2 PRO CG C -7.539 -5.194 7.130 1.00 . B B . 2 PRO CG 1 1 6 6469 2 2 2 PRO HA H -10.281 -5.323 6.262 1.00 . B B . 2 PRO HA 1 1 6 6470 2 2 2 PRO HB2 H -7.618 -4.719 5.047 1.00 . B B . 2 PRO HB2 1 1 6 6471 2 2 2 PRO HB3 H -8.642 -3.704 6.069 1.00 . B B . 2 PRO HB3 1 1 6 6472 2 2 2 PRO HD2 H -6.814 -7.141 6.630 1.00 . B B . 2 PRO HD2 1 1 6 6473 2 2 2 PRO HD3 H -7.784 -7.074 8.114 1.00 . B B . 2 PRO HD3 1 1 6 6474 2 2 2 PRO HG2 H -6.498 -4.909 7.082 1.00 . B B . 2 PRO HG2 1 1 6 6475 2 2 2 PRO HG3 H -7.999 -4.788 8.018 1.00 . B B . 2 PRO HG3 1 1 6 6476 2 2 2 PRO N N -8.897 -6.922 6.319 1.00 . B B . 2 PRO N 1 1 6 6477 2 2 2 PRO O O -8.855 -5.841 3.403 1.00 . B B . 2 PRO O 1 1 6 6478 2 2 3 PRO C C -11.097 -4.965 1.644 1.00 . B B . 3 PRO C 1 1 6 6479 2 2 3 PRO CA C -11.499 -6.135 2.537 1.00 . B B . 3 PRO CA 1 1 6 6480 2 2 3 PRO CB C -13.026 -6.211 2.660 1.00 . B B . 3 PRO CB 1 1 6 6481 2 2 3 PRO CD C -12.168 -5.981 4.875 1.00 . B B . 3 PRO CD 1 1 6 6482 2 2 3 PRO CG C -13.284 -6.591 4.078 1.00 . B B . 3 PRO CG 1 1 6 6483 2 2 3 PRO HA H -11.126 -7.054 2.109 1.00 . B B . 3 PRO HA 1 1 6 6484 2 2 3 PRO HB2 H -13.456 -5.247 2.426 1.00 . B B . 3 PRO HB2 1 1 6 6485 2 2 3 PRO HB3 H -13.407 -6.955 1.977 1.00 . B B . 3 PRO HB3 1 1 6 6486 2 2 3 PRO HD2 H -12.426 -4.977 5.179 1.00 . B B . 3 PRO HD2 1 1 6 6487 2 2 3 PRO HD3 H -11.940 -6.591 5.736 1.00 . B B . 3 PRO HD3 1 1 6 6488 2 2 3 PRO HG2 H -14.236 -6.194 4.397 1.00 . B B . 3 PRO HG2 1 1 6 6489 2 2 3 PRO HG3 H -13.271 -7.666 4.177 1.00 . B B . 3 PRO HG3 1 1 6 6490 2 2 3 PRO N N -11.044 -5.971 3.923 1.00 . B B . 3 PRO N 1 1 6 6491 2 2 3 PRO O O -10.886 -5.137 0.443 1.00 . B B . 3 PRO O 1 1 6 6492 2 2 4 GLY C C -9.259 -2.743 0.811 1.00 . B B . 4 GLY C 1 1 6 6493 2 2 4 GLY CA C -10.619 -2.604 1.463 1.00 . B B . 4 GLY CA 1 1 6 6494 2 2 4 GLY H H -11.168 -3.698 3.192 1.00 . B B . 4 GLY H 1 1 6 6495 2 2 4 GLY HA2 H -11.359 -2.446 0.693 1.00 . B B . 4 GLY HA2 1 1 6 6496 2 2 4 GLY HA3 H -10.606 -1.745 2.118 1.00 . B B . 4 GLY HA3 1 1 6 6497 2 2 4 GLY N N -10.991 -3.778 2.232 1.00 . B B . 4 GLY N 1 1 6 6498 2 2 4 GLY O O -8.239 -2.414 1.413 1.00 . B B . 4 GLY O 1 1 6 6499 2 2 5 THR C C -8.225 -3.319 -2.673 1.00 . B B . 5 THR C 1 1 6 6500 2 2 5 THR CA C -8.002 -3.420 -1.166 1.00 . B B . 5 THR CA 1 1 6 6501 2 2 5 THR CB C -7.378 -4.790 -0.843 1.00 . B B . 5 THR CB 1 1 6 6502 2 2 5 THR CG2 C -7.154 -4.940 0.654 1.00 . B B . 5 THR CG2 1 1 6 6503 2 2 5 THR H H -10.099 -3.405 -0.867 1.00 . B B . 5 THR H 1 1 6 6504 2 2 5 THR HA H -7.309 -2.653 -0.864 1.00 . B B . 5 THR HA 1 1 6 6505 2 2 5 THR HB H -6.423 -4.862 -1.343 1.00 . B B . 5 THR HB 1 1 6 6506 2 2 5 THR HG1 H -8.190 -5.888 -2.268 1.00 . B B . 5 THR HG1 1 1 6 6507 2 2 5 THR HG21 H -6.487 -4.165 0.998 1.00 . B B . 5 THR HG21 1 1 6 6508 2 2 5 THR HG22 H -6.720 -5.907 0.857 1.00 . B B . 5 THR HG22 1 1 6 6509 2 2 5 THR HG23 H -8.100 -4.856 1.168 1.00 . B B . 5 THR HG23 1 1 6 6510 2 2 5 THR N N -9.247 -3.219 -0.427 1.00 . B B . 5 THR N 1 1 6 6511 2 2 5 THR O O -9.315 -3.615 -3.163 1.00 . B B . 5 THR O 1 1 6 6512 2 2 5 THR OG1 O -8.232 -5.841 -1.310 1.00 . B B . 5 THR OG1 1 1 6 6513 2 2 6 ALA C C -5.974 -2.887 -5.596 1.00 . B B . 6 ALA C 1 1 6 6514 2 2 6 ALA CA C -7.317 -2.785 -4.863 1.00 . B B . 6 ALA CA 1 1 6 6515 2 2 6 ALA CB C -8.014 -1.486 -5.219 1.00 . B B . 6 ALA CB 1 1 6 6516 2 2 6 ALA H H -6.357 -2.644 -2.972 1.00 . B B . 6 ALA H 1 1 6 6517 2 2 6 ALA HA H -7.949 -3.593 -5.198 1.00 . B B . 6 ALA HA 1 1 6 6518 2 2 6 ALA HB1 H -8.895 -1.700 -5.805 1.00 . B B . 6 ALA HB1 1 1 6 6519 2 2 6 ALA HB2 H -7.344 -0.862 -5.789 1.00 . B B . 6 ALA HB2 1 1 6 6520 2 2 6 ALA HB3 H -8.297 -0.979 -4.312 1.00 . B B . 6 ALA HB3 1 1 6 6521 2 2 6 ALA N N -7.195 -2.900 -3.411 1.00 . B B . 6 ALA N 1 1 6 6522 2 2 6 ALA O O -5.630 -3.946 -6.121 1.00 . B B . 6 ALA O 1 1 6 6523 2 2 7 ARG C C -3.052 -2.957 -5.986 1.00 . B B . 7 ARG C 1 1 6 6524 2 2 7 ARG CA C -3.937 -1.766 -6.345 1.00 . B B . 7 ARG CA 1 1 6 6525 2 2 7 ARG CB C -3.193 -0.456 -6.099 1.00 . B B . 7 ARG CB 1 1 6 6526 2 2 7 ARG CD C -4.187 0.677 -8.100 1.00 . B B . 7 ARG CD 1 1 6 6527 2 2 7 ARG CG C -3.938 0.766 -6.603 1.00 . B B . 7 ARG CG 1 1 6 6528 2 2 7 ARG CZ C -5.259 1.983 -9.883 1.00 . B B . 7 ARG CZ 1 1 6 6529 2 2 7 ARG H H -5.520 -0.981 -5.168 1.00 . B B . 7 ARG H 1 1 6 6530 2 2 7 ARG HA H -4.165 -1.830 -7.400 1.00 . B B . 7 ARG HA 1 1 6 6531 2 2 7 ARG HB2 H -3.025 -0.345 -5.045 1.00 . B B . 7 ARG HB2 1 1 6 6532 2 2 7 ARG HB3 H -2.237 -0.499 -6.602 1.00 . B B . 7 ARG HB3 1 1 6 6533 2 2 7 ARG HD2 H -3.235 0.608 -8.605 1.00 . B B . 7 ARG HD2 1 1 6 6534 2 2 7 ARG HD3 H -4.765 -0.213 -8.303 1.00 . B B . 7 ARG HD3 1 1 6 6535 2 2 7 ARG HE H -5.146 2.541 -7.970 1.00 . B B . 7 ARG HE 1 1 6 6536 2 2 7 ARG HG2 H -4.888 0.834 -6.093 1.00 . B B . 7 ARG HG2 1 1 6 6537 2 2 7 ARG HG3 H -3.351 1.648 -6.395 1.00 . B B . 7 ARG HG3 1 1 6 6538 2 2 7 ARG HH11 H -4.446 0.233 -10.482 1.00 . B B . 7 ARG HH11 1 1 6 6539 2 2 7 ARG HH12 H -5.211 1.161 -11.728 1.00 . B B . 7 ARG HH12 1 1 6 6540 2 2 7 ARG HH21 H -6.158 3.771 -9.604 1.00 . B B . 7 ARG HH21 1 1 6 6541 2 2 7 ARG HH22 H -6.185 3.171 -11.228 1.00 . B B . 7 ARG HH22 1 1 6 6542 2 2 7 ARG N N -5.217 -1.789 -5.632 1.00 . B B . 7 ARG N 1 1 6 6543 2 2 7 ARG NE N -4.908 1.838 -8.609 1.00 . B B . 7 ARG NE 1 1 6 6544 2 2 7 ARG NH1 N -4.946 1.049 -10.770 1.00 . B B . 7 ARG NH1 1 1 6 6545 2 2 7 ARG NH2 N -5.921 3.064 -10.270 1.00 . B B . 7 ARG NH2 1 1 6 6546 2 2 7 ARG O O -3.200 -4.030 -6.572 1.00 . B B . 7 ARG O 1 1 6 6547 2 2 8 ARG C C -0.437 -4.340 -5.878 1.00 . B B . 8 ARG C 1 1 6 6548 2 2 8 ARG CA C -1.246 -3.883 -4.665 1.00 . B B . 8 ARG CA 1 1 6 6549 2 2 8 ARG CB C -2.073 -5.045 -4.119 1.00 . B B . 8 ARG CB 1 1 6 6550 2 2 8 ARG CD C -3.621 -5.812 -2.307 1.00 . B B . 8 ARG CD 1 1 6 6551 2 2 8 ARG CG C -2.471 -4.885 -2.663 1.00 . B B . 8 ARG CG 1 1 6 6552 2 2 8 ARG CZ C -4.615 -6.834 -0.307 1.00 . B B . 8 ARG CZ 1 1 6 6553 2 2 8 ARG H H -2.036 -1.920 -4.576 1.00 . B B . 8 ARG H 1 1 6 6554 2 2 8 ARG HA H -0.570 -3.532 -3.899 1.00 . B B . 8 ARG HA 1 1 6 6555 2 2 8 ARG HB2 H -2.976 -5.128 -4.704 1.00 . B B . 8 ARG HB2 1 1 6 6556 2 2 8 ARG HB3 H -1.504 -5.956 -4.218 1.00 . B B . 8 ARG HB3 1 1 6 6557 2 2 8 ARG HD2 H -4.535 -5.395 -2.704 1.00 . B B . 8 ARG HD2 1 1 6 6558 2 2 8 ARG HD3 H -3.441 -6.777 -2.757 1.00 . B B . 8 ARG HD3 1 1 6 6559 2 2 8 ARG HE H -3.201 -5.426 -0.285 1.00 . B B . 8 ARG HE 1 1 6 6560 2 2 8 ARG HG2 H -1.622 -5.122 -2.038 1.00 . B B . 8 ARG HG2 1 1 6 6561 2 2 8 ARG HG3 H -2.776 -3.863 -2.492 1.00 . B B . 8 ARG HG3 1 1 6 6562 2 2 8 ARG HH11 H -5.341 -7.523 -2.062 1.00 . B B . 8 ARG HH11 1 1 6 6563 2 2 8 ARG HH12 H -6.031 -8.235 -0.642 1.00 . B B . 8 ARG HH12 1 1 6 6564 2 2 8 ARG HH21 H -4.099 -6.356 1.581 1.00 . B B . 8 ARG HH21 1 1 6 6565 2 2 8 ARG HH22 H -5.321 -7.573 1.434 1.00 . B B . 8 ARG HH22 1 1 6 6566 2 2 8 ARG N N -2.126 -2.786 -5.035 1.00 . B B . 8 ARG N 1 1 6 6567 2 2 8 ARG NE N -3.765 -5.978 -0.866 1.00 . B B . 8 ARG NE 1 1 6 6568 2 2 8 ARG NH1 N -5.391 -7.593 -1.066 1.00 . B B . 8 ARG NH1 1 1 6 6569 2 2 8 ARG NH2 N -4.684 -6.928 1.010 1.00 . B B . 8 ARG NH2 1 1 6 6570 2 2 8 ARG O O -0.813 -4.067 -7.017 1.00 . B B . 8 ARG O 1 1 6 6571 2 2 9 LYS C C 1.963 -6.958 -6.463 1.00 . B B . 9 LYS C 1 1 6 6572 2 2 9 LYS CA C 1.518 -5.519 -6.719 1.00 . B B . 9 LYS CA 1 1 6 6573 2 2 9 LYS CB C 2.740 -4.607 -6.875 1.00 . B B . 9 LYS CB 1 1 6 6574 2 2 9 LYS CD C 1.679 -2.818 -8.287 1.00 . B B . 9 LYS CD 1 1 6 6575 2 2 9 LYS CE C 1.309 -1.346 -8.380 1.00 . B B . 9 LYS CE 1 1 6 6576 2 2 9 LYS CG C 2.389 -3.132 -6.980 1.00 . B B . 9 LYS CG 1 1 6 6577 2 2 9 LYS H H 0.917 -5.236 -4.706 1.00 . B B . 9 LYS H 1 1 6 6578 2 2 9 LYS HA H 0.940 -5.490 -7.630 1.00 . B B . 9 LYS HA 1 1 6 6579 2 2 9 LYS HB2 H 3.391 -4.742 -6.024 1.00 . B B . 9 LYS HB2 1 1 6 6580 2 2 9 LYS HB3 H 3.273 -4.887 -7.771 1.00 . B B . 9 LYS HB3 1 1 6 6581 2 2 9 LYS HD2 H 2.334 -3.065 -9.110 1.00 . B B . 9 LYS HD2 1 1 6 6582 2 2 9 LYS HD3 H 0.780 -3.410 -8.351 1.00 . B B . 9 LYS HD3 1 1 6 6583 2 2 9 LYS HE2 H 0.794 -1.175 -9.314 1.00 . B B . 9 LYS HE2 1 1 6 6584 2 2 9 LYS HE3 H 0.654 -1.100 -7.557 1.00 . B B . 9 LYS HE3 1 1 6 6585 2 2 9 LYS HG2 H 1.741 -2.867 -6.158 1.00 . B B . 9 LYS HG2 1 1 6 6586 2 2 9 LYS HG3 H 3.298 -2.550 -6.925 1.00 . B B . 9 LYS HG3 1 1 6 6587 2 2 9 LYS HZ1 H 2.226 0.531 -8.376 1.00 . B B . 9 LYS HZ1 1 1 6 6588 2 2 9 LYS HZ2 H 3.148 -0.681 -9.115 1.00 . B B . 9 LYS HZ2 1 1 6 6589 2 2 9 LYS HZ3 H 3.022 -0.623 -7.429 1.00 . B B . 9 LYS HZ3 1 1 6 6590 2 2 9 LYS N N 0.668 -5.038 -5.633 1.00 . B B . 9 LYS N 1 1 6 6591 2 2 9 LYS NZ N 2.511 -0.468 -8.321 1.00 . B B . 9 LYS NZ 1 1 6 6592 2 2 9 LYS O O 1.375 -7.660 -5.641 1.00 . B B . 9 LYS O 1 1 6 6593 2 2 10 ARG C C 3.685 -9.120 -5.549 1.00 . B B . 10 ARG C 1 1 6 6594 2 2 10 ARG CA C 3.534 -8.746 -7.020 1.00 . B B . 10 ARG CA 1 1 6 6595 2 2 10 ARG CB C 4.891 -8.859 -7.713 1.00 . B B . 10 ARG CB 1 1 6 6596 2 2 10 ARG CD C 7.324 -8.226 -7.709 1.00 . B B . 10 ARG CD 1 1 6 6597 2 2 10 ARG CG C 5.956 -7.962 -7.100 1.00 . B B . 10 ARG CG 1 1 6 6598 2 2 10 ARG CZ C 9.560 -7.201 -7.627 1.00 . B B . 10 ARG CZ 1 1 6 6599 2 2 10 ARG H H 3.428 -6.788 -7.814 1.00 . B B . 10 ARG H 1 1 6 6600 2 2 10 ARG HA H 2.841 -9.429 -7.487 1.00 . B B . 10 ARG HA 1 1 6 6601 2 2 10 ARG HB2 H 5.231 -9.881 -7.651 1.00 . B B . 10 ARG HB2 1 1 6 6602 2 2 10 ARG HB3 H 4.775 -8.586 -8.751 1.00 . B B . 10 ARG HB3 1 1 6 6603 2 2 10 ARG HD2 H 7.562 -9.272 -7.585 1.00 . B B . 10 ARG HD2 1 1 6 6604 2 2 10 ARG HD3 H 7.286 -7.990 -8.762 1.00 . B B . 10 ARG HD3 1 1 6 6605 2 2 10 ARG HE H 8.175 -7.035 -6.201 1.00 . B B . 10 ARG HE 1 1 6 6606 2 2 10 ARG HG2 H 5.688 -6.931 -7.276 1.00 . B B . 10 ARG HG2 1 1 6 6607 2 2 10 ARG HG3 H 6.002 -8.147 -6.034 1.00 . B B . 10 ARG HG3 1 1 6 6608 2 2 10 ARG HH11 H 9.177 -8.263 -9.303 1.00 . B B . 10 ARG HH11 1 1 6 6609 2 2 10 ARG HH12 H 10.747 -7.538 -9.227 1.00 . B B . 10 ARG HH12 1 1 6 6610 2 2 10 ARG HH21 H 10.241 -6.078 -6.090 1.00 . B B . 10 ARG HH21 1 1 6 6611 2 2 10 ARG HH22 H 11.354 -6.297 -7.400 1.00 . B B . 10 ARG HH22 1 1 6 6612 2 2 10 ARG N N 3.005 -7.391 -7.171 1.00 . B B . 10 ARG N 1 1 6 6613 2 2 10 ARG NE N 8.369 -7.424 -7.078 1.00 . B B . 10 ARG NE 1 1 6 6614 2 2 10 ARG NH1 N 9.852 -7.709 -8.816 1.00 . B B . 10 ARG NH1 1 1 6 6615 2 2 10 ARG NH2 N 10.459 -6.465 -6.987 1.00 . B B . 10 ARG NH2 1 1 6 6616 2 2 10 ARG O O 3.644 -10.297 -5.191 1.00 . B B . 10 ARG O 1 1 6 6617 2 2 11 LYS C C 5.461 -8.734 -2.953 1.00 . B B . 11 LYS C 1 1 6 6618 2 2 11 LYS CA C 4.039 -8.301 -3.270 1.00 . B B . 11 LYS CA 1 1 6 6619 2 2 11 LYS CB C 3.045 -9.325 -2.719 1.00 . B B . 11 LYS CB 1 1 6 6620 2 2 11 LYS CD C 2.806 -5.910 0.384 1.00 . B B . 11 LYS CD 1 1 6 6621 2 2 11 LYS CE C 4.073 -5.722 1.204 1.00 . B B . 11 LYS CE 1 1 6 6622 2 2 11 LYS CG C 1.692 -6.524 1.211 1.00 . B B . 11 LYS CG 1 1 6 6623 2 2 11 LYS H H 3.912 -7.195 -5.065 1.00 . B B . 11 LYS H 1 1 6 6624 2 2 11 LYS HA H 3.858 -7.349 -2.791 1.00 . B B . 11 LYS HA 1 1 6 6625 2 2 11 LYS HB2 H 3.091 -9.305 -1.640 1.00 . B B . 11 LYS HB2 1 1 6 6626 2 2 11 LYS HB3 H 3.326 -10.309 -3.061 1.00 . B B . 11 LYS HB3 1 1 6 6627 2 2 11 LYS HD2 H 3.022 -6.567 -0.444 1.00 . B B . 11 LYS HD2 1 1 6 6628 2 2 11 LYS HD3 H 2.481 -4.950 0.013 1.00 . B B . 11 LYS HD3 1 1 6 6629 2 2 11 LYS HE2 H 4.352 -6.673 1.634 1.00 . B B . 11 LYS HE2 1 1 6 6630 2 2 11 LYS HE3 H 3.874 -5.014 1.994 1.00 . B B . 11 LYS HE3 1 1 6 6631 2 2 11 LYS HG2 H 0.808 -6.613 0.597 1.00 . B B . 11 LYS HG2 1 1 6 6632 2 2 11 LYS HG3 H 1.485 -5.883 2.055 1.00 . B B . 11 LYS HG3 1 1 6 6633 2 2 11 LYS HZ1 H 0.169 -11.739 -0.383 1.00 . B B . 11 LYS HZ1 1 1 6 6634 2 2 11 LYS HZ2 H 0.129 -13.065 -1.431 1.00 . B B . 11 LYS HZ2 1 1 6 6635 2 2 11 LYS HZ3 H -1.035 -11.845 -1.567 1.00 . B B . 11 LYS HZ3 1 1 6 6636 2 2 11 LYS N N 3.872 -8.106 -4.707 1.00 . B B . 11 LYS N 1 1 6 6637 2 2 11 LYS NZ N -0.035 -12.041 -1.357 1.00 . B B . 11 LYS NZ 1 1 6 6638 2 2 11 LYS O O 5.812 -9.907 -3.083 1.00 . B B . 11 LYS O 1 1 6 6639 2 2 12 ALA C C 7.824 -8.242 -0.698 1.00 . B B . 12 ALA C 1 1 6 6640 2 2 12 ALA CA C 7.663 -8.042 -2.196 1.00 . B B . 12 ALA CA 1 1 6 6641 2 2 12 ALA CB C 8.547 -6.901 -2.666 1.00 . B B . 12 ALA CB 1 1 6 6642 2 2 12 ALA H H 5.925 -6.865 -2.444 1.00 . B B . 12 ALA H 1 1 6 6643 2 2 12 ALA HA H 7.966 -8.941 -2.711 1.00 . B B . 12 ALA HA 1 1 6 6644 2 2 12 ALA HB1 H 8.205 -6.550 -3.628 1.00 . B B . 12 ALA HB1 1 1 6 6645 2 2 12 ALA HB2 H 9.566 -7.245 -2.747 1.00 . B B . 12 ALA HB2 1 1 6 6646 2 2 12 ALA HB3 H 8.495 -6.095 -1.948 1.00 . B B . 12 ALA HB3 1 1 6 6647 2 2 12 ALA N N 6.273 -7.776 -2.534 1.00 . B B . 12 ALA N 1 1 6 6648 2 2 12 ALA O O 8.881 -7.957 -0.134 1.00 . B B . 12 ALA O 1 1 6 6649 2 2 13 ASP C C 6.851 -10.456 1.684 1.00 . B B . 13 ASP C 1 1 6 6650 2 2 13 ASP CA C 6.798 -8.967 1.380 1.00 . B B . 13 ASP CA 1 1 6 6651 2 2 13 ASP CB C 5.569 -8.341 2.042 1.00 . B B . 13 ASP CB 1 1 6 6652 2 2 13 ASP CG C 4.271 -8.914 1.507 1.00 . B B . 13 ASP CG 1 1 6 6653 2 2 13 ASP H H 5.963 -8.958 -0.564 1.00 . B B . 13 ASP H 1 1 6 6654 2 2 13 ASP HA H 7.687 -8.500 1.774 1.00 . B B . 13 ASP HA 1 1 6 6655 2 2 13 ASP HB2 H 5.609 -8.523 3.104 1.00 . B B . 13 ASP HB2 1 1 6 6656 2 2 13 ASP HB3 H 5.573 -7.277 1.860 1.00 . B B . 13 ASP HB3 1 1 6 6657 2 2 13 ASP N N 6.774 -8.739 -0.058 1.00 . B B . 13 ASP N 1 1 6 6658 2 2 13 ASP O O 6.129 -10.955 2.548 1.00 . B B . 13 ASP O 1 1 6 6659 2 2 13 ASP OD1 O 3.792 -8.427 0.462 1.00 . B B . 13 ASP OD1 1 1 6 6660 2 2 13 ASP OD2 O 3.733 -9.852 2.134 1.00 . B B . 13 ASP OD2 1 1 6 6661 2 2 14 SER C C 6.611 -13.344 0.766 1.00 . B B . 14 SER C 1 1 6 6662 2 2 14 SER CA C 7.882 -12.589 1.147 1.00 . B B . 14 SER CA 1 1 6 6663 2 2 14 SER CB C 8.260 -12.895 2.597 1.00 . B B . 14 SER CB 1 1 6 6664 2 2 14 SER H H 8.255 -10.697 0.287 1.00 . B B . 14 SER H 1 1 6 6665 2 2 14 SER HA H 8.683 -12.907 0.500 1.00 . B B . 14 SER HA 1 1 6 6666 2 2 14 SER HB2 H 9.197 -12.413 2.832 1.00 . B B . 14 SER HB2 1 1 6 6667 2 2 14 SER HB3 H 7.489 -12.521 3.254 1.00 . B B . 14 SER HB3 1 1 6 6668 2 2 14 SER HG H 9.316 -14.492 3.006 1.00 . B B . 14 SER HG 1 1 6 6669 2 2 14 SER N N 7.714 -11.157 0.963 1.00 . B B . 14 SER N 1 1 6 6670 2 2 14 SER O O 5.756 -13.547 1.655 1.00 . B B . 14 SER O 1 1 6 6671 2 2 14 SER OXT O 6.482 -13.724 -0.415 1.00 . B B . 14 SER OXT 1 1 6 6672 2 2 14 SER OG O 8.399 -14.289 2.805 1.00 . B B . 14 SER OG 1 1 7 6673 1 1 1 GLY C C 11.417 4.863 -5.752 1.00 . A A . 1 GLY C 1 1 7 6674 1 1 1 GLY CA C 10.858 3.671 -6.506 1.00 . A A . 1 GLY CA 1 1 7 6675 1 1 1 GLY H1 H 9.097 3.382 -5.418 1.00 . A A . 1 GLY H1 1 1 7 6676 1 1 1 GLY H2 H 9.027 2.796 -7.003 1.00 . A A . 1 GLY H2 1 1 7 6677 1 1 1 GLY H3 H 8.933 4.460 -6.713 1.00 . A A . 1 GLY H3 1 1 7 6678 1 1 1 GLY HA2 H 11.298 2.768 -6.111 1.00 . A A . 1 GLY HA2 1 1 7 6679 1 1 1 GLY HA3 H 11.127 3.762 -7.548 1.00 . A A . 1 GLY HA3 1 1 7 6680 1 1 1 GLY N N 9.375 3.570 -6.403 1.00 . A A . 1 GLY N 1 1 7 6681 1 1 1 GLY O O 12.392 5.474 -6.189 1.00 . A A . 1 GLY O 1 1 7 6682 1 1 2 SER C C 10.328 6.560 -2.614 1.00 . A A . 2 SER C 1 1 7 6683 1 1 2 SER CA C 11.256 6.321 -3.801 1.00 . A A . 2 SER CA 1 1 7 6684 1 1 2 SER CB C 11.338 7.585 -4.656 1.00 . A A . 2 SER CB 1 1 7 6685 1 1 2 SER H H 10.044 4.656 -4.308 1.00 . A A . 2 SER H 1 1 7 6686 1 1 2 SER HA H 12.241 6.090 -3.425 1.00 . A A . 2 SER HA 1 1 7 6687 1 1 2 SER HB2 H 12.128 7.472 -5.382 1.00 . A A . 2 SER HB2 1 1 7 6688 1 1 2 SER HB3 H 10.398 7.732 -5.165 1.00 . A A . 2 SER HB3 1 1 7 6689 1 1 2 SER HG H 10.863 9.324 -3.892 1.00 . A A . 2 SER HG 1 1 7 6690 1 1 2 SER N N 10.808 5.190 -4.612 1.00 . A A . 2 SER N 1 1 7 6691 1 1 2 SER O O 10.765 7.016 -1.558 1.00 . A A . 2 SER O 1 1 7 6692 1 1 2 SER OG O 11.611 8.723 -3.859 1.00 . A A . 2 SER OG 1 1 7 6693 1 1 3 GLN C C 7.996 5.174 -0.873 1.00 . A A . 3 GLN C 1 1 7 6694 1 1 3 GLN CA C 8.071 6.430 -1.727 1.00 . A A . 3 GLN CA 1 1 7 6695 1 1 3 GLN CB C 6.703 6.752 -2.313 1.00 . A A . 3 GLN CB 1 1 7 6696 1 1 3 GLN CD C 6.941 9.261 -2.168 1.00 . A A . 3 GLN CD 1 1 7 6697 1 1 3 GLN CG C 6.655 8.072 -3.063 1.00 . A A . 3 GLN CG 1 1 7 6698 1 1 3 GLN H H 8.749 5.908 -3.656 1.00 . A A . 3 GLN H 1 1 7 6699 1 1 3 GLN HA H 8.389 7.250 -1.116 1.00 . A A . 3 GLN HA 1 1 7 6700 1 1 3 GLN HB2 H 6.437 5.968 -2.994 1.00 . A A . 3 GLN HB2 1 1 7 6701 1 1 3 GLN HB3 H 5.977 6.788 -1.514 1.00 . A A . 3 GLN HB3 1 1 7 6702 1 1 3 GLN HE21 H 8.887 9.106 -2.542 1.00 . A A . 3 GLN HE21 1 1 7 6703 1 1 3 GLN HE22 H 8.428 10.386 -1.477 1.00 . A A . 3 GLN HE22 1 1 7 6704 1 1 3 GLN HG2 H 7.392 8.051 -3.852 1.00 . A A . 3 GLN HG2 1 1 7 6705 1 1 3 GLN HG3 H 5.672 8.192 -3.494 1.00 . A A . 3 GLN HG3 1 1 7 6706 1 1 3 GLN N N 9.047 6.254 -2.791 1.00 . A A . 3 GLN N 1 1 7 6707 1 1 3 GLN NE2 N 8.214 9.621 -2.050 1.00 . A A . 3 GLN NE2 1 1 7 6708 1 1 3 GLN O O 7.989 4.060 -1.394 1.00 . A A . 3 GLN O 1 1 7 6709 1 1 3 GLN OE1 O 6.029 9.850 -1.587 1.00 . A A . 3 GLN OE1 1 1 7 6710 1 1 4 VAL C C 6.446 3.857 1.662 1.00 . A A . 4 VAL C 1 1 7 6711 1 1 4 VAL CA C 7.887 4.227 1.353 1.00 . A A . 4 VAL CA 1 1 7 6712 1 1 4 VAL CB C 8.629 4.527 2.673 1.00 . A A . 4 VAL CB 1 1 7 6713 1 1 4 VAL CG1 C 9.033 3.233 3.363 1.00 . A A . 4 VAL CG1 1 1 7 6714 1 1 4 VAL CG2 C 9.846 5.407 2.423 1.00 . A A . 4 VAL CG2 1 1 7 6715 1 1 4 VAL H H 7.917 6.262 0.799 1.00 . A A . 4 VAL H 1 1 7 6716 1 1 4 VAL HA H 8.370 3.386 0.875 1.00 . A A . 4 VAL HA 1 1 7 6717 1 1 4 VAL HB H 7.956 5.058 3.326 1.00 . A A . 4 VAL HB 1 1 7 6718 1 1 4 VAL HG11 H 8.177 2.583 3.439 1.00 . A A . 4 VAL HG11 1 1 7 6719 1 1 4 VAL HG12 H 9.408 3.454 4.351 1.00 . A A . 4 VAL HG12 1 1 7 6720 1 1 4 VAL HG13 H 9.806 2.745 2.787 1.00 . A A . 4 VAL HG13 1 1 7 6721 1 1 4 VAL HG21 H 9.524 6.382 2.089 1.00 . A A . 4 VAL HG21 1 1 7 6722 1 1 4 VAL HG22 H 10.467 4.953 1.665 1.00 . A A . 4 VAL HG22 1 1 7 6723 1 1 4 VAL HG23 H 10.412 5.509 3.337 1.00 . A A . 4 VAL HG23 1 1 7 6724 1 1 4 VAL N N 7.940 5.354 0.438 1.00 . A A . 4 VAL N 1 1 7 6725 1 1 4 VAL O O 6.069 3.700 2.822 1.00 . A A . 4 VAL O 1 1 7 6726 1 1 5 PHE C C 3.514 3.320 -0.562 1.00 . A A . 5 PHE C 1 1 7 6727 1 1 5 PHE CA C 4.237 3.371 0.784 1.00 . A A . 5 PHE CA 1 1 7 6728 1 1 5 PHE CB C 3.555 4.386 1.695 1.00 . A A . 5 PHE CB 1 1 7 6729 1 1 5 PHE CD1 C 3.191 6.294 0.108 1.00 . A A . 5 PHE CD1 1 1 7 6730 1 1 5 PHE CD2 C 4.555 6.661 2.030 1.00 . A A . 5 PHE CD2 1 1 7 6731 1 1 5 PHE CE1 C 3.391 7.604 -0.287 1.00 . A A . 5 PHE CE1 1 1 7 6732 1 1 5 PHE CE2 C 4.758 7.971 1.640 1.00 . A A . 5 PHE CE2 1 1 7 6733 1 1 5 PHE CG C 3.770 5.810 1.270 1.00 . A A . 5 PHE CG 1 1 7 6734 1 1 5 PHE CZ C 4.175 8.443 0.480 1.00 . A A . 5 PHE CZ 1 1 7 6735 1 1 5 PHE H H 5.990 3.878 -0.286 1.00 . A A . 5 PHE H 1 1 7 6736 1 1 5 PHE HA H 4.197 2.390 1.253 1.00 . A A . 5 PHE HA 1 1 7 6737 1 1 5 PHE HB2 H 2.496 4.197 1.702 1.00 . A A . 5 PHE HB2 1 1 7 6738 1 1 5 PHE HB3 H 3.942 4.278 2.695 1.00 . A A . 5 PHE HB3 1 1 7 6739 1 1 5 PHE HD1 H 2.578 5.639 -0.492 1.00 . A A . 5 PHE HD1 1 1 7 6740 1 1 5 PHE HD2 H 5.011 6.293 2.937 1.00 . A A . 5 PHE HD2 1 1 7 6741 1 1 5 PHE HE1 H 2.934 7.970 -1.195 1.00 . A A . 5 PHE HE1 1 1 7 6742 1 1 5 PHE HE2 H 5.373 8.624 2.242 1.00 . A A . 5 PHE HE2 1 1 7 6743 1 1 5 PHE HZ H 4.334 9.465 0.173 1.00 . A A . 5 PHE HZ 1 1 7 6744 1 1 5 PHE N N 5.637 3.729 0.616 1.00 . A A . 5 PHE N 1 1 7 6745 1 1 5 PHE O O 3.847 4.064 -1.484 1.00 . A A . 5 PHE O 1 1 7 6746 1 1 6 GLU C C 0.250 2.312 -1.574 1.00 . A A . 6 GLU C 1 1 7 6747 1 1 6 GLU CA C 1.741 2.301 -1.891 1.00 . A A . 6 GLU CA 1 1 7 6748 1 1 6 GLU CB C 2.105 1.010 -2.619 1.00 . A A . 6 GLU CB 1 1 7 6749 1 1 6 GLU CD C 1.513 1.843 -4.926 1.00 . A A . 6 GLU CD 1 1 7 6750 1 1 6 GLU CG C 1.281 0.777 -3.873 1.00 . A A . 6 GLU CG 1 1 7 6751 1 1 6 GLU H H 2.314 1.866 0.100 1.00 . A A . 6 GLU H 1 1 7 6752 1 1 6 GLU HA H 1.970 3.142 -2.527 1.00 . A A . 6 GLU HA 1 1 7 6753 1 1 6 GLU HB2 H 3.147 1.047 -2.899 1.00 . A A . 6 GLU HB2 1 1 7 6754 1 1 6 GLU HB3 H 1.948 0.175 -1.951 1.00 . A A . 6 GLU HB3 1 1 7 6755 1 1 6 GLU HG2 H 1.542 -0.182 -4.288 1.00 . A A . 6 GLU HG2 1 1 7 6756 1 1 6 GLU HG3 H 0.234 0.780 -3.605 1.00 . A A . 6 GLU HG3 1 1 7 6757 1 1 6 GLU N N 2.523 2.439 -0.665 1.00 . A A . 6 GLU N 1 1 7 6758 1 1 6 GLU O O -0.180 1.756 -0.566 1.00 . A A . 6 GLU O 1 1 7 6759 1 1 6 GLU OE1 O 0.803 2.870 -4.900 1.00 . A A . 6 GLU OE1 1 1 7 6760 1 1 6 GLU OE2 O 2.409 1.652 -5.776 1.00 . A A . 6 GLU OE2 1 1 7 6761 1 1 7 TYR C C -2.720 1.817 -2.795 1.00 . A A . 7 TYR C 1 1 7 6762 1 1 7 TYR CA C -1.969 3.008 -2.219 1.00 . A A . 7 TYR CA 1 1 7 6763 1 1 7 TYR CB C -2.511 4.310 -2.801 1.00 . A A . 7 TYR CB 1 1 7 6764 1 1 7 TYR CD1 C -1.175 4.860 -4.870 1.00 . A A . 7 TYR CD1 1 1 7 6765 1 1 7 TYR CD2 C -3.418 4.107 -5.146 1.00 . A A . 7 TYR CD2 1 1 7 6766 1 1 7 TYR CE1 C -1.039 4.974 -6.241 1.00 . A A . 7 TYR CE1 1 1 7 6767 1 1 7 TYR CE2 C -3.292 4.218 -6.518 1.00 . A A . 7 TYR CE2 1 1 7 6768 1 1 7 TYR CG C -2.364 4.425 -4.301 1.00 . A A . 7 TYR CG 1 1 7 6769 1 1 7 TYR CZ C -2.101 4.652 -7.060 1.00 . A A . 7 TYR CZ 1 1 7 6770 1 1 7 TYR H H -0.165 3.334 -3.245 1.00 . A A . 7 TYR H 1 1 7 6771 1 1 7 TYR HA H -2.124 3.016 -1.157 1.00 . A A . 7 TYR HA 1 1 7 6772 1 1 7 TYR HB2 H -3.554 4.385 -2.567 1.00 . A A . 7 TYR HB2 1 1 7 6773 1 1 7 TYR HB3 H -1.987 5.140 -2.351 1.00 . A A . 7 TYR HB3 1 1 7 6774 1 1 7 TYR HD1 H -0.344 5.111 -4.227 1.00 . A A . 7 TYR HD1 1 1 7 6775 1 1 7 TYR HD2 H -4.350 3.766 -4.720 1.00 . A A . 7 TYR HD2 1 1 7 6776 1 1 7 TYR HE1 H -0.106 5.313 -6.666 1.00 . A A . 7 TYR HE1 1 1 7 6777 1 1 7 TYR HE2 H -4.123 3.966 -7.159 1.00 . A A . 7 TYR HE2 1 1 7 6778 1 1 7 TYR HH H -2.755 5.192 -8.785 1.00 . A A . 7 TYR HH 1 1 7 6779 1 1 7 TYR N N -0.543 2.923 -2.445 1.00 . A A . 7 TYR N 1 1 7 6780 1 1 7 TYR O O -2.871 1.682 -4.011 1.00 . A A . 7 TYR O 1 1 7 6781 1 1 7 TYR OH O -1.972 4.768 -8.425 1.00 . A A . 7 TYR OH 1 1 7 6782 1 1 8 ALA C C -5.434 0.136 -2.310 1.00 . A A . 8 ALA C 1 1 7 6783 1 1 8 ALA CA C -3.955 -0.223 -2.284 1.00 . A A . 8 ALA CA 1 1 7 6784 1 1 8 ALA CB C -3.696 -1.357 -1.300 1.00 . A A . 8 ALA CB 1 1 7 6785 1 1 8 ALA H H -3.011 1.116 -0.943 1.00 . A A . 8 ALA H 1 1 7 6786 1 1 8 ALA HA H -3.639 -0.535 -3.268 1.00 . A A . 8 ALA HA 1 1 7 6787 1 1 8 ALA HB1 H -2.669 -1.679 -1.380 1.00 . A A . 8 ALA HB1 1 1 7 6788 1 1 8 ALA HB2 H -4.352 -2.186 -1.523 1.00 . A A . 8 ALA HB2 1 1 7 6789 1 1 8 ALA HB3 H -3.885 -1.012 -0.292 1.00 . A A . 8 ALA HB3 1 1 7 6790 1 1 8 ALA N N -3.187 0.953 -1.898 1.00 . A A . 8 ALA N 1 1 7 6791 1 1 8 ALA O O -6.260 -0.528 -1.685 1.00 . A A . 8 ALA O 1 1 7 6792 1 1 9 GLU C C -7.743 1.511 -4.480 1.00 . A A . 9 GLU C 1 1 7 6793 1 1 9 GLU CA C -7.114 1.696 -3.120 1.00 . A A . 9 GLU CA 1 1 7 6794 1 1 9 GLU CB C -7.086 3.164 -2.685 1.00 . A A . 9 GLU CB 1 1 7 6795 1 1 9 GLU CD C -7.302 4.340 -4.920 1.00 . A A . 9 GLU CD 1 1 7 6796 1 1 9 GLU CG C -7.879 4.149 -3.530 1.00 . A A . 9 GLU CG 1 1 7 6797 1 1 9 GLU H H -5.061 1.670 -3.538 1.00 . A A . 9 GLU H 1 1 7 6798 1 1 9 GLU HA H -7.709 1.148 -2.425 1.00 . A A . 9 GLU HA 1 1 7 6799 1 1 9 GLU HB2 H -7.467 3.223 -1.678 1.00 . A A . 9 GLU HB2 1 1 7 6800 1 1 9 GLU HB3 H -6.057 3.491 -2.678 1.00 . A A . 9 GLU HB3 1 1 7 6801 1 1 9 GLU HG2 H -8.882 3.787 -3.616 1.00 . A A . 9 GLU HG2 1 1 7 6802 1 1 9 GLU HG3 H -7.885 5.100 -3.029 1.00 . A A . 9 GLU HG3 1 1 7 6803 1 1 9 GLU N N -5.758 1.198 -3.044 1.00 . A A . 9 GLU N 1 1 7 6804 1 1 9 GLU O O -7.073 1.463 -5.511 1.00 . A A . 9 GLU O 1 1 7 6805 1 1 9 GLU OE1 O -6.279 5.044 -5.047 1.00 . A A . 9 GLU OE1 1 1 7 6806 1 1 9 GLU OE2 O -7.873 3.784 -5.883 1.00 . A A . 9 GLU OE2 1 1 7 6807 1 1 10 VAL C C -10.246 2.595 -6.194 1.00 . A A . 10 VAL C 1 1 7 6808 1 1 10 VAL CA C -9.840 1.241 -5.631 1.00 . A A . 10 VAL CA 1 1 7 6809 1 1 10 VAL CB C -11.060 0.366 -5.361 1.00 . A A . 10 VAL CB 1 1 7 6810 1 1 10 VAL CG1 C -11.867 0.166 -6.636 1.00 . A A . 10 VAL CG1 1 1 7 6811 1 1 10 VAL CG2 C -10.614 -0.969 -4.775 1.00 . A A . 10 VAL CG2 1 1 7 6812 1 1 10 VAL H H -9.512 1.423 -3.574 1.00 . A A . 10 VAL H 1 1 7 6813 1 1 10 VAL HA H -9.235 0.748 -6.337 1.00 . A A . 10 VAL HA 1 1 7 6814 1 1 10 VAL HB H -11.667 0.862 -4.636 1.00 . A A . 10 VAL HB 1 1 7 6815 1 1 10 VAL HG11 H -11.609 -0.784 -7.080 1.00 . A A . 10 VAL HG11 1 1 7 6816 1 1 10 VAL HG12 H -11.638 0.959 -7.333 1.00 . A A . 10 VAL HG12 1 1 7 6817 1 1 10 VAL HG13 H -12.920 0.183 -6.407 1.00 . A A . 10 VAL HG13 1 1 7 6818 1 1 10 VAL HG21 H -10.302 -0.824 -3.749 1.00 . A A . 10 VAL HG21 1 1 7 6819 1 1 10 VAL HG22 H -9.786 -1.354 -5.351 1.00 . A A . 10 VAL HG22 1 1 7 6820 1 1 10 VAL HG23 H -11.430 -1.672 -4.807 1.00 . A A . 10 VAL HG23 1 1 7 6821 1 1 10 VAL N N -9.058 1.404 -4.442 1.00 . A A . 10 VAL N 1 1 7 6822 1 1 10 VAL O O -10.342 2.772 -7.407 1.00 . A A . 10 VAL O 1 1 7 6823 1 1 11 ASP C C -10.220 5.963 -4.796 1.00 . A A . 11 ASP C 1 1 7 6824 1 1 11 ASP CA C -10.839 4.900 -5.710 1.00 . A A . 11 ASP CA 1 1 7 6825 1 1 11 ASP CB C -12.356 5.075 -5.725 1.00 . A A . 11 ASP CB 1 1 7 6826 1 1 11 ASP CG C -12.783 6.377 -6.376 1.00 . A A . 11 ASP CG 1 1 7 6827 1 1 11 ASP H H -10.476 3.320 -4.353 1.00 . A A . 11 ASP H 1 1 7 6828 1 1 11 ASP HA H -10.465 5.046 -6.711 1.00 . A A . 11 ASP HA 1 1 7 6829 1 1 11 ASP HB2 H -12.800 4.262 -6.270 1.00 . A A . 11 ASP HB2 1 1 7 6830 1 1 11 ASP HB3 H -12.723 5.066 -4.711 1.00 . A A . 11 ASP HB3 1 1 7 6831 1 1 11 ASP N N -10.488 3.546 -5.301 1.00 . A A . 11 ASP N 1 1 7 6832 1 1 11 ASP O O -9.780 7.008 -5.272 1.00 . A A . 11 ASP O 1 1 7 6833 1 1 11 ASP OD1 O -12.868 7.397 -5.662 1.00 . A A . 11 ASP OD1 1 1 7 6834 1 1 11 ASP OD2 O -13.029 6.374 -7.600 1.00 . A A . 11 ASP OD2 1 1 7 6835 1 1 12 GLU C C -9.129 6.061 -1.249 1.00 . A A . 12 GLU C 1 1 7 6836 1 1 12 GLU CA C -9.656 6.694 -2.534 1.00 . A A . 12 GLU CA 1 1 7 6837 1 1 12 GLU CB C -10.742 7.712 -2.192 1.00 . A A . 12 GLU CB 1 1 7 6838 1 1 12 GLU CD C -9.862 9.567 -3.666 1.00 . A A . 12 GLU CD 1 1 7 6839 1 1 12 GLU CG C -11.046 8.685 -3.319 1.00 . A A . 12 GLU CG 1 1 7 6840 1 1 12 GLU H H -10.432 4.802 -3.170 1.00 . A A . 12 GLU H 1 1 7 6841 1 1 12 GLU HA H -8.840 7.210 -3.018 1.00 . A A . 12 GLU HA 1 1 7 6842 1 1 12 GLU HB2 H -11.651 7.181 -1.949 1.00 . A A . 12 GLU HB2 1 1 7 6843 1 1 12 GLU HB3 H -10.425 8.279 -1.330 1.00 . A A . 12 GLU HB3 1 1 7 6844 1 1 12 GLU HG2 H -11.326 8.123 -4.197 1.00 . A A . 12 GLU HG2 1 1 7 6845 1 1 12 GLU HG3 H -11.870 9.315 -3.019 1.00 . A A . 12 GLU HG3 1 1 7 6846 1 1 12 GLU N N -10.180 5.700 -3.488 1.00 . A A . 12 GLU N 1 1 7 6847 1 1 12 GLU O O -9.554 4.983 -0.867 1.00 . A A . 12 GLU O 1 1 7 6848 1 1 12 GLU OE1 O -9.630 10.562 -2.948 1.00 . A A . 12 GLU OE1 1 1 7 6849 1 1 12 GLU OE2 O -9.164 9.261 -4.656 1.00 . A A . 12 GLU OE2 1 1 7 6850 1 1 13 ILE C C -7.724 7.323 1.778 1.00 . A A . 13 ILE C 1 1 7 6851 1 1 13 ILE CA C -7.640 6.259 0.680 1.00 . A A . 13 ILE CA 1 1 7 6852 1 1 13 ILE CB C -6.156 5.838 0.487 1.00 . A A . 13 ILE CB 1 1 7 6853 1 1 13 ILE CD1 C -5.522 7.852 -0.926 1.00 . A A . 13 ILE CD1 1 1 7 6854 1 1 13 ILE CG1 C -5.251 7.065 0.339 1.00 . A A . 13 ILE CG1 1 1 7 6855 1 1 13 ILE CG2 C -6.030 4.972 -0.744 1.00 . A A . 13 ILE CG2 1 1 7 6856 1 1 13 ILE H H -7.940 7.633 -0.910 1.00 . A A . 13 ILE H 1 1 7 6857 1 1 13 ILE HA H -8.207 5.385 0.982 1.00 . A A . 13 ILE HA 1 1 7 6858 1 1 13 ILE HB H -5.836 5.246 1.344 1.00 . A A . 13 ILE HB 1 1 7 6859 1 1 13 ILE HD11 H -6.269 8.605 -0.727 1.00 . A A . 13 ILE HD11 1 1 7 6860 1 1 13 ILE HD12 H -5.881 7.183 -1.696 1.00 . A A . 13 ILE HD12 1 1 7 6861 1 1 13 ILE HD13 H -4.610 8.325 -1.256 1.00 . A A . 13 ILE HD13 1 1 7 6862 1 1 13 ILE HG12 H -5.406 7.726 1.180 1.00 . A A . 13 ILE HG12 1 1 7 6863 1 1 13 ILE HG13 H -4.220 6.751 0.320 1.00 . A A . 13 ILE HG13 1 1 7 6864 1 1 13 ILE HG21 H -6.901 5.106 -1.358 1.00 . A A . 13 ILE HG21 1 1 7 6865 1 1 13 ILE HG22 H -5.942 3.937 -0.455 1.00 . A A . 13 ILE HG22 1 1 7 6866 1 1 13 ILE HG23 H -5.153 5.266 -1.302 1.00 . A A . 13 ILE HG23 1 1 7 6867 1 1 13 ILE N N -8.221 6.760 -0.569 1.00 . A A . 13 ILE N 1 1 7 6868 1 1 13 ILE O O -8.400 8.340 1.622 1.00 . A A . 13 ILE O 1 1 7 6869 1 1 14 VAL C C -5.684 7.876 4.760 1.00 . A A . 14 VAL C 1 1 7 6870 1 1 14 VAL CA C -7.003 8.007 4.005 1.00 . A A . 14 VAL CA 1 1 7 6871 1 1 14 VAL CB C -8.187 7.781 4.968 1.00 . A A . 14 VAL CB 1 1 7 6872 1 1 14 VAL CG1 C -8.070 8.672 6.198 1.00 . A A . 14 VAL CG1 1 1 7 6873 1 1 14 VAL CG2 C -9.504 8.033 4.249 1.00 . A A . 14 VAL CG2 1 1 7 6874 1 1 14 VAL H H -6.526 6.238 2.951 1.00 . A A . 14 VAL H 1 1 7 6875 1 1 14 VAL HA H -7.075 9.007 3.605 1.00 . A A . 14 VAL HA 1 1 7 6876 1 1 14 VAL HB H -8.171 6.751 5.293 1.00 . A A . 14 VAL HB 1 1 7 6877 1 1 14 VAL HG11 H -7.183 8.402 6.753 1.00 . A A . 14 VAL HG11 1 1 7 6878 1 1 14 VAL HG12 H -8.940 8.541 6.823 1.00 . A A . 14 VAL HG12 1 1 7 6879 1 1 14 VAL HG13 H -8.000 9.705 5.888 1.00 . A A . 14 VAL HG13 1 1 7 6880 1 1 14 VAL HG21 H -10.324 7.863 4.931 1.00 . A A . 14 VAL HG21 1 1 7 6881 1 1 14 VAL HG22 H -9.591 7.362 3.407 1.00 . A A . 14 VAL HG22 1 1 7 6882 1 1 14 VAL HG23 H -9.534 9.055 3.900 1.00 . A A . 14 VAL HG23 1 1 7 6883 1 1 14 VAL N N -7.033 7.074 2.885 1.00 . A A . 14 VAL N 1 1 7 6884 1 1 14 VAL O O -4.955 8.851 4.940 1.00 . A A . 14 VAL O 1 1 7 6885 1 1 15 GLU C C -3.075 5.943 4.925 1.00 . A A . 15 GLU C 1 1 7 6886 1 1 15 GLU CA C -4.150 6.379 5.913 1.00 . A A . 15 GLU CA 1 1 7 6887 1 1 15 GLU CB C -4.377 5.284 6.959 1.00 . A A . 15 GLU CB 1 1 7 6888 1 1 15 GLU CD C -5.728 4.492 8.939 1.00 . A A . 15 GLU CD 1 1 7 6889 1 1 15 GLU CG C -5.432 5.639 7.994 1.00 . A A . 15 GLU CG 1 1 7 6890 1 1 15 GLU H H -6.025 5.929 5.031 1.00 . A A . 15 GLU H 1 1 7 6891 1 1 15 GLU HA H -3.833 7.286 6.406 1.00 . A A . 15 GLU HA 1 1 7 6892 1 1 15 GLU HB2 H -4.688 4.381 6.456 1.00 . A A . 15 GLU HB2 1 1 7 6893 1 1 15 GLU HB3 H -3.446 5.097 7.474 1.00 . A A . 15 GLU HB3 1 1 7 6894 1 1 15 GLU HG2 H -5.082 6.480 8.574 1.00 . A A . 15 GLU HG2 1 1 7 6895 1 1 15 GLU HG3 H -6.344 5.911 7.483 1.00 . A A . 15 GLU HG3 1 1 7 6896 1 1 15 GLU N N -5.390 6.659 5.196 1.00 . A A . 15 GLU N 1 1 7 6897 1 1 15 GLU O O -3.357 5.213 3.985 1.00 . A A . 15 GLU O 1 1 7 6898 1 1 15 GLU OE1 O -5.012 4.358 9.954 1.00 . A A . 15 GLU OE1 1 1 7 6899 1 1 15 GLU OE2 O -6.678 3.729 8.666 1.00 . A A . 15 GLU OE2 1 1 7 6900 1 1 16 LYS C C 0.606 6.079 4.878 1.00 . A A . 16 LYS C 1 1 7 6901 1 1 16 LYS CA C -0.768 6.046 4.197 1.00 . A A . 16 LYS CA 1 1 7 6902 1 1 16 LYS CB C -0.766 6.996 3.003 1.00 . A A . 16 LYS CB 1 1 7 6903 1 1 16 LYS CD C -0.912 9.359 2.163 1.00 . A A . 16 LYS CD 1 1 7 6904 1 1 16 LYS CE C -1.165 10.809 2.538 1.00 . A A . 16 LYS CE 1 1 7 6905 1 1 16 LYS CG C -0.918 8.458 3.387 1.00 . A A . 16 LYS CG 1 1 7 6906 1 1 16 LYS H H -1.670 7.012 5.860 1.00 . A A . 16 LYS H 1 1 7 6907 1 1 16 LYS HA H -0.970 5.038 3.843 1.00 . A A . 16 LYS HA 1 1 7 6908 1 1 16 LYS HB2 H 0.167 6.882 2.473 1.00 . A A . 16 LYS HB2 1 1 7 6909 1 1 16 LYS HB3 H -1.579 6.731 2.345 1.00 . A A . 16 LYS HB3 1 1 7 6910 1 1 16 LYS HD2 H 0.050 9.286 1.678 1.00 . A A . 16 LYS HD2 1 1 7 6911 1 1 16 LYS HD3 H -1.685 9.031 1.483 1.00 . A A . 16 LYS HD3 1 1 7 6912 1 1 16 LYS HE2 H -0.407 11.124 3.240 1.00 . A A . 16 LYS HE2 1 1 7 6913 1 1 16 LYS HE3 H -1.102 11.415 1.646 1.00 . A A . 16 LYS HE3 1 1 7 6914 1 1 16 LYS HG2 H -1.852 8.587 3.912 1.00 . A A . 16 LYS HG2 1 1 7 6915 1 1 16 LYS HG3 H -0.098 8.737 4.032 1.00 . A A . 16 LYS HG3 1 1 7 6916 1 1 16 LYS HZ1 H -2.654 11.997 3.397 1.00 . A A . 16 LYS HZ1 1 1 7 6917 1 1 16 LYS HZ2 H -2.581 10.428 4.026 1.00 . A A . 16 LYS HZ2 1 1 7 6918 1 1 16 LYS HZ3 H -3.251 10.696 2.496 1.00 . A A . 16 LYS HZ3 1 1 7 6919 1 1 16 LYS N N -1.849 6.413 5.109 1.00 . A A . 16 LYS N 1 1 7 6920 1 1 16 LYS NZ N -2.507 10.996 3.158 1.00 . A A . 16 LYS NZ 1 1 7 6921 1 1 16 LYS O O 1.280 7.110 4.861 1.00 . A A . 16 LYS O 1 1 7 6922 1 1 17 ARG C C 2.861 3.480 6.200 1.00 . A A . 17 ARG C 1 1 7 6923 1 1 17 ARG CA C 2.325 4.909 6.150 1.00 . A A . 17 ARG CA 1 1 7 6924 1 1 17 ARG CB C 2.206 5.491 7.559 1.00 . A A . 17 ARG CB 1 1 7 6925 1 1 17 ARG CD C 0.898 5.558 9.703 1.00 . A A . 17 ARG CD 1 1 7 6926 1 1 17 ARG CG C 1.224 4.752 8.455 1.00 . A A . 17 ARG CG 1 1 7 6927 1 1 17 ARG CZ C -0.475 7.509 10.301 1.00 . A A . 17 ARG CZ 1 1 7 6928 1 1 17 ARG H H 0.474 4.155 5.432 1.00 . A A . 17 ARG H 1 1 7 6929 1 1 17 ARG HA H 3.016 5.514 5.581 1.00 . A A . 17 ARG HA 1 1 7 6930 1 1 17 ARG HB2 H 3.177 5.469 8.030 1.00 . A A . 17 ARG HB2 1 1 7 6931 1 1 17 ARG HB3 H 1.879 6.515 7.477 1.00 . A A . 17 ARG HB3 1 1 7 6932 1 1 17 ARG HD2 H 0.294 4.950 10.361 1.00 . A A . 17 ARG HD2 1 1 7 6933 1 1 17 ARG HD3 H 1.822 5.816 10.199 1.00 . A A . 17 ARG HD3 1 1 7 6934 1 1 17 ARG HE H 0.157 7.080 8.457 1.00 . A A . 17 ARG HE 1 1 7 6935 1 1 17 ARG HG2 H 0.311 4.573 7.906 1.00 . A A . 17 ARG HG2 1 1 7 6936 1 1 17 ARG HG3 H 1.657 3.811 8.755 1.00 . A A . 17 ARG HG3 1 1 7 6937 1 1 17 ARG HH11 H 0.010 6.303 11.848 1.00 . A A . 17 ARG HH11 1 1 7 6938 1 1 17 ARG HH12 H -0.959 7.678 12.255 1.00 . A A . 17 ARG HH12 1 1 7 6939 1 1 17 ARG HH21 H -1.123 8.898 8.983 1.00 . A A . 17 ARG HH21 1 1 7 6940 1 1 17 ARG HH22 H -1.603 9.154 10.627 1.00 . A A . 17 ARG HH22 1 1 7 6941 1 1 17 ARG N N 1.027 4.964 5.475 1.00 . A A . 17 ARG N 1 1 7 6942 1 1 17 ARG NE N 0.169 6.784 9.391 1.00 . A A . 17 ARG NE 1 1 7 6943 1 1 17 ARG NH1 N -0.474 7.132 11.572 1.00 . A A . 17 ARG NH1 1 1 7 6944 1 1 17 ARG NH2 N -1.119 8.611 9.941 1.00 . A A . 17 ARG NH2 1 1 7 6945 1 1 17 ARG O O 2.549 2.732 7.125 1.00 . A A . 17 ARG O 1 1 7 6946 1 1 18 GLY C C 5.487 1.533 4.513 1.00 . A A . 18 GLY C 1 1 7 6947 1 1 18 GLY CA C 4.165 1.726 5.219 1.00 . A A . 18 GLY CA 1 1 7 6948 1 1 18 GLY H H 3.923 3.708 4.503 1.00 . A A . 18 GLY H 1 1 7 6949 1 1 18 GLY HA2 H 4.275 1.402 6.242 1.00 . A A . 18 GLY HA2 1 1 7 6950 1 1 18 GLY HA3 H 3.437 1.099 4.742 1.00 . A A . 18 GLY HA3 1 1 7 6951 1 1 18 GLY N N 3.662 3.083 5.214 1.00 . A A . 18 GLY N 1 1 7 6952 1 1 18 GLY O O 6.448 2.271 4.731 1.00 . A A . 18 GLY O 1 1 7 6953 1 1 19 LYS C C 6.374 0.251 1.405 1.00 . A A . 19 LYS C 1 1 7 6954 1 1 19 LYS CA C 6.684 0.131 2.904 1.00 . A A . 19 LYS CA 1 1 7 6955 1 1 19 LYS CB C 7.037 -1.290 3.298 1.00 . A A . 19 LYS CB 1 1 7 6956 1 1 19 LYS CD C 7.897 -2.834 5.041 1.00 . A A . 19 LYS CD 1 1 7 6957 1 1 19 LYS CE C 8.334 -2.986 6.487 1.00 . A A . 19 LYS CE 1 1 7 6958 1 1 19 LYS CG C 7.511 -1.410 4.729 1.00 . A A . 19 LYS CG 1 1 7 6959 1 1 19 LYS H H 4.709 -0.046 3.572 1.00 . A A . 19 LYS H 1 1 7 6960 1 1 19 LYS HA H 7.491 0.785 3.162 1.00 . A A . 19 LYS HA 1 1 7 6961 1 1 19 LYS HB2 H 6.147 -1.895 3.183 1.00 . A A . 19 LYS HB2 1 1 7 6962 1 1 19 LYS HB3 H 7.811 -1.665 2.647 1.00 . A A . 19 LYS HB3 1 1 7 6963 1 1 19 LYS HD2 H 7.045 -3.467 4.856 1.00 . A A . 19 LYS HD2 1 1 7 6964 1 1 19 LYS HD3 H 8.709 -3.121 4.390 1.00 . A A . 19 LYS HD3 1 1 7 6965 1 1 19 LYS HE2 H 7.515 -2.694 7.128 1.00 . A A . 19 LYS HE2 1 1 7 6966 1 1 19 LYS HE3 H 8.584 -4.019 6.671 1.00 . A A . 19 LYS HE3 1 1 7 6967 1 1 19 LYS HG2 H 8.369 -0.771 4.873 1.00 . A A . 19 LYS HG2 1 1 7 6968 1 1 19 LYS HG3 H 6.714 -1.107 5.391 1.00 . A A . 19 LYS HG3 1 1 7 6969 1 1 19 LYS HZ1 H 9.794 -2.261 7.793 1.00 . A A . 19 LYS HZ1 1 1 7 6970 1 1 19 LYS HZ2 H 9.291 -1.135 6.634 1.00 . A A . 19 LYS HZ2 1 1 7 6971 1 1 19 LYS HZ3 H 10.317 -2.404 6.191 1.00 . A A . 19 LYS HZ3 1 1 7 6972 1 1 19 LYS N N 5.515 0.503 3.673 1.00 . A A . 19 LYS N 1 1 7 6973 1 1 19 LYS NZ N 9.517 -2.138 6.799 1.00 . A A . 19 LYS NZ 1 1 7 6974 1 1 19 LYS O O 6.032 1.323 0.934 1.00 . A A . 19 LYS O 1 1 7 6975 1 1 20 GLY C C 4.735 -1.219 -0.881 1.00 . A A . 20 GLY C 1 1 7 6976 1 1 20 GLY CA C 6.161 -0.788 -0.744 1.00 . A A . 20 GLY CA 1 1 7 6977 1 1 20 GLY H H 6.800 -1.664 1.036 1.00 . A A . 20 GLY H 1 1 7 6978 1 1 20 GLY HA2 H 6.289 0.213 -1.121 1.00 . A A . 20 GLY HA2 1 1 7 6979 1 1 20 GLY HA3 H 6.784 -1.470 -1.284 1.00 . A A . 20 GLY HA3 1 1 7 6980 1 1 20 GLY N N 6.501 -0.832 0.651 1.00 . A A . 20 GLY N 1 1 7 6981 1 1 20 GLY O O 3.948 -0.653 -1.636 1.00 . A A . 20 GLY O 1 1 7 6982 1 1 21 LYS C C 2.721 -3.142 1.407 1.00 . A A . 21 LYS C 1 1 7 6983 1 1 21 LYS CA C 3.097 -2.808 -0.045 1.00 . A A . 21 LYS CA 1 1 7 6984 1 1 21 LYS CB C 2.991 -4.051 -0.925 1.00 . A A . 21 LYS CB 1 1 7 6985 1 1 21 LYS CD C 0.618 -3.557 -1.593 1.00 . A A . 21 LYS CD 1 1 7 6986 1 1 21 LYS CE C 0.010 -4.712 -0.814 1.00 . A A . 21 LYS CE 1 1 7 6987 1 1 21 LYS CG C 2.021 -3.884 -2.082 1.00 . A A . 21 LYS CG 1 1 7 6988 1 1 21 LYS H H 5.154 -2.678 0.391 1.00 . A A . 21 LYS H 1 1 7 6989 1 1 21 LYS HA H 2.412 -2.060 -0.413 1.00 . A A . 21 LYS HA 1 1 7 6990 1 1 21 LYS HB2 H 3.968 -4.275 -1.330 1.00 . A A . 21 LYS HB2 1 1 7 6991 1 1 21 LYS HB3 H 2.661 -4.882 -0.321 1.00 . A A . 21 LYS HB3 1 1 7 6992 1 1 21 LYS HD2 H 0.663 -2.690 -0.953 1.00 . A A . 21 LYS HD2 1 1 7 6993 1 1 21 LYS HD3 H -0.008 -3.342 -2.447 1.00 . A A . 21 LYS HD3 1 1 7 6994 1 1 21 LYS HE2 H -0.275 -5.489 -1.508 1.00 . A A . 21 LYS HE2 1 1 7 6995 1 1 21 LYS HE3 H 0.750 -5.097 -0.128 1.00 . A A . 21 LYS HE3 1 1 7 6996 1 1 21 LYS HG2 H 2.368 -3.077 -2.711 1.00 . A A . 21 LYS HG2 1 1 7 6997 1 1 21 LYS HG3 H 1.992 -4.800 -2.652 1.00 . A A . 21 LYS HG3 1 1 7 6998 1 1 21 LYS HZ1 H -0.901 -3.807 0.833 1.00 . A A . 21 LYS HZ1 1 1 7 6999 1 1 21 LYS HZ2 H -1.770 -5.116 0.204 1.00 . A A . 21 LYS HZ2 1 1 7 7000 1 1 21 LYS HZ3 H -1.766 -3.632 -0.610 1.00 . A A . 21 LYS HZ3 1 1 7 7001 1 1 21 LYS N N 4.431 -2.252 -0.119 1.00 . A A . 21 LYS N 1 1 7 7002 1 1 21 LYS NZ N -1.191 -4.288 -0.044 1.00 . A A . 21 LYS NZ 1 1 7 7003 1 1 21 LYS O O 1.633 -3.653 1.661 1.00 . A A . 21 LYS O 1 1 7 7004 1 1 22 ASP C C 2.581 -1.937 4.413 1.00 . A A . 22 ASP C 1 1 7 7005 1 1 22 ASP CA C 3.349 -3.074 3.772 1.00 . A A . 22 ASP CA 1 1 7 7006 1 1 22 ASP CB C 4.658 -3.261 4.536 1.00 . A A . 22 ASP CB 1 1 7 7007 1 1 22 ASP CG C 4.458 -3.945 5.875 1.00 . A A . 22 ASP CG 1 1 7 7008 1 1 22 ASP H H 4.422 -2.360 2.125 1.00 . A A . 22 ASP H 1 1 7 7009 1 1 22 ASP HA H 2.769 -3.961 3.825 1.00 . A A . 22 ASP HA 1 1 7 7010 1 1 22 ASP HB2 H 5.342 -3.843 3.945 1.00 . A A . 22 ASP HB2 1 1 7 7011 1 1 22 ASP HB3 H 5.093 -2.290 4.721 1.00 . A A . 22 ASP HB3 1 1 7 7012 1 1 22 ASP N N 3.602 -2.805 2.365 1.00 . A A . 22 ASP N 1 1 7 7013 1 1 22 ASP O O 2.438 -1.874 5.631 1.00 . A A . 22 ASP O 1 1 7 7014 1 1 22 ASP OD1 O 3.299 -4.034 6.334 1.00 . A A . 22 ASP OD1 1 1 7 7015 1 1 22 ASP OD2 O 5.457 -4.406 6.460 1.00 . A A . 22 ASP OD2 1 1 7 7016 1 1 23 VAL C C -0.122 -0.212 4.146 1.00 . A A . 23 VAL C 1 1 7 7017 1 1 23 VAL CA C 1.360 0.096 4.061 1.00 . A A . 23 VAL CA 1 1 7 7018 1 1 23 VAL CB C 1.592 1.294 3.141 1.00 . A A . 23 VAL CB 1 1 7 7019 1 1 23 VAL CG1 C 0.889 1.102 1.805 1.00 . A A . 23 VAL CG1 1 1 7 7020 1 1 23 VAL CG2 C 1.143 2.571 3.810 1.00 . A A . 23 VAL CG2 1 1 7 7021 1 1 23 VAL H H 2.278 -1.116 2.642 1.00 . A A . 23 VAL H 1 1 7 7022 1 1 23 VAL HA H 1.721 0.352 5.041 1.00 . A A . 23 VAL HA 1 1 7 7023 1 1 23 VAL HB H 2.657 1.363 2.957 1.00 . A A . 23 VAL HB 1 1 7 7024 1 1 23 VAL HG11 H 0.875 2.038 1.280 1.00 . A A . 23 VAL HG11 1 1 7 7025 1 1 23 VAL HG12 H -0.123 0.768 1.966 1.00 . A A . 23 VAL HG12 1 1 7 7026 1 1 23 VAL HG13 H 1.423 0.369 1.218 1.00 . A A . 23 VAL HG13 1 1 7 7027 1 1 23 VAL HG21 H 1.829 3.368 3.564 1.00 . A A . 23 VAL HG21 1 1 7 7028 1 1 23 VAL HG22 H 1.129 2.425 4.880 1.00 . A A . 23 VAL HG22 1 1 7 7029 1 1 23 VAL HG23 H 0.152 2.828 3.469 1.00 . A A . 23 VAL HG23 1 1 7 7030 1 1 23 VAL N N 2.103 -1.035 3.590 1.00 . A A . 23 VAL N 1 1 7 7031 1 1 23 VAL O O -0.638 -1.063 3.421 1.00 . A A . 23 VAL O 1 1 7 7032 1 1 24 GLU C C -2.988 1.512 4.663 1.00 . A A . 24 GLU C 1 1 7 7033 1 1 24 GLU CA C -2.220 0.314 5.199 1.00 . A A . 24 GLU CA 1 1 7 7034 1 1 24 GLU CB C -2.543 0.096 6.675 1.00 . A A . 24 GLU CB 1 1 7 7035 1 1 24 GLU CD C -2.070 0.751 9.068 1.00 . A A . 24 GLU CD 1 1 7 7036 1 1 24 GLU CG C -1.825 1.060 7.604 1.00 . A A . 24 GLU CG 1 1 7 7037 1 1 24 GLU H H -0.333 1.210 5.509 1.00 . A A . 24 GLU H 1 1 7 7038 1 1 24 GLU HA H -2.503 -0.573 4.643 1.00 . A A . 24 GLU HA 1 1 7 7039 1 1 24 GLU HB2 H -3.606 0.217 6.815 1.00 . A A . 24 GLU HB2 1 1 7 7040 1 1 24 GLU HB3 H -2.264 -0.909 6.945 1.00 . A A . 24 GLU HB3 1 1 7 7041 1 1 24 GLU HG2 H -0.763 1.000 7.413 1.00 . A A . 24 GLU HG2 1 1 7 7042 1 1 24 GLU HG3 H -2.170 2.062 7.401 1.00 . A A . 24 GLU HG3 1 1 7 7043 1 1 24 GLU N N -0.798 0.509 5.009 1.00 . A A . 24 GLU N 1 1 7 7044 1 1 24 GLU O O -3.101 2.542 5.327 1.00 . A A . 24 GLU O 1 1 7 7045 1 1 24 GLU OE1 O -1.330 -0.083 9.630 1.00 . A A . 24 GLU OE1 1 1 7 7046 1 1 24 GLU OE2 O -3.003 1.342 9.651 1.00 . A A . 24 GLU OE2 1 1 7 7047 1 1 25 TYR C C -5.745 2.139 2.851 1.00 . A A . 25 TYR C 1 1 7 7048 1 1 25 TYR CA C -4.253 2.430 2.806 1.00 . A A . 25 TYR CA 1 1 7 7049 1 1 25 TYR CB C -3.811 2.570 1.351 1.00 . A A . 25 TYR CB 1 1 7 7050 1 1 25 TYR CD1 C -1.394 3.242 1.645 1.00 . A A . 25 TYR CD1 1 1 7 7051 1 1 25 TYR CD2 C -2.819 4.689 0.411 1.00 . A A . 25 TYR CD2 1 1 7 7052 1 1 25 TYR CE1 C -0.337 4.106 1.431 1.00 . A A . 25 TYR CE1 1 1 7 7053 1 1 25 TYR CE2 C -1.767 5.553 0.188 1.00 . A A . 25 TYR CE2 1 1 7 7054 1 1 25 TYR CG C -2.653 3.520 1.138 1.00 . A A . 25 TYR CG 1 1 7 7055 1 1 25 TYR CZ C -0.528 5.256 0.700 1.00 . A A . 25 TYR CZ 1 1 7 7056 1 1 25 TYR H H -3.412 0.512 2.999 1.00 . A A . 25 TYR H 1 1 7 7057 1 1 25 TYR HA H -4.045 3.348 3.328 1.00 . A A . 25 TYR HA 1 1 7 7058 1 1 25 TYR HB2 H -3.516 1.601 0.980 1.00 . A A . 25 TYR HB2 1 1 7 7059 1 1 25 TYR HB3 H -4.645 2.932 0.766 1.00 . A A . 25 TYR HB3 1 1 7 7060 1 1 25 TYR HD1 H -1.245 2.338 2.216 1.00 . A A . 25 TYR HD1 1 1 7 7061 1 1 25 TYR HD2 H -3.785 4.917 0.012 1.00 . A A . 25 TYR HD2 1 1 7 7062 1 1 25 TYR HE1 H 0.634 3.874 1.833 1.00 . A A . 25 TYR HE1 1 1 7 7063 1 1 25 TYR HE2 H -1.922 6.457 -0.381 1.00 . A A . 25 TYR HE2 1 1 7 7064 1 1 25 TYR HH H 0.221 7.020 0.534 1.00 . A A . 25 TYR HH 1 1 7 7065 1 1 25 TYR N N -3.509 1.366 3.456 1.00 . A A . 25 TYR N 1 1 7 7066 1 1 25 TYR O O -6.156 0.988 2.891 1.00 . A A . 25 TYR O 1 1 7 7067 1 1 25 TYR OH O 0.528 6.112 0.476 1.00 . A A . 25 TYR OH 1 1 7 7068 1 1 26 LEU C C -8.472 2.901 1.413 1.00 . A A . 26 LEU C 1 1 7 7069 1 1 26 LEU CA C -7.989 3.032 2.836 1.00 . A A . 26 LEU CA 1 1 7 7070 1 1 26 LEU CB C -8.649 4.233 3.515 1.00 . A A . 26 LEU CB 1 1 7 7071 1 1 26 LEU CD1 C -10.841 4.975 4.484 1.00 . A A . 26 LEU CD1 1 1 7 7072 1 1 26 LEU CD2 C -10.430 5.167 2.021 1.00 . A A . 26 LEU CD2 1 1 7 7073 1 1 26 LEU CG C -10.154 4.357 3.277 1.00 . A A . 26 LEU CG 1 1 7 7074 1 1 26 LEU H H -6.174 4.074 2.768 1.00 . A A . 26 LEU H 1 1 7 7075 1 1 26 LEU HA H -8.232 2.130 3.377 1.00 . A A . 26 LEU HA 1 1 7 7076 1 1 26 LEU HB2 H -8.473 4.164 4.578 1.00 . A A . 26 LEU HB2 1 1 7 7077 1 1 26 LEU HB3 H -8.175 5.129 3.148 1.00 . A A . 26 LEU HB3 1 1 7 7078 1 1 26 LEU HD11 H -10.261 5.812 4.839 1.00 . A A . 26 LEU HD11 1 1 7 7079 1 1 26 LEU HD12 H -10.923 4.235 5.266 1.00 . A A . 26 LEU HD12 1 1 7 7080 1 1 26 LEU HD13 H -11.827 5.312 4.202 1.00 . A A . 26 LEU HD13 1 1 7 7081 1 1 26 LEU HD21 H -9.778 6.027 1.992 1.00 . A A . 26 LEU HD21 1 1 7 7082 1 1 26 LEU HD22 H -11.460 5.494 2.022 1.00 . A A . 26 LEU HD22 1 1 7 7083 1 1 26 LEU HD23 H -10.253 4.548 1.153 1.00 . A A . 26 LEU HD23 1 1 7 7084 1 1 26 LEU HG H -10.563 3.376 3.129 1.00 . A A . 26 LEU HG 1 1 7 7085 1 1 26 LEU N N -6.551 3.184 2.821 1.00 . A A . 26 LEU N 1 1 7 7086 1 1 26 LEU O O -7.788 3.326 0.486 1.00 . A A . 26 LEU O 1 1 7 7087 1 1 27 VAL C C -11.614 2.335 -0.284 1.00 . A A . 27 VAL C 1 1 7 7088 1 1 27 VAL CA C -10.112 2.153 -0.140 1.00 . A A . 27 VAL CA 1 1 7 7089 1 1 27 VAL CB C -9.631 0.825 -0.788 1.00 . A A . 27 VAL CB 1 1 7 7090 1 1 27 VAL CG1 C -8.527 0.165 0.023 1.00 . A A . 27 VAL CG1 1 1 7 7091 1 1 27 VAL CG2 C -10.750 -0.181 -1.069 1.00 . A A . 27 VAL CG2 1 1 7 7092 1 1 27 VAL H H -10.144 1.954 1.966 1.00 . A A . 27 VAL H 1 1 7 7093 1 1 27 VAL HA H -9.649 2.937 -0.712 1.00 . A A . 27 VAL HA 1 1 7 7094 1 1 27 VAL HB H -9.204 1.110 -1.720 1.00 . A A . 27 VAL HB 1 1 7 7095 1 1 27 VAL HG11 H -7.747 0.886 0.222 1.00 . A A . 27 VAL HG11 1 1 7 7096 1 1 27 VAL HG12 H -8.118 -0.661 -0.537 1.00 . A A . 27 VAL HG12 1 1 7 7097 1 1 27 VAL HG13 H -8.932 -0.197 0.957 1.00 . A A . 27 VAL HG13 1 1 7 7098 1 1 27 VAL HG21 H -11.410 0.219 -1.826 1.00 . A A . 27 VAL HG21 1 1 7 7099 1 1 27 VAL HG22 H -11.308 -0.361 -0.165 1.00 . A A . 27 VAL HG22 1 1 7 7100 1 1 27 VAL HG23 H -10.322 -1.109 -1.419 1.00 . A A . 27 VAL HG23 1 1 7 7101 1 1 27 VAL N N -9.631 2.306 1.213 1.00 . A A . 27 VAL N 1 1 7 7102 1 1 27 VAL O O -12.409 1.501 0.153 1.00 . A A . 27 VAL O 1 1 7 7103 1 1 28 ARG C C -13.680 2.970 -2.448 1.00 . A A . 28 ARG C 1 1 7 7104 1 1 28 ARG CA C -13.374 3.713 -1.185 1.00 . A A . 28 ARG CA 1 1 7 7105 1 1 28 ARG CB C -13.631 5.198 -1.383 1.00 . A A . 28 ARG CB 1 1 7 7106 1 1 28 ARG CD C -15.288 7.077 -1.505 1.00 . A A . 28 ARG CD 1 1 7 7107 1 1 28 ARG CG C -15.086 5.600 -1.209 1.00 . A A . 28 ARG CG 1 1 7 7108 1 1 28 ARG CZ C -17.095 8.743 -1.430 1.00 . A A . 28 ARG CZ 1 1 7 7109 1 1 28 ARG H H -11.308 4.107 -1.147 1.00 . A A . 28 ARG H 1 1 7 7110 1 1 28 ARG HA H -13.991 3.320 -0.395 1.00 . A A . 28 ARG HA 1 1 7 7111 1 1 28 ARG HB2 H -13.034 5.758 -0.680 1.00 . A A . 28 ARG HB2 1 1 7 7112 1 1 28 ARG HB3 H -13.332 5.451 -2.385 1.00 . A A . 28 ARG HB3 1 1 7 7113 1 1 28 ARG HD2 H -14.689 7.653 -0.817 1.00 . A A . 28 ARG HD2 1 1 7 7114 1 1 28 ARG HD3 H -14.964 7.275 -2.516 1.00 . A A . 28 ARG HD3 1 1 7 7115 1 1 28 ARG HE H -17.350 6.775 -1.224 1.00 . A A . 28 ARG HE 1 1 7 7116 1 1 28 ARG HG2 H -15.695 5.020 -1.887 1.00 . A A . 28 ARG HG2 1 1 7 7117 1 1 28 ARG HG3 H -15.387 5.400 -0.191 1.00 . A A . 28 ARG HG3 1 1 7 7118 1 1 28 ARG HH11 H -15.246 9.505 -1.712 1.00 . A A . 28 ARG HH11 1 1 7 7119 1 1 28 ARG HH12 H -16.527 10.669 -1.664 1.00 . A A . 28 ARG HH12 1 1 7 7120 1 1 28 ARG HH21 H -19.049 8.298 -1.160 1.00 . A A . 28 ARG HH21 1 1 7 7121 1 1 28 ARG HH22 H -18.691 9.982 -1.349 1.00 . A A . 28 ARG HH22 1 1 7 7122 1 1 28 ARG N N -11.987 3.449 -0.891 1.00 . A A . 28 ARG N 1 1 7 7123 1 1 28 ARG NE N -16.685 7.480 -1.368 1.00 . A A . 28 ARG NE 1 1 7 7124 1 1 28 ARG NH1 N -16.217 9.719 -1.617 1.00 . A A . 28 ARG NH1 1 1 7 7125 1 1 28 ARG NH2 N -18.384 9.031 -1.302 1.00 . A A . 28 ARG NH2 1 1 7 7126 1 1 28 ARG O O -13.752 3.555 -3.528 1.00 . A A . 28 ARG O 1 1 7 7127 1 1 29 TRP C C -14.811 1.407 -4.536 1.00 . A A . 29 TRP C 1 1 7 7128 1 1 29 TRP CA C -14.095 0.741 -3.378 1.00 . A A . 29 TRP CA 1 1 7 7129 1 1 29 TRP CB C -14.929 -0.413 -2.854 1.00 . A A . 29 TRP CB 1 1 7 7130 1 1 29 TRP CD1 C -13.906 -1.882 -4.683 1.00 . A A . 29 TRP CD1 1 1 7 7131 1 1 29 TRP CD2 C -15.476 -2.904 -3.457 1.00 . A A . 29 TRP CD2 1 1 7 7132 1 1 29 TRP CE2 C -14.997 -3.812 -4.421 1.00 . A A . 29 TRP CE2 1 1 7 7133 1 1 29 TRP CE3 C -16.470 -3.324 -2.570 1.00 . A A . 29 TRP CE3 1 1 7 7134 1 1 29 TRP CG C -14.763 -1.675 -3.642 1.00 . A A . 29 TRP CG 1 1 7 7135 1 1 29 TRP CH2 C -16.455 -5.499 -3.641 1.00 . A A . 29 TRP CH2 1 1 7 7136 1 1 29 TRP CZ2 C -15.482 -5.114 -4.522 1.00 . A A . 29 TRP CZ2 1 1 7 7137 1 1 29 TRP CZ3 C -16.950 -4.616 -2.671 1.00 . A A . 29 TRP CZ3 1 1 7 7138 1 1 29 TRP H H -13.767 1.300 -1.378 1.00 . A A . 29 TRP H 1 1 7 7139 1 1 29 TRP HA H -13.148 0.356 -3.726 1.00 . A A . 29 TRP HA 1 1 7 7140 1 1 29 TRP HB2 H -14.640 -0.603 -1.833 1.00 . A A . 29 TRP HB2 1 1 7 7141 1 1 29 TRP HB3 H -15.970 -0.134 -2.880 1.00 . A A . 29 TRP HB3 1 1 7 7142 1 1 29 TRP HD1 H -13.226 -1.136 -5.068 1.00 . A A . 29 TRP HD1 1 1 7 7143 1 1 29 TRP HE1 H -13.532 -3.552 -5.902 1.00 . A A . 29 TRP HE1 1 1 7 7144 1 1 29 TRP HE3 H -16.864 -2.659 -1.816 1.00 . A A . 29 TRP HE3 1 1 7 7145 1 1 29 TRP HH2 H -16.859 -6.499 -3.683 1.00 . A A . 29 TRP HH2 1 1 7 7146 1 1 29 TRP HZ2 H -15.111 -5.806 -5.265 1.00 . A A . 29 TRP HZ2 1 1 7 7147 1 1 29 TRP HZ3 H -17.718 -4.958 -1.995 1.00 . A A . 29 TRP HZ3 1 1 7 7148 1 1 29 TRP N N -13.834 1.663 -2.285 1.00 . A A . 29 TRP N 1 1 7 7149 1 1 29 TRP NE1 N -14.040 -3.164 -5.158 1.00 . A A . 29 TRP NE1 1 1 7 7150 1 1 29 TRP O O -16.035 1.491 -4.556 1.00 . A A . 29 TRP O 1 1 7 7151 1 1 30 LYS C C -15.863 2.033 -7.122 1.00 . A A . 30 LYS C 1 1 7 7152 1 1 30 LYS CA C -14.511 2.601 -6.678 1.00 . A A . 30 LYS CA 1 1 7 7153 1 1 30 LYS CB C -13.504 2.444 -7.822 1.00 . A A . 30 LYS CB 1 1 7 7154 1 1 30 LYS CD C -12.926 2.925 -10.220 1.00 . A A . 30 LYS CD 1 1 7 7155 1 1 30 LYS CE C -13.386 3.579 -11.513 1.00 . A A . 30 LYS CE 1 1 7 7156 1 1 30 LYS CG C -13.904 3.186 -9.087 1.00 . A A . 30 LYS CG 1 1 7 7157 1 1 30 LYS H H -13.025 1.935 -5.280 1.00 . A A . 30 LYS H 1 1 7 7158 1 1 30 LYS HA H -14.631 3.651 -6.460 1.00 . A A . 30 LYS HA 1 1 7 7159 1 1 30 LYS HB2 H -12.543 2.815 -7.500 1.00 . A A . 30 LYS HB2 1 1 7 7160 1 1 30 LYS HB3 H -13.412 1.396 -8.061 1.00 . A A . 30 LYS HB3 1 1 7 7161 1 1 30 LYS HD2 H -11.961 3.327 -9.949 1.00 . A A . 30 LYS HD2 1 1 7 7162 1 1 30 LYS HD3 H -12.844 1.860 -10.374 1.00 . A A . 30 LYS HD3 1 1 7 7163 1 1 30 LYS HE2 H -13.440 4.646 -11.362 1.00 . A A . 30 LYS HE2 1 1 7 7164 1 1 30 LYS HE3 H -12.665 3.361 -12.287 1.00 . A A . 30 LYS HE3 1 1 7 7165 1 1 30 LYS HG2 H -14.886 2.857 -9.391 1.00 . A A . 30 LYS HG2 1 1 7 7166 1 1 30 LYS HG3 H -13.926 4.246 -8.879 1.00 . A A . 30 LYS HG3 1 1 7 7167 1 1 30 LYS HZ1 H -14.985 3.506 -12.855 1.00 . A A . 30 LYS HZ1 1 1 7 7168 1 1 30 LYS HZ2 H -15.443 3.337 -11.235 1.00 . A A . 30 LYS HZ2 1 1 7 7169 1 1 30 LYS HZ3 H -14.705 2.048 -12.045 1.00 . A A . 30 LYS HZ3 1 1 7 7170 1 1 30 LYS N N -14.004 1.939 -5.459 1.00 . A A . 30 LYS N 1 1 7 7171 1 1 30 LYS NZ N -14.723 3.082 -11.942 1.00 . A A . 30 LYS NZ 1 1 7 7172 1 1 30 LYS O O -16.722 2.762 -7.617 1.00 . A A . 30 LYS O 1 1 7 7173 1 1 31 ASP C C -17.878 -0.600 -6.048 1.00 . A A . 31 ASP C 1 1 7 7174 1 1 31 ASP CA C -17.280 0.056 -7.291 1.00 . A A . 31 ASP CA 1 1 7 7175 1 1 31 ASP CB C -17.038 -0.997 -8.375 1.00 . A A . 31 ASP CB 1 1 7 7176 1 1 31 ASP CG C -18.300 -1.757 -8.733 1.00 . A A . 31 ASP CG 1 1 7 7177 1 1 31 ASP H H -15.295 0.196 -6.579 1.00 . A A . 31 ASP H 1 1 7 7178 1 1 31 ASP HA H -17.969 0.799 -7.663 1.00 . A A . 31 ASP HA 1 1 7 7179 1 1 31 ASP HB2 H -16.670 -0.510 -9.265 1.00 . A A . 31 ASP HB2 1 1 7 7180 1 1 31 ASP HB3 H -16.301 -1.703 -8.024 1.00 . A A . 31 ASP HB3 1 1 7 7181 1 1 31 ASP N N -16.033 0.726 -6.945 1.00 . A A . 31 ASP N 1 1 7 7182 1 1 31 ASP O O -18.114 -1.807 -6.020 1.00 . A A . 31 ASP O 1 1 7 7183 1 1 31 ASP OD1 O -19.082 -1.252 -9.566 1.00 . A A . 31 ASP OD1 1 1 7 7184 1 1 31 ASP OD2 O -18.507 -2.859 -8.181 1.00 . A A . 31 ASP OD2 1 1 7 7185 1 1 32 GLY C C -19.589 0.701 -3.094 1.00 . A A . 32 GLY C 1 1 7 7186 1 1 32 GLY CA C -18.668 -0.291 -3.776 1.00 . A A . 32 GLY CA 1 1 7 7187 1 1 32 GLY H H -17.923 1.170 -5.112 1.00 . A A . 32 GLY H 1 1 7 7188 1 1 32 GLY HA2 H -19.217 -1.200 -3.976 1.00 . A A . 32 GLY HA2 1 1 7 7189 1 1 32 GLY HA3 H -17.846 -0.515 -3.105 1.00 . A A . 32 GLY HA3 1 1 7 7190 1 1 32 GLY N N -18.120 0.214 -5.022 1.00 . A A . 32 GLY N 1 1 7 7191 1 1 32 GLY O O -19.992 1.700 -3.689 1.00 . A A . 32 GLY O 1 1 7 7192 1 1 33 GLY C C -20.117 1.830 0.174 1.00 . A A . 33 GLY C 1 1 7 7193 1 1 33 GLY CA C -20.789 1.300 -1.078 1.00 . A A . 33 GLY CA 1 1 7 7194 1 1 33 GLY H H -19.570 -0.396 -1.420 1.00 . A A . 33 GLY H 1 1 7 7195 1 1 33 GLY HA2 H -21.073 2.135 -1.703 1.00 . A A . 33 GLY HA2 1 1 7 7196 1 1 33 GLY HA3 H -21.677 0.756 -0.795 1.00 . A A . 33 GLY HA3 1 1 7 7197 1 1 33 GLY N N -19.919 0.420 -1.837 1.00 . A A . 33 GLY N 1 1 7 7198 1 1 33 GLY O O -20.288 2.995 0.534 1.00 . A A . 33 GLY O 1 1 7 7199 1 1 34 ASP C C -17.137 1.346 1.829 1.00 . A A . 34 ASP C 1 1 7 7200 1 1 34 ASP CA C -18.646 1.353 2.058 1.00 . A A . 34 ASP CA 1 1 7 7201 1 1 34 ASP CB C -19.004 0.403 3.201 1.00 . A A . 34 ASP CB 1 1 7 7202 1 1 34 ASP CG C -18.366 0.813 4.514 1.00 . A A . 34 ASP CG 1 1 7 7203 1 1 34 ASP H H -19.258 0.054 0.503 1.00 . A A . 34 ASP H 1 1 7 7204 1 1 34 ASP HA H -18.956 2.354 2.320 1.00 . A A . 34 ASP HA 1 1 7 7205 1 1 34 ASP HB2 H -20.077 0.393 3.332 1.00 . A A . 34 ASP HB2 1 1 7 7206 1 1 34 ASP HB3 H -18.666 -0.592 2.953 1.00 . A A . 34 ASP HB3 1 1 7 7207 1 1 34 ASP N N -19.351 0.970 0.839 1.00 . A A . 34 ASP N 1 1 7 7208 1 1 34 ASP O O -16.653 0.776 0.851 1.00 . A A . 34 ASP O 1 1 7 7209 1 1 34 ASP OD1 O -18.994 1.593 5.263 1.00 . A A . 34 ASP OD1 1 1 7 7210 1 1 34 ASP OD2 O -17.239 0.356 4.795 1.00 . A A . 34 ASP OD2 1 1 7 7211 1 1 35 CYS C C -14.269 1.387 3.819 1.00 . A A . 35 CYS C 1 1 7 7212 1 1 35 CYS CA C -14.946 2.045 2.620 1.00 . A A . 35 CYS CA 1 1 7 7213 1 1 35 CYS CB C -14.489 3.499 2.501 1.00 . A A . 35 CYS CB 1 1 7 7214 1 1 35 CYS H H -16.840 2.413 3.494 1.00 . A A . 35 CYS H 1 1 7 7215 1 1 35 CYS HA H -14.661 1.514 1.725 1.00 . A A . 35 CYS HA 1 1 7 7216 1 1 35 CYS HB2 H -13.413 3.525 2.417 1.00 . A A . 35 CYS HB2 1 1 7 7217 1 1 35 CYS HB3 H -14.924 3.934 1.611 1.00 . A A . 35 CYS HB3 1 1 7 7218 1 1 35 CYS HG H -16.212 4.920 3.733 1.00 . A A . 35 CYS HG 1 1 7 7219 1 1 35 CYS N N -16.399 1.979 2.734 1.00 . A A . 35 CYS N 1 1 7 7220 1 1 35 CYS O O -14.745 1.488 4.949 1.00 . A A . 35 CYS O 1 1 7 7221 1 1 35 CYS SG S -14.954 4.538 3.905 1.00 . A A . 35 CYS SG 1 1 7 7222 1 1 36 GLU C C -10.903 0.292 4.455 1.00 . A A . 36 GLU C 1 1 7 7223 1 1 36 GLU CA C -12.401 0.039 4.612 1.00 . A A . 36 GLU CA 1 1 7 7224 1 1 36 GLU CB C -12.687 -1.462 4.590 1.00 . A A . 36 GLU CB 1 1 7 7225 1 1 36 GLU CD C -14.610 -1.264 6.216 1.00 . A A . 36 GLU CD 1 1 7 7226 1 1 36 GLU CG C -13.318 -1.978 5.874 1.00 . A A . 36 GLU CG 1 1 7 7227 1 1 36 GLU H H -12.826 0.669 2.637 1.00 . A A . 36 GLU H 1 1 7 7228 1 1 36 GLU HA H -12.723 0.445 5.560 1.00 . A A . 36 GLU HA 1 1 7 7229 1 1 36 GLU HB2 H -13.359 -1.679 3.773 1.00 . A A . 36 GLU HB2 1 1 7 7230 1 1 36 GLU HB3 H -11.760 -1.992 4.432 1.00 . A A . 36 GLU HB3 1 1 7 7231 1 1 36 GLU HG2 H -13.526 -3.031 5.760 1.00 . A A . 36 GLU HG2 1 1 7 7232 1 1 36 GLU HG3 H -12.619 -1.836 6.685 1.00 . A A . 36 GLU HG3 1 1 7 7233 1 1 36 GLU N N -13.152 0.714 3.559 1.00 . A A . 36 GLU N 1 1 7 7234 1 1 36 GLU O O -10.472 0.963 3.518 1.00 . A A . 36 GLU O 1 1 7 7235 1 1 36 GLU OE1 O -15.673 -1.684 5.713 1.00 . A A . 36 GLU OE1 1 1 7 7236 1 1 36 GLU OE2 O -14.560 -0.285 6.991 1.00 . A A . 36 GLU OE2 1 1 7 7237 1 1 37 TRP C C -7.972 -1.301 4.763 1.00 . A A . 37 TRP C 1 1 7 7238 1 1 37 TRP CA C -8.669 -0.080 5.351 1.00 . A A . 37 TRP CA 1 1 7 7239 1 1 37 TRP CB C -8.151 0.166 6.768 1.00 . A A . 37 TRP CB 1 1 7 7240 1 1 37 TRP CD1 C -9.111 2.537 6.889 1.00 . A A . 37 TRP CD1 1 1 7 7241 1 1 37 TRP CD2 C -9.223 1.405 8.815 1.00 . A A . 37 TRP CD2 1 1 7 7242 1 1 37 TRP CE2 C -9.779 2.683 9.014 1.00 . A A . 37 TRP CE2 1 1 7 7243 1 1 37 TRP CE3 C -9.184 0.513 9.891 1.00 . A A . 37 TRP CE3 1 1 7 7244 1 1 37 TRP CG C -8.803 1.332 7.448 1.00 . A A . 37 TRP CG 1 1 7 7245 1 1 37 TRP CH2 C -10.240 2.198 11.277 1.00 . A A . 37 TRP CH2 1 1 7 7246 1 1 37 TRP CZ2 C -10.291 3.090 10.243 1.00 . A A . 37 TRP CZ2 1 1 7 7247 1 1 37 TRP CZ3 C -9.693 0.919 11.111 1.00 . A A . 37 TRP CZ3 1 1 7 7248 1 1 37 TRP H H -10.517 -0.778 6.099 1.00 . A A . 37 TRP H 1 1 7 7249 1 1 37 TRP HA H -8.446 0.781 4.741 1.00 . A A . 37 TRP HA 1 1 7 7250 1 1 37 TRP HB2 H -8.332 -0.714 7.367 1.00 . A A . 37 TRP HB2 1 1 7 7251 1 1 37 TRP HB3 H -7.091 0.352 6.725 1.00 . A A . 37 TRP HB3 1 1 7 7252 1 1 37 TRP HD1 H -8.916 2.795 5.860 1.00 . A A . 37 TRP HD1 1 1 7 7253 1 1 37 TRP HE1 H -10.011 4.271 7.662 1.00 . A A . 37 TRP HE1 1 1 7 7254 1 1 37 TRP HE3 H -8.766 -0.477 9.783 1.00 . A A . 37 TRP HE3 1 1 7 7255 1 1 37 TRP HH2 H -10.626 2.472 12.248 1.00 . A A . 37 TRP HH2 1 1 7 7256 1 1 37 TRP HZ2 H -10.717 4.073 10.388 1.00 . A A . 37 TRP HZ2 1 1 7 7257 1 1 37 TRP HZ3 H -9.672 0.244 11.954 1.00 . A A . 37 TRP HZ3 1 1 7 7258 1 1 37 TRP N N -10.117 -0.252 5.378 1.00 . A A . 37 TRP N 1 1 7 7259 1 1 37 TRP NE1 N -9.699 3.355 7.823 1.00 . A A . 37 TRP NE1 1 1 7 7260 1 1 37 TRP O O -8.444 -2.429 4.909 1.00 . A A . 37 TRP O 1 1 7 7261 1 1 38 VAL C C -5.072 -2.688 4.532 1.00 . A A . 38 VAL C 1 1 7 7262 1 1 38 VAL CA C -6.062 -2.153 3.512 1.00 . A A . 38 VAL CA 1 1 7 7263 1 1 38 VAL CB C -5.276 -1.705 2.263 1.00 . A A . 38 VAL CB 1 1 7 7264 1 1 38 VAL CG1 C -4.485 -2.870 1.687 1.00 . A A . 38 VAL CG1 1 1 7 7265 1 1 38 VAL CG2 C -6.206 -1.123 1.218 1.00 . A A . 38 VAL CG2 1 1 7 7266 1 1 38 VAL H H -6.525 -0.140 3.998 1.00 . A A . 38 VAL H 1 1 7 7267 1 1 38 VAL HA H -6.741 -2.942 3.228 1.00 . A A . 38 VAL HA 1 1 7 7268 1 1 38 VAL HB H -4.577 -0.939 2.560 1.00 . A A . 38 VAL HB 1 1 7 7269 1 1 38 VAL HG11 H -5.104 -3.756 1.685 1.00 . A A . 38 VAL HG11 1 1 7 7270 1 1 38 VAL HG12 H -3.608 -3.046 2.293 1.00 . A A . 38 VAL HG12 1 1 7 7271 1 1 38 VAL HG13 H -4.185 -2.643 0.680 1.00 . A A . 38 VAL HG13 1 1 7 7272 1 1 38 VAL HG21 H -7.222 -1.162 1.580 1.00 . A A . 38 VAL HG21 1 1 7 7273 1 1 38 VAL HG22 H -6.126 -1.697 0.307 1.00 . A A . 38 VAL HG22 1 1 7 7274 1 1 38 VAL HG23 H -5.931 -0.098 1.020 1.00 . A A . 38 VAL HG23 1 1 7 7275 1 1 38 VAL N N -6.840 -1.068 4.101 1.00 . A A . 38 VAL N 1 1 7 7276 1 1 38 VAL O O -4.767 -2.019 5.519 1.00 . A A . 38 VAL O 1 1 7 7277 1 1 39 LYS C C -2.223 -3.953 5.036 1.00 . A A . 39 LYS C 1 1 7 7278 1 1 39 LYS CA C -3.630 -4.495 5.214 1.00 . A A . 39 LYS CA 1 1 7 7279 1 1 39 LYS CB C -3.639 -6.017 5.066 1.00 . A A . 39 LYS CB 1 1 7 7280 1 1 39 LYS CD C -2.807 -8.241 5.883 1.00 . A A . 39 LYS CD 1 1 7 7281 1 1 39 LYS CE C -4.240 -8.712 6.067 1.00 . A A . 39 LYS CE 1 1 7 7282 1 1 39 LYS CG C -2.696 -6.731 6.020 1.00 . A A . 39 LYS CG 1 1 7 7283 1 1 39 LYS H H -4.856 -4.389 3.503 1.00 . A A . 39 LYS H 1 1 7 7284 1 1 39 LYS HA H -3.951 -4.237 6.200 1.00 . A A . 39 LYS HA 1 1 7 7285 1 1 39 LYS HB2 H -4.639 -6.378 5.247 1.00 . A A . 39 LYS HB2 1 1 7 7286 1 1 39 LYS HB3 H -3.352 -6.269 4.055 1.00 . A A . 39 LYS HB3 1 1 7 7287 1 1 39 LYS HD2 H -2.468 -8.529 4.899 1.00 . A A . 39 LYS HD2 1 1 7 7288 1 1 39 LYS HD3 H -2.185 -8.708 6.632 1.00 . A A . 39 LYS HD3 1 1 7 7289 1 1 39 LYS HE2 H -4.834 -8.349 5.241 1.00 . A A . 39 LYS HE2 1 1 7 7290 1 1 39 LYS HE3 H -4.253 -9.792 6.070 1.00 . A A . 39 LYS HE3 1 1 7 7291 1 1 39 LYS HG2 H -1.682 -6.433 5.800 1.00 . A A . 39 LYS HG2 1 1 7 7292 1 1 39 LYS HG3 H -2.945 -6.450 7.033 1.00 . A A . 39 LYS HG3 1 1 7 7293 1 1 39 LYS HZ1 H -4.849 -7.176 7.346 1.00 . A A . 39 LYS HZ1 1 1 7 7294 1 1 39 LYS HZ2 H -4.262 -8.545 8.150 1.00 . A A . 39 LYS HZ2 1 1 7 7295 1 1 39 LYS HZ3 H -5.801 -8.570 7.448 1.00 . A A . 39 LYS HZ3 1 1 7 7296 1 1 39 LYS N N -4.572 -3.891 4.296 1.00 . A A . 39 LYS N 1 1 7 7297 1 1 39 LYS NZ N -4.829 -8.216 7.342 1.00 . A A . 39 LYS NZ 1 1 7 7298 1 1 39 LYS O O -1.546 -4.232 4.046 1.00 . A A . 39 LYS O 1 1 7 7299 1 1 40 GLY C C 0.546 -3.491 6.693 1.00 . A A . 40 GLY C 1 1 7 7300 1 1 40 GLY CA C -0.469 -2.601 6.008 1.00 . A A . 40 GLY CA 1 1 7 7301 1 1 40 GLY H H -2.408 -2.957 6.753 1.00 . A A . 40 GLY H 1 1 7 7302 1 1 40 GLY HA2 H -0.164 -2.465 4.985 1.00 . A A . 40 GLY HA2 1 1 7 7303 1 1 40 GLY HA3 H -0.489 -1.642 6.503 1.00 . A A . 40 GLY HA3 1 1 7 7304 1 1 40 GLY N N -1.799 -3.168 6.021 1.00 . A A . 40 GLY N 1 1 7 7305 1 1 40 GLY O O 1.382 -3.020 7.465 1.00 . A A . 40 GLY O 1 1 7 7306 1 1 41 VAL C C 2.196 -6.398 5.857 1.00 . A A . 41 VAL C 1 1 7 7307 1 1 41 VAL CA C 1.386 -5.755 6.978 1.00 . A A . 41 VAL CA 1 1 7 7308 1 1 41 VAL CB C 0.666 -6.873 7.752 1.00 . A A . 41 VAL CB 1 1 7 7309 1 1 41 VAL CG1 C 1.626 -7.556 8.717 1.00 . A A . 41 VAL CG1 1 1 7 7310 1 1 41 VAL CG2 C -0.550 -6.331 8.487 1.00 . A A . 41 VAL CG2 1 1 7 7311 1 1 41 VAL H H -0.259 -5.100 5.834 1.00 . A A . 41 VAL H 1 1 7 7312 1 1 41 VAL HA H 2.053 -5.239 7.652 1.00 . A A . 41 VAL HA 1 1 7 7313 1 1 41 VAL HB H 0.334 -7.611 7.037 1.00 . A A . 41 VAL HB 1 1 7 7314 1 1 41 VAL HG11 H 2.453 -7.975 8.164 1.00 . A A . 41 VAL HG11 1 1 7 7315 1 1 41 VAL HG12 H 1.107 -8.344 9.240 1.00 . A A . 41 VAL HG12 1 1 7 7316 1 1 41 VAL HG13 H 1.996 -6.834 9.429 1.00 . A A . 41 VAL HG13 1 1 7 7317 1 1 41 VAL HG21 H -0.237 -5.580 9.197 1.00 . A A . 41 VAL HG21 1 1 7 7318 1 1 41 VAL HG22 H -1.045 -7.136 9.011 1.00 . A A . 41 VAL HG22 1 1 7 7319 1 1 41 VAL HG23 H -1.234 -5.891 7.776 1.00 . A A . 41 VAL HG23 1 1 7 7320 1 1 41 VAL N N 0.454 -4.786 6.425 1.00 . A A . 41 VAL N 1 1 7 7321 1 1 41 VAL O O 3.058 -7.241 6.110 1.00 . A A . 41 VAL O 1 1 7 7322 1 1 42 HIS C C 4.050 -6.078 3.432 1.00 . A A . 42 HIS C 1 1 7 7323 1 1 42 HIS CA C 2.620 -6.550 3.469 1.00 . A A . 42 HIS CA 1 1 7 7324 1 1 42 HIS CB C 1.871 -6.221 2.181 1.00 . A A . 42 HIS CB 1 1 7 7325 1 1 42 HIS CD2 C 0.378 -8.298 1.771 1.00 . A A . 42 HIS CD2 1 1 7 7326 1 1 42 HIS CE1 C 1.258 -8.960 -0.123 1.00 . A A . 42 HIS CE1 1 1 7 7327 1 1 42 HIS CG C 1.370 -7.431 1.459 1.00 . A A . 42 HIS CG 1 1 7 7328 1 1 42 HIS H H 1.241 -5.301 4.462 1.00 . A A . 42 HIS H 1 1 7 7329 1 1 42 HIS HA H 2.651 -7.606 3.593 1.00 . A A . 42 HIS HA 1 1 7 7330 1 1 42 HIS HB2 H 1.011 -5.604 2.425 1.00 . A A . 42 HIS HB2 1 1 7 7331 1 1 42 HIS HB3 H 2.525 -5.677 1.515 1.00 . A A . 42 HIS HB3 1 1 7 7332 1 1 42 HIS HD1 H 2.640 -7.453 -0.222 1.00 . A A . 42 HIS HD1 1 1 7 7333 1 1 42 HIS HD2 H -0.259 -8.256 2.644 1.00 . A A . 42 HIS HD2 1 1 7 7334 1 1 42 HIS HE1 H 1.461 -9.527 -1.021 1.00 . A A . 42 HIS HE1 1 1 7 7335 1 1 42 HIS HE2 H -0.298 -9.988 0.724 1.00 . A A . 42 HIS HE2 1 1 7 7336 1 1 42 HIS N N 1.921 -5.995 4.613 1.00 . A A . 42 HIS N 1 1 7 7337 1 1 42 HIS ND1 N 1.903 -7.874 0.267 1.00 . A A . 42 HIS ND1 1 1 7 7338 1 1 42 HIS NE2 N 0.329 -9.237 0.772 1.00 . A A . 42 HIS NE2 1 1 7 7339 1 1 42 HIS O O 4.432 -5.239 2.618 1.00 . A A . 42 HIS O 1 1 7 7340 1 1 43 VAL C C 7.051 -6.605 3.228 1.00 . A A . 43 VAL C 1 1 7 7341 1 1 43 VAL CA C 6.239 -6.363 4.484 1.00 . A A . 43 VAL CA 1 1 7 7342 1 1 43 VAL CB C 6.853 -7.148 5.660 1.00 . A A . 43 VAL CB 1 1 7 7343 1 1 43 VAL CG1 C 6.651 -8.644 5.476 1.00 . A A . 43 VAL CG1 1 1 7 7344 1 1 43 VAL CG2 C 8.330 -6.818 5.826 1.00 . A A . 43 VAL CG2 1 1 7 7345 1 1 43 VAL H H 4.421 -7.343 4.922 1.00 . A A . 43 VAL H 1 1 7 7346 1 1 43 VAL HA H 6.312 -5.321 4.713 1.00 . A A . 43 VAL HA 1 1 7 7347 1 1 43 VAL HB H 6.340 -6.850 6.560 1.00 . A A . 43 VAL HB 1 1 7 7348 1 1 43 VAL HG11 H 7.271 -8.995 4.666 1.00 . A A . 43 VAL HG11 1 1 7 7349 1 1 43 VAL HG12 H 5.614 -8.841 5.247 1.00 . A A . 43 VAL HG12 1 1 7 7350 1 1 43 VAL HG13 H 6.920 -9.158 6.386 1.00 . A A . 43 VAL HG13 1 1 7 7351 1 1 43 VAL HG21 H 8.893 -7.266 5.021 1.00 . A A . 43 VAL HG21 1 1 7 7352 1 1 43 VAL HG22 H 8.682 -7.208 6.770 1.00 . A A . 43 VAL HG22 1 1 7 7353 1 1 43 VAL HG23 H 8.464 -5.747 5.806 1.00 . A A . 43 VAL HG23 1 1 7 7354 1 1 43 VAL N N 4.828 -6.673 4.327 1.00 . A A . 43 VAL N 1 1 7 7355 1 1 43 VAL O O 7.832 -7.552 3.140 1.00 . A A . 43 VAL O 1 1 7 7356 1 1 44 ALA C C 8.846 -4.913 1.181 1.00 . A A . 44 ALA C 1 1 7 7357 1 1 44 ALA CA C 7.614 -5.790 1.025 1.00 . A A . 44 ALA CA 1 1 7 7358 1 1 44 ALA CB C 6.765 -5.344 -0.156 1.00 . A A . 44 ALA CB 1 1 7 7359 1 1 44 ALA H H 6.165 -5.049 2.361 1.00 . A A . 44 ALA H 1 1 7 7360 1 1 44 ALA HA H 7.927 -6.811 0.867 1.00 . A A . 44 ALA HA 1 1 7 7361 1 1 44 ALA HB1 H 7.348 -5.402 -1.062 1.00 . A A . 44 ALA HB1 1 1 7 7362 1 1 44 ALA HB2 H 6.440 -4.326 -0.001 1.00 . A A . 44 ALA HB2 1 1 7 7363 1 1 44 ALA HB3 H 5.902 -5.988 -0.241 1.00 . A A . 44 ALA HB3 1 1 7 7364 1 1 44 ALA N N 6.854 -5.737 2.253 1.00 . A A . 44 ALA N 1 1 7 7365 1 1 44 ALA O O 9.128 -4.051 0.348 1.00 . A A . 44 ALA O 1 1 7 7366 1 1 45 GLU C C 11.677 -4.261 1.369 1.00 . A A . 45 GLU C 1 1 7 7367 1 1 45 GLU CA C 10.780 -4.386 2.587 1.00 . A A . 45 GLU CA 1 1 7 7368 1 1 45 GLU CB C 11.547 -5.050 3.735 1.00 . A A . 45 GLU CB 1 1 7 7369 1 1 45 GLU CD C 13.579 -5.012 5.234 1.00 . A A . 45 GLU CD 1 1 7 7370 1 1 45 GLU CG C 12.831 -4.329 4.105 1.00 . A A . 45 GLU CG 1 1 7 7371 1 1 45 GLU H H 9.307 -5.875 2.868 1.00 . A A . 45 GLU H 1 1 7 7372 1 1 45 GLU HA H 10.473 -3.399 2.896 1.00 . A A . 45 GLU HA 1 1 7 7373 1 1 45 GLU HB2 H 10.910 -5.078 4.608 1.00 . A A . 45 GLU HB2 1 1 7 7374 1 1 45 GLU HB3 H 11.795 -6.062 3.449 1.00 . A A . 45 GLU HB3 1 1 7 7375 1 1 45 GLU HG2 H 13.474 -4.296 3.238 1.00 . A A . 45 GLU HG2 1 1 7 7376 1 1 45 GLU HG3 H 12.589 -3.322 4.411 1.00 . A A . 45 GLU HG3 1 1 7 7377 1 1 45 GLU N N 9.577 -5.151 2.270 1.00 . A A . 45 GLU N 1 1 7 7378 1 1 45 GLU O O 12.462 -3.323 1.256 1.00 . A A . 45 GLU O 1 1 7 7379 1 1 45 GLU OE1 O 14.355 -5.948 4.950 1.00 . A A . 45 GLU OE1 1 1 7 7380 1 1 45 GLU OE2 O 13.386 -4.612 6.401 1.00 . A A . 45 GLU OE2 1 1 7 7381 1 1 46 ASP C C 11.889 -4.060 -1.650 1.00 . A A . 46 ASP C 1 1 7 7382 1 1 46 ASP CA C 12.348 -5.198 -0.759 1.00 . A A . 46 ASP CA 1 1 7 7383 1 1 46 ASP CB C 12.221 -6.527 -1.495 1.00 . A A . 46 ASP CB 1 1 7 7384 1 1 46 ASP CG C 13.048 -6.568 -2.765 1.00 . A A . 46 ASP CG 1 1 7 7385 1 1 46 ASP H H 10.934 -5.958 0.627 1.00 . A A . 46 ASP H 1 1 7 7386 1 1 46 ASP HA H 13.382 -5.032 -0.497 1.00 . A A . 46 ASP HA 1 1 7 7387 1 1 46 ASP HB2 H 12.552 -7.320 -0.845 1.00 . A A . 46 ASP HB2 1 1 7 7388 1 1 46 ASP HB3 H 11.187 -6.685 -1.753 1.00 . A A . 46 ASP HB3 1 1 7 7389 1 1 46 ASP N N 11.561 -5.218 0.465 1.00 . A A . 46 ASP N 1 1 7 7390 1 1 46 ASP O O 12.699 -3.374 -2.261 1.00 . A A . 46 ASP O 1 1 7 7391 1 1 46 ASP OD1 O 14.284 -6.712 -2.664 1.00 . A A . 46 ASP OD1 1 1 7 7392 1 1 46 ASP OD2 O 12.459 -6.454 -3.860 1.00 . A A . 46 ASP OD2 1 1 7 7393 1 1 47 VAL C C 10.438 -1.438 -1.928 1.00 . A A . 47 VAL C 1 1 7 7394 1 1 47 VAL CA C 10.028 -2.783 -2.516 1.00 . A A . 47 VAL CA 1 1 7 7395 1 1 47 VAL CB C 8.492 -2.869 -2.583 1.00 . A A . 47 VAL CB 1 1 7 7396 1 1 47 VAL CG1 C 7.924 -1.721 -3.403 1.00 . A A . 47 VAL CG1 1 1 7 7397 1 1 47 VAL CG2 C 8.059 -4.208 -3.162 1.00 . A A . 47 VAL CG2 1 1 7 7398 1 1 47 VAL H H 9.979 -4.437 -1.200 1.00 . A A . 47 VAL H 1 1 7 7399 1 1 47 VAL HA H 10.425 -2.869 -3.518 1.00 . A A . 47 VAL HA 1 1 7 7400 1 1 47 VAL HB H 8.104 -2.795 -1.578 1.00 . A A . 47 VAL HB 1 1 7 7401 1 1 47 VAL HG11 H 8.278 -0.782 -3.005 1.00 . A A . 47 VAL HG11 1 1 7 7402 1 1 47 VAL HG12 H 6.844 -1.747 -3.359 1.00 . A A . 47 VAL HG12 1 1 7 7403 1 1 47 VAL HG13 H 8.244 -1.821 -4.429 1.00 . A A . 47 VAL HG13 1 1 7 7404 1 1 47 VAL HG21 H 8.487 -5.008 -2.577 1.00 . A A . 47 VAL HG21 1 1 7 7405 1 1 47 VAL HG22 H 8.399 -4.286 -4.183 1.00 . A A . 47 VAL HG22 1 1 7 7406 1 1 47 VAL HG23 H 6.981 -4.279 -3.135 1.00 . A A . 47 VAL HG23 1 1 7 7407 1 1 47 VAL N N 10.582 -3.857 -1.712 1.00 . A A . 47 VAL N 1 1 7 7408 1 1 47 VAL O O 10.898 -0.568 -2.633 1.00 . A A . 47 VAL O 1 1 7 7409 1 1 48 ALA C C 12.101 0.103 0.232 1.00 . A A . 48 ALA C 1 1 7 7410 1 1 48 ALA CA C 10.602 -0.157 0.196 1.00 . A A . 48 ALA CA 1 1 7 7411 1 1 48 ALA CB C 10.086 -0.359 1.614 1.00 . A A . 48 ALA CB 1 1 7 7412 1 1 48 ALA H H 9.938 -2.092 -0.171 1.00 . A A . 48 ALA H 1 1 7 7413 1 1 48 ALA HA H 10.097 0.701 -0.213 1.00 . A A . 48 ALA HA 1 1 7 7414 1 1 48 ALA HB1 H 10.290 0.524 2.201 1.00 . A A . 48 ALA HB1 1 1 7 7415 1 1 48 ALA HB2 H 10.580 -1.210 2.058 1.00 . A A . 48 ALA HB2 1 1 7 7416 1 1 48 ALA HB3 H 9.020 -0.535 1.587 1.00 . A A . 48 ALA HB3 1 1 7 7417 1 1 48 ALA N N 10.280 -1.336 -0.614 1.00 . A A . 48 ALA N 1 1 7 7418 1 1 48 ALA O O 12.558 1.198 -0.098 1.00 . A A . 48 ALA O 1 1 7 7419 1 1 49 LYS C C 14.867 -0.472 -0.678 1.00 . A A . 49 LYS C 1 1 7 7420 1 1 49 LYS CA C 14.317 -0.774 0.706 1.00 . A A . 49 LYS CA 1 1 7 7421 1 1 49 LYS CB C 14.955 -2.048 1.267 1.00 . A A . 49 LYS CB 1 1 7 7422 1 1 49 LYS CD C 15.317 -1.087 3.559 1.00 . A A . 49 LYS CD 1 1 7 7423 1 1 49 LYS CE C 15.187 -1.320 5.056 1.00 . A A . 49 LYS CE 1 1 7 7424 1 1 49 LYS CG C 14.724 -2.235 2.758 1.00 . A A . 49 LYS CG 1 1 7 7425 1 1 49 LYS H H 12.451 -1.766 0.871 1.00 . A A . 49 LYS H 1 1 7 7426 1 1 49 LYS HA H 14.542 0.055 1.360 1.00 . A A . 49 LYS HA 1 1 7 7427 1 1 49 LYS HB2 H 14.544 -2.902 0.750 1.00 . A A . 49 LYS HB2 1 1 7 7428 1 1 49 LYS HB3 H 16.019 -2.010 1.091 1.00 . A A . 49 LYS HB3 1 1 7 7429 1 1 49 LYS HD2 H 16.365 -0.991 3.311 1.00 . A A . 49 LYS HD2 1 1 7 7430 1 1 49 LYS HD3 H 14.799 -0.174 3.299 1.00 . A A . 49 LYS HD3 1 1 7 7431 1 1 49 LYS HE2 H 14.141 -1.436 5.300 1.00 . A A . 49 LYS HE2 1 1 7 7432 1 1 49 LYS HE3 H 15.719 -2.223 5.314 1.00 . A A . 49 LYS HE3 1 1 7 7433 1 1 49 LYS HG2 H 13.663 -2.281 2.947 1.00 . A A . 49 LYS HG2 1 1 7 7434 1 1 49 LYS HG3 H 15.189 -3.159 3.072 1.00 . A A . 49 LYS HG3 1 1 7 7435 1 1 49 LYS HZ1 H 16.746 -0.041 5.603 1.00 . A A . 49 LYS HZ1 1 1 7 7436 1 1 49 LYS HZ2 H 15.671 -0.389 6.863 1.00 . A A . 49 LYS HZ2 1 1 7 7437 1 1 49 LYS HZ3 H 15.219 0.686 5.638 1.00 . A A . 49 LYS HZ3 1 1 7 7438 1 1 49 LYS N N 12.868 -0.908 0.635 1.00 . A A . 49 LYS N 1 1 7 7439 1 1 49 LYS NZ N 15.744 -0.186 5.845 1.00 . A A . 49 LYS NZ 1 1 7 7440 1 1 49 LYS O O 15.876 0.214 -0.833 1.00 . A A . 49 LYS O 1 1 7 7441 1 1 50 ASP C C 13.841 0.418 -3.644 1.00 . A A . 50 ASP C 1 1 7 7442 1 1 50 ASP CA C 14.582 -0.789 -3.066 1.00 . A A . 50 ASP CA 1 1 7 7443 1 1 50 ASP CB C 14.291 -2.038 -3.899 1.00 . A A . 50 ASP CB 1 1 7 7444 1 1 50 ASP CG C 15.083 -2.069 -5.191 1.00 . A A . 50 ASP CG 1 1 7 7445 1 1 50 ASP H H 13.406 -1.553 -1.492 1.00 . A A . 50 ASP H 1 1 7 7446 1 1 50 ASP HA H 15.643 -0.590 -3.087 1.00 . A A . 50 ASP HA 1 1 7 7447 1 1 50 ASP HB2 H 14.541 -2.916 -3.318 1.00 . A A . 50 ASP HB2 1 1 7 7448 1 1 50 ASP HB3 H 13.238 -2.061 -4.142 1.00 . A A . 50 ASP HB3 1 1 7 7449 1 1 50 ASP N N 14.195 -1.008 -1.685 1.00 . A A . 50 ASP N 1 1 7 7450 1 1 50 ASP O O 14.178 0.903 -4.723 1.00 . A A . 50 ASP O 1 1 7 7451 1 1 50 ASP OD1 O 16.261 -2.483 -5.156 1.00 . A A . 50 ASP OD1 1 1 7 7452 1 1 50 ASP OD2 O 14.527 -1.677 -6.238 1.00 . A A . 50 ASP OD2 1 1 7 7453 1 1 51 TYR C C 12.721 3.336 -2.991 1.00 . A A . 51 TYR C 1 1 7 7454 1 1 51 TYR CA C 12.043 2.033 -3.372 1.00 . A A . 51 TYR CA 1 1 7 7455 1 1 51 TYR CB C 10.633 2.023 -2.794 1.00 . A A . 51 TYR CB 1 1 7 7456 1 1 51 TYR CD1 C 9.944 0.638 -4.805 1.00 . A A . 51 TYR CD1 1 1 7 7457 1 1 51 TYR CD2 C 8.225 1.709 -3.545 1.00 . A A . 51 TYR CD2 1 1 7 7458 1 1 51 TYR CE1 C 8.992 0.107 -5.654 1.00 . A A . 51 TYR CE1 1 1 7 7459 1 1 51 TYR CE2 C 7.270 1.182 -4.392 1.00 . A A . 51 TYR CE2 1 1 7 7460 1 1 51 TYR CG C 9.581 1.449 -3.733 1.00 . A A . 51 TYR CG 1 1 7 7461 1 1 51 TYR CZ C 7.654 0.413 -5.458 1.00 . A A . 51 TYR CZ 1 1 7 7462 1 1 51 TYR H H 12.596 0.481 -2.074 1.00 . A A . 51 TYR H 1 1 7 7463 1 1 51 TYR HA H 11.966 1.941 -4.421 1.00 . A A . 51 TYR HA 1 1 7 7464 1 1 51 TYR HB2 H 10.642 1.438 -1.904 1.00 . A A . 51 TYR HB2 1 1 7 7465 1 1 51 TYR HB3 H 10.345 3.035 -2.551 1.00 . A A . 51 TYR HB3 1 1 7 7466 1 1 51 TYR HD1 H 10.987 0.425 -4.974 1.00 . A A . 51 TYR HD1 1 1 7 7467 1 1 51 TYR HD2 H 7.919 2.339 -2.725 1.00 . A A . 51 TYR HD2 1 1 7 7468 1 1 51 TYR HE1 H 9.295 -0.519 -6.481 1.00 . A A . 51 TYR HE1 1 1 7 7469 1 1 51 TYR HE2 H 6.224 1.398 -4.227 1.00 . A A . 51 TYR HE2 1 1 7 7470 1 1 51 TYR HH H 6.898 -1.073 -6.443 1.00 . A A . 51 TYR HH 1 1 7 7471 1 1 51 TYR N N 12.824 0.898 -2.920 1.00 . A A . 51 TYR N 1 1 7 7472 1 1 51 TYR O O 13.132 4.119 -3.847 1.00 . A A . 51 TYR O 1 1 7 7473 1 1 51 TYR OH O 6.707 -0.145 -6.285 1.00 . A A . 51 TYR OH 1 1 7 7474 1 1 52 GLU C C 14.959 4.580 -1.022 1.00 . A A . 52 GLU C 1 1 7 7475 1 1 52 GLU CA C 13.451 4.758 -1.153 1.00 . A A . 52 GLU CA 1 1 7 7476 1 1 52 GLU CB C 12.852 5.108 0.212 1.00 . A A . 52 GLU CB 1 1 7 7477 1 1 52 GLU CD C 12.640 4.509 2.660 1.00 . A A . 52 GLU CD 1 1 7 7478 1 1 52 GLU CG C 13.272 4.161 1.326 1.00 . A A . 52 GLU CG 1 1 7 7479 1 1 52 GLU H H 12.503 2.870 -1.059 1.00 . A A . 52 GLU H 1 1 7 7480 1 1 52 GLU HA H 13.247 5.558 -1.842 1.00 . A A . 52 GLU HA 1 1 7 7481 1 1 52 GLU HB2 H 13.163 6.107 0.483 1.00 . A A . 52 GLU HB2 1 1 7 7482 1 1 52 GLU HB3 H 11.774 5.084 0.136 1.00 . A A . 52 GLU HB3 1 1 7 7483 1 1 52 GLU HG2 H 12.979 3.157 1.059 1.00 . A A . 52 GLU HG2 1 1 7 7484 1 1 52 GLU HG3 H 14.346 4.206 1.433 1.00 . A A . 52 GLU HG3 1 1 7 7485 1 1 52 GLU N N 12.836 3.551 -1.683 1.00 . A A . 52 GLU N 1 1 7 7486 1 1 52 GLU O O 15.737 5.446 -1.420 1.00 . A A . 52 GLU O 1 1 7 7487 1 1 52 GLU OE1 O 12.993 5.566 3.225 1.00 . A A . 52 GLU OE1 1 1 7 7488 1 1 52 GLU OE2 O 11.796 3.724 3.140 1.00 . A A . 52 GLU OE2 1 1 7 7489 1 1 53 ASP C C 17.401 2.581 -1.531 1.00 . A A . 53 ASP C 1 1 7 7490 1 1 53 ASP CA C 16.765 3.136 -0.259 1.00 . A A . 53 ASP CA 1 1 7 7491 1 1 53 ASP CB C 16.912 2.136 0.888 1.00 . A A . 53 ASP CB 1 1 7 7492 1 1 53 ASP CG C 17.008 2.817 2.240 1.00 . A A . 53 ASP CG 1 1 7 7493 1 1 53 ASP H H 14.682 2.796 -0.172 1.00 . A A . 53 ASP H 1 1 7 7494 1 1 53 ASP HA H 17.270 4.052 0.008 1.00 . A A . 53 ASP HA 1 1 7 7495 1 1 53 ASP HB2 H 16.047 1.487 0.899 1.00 . A A . 53 ASP HB2 1 1 7 7496 1 1 53 ASP HB3 H 17.803 1.545 0.735 1.00 . A A . 53 ASP HB3 1 1 7 7497 1 1 53 ASP N N 15.356 3.446 -0.460 1.00 . A A . 53 ASP N 1 1 7 7498 1 1 53 ASP O O 18.621 2.617 -1.690 1.00 . A A . 53 ASP O 1 1 7 7499 1 1 53 ASP OD1 O 18.065 3.416 2.530 1.00 . A A . 53 ASP OD1 1 1 7 7500 1 1 53 ASP OD2 O 16.027 2.751 3.009 1.00 . A A . 53 ASP OD2 1 1 7 7501 1 1 54 GLY C C 17.589 2.597 -4.615 1.00 . A A . 54 GLY C 1 1 7 7502 1 1 54 GLY CA C 17.081 1.519 -3.678 1.00 . A A . 54 GLY CA 1 1 7 7503 1 1 54 GLY H H 15.609 2.058 -2.255 1.00 . A A . 54 GLY H 1 1 7 7504 1 1 54 GLY HA2 H 17.889 0.839 -3.455 1.00 . A A . 54 GLY HA2 1 1 7 7505 1 1 54 GLY HA3 H 16.291 0.974 -4.171 1.00 . A A . 54 GLY HA3 1 1 7 7506 1 1 54 GLY N N 16.571 2.067 -2.433 1.00 . A A . 54 GLY N 1 1 7 7507 1 1 54 GLY O O 18.632 2.438 -5.250 1.00 . A A . 54 GLY O 1 1 7 7508 1 1 55 LEU C C 18.364 5.610 -4.933 1.00 . A A . 55 LEU C 1 1 7 7509 1 1 55 LEU CA C 17.231 4.811 -5.562 1.00 . A A . 55 LEU CA 1 1 7 7510 1 1 55 LEU CB C 16.028 5.722 -5.817 1.00 . A A . 55 LEU CB 1 1 7 7511 1 1 55 LEU CD1 C 16.803 6.572 -8.046 1.00 . A A . 55 LEU CD1 1 1 7 7512 1 1 55 LEU CD2 C 15.082 7.846 -6.754 1.00 . A A . 55 LEU CD2 1 1 7 7513 1 1 55 LEU CG C 16.319 6.965 -6.658 1.00 . A A . 55 LEU CG 1 1 7 7514 1 1 55 LEU H H 16.026 3.762 -4.174 1.00 . A A . 55 LEU H 1 1 7 7515 1 1 55 LEU HA H 17.569 4.403 -6.503 1.00 . A A . 55 LEU HA 1 1 7 7516 1 1 55 LEU HB2 H 15.266 5.143 -6.318 1.00 . A A . 55 LEU HB2 1 1 7 7517 1 1 55 LEU HB3 H 15.640 6.045 -4.861 1.00 . A A . 55 LEU HB3 1 1 7 7518 1 1 55 LEU HD11 H 16.996 7.463 -8.626 1.00 . A A . 55 LEU HD11 1 1 7 7519 1 1 55 LEU HD12 H 16.044 5.981 -8.538 1.00 . A A . 55 LEU HD12 1 1 7 7520 1 1 55 LEU HD13 H 17.710 5.993 -7.961 1.00 . A A . 55 LEU HD13 1 1 7 7521 1 1 55 LEU HD21 H 15.308 8.719 -7.349 1.00 . A A . 55 LEU HD21 1 1 7 7522 1 1 55 LEU HD22 H 14.781 8.152 -5.764 1.00 . A A . 55 LEU HD22 1 1 7 7523 1 1 55 LEU HD23 H 14.281 7.290 -7.220 1.00 . A A . 55 LEU HD23 1 1 7 7524 1 1 55 LEU HG H 17.103 7.538 -6.183 1.00 . A A . 55 LEU HG 1 1 7 7525 1 1 55 LEU N N 16.849 3.698 -4.701 1.00 . A A . 55 LEU N 1 1 7 7526 1 1 55 LEU O O 19.468 5.676 -5.475 1.00 . A A . 55 LEU O 1 1 7 7527 1 1 56 GLU C C 19.901 6.132 -2.138 1.00 . A A . 56 GLU C 1 1 7 7528 1 1 56 GLU CA C 19.082 7.008 -3.078 1.00 . A A . 56 GLU CA 1 1 7 7529 1 1 56 GLU CB C 18.414 8.134 -2.293 1.00 . A A . 56 GLU CB 1 1 7 7530 1 1 56 GLU CD C 16.998 10.225 -2.360 1.00 . A A . 56 GLU CD 1 1 7 7531 1 1 56 GLU CG C 17.653 9.119 -3.165 1.00 . A A . 56 GLU CG 1 1 7 7532 1 1 56 GLU H H 17.187 6.128 -3.402 1.00 . A A . 56 GLU H 1 1 7 7533 1 1 56 GLU HA H 19.741 7.439 -3.811 1.00 . A A . 56 GLU HA 1 1 7 7534 1 1 56 GLU HB2 H 17.723 7.698 -1.592 1.00 . A A . 56 GLU HB2 1 1 7 7535 1 1 56 GLU HB3 H 19.172 8.677 -1.749 1.00 . A A . 56 GLU HB3 1 1 7 7536 1 1 56 GLU HG2 H 18.342 9.565 -3.867 1.00 . A A . 56 GLU HG2 1 1 7 7537 1 1 56 GLU HG3 H 16.886 8.584 -3.706 1.00 . A A . 56 GLU HG3 1 1 7 7538 1 1 56 GLU N N 18.085 6.216 -3.784 1.00 . A A . 56 GLU N 1 1 7 7539 1 1 56 GLU O O 19.907 6.336 -0.925 1.00 . A A . 56 GLU O 1 1 7 7540 1 1 56 GLU OE1 O 17.658 11.259 -2.125 1.00 . A A . 56 GLU OE1 1 1 7 7541 1 1 56 GLU OE2 O 15.825 10.057 -1.963 1.00 . A A . 56 GLU OE2 1 1 7 7542 1 1 57 TYR C C 22.796 4.838 -1.676 1.00 . A A . 57 TYR C 1 1 7 7543 1 1 57 TYR CA C 21.418 4.238 -1.937 1.00 . A A . 57 TYR CA 1 1 7 7544 1 1 57 TYR CB C 21.562 2.904 -2.670 1.00 . A A . 57 TYR CB 1 1 7 7545 1 1 57 TYR CD1 C 22.016 1.048 -1.021 1.00 . A A . 57 TYR CD1 1 1 7 7546 1 1 57 TYR CD2 C 23.844 1.895 -2.295 1.00 . A A . 57 TYR CD2 1 1 7 7547 1 1 57 TYR CE1 C 22.862 0.158 -0.390 1.00 . A A . 57 TYR CE1 1 1 7 7548 1 1 57 TYR CE2 C 24.698 1.006 -1.669 1.00 . A A . 57 TYR CE2 1 1 7 7549 1 1 57 TYR CG C 22.491 1.931 -1.983 1.00 . A A . 57 TYR CG 1 1 7 7550 1 1 57 TYR CZ C 24.202 0.140 -0.718 1.00 . A A . 57 TYR CZ 1 1 7 7551 1 1 57 TYR H H 20.538 5.042 -3.684 1.00 . A A . 57 TYR H 1 1 7 7552 1 1 57 TYR HA H 20.927 4.068 -0.990 1.00 . A A . 57 TYR HA 1 1 7 7553 1 1 57 TYR HB2 H 20.591 2.437 -2.748 1.00 . A A . 57 TYR HB2 1 1 7 7554 1 1 57 TYR HB3 H 21.947 3.088 -3.662 1.00 . A A . 57 TYR HB3 1 1 7 7555 1 1 57 TYR HD1 H 20.966 1.065 -0.768 1.00 . A A . 57 TYR HD1 1 1 7 7556 1 1 57 TYR HD2 H 24.230 2.575 -3.041 1.00 . A A . 57 TYR HD2 1 1 7 7557 1 1 57 TYR HE1 H 22.473 -0.521 0.355 1.00 . A A . 57 TYR HE1 1 1 7 7558 1 1 57 TYR HE2 H 25.747 0.994 -1.925 1.00 . A A . 57 TYR HE2 1 1 7 7559 1 1 57 TYR HH H 24.632 -1.610 -0.052 1.00 . A A . 57 TYR HH 1 1 7 7560 1 1 57 TYR N N 20.590 5.153 -2.712 1.00 . A A . 57 TYR N 1 1 7 7561 1 1 57 TYR O O 23.699 4.630 -2.513 1.00 . A A . 57 TYR O 1 1 7 7562 1 1 57 TYR OXT O 22.960 5.513 -0.638 1.00 . A A . 57 TYR OXT 1 1 7 7563 1 1 57 TYR OH O 25.047 -0.745 -0.091 1.00 . A A . 57 TYR OH 1 1 7 7564 2 2 1 ALA C C -11.650 -7.895 0.234 1.00 . B B . 1 ALA C 1 1 7 7565 2 2 1 ALA CA C -11.677 -8.996 1.297 1.00 . B B . 1 ALA CA 1 1 7 7566 2 2 1 ALA CB C -10.621 -10.048 0.991 1.00 . B B . 1 ALA CB 1 1 7 7567 2 2 1 ALA H1 H -13.202 -9.905 2.394 1.00 . B B . 1 ALA H1 1 1 7 7568 2 2 1 ALA H2 H -13.065 -10.478 0.811 1.00 . B B . 1 ALA H2 1 1 7 7569 2 2 1 ALA H3 H -13.757 -8.962 1.102 1.00 . B B . 1 ALA H3 1 1 7 7570 2 2 1 ALA HA H -11.436 -8.555 2.253 1.00 . B B . 1 ALA HA 1 1 7 7571 2 2 1 ALA HB1 H -9.650 -9.579 0.949 1.00 . B B . 1 ALA HB1 1 1 7 7572 2 2 1 ALA HB2 H -10.837 -10.511 0.041 1.00 . B B . 1 ALA HB2 1 1 7 7573 2 2 1 ALA HB3 H -10.625 -10.798 1.767 1.00 . B B . 1 ALA HB3 1 1 7 7574 2 2 1 ALA N N -13.019 -9.628 1.408 1.00 . B B . 1 ALA N 1 1 7 7575 2 2 1 ALA O O -11.115 -6.813 0.477 1.00 . B B . 1 ALA O 1 1 7 7576 2 2 2 PRO C C -12.611 -5.755 -1.571 1.00 . B B . 2 PRO C 1 1 7 7577 2 2 2 PRO CA C -12.241 -7.161 -2.043 1.00 . B B . 2 PRO CA 1 1 7 7578 2 2 2 PRO CB C -13.303 -7.704 -2.996 1.00 . B B . 2 PRO CB 1 1 7 7579 2 2 2 PRO CD C -12.902 -9.399 -1.344 1.00 . B B . 2 PRO CD 1 1 7 7580 2 2 2 PRO CG C -13.273 -9.179 -2.789 1.00 . B B . 2 PRO CG 1 1 7 7581 2 2 2 PRO HA H -11.290 -7.122 -2.553 1.00 . B B . 2 PRO HA 1 1 7 7582 2 2 2 PRO HB2 H -14.267 -7.284 -2.746 1.00 . B B . 2 PRO HB2 1 1 7 7583 2 2 2 PRO HB3 H -13.045 -7.444 -4.011 1.00 . B B . 2 PRO HB3 1 1 7 7584 2 2 2 PRO HD2 H -13.790 -9.555 -0.749 1.00 . B B . 2 PRO HD2 1 1 7 7585 2 2 2 PRO HD3 H -12.236 -10.243 -1.255 1.00 . B B . 2 PRO HD3 1 1 7 7586 2 2 2 PRO HG2 H -14.249 -9.597 -2.992 1.00 . B B . 2 PRO HG2 1 1 7 7587 2 2 2 PRO HG3 H -12.533 -9.624 -3.436 1.00 . B B . 2 PRO HG3 1 1 7 7588 2 2 2 PRO N N -12.223 -8.146 -0.959 1.00 . B B . 2 PRO N 1 1 7 7589 2 2 2 PRO O O -11.985 -4.775 -1.980 1.00 . B B . 2 PRO O 1 1 7 7590 2 2 3 PRO C C -13.146 -3.793 0.884 1.00 . B B . 3 PRO C 1 1 7 7591 2 2 3 PRO CA C -14.082 -4.335 -0.191 1.00 . B B . 3 PRO CA 1 1 7 7592 2 2 3 PRO CB C -15.466 -4.635 0.409 1.00 . B B . 3 PRO CB 1 1 7 7593 2 2 3 PRO CD C -14.436 -6.723 -0.156 1.00 . B B . 3 PRO CD 1 1 7 7594 2 2 3 PRO CG C -15.763 -6.063 0.072 1.00 . B B . 3 PRO CG 1 1 7 7595 2 2 3 PRO HA H -14.179 -3.607 -0.982 1.00 . B B . 3 PRO HA 1 1 7 7596 2 2 3 PRO HB2 H -15.433 -4.486 1.479 1.00 . B B . 3 PRO HB2 1 1 7 7597 2 2 3 PRO HB3 H -16.197 -3.969 -0.025 1.00 . B B . 3 PRO HB3 1 1 7 7598 2 2 3 PRO HD2 H -14.022 -7.074 0.779 1.00 . B B . 3 PRO HD2 1 1 7 7599 2 2 3 PRO HD3 H -14.527 -7.534 -0.862 1.00 . B B . 3 PRO HD3 1 1 7 7600 2 2 3 PRO HG2 H -16.280 -6.534 0.893 1.00 . B B . 3 PRO HG2 1 1 7 7601 2 2 3 PRO HG3 H -16.363 -6.109 -0.826 1.00 . B B . 3 PRO HG3 1 1 7 7602 2 2 3 PRO N N -13.634 -5.630 -0.707 1.00 . B B . 3 PRO N 1 1 7 7603 2 2 3 PRO O O -12.989 -4.399 1.944 1.00 . B B . 3 PRO O 1 1 7 7604 2 2 4 GLY C C -10.159 -2.342 1.239 1.00 . B B . 4 GLY C 1 1 7 7605 2 2 4 GLY CA C -11.613 -2.056 1.563 1.00 . B B . 4 GLY CA 1 1 7 7606 2 2 4 GLY H H -12.692 -2.210 -0.253 1.00 . B B . 4 GLY H 1 1 7 7607 2 2 4 GLY HA2 H -11.767 -0.988 1.581 1.00 . B B . 4 GLY HA2 1 1 7 7608 2 2 4 GLY HA3 H -11.833 -2.454 2.542 1.00 . B B . 4 GLY HA3 1 1 7 7609 2 2 4 GLY N N -12.527 -2.650 0.606 1.00 . B B . 4 GLY N 1 1 7 7610 2 2 4 GLY O O -9.278 -2.113 2.068 1.00 . B B . 4 GLY O 1 1 7 7611 2 2 5 THR C C -8.349 -3.058 -1.887 1.00 . B B . 5 THR C 1 1 7 7612 2 2 5 THR CA C -8.537 -3.169 -0.378 1.00 . B B . 5 THR CA 1 1 7 7613 2 2 5 THR CB C -8.138 -4.588 0.078 1.00 . B B . 5 THR CB 1 1 7 7614 2 2 5 THR CG2 C -6.718 -4.922 -0.359 1.00 . B B . 5 THR CG2 1 1 7 7615 2 2 5 THR H H -10.634 -2.973 -0.600 1.00 . B B . 5 THR H 1 1 7 7616 2 2 5 THR HA H -7.879 -2.466 0.100 1.00 . B B . 5 THR HA 1 1 7 7617 2 2 5 THR HB H -8.815 -5.299 -0.372 1.00 . B B . 5 THR HB 1 1 7 7618 2 2 5 THR HG1 H -9.160 -4.704 1.762 1.00 . B B . 5 THR HG1 1 1 7 7619 2 2 5 THR HG21 H -6.035 -4.190 0.043 1.00 . B B . 5 THR HG21 1 1 7 7620 2 2 5 THR HG22 H -6.663 -4.912 -1.437 1.00 . B B . 5 THR HG22 1 1 7 7621 2 2 5 THR HG23 H -6.451 -5.903 0.006 1.00 . B B . 5 THR HG23 1 1 7 7622 2 2 5 THR N N -9.900 -2.843 0.032 1.00 . B B . 5 THR N 1 1 7 7623 2 2 5 THR O O -9.303 -3.176 -2.655 1.00 . B B . 5 THR O 1 1 7 7624 2 2 5 THR OG1 O -8.235 -4.688 1.504 1.00 . B B . 5 THR OG1 1 1 7 7625 2 2 6 ALA C C -5.269 -2.662 -3.950 1.00 . B B . 6 ALA C 1 1 7 7626 2 2 6 ALA CA C -6.778 -2.705 -3.718 1.00 . B B . 6 ALA CA 1 1 7 7627 2 2 6 ALA CB C -7.427 -1.464 -4.301 1.00 . B B . 6 ALA CB 1 1 7 7628 2 2 6 ALA H H -6.388 -2.737 -1.639 1.00 . B B . 6 ALA H 1 1 7 7629 2 2 6 ALA HA H -7.185 -3.566 -4.228 1.00 . B B . 6 ALA HA 1 1 7 7630 2 2 6 ALA HB1 H -8.294 -1.199 -3.714 1.00 . B B . 6 ALA HB1 1 1 7 7631 2 2 6 ALA HB2 H -7.725 -1.658 -5.320 1.00 . B B . 6 ALA HB2 1 1 7 7632 2 2 6 ALA HB3 H -6.715 -0.654 -4.283 1.00 . B B . 6 ALA HB3 1 1 7 7633 2 2 6 ALA N N -7.103 -2.827 -2.302 1.00 . B B . 6 ALA N 1 1 7 7634 2 2 6 ALA O O -4.775 -1.808 -4.687 1.00 . B B . 6 ALA O 1 1 7 7635 2 2 7 ARG C C -2.704 -3.557 -4.956 1.00 . B B . 7 ARG C 1 1 7 7636 2 2 7 ARG CA C -3.080 -3.638 -3.480 1.00 . B B . 7 ARG CA 1 1 7 7637 2 2 7 ARG CB C -2.535 -4.929 -2.865 1.00 . B B . 7 ARG CB 1 1 7 7638 2 2 7 ARG CD C -2.776 -7.415 -2.603 1.00 . B B . 7 ARG CD 1 1 7 7639 2 2 7 ARG CG C -3.230 -6.183 -3.369 1.00 . B B . 7 ARG CG 1 1 7 7640 2 2 7 ARG CZ C -3.240 -9.829 -2.547 1.00 . B B . 7 ARG CZ 1 1 7 7641 2 2 7 ARG H H -4.980 -4.233 -2.742 1.00 . B B . 7 ARG H 1 1 7 7642 2 2 7 ARG HA H -2.654 -2.792 -2.964 1.00 . B B . 7 ARG HA 1 1 7 7643 2 2 7 ARG HB2 H -1.482 -5.008 -3.096 1.00 . B B . 7 ARG HB2 1 1 7 7644 2 2 7 ARG HB3 H -2.658 -4.882 -1.794 1.00 . B B . 7 ARG HB3 1 1 7 7645 2 2 7 ARG HD2 H -1.722 -7.566 -2.779 1.00 . B B . 7 ARG HD2 1 1 7 7646 2 2 7 ARG HD3 H -2.944 -7.248 -1.548 1.00 . B B . 7 ARG HD3 1 1 7 7647 2 2 7 ARG HE H -4.219 -8.505 -3.672 1.00 . B B . 7 ARG HE 1 1 7 7648 2 2 7 ARG HG2 H -4.296 -6.067 -3.246 1.00 . B B . 7 ARG HG2 1 1 7 7649 2 2 7 ARG HG3 H -2.997 -6.316 -4.416 1.00 . B B . 7 ARG HG3 1 1 7 7650 2 2 7 ARG HH11 H -1.739 -9.222 -1.337 1.00 . B B . 7 ARG HH11 1 1 7 7651 2 2 7 ARG HH12 H -2.076 -10.920 -1.306 1.00 . B B . 7 ARG HH12 1 1 7 7652 2 2 7 ARG HH21 H -4.676 -10.740 -3.638 1.00 . B B . 7 ARG HH21 1 1 7 7653 2 2 7 ARG HH22 H -3.746 -11.784 -2.615 1.00 . B B . 7 ARG HH22 1 1 7 7654 2 2 7 ARG N N -4.535 -3.581 -3.322 1.00 . B B . 7 ARG N 1 1 7 7655 2 2 7 ARG NE N -3.501 -8.613 -3.015 1.00 . B B . 7 ARG NE 1 1 7 7656 2 2 7 ARG NH1 N -2.272 -10.005 -1.656 1.00 . B B . 7 ARG NH1 1 1 7 7657 2 2 7 ARG NH2 N -3.946 -10.870 -2.968 1.00 . B B . 7 ARG NH2 1 1 7 7658 2 2 7 ARG O O -3.283 -4.259 -5.785 1.00 . B B . 7 ARG O 1 1 7 7659 2 2 8 ARG C C 0.163 -2.567 -6.897 1.00 . B B . 8 ARG C 1 1 7 7660 2 2 8 ARG CA C -1.348 -2.558 -6.694 1.00 . B B . 8 ARG CA 1 1 7 7661 2 2 8 ARG CB C -1.928 -1.269 -7.271 1.00 . B B . 8 ARG CB 1 1 7 7662 2 2 8 ARG CD C -1.522 1.194 -7.466 1.00 . B B . 8 ARG CD 1 1 7 7663 2 2 8 ARG CG C -1.449 -0.018 -6.557 1.00 . B B . 8 ARG CG 1 1 7 7664 2 2 8 ARG CZ C -3.189 2.162 -8.998 1.00 . B B . 8 ARG CZ 1 1 7 7665 2 2 8 ARG H H -1.284 -2.169 -4.597 1.00 . B B . 8 ARG H 1 1 7 7666 2 2 8 ARG HA H -1.768 -3.391 -7.233 1.00 . B B . 8 ARG HA 1 1 7 7667 2 2 8 ARG HB2 H -1.645 -1.194 -8.311 1.00 . B B . 8 ARG HB2 1 1 7 7668 2 2 8 ARG HB3 H -3.004 -1.308 -7.202 1.00 . B B . 8 ARG HB3 1 1 7 7669 2 2 8 ARG HD2 H -1.141 2.051 -6.932 1.00 . B B . 8 ARG HD2 1 1 7 7670 2 2 8 ARG HD3 H -0.907 1.009 -8.335 1.00 . B B . 8 ARG HD3 1 1 7 7671 2 2 8 ARG HE H -3.620 1.129 -7.346 1.00 . B B . 8 ARG HE 1 1 7 7672 2 2 8 ARG HG2 H -2.073 0.154 -5.693 1.00 . B B . 8 ARG HG2 1 1 7 7673 2 2 8 ARG HG3 H -0.426 -0.162 -6.243 1.00 . B B . 8 ARG HG3 1 1 7 7674 2 2 8 ARG HH11 H -1.266 2.493 -9.528 1.00 . B B . 8 ARG HH11 1 1 7 7675 2 2 8 ARG HH12 H -2.455 3.160 -10.595 1.00 . B B . 8 ARG HH12 1 1 7 7676 2 2 8 ARG HH21 H -5.188 2.008 -8.745 1.00 . B B . 8 ARG HH21 1 1 7 7677 2 2 8 ARG HH22 H -4.683 2.888 -10.149 1.00 . B B . 8 ARG HH22 1 1 7 7678 2 2 8 ARG N N -1.737 -2.703 -5.293 1.00 . B B . 8 ARG N 1 1 7 7679 2 2 8 ARG NE N -2.888 1.473 -7.901 1.00 . B B . 8 ARG NE 1 1 7 7680 2 2 8 ARG NH1 N -2.224 2.645 -9.770 1.00 . B B . 8 ARG NH1 1 1 7 7681 2 2 8 ARG NH2 N -4.458 2.370 -9.324 1.00 . B B . 8 ARG NH2 1 1 7 7682 2 2 8 ARG O O 0.727 -1.608 -7.420 1.00 . B B . 8 ARG O 1 1 7 7683 2 2 9 LYS C C 2.601 -5.255 -6.901 1.00 . B B . 9 LYS C 1 1 7 7684 2 2 9 LYS CA C 2.247 -3.792 -6.672 1.00 . B B . 9 LYS CA 1 1 7 7685 2 2 9 LYS CB C 3.010 -3.259 -5.455 1.00 . B B . 9 LYS CB 1 1 7 7686 2 2 9 LYS CD C 4.279 -1.172 -6.064 1.00 . B B . 9 LYS CD 1 1 7 7687 2 2 9 LYS CE C 4.333 -1.562 -7.534 1.00 . B B . 9 LYS CE 1 1 7 7688 2 2 9 LYS CG C 3.053 -1.742 -5.367 1.00 . B B . 9 LYS CG 1 1 7 7689 2 2 9 LYS H H 0.318 -4.386 -6.082 1.00 . B B . 9 LYS H 1 1 7 7690 2 2 9 LYS HA H 2.521 -3.219 -7.544 1.00 . B B . 9 LYS HA 1 1 7 7691 2 2 9 LYS HB2 H 2.543 -3.634 -4.557 1.00 . B B . 9 LYS HB2 1 1 7 7692 2 2 9 LYS HB3 H 4.026 -3.622 -5.496 1.00 . B B . 9 LYS HB3 1 1 7 7693 2 2 9 LYS HD2 H 4.251 -0.095 -5.993 1.00 . B B . 9 LYS HD2 1 1 7 7694 2 2 9 LYS HD3 H 5.166 -1.542 -5.571 1.00 . B B . 9 LYS HD3 1 1 7 7695 2 2 9 LYS HE2 H 5.241 -1.167 -7.964 1.00 . B B . 9 LYS HE2 1 1 7 7696 2 2 9 LYS HE3 H 4.343 -2.638 -7.609 1.00 . B B . 9 LYS HE3 1 1 7 7697 2 2 9 LYS HG2 H 2.169 -1.337 -5.829 1.00 . B B . 9 LYS HG2 1 1 7 7698 2 2 9 LYS HG3 H 3.079 -1.455 -4.325 1.00 . B B . 9 LYS HG3 1 1 7 7699 2 2 9 LYS HZ1 H 2.281 -1.309 -7.834 1.00 . B B . 9 LYS HZ1 1 1 7 7700 2 2 9 LYS HZ2 H 3.175 -1.405 -9.267 1.00 . B B . 9 LYS HZ2 1 1 7 7701 2 2 9 LYS HZ3 H 3.215 0.008 -8.340 1.00 . B B . 9 LYS HZ3 1 1 7 7702 2 2 9 LYS N N 0.813 -3.655 -6.499 1.00 . B B . 9 LYS N 1 1 7 7703 2 2 9 LYS NZ N 3.169 -1.030 -8.296 1.00 . B B . 9 LYS NZ 1 1 7 7704 2 2 9 LYS O O 1.720 -6.114 -6.924 1.00 . B B . 9 LYS O 1 1 7 7705 2 2 10 ARG C C 4.024 -7.747 -6.037 1.00 . B B . 10 ARG C 1 1 7 7706 2 2 10 ARG CA C 4.324 -6.911 -7.276 1.00 . B B . 10 ARG CA 1 1 7 7707 2 2 10 ARG CB C 5.820 -6.927 -7.549 1.00 . B B . 10 ARG CB 1 1 7 7708 2 2 10 ARG CD C 8.033 -6.474 -6.455 1.00 . B B . 10 ARG CD 1 1 7 7709 2 2 10 ARG CG C 6.585 -6.040 -6.589 1.00 . B B . 10 ARG CG 1 1 7 7710 2 2 10 ARG CZ C 9.999 -6.734 -7.913 1.00 . B B . 10 ARG CZ 1 1 7 7711 2 2 10 ARG H H 4.549 -4.825 -7.050 1.00 . B B . 10 ARG H 1 1 7 7712 2 2 10 ARG HA H 3.797 -7.321 -8.124 1.00 . B B . 10 ARG HA 1 1 7 7713 2 2 10 ARG HB2 H 6.186 -7.939 -7.450 1.00 . B B . 10 ARG HB2 1 1 7 7714 2 2 10 ARG HB3 H 6.000 -6.579 -8.555 1.00 . B B . 10 ARG HB3 1 1 7 7715 2 2 10 ARG HD2 H 8.497 -5.904 -5.663 1.00 . B B . 10 ARG HD2 1 1 7 7716 2 2 10 ARG HD3 H 8.061 -7.525 -6.206 1.00 . B B . 10 ARG HD3 1 1 7 7717 2 2 10 ARG HE H 8.347 -5.729 -8.396 1.00 . B B . 10 ARG HE 1 1 7 7718 2 2 10 ARG HG2 H 6.558 -5.026 -6.960 1.00 . B B . 10 ARG HG2 1 1 7 7719 2 2 10 ARG HG3 H 6.101 -6.082 -5.620 1.00 . B B . 10 ARG HG3 1 1 7 7720 2 2 10 ARG HH11 H 10.146 -7.654 -6.120 1.00 . B B . 10 ARG HH11 1 1 7 7721 2 2 10 ARG HH12 H 11.526 -7.818 -7.153 1.00 . B B . 10 ARG HH12 1 1 7 7722 2 2 10 ARG HH21 H 10.156 -5.934 -9.763 1.00 . B B . 10 ARG HH21 1 1 7 7723 2 2 10 ARG HH22 H 11.533 -6.839 -9.225 1.00 . B B . 10 ARG HH22 1 1 7 7724 2 2 10 ARG N N 3.882 -5.544 -7.072 1.00 . B B . 10 ARG N 1 1 7 7725 2 2 10 ARG NE N 8.778 -6.259 -7.693 1.00 . B B . 10 ARG NE 1 1 7 7726 2 2 10 ARG NH1 N 10.607 -7.461 -6.986 1.00 . B B . 10 ARG NH1 1 1 7 7727 2 2 10 ARG NH2 N 10.613 -6.482 -9.061 1.00 . B B . 10 ARG NH2 1 1 7 7728 2 2 10 ARG O O 3.813 -8.957 -6.119 1.00 . B B . 10 ARG O 1 1 7 7729 2 2 11 LYS C C 4.940 -8.587 -3.220 1.00 . B B . 11 LYS C 1 1 7 7730 2 2 11 LYS CA C 3.749 -7.731 -3.615 1.00 . B B . 11 LYS CA 1 1 7 7731 2 2 11 LYS CB C 2.496 -8.595 -3.692 1.00 . B B . 11 LYS CB 1 1 7 7732 2 2 11 LYS CD C 0.401 -8.855 -5.027 1.00 . B B . 11 LYS CD 1 1 7 7733 2 2 11 LYS CE C -0.865 -8.181 -5.530 1.00 . B B . 11 LYS CE 1 1 7 7734 2 2 11 LYS CG C 1.299 -7.881 -4.291 1.00 . B B . 11 LYS CG 1 1 7 7735 2 2 11 LYS H H 4.176 -6.112 -4.895 1.00 . B B . 11 LYS H 1 1 7 7736 2 2 11 LYS HA H 3.603 -6.961 -2.872 1.00 . B B . 11 LYS HA 1 1 7 7737 2 2 11 LYS HB2 H 2.709 -9.466 -4.295 1.00 . B B . 11 LYS HB2 1 1 7 7738 2 2 11 LYS HB3 H 2.236 -8.914 -2.693 1.00 . B B . 11 LYS HB3 1 1 7 7739 2 2 11 LYS HD2 H 0.944 -9.255 -5.871 1.00 . B B . 11 LYS HD2 1 1 7 7740 2 2 11 LYS HD3 H 0.132 -9.657 -4.357 1.00 . B B . 11 LYS HD3 1 1 7 7741 2 2 11 LYS HE2 H -1.490 -8.924 -6.002 1.00 . B B . 11 LYS HE2 1 1 7 7742 2 2 11 LYS HE3 H -1.390 -7.755 -4.687 1.00 . B B . 11 LYS HE3 1 1 7 7743 2 2 11 LYS HG2 H 0.736 -7.412 -3.497 1.00 . B B . 11 LYS HG2 1 1 7 7744 2 2 11 LYS HG3 H 1.648 -7.129 -4.984 1.00 . B B . 11 LYS HG3 1 1 7 7745 2 2 11 LYS HZ1 H 0.013 -6.365 -6.068 1.00 . B B . 11 LYS HZ1 1 1 7 7746 2 2 11 LYS HZ2 H -1.455 -6.674 -6.850 1.00 . B B . 11 LYS HZ2 1 1 7 7747 2 2 11 LYS HZ3 H -0.053 -7.492 -7.326 1.00 . B B . 11 LYS HZ3 1 1 7 7748 2 2 11 LYS N N 4.006 -7.076 -4.888 1.00 . B B . 11 LYS N 1 1 7 7749 2 2 11 LYS NZ N -0.570 -7.102 -6.512 1.00 . B B . 11 LYS NZ 1 1 7 7750 2 2 11 LYS O O 4.786 -9.742 -2.823 1.00 . B B . 11 LYS O 1 1 7 7751 2 2 12 ALA C C 7.244 -9.640 -1.836 1.00 . B B . 12 ALA C 1 1 7 7752 2 2 12 ALA CA C 7.387 -8.679 -3.017 1.00 . B B . 12 ALA CA 1 1 7 7753 2 2 12 ALA CB C 8.471 -7.652 -2.726 1.00 . B B . 12 ALA CB 1 1 7 7754 2 2 12 ALA H H 6.160 -7.078 -3.666 1.00 . B B . 12 ALA H 1 1 7 7755 2 2 12 ALA HA H 7.689 -9.240 -3.887 1.00 . B B . 12 ALA HA 1 1 7 7756 2 2 12 ALA HB1 H 8.554 -6.970 -3.560 1.00 . B B . 12 ALA HB1 1 1 7 7757 2 2 12 ALA HB2 H 9.415 -8.157 -2.578 1.00 . B B . 12 ALA HB2 1 1 7 7758 2 2 12 ALA HB3 H 8.214 -7.100 -1.835 1.00 . B B . 12 ALA HB3 1 1 7 7759 2 2 12 ALA N N 6.129 -8.001 -3.341 1.00 . B B . 12 ALA N 1 1 7 7760 2 2 12 ALA O O 7.906 -10.676 -1.785 1.00 . B B . 12 ALA O 1 1 7 7761 2 2 13 ASP C C 4.709 -10.641 0.300 1.00 . B B . 13 ASP C 1 1 7 7762 2 2 13 ASP CA C 6.144 -10.124 0.279 1.00 . B B . 13 ASP CA 1 1 7 7763 2 2 13 ASP CB C 6.434 -9.338 1.559 1.00 . B B . 13 ASP CB 1 1 7 7764 2 2 13 ASP CG C 6.235 -10.177 2.807 1.00 . B B . 13 ASP CG 1 1 7 7765 2 2 13 ASP H H 5.884 -8.446 -0.986 1.00 . B B . 13 ASP H 1 1 7 7766 2 2 13 ASP HA H 6.817 -10.966 0.224 1.00 . B B . 13 ASP HA 1 1 7 7767 2 2 13 ASP HB2 H 7.457 -8.993 1.538 1.00 . B B . 13 ASP HB2 1 1 7 7768 2 2 13 ASP HB3 H 5.771 -8.487 1.609 1.00 . B B . 13 ASP HB3 1 1 7 7769 2 2 13 ASP N N 6.377 -9.288 -0.893 1.00 . B B . 13 ASP N 1 1 7 7770 2 2 13 ASP O O 3.869 -10.139 1.047 1.00 . B B . 13 ASP O 1 1 7 7771 2 2 13 ASP OD1 O 5.103 -10.196 3.335 1.00 . B B . 13 ASP OD1 1 1 7 7772 2 2 13 ASP OD2 O 7.211 -10.812 3.258 1.00 . B B . 13 ASP OD2 1 1 7 7773 2 2 14 SER C C 2.861 -13.194 0.557 1.00 . B B . 14 SER C 1 1 7 7774 2 2 14 SER CA C 3.102 -12.233 -0.603 1.00 . B B . 14 SER CA 1 1 7 7775 2 2 14 SER CB C 2.921 -12.967 -1.934 1.00 . B B . 14 SER CB 1 1 7 7776 2 2 14 SER H H 5.149 -12.005 -1.095 1.00 . B B . 14 SER H 1 1 7 7777 2 2 14 SER HA H 2.383 -11.429 -0.545 1.00 . B B . 14 SER HA 1 1 7 7778 2 2 14 SER HB2 H 1.929 -13.391 -1.976 1.00 . B B . 14 SER HB2 1 1 7 7779 2 2 14 SER HB3 H 3.048 -12.269 -2.749 1.00 . B B . 14 SER HB3 1 1 7 7780 2 2 14 SER HG H 4.594 -13.712 -2.627 1.00 . B B . 14 SER HG 1 1 7 7781 2 2 14 SER N N 4.436 -11.647 -0.526 1.00 . B B . 14 SER N 1 1 7 7782 2 2 14 SER O O 3.103 -14.406 0.381 1.00 . B B . 14 SER O 1 1 7 7783 2 2 14 SER OXT O 2.433 -12.724 1.632 1.00 . B B . 14 SER OXT 1 1 7 7784 2 2 14 SER OG O 3.868 -14.010 -2.075 1.00 . B B . 14 SER OG 1 1 8 7785 1 1 1 GLY C C 10.685 3.384 -6.320 1.00 . A A . 1 GLY C 1 1 8 7786 1 1 1 GLY CA C 10.009 2.126 -6.835 1.00 . A A . 1 GLY CA 1 1 8 7787 1 1 1 GLY H1 H 8.271 2.199 -5.677 1.00 . A A . 1 GLY H1 1 1 8 7788 1 1 1 GLY H2 H 8.101 1.324 -7.113 1.00 . A A . 1 GLY H2 1 1 8 7789 1 1 1 GLY H3 H 8.144 3.013 -7.153 1.00 . A A . 1 GLY H3 1 1 8 7790 1 1 1 GLY HA2 H 10.394 1.275 -6.292 1.00 . A A . 1 GLY HA2 1 1 8 7791 1 1 1 GLY HA3 H 10.247 2.008 -7.882 1.00 . A A . 1 GLY HA3 1 1 8 7792 1 1 1 GLY N N 8.528 2.168 -6.684 1.00 . A A . 1 GLY N 1 1 8 7793 1 1 1 GLY O O 11.669 3.846 -6.898 1.00 . A A . 1 GLY O 1 1 8 7794 1 1 2 SER C C 9.899 5.616 -3.445 1.00 . A A . 2 SER C 1 1 8 7795 1 1 2 SER CA C 10.721 5.153 -4.642 1.00 . A A . 2 SER CA 1 1 8 7796 1 1 2 SER CB C 10.792 6.262 -5.692 1.00 . A A . 2 SER CB 1 1 8 7797 1 1 2 SER H H 9.385 3.517 -4.802 1.00 . A A . 2 SER H 1 1 8 7798 1 1 2 SER HA H 11.720 4.928 -4.304 1.00 . A A . 2 SER HA 1 1 8 7799 1 1 2 SER HB2 H 11.489 5.976 -6.465 1.00 . A A . 2 SER HB2 1 1 8 7800 1 1 2 SER HB3 H 9.815 6.407 -6.126 1.00 . A A . 2 SER HB3 1 1 8 7801 1 1 2 SER HG H 10.667 8.199 -5.429 1.00 . A A . 2 SER HG 1 1 8 7802 1 1 2 SER N N 10.162 3.938 -5.227 1.00 . A A . 2 SER N 1 1 8 7803 1 1 2 SER O O 10.438 6.183 -2.494 1.00 . A A . 2 SER O 1 1 8 7804 1 1 2 SER OG O 11.226 7.483 -5.118 1.00 . A A . 2 SER OG 1 1 8 7805 1 1 3 GLN C C 7.614 4.643 -1.384 1.00 . A A . 3 GLN C 1 1 8 7806 1 1 3 GLN CA C 7.708 5.759 -2.418 1.00 . A A . 3 GLN CA 1 1 8 7807 1 1 3 GLN CB C 6.329 6.087 -2.992 1.00 . A A . 3 GLN CB 1 1 8 7808 1 1 3 GLN CD C 4.230 5.220 -4.104 1.00 . A A . 3 GLN CD 1 1 8 7809 1 1 3 GLN CG C 5.497 4.864 -3.350 1.00 . A A . 3 GLN CG 1 1 8 7810 1 1 3 GLN H H 8.212 4.956 -4.292 1.00 . A A . 3 GLN H 1 1 8 7811 1 1 3 GLN HA H 8.116 6.641 -1.947 1.00 . A A . 3 GLN HA 1 1 8 7812 1 1 3 GLN HB2 H 5.779 6.677 -2.275 1.00 . A A . 3 GLN HB2 1 1 8 7813 1 1 3 GLN HB3 H 6.472 6.666 -3.893 1.00 . A A . 3 GLN HB3 1 1 8 7814 1 1 3 GLN HE21 H 5.184 5.035 -5.839 1.00 . A A . 3 GLN HE21 1 1 8 7815 1 1 3 GLN HE22 H 3.516 5.471 -5.943 1.00 . A A . 3 GLN HE22 1 1 8 7816 1 1 3 GLN HG2 H 6.091 4.207 -3.967 1.00 . A A . 3 GLN HG2 1 1 8 7817 1 1 3 GLN HG3 H 5.224 4.350 -2.439 1.00 . A A . 3 GLN HG3 1 1 8 7818 1 1 3 GLN N N 8.595 5.377 -3.498 1.00 . A A . 3 GLN N 1 1 8 7819 1 1 3 GLN NE2 N 4.319 5.244 -5.430 1.00 . A A . 3 GLN NE2 1 1 8 7820 1 1 3 GLN O O 7.521 3.466 -1.733 1.00 . A A . 3 GLN O 1 1 8 7821 1 1 3 GLN OE1 O 3.185 5.469 -3.503 1.00 . A A . 3 GLN OE1 1 1 8 7822 1 1 4 VAL C C 6.126 3.921 1.447 1.00 . A A . 4 VAL C 1 1 8 7823 1 1 4 VAL CA C 7.564 4.055 0.970 1.00 . A A . 4 VAL CA 1 1 8 7824 1 1 4 VAL CB C 8.467 4.448 2.167 1.00 . A A . 4 VAL CB 1 1 8 7825 1 1 4 VAL CG1 C 9.106 3.215 2.783 1.00 . A A . 4 VAL CG1 1 1 8 7826 1 1 4 VAL CG2 C 9.539 5.454 1.761 1.00 . A A . 4 VAL CG2 1 1 8 7827 1 1 4 VAL H H 7.686 5.970 0.102 1.00 . A A . 4 VAL H 1 1 8 7828 1 1 4 VAL HA H 7.895 3.100 0.591 1.00 . A A . 4 VAL HA 1 1 8 7829 1 1 4 VAL HB H 7.845 4.906 2.916 1.00 . A A . 4 VAL HB 1 1 8 7830 1 1 4 VAL HG11 H 8.399 2.729 3.434 1.00 . A A . 4 VAL HG11 1 1 8 7831 1 1 4 VAL HG12 H 9.977 3.507 3.352 1.00 . A A . 4 VAL HG12 1 1 8 7832 1 1 4 VAL HG13 H 9.401 2.533 1.999 1.00 . A A . 4 VAL HG13 1 1 8 7833 1 1 4 VAL HG21 H 10.131 5.044 0.955 1.00 . A A . 4 VAL HG21 1 1 8 7834 1 1 4 VAL HG22 H 10.178 5.662 2.606 1.00 . A A . 4 VAL HG22 1 1 8 7835 1 1 4 VAL HG23 H 9.069 6.370 1.433 1.00 . A A . 4 VAL HG23 1 1 8 7836 1 1 4 VAL N N 7.635 5.020 -0.114 1.00 . A A . 4 VAL N 1 1 8 7837 1 1 4 VAL O O 5.847 3.940 2.644 1.00 . A A . 4 VAL O 1 1 8 7838 1 1 5 PHE C C 2.979 3.523 -0.493 1.00 . A A . 5 PHE C 1 1 8 7839 1 1 5 PHE CA C 3.797 3.662 0.794 1.00 . A A . 5 PHE CA 1 1 8 7840 1 1 5 PHE CB C 3.323 4.874 1.595 1.00 . A A . 5 PHE CB 1 1 8 7841 1 1 5 PHE CD1 C 4.507 7.363 0.733 1.00 . A A . 5 PHE CD1 1 1 8 7842 1 1 5 PHE CD2 C 4.444 5.494 2.212 1.00 . A A . 5 PHE CD2 1 1 8 7843 1 1 5 PHE CE1 C 5.602 7.867 1.409 1.00 . A A . 5 PHE CE1 1 1 8 7844 1 1 5 PHE CE2 C 5.539 5.993 2.894 1.00 . A A . 5 PHE CE2 1 1 8 7845 1 1 5 PHE CG C 3.916 6.173 1.126 1.00 . A A . 5 PHE CG 1 1 8 7846 1 1 5 PHE CZ C 5.018 8.573 0.260 1.00 . A A . 5 PHE CZ 1 1 8 7847 1 1 5 PHE H H 5.500 3.808 -0.448 1.00 . A A . 5 PHE H 1 1 8 7848 1 1 5 PHE HA H 3.674 2.767 1.395 1.00 . A A . 5 PHE HA 1 1 8 7849 1 1 5 PHE HB2 H 2.250 4.955 1.518 1.00 . A A . 5 PHE HB2 1 1 8 7850 1 1 5 PHE HB3 H 3.596 4.739 2.628 1.00 . A A . 5 PHE HB3 1 1 8 7851 1 1 5 PHE HD1 H 4.104 7.900 -0.112 1.00 . A A . 5 PHE HD1 1 1 8 7852 1 1 5 PHE HD2 H 3.992 4.564 2.527 1.00 . A A . 5 PHE HD2 1 1 8 7853 1 1 5 PHE HE1 H 6.053 8.795 1.093 1.00 . A A . 5 PHE HE1 1 1 8 7854 1 1 5 PHE HE2 H 5.942 5.454 3.739 1.00 . A A . 5 PHE HE2 1 1 8 7855 1 1 5 PHE HZ H 5.447 9.506 -0.076 1.00 . A A . 5 PHE HZ 1 1 8 7856 1 1 5 PHE N N 5.212 3.801 0.489 1.00 . A A . 5 PHE N 1 1 8 7857 1 1 5 PHE O O 2.949 4.435 -1.319 1.00 . A A . 5 PHE O 1 1 8 7858 1 1 6 GLU C C 0.020 2.079 -1.523 1.00 . A A . 6 GLU C 1 1 8 7859 1 1 6 GLU CA C 1.513 2.116 -1.852 1.00 . A A . 6 GLU CA 1 1 8 7860 1 1 6 GLU CB C 1.944 0.796 -2.492 1.00 . A A . 6 GLU CB 1 1 8 7861 1 1 6 GLU CD C 1.284 1.486 -4.829 1.00 . A A . 6 GLU CD 1 1 8 7862 1 1 6 GLU CG C 1.157 0.437 -3.741 1.00 . A A . 6 GLU CG 1 1 8 7863 1 1 6 GLU H H 2.380 1.692 0.039 1.00 . A A . 6 GLU H 1 1 8 7864 1 1 6 GLU HA H 1.694 2.918 -2.552 1.00 . A A . 6 GLU HA 1 1 8 7865 1 1 6 GLU HB2 H 2.988 0.864 -2.760 1.00 . A A . 6 GLU HB2 1 1 8 7866 1 1 6 GLU HB3 H 1.819 0.001 -1.771 1.00 . A A . 6 GLU HB3 1 1 8 7867 1 1 6 GLU HG2 H 1.524 -0.504 -4.124 1.00 . A A . 6 GLU HG2 1 1 8 7868 1 1 6 GLU HG3 H 0.115 0.336 -3.477 1.00 . A A . 6 GLU HG3 1 1 8 7869 1 1 6 GLU N N 2.320 2.377 -0.657 1.00 . A A . 6 GLU N 1 1 8 7870 1 1 6 GLU O O -0.407 1.391 -0.601 1.00 . A A . 6 GLU O 1 1 8 7871 1 1 6 GLU OE1 O 0.515 2.469 -4.798 1.00 . A A . 6 GLU OE1 1 1 8 7872 1 1 6 GLU OE2 O 2.154 1.324 -5.711 1.00 . A A . 6 GLU OE2 1 1 8 7873 1 1 7 TYR C C -2.961 1.758 -2.821 1.00 . A A . 7 TYR C 1 1 8 7874 1 1 7 TYR CA C -2.211 2.864 -2.083 1.00 . A A . 7 TYR CA 1 1 8 7875 1 1 7 TYR CB C -2.735 4.224 -2.543 1.00 . A A . 7 TYR CB 1 1 8 7876 1 1 7 TYR CD1 C -1.320 5.048 -4.468 1.00 . A A . 7 TYR CD1 1 1 8 7877 1 1 7 TYR CD2 C -3.513 4.244 -4.946 1.00 . A A . 7 TYR CD2 1 1 8 7878 1 1 7 TYR CE1 C -1.121 5.313 -5.810 1.00 . A A . 7 TYR CE1 1 1 8 7879 1 1 7 TYR CE2 C -3.321 4.507 -6.289 1.00 . A A . 7 TYR CE2 1 1 8 7880 1 1 7 TYR CG C -2.517 4.508 -4.013 1.00 . A A . 7 TYR CG 1 1 8 7881 1 1 7 TYR CZ C -2.124 5.042 -6.715 1.00 . A A . 7 TYR CZ 1 1 8 7882 1 1 7 TYR H H -0.394 3.311 -3.043 1.00 . A A . 7 TYR H 1 1 8 7883 1 1 7 TYR HA H -2.392 2.761 -1.026 1.00 . A A . 7 TYR HA 1 1 8 7884 1 1 7 TYR HB2 H -3.789 4.271 -2.357 1.00 . A A . 7 TYR HB2 1 1 8 7885 1 1 7 TYR HB3 H -2.242 5.001 -1.981 1.00 . A A . 7 TYR HB3 1 1 8 7886 1 1 7 TYR HD1 H -0.536 5.259 -3.756 1.00 . A A . 7 TYR HD1 1 1 8 7887 1 1 7 TYR HD2 H -4.449 3.825 -4.610 1.00 . A A . 7 TYR HD2 1 1 8 7888 1 1 7 TYR HE1 H -0.183 5.733 -6.143 1.00 . A A . 7 TYR HE1 1 1 8 7889 1 1 7 TYR HE2 H -4.108 4.294 -6.998 1.00 . A A . 7 TYR HE2 1 1 8 7890 1 1 7 TYR HH H -2.705 5.748 -8.405 1.00 . A A . 7 TYR HH 1 1 8 7891 1 1 7 TYR N N -0.777 2.800 -2.305 1.00 . A A . 7 TYR N 1 1 8 7892 1 1 7 TYR O O -3.058 1.775 -4.047 1.00 . A A . 7 TYR O 1 1 8 7893 1 1 7 TYR OH O -1.930 5.308 -8.050 1.00 . A A . 7 TYR OH 1 1 8 7894 1 1 8 ALA C C -5.734 0.096 -2.675 1.00 . A A . 8 ALA C 1 1 8 7895 1 1 8 ALA CA C -4.261 -0.290 -2.672 1.00 . A A . 8 ALA CA 1 1 8 7896 1 1 8 ALA CB C -4.049 -1.594 -1.918 1.00 . A A . 8 ALA CB 1 1 8 7897 1 1 8 ALA H H -3.349 0.802 -1.090 1.00 . A A . 8 ALA H 1 1 8 7898 1 1 8 ALA HA H -3.926 -0.420 -3.689 1.00 . A A . 8 ALA HA 1 1 8 7899 1 1 8 ALA HB1 H -4.751 -1.657 -1.101 1.00 . A A . 8 ALA HB1 1 1 8 7900 1 1 8 ALA HB2 H -3.040 -1.628 -1.530 1.00 . A A . 8 ALA HB2 1 1 8 7901 1 1 8 ALA HB3 H -4.203 -2.427 -2.588 1.00 . A A . 8 ALA HB3 1 1 8 7902 1 1 8 ALA N N -3.486 0.791 -2.070 1.00 . A A . 8 ALA N 1 1 8 7903 1 1 8 ALA O O -6.576 -0.625 -2.155 1.00 . A A . 8 ALA O 1 1 8 7904 1 1 9 GLU C C -8.011 1.704 -4.684 1.00 . A A . 9 GLU C 1 1 8 7905 1 1 9 GLU CA C -7.369 1.794 -3.318 1.00 . A A . 9 GLU CA 1 1 8 7906 1 1 9 GLU CB C -7.282 3.236 -2.807 1.00 . A A . 9 GLU CB 1 1 8 7907 1 1 9 GLU CD C -7.392 4.510 -5.000 1.00 . A A . 9 GLU CD 1 1 8 7908 1 1 9 GLU CG C -7.998 4.303 -3.624 1.00 . A A . 9 GLU CG 1 1 8 7909 1 1 9 GLU H H -5.309 1.742 -3.719 1.00 . A A . 9 GLU H 1 1 8 7910 1 1 9 GLU HA H -7.984 1.232 -2.648 1.00 . A A . 9 GLU HA 1 1 8 7911 1 1 9 GLU HB2 H -7.691 3.264 -1.811 1.00 . A A . 9 GLU HB2 1 1 8 7912 1 1 9 GLU HB3 H -6.238 3.507 -2.755 1.00 . A A . 9 GLU HB3 1 1 8 7913 1 1 9 GLU HG2 H -9.024 4.012 -3.735 1.00 . A A . 9 GLU HG2 1 1 8 7914 1 1 9 GLU HG3 H -7.945 5.232 -3.086 1.00 . A A . 9 GLU HG3 1 1 8 7915 1 1 9 GLU N N -6.024 1.243 -3.281 1.00 . A A . 9 GLU N 1 1 8 7916 1 1 9 GLU O O -7.349 1.709 -5.720 1.00 . A A . 9 GLU O 1 1 8 7917 1 1 9 GLU OE1 O -6.321 5.145 -5.088 1.00 . A A . 9 GLU OE1 1 1 8 7918 1 1 9 GLU OE2 O -7.992 4.038 -5.991 1.00 . A A . 9 GLU OE2 1 1 8 7919 1 1 10 VAL C C -10.495 2.921 -6.336 1.00 . A A . 10 VAL C 1 1 8 7920 1 1 10 VAL CA C -10.121 1.533 -5.837 1.00 . A A . 10 VAL CA 1 1 8 7921 1 1 10 VAL CB C -11.365 0.690 -5.584 1.00 . A A . 10 VAL CB 1 1 8 7922 1 1 10 VAL CG1 C -12.235 0.599 -6.829 1.00 . A A . 10 VAL CG1 1 1 8 7923 1 1 10 VAL CG2 C -10.958 -0.694 -5.108 1.00 . A A . 10 VAL CG2 1 1 8 7924 1 1 10 VAL H H -9.778 1.627 -3.777 1.00 . A A . 10 VAL H 1 1 8 7925 1 1 10 VAL HA H -9.539 1.044 -6.567 1.00 . A A . 10 VAL HA 1 1 8 7926 1 1 10 VAL HB H -11.923 1.162 -4.802 1.00 . A A . 10 VAL HB 1 1 8 7927 1 1 10 VAL HG11 H -12.085 1.475 -7.439 1.00 . A A . 10 VAL HG11 1 1 8 7928 1 1 10 VAL HG12 H -13.273 0.536 -6.538 1.00 . A A . 10 VAL HG12 1 1 8 7929 1 1 10 VAL HG13 H -11.964 -0.282 -7.391 1.00 . A A . 10 VAL HG13 1 1 8 7930 1 1 10 VAL HG21 H -11.838 -1.307 -4.990 1.00 . A A . 10 VAL HG21 1 1 8 7931 1 1 10 VAL HG22 H -10.447 -0.610 -4.157 1.00 . A A . 10 VAL HG22 1 1 8 7932 1 1 10 VAL HG23 H -10.298 -1.145 -5.833 1.00 . A A . 10 VAL HG23 1 1 8 7933 1 1 10 VAL N N -9.328 1.625 -4.645 1.00 . A A . 10 VAL N 1 1 8 7934 1 1 10 VAL O O -10.578 3.162 -7.540 1.00 . A A . 10 VAL O 1 1 8 7935 1 1 11 ASP C C -10.392 6.203 -4.779 1.00 . A A . 11 ASP C 1 1 8 7936 1 1 11 ASP CA C -11.057 5.206 -5.729 1.00 . A A . 11 ASP CA 1 1 8 7937 1 1 11 ASP CB C -12.571 5.412 -5.684 1.00 . A A . 11 ASP CB 1 1 8 7938 1 1 11 ASP CG C -13.527 4.208 -9.734 1.00 . A A . 11 ASP CG 1 1 8 7939 1 1 11 ASP H H -10.692 3.553 -4.459 1.00 . A A . 11 ASP H 1 1 8 7940 1 1 11 ASP HA H -10.710 5.397 -6.733 1.00 . A A . 11 ASP HA 1 1 8 7941 1 1 11 ASP HB2 H -12.903 5.357 -4.659 1.00 . A A . 11 ASP HB2 1 1 8 7942 1 1 11 ASP HB3 H -13.054 4.639 -6.257 1.00 . A A . 11 ASP HB3 1 1 8 7943 1 1 11 ASP N N -10.721 3.827 -5.396 1.00 . A A . 11 ASP N 1 1 8 7944 1 1 11 ASP O O -9.936 7.264 -5.207 1.00 . A A . 11 ASP O 1 1 8 7945 1 1 11 ASP OD1 O -13.855 4.034 -10.926 1.00 . A A . 11 ASP OD1 1 1 8 7946 1 1 11 ASP OD2 O -14.295 4.693 -8.876 1.00 . A A . 11 ASP OD2 1 1 8 7947 1 1 12 GLU C C -9.213 6.047 -1.277 1.00 . A A . 12 GLU C 1 1 8 7948 1 1 12 GLU CA C -9.760 6.779 -2.498 1.00 . A A . 12 GLU CA 1 1 8 7949 1 1 12 GLU CB C -10.811 7.799 -2.055 1.00 . A A . 12 GLU CB 1 1 8 7950 1 1 12 GLU CD C -12.171 9.843 -2.638 1.00 . A A . 12 GLU CD 1 1 8 7951 1 1 12 GLU CG C -11.156 8.825 -3.121 1.00 . A A . 12 GLU CG 1 1 8 7952 1 1 12 GLU H H -10.606 4.959 -3.219 1.00 . A A . 12 GLU H 1 1 8 7953 1 1 12 GLU HA H -8.944 7.305 -2.971 1.00 . A A . 12 GLU HA 1 1 8 7954 1 1 12 GLU HB2 H -11.715 7.272 -1.788 1.00 . A A . 12 GLU HB2 1 1 8 7955 1 1 12 GLU HB3 H -10.441 8.321 -1.187 1.00 . A A . 12 GLU HB3 1 1 8 7956 1 1 12 GLU HG2 H -10.254 9.347 -3.406 1.00 . A A . 12 GLU HG2 1 1 8 7957 1 1 12 GLU HG3 H -11.562 8.313 -3.979 1.00 . A A . 12 GLU HG3 1 1 8 7958 1 1 12 GLU N N -10.332 5.863 -3.492 1.00 . A A . 12 GLU N 1 1 8 7959 1 1 12 GLU O O -9.623 4.936 -0.973 1.00 . A A . 12 GLU O 1 1 8 7960 1 1 12 GLU OE1 O -11.763 10.827 -1.986 1.00 . A A . 12 GLU OE1 1 1 8 7961 1 1 12 GLU OE2 O -13.376 9.655 -2.911 1.00 . A A . 12 GLU OE2 1 1 8 7962 1 1 13 ILE C C -7.814 7.124 1.784 1.00 . A A . 13 ILE C 1 1 8 7963 1 1 13 ILE CA C -7.682 6.137 0.624 1.00 . A A . 13 ILE CA 1 1 8 7964 1 1 13 ILE CB C -6.178 5.830 0.395 1.00 . A A . 13 ILE CB 1 1 8 7965 1 1 13 ILE CD1 C -5.661 7.779 -1.158 1.00 . A A . 13 ILE CD1 1 1 8 7966 1 1 13 ILE CG1 C -5.391 7.132 0.186 1.00 . A A . 13 ILE CG1 1 1 8 7967 1 1 13 ILE CG2 C -6.019 4.945 -0.822 1.00 . A A . 13 ILE CG2 1 1 8 7968 1 1 13 ILE H H -8.045 7.606 -0.852 1.00 . A A . 13 ILE H 1 1 8 7969 1 1 13 ILE HA H -8.199 5.208 0.859 1.00 . A A . 13 ILE HA 1 1 8 7970 1 1 13 ILE HB H -5.782 5.295 1.258 1.00 . A A . 13 ILE HB 1 1 8 7971 1 1 13 ILE HD11 H -6.081 8.762 -1.009 1.00 . A A . 13 ILE HD11 1 1 8 7972 1 1 13 ILE HD12 H -6.363 7.167 -1.715 1.00 . A A . 13 ILE HD12 1 1 8 7973 1 1 13 ILE HD13 H -4.738 7.860 -1.711 1.00 . A A . 13 ILE HD13 1 1 8 7974 1 1 13 ILE HG12 H -5.659 7.839 0.955 1.00 . A A . 13 ILE HG12 1 1 8 7975 1 1 13 ILE HG13 H -4.334 6.925 0.247 1.00 . A A . 13 ILE HG13 1 1 8 7976 1 1 13 ILE HG21 H -6.868 5.094 -1.465 1.00 . A A . 13 ILE HG21 1 1 8 7977 1 1 13 ILE HG22 H -5.955 3.912 -0.522 1.00 . A A . 13 ILE HG22 1 1 8 7978 1 1 13 ILE HG23 H -5.120 5.223 -1.347 1.00 . A A . 13 ILE HG23 1 1 8 7979 1 1 13 ILE N N -8.299 6.705 -0.571 1.00 . A A . 13 ILE N 1 1 8 7980 1 1 13 ILE O O -8.554 8.104 1.693 1.00 . A A . 13 ILE O 1 1 8 7981 1 1 14 VAL C C -5.792 7.656 4.768 1.00 . A A . 14 VAL C 1 1 8 7982 1 1 14 VAL CA C -7.119 7.741 4.029 1.00 . A A . 14 VAL CA 1 1 8 7983 1 1 14 VAL CB C -8.284 7.403 4.986 1.00 . A A . 14 VAL CB 1 1 8 7984 1 1 14 VAL CG1 C -8.198 8.227 6.266 1.00 . A A . 14 VAL CG1 1 1 8 7985 1 1 14 VAL CG2 C -9.618 7.635 4.294 1.00 . A A . 14 VAL CG2 1 1 8 7986 1 1 14 VAL H H -6.543 6.056 2.887 1.00 . A A . 14 VAL H 1 1 8 7987 1 1 14 VAL HA H -7.254 8.751 3.673 1.00 . A A . 14 VAL HA 1 1 8 7988 1 1 14 VAL HB H -8.216 6.358 5.252 1.00 . A A . 14 VAL HB 1 1 8 7989 1 1 14 VAL HG11 H -9.012 7.959 6.922 1.00 . A A . 14 VAL HG11 1 1 8 7990 1 1 14 VAL HG12 H -8.264 9.278 6.022 1.00 . A A . 14 VAL HG12 1 1 8 7991 1 1 14 VAL HG13 H -7.258 8.031 6.759 1.00 . A A . 14 VAL HG13 1 1 8 7992 1 1 14 VAL HG21 H -9.694 6.991 3.430 1.00 . A A . 14 VAL HG21 1 1 8 7993 1 1 14 VAL HG22 H -9.687 8.667 3.982 1.00 . A A . 14 VAL HG22 1 1 8 7994 1 1 14 VAL HG23 H -10.423 7.413 4.981 1.00 . A A . 14 VAL HG23 1 1 8 7995 1 1 14 VAL N N -7.100 6.862 2.867 1.00 . A A . 14 VAL N 1 1 8 7996 1 1 14 VAL O O -5.207 8.671 5.145 1.00 . A A . 14 VAL O 1 1 8 7997 1 1 15 GLU C C -2.960 5.934 4.619 1.00 . A A . 15 GLU C 1 1 8 7998 1 1 15 GLU CA C -4.057 6.198 5.645 1.00 . A A . 15 GLU CA 1 1 8 7999 1 1 15 GLU CB C -4.178 5.011 6.604 1.00 . A A . 15 GLU CB 1 1 8 8000 1 1 15 GLU CD C -5.403 3.979 8.557 1.00 . A A . 15 GLU CD 1 1 8 8001 1 1 15 GLU CG C -5.251 5.195 7.665 1.00 . A A . 15 GLU CG 1 1 8 8002 1 1 15 GLU H H -5.851 5.664 4.657 1.00 . A A . 15 GLU H 1 1 8 8003 1 1 15 GLU HA H -3.808 7.085 6.206 1.00 . A A . 15 GLU HA 1 1 8 8004 1 1 15 GLU HB2 H -4.413 4.125 6.035 1.00 . A A . 15 GLU HB2 1 1 8 8005 1 1 15 GLU HB3 H -3.230 4.869 7.102 1.00 . A A . 15 GLU HB3 1 1 8 8006 1 1 15 GLU HG2 H -4.990 6.042 8.281 1.00 . A A . 15 GLU HG2 1 1 8 8007 1 1 15 GLU HG3 H -6.195 5.384 7.175 1.00 . A A . 15 GLU HG3 1 1 8 8008 1 1 15 GLU N N -5.325 6.431 4.969 1.00 . A A . 15 GLU N 1 1 8 8009 1 1 15 GLU O O -3.214 5.369 3.561 1.00 . A A . 15 GLU O 1 1 8 8010 1 1 15 GLU OE1 O -4.614 3.842 9.515 1.00 . A A . 15 GLU OE1 1 1 8 8011 1 1 15 GLU OE2 O -6.314 3.164 8.299 1.00 . A A . 15 GLU OE2 1 1 8 8012 1 1 16 LYS C C 0.712 6.211 4.715 1.00 . A A . 16 LYS C 1 1 8 8013 1 1 16 LYS CA C -0.637 6.185 3.984 1.00 . A A . 16 LYS CA 1 1 8 8014 1 1 16 LYS CB C -0.652 7.252 2.889 1.00 . A A . 16 LYS CB 1 1 8 8015 1 1 16 LYS CD C -0.900 9.682 2.300 1.00 . A A . 16 LYS CD 1 1 8 8016 1 1 16 LYS CE C -1.096 11.090 2.838 1.00 . A A . 16 LYS CE 1 1 8 8017 1 1 16 LYS CG C -0.766 8.670 3.426 1.00 . A A . 16 LYS CG 1 1 8 8018 1 1 16 LYS H H -1.612 6.896 5.730 1.00 . A A . 16 LYS H 1 1 8 8019 1 1 16 LYS HA H -0.780 5.211 3.528 1.00 . A A . 16 LYS HA 1 1 8 8020 1 1 16 LYS HB2 H 0.261 7.179 2.318 1.00 . A A . 16 LYS HB2 1 1 8 8021 1 1 16 LYS HB3 H -1.492 7.071 2.238 1.00 . A A . 16 LYS HB3 1 1 8 8022 1 1 16 LYS HD2 H -0.003 9.659 1.699 1.00 . A A . 16 LYS HD2 1 1 8 8023 1 1 16 LYS HD3 H -1.751 9.417 1.690 1.00 . A A . 16 LYS HD3 1 1 8 8024 1 1 16 LYS HE2 H -1.968 11.099 3.475 1.00 . A A . 16 LYS HE2 1 1 8 8025 1 1 16 LYS HE3 H -0.226 11.364 3.417 1.00 . A A . 16 LYS HE3 1 1 8 8026 1 1 16 LYS HG2 H -1.638 8.736 4.060 1.00 . A A . 16 LYS HG2 1 1 8 8027 1 1 16 LYS HG3 H 0.118 8.899 4.001 1.00 . A A . 16 LYS HG3 1 1 8 8028 1 1 16 LYS HZ1 H -1.435 13.031 2.146 1.00 . A A . 16 LYS HZ1 1 1 8 8029 1 1 16 LYS HZ2 H -2.112 11.825 1.169 1.00 . A A . 16 LYS HZ2 1 1 8 8030 1 1 16 LYS HZ3 H -0.444 12.106 1.134 1.00 . A A . 16 LYS HZ3 1 1 8 8031 1 1 16 LYS N N -1.753 6.401 4.899 1.00 . A A . 16 LYS N 1 1 8 8032 1 1 16 LYS NZ N -1.285 12.082 1.745 1.00 . A A . 16 LYS NZ 1 1 8 8033 1 1 16 LYS O O 1.376 7.246 4.744 1.00 . A A . 16 LYS O 1 1 8 8034 1 1 17 ARG C C 2.967 3.633 6.064 1.00 . A A . 17 ARG C 1 1 8 8035 1 1 17 ARG CA C 2.395 5.045 6.030 1.00 . A A . 17 ARG CA 1 1 8 8036 1 1 17 ARG CB C 2.208 5.561 7.457 1.00 . A A . 17 ARG CB 1 1 8 8037 1 1 17 ARG CD C 3.217 5.951 9.725 1.00 . A A . 17 ARG CD 1 1 8 8038 1 1 17 ARG CG C 3.471 5.492 8.299 1.00 . A A . 17 ARG CG 1 1 8 8039 1 1 17 ARG CZ C 4.416 5.987 11.872 1.00 . A A . 17 ARG CZ 1 1 8 8040 1 1 17 ARG H H 0.584 4.267 5.222 1.00 . A A . 17 ARG H 1 1 8 8041 1 1 17 ARG HA H 3.091 5.689 5.513 1.00 . A A . 17 ARG HA 1 1 8 8042 1 1 17 ARG HB2 H 1.885 6.591 7.416 1.00 . A A . 17 ARG HB2 1 1 8 8043 1 1 17 ARG HB3 H 1.444 4.974 7.944 1.00 . A A . 17 ARG HB3 1 1 8 8044 1 1 17 ARG HD2 H 2.871 6.974 9.705 1.00 . A A . 17 ARG HD2 1 1 8 8045 1 1 17 ARG HD3 H 2.454 5.323 10.162 1.00 . A A . 17 ARG HD3 1 1 8 8046 1 1 17 ARG HE H 5.275 5.734 10.089 1.00 . A A . 17 ARG HE 1 1 8 8047 1 1 17 ARG HG2 H 3.823 4.471 8.318 1.00 . A A . 17 ARG HG2 1 1 8 8048 1 1 17 ARG HG3 H 4.224 6.127 7.855 1.00 . A A . 17 ARG HG3 1 1 8 8049 1 1 17 ARG HH11 H 2.416 6.232 12.012 1.00 . A A . 17 ARG HH11 1 1 8 8050 1 1 17 ARG HH12 H 3.274 6.258 13.516 1.00 . A A . 17 ARG HH12 1 1 8 8051 1 1 17 ARG HH21 H 6.416 5.766 12.062 1.00 . A A . 17 ARG HH21 1 1 8 8052 1 1 17 ARG HH22 H 5.550 5.993 13.545 1.00 . A A . 17 ARG HH22 1 1 8 8053 1 1 17 ARG N N 1.122 5.088 5.305 1.00 . A A . 17 ARG N 1 1 8 8054 1 1 17 ARG NE N 4.421 5.875 10.547 1.00 . A A . 17 ARG NE 1 1 8 8055 1 1 17 ARG NH1 N 3.276 6.174 12.519 1.00 . A A . 17 ARG NH1 1 1 8 8056 1 1 17 ARG NH2 N 5.554 5.909 12.548 1.00 . A A . 17 ARG NH2 1 1 8 8057 1 1 17 ARG O O 2.724 2.892 7.016 1.00 . A A . 17 ARG O 1 1 8 8058 1 1 18 GLY C C 5.558 1.760 4.270 1.00 . A A . 18 GLY C 1 1 8 8059 1 1 18 GLY CA C 4.262 1.905 5.030 1.00 . A A . 18 GLY CA 1 1 8 8060 1 1 18 GLY H H 3.924 3.870 4.305 1.00 . A A . 18 GLY H 1 1 8 8061 1 1 18 GLY HA2 H 4.426 1.590 6.048 1.00 . A A . 18 GLY HA2 1 1 8 8062 1 1 18 GLY HA3 H 3.534 1.254 4.584 1.00 . A A . 18 GLY HA3 1 1 8 8063 1 1 18 GLY N N 3.723 3.247 5.039 1.00 . A A . 18 GLY N 1 1 8 8064 1 1 18 GLY O O 6.506 2.517 4.470 1.00 . A A . 18 GLY O 1 1 8 8065 1 1 19 LYS C C 6.330 0.404 1.113 1.00 . A A . 19 LYS C 1 1 8 8066 1 1 19 LYS CA C 6.732 0.432 2.595 1.00 . A A . 19 LYS CA 1 1 8 8067 1 1 19 LYS CB C 7.264 -0.900 3.082 1.00 . A A . 19 LYS CB 1 1 8 8068 1 1 19 LYS CD C 7.882 -2.066 5.212 1.00 . A A . 19 LYS CD 1 1 8 8069 1 1 19 LYS CE C 8.779 -2.026 6.436 1.00 . A A . 19 LYS CE 1 1 8 8070 1 1 19 LYS CG C 7.991 -0.789 4.409 1.00 . A A . 19 LYS CG 1 1 8 8071 1 1 19 LYS H H 4.800 0.166 3.346 1.00 . A A . 19 LYS H 1 1 8 8072 1 1 19 LYS HA H 7.475 1.184 2.749 1.00 . A A . 19 LYS HA 1 1 8 8073 1 1 19 LYS HB2 H 6.417 -1.560 3.203 1.00 . A A . 19 LYS HB2 1 1 8 8074 1 1 19 LYS HB3 H 7.943 -1.313 2.354 1.00 . A A . 19 LYS HB3 1 1 8 8075 1 1 19 LYS HD2 H 6.860 -2.183 5.534 1.00 . A A . 19 LYS HD2 1 1 8 8076 1 1 19 LYS HD3 H 8.165 -2.899 4.588 1.00 . A A . 19 LYS HD3 1 1 8 8077 1 1 19 LYS HE2 H 9.789 -1.821 6.118 1.00 . A A . 19 LYS HE2 1 1 8 8078 1 1 19 LYS HE3 H 8.438 -1.234 7.087 1.00 . A A . 19 LYS HE3 1 1 8 8079 1 1 19 LYS HG2 H 9.034 -0.585 4.220 1.00 . A A . 19 LYS HG2 1 1 8 8080 1 1 19 LYS HG3 H 7.560 0.023 4.977 1.00 . A A . 19 LYS HG3 1 1 8 8081 1 1 19 LYS HZ1 H 9.361 -3.247 8.026 1.00 . A A . 19 LYS HZ1 1 1 8 8082 1 1 19 LYS HZ2 H 9.105 -4.081 6.577 1.00 . A A . 19 LYS HZ2 1 1 8 8083 1 1 19 LYS HZ3 H 7.785 -3.535 7.483 1.00 . A A . 19 LYS HZ3 1 1 8 8084 1 1 19 LYS N N 5.583 0.747 3.412 1.00 . A A . 19 LYS N 1 1 8 8085 1 1 19 LYS NZ N 8.755 -3.312 7.183 1.00 . A A . 19 LYS NZ 1 1 8 8086 1 1 19 LYS O O 5.857 1.406 0.589 1.00 . A A . 19 LYS O 1 1 8 8087 1 1 20 GLY C C 4.716 -1.356 -1.019 1.00 . A A . 20 GLY C 1 1 8 8088 1 1 20 GLY CA C 6.107 -0.810 -0.946 1.00 . A A . 20 GLY CA 1 1 8 8089 1 1 20 GLY H H 6.867 -1.508 0.866 1.00 . A A . 20 GLY H 1 1 8 8090 1 1 20 GLY HA2 H 6.149 0.166 -1.396 1.00 . A A . 20 GLY HA2 1 1 8 8091 1 1 20 GLY HA3 H 6.770 -1.481 -1.457 1.00 . A A . 20 GLY HA3 1 1 8 8092 1 1 20 GLY N N 6.502 -0.725 0.433 1.00 . A A . 20 GLY N 1 1 8 8093 1 1 20 GLY O O 3.878 -0.913 -1.803 1.00 . A A . 20 GLY O 1 1 8 8094 1 1 21 LYS C C 2.857 -3.225 1.430 1.00 . A A . 21 LYS C 1 1 8 8095 1 1 21 LYS CA C 3.217 -3.004 -0.046 1.00 . A A . 21 LYS CA 1 1 8 8096 1 1 21 LYS CB C 3.253 -4.337 -0.790 1.00 . A A . 21 LYS CB 1 1 8 8097 1 1 21 LYS CD C 3.927 -5.529 -2.898 1.00 . A A . 21 LYS CD 1 1 8 8098 1 1 21 LYS CE C 4.386 -5.359 -4.335 1.00 . A A . 21 LYS CE 1 1 8 8099 1 1 21 LYS CG C 3.592 -4.190 -2.264 1.00 . A A . 21 LYS CG 1 1 8 8100 1 1 21 LYS H H 5.256 -2.660 0.364 1.00 . A A . 21 LYS H 1 1 8 8101 1 1 21 LYS HA H 2.470 -2.369 -0.497 1.00 . A A . 21 LYS HA 1 1 8 8102 1 1 21 LYS HB2 H 3.997 -4.971 -0.334 1.00 . A A . 21 LYS HB2 1 1 8 8103 1 1 21 LYS HB3 H 2.286 -4.811 -0.710 1.00 . A A . 21 LYS HB3 1 1 8 8104 1 1 21 LYS HD2 H 4.718 -5.998 -2.331 1.00 . A A . 21 LYS HD2 1 1 8 8105 1 1 21 LYS HD3 H 3.047 -6.156 -2.881 1.00 . A A . 21 LYS HD3 1 1 8 8106 1 1 21 LYS HE2 H 4.599 -6.333 -4.752 1.00 . A A . 21 LYS HE2 1 1 8 8107 1 1 21 LYS HE3 H 3.593 -4.891 -4.900 1.00 . A A . 21 LYS HE3 1 1 8 8108 1 1 21 LYS HG2 H 2.745 -3.763 -2.778 1.00 . A A . 21 LYS HG2 1 1 8 8109 1 1 21 LYS HG3 H 4.443 -3.532 -2.361 1.00 . A A . 21 LYS HG3 1 1 8 8110 1 1 21 LYS HZ1 H 5.895 -4.410 -5.425 1.00 . A A . 21 LYS HZ1 1 1 8 8111 1 1 21 LYS HZ2 H 6.389 -4.955 -3.901 1.00 . A A . 21 LYS HZ2 1 1 8 8112 1 1 21 LYS HZ3 H 5.425 -3.573 -4.035 1.00 . A A . 21 LYS HZ3 1 1 8 8113 1 1 21 LYS N N 4.501 -2.344 -0.175 1.00 . A A . 21 LYS N 1 1 8 8114 1 1 21 LYS NZ N 5.609 -4.515 -4.431 1.00 . A A . 21 LYS NZ 1 1 8 8115 1 1 21 LYS O O 1.784 -3.741 1.733 1.00 . A A . 21 LYS O 1 1 8 8116 1 1 22 ASP C C 2.727 -1.814 4.360 1.00 . A A . 22 ASP C 1 1 8 8117 1 1 22 ASP CA C 3.508 -2.968 3.772 1.00 . A A . 22 ASP CA 1 1 8 8118 1 1 22 ASP CB C 4.827 -3.071 4.518 1.00 . A A . 22 ASP CB 1 1 8 8119 1 1 22 ASP CG C 4.654 -3.611 5.924 1.00 . A A . 22 ASP CG 1 1 8 8120 1 1 22 ASP H H 4.544 -2.351 2.071 1.00 . A A . 22 ASP H 1 1 8 8121 1 1 22 ASP HA H 2.953 -3.864 3.900 1.00 . A A . 22 ASP HA 1 1 8 8122 1 1 22 ASP HB2 H 5.503 -3.706 3.972 1.00 . A A . 22 ASP HB2 1 1 8 8123 1 1 22 ASP HB3 H 5.249 -2.082 4.590 1.00 . A A . 22 ASP HB3 1 1 8 8124 1 1 22 ASP N N 3.737 -2.795 2.350 1.00 . A A . 22 ASP N 1 1 8 8125 1 1 22 ASP O O 2.592 -1.695 5.575 1.00 . A A . 22 ASP O 1 1 8 8126 1 1 22 ASP OD1 O 3.872 -4.568 6.103 1.00 . A A . 22 ASP OD1 1 1 8 8127 1 1 22 ASP OD2 O 5.296 -3.070 6.849 1.00 . A A . 22 ASP OD2 1 1 8 8128 1 1 23 VAL C C 0.002 -0.190 4.054 1.00 . A A . 23 VAL C 1 1 8 8129 1 1 23 VAL CA C 1.468 0.172 3.937 1.00 . A A . 23 VAL CA 1 1 8 8130 1 1 23 VAL CB C 1.636 1.345 2.972 1.00 . A A . 23 VAL CB 1 1 8 8131 1 1 23 VAL CG1 C 0.874 1.106 1.676 1.00 . A A . 23 VAL CG1 1 1 8 8132 1 1 23 VAL CG2 C 1.202 2.633 3.634 1.00 . A A . 23 VAL CG2 1 1 8 8133 1 1 23 VAL H H 2.426 -1.070 2.561 1.00 . A A . 23 VAL H 1 1 8 8134 1 1 23 VAL HA H 1.833 0.475 4.903 1.00 . A A . 23 VAL HA 1 1 8 8135 1 1 23 VAL HB H 2.687 1.425 2.738 1.00 . A A . 23 VAL HB 1 1 8 8136 1 1 23 VAL HG11 H -0.132 0.781 1.894 1.00 . A A . 23 VAL HG11 1 1 8 8137 1 1 23 VAL HG12 H 1.377 0.346 1.098 1.00 . A A . 23 VAL HG12 1 1 8 8138 1 1 23 VAL HG13 H 0.836 2.020 1.108 1.00 . A A . 23 VAL HG13 1 1 8 8139 1 1 23 VAL HG21 H 1.318 2.538 4.701 1.00 . A A . 23 VAL HG21 1 1 8 8140 1 1 23 VAL HG22 H 0.168 2.825 3.406 1.00 . A A . 23 VAL HG22 1 1 8 8141 1 1 23 VAL HG23 H 1.810 3.449 3.274 1.00 . A A . 23 VAL HG23 1 1 8 8142 1 1 23 VAL N N 2.238 -0.959 3.502 1.00 . A A . 23 VAL N 1 1 8 8143 1 1 23 VAL O O -0.515 -1.000 3.285 1.00 . A A . 23 VAL O 1 1 8 8144 1 1 24 GLU C C -2.903 1.375 4.813 1.00 . A A . 24 GLU C 1 1 8 8145 1 1 24 GLU CA C -2.070 0.168 5.210 1.00 . A A . 24 GLU CA 1 1 8 8146 1 1 24 GLU CB C -2.356 -0.183 6.662 1.00 . A A . 24 GLU CB 1 1 8 8147 1 1 24 GLU CD C -1.857 0.259 9.100 1.00 . A A . 24 GLU CD 1 1 8 8148 1 1 24 GLU CG C -1.555 0.636 7.663 1.00 . A A . 24 GLU CG 1 1 8 8149 1 1 24 GLU H H -0.205 1.116 5.521 1.00 . A A . 24 GLU H 1 1 8 8150 1 1 24 GLU HA H -2.333 -0.682 4.586 1.00 . A A . 24 GLU HA 1 1 8 8151 1 1 24 GLU HB2 H -3.406 -0.013 6.848 1.00 . A A . 24 GLU HB2 1 1 8 8152 1 1 24 GLU HB3 H -2.140 -1.226 6.818 1.00 . A A . 24 GLU HB3 1 1 8 8153 1 1 24 GLU HG2 H -0.504 0.477 7.478 1.00 . A A . 24 GLU HG2 1 1 8 8154 1 1 24 GLU HG3 H -1.791 1.681 7.522 1.00 . A A . 24 GLU HG3 1 1 8 8155 1 1 24 GLU N N -0.662 0.435 4.992 1.00 . A A . 24 GLU N 1 1 8 8156 1 1 24 GLU O O -3.164 2.260 5.629 1.00 . A A . 24 GLU O 1 1 8 8157 1 1 24 GLU OE1 O -2.840 0.790 9.658 1.00 . A A . 24 GLU OE1 1 1 8 8158 1 1 24 GLU OE2 O -1.111 -0.566 9.666 1.00 . A A . 24 GLU OE2 1 1 8 8159 1 1 25 TYR C C -5.591 2.191 3.263 1.00 . A A . 25 TYR C 1 1 8 8160 1 1 25 TYR CA C -4.112 2.492 3.050 1.00 . A A . 25 TYR CA 1 1 8 8161 1 1 25 TYR CB C -3.824 2.671 1.553 1.00 . A A . 25 TYR CB 1 1 8 8162 1 1 25 TYR CD1 C -1.382 3.290 1.631 1.00 . A A . 25 TYR CD1 1 1 8 8163 1 1 25 TYR CD2 C -2.888 4.811 0.603 1.00 . A A . 25 TYR CD2 1 1 8 8164 1 1 25 TYR CE1 C -0.328 4.143 1.370 1.00 . A A . 25 TYR CE1 1 1 8 8165 1 1 25 TYR CE2 C -1.840 5.672 0.337 1.00 . A A . 25 TYR CE2 1 1 8 8166 1 1 25 TYR CG C -2.675 3.608 1.252 1.00 . A A . 25 TYR CG 1 1 8 8167 1 1 25 TYR CZ C -0.569 5.328 0.679 1.00 . A A . 25 TYR CZ 1 1 8 8168 1 1 25 TYR H H -3.086 0.675 2.969 1.00 . A A . 25 TYR H 1 1 8 8169 1 1 25 TYR HA H -3.838 3.389 3.580 1.00 . A A . 25 TYR HA 1 1 8 8170 1 1 25 TYR HB2 H -3.578 1.710 1.128 1.00 . A A . 25 TYR HB2 1 1 8 8171 1 1 25 TYR HB3 H -4.701 3.056 1.061 1.00 . A A . 25 TYR HB3 1 1 8 8172 1 1 25 TYR HD1 H -1.203 2.360 2.137 1.00 . A A . 25 TYR HD1 1 1 8 8173 1 1 25 TYR HD2 H -3.889 5.071 0.303 1.00 . A A . 25 TYR HD2 1 1 8 8174 1 1 25 TYR HE1 H 0.673 3.872 1.673 1.00 . A A . 25 TYR HE1 1 1 8 8175 1 1 25 TYR HE2 H -2.026 6.604 -0.169 1.00 . A A . 25 TYR HE2 1 1 8 8176 1 1 25 TYR HH H 1.290 5.685 0.344 1.00 . A A . 25 TYR HH 1 1 8 8177 1 1 25 TYR N N -3.316 1.405 3.562 1.00 . A A . 25 TYR N 1 1 8 8178 1 1 25 TYR O O -5.947 1.284 4.011 1.00 . A A . 25 TYR O 1 1 8 8179 1 1 25 TYR OH O 0.483 6.191 0.466 1.00 . A A . 25 TYR OH 1 1 8 8180 1 1 26 LEU C C -8.394 2.709 1.284 1.00 . A A . 26 LEU C 1 1 8 8181 1 1 26 LEU CA C -7.875 2.781 2.693 1.00 . A A . 26 LEU CA 1 1 8 8182 1 1 26 LEU CB C -8.564 3.927 3.442 1.00 . A A . 26 LEU CB 1 1 8 8183 1 1 26 LEU CD1 C -10.782 4.576 4.436 1.00 . A A . 26 LEU CD1 1 1 8 8184 1 1 26 LEU CD2 C -10.396 4.857 1.978 1.00 . A A . 26 LEU CD2 1 1 8 8185 1 1 26 LEU CG C -10.080 4.022 3.212 1.00 . A A . 26 LEU CG 1 1 8 8186 1 1 26 LEU H H -6.095 3.716 2.110 1.00 . A A . 26 LEU H 1 1 8 8187 1 1 26 LEU HA H -8.075 1.846 3.186 1.00 . A A . 26 LEU HA 1 1 8 8188 1 1 26 LEU HB2 H -8.381 3.802 4.500 1.00 . A A . 26 LEU HB2 1 1 8 8189 1 1 26 LEU HB3 H -8.115 4.854 3.126 1.00 . A A . 26 LEU HB3 1 1 8 8190 1 1 26 LEU HD11 H -10.184 5.358 4.873 1.00 . A A . 26 LEU HD11 1 1 8 8191 1 1 26 LEU HD12 H -10.921 3.784 5.157 1.00 . A A . 26 LEU HD12 1 1 8 8192 1 1 26 LEU HD13 H -11.744 4.973 4.149 1.00 . A A . 26 LEU HD13 1 1 8 8193 1 1 26 LEU HD21 H -11.427 5.172 2.013 1.00 . A A . 26 LEU HD21 1 1 8 8194 1 1 26 LEU HD22 H -10.233 4.266 1.087 1.00 . A A . 26 LEU HD22 1 1 8 8195 1 1 26 LEU HD23 H -9.756 5.721 1.955 1.00 . A A . 26 LEU HD23 1 1 8 8196 1 1 26 LEU HG H -10.461 3.038 3.037 1.00 . A A . 26 LEU HG 1 1 8 8197 1 1 26 LEU N N -6.440 2.976 2.632 1.00 . A A . 26 LEU N 1 1 8 8198 1 1 26 LEU O O -7.731 3.165 0.361 1.00 . A A . 26 LEU O 1 1 8 8199 1 1 27 VAL C C -11.581 2.338 -0.327 1.00 . A A . 27 VAL C 1 1 8 8200 1 1 27 VAL CA C -10.084 2.071 -0.248 1.00 . A A . 27 VAL CA 1 1 8 8201 1 1 27 VAL CB C -9.724 0.741 -0.934 1.00 . A A . 27 VAL CB 1 1 8 8202 1 1 27 VAL CG1 C -8.393 0.209 -0.427 1.00 . A A . 27 VAL CG1 1 1 8 8203 1 1 27 VAL CG2 C -10.810 -0.320 -0.785 1.00 . A A . 27 VAL CG2 1 1 8 8204 1 1 27 VAL H H -10.046 1.718 1.830 1.00 . A A . 27 VAL H 1 1 8 8205 1 1 27 VAL HA H -9.589 2.844 -0.812 1.00 . A A . 27 VAL HA 1 1 8 8206 1 1 27 VAL HB H -9.609 0.972 -1.972 1.00 . A A . 27 VAL HB 1 1 8 8207 1 1 27 VAL HG11 H -8.393 0.210 0.653 1.00 . A A . 27 VAL HG11 1 1 8 8208 1 1 27 VAL HG12 H -7.591 0.835 -0.789 1.00 . A A . 27 VAL HG12 1 1 8 8209 1 1 27 VAL HG13 H -8.252 -0.801 -0.784 1.00 . A A . 27 VAL HG13 1 1 8 8210 1 1 27 VAL HG21 H -11.687 -0.011 -1.328 1.00 . A A . 27 VAL HG21 1 1 8 8211 1 1 27 VAL HG22 H -11.056 -0.434 0.259 1.00 . A A . 27 VAL HG22 1 1 8 8212 1 1 27 VAL HG23 H -10.453 -1.261 -1.177 1.00 . A A . 27 VAL HG23 1 1 8 8213 1 1 27 VAL N N -9.562 2.133 1.089 1.00 . A A . 27 VAL N 1 1 8 8214 1 1 27 VAL O O -12.396 1.575 0.192 1.00 . A A . 27 VAL O 1 1 8 8215 1 1 28 ARG C C -13.728 3.125 -2.470 1.00 . A A . 28 ARG C 1 1 8 8216 1 1 28 ARG CA C -13.316 3.778 -1.182 1.00 . A A . 28 ARG CA 1 1 8 8217 1 1 28 ARG CB C -13.523 5.290 -1.254 1.00 . A A . 28 ARG CB 1 1 8 8218 1 1 28 ARG CD C -15.114 7.226 -1.083 1.00 . A A . 28 ARG CD 1 1 8 8219 1 1 28 ARG CG C -14.976 5.712 -1.119 1.00 . A A . 28 ARG CG 1 1 8 8220 1 1 28 ARG CZ C -17.274 7.756 -0.021 1.00 . A A . 28 ARG CZ 1 1 8 8221 1 1 28 ARG H H -11.230 4.040 -1.305 1.00 . A A . 28 ARG H 1 1 8 8222 1 1 28 ARG HA H -13.902 3.360 -0.382 1.00 . A A . 28 ARG HA 1 1 8 8223 1 1 28 ARG HB2 H -12.956 5.761 -0.465 1.00 . A A . 28 ARG HB2 1 1 8 8224 1 1 28 ARG HB3 H -13.159 5.637 -2.207 1.00 . A A . 28 ARG HB3 1 1 8 8225 1 1 28 ARG HD2 H -14.649 7.596 -0.182 1.00 . A A . 28 ARG HD2 1 1 8 8226 1 1 28 ARG HD3 H -14.608 7.640 -1.943 1.00 . A A . 28 ARG HD3 1 1 8 8227 1 1 28 ARG HE H -16.901 7.879 -1.978 1.00 . A A . 28 ARG HE 1 1 8 8228 1 1 28 ARG HG2 H -15.533 5.330 -1.962 1.00 . A A . 28 ARG HG2 1 1 8 8229 1 1 28 ARG HG3 H -15.378 5.301 -0.205 1.00 . A A . 28 ARG HG3 1 1 8 8230 1 1 28 ARG HH11 H -15.845 7.118 1.259 1.00 . A A . 28 ARG HH11 1 1 8 8231 1 1 28 ARG HH12 H -17.365 7.521 1.983 1.00 . A A . 28 ARG HH12 1 1 8 8232 1 1 28 ARG HH21 H -18.901 8.405 -1.028 1.00 . A A . 28 ARG HH21 1 1 8 8233 1 1 28 ARG HH22 H -19.102 8.248 0.685 1.00 . A A . 28 ARG HH22 1 1 8 8234 1 1 28 ARG N N -11.927 3.441 -0.968 1.00 . A A . 28 ARG N 1 1 8 8235 1 1 28 ARG NE N -16.512 7.651 -1.107 1.00 . A A . 28 ARG NE 1 1 8 8236 1 1 28 ARG NH1 N -16.787 7.438 1.171 1.00 . A A . 28 ARG NH1 1 1 8 8237 1 1 28 ARG NH2 N -18.528 8.170 -0.130 1.00 . A A . 28 ARG NH2 1 1 8 8238 1 1 28 ARG O O -13.850 3.781 -3.503 1.00 . A A . 28 ARG O 1 1 8 8239 1 1 29 TRP C C -15.056 1.738 -4.577 1.00 . A A . 29 TRP C 1 1 8 8240 1 1 29 TRP CA C -14.291 0.974 -3.518 1.00 . A A . 29 TRP CA 1 1 8 8241 1 1 29 TRP CB C -15.116 -0.210 -3.033 1.00 . A A . 29 TRP CB 1 1 8 8242 1 1 29 TRP CD1 C -12.919 -1.506 -2.770 1.00 . A A . 29 TRP CD1 1 1 8 8243 1 1 29 TRP CD2 C -14.742 -2.644 -2.132 1.00 . A A . 29 TRP CD2 1 1 8 8244 1 1 29 TRP CE2 C -13.611 -3.460 -1.939 1.00 . A A . 29 TRP CE2 1 1 8 8245 1 1 29 TRP CE3 C -16.002 -3.149 -1.802 1.00 . A A . 29 TRP CE3 1 1 8 8246 1 1 29 TRP CG C -14.278 -1.396 -2.663 1.00 . A A . 29 TRP CG 1 1 8 8247 1 1 29 TRP CH2 C -14.951 -5.221 -1.113 1.00 . A A . 29 TRP CH2 1 1 8 8248 1 1 29 TRP CZ2 C -13.704 -4.752 -1.429 1.00 . A A . 29 TRP CZ2 1 1 8 8249 1 1 29 TRP CZ3 C -16.094 -4.432 -1.295 1.00 . A A . 29 TRP CZ3 1 1 8 8250 1 1 29 TRP H H -13.818 1.383 -1.509 1.00 . A A . 29 TRP H 1 1 8 8251 1 1 29 TRP HA H -13.383 0.599 -3.957 1.00 . A A . 29 TRP HA 1 1 8 8252 1 1 29 TRP HB2 H -15.672 0.093 -2.158 1.00 . A A . 29 TRP HB2 1 1 8 8253 1 1 29 TRP HB3 H -15.803 -0.509 -3.811 1.00 . A A . 29 TRP HB3 1 1 8 8254 1 1 29 TRP HD1 H -12.269 -0.722 -3.140 1.00 . A A . 29 TRP HD1 1 1 8 8255 1 1 29 TRP HE1 H -11.585 -3.060 -2.310 1.00 . A A . 29 TRP HE1 1 1 8 8256 1 1 29 TRP HE3 H -16.895 -2.555 -1.935 1.00 . A A . 29 TRP HE3 1 1 8 8257 1 1 29 TRP HH2 H -15.069 -6.218 -0.716 1.00 . A A . 29 TRP HH2 1 1 8 8258 1 1 29 TRP HZ2 H -12.833 -5.373 -1.281 1.00 . A A . 29 TRP HZ2 1 1 8 8259 1 1 29 TRP HZ3 H -17.059 -4.840 -1.034 1.00 . A A . 29 TRP HZ3 1 1 8 8260 1 1 29 TRP N N -13.925 1.810 -2.382 1.00 . A A . 29 TRP N 1 1 8 8261 1 1 29 TRP NE1 N -12.511 -2.743 -2.333 1.00 . A A . 29 TRP NE1 1 1 8 8262 1 1 29 TRP O O -16.273 1.867 -4.511 1.00 . A A . 29 TRP O 1 1 8 8263 1 1 30 LYS C C -16.242 2.536 -7.052 1.00 . A A . 30 LYS C 1 1 8 8264 1 1 30 LYS CA C -14.858 3.061 -6.649 1.00 . A A . 30 LYS CA 1 1 8 8265 1 1 30 LYS CB C -13.921 2.983 -7.857 1.00 . A A . 30 LYS CB 1 1 8 8266 1 1 30 LYS CD C -13.382 3.766 -10.181 1.00 . A A . 30 LYS CD 1 1 8 8267 1 1 30 LYS CE C -13.809 4.656 -11.336 1.00 . A A . 30 LYS CE 1 1 8 8268 1 1 30 LYS CG C -14.320 3.908 -8.994 1.00 . A A . 30 LYS CG 1 1 8 8269 1 1 30 LYS H H -13.304 2.264 -5.400 1.00 . A A . 30 LYS H 1 1 8 8270 1 1 30 LYS HA H -14.952 4.094 -6.347 1.00 . A A . 30 LYS HA 1 1 8 8271 1 1 30 LYS HB2 H -12.921 3.240 -7.545 1.00 . A A . 30 LYS HB2 1 1 8 8272 1 1 30 LYS HB3 H -13.923 1.971 -8.232 1.00 . A A . 30 LYS HB3 1 1 8 8273 1 1 30 LYS HD2 H -12.384 4.044 -9.875 1.00 . A A . 30 LYS HD2 1 1 8 8274 1 1 30 LYS HD3 H -13.386 2.737 -10.509 1.00 . A A . 30 LYS HD3 1 1 8 8275 1 1 30 LYS HE2 H -13.121 4.512 -12.156 1.00 . A A . 30 LYS HE2 1 1 8 8276 1 1 30 LYS HE3 H -14.803 4.369 -11.646 1.00 . A A . 30 LYS HE3 1 1 8 8277 1 1 30 LYS HG2 H -15.323 3.664 -9.310 1.00 . A A . 30 LYS HG2 1 1 8 8278 1 1 30 LYS HG3 H -14.289 4.929 -8.643 1.00 . A A . 30 LYS HG3 1 1 8 8279 1 1 30 LYS HZ1 H -14.096 6.678 -11.767 1.00 . A A . 30 LYS HZ1 1 1 8 8280 1 1 30 LYS HZ2 H -12.866 6.384 -10.643 1.00 . A A . 30 LYS HZ2 1 1 8 8281 1 1 30 LYS HZ3 H -14.487 6.255 -10.178 1.00 . A A . 30 LYS HZ3 1 1 8 8282 1 1 30 LYS N N -14.292 2.308 -5.513 1.00 . A A . 30 LYS N 1 1 8 8283 1 1 30 LYS NZ N -13.815 6.094 -10.954 1.00 . A A . 30 LYS NZ 1 1 8 8284 1 1 30 LYS O O -17.117 3.303 -7.451 1.00 . A A . 30 LYS O 1 1 8 8285 1 1 31 ASP C C -18.165 -0.260 -6.084 1.00 . A A . 31 ASP C 1 1 8 8286 1 1 31 ASP CA C -17.692 0.581 -7.268 1.00 . A A . 31 ASP CA 1 1 8 8287 1 1 31 ASP CB C -17.556 -0.294 -8.515 1.00 . A A . 31 ASP CB 1 1 8 8288 1 1 31 ASP CG C -17.078 0.490 -9.722 1.00 . A A . 31 ASP CG 1 1 8 8289 1 1 31 ASP H H -15.670 0.661 -6.655 1.00 . A A . 31 ASP H 1 1 8 8290 1 1 31 ASP HA H -18.417 1.359 -7.457 1.00 . A A . 31 ASP HA 1 1 8 8291 1 1 31 ASP HB2 H -16.846 -1.083 -8.317 1.00 . A A . 31 ASP HB2 1 1 8 8292 1 1 31 ASP HB3 H -18.518 -0.729 -8.748 1.00 . A A . 31 ASP HB3 1 1 8 8293 1 1 31 ASP N N -16.419 1.220 -6.947 1.00 . A A . 31 ASP N 1 1 8 8294 1 1 31 ASP O O -18.494 -1.437 -6.233 1.00 . A A . 31 ASP O 1 1 8 8295 1 1 31 ASP OD1 O -17.924 1.110 -10.398 1.00 . A A . 31 ASP OD1 1 1 8 8296 1 1 31 ASP OD2 O -15.859 0.482 -9.990 1.00 . A A . 31 ASP OD2 1 1 8 8297 1 1 32 GLY C C -19.632 0.458 -2.907 1.00 . A A . 32 GLY C 1 1 8 8298 1 1 32 GLY CA C -18.604 -0.325 -3.698 1.00 . A A . 32 GLY CA 1 1 8 8299 1 1 32 GLY H H -17.930 1.305 -4.863 1.00 . A A . 32 GLY H 1 1 8 8300 1 1 32 GLY HA2 H -19.019 -1.286 -3.961 1.00 . A A . 32 GLY HA2 1 1 8 8301 1 1 32 GLY HA3 H -17.730 -0.475 -3.074 1.00 . A A . 32 GLY HA3 1 1 8 8302 1 1 32 GLY N N -18.192 0.362 -4.908 1.00 . A A . 32 GLY N 1 1 8 8303 1 1 32 GLY O O -20.549 1.048 -3.478 1.00 . A A . 32 GLY O 1 1 8 8304 1 1 33 GLY C C -19.756 1.688 0.541 1.00 . A A . 33 GLY C 1 1 8 8305 1 1 33 GLY CA C -20.405 1.183 -0.734 1.00 . A A . 33 GLY CA 1 1 8 8306 1 1 33 GLY H H -18.729 -0.026 -1.187 1.00 . A A . 33 GLY H 1 1 8 8307 1 1 33 GLY HA2 H -20.800 2.027 -1.282 1.00 . A A . 33 GLY HA2 1 1 8 8308 1 1 33 GLY HA3 H -21.221 0.524 -0.471 1.00 . A A . 33 GLY HA3 1 1 8 8309 1 1 33 GLY N N -19.479 0.463 -1.585 1.00 . A A . 33 GLY N 1 1 8 8310 1 1 33 GLY O O -19.906 2.855 0.902 1.00 . A A . 33 GLY O 1 1 8 8311 1 1 34 ASP C C -16.890 1.506 2.223 1.00 . A A . 34 ASP C 1 1 8 8312 1 1 34 ASP CA C -18.359 1.165 2.468 1.00 . A A . 34 ASP CA 1 1 8 8313 1 1 34 ASP CB C -18.466 0.015 3.471 1.00 . A A . 34 ASP CB 1 1 8 8314 1 1 34 ASP CG C -19.905 -0.367 3.762 1.00 . A A . 34 ASP CG 1 1 8 8315 1 1 34 ASP H H -18.945 -0.107 0.880 1.00 . A A . 34 ASP H 1 1 8 8316 1 1 34 ASP HA H -18.855 2.033 2.874 1.00 . A A . 34 ASP HA 1 1 8 8317 1 1 34 ASP HB2 H -17.958 -0.851 3.074 1.00 . A A . 34 ASP HB2 1 1 8 8318 1 1 34 ASP HB3 H -17.997 0.309 4.398 1.00 . A A . 34 ASP HB3 1 1 8 8319 1 1 34 ASP N N -19.030 0.807 1.222 1.00 . A A . 34 ASP N 1 1 8 8320 1 1 34 ASP O O -16.410 1.453 1.092 1.00 . A A . 34 ASP O 1 1 8 8321 1 1 34 ASP OD1 O -20.451 -1.225 3.036 1.00 . A A . 34 ASP OD1 1 1 8 8322 1 1 34 ASP OD2 O -20.486 0.191 4.717 1.00 . A A . 34 ASP OD2 1 1 8 8323 1 1 35 CYS C C -13.926 1.344 4.133 1.00 . A A . 35 CYS C 1 1 8 8324 1 1 35 CYS CA C -14.770 2.210 3.201 1.00 . A A . 35 CYS CA 1 1 8 8325 1 1 35 CYS CB C -14.567 3.688 3.539 1.00 . A A . 35 CYS CB 1 1 8 8326 1 1 35 CYS H H -16.625 1.884 4.170 1.00 . A A . 35 CYS H 1 1 8 8327 1 1 35 CYS HA H -14.453 2.036 2.184 1.00 . A A . 35 CYS HA 1 1 8 8328 1 1 35 CYS HB2 H -14.904 3.867 4.549 1.00 . A A . 35 CYS HB2 1 1 8 8329 1 1 35 CYS HB3 H -13.515 3.924 3.469 1.00 . A A . 35 CYS HB3 1 1 8 8330 1 1 35 CYS HG H -14.792 5.969 2.424 1.00 . A A . 35 CYS HG 1 1 8 8331 1 1 35 CYS N N -16.184 1.858 3.296 1.00 . A A . 35 CYS N 1 1 8 8332 1 1 35 CYS O O -13.939 1.527 5.351 1.00 . A A . 35 CYS O 1 1 8 8333 1 1 35 CYS SG S -15.459 4.825 2.454 1.00 . A A . 35 CYS SG 1 1 8 8334 1 1 36 GLU C C -10.877 -0.056 4.254 1.00 . A A . 36 GLU C 1 1 8 8335 1 1 36 GLU CA C -12.337 -0.494 4.321 1.00 . A A . 36 GLU CA 1 1 8 8336 1 1 36 GLU CB C -12.474 -1.921 3.797 1.00 . A A . 36 GLU CB 1 1 8 8337 1 1 36 GLU CD C -14.923 -1.769 3.202 1.00 . A A . 36 GLU CD 1 1 8 8338 1 1 36 GLU CG C -13.861 -2.512 3.989 1.00 . A A . 36 GLU CG 1 1 8 8339 1 1 36 GLU H H -13.219 0.313 2.575 1.00 . A A . 36 GLU H 1 1 8 8340 1 1 36 GLU HA H -12.666 -0.463 5.349 1.00 . A A . 36 GLU HA 1 1 8 8341 1 1 36 GLU HB2 H -12.248 -1.922 2.745 1.00 . A A . 36 GLU HB2 1 1 8 8342 1 1 36 GLU HB3 H -11.762 -2.551 4.308 1.00 . A A . 36 GLU HB3 1 1 8 8343 1 1 36 GLU HG2 H -13.848 -3.541 3.664 1.00 . A A . 36 GLU HG2 1 1 8 8344 1 1 36 GLU HG3 H -14.114 -2.470 5.038 1.00 . A A . 36 GLU HG3 1 1 8 8345 1 1 36 GLU N N -13.189 0.404 3.549 1.00 . A A . 36 GLU N 1 1 8 8346 1 1 36 GLU O O -10.557 0.976 3.671 1.00 . A A . 36 GLU O 1 1 8 8347 1 1 36 GLU OE1 O -15.159 -2.134 2.031 1.00 . A A . 36 GLU OE1 1 1 8 8348 1 1 36 GLU OE2 O -15.518 -0.821 3.757 1.00 . A A . 36 GLU OE2 1 1 8 8349 1 1 37 TRP C C -7.761 -1.559 4.072 1.00 . A A . 37 TRP C 1 1 8 8350 1 1 37 TRP CA C -8.569 -0.540 4.864 1.00 . A A . 37 TRP CA 1 1 8 8351 1 1 37 TRP CB C -8.062 -0.492 6.305 1.00 . A A . 37 TRP CB 1 1 8 8352 1 1 37 TRP CD1 C -8.826 1.941 6.523 1.00 . A A . 37 TRP CD1 1 1 8 8353 1 1 37 TRP CD2 C -8.701 0.838 8.468 1.00 . A A . 37 TRP CD2 1 1 8 8354 1 1 37 TRP CE2 C -9.129 2.155 8.726 1.00 . A A . 37 TRP CE2 1 1 8 8355 1 1 37 TRP CE3 C -8.549 -0.045 9.540 1.00 . A A . 37 TRP CE3 1 1 8 8356 1 1 37 TRP CG C -8.514 0.723 7.052 1.00 . A A . 37 TRP CG 1 1 8 8357 1 1 37 TRP CH2 C -9.248 1.722 11.045 1.00 . A A . 37 TRP CH2 1 1 8 8358 1 1 37 TRP CZ2 C -9.405 2.608 10.014 1.00 . A A . 37 TRP CZ2 1 1 8 8359 1 1 37 TRP CZ3 C -8.824 0.407 10.818 1.00 . A A . 37 TRP CZ3 1 1 8 8360 1 1 37 TRP H H -10.306 -1.664 5.297 1.00 . A A . 37 TRP H 1 1 8 8361 1 1 37 TRP HA H -8.432 0.431 4.417 1.00 . A A . 37 TRP HA 1 1 8 8362 1 1 37 TRP HB2 H -8.418 -1.362 6.833 1.00 . A A . 37 TRP HB2 1 1 8 8363 1 1 37 TRP HB3 H -6.984 -0.499 6.297 1.00 . A A . 37 TRP HB3 1 1 8 8364 1 1 37 TRP HD1 H -8.783 2.176 5.468 1.00 . A A . 37 TRP HD1 1 1 8 8365 1 1 37 TRP HE1 H -9.467 3.742 7.396 1.00 . A A . 37 TRP HE1 1 1 8 8366 1 1 37 TRP HE3 H -8.224 -1.062 9.384 1.00 . A A . 37 TRP HE3 1 1 8 8367 1 1 37 TRP HH2 H -9.450 2.031 12.059 1.00 . A A . 37 TRP HH2 1 1 8 8368 1 1 37 TRP HZ2 H -9.732 3.619 10.206 1.00 . A A . 37 TRP HZ2 1 1 8 8369 1 1 37 TRP HZ3 H -8.711 -0.262 11.659 1.00 . A A . 37 TRP HZ3 1 1 8 8370 1 1 37 TRP N N -9.993 -0.852 4.851 1.00 . A A . 37 TRP N 1 1 8 8371 1 1 37 TRP NE1 N -9.198 2.809 7.523 1.00 . A A . 37 TRP NE1 1 1 8 8372 1 1 37 TRP O O -8.168 -2.710 3.915 1.00 . A A . 37 TRP O 1 1 8 8373 1 1 38 VAL C C -4.764 -2.699 3.767 1.00 . A A . 38 VAL C 1 1 8 8374 1 1 38 VAL CA C -5.713 -1.978 2.818 1.00 . A A . 38 VAL CA 1 1 8 8375 1 1 38 VAL CB C -4.905 -1.157 1.790 1.00 . A A . 38 VAL CB 1 1 8 8376 1 1 38 VAL CG1 C -3.836 -2.002 1.111 1.00 . A A . 38 VAL CG1 1 1 8 8377 1 1 38 VAL CG2 C -5.832 -0.531 0.762 1.00 . A A . 38 VAL CG2 1 1 8 8378 1 1 38 VAL H H -6.357 -0.183 3.723 1.00 . A A . 38 VAL H 1 1 8 8379 1 1 38 VAL HA H -6.309 -2.707 2.292 1.00 . A A . 38 VAL HA 1 1 8 8380 1 1 38 VAL HB H -4.415 -0.362 2.313 1.00 . A A . 38 VAL HB 1 1 8 8381 1 1 38 VAL HG11 H -3.321 -1.402 0.377 1.00 . A A . 38 VAL HG11 1 1 8 8382 1 1 38 VAL HG12 H -4.298 -2.849 0.626 1.00 . A A . 38 VAL HG12 1 1 8 8383 1 1 38 VAL HG13 H -3.128 -2.349 1.848 1.00 . A A . 38 VAL HG13 1 1 8 8384 1 1 38 VAL HG21 H -5.251 0.046 0.058 1.00 . A A . 38 VAL HG21 1 1 8 8385 1 1 38 VAL HG22 H -6.538 0.117 1.261 1.00 . A A . 38 VAL HG22 1 1 8 8386 1 1 38 VAL HG23 H -6.365 -1.307 0.239 1.00 . A A . 38 VAL HG23 1 1 8 8387 1 1 38 VAL N N -6.607 -1.119 3.581 1.00 . A A . 38 VAL N 1 1 8 8388 1 1 38 VAL O O -4.597 -2.294 4.917 1.00 . A A . 38 VAL O 1 1 8 8389 1 1 39 LYS C C -1.860 -3.930 4.227 1.00 . A A . 39 LYS C 1 1 8 8390 1 1 39 LYS CA C -3.246 -4.549 4.116 1.00 . A A . 39 LYS CA 1 1 8 8391 1 1 39 LYS CB C -3.141 -5.977 3.583 1.00 . A A . 39 LYS CB 1 1 8 8392 1 1 39 LYS CD C -3.536 -7.118 5.784 1.00 . A A . 39 LYS CD 1 1 8 8393 1 1 39 LYS CE C -3.124 -8.277 6.677 1.00 . A A . 39 LYS CE 1 1 8 8394 1 1 39 LYS CG C -2.599 -6.970 4.598 1.00 . A A . 39 LYS CG 1 1 8 8395 1 1 39 LYS H H -4.297 -4.035 2.356 1.00 . A A . 39 LYS H 1 1 8 8396 1 1 39 LYS HA H -3.672 -4.576 5.100 1.00 . A A . 39 LYS HA 1 1 8 8397 1 1 39 LYS HB2 H -4.123 -6.307 3.278 1.00 . A A . 39 LYS HB2 1 1 8 8398 1 1 39 LYS HB3 H -2.486 -5.980 2.724 1.00 . A A . 39 LYS HB3 1 1 8 8399 1 1 39 LYS HD2 H -3.516 -6.207 6.363 1.00 . A A . 39 LYS HD2 1 1 8 8400 1 1 39 LYS HD3 H -4.538 -7.293 5.420 1.00 . A A . 39 LYS HD3 1 1 8 8401 1 1 39 LYS HE2 H -2.119 -8.105 7.029 1.00 . A A . 39 LYS HE2 1 1 8 8402 1 1 39 LYS HE3 H -3.798 -8.322 7.521 1.00 . A A . 39 LYS HE3 1 1 8 8403 1 1 39 LYS HG2 H -2.484 -7.933 4.120 1.00 . A A . 39 LYS HG2 1 1 8 8404 1 1 39 LYS HG3 H -1.638 -6.624 4.950 1.00 . A A . 39 LYS HG3 1 1 8 8405 1 1 39 LYS HZ1 H -2.976 -10.361 6.611 1.00 . A A . 39 LYS HZ1 1 1 8 8406 1 1 39 LYS HZ2 H -2.451 -9.590 5.197 1.00 . A A . 39 LYS HZ2 1 1 8 8407 1 1 39 LYS HZ3 H -4.105 -9.719 5.526 1.00 . A A . 39 LYS HZ3 1 1 8 8408 1 1 39 LYS N N -4.144 -3.767 3.285 1.00 . A A . 39 LYS N 1 1 8 8409 1 1 39 LYS NZ N -3.166 -9.578 5.953 1.00 . A A . 39 LYS NZ 1 1 8 8410 1 1 39 LYS O O -1.024 -4.072 3.334 1.00 . A A . 39 LYS O 1 1 8 8411 1 1 40 GLY C C 0.527 -3.486 6.490 1.00 . A A . 40 GLY C 1 1 8 8412 1 1 40 GLY CA C -0.336 -2.635 5.587 1.00 . A A . 40 GLY CA 1 1 8 8413 1 1 40 GLY H H -2.350 -3.135 5.992 1.00 . A A . 40 GLY H 1 1 8 8414 1 1 40 GLY HA2 H 0.175 -2.519 4.644 1.00 . A A . 40 GLY HA2 1 1 8 8415 1 1 40 GLY HA3 H -0.471 -1.666 6.038 1.00 . A A . 40 GLY HA3 1 1 8 8416 1 1 40 GLY N N -1.629 -3.243 5.341 1.00 . A A . 40 GLY N 1 1 8 8417 1 1 40 GLY O O 1.393 -2.979 7.203 1.00 . A A . 40 GLY O 1 1 8 8418 1 1 41 VAL C C 1.999 -6.490 6.343 1.00 . A A . 41 VAL C 1 1 8 8419 1 1 41 VAL CA C 1.053 -5.723 7.260 1.00 . A A . 41 VAL CA 1 1 8 8420 1 1 41 VAL CB C 0.179 -6.748 8.005 1.00 . A A . 41 VAL CB 1 1 8 8421 1 1 41 VAL CG1 C 0.885 -7.235 9.261 1.00 . A A . 41 VAL CG1 1 1 8 8422 1 1 41 VAL CG2 C -1.191 -6.172 8.342 1.00 . A A . 41 VAL CG2 1 1 8 8423 1 1 41 VAL H H -0.466 -5.118 5.924 1.00 . A A . 41 VAL H 1 1 8 8424 1 1 41 VAL HA H 1.630 -5.166 7.984 1.00 . A A . 41 VAL HA 1 1 8 8425 1 1 41 VAL HB H 0.041 -7.598 7.352 1.00 . A A . 41 VAL HB 1 1 8 8426 1 1 41 VAL HG11 H 0.249 -7.937 9.781 1.00 . A A . 41 VAL HG11 1 1 8 8427 1 1 41 VAL HG12 H 1.095 -6.394 9.906 1.00 . A A . 41 VAL HG12 1 1 8 8428 1 1 41 VAL HG13 H 1.810 -7.721 8.989 1.00 . A A . 41 VAL HG13 1 1 8 8429 1 1 41 VAL HG21 H -1.728 -5.964 7.430 1.00 . A A . 41 VAL HG21 1 1 8 8430 1 1 41 VAL HG22 H -1.068 -5.258 8.904 1.00 . A A . 41 VAL HG22 1 1 8 8431 1 1 41 VAL HG23 H -1.746 -6.884 8.934 1.00 . A A . 41 VAL HG23 1 1 8 8432 1 1 41 VAL N N 0.269 -4.782 6.478 1.00 . A A . 41 VAL N 1 1 8 8433 1 1 41 VAL O O 2.799 -7.304 6.804 1.00 . A A . 41 VAL O 1 1 8 8434 1 1 42 HIS C C 4.150 -6.368 4.148 1.00 . A A . 42 HIS C 1 1 8 8435 1 1 42 HIS CA C 2.747 -6.906 4.070 1.00 . A A . 42 HIS CA 1 1 8 8436 1 1 42 HIS CB C 2.175 -6.773 2.661 1.00 . A A . 42 HIS CB 1 1 8 8437 1 1 42 HIS CD2 C -0.360 -7.054 2.214 1.00 . A A . 42 HIS CD2 1 1 8 8438 1 1 42 HIS CE1 C -0.477 -9.236 2.377 1.00 . A A . 42 HIS CE1 1 1 8 8439 1 1 42 HIS CG C 0.886 -7.509 2.477 1.00 . A A . 42 HIS CG 1 1 8 8440 1 1 42 HIS H H 1.272 -5.547 4.717 1.00 . A A . 42 HIS H 1 1 8 8441 1 1 42 HIS HA H 2.782 -7.940 4.340 1.00 . A A . 42 HIS HA 1 1 8 8442 1 1 42 HIS HB2 H 1.990 -5.734 2.456 1.00 . A A . 42 HIS HB2 1 1 8 8443 1 1 42 HIS HB3 H 2.887 -7.158 1.948 1.00 . A A . 42 HIS HB3 1 1 8 8444 1 1 42 HIS HD1 H 1.516 -9.500 2.756 1.00 . A A . 42 HIS HD1 1 1 8 8445 1 1 42 HIS HD2 H -0.649 -6.023 2.078 1.00 . A A . 42 HIS HD2 1 1 8 8446 1 1 42 HIS HE1 H -0.858 -10.247 2.398 1.00 . A A . 42 HIS HE1 1 1 8 8447 1 1 42 HIS HE2 H -2.128 -8.135 1.877 1.00 . A A . 42 HIS HE2 1 1 8 8448 1 1 42 HIS N N 1.904 -6.228 5.034 1.00 . A A . 42 HIS N 1 1 8 8449 1 1 42 HIS ND1 N 0.780 -8.880 2.573 1.00 . A A . 42 HIS ND1 1 1 8 8450 1 1 42 HIS NE2 N -1.190 -8.147 2.157 1.00 . A A . 42 HIS NE2 1 1 8 8451 1 1 42 HIS O O 4.568 -5.547 3.338 1.00 . A A . 42 HIS O 1 1 8 8452 1 1 43 VAL C C 7.172 -6.736 4.283 1.00 . A A . 43 VAL C 1 1 8 8453 1 1 43 VAL CA C 6.225 -6.461 5.437 1.00 . A A . 43 VAL CA 1 1 8 8454 1 1 43 VAL CB C 6.752 -7.148 6.709 1.00 . A A . 43 VAL CB 1 1 8 8455 1 1 43 VAL CG1 C 6.725 -8.662 6.561 1.00 . A A . 43 VAL CG1 1 1 8 8456 1 1 43 VAL CG2 C 8.153 -6.659 7.049 1.00 . A A . 43 VAL CG2 1 1 8 8457 1 1 43 VAL H H 4.400 -7.481 5.769 1.00 . A A . 43 VAL H 1 1 8 8458 1 1 43 VAL HA H 6.228 -5.405 5.610 1.00 . A A . 43 VAL HA 1 1 8 8459 1 1 43 VAL HB H 6.098 -6.879 7.523 1.00 . A A . 43 VAL HB 1 1 8 8460 1 1 43 VAL HG11 H 5.804 -8.958 6.080 1.00 . A A . 43 VAL HG11 1 1 8 8461 1 1 43 VAL HG12 H 6.781 -9.118 7.538 1.00 . A A . 43 VAL HG12 1 1 8 8462 1 1 43 VAL HG13 H 7.564 -8.983 5.965 1.00 . A A . 43 VAL HG13 1 1 8 8463 1 1 43 VAL HG21 H 8.123 -5.599 7.254 1.00 . A A . 43 VAL HG21 1 1 8 8464 1 1 43 VAL HG22 H 8.815 -6.847 6.218 1.00 . A A . 43 VAL HG22 1 1 8 8465 1 1 43 VAL HG23 H 8.515 -7.182 7.921 1.00 . A A . 43 VAL HG23 1 1 8 8466 1 1 43 VAL N N 4.849 -6.854 5.161 1.00 . A A . 43 VAL N 1 1 8 8467 1 1 43 VAL O O 8.029 -7.617 4.348 1.00 . A A . 43 VAL O 1 1 8 8468 1 1 44 ALA C C 8.984 -5.061 2.196 1.00 . A A . 44 ALA C 1 1 8 8469 1 1 44 ALA CA C 7.853 -6.064 2.060 1.00 . A A . 44 ALA CA 1 1 8 8470 1 1 44 ALA CB C 7.061 -5.841 0.782 1.00 . A A . 44 ALA CB 1 1 8 8471 1 1 44 ALA H H 6.263 -5.324 3.223 1.00 . A A . 44 ALA H 1 1 8 8472 1 1 44 ALA HA H 8.275 -7.054 2.037 1.00 . A A . 44 ALA HA 1 1 8 8473 1 1 44 ALA HB1 H 6.112 -6.352 0.854 1.00 . A A . 44 ALA HB1 1 1 8 8474 1 1 44 ALA HB2 H 7.615 -6.232 -0.056 1.00 . A A . 44 ALA HB2 1 1 8 8475 1 1 44 ALA HB3 H 6.892 -4.784 0.642 1.00 . A A . 44 ALA HB3 1 1 8 8476 1 1 44 ALA N N 6.996 -5.972 3.221 1.00 . A A . 44 ALA N 1 1 8 8477 1 1 44 ALA O O 9.263 -4.284 1.284 1.00 . A A . 44 ALA O 1 1 8 8478 1 1 45 GLU C C 11.702 -4.110 2.490 1.00 . A A . 45 GLU C 1 1 8 8479 1 1 45 GLU CA C 10.738 -4.191 3.662 1.00 . A A . 45 GLU CA 1 1 8 8480 1 1 45 GLU CB C 11.475 -4.663 4.918 1.00 . A A . 45 GLU CB 1 1 8 8481 1 1 45 GLU CD C 13.301 -4.210 6.603 1.00 . A A . 45 GLU CD 1 1 8 8482 1 1 45 GLU CG C 12.668 -3.797 5.288 1.00 . A A . 45 GLU CG 1 1 8 8483 1 1 45 GLU H H 9.367 -5.762 4.023 1.00 . A A . 45 GLU H 1 1 8 8484 1 1 45 GLU HA H 10.326 -3.210 3.844 1.00 . A A . 45 GLU HA 1 1 8 8485 1 1 45 GLU HB2 H 10.785 -4.658 5.749 1.00 . A A . 45 GLU HB2 1 1 8 8486 1 1 45 GLU HB3 H 11.825 -5.672 4.758 1.00 . A A . 45 GLU HB3 1 1 8 8487 1 1 45 GLU HG2 H 13.411 -3.880 4.508 1.00 . A A . 45 GLU HG2 1 1 8 8488 1 1 45 GLU HG3 H 12.342 -2.771 5.366 1.00 . A A . 45 GLU HG3 1 1 8 8489 1 1 45 GLU N N 9.632 -5.096 3.358 1.00 . A A . 45 GLU N 1 1 8 8490 1 1 45 GLU O O 12.378 -3.101 2.290 1.00 . A A . 45 GLU O 1 1 8 8491 1 1 45 GLU OE1 O 14.209 -5.067 6.583 1.00 . A A . 45 GLU OE1 1 1 8 8492 1 1 45 GLU OE2 O 12.889 -3.674 7.653 1.00 . A A . 45 GLU OE2 1 1 8 8493 1 1 46 ASP C C 12.122 -4.284 -0.521 1.00 . A A . 46 ASP C 1 1 8 8494 1 1 46 ASP CA C 12.619 -5.242 0.549 1.00 . A A . 46 ASP CA 1 1 8 8495 1 1 46 ASP CB C 12.671 -6.663 -0.006 1.00 . A A . 46 ASP CB 1 1 8 8496 1 1 46 ASP CG C 13.214 -7.658 1.000 1.00 . A A . 46 ASP CG 1 1 8 8497 1 1 46 ASP H H 11.196 -5.962 1.945 1.00 . A A . 46 ASP H 1 1 8 8498 1 1 46 ASP HA H 13.613 -4.941 0.846 1.00 . A A . 46 ASP HA 1 1 8 8499 1 1 46 ASP HB2 H 11.675 -6.968 -0.287 1.00 . A A . 46 ASP HB2 1 1 8 8500 1 1 46 ASP HB3 H 13.306 -6.675 -0.879 1.00 . A A . 46 ASP HB3 1 1 8 8501 1 1 46 ASP N N 11.754 -5.185 1.718 1.00 . A A . 46 ASP N 1 1 8 8502 1 1 46 ASP O O 12.893 -3.508 -1.075 1.00 . A A . 46 ASP O 1 1 8 8503 1 1 46 ASP OD1 O 14.448 -7.845 1.043 1.00 . A A . 46 ASP OD1 1 1 8 8504 1 1 46 ASP OD2 O 12.405 -8.251 1.745 1.00 . A A . 46 ASP OD2 1 1 8 8505 1 1 47 VAL C C 10.558 -2.002 -1.505 1.00 . A A . 47 VAL C 1 1 8 8506 1 1 47 VAL CA C 10.237 -3.463 -1.805 1.00 . A A . 47 VAL CA 1 1 8 8507 1 1 47 VAL CB C 8.713 -3.648 -1.889 1.00 . A A . 47 VAL CB 1 1 8 8508 1 1 47 VAL CG1 C 8.129 -2.766 -2.980 1.00 . A A . 47 VAL CG1 1 1 8 8509 1 1 47 VAL CG2 C 8.366 -5.109 -2.139 1.00 . A A . 47 VAL CG2 1 1 8 8510 1 1 47 VAL H H 10.251 -4.955 -0.307 1.00 . A A . 47 VAL H 1 1 8 8511 1 1 47 VAL HA H 10.666 -3.725 -2.762 1.00 . A A . 47 VAL HA 1 1 8 8512 1 1 47 VAL HB H 8.282 -3.354 -0.944 1.00 . A A . 47 VAL HB 1 1 8 8513 1 1 47 VAL HG11 H 8.468 -3.114 -3.944 1.00 . A A . 47 VAL HG11 1 1 8 8514 1 1 47 VAL HG12 H 8.454 -1.746 -2.830 1.00 . A A . 47 VAL HG12 1 1 8 8515 1 1 47 VAL HG13 H 7.050 -2.810 -2.941 1.00 . A A . 47 VAL HG13 1 1 8 8516 1 1 47 VAL HG21 H 8.669 -5.385 -3.139 1.00 . A A . 47 VAL HG21 1 1 8 8517 1 1 47 VAL HG22 H 7.300 -5.249 -2.037 1.00 . A A . 47 VAL HG22 1 1 8 8518 1 1 47 VAL HG23 H 8.882 -5.731 -1.424 1.00 . A A . 47 VAL HG23 1 1 8 8519 1 1 47 VAL N N 10.825 -4.331 -0.798 1.00 . A A . 47 VAL N 1 1 8 8520 1 1 47 VAL O O 10.853 -1.248 -2.399 1.00 . A A . 47 VAL O 1 1 8 8521 1 1 48 ALA C C 12.273 -0.018 0.233 1.00 . A A . 48 ALA C 1 1 8 8522 1 1 48 ALA CA C 10.782 -0.305 0.288 1.00 . A A . 48 ALA CA 1 1 8 8523 1 1 48 ALA CB C 10.289 -0.183 1.722 1.00 . A A . 48 ALA CB 1 1 8 8524 1 1 48 ALA H H 10.261 -2.325 0.394 1.00 . A A . 48 ALA H 1 1 8 8525 1 1 48 ALA HA H 10.254 0.425 -0.304 1.00 . A A . 48 ALA HA 1 1 8 8526 1 1 48 ALA HB1 H 10.773 0.657 2.199 1.00 . A A . 48 ALA HB1 1 1 8 8527 1 1 48 ALA HB2 H 10.522 -1.088 2.263 1.00 . A A . 48 ALA HB2 1 1 8 8528 1 1 48 ALA HB3 H 9.221 -0.026 1.721 1.00 . A A . 48 ALA HB3 1 1 8 8529 1 1 48 ALA N N 10.498 -1.652 -0.226 1.00 . A A . 48 ALA N 1 1 8 8530 1 1 48 ALA O O 12.711 0.925 -0.426 1.00 . A A . 48 ALA O 1 1 8 8531 1 1 49 LYS C C 15.017 -0.714 -0.492 1.00 . A A . 49 LYS C 1 1 8 8532 1 1 49 LYS CA C 14.498 -0.678 0.938 1.00 . A A . 49 LYS CA 1 1 8 8533 1 1 49 LYS CB C 15.161 -1.780 1.766 1.00 . A A . 49 LYS CB 1 1 8 8534 1 1 49 LYS CD C 17.111 -0.377 2.492 1.00 . A A . 49 LYS CD 1 1 8 8535 1 1 49 LYS CE C 16.641 -0.311 3.936 1.00 . A A . 49 LYS CE 1 1 8 8536 1 1 49 LYS CG C 16.675 -1.668 1.821 1.00 . A A . 49 LYS CG 1 1 8 8537 1 1 49 LYS H H 12.648 -1.577 1.437 1.00 . A A . 49 LYS H 1 1 8 8538 1 1 49 LYS HA H 14.727 0.284 1.373 1.00 . A A . 49 LYS HA 1 1 8 8539 1 1 49 LYS HB2 H 14.782 -1.734 2.776 1.00 . A A . 49 LYS HB2 1 1 8 8540 1 1 49 LYS HB3 H 14.907 -2.739 1.339 1.00 . A A . 49 LYS HB3 1 1 8 8541 1 1 49 LYS HD2 H 18.189 -0.317 2.471 1.00 . A A . 49 LYS HD2 1 1 8 8542 1 1 49 LYS HD3 H 16.692 0.456 1.950 1.00 . A A . 49 LYS HD3 1 1 8 8543 1 1 49 LYS HE2 H 16.943 0.636 4.356 1.00 . A A . 49 LYS HE2 1 1 8 8544 1 1 49 LYS HE3 H 15.563 -0.386 3.954 1.00 . A A . 49 LYS HE3 1 1 8 8545 1 1 49 LYS HG2 H 17.070 -2.504 2.378 1.00 . A A . 49 LYS HG2 1 1 8 8546 1 1 49 LYS HG3 H 17.064 -1.689 0.812 1.00 . A A . 49 LYS HG3 1 1 8 8547 1 1 49 LYS HZ1 H 16.885 -1.335 5.740 1.00 . A A . 49 LYS HZ1 1 1 8 8548 1 1 49 LYS HZ2 H 18.255 -1.357 4.748 1.00 . A A . 49 LYS HZ2 1 1 8 8549 1 1 49 LYS HZ3 H 16.925 -2.334 4.376 1.00 . A A . 49 LYS HZ3 1 1 8 8550 1 1 49 LYS N N 13.053 -0.840 0.930 1.00 . A A . 49 LYS N 1 1 8 8551 1 1 49 LYS NZ N 17.217 -1.411 4.757 1.00 . A A . 49 LYS NZ 1 1 8 8552 1 1 49 LYS O O 16.053 -0.136 -0.808 1.00 . A A . 49 LYS O 1 1 8 8553 1 1 50 ASP C C 13.915 -0.483 -3.569 1.00 . A A . 50 ASP C 1 1 8 8554 1 1 50 ASP CA C 14.641 -1.548 -2.747 1.00 . A A . 50 ASP CA 1 1 8 8555 1 1 50 ASP CB C 14.289 -2.944 -3.263 1.00 . A A . 50 ASP CB 1 1 8 8556 1 1 50 ASP CG C 15.038 -3.298 -4.533 1.00 . A A . 50 ASP CG 1 1 8 8557 1 1 50 ASP H H 13.493 -1.892 -1.017 1.00 . A A . 50 ASP H 1 1 8 8558 1 1 50 ASP HA H 15.706 -1.395 -2.840 1.00 . A A . 50 ASP HA 1 1 8 8559 1 1 50 ASP HB2 H 14.533 -3.675 -2.502 1.00 . A A . 50 ASP HB2 1 1 8 8560 1 1 50 ASP HB3 H 13.230 -2.986 -3.469 1.00 . A A . 50 ASP HB3 1 1 8 8561 1 1 50 ASP N N 14.292 -1.431 -1.342 1.00 . A A . 50 ASP N 1 1 8 8562 1 1 50 ASP O O 14.337 -0.146 -4.674 1.00 . A A . 50 ASP O 1 1 8 8563 1 1 50 ASP OD1 O 14.624 -2.834 -5.616 1.00 . A A . 50 ASP OD1 1 1 8 8564 1 1 50 ASP OD2 O 16.039 -4.039 -4.443 1.00 . A A . 50 ASP OD2 1 1 8 8565 1 1 51 TYR C C 12.745 2.388 -3.687 1.00 . A A . 51 TYR C 1 1 8 8566 1 1 51 TYR CA C 12.032 1.051 -3.724 1.00 . A A . 51 TYR CA 1 1 8 8567 1 1 51 TYR CB C 10.638 1.238 -3.127 1.00 . A A . 51 TYR CB 1 1 8 8568 1 1 51 TYR CD1 C 9.804 -0.535 -4.747 1.00 . A A . 51 TYR CD1 1 1 8 8569 1 1 51 TYR CD2 C 8.194 0.844 -3.654 1.00 . A A . 51 TYR CD2 1 1 8 8570 1 1 51 TYR CE1 C 8.788 -1.199 -5.409 1.00 . A A . 51 TYR CE1 1 1 8 8571 1 1 51 TYR CE2 C 7.175 0.184 -4.312 1.00 . A A . 51 TYR CE2 1 1 8 8572 1 1 51 TYR CG C 9.527 0.501 -3.858 1.00 . A A . 51 TYR CG 1 1 8 8573 1 1 51 TYR CZ C 7.476 -0.836 -5.188 1.00 . A A . 51 TYR CZ 1 1 8 8574 1 1 51 TYR H H 12.511 -0.273 -2.152 1.00 . A A . 51 TYR H 1 1 8 8575 1 1 51 TYR HA H 11.925 0.713 -4.721 1.00 . A A . 51 TYR HA 1 1 8 8576 1 1 51 TYR HB2 H 10.656 0.892 -2.123 1.00 . A A . 51 TYR HB2 1 1 8 8577 1 1 51 TYR HB3 H 10.391 2.290 -3.131 1.00 . A A . 51 TYR HB3 1 1 8 8578 1 1 51 TYR HD1 H 10.828 -0.823 -4.919 1.00 . A A . 51 TYR HD1 1 1 8 8579 1 1 51 TYR HD2 H 7.957 1.641 -2.966 1.00 . A A . 51 TYR HD2 1 1 8 8580 1 1 51 TYR HE1 H 9.024 -2.000 -6.094 1.00 . A A . 51 TYR HE1 1 1 8 8581 1 1 51 TYR HE2 H 6.147 0.467 -4.139 1.00 . A A . 51 TYR HE2 1 1 8 8582 1 1 51 TYR HH H 5.823 -0.859 -6.169 1.00 . A A . 51 TYR HH 1 1 8 8583 1 1 51 TYR N N 12.810 0.037 -3.027 1.00 . A A . 51 TYR N 1 1 8 8584 1 1 51 TYR O O 13.198 2.905 -4.708 1.00 . A A . 51 TYR O 1 1 8 8585 1 1 51 TYR OH O 6.464 -1.497 -5.845 1.00 . A A . 51 TYR OH 1 1 8 8586 1 1 52 GLU C C 14.974 4.091 -2.126 1.00 . A A . 52 GLU C 1 1 8 8587 1 1 52 GLU CA C 13.463 4.228 -2.266 1.00 . A A . 52 GLU CA 1 1 8 8588 1 1 52 GLU CB C 12.889 4.899 -1.016 1.00 . A A . 52 GLU CB 1 1 8 8589 1 1 52 GLU CD C 12.559 4.786 1.487 1.00 . A A . 52 GLU CD 1 1 8 8590 1 1 52 GLU CG C 13.224 4.167 0.274 1.00 . A A . 52 GLU CG 1 1 8 8591 1 1 52 GLU H H 12.455 2.459 -1.711 1.00 . A A . 52 GLU H 1 1 8 8592 1 1 52 GLU HA H 13.243 4.837 -3.119 1.00 . A A . 52 GLU HA 1 1 8 8593 1 1 52 GLU HB2 H 13.282 5.902 -0.948 1.00 . A A . 52 GLU HB2 1 1 8 8594 1 1 52 GLU HB3 H 11.814 4.947 -1.109 1.00 . A A . 52 GLU HB3 1 1 8 8595 1 1 52 GLU HG2 H 12.896 3.142 0.187 1.00 . A A . 52 GLU HG2 1 1 8 8596 1 1 52 GLU HG3 H 14.294 4.190 0.417 1.00 . A A . 52 GLU HG3 1 1 8 8597 1 1 52 GLU N N 12.830 2.939 -2.480 1.00 . A A . 52 GLU N 1 1 8 8598 1 1 52 GLU O O 15.737 4.818 -2.762 1.00 . A A . 52 GLU O 1 1 8 8599 1 1 52 GLU OE1 O 12.808 5.981 1.754 1.00 . A A . 52 GLU OE1 1 1 8 8600 1 1 52 GLU OE2 O 11.793 4.076 2.171 1.00 . A A . 52 GLU OE2 1 1 8 8601 1 1 53 ASP C C 17.464 2.175 -2.204 1.00 . A A . 53 ASP C 1 1 8 8602 1 1 53 ASP CA C 16.813 2.927 -1.047 1.00 . A A . 53 ASP CA 1 1 8 8603 1 1 53 ASP CB C 16.997 2.154 0.258 1.00 . A A . 53 ASP CB 1 1 8 8604 1 1 53 ASP CG C 17.283 3.065 1.436 1.00 . A A . 53 ASP CG 1 1 8 8605 1 1 53 ASP H H 14.738 2.601 -0.821 1.00 . A A . 53 ASP H 1 1 8 8606 1 1 53 ASP HA H 17.288 3.891 -0.950 1.00 . A A . 53 ASP HA 1 1 8 8607 1 1 53 ASP HB2 H 16.089 1.606 0.469 1.00 . A A . 53 ASP HB2 1 1 8 8608 1 1 53 ASP HB3 H 17.817 1.461 0.148 1.00 . A A . 53 ASP HB3 1 1 8 8609 1 1 53 ASP N N 15.396 3.155 -1.289 1.00 . A A . 53 ASP N 1 1 8 8610 1 1 53 ASP O O 18.611 2.443 -2.558 1.00 . A A . 53 ASP O 1 1 8 8611 1 1 53 ASP OD1 O 16.316 3.565 2.048 1.00 . A A . 53 ASP OD1 1 1 8 8612 1 1 53 ASP OD2 O 18.474 3.280 1.743 1.00 . A A . 53 ASP OD2 1 1 8 8613 1 1 54 GLY C C 17.838 1.357 -4.988 1.00 . A A . 54 GLY C 1 1 8 8614 1 1 54 GLY CA C 17.268 0.470 -3.902 1.00 . A A . 54 GLY CA 1 1 8 8615 1 1 54 GLY H H 15.820 1.064 -2.474 1.00 . A A . 54 GLY H 1 1 8 8616 1 1 54 GLY HA2 H 18.050 -0.176 -3.531 1.00 . A A . 54 GLY HA2 1 1 8 8617 1 1 54 GLY HA3 H 16.482 -0.139 -4.322 1.00 . A A . 54 GLY HA3 1 1 8 8618 1 1 54 GLY N N 16.730 1.237 -2.793 1.00 . A A . 54 GLY N 1 1 8 8619 1 1 54 GLY O O 18.912 1.084 -5.524 1.00 . A A . 54 GLY O 1 1 8 8620 1 1 55 LEU C C 18.513 4.386 -5.739 1.00 . A A . 55 LEU C 1 1 8 8621 1 1 55 LEU CA C 17.555 3.362 -6.333 1.00 . A A . 55 LEU CA 1 1 8 8622 1 1 55 LEU CB C 16.350 4.069 -6.958 1.00 . A A . 55 LEU CB 1 1 8 8623 1 1 55 LEU CD1 C 15.036 1.951 -7.223 1.00 . A A . 55 LEU CD1 1 1 8 8624 1 1 55 LEU CD2 C 14.352 4.006 -8.471 1.00 . A A . 55 LEU CD2 1 1 8 8625 1 1 55 LEU CG C 15.525 3.210 -7.919 1.00 . A A . 55 LEU CG 1 1 8 8626 1 1 55 LEU H H 16.264 2.580 -4.853 1.00 . A A . 55 LEU H 1 1 8 8627 1 1 55 LEU HA H 18.072 2.803 -7.099 1.00 . A A . 55 LEU HA 1 1 8 8628 1 1 55 LEU HB2 H 15.702 4.403 -6.159 1.00 . A A . 55 LEU HB2 1 1 8 8629 1 1 55 LEU HB3 H 16.706 4.933 -7.497 1.00 . A A . 55 LEU HB3 1 1 8 8630 1 1 55 LEU HD11 H 14.472 2.221 -6.343 1.00 . A A . 55 LEU HD11 1 1 8 8631 1 1 55 LEU HD12 H 15.883 1.346 -6.935 1.00 . A A . 55 LEU HD12 1 1 8 8632 1 1 55 LEU HD13 H 14.404 1.389 -7.896 1.00 . A A . 55 LEU HD13 1 1 8 8633 1 1 55 LEU HD21 H 13.769 3.379 -9.127 1.00 . A A . 55 LEU HD21 1 1 8 8634 1 1 55 LEU HD22 H 14.724 4.858 -9.021 1.00 . A A . 55 LEU HD22 1 1 8 8635 1 1 55 LEU HD23 H 13.733 4.348 -7.654 1.00 . A A . 55 LEU HD23 1 1 8 8636 1 1 55 LEU HG H 16.148 2.912 -8.749 1.00 . A A . 55 LEU HG 1 1 8 8637 1 1 55 LEU N N 17.115 2.422 -5.313 1.00 . A A . 55 LEU N 1 1 8 8638 1 1 55 LEU O O 19.648 4.528 -6.193 1.00 . A A . 55 LEU O 1 1 8 8639 1 1 56 GLU C C 19.632 5.495 -2.889 1.00 . A A . 56 GLU C 1 1 8 8640 1 1 56 GLU CA C 18.860 6.105 -4.053 1.00 . A A . 56 GLU CA 1 1 8 8641 1 1 56 GLU CB C 17.985 7.254 -3.561 1.00 . A A . 56 GLU CB 1 1 8 8642 1 1 56 GLU CD C 18.284 8.559 -5.701 1.00 . A A . 56 GLU CD 1 1 8 8643 1 1 56 GLU CG C 17.301 8.018 -4.682 1.00 . A A . 56 GLU CG 1 1 8 8644 1 1 56 GLU H H 17.131 4.940 -4.406 1.00 . A A . 56 GLU H 1 1 8 8645 1 1 56 GLU HA H 19.563 6.489 -4.772 1.00 . A A . 56 GLU HA 1 1 8 8646 1 1 56 GLU HB2 H 17.227 6.853 -2.913 1.00 . A A . 56 GLU HB2 1 1 8 8647 1 1 56 GLU HB3 H 18.598 7.946 -3.003 1.00 . A A . 56 GLU HB3 1 1 8 8648 1 1 56 GLU HG2 H 16.612 7.355 -5.185 1.00 . A A . 56 GLU HG2 1 1 8 8649 1 1 56 GLU HG3 H 16.754 8.846 -4.254 1.00 . A A . 56 GLU HG3 1 1 8 8650 1 1 56 GLU N N 18.045 5.098 -4.719 1.00 . A A . 56 GLU N 1 1 8 8651 1 1 56 GLU O O 19.429 5.865 -1.732 1.00 . A A . 56 GLU O 1 1 8 8652 1 1 56 GLU OE1 O 18.896 9.616 -5.434 1.00 . A A . 56 GLU OE1 1 1 8 8653 1 1 56 GLU OE2 O 18.444 7.926 -6.766 1.00 . A A . 56 GLU OE2 1 1 8 8654 1 1 57 TYR C C 22.620 4.650 -1.932 1.00 . A A . 57 TYR C 1 1 8 8655 1 1 57 TYR CA C 21.323 3.888 -2.187 1.00 . A A . 57 TYR CA 1 1 8 8656 1 1 57 TYR CB C 21.637 2.453 -2.617 1.00 . A A . 57 TYR CB 1 1 8 8657 1 1 57 TYR CD1 C 21.897 1.272 -0.400 1.00 . A A . 57 TYR CD1 1 1 8 8658 1 1 57 TYR CD2 C 23.782 1.358 -1.857 1.00 . A A . 57 TYR CD2 1 1 8 8659 1 1 57 TYR CE1 C 22.640 0.565 0.526 1.00 . A A . 57 TYR CE1 1 1 8 8660 1 1 57 TYR CE2 C 24.532 0.651 -0.935 1.00 . A A . 57 TYR CE2 1 1 8 8661 1 1 57 TYR CG C 22.454 1.680 -1.606 1.00 . A A . 57 TYR CG 1 1 8 8662 1 1 57 TYR CZ C 23.958 0.261 0.255 1.00 . A A . 57 TYR CZ 1 1 8 8663 1 1 57 TYR H H 20.632 4.305 -4.145 1.00 . A A . 57 TYR H 1 1 8 8664 1 1 57 TYR HA H 20.748 3.864 -1.274 1.00 . A A . 57 TYR HA 1 1 8 8665 1 1 57 TYR HB2 H 20.712 1.918 -2.771 1.00 . A A . 57 TYR HB2 1 1 8 8666 1 1 57 TYR HB3 H 22.191 2.476 -3.544 1.00 . A A . 57 TYR HB3 1 1 8 8667 1 1 57 TYR HD1 H 20.866 1.515 -0.190 1.00 . A A . 57 TYR HD1 1 1 8 8668 1 1 57 TYR HD2 H 24.230 1.668 -2.789 1.00 . A A . 57 TYR HD2 1 1 8 8669 1 1 57 TYR HE1 H 22.189 0.256 1.458 1.00 . A A . 57 TYR HE1 1 1 8 8670 1 1 57 TYR HE2 H 25.562 0.410 -1.150 1.00 . A A . 57 TYR HE2 1 1 8 8671 1 1 57 TYR HH H 24.171 -1.170 1.525 1.00 . A A . 57 TYR HH 1 1 8 8672 1 1 57 TYR N N 20.517 4.556 -3.205 1.00 . A A . 57 TYR N 1 1 8 8673 1 1 57 TYR O O 23.614 4.379 -2.639 1.00 . A A . 57 TYR O 1 1 8 8674 1 1 57 TYR OXT O 22.630 5.514 -1.030 1.00 . A A . 57 TYR OXT 1 1 8 8675 1 1 57 TYR OH O 24.698 -0.447 1.174 1.00 . A A . 57 TYR OH 1 1 8 8676 2 2 1 ALA C C -11.557 -6.992 7.413 1.00 . B B . 1 ALA C 1 1 8 8677 2 2 1 ALA CA C -10.647 -7.782 8.352 1.00 . B B . 1 ALA CA 1 1 8 8678 2 2 1 ALA CB C -9.506 -8.414 7.570 1.00 . B B . 1 ALA CB 1 1 8 8679 2 2 1 ALA H1 H -11.856 -9.481 8.411 1.00 . B B . 1 ALA H1 1 1 8 8680 2 2 1 ALA H2 H -12.149 -8.387 9.667 1.00 . B B . 1 ALA H2 1 1 8 8681 2 2 1 ALA H3 H -10.771 -9.367 9.703 1.00 . B B . 1 ALA H3 1 1 8 8682 2 2 1 ALA HA H -10.220 -7.105 9.078 1.00 . B B . 1 ALA HA 1 1 8 8683 2 2 1 ALA HB1 H -9.907 -9.108 6.845 1.00 . B B . 1 ALA HB1 1 1 8 8684 2 2 1 ALA HB2 H -8.852 -8.940 8.249 1.00 . B B . 1 ALA HB2 1 1 8 8685 2 2 1 ALA HB3 H -8.949 -7.643 7.059 1.00 . B B . 1 ALA HB3 1 1 8 8686 2 2 1 ALA N N -11.409 -8.827 9.084 1.00 . B B . 1 ALA N 1 1 8 8687 2 2 1 ALA O O -12.440 -7.560 6.771 1.00 . B B . 1 ALA O 1 1 8 8688 2 2 2 PRO C C -11.725 -4.882 4.991 1.00 . B B . 2 PRO C 1 1 8 8689 2 2 2 PRO CA C -12.151 -4.797 6.457 1.00 . B B . 2 PRO CA 1 1 8 8690 2 2 2 PRO CB C -11.866 -3.406 7.019 1.00 . B B . 2 PRO CB 1 1 8 8691 2 2 2 PRO CD C -10.314 -4.910 8.054 1.00 . B B . 2 PRO CD 1 1 8 8692 2 2 2 PRO CG C -10.478 -3.499 7.552 1.00 . B B . 2 PRO CG 1 1 8 8693 2 2 2 PRO HA H -13.205 -5.015 6.545 1.00 . B B . 2 PRO HA 1 1 8 8694 2 2 2 PRO HB2 H -11.940 -2.673 6.230 1.00 . B B . 2 PRO HB2 1 1 8 8695 2 2 2 PRO HB3 H -12.573 -3.176 7.801 1.00 . B B . 2 PRO HB3 1 1 8 8696 2 2 2 PRO HD2 H -9.327 -5.281 7.818 1.00 . B B . 2 PRO HD2 1 1 8 8697 2 2 2 PRO HD3 H -10.488 -4.954 9.119 1.00 . B B . 2 PRO HD3 1 1 8 8698 2 2 2 PRO HG2 H -9.768 -3.297 6.764 1.00 . B B . 2 PRO HG2 1 1 8 8699 2 2 2 PRO HG3 H -10.349 -2.797 8.363 1.00 . B B . 2 PRO HG3 1 1 8 8700 2 2 2 PRO N N -11.348 -5.667 7.321 1.00 . B B . 2 PRO N 1 1 8 8701 2 2 2 PRO O O -10.624 -4.459 4.635 1.00 . B B . 2 PRO O 1 1 8 8702 2 2 3 PRO C C -12.061 -4.228 1.995 1.00 . B B . 3 PRO C 1 1 8 8703 2 2 3 PRO CA C -12.292 -5.570 2.687 1.00 . B B . 3 PRO CA 1 1 8 8704 2 2 3 PRO CB C -13.544 -6.249 2.116 1.00 . B B . 3 PRO CB 1 1 8 8705 2 2 3 PRO CD C -13.918 -5.969 4.455 1.00 . B B . 3 PRO CD 1 1 8 8706 2 2 3 PRO CG C -14.223 -6.865 3.292 1.00 . B B . 3 PRO CG 1 1 8 8707 2 2 3 PRO HA H -11.434 -6.205 2.524 1.00 . B B . 3 PRO HA 1 1 8 8708 2 2 3 PRO HB2 H -14.172 -5.510 1.641 1.00 . B B . 3 PRO HB2 1 1 8 8709 2 2 3 PRO HB3 H -13.252 -6.998 1.395 1.00 . B B . 3 PRO HB3 1 1 8 8710 2 2 3 PRO HD2 H -14.651 -5.177 4.525 1.00 . B B . 3 PRO HD2 1 1 8 8711 2 2 3 PRO HD3 H -13.884 -6.537 5.372 1.00 . B B . 3 PRO HD3 1 1 8 8712 2 2 3 PRO HG2 H -15.288 -6.909 3.120 1.00 . B B . 3 PRO HG2 1 1 8 8713 2 2 3 PRO HG3 H -13.828 -7.855 3.468 1.00 . B B . 3 PRO HG3 1 1 8 8714 2 2 3 PRO N N -12.590 -5.431 4.118 1.00 . B B . 3 PRO N 1 1 8 8715 2 2 3 PRO O O -13.005 -3.582 1.542 1.00 . B B . 3 PRO O 1 1 8 8716 2 2 4 GLY C C -9.105 -2.615 0.595 1.00 . B B . 4 GLY C 1 1 8 8717 2 2 4 GLY CA C -10.459 -2.561 1.269 1.00 . B B . 4 GLY CA 1 1 8 8718 2 2 4 GLY H H -10.089 -4.372 2.302 1.00 . B B . 4 GLY H 1 1 8 8719 2 2 4 GLY HA2 H -11.211 -2.338 0.525 1.00 . B B . 4 GLY HA2 1 1 8 8720 2 2 4 GLY HA3 H -10.452 -1.774 2.009 1.00 . B B . 4 GLY HA3 1 1 8 8721 2 2 4 GLY N N -10.798 -3.818 1.916 1.00 . B B . 4 GLY N 1 1 8 8722 2 2 4 GLY O O -8.097 -2.233 1.184 1.00 . B B . 4 GLY O 1 1 8 8723 2 2 5 THR C C -8.061 -3.092 -2.902 1.00 . B B . 5 THR C 1 1 8 8724 2 2 5 THR CA C -7.838 -3.214 -1.399 1.00 . B B . 5 THR CA 1 1 8 8725 2 2 5 THR CB C -7.156 -4.564 -1.106 1.00 . B B . 5 THR CB 1 1 8 8726 2 2 5 THR CG2 C -7.711 -6.313 0.104 1.00 . B B . 5 THR CG2 1 1 8 8727 2 2 5 THR H H -9.934 -3.296 -1.082 1.00 . B B . 5 THR H 1 1 8 8728 2 2 5 THR HA H -7.175 -2.426 -1.082 1.00 . B B . 5 THR HA 1 1 8 8729 2 2 5 THR HB H -6.904 -4.603 -0.056 1.00 . B B . 5 THR HB 1 1 8 8730 2 2 5 THR HG1 H -6.019 -3.829 1.275 1.00 . B B . 5 THR HG1 1 1 8 8731 2 2 5 THR HG21 H -8.627 -5.805 -0.162 1.00 . B B . 5 THR HG21 1 1 8 8732 2 2 5 THR HG22 H -7.812 -6.743 1.090 1.00 . B B . 5 THR HG22 1 1 8 8733 2 2 5 THR HG23 H -7.514 -7.097 -0.612 1.00 . B B . 5 THR HG23 1 1 8 8734 2 2 5 THR N N -9.085 -3.079 -0.648 1.00 . B B . 5 THR N 1 1 8 8735 2 2 5 THR O O -9.132 -3.424 -3.411 1.00 . B B . 5 THR O 1 1 8 8736 2 2 5 THR OG1 O -6.841 -4.252 1.013 1.00 . B B . 5 THR OG1 1 1 8 8737 2 2 6 ALA C C -5.782 -2.708 -5.753 1.00 . B B . 6 ALA C 1 1 8 8738 2 2 6 ALA CA C -7.124 -2.465 -5.059 1.00 . B B . 6 ALA CA 1 1 8 8739 2 2 6 ALA CB C -7.646 -1.086 -5.408 1.00 . B B . 6 ALA CB 1 1 8 8740 2 2 6 ALA H H -6.223 -2.336 -3.145 1.00 . B B . 6 ALA H 1 1 8 8741 2 2 6 ALA HA H -7.838 -3.189 -5.424 1.00 . B B . 6 ALA HA 1 1 8 8742 2 2 6 ALA HB1 H -8.553 -0.893 -4.857 1.00 . B B . 6 ALA HB1 1 1 8 8743 2 2 6 ALA HB2 H -7.849 -1.034 -6.468 1.00 . B B . 6 ALA HB2 1 1 8 8744 2 2 6 ALA HB3 H -6.903 -0.351 -5.147 1.00 . B B . 6 ALA HB3 1 1 8 8745 2 2 6 ALA N N -7.039 -2.615 -3.611 1.00 . B B . 6 ALA N 1 1 8 8746 2 2 6 ALA O O -5.570 -3.763 -6.350 1.00 . B B . 6 ALA O 1 1 8 8747 2 2 7 ARG C C -2.796 -3.059 -5.802 1.00 . B B . 7 ARG C 1 1 8 8748 2 2 7 ARG CA C -3.573 -1.848 -6.325 1.00 . B B . 7 ARG CA 1 1 8 8749 2 2 7 ARG CB C -2.763 -0.557 -6.168 1.00 . B B . 7 ARG CB 1 1 8 8750 2 2 7 ARG CD C -0.820 0.772 -7.059 1.00 . B B . 7 ARG CD 1 1 8 8751 2 2 7 ARG CG C -1.397 -0.617 -6.835 1.00 . B B . 7 ARG CG 1 1 8 8752 2 2 7 ARG CZ C -1.169 2.592 -8.680 1.00 . B B . 7 ARG CZ 1 1 8 8753 2 2 7 ARG H H -5.084 -0.920 -5.166 1.00 . B B . 7 ARG H 1 1 8 8754 2 2 7 ARG HA H -3.761 -2.005 -7.378 1.00 . B B . 7 ARG HA 1 1 8 8755 2 2 7 ARG HB2 H -3.318 0.259 -6.607 1.00 . B B . 7 ARG HB2 1 1 8 8756 2 2 7 ARG HB3 H -2.618 -0.359 -5.116 1.00 . B B . 7 ARG HB3 1 1 8 8757 2 2 7 ARG HD2 H -0.773 1.286 -6.112 1.00 . B B . 7 ARG HD2 1 1 8 8758 2 2 7 ARG HD3 H 0.176 0.671 -7.464 1.00 . B B . 7 ARG HD3 1 1 8 8759 2 2 7 ARG HE H -2.570 1.297 -8.099 1.00 . B B . 7 ARG HE 1 1 8 8760 2 2 7 ARG HG2 H -0.724 -1.176 -6.202 1.00 . B B . 7 ARG HG2 1 1 8 8761 2 2 7 ARG HG3 H -1.495 -1.116 -7.788 1.00 . B B . 7 ARG HG3 1 1 8 8762 2 2 7 ARG HH11 H 0.703 2.481 -7.923 1.00 . B B . 7 ARG HH11 1 1 8 8763 2 2 7 ARG HH12 H 0.440 3.751 -9.071 1.00 . B B . 7 ARG HH12 1 1 8 8764 2 2 7 ARG HH21 H -2.923 2.968 -9.609 1.00 . B B . 7 ARG HH21 1 1 8 8765 2 2 7 ARG HH22 H -1.620 4.029 -10.028 1.00 . B B . 7 ARG HH22 1 1 8 8766 2 2 7 ARG N N -4.876 -1.730 -5.675 1.00 . B B . 7 ARG N 1 1 8 8767 2 2 7 ARG NE N -1.632 1.556 -7.987 1.00 . B B . 7 ARG NE 1 1 8 8768 2 2 7 ARG NH1 N 0.095 2.973 -8.547 1.00 . B B . 7 ARG NH1 1 1 8 8769 2 2 7 ARG NH2 N -1.970 3.250 -9.507 1.00 . B B . 7 ARG NH2 1 1 8 8770 2 2 7 ARG O O -3.101 -4.189 -6.181 1.00 . B B . 7 ARG O 1 1 8 8771 2 2 8 ARG C C -0.489 -4.818 -5.560 1.00 . B B . 8 ARG C 1 1 8 8772 2 2 8 ARG CA C -1.023 -3.960 -4.414 1.00 . B B . 8 ARG CA 1 1 8 8773 2 2 8 ARG CB C -1.888 -4.800 -3.474 1.00 . B B . 8 ARG CB 1 1 8 8774 2 2 8 ARG CD C -2.865 -5.012 -1.169 1.00 . B B . 8 ARG CD 1 1 8 8775 2 2 8 ARG CG C -1.755 -4.407 -2.012 1.00 . B B . 8 ARG CG 1 1 8 8776 2 2 8 ARG CZ C -3.821 -7.222 -0.675 1.00 . B B . 8 ARG CZ 1 1 8 8777 2 2 8 ARG H H -1.590 -1.938 -4.630 1.00 . B B . 8 ARG H 1 1 8 8778 2 2 8 ARG HA H -0.188 -3.555 -3.860 1.00 . B B . 8 ARG HA 1 1 8 8779 2 2 8 ARG HB2 H -2.925 -4.682 -3.760 1.00 . B B . 8 ARG HB2 1 1 8 8780 2 2 8 ARG HB3 H -1.610 -5.838 -3.574 1.00 . B B . 8 ARG HB3 1 1 8 8781 2 2 8 ARG HD2 H -2.682 -4.776 -0.131 1.00 . B B . 8 ARG HD2 1 1 8 8782 2 2 8 ARG HD3 H -3.807 -4.580 -1.473 1.00 . B B . 8 ARG HD3 1 1 8 8783 2 2 8 ARG HE H -2.304 -6.890 -1.928 1.00 . B B . 8 ARG HE 1 1 8 8784 2 2 8 ARG HG2 H -0.803 -4.757 -1.641 1.00 . B B . 8 ARG HG2 1 1 8 8785 2 2 8 ARG HG3 H -1.800 -3.330 -1.932 1.00 . B B . 8 ARG HG3 1 1 8 8786 2 2 8 ARG HH11 H -4.676 -5.683 0.316 1.00 . B B . 8 ARG HH11 1 1 8 8787 2 2 8 ARG HH12 H -5.349 -7.244 0.646 1.00 . B B . 8 ARG HH12 1 1 8 8788 2 2 8 ARG HH21 H -3.187 -8.951 -1.504 1.00 . B B . 8 ARG HH21 1 1 8 8789 2 2 8 ARG HH22 H -4.503 -9.103 -0.389 1.00 . B B . 8 ARG HH22 1 1 8 8790 2 2 8 ARG N N -1.800 -2.846 -4.932 1.00 . B B . 8 ARG N 1 1 8 8791 2 2 8 ARG NE N -2.939 -6.462 -1.317 1.00 . B B . 8 ARG NE 1 1 8 8792 2 2 8 ARG NH1 N -4.687 -6.671 0.164 1.00 . B B . 8 ARG NH1 1 1 8 8793 2 2 8 ARG NH2 N -3.838 -8.533 -0.873 1.00 . B B . 8 ARG NH2 1 1 8 8794 2 2 8 ARG O O -0.769 -4.550 -6.729 1.00 . B B . 8 ARG O 1 1 8 8795 2 2 9 LYS C C 1.086 -8.128 -5.677 1.00 . B B . 9 LYS C 1 1 8 8796 2 2 9 LYS CA C 0.854 -6.727 -6.238 1.00 . B B . 9 LYS CA 1 1 8 8797 2 2 9 LYS CB C 2.172 -6.151 -6.760 1.00 . B B . 9 LYS CB 1 1 8 8798 2 2 9 LYS CD C 3.438 -4.159 -7.611 1.00 . B B . 9 LYS CD 1 1 8 8799 2 2 9 LYS CE C 3.421 -2.653 -7.821 1.00 . B B . 9 LYS CE 1 1 8 8800 2 2 9 LYS CG C 2.119 -4.660 -7.046 1.00 . B B . 9 LYS CG 1 1 8 8801 2 2 9 LYS H H 0.477 -6.002 -4.279 1.00 . B B . 9 LYS H 1 1 8 8802 2 2 9 LYS HA H 0.152 -6.792 -7.055 1.00 . B B . 9 LYS HA 1 1 8 8803 2 2 9 LYS HB2 H 2.944 -6.330 -6.028 1.00 . B B . 9 LYS HB2 1 1 8 8804 2 2 9 LYS HB3 H 2.434 -6.660 -7.675 1.00 . B B . 9 LYS HB3 1 1 8 8805 2 2 9 LYS HD2 H 4.231 -4.408 -6.924 1.00 . B B . 9 LYS HD2 1 1 8 8806 2 2 9 LYS HD3 H 3.616 -4.642 -8.561 1.00 . B B . 9 LYS HD3 1 1 8 8807 2 2 9 LYS HE2 H 4.348 -2.358 -8.290 1.00 . B B . 9 LYS HE2 1 1 8 8808 2 2 9 LYS HE3 H 2.594 -2.402 -8.467 1.00 . B B . 9 LYS HE3 1 1 8 8809 2 2 9 LYS HG2 H 1.334 -4.467 -7.762 1.00 . B B . 9 LYS HG2 1 1 8 8810 2 2 9 LYS HG3 H 1.908 -4.134 -6.126 1.00 . B B . 9 LYS HG3 1 1 8 8811 2 2 9 LYS HZ1 H 2.406 -2.214 -6.048 1.00 . B B . 9 LYS HZ1 1 1 8 8812 2 2 9 LYS HZ2 H 3.224 -0.892 -6.715 1.00 . B B . 9 LYS HZ2 1 1 8 8813 2 2 9 LYS HZ3 H 4.088 -2.106 -5.918 1.00 . B B . 9 LYS HZ3 1 1 8 8814 2 2 9 LYS N N 0.285 -5.841 -5.225 1.00 . B B . 9 LYS N 1 1 8 8815 2 2 9 LYS NZ N 3.275 -1.915 -6.535 1.00 . B B . 9 LYS NZ 1 1 8 8816 2 2 9 LYS O O 0.482 -8.513 -4.677 1.00 . B B . 9 LYS O 1 1 8 8817 2 2 10 ARG C C 2.493 -10.314 -4.389 1.00 . B B . 10 ARG C 1 1 8 8818 2 2 10 ARG CA C 2.292 -10.246 -5.899 1.00 . B B . 10 ARG CA 1 1 8 8819 2 2 10 ARG CB C 3.559 -10.734 -6.603 1.00 . B B . 10 ARG CB 1 1 8 8820 2 2 10 ARG CD C 6.058 -10.572 -6.809 1.00 . B B . 10 ARG CD 1 1 8 8821 2 2 10 ARG CG C 4.804 -9.951 -6.216 1.00 . B B . 10 ARG CG 1 1 8 8822 2 2 10 ARG CZ C 7.226 -12.737 -6.801 1.00 . B B . 10 ARG CZ 1 1 8 8823 2 2 10 ARG H H 2.410 -8.526 -7.127 1.00 . B B . 10 ARG H 1 1 8 8824 2 2 10 ARG HA H 1.468 -10.888 -6.173 1.00 . B B . 10 ARG HA 1 1 8 8825 2 2 10 ARG HB2 H 3.719 -11.773 -6.353 1.00 . B B . 10 ARG HB2 1 1 8 8826 2 2 10 ARG HB3 H 3.421 -10.645 -7.670 1.00 . B B . 10 ARG HB3 1 1 8 8827 2 2 10 ARG HD2 H 5.970 -10.573 -7.885 1.00 . B B . 10 ARG HD2 1 1 8 8828 2 2 10 ARG HD3 H 6.912 -9.977 -6.519 1.00 . B B . 10 ARG HD3 1 1 8 8829 2 2 10 ARG HE H 5.642 -12.291 -5.673 1.00 . B B . 10 ARG HE 1 1 8 8830 2 2 10 ARG HG2 H 4.709 -8.940 -6.580 1.00 . B B . 10 ARG HG2 1 1 8 8831 2 2 10 ARG HG3 H 4.892 -9.940 -5.137 1.00 . B B . 10 ARG HG3 1 1 8 8832 2 2 10 ARG HH11 H 7.991 -11.362 -8.069 1.00 . B B . 10 ARG HH11 1 1 8 8833 2 2 10 ARG HH12 H 8.803 -12.892 -8.056 1.00 . B B . 10 ARG HH12 1 1 8 8834 2 2 10 ARG HH21 H 6.705 -14.311 -5.646 1.00 . B B . 10 ARG HH21 1 1 8 8835 2 2 10 ARG HH22 H 8.072 -14.568 -6.678 1.00 . B B . 10 ARG HH22 1 1 8 8836 2 2 10 ARG N N 1.969 -8.887 -6.330 1.00 . B B . 10 ARG N 1 1 8 8837 2 2 10 ARG NE N 6.260 -11.944 -6.350 1.00 . B B . 10 ARG NE 1 1 8 8838 2 2 10 ARG NH1 N 8.076 -12.294 -7.717 1.00 . B B . 10 ARG NH1 1 1 8 8839 2 2 10 ARG NH2 N 7.344 -13.974 -6.337 1.00 . B B . 10 ARG NH2 1 1 8 8840 2 2 10 ARG O O 2.274 -11.356 -3.770 1.00 . B B . 10 ARG O 1 1 8 8841 2 2 11 LYS C C 4.516 -9.676 -2.005 1.00 . B B . 11 LYS C 1 1 8 8842 2 2 11 LYS CA C 3.161 -9.095 -2.370 1.00 . B B . 11 LYS CA 1 1 8 8843 2 2 11 LYS CB C 2.060 -9.792 -1.566 1.00 . B B . 11 LYS CB 1 1 8 8844 2 2 11 LYS CD C 2.200 -6.356 0.464 1.00 . B B . 11 LYS CD 1 1 8 8845 2 2 11 LYS CE C 3.532 -5.998 1.104 1.00 . B B . 11 LYS CE 1 1 8 8846 2 2 11 LYS CG C 1.202 -6.848 1.494 1.00 . B B . 11 LYS CG 1 1 8 8847 2 2 11 LYS H H 3.090 -8.408 -4.366 1.00 . B B . 11 LYS H 1 1 8 8848 2 2 11 LYS HA H 3.162 -8.046 -2.115 1.00 . B B . 11 LYS HA 1 1 8 8849 2 2 11 LYS HB2 H 2.178 -9.536 -0.523 1.00 . B B . 11 LYS HB2 1 1 8 8850 2 2 11 LYS HB3 H 2.165 -10.860 -1.676 1.00 . B B . 11 LYS HB3 1 1 8 8851 2 2 11 LYS HD2 H 2.359 -7.140 -0.262 1.00 . B B . 11 LYS HD2 1 1 8 8852 2 2 11 LYS HD3 H 1.796 -5.484 -0.025 1.00 . B B . 11 LYS HD3 1 1 8 8853 2 2 11 LYS HE2 H 3.911 -6.865 1.624 1.00 . B B . 11 LYS HE2 1 1 8 8854 2 2 11 LYS HE3 H 3.373 -5.197 1.809 1.00 . B B . 11 LYS HE3 1 1 8 8855 2 2 11 LYS HG2 H 0.233 -6.945 1.027 1.00 . B B . 11 LYS HG2 1 1 8 8856 2 2 11 LYS HG3 H 1.147 -6.132 2.301 1.00 . B B . 11 LYS HG3 1 1 8 8857 2 2 11 LYS HZ1 H -2.400 -11.404 -0.103 1.00 . B B . 11 LYS HZ1 1 1 8 8858 2 2 11 LYS HZ2 H -1.140 -11.574 1.012 1.00 . B B . 11 LYS HZ2 1 1 8 8859 2 2 11 LYS HZ3 H -1.568 -12.873 0.020 1.00 . B B . 11 LYS HZ3 1 1 8 8860 2 2 11 LYS N N 2.920 -9.194 -3.807 1.00 . B B . 11 LYS N 1 1 8 8861 2 2 11 LYS NZ N -1.469 -11.839 0.063 1.00 . B B . 11 LYS NZ 1 1 8 8862 2 2 11 LYS O O 4.677 -10.890 -1.879 1.00 . B B . 11 LYS O 1 1 8 8863 2 2 12 ALA C C 7.037 -9.160 0.023 1.00 . B B . 12 ALA C 1 1 8 8864 2 2 12 ALA CA C 6.840 -9.196 -1.484 1.00 . B B . 12 ALA CA 1 1 8 8865 2 2 12 ALA CB C 7.860 -8.295 -2.160 1.00 . B B . 12 ALA CB 1 1 8 8866 2 2 12 ALA H H 5.286 -7.842 -1.955 1.00 . B B . 12 ALA H 1 1 8 8867 2 2 12 ALA HA H 6.993 -10.205 -1.838 1.00 . B B . 12 ALA HA 1 1 8 8868 2 2 12 ALA HB1 H 7.405 -7.805 -3.007 1.00 . B B . 12 ALA HB1 1 1 8 8869 2 2 12 ALA HB2 H 8.699 -8.888 -2.493 1.00 . B B . 12 ALA HB2 1 1 8 8870 2 2 12 ALA HB3 H 8.204 -7.552 -1.454 1.00 . B B . 12 ALA HB3 1 1 8 8871 2 2 12 ALA N N 5.488 -8.792 -1.839 1.00 . B B . 12 ALA N 1 1 8 8872 2 2 12 ALA O O 7.991 -8.565 0.518 1.00 . B B . 12 ALA O 1 1 8 8873 2 2 13 ASP C C 6.628 -11.221 2.688 1.00 . B B . 13 ASP C 1 1 8 8874 2 2 13 ASP CA C 6.214 -9.841 2.204 1.00 . B B . 13 ASP CA 1 1 8 8875 2 2 13 ASP CB C 4.866 -9.456 2.816 1.00 . B B . 13 ASP CB 1 1 8 8876 2 2 13 ASP CG C 3.755 -10.403 2.409 1.00 . B B . 13 ASP CG 1 1 8 8877 2 2 13 ASP H H 5.408 -10.284 0.298 1.00 . B B . 13 ASP H 1 1 8 8878 2 2 13 ASP HA H 6.959 -9.123 2.512 1.00 . B B . 13 ASP HA 1 1 8 8879 2 2 13 ASP HB2 H 4.949 -9.471 3.893 1.00 . B B . 13 ASP HB2 1 1 8 8880 2 2 13 ASP HB3 H 4.601 -8.459 2.495 1.00 . B B . 13 ASP HB3 1 1 8 8881 2 2 13 ASP N N 6.137 -9.811 0.750 1.00 . B B . 13 ASP N 1 1 8 8882 2 2 13 ASP O O 6.224 -11.664 3.763 1.00 . B B . 13 ASP O 1 1 8 8883 2 2 13 ASP OD1 O 3.622 -11.470 3.043 1.00 . B B . 13 ASP OD1 1 1 8 8884 2 2 13 ASP OD2 O 3.017 -10.077 1.455 1.00 . B B . 13 ASP OD2 1 1 8 8885 2 2 14 SER C C 8.839 -13.769 1.138 1.00 . B B . 14 SER C 1 1 8 8886 2 2 14 SER CA C 7.917 -13.226 2.224 1.00 . B B . 14 SER CA 1 1 8 8887 2 2 14 SER CB C 6.741 -14.180 2.440 1.00 . B B . 14 SER CB 1 1 8 8888 2 2 14 SER H H 7.721 -11.491 1.037 1.00 . B B . 14 SER H 1 1 8 8889 2 2 14 SER HA H 8.474 -13.141 3.142 1.00 . B B . 14 SER HA 1 1 8 8890 2 2 14 SER HB2 H 6.117 -13.805 3.238 1.00 . B B . 14 SER HB2 1 1 8 8891 2 2 14 SER HB3 H 6.160 -14.243 1.530 1.00 . B B . 14 SER HB3 1 1 8 8892 2 2 14 SER HG H 7.492 -15.480 3.696 1.00 . B B . 14 SER HG 1 1 8 8893 2 2 14 SER N N 7.438 -11.897 1.881 1.00 . B B . 14 SER N 1 1 8 8894 2 2 14 SER O O 10.064 -13.546 1.237 1.00 . B B . 14 SER O 1 1 8 8895 2 2 14 SER OXT O 8.329 -14.412 0.196 1.00 . B B . 14 SER OXT 1 1 8 8896 2 2 14 SER OG O 7.192 -15.477 2.784 1.00 . B B . 14 SER OG 1 1 9 8897 1 1 1 GLY C C 10.501 3.557 -6.672 1.00 . A A . 1 GLY C 1 1 9 8898 1 1 1 GLY CA C 9.849 2.252 -7.088 1.00 . A A . 1 GLY CA 1 1 9 8899 1 1 1 GLY H1 H 7.970 1.341 -7.142 1.00 . A A . 1 GLY H1 1 1 9 8900 1 1 1 GLY H2 H 7.910 3.031 -7.113 1.00 . A A . 1 GLY H2 1 1 9 8901 1 1 1 GLY H3 H 8.285 2.174 -5.704 1.00 . A A . 1 GLY H3 1 1 9 8902 1 1 1 GLY HA2 H 10.358 1.435 -6.598 1.00 . A A . 1 GLY HA2 1 1 9 8903 1 1 1 GLY HA3 H 9.953 2.137 -8.156 1.00 . A A . 1 GLY HA3 1 1 9 8904 1 1 1 GLY N N 8.402 2.197 -6.738 1.00 . A A . 1 GLY N 1 1 9 8905 1 1 1 GLY O O 11.427 4.030 -7.331 1.00 . A A . 1 GLY O 1 1 9 8906 1 1 2 SER C C 9.824 5.869 -3.840 1.00 . A A . 2 SER C 1 1 9 8907 1 1 2 SER CA C 10.573 5.396 -5.073 1.00 . A A . 2 SER CA 1 1 9 8908 1 1 2 SER CB C 10.524 6.467 -6.160 1.00 . A A . 2 SER CB 1 1 9 8909 1 1 2 SER H H 9.299 3.701 -5.079 1.00 . A A . 2 SER H 1 1 9 8910 1 1 2 SER HA H 11.597 5.227 -4.793 1.00 . A A . 2 SER HA 1 1 9 8911 1 1 2 SER HB2 H 10.894 7.398 -5.761 1.00 . A A . 2 SER HB2 1 1 9 8912 1 1 2 SER HB3 H 11.143 6.159 -6.990 1.00 . A A . 2 SER HB3 1 1 9 8913 1 1 2 SER HG H 8.702 7.160 -5.971 1.00 . A A . 2 SER HG 1 1 9 8914 1 1 2 SER N N 10.028 4.135 -5.571 1.00 . A A . 2 SER N 1 1 9 8915 1 1 2 SER O O 10.407 6.484 -2.947 1.00 . A A . 2 SER O 1 1 9 8916 1 1 2 SER OG O 9.201 6.664 -6.625 1.00 . A A . 2 SER OG 1 1 9 8917 1 1 3 GLN C C 7.771 4.872 -1.600 1.00 . A A . 3 GLN C 1 1 9 8918 1 1 3 GLN CA C 7.729 5.966 -2.650 1.00 . A A . 3 GLN CA 1 1 9 8919 1 1 3 GLN CB C 6.290 6.235 -3.075 1.00 . A A . 3 GLN CB 1 1 9 8920 1 1 3 GLN CD C 6.576 8.739 -3.260 1.00 . A A . 3 GLN CD 1 1 9 8921 1 1 3 GLN CG C 6.130 7.466 -3.953 1.00 . A A . 3 GLN CG 1 1 9 8922 1 1 3 GLN H H 8.114 5.110 -4.534 1.00 . A A . 3 GLN H 1 1 9 8923 1 1 3 GLN HA H 8.143 6.864 -2.237 1.00 . A A . 3 GLN HA 1 1 9 8924 1 1 3 GLN HB2 H 5.935 5.384 -3.621 1.00 . A A . 3 GLN HB2 1 1 9 8925 1 1 3 GLN HB3 H 5.682 6.367 -2.191 1.00 . A A . 3 GLN HB3 1 1 9 8926 1 1 3 GLN HE21 H 7.077 9.545 -5.008 1.00 . A A . 3 GLN HE21 1 1 9 8927 1 1 3 GLN HE22 H 7.341 10.539 -3.619 1.00 . A A . 3 GLN HE22 1 1 9 8928 1 1 3 GLN HG2 H 6.724 7.334 -4.846 1.00 . A A . 3 GLN HG2 1 1 9 8929 1 1 3 GLN HG3 H 5.090 7.567 -4.225 1.00 . A A . 3 GLN HG3 1 1 9 8930 1 1 3 GLN N N 8.534 5.582 -3.789 1.00 . A A . 3 GLN N 1 1 9 8931 1 1 3 GLN NE2 N 7.045 9.705 -4.042 1.00 . A A . 3 GLN NE2 1 1 9 8932 1 1 3 GLN O O 7.850 3.686 -1.924 1.00 . A A . 3 GLN O 1 1 9 8933 1 1 3 GLN OE1 O 6.497 8.855 -2.037 1.00 . A A . 3 GLN OE1 1 1 9 8934 1 1 4 VAL C C 6.339 3.890 1.121 1.00 . A A . 4 VAL C 1 1 9 8935 1 1 4 VAL CA C 7.751 4.334 0.763 1.00 . A A . 4 VAL CA 1 1 9 8936 1 1 4 VAL CB C 8.429 4.956 1.999 1.00 . A A . 4 VAL CB 1 1 9 8937 1 1 4 VAL CG1 C 7.634 6.153 2.505 1.00 . A A . 4 VAL CG1 1 1 9 8938 1 1 4 VAL CG2 C 8.606 3.920 3.097 1.00 . A A . 4 VAL CG2 1 1 9 8939 1 1 4 VAL H H 7.650 6.226 -0.152 1.00 . A A . 4 VAL H 1 1 9 8940 1 1 4 VAL HA H 8.325 3.472 0.455 1.00 . A A . 4 VAL HA 1 1 9 8941 1 1 4 VAL HB H 9.408 5.306 1.707 1.00 . A A . 4 VAL HB 1 1 9 8942 1 1 4 VAL HG11 H 8.164 6.615 3.324 1.00 . A A . 4 VAL HG11 1 1 9 8943 1 1 4 VAL HG12 H 6.663 5.825 2.846 1.00 . A A . 4 VAL HG12 1 1 9 8944 1 1 4 VAL HG13 H 7.513 6.869 1.706 1.00 . A A . 4 VAL HG13 1 1 9 8945 1 1 4 VAL HG21 H 8.107 4.256 3.993 1.00 . A A . 4 VAL HG21 1 1 9 8946 1 1 4 VAL HG22 H 9.657 3.785 3.300 1.00 . A A . 4 VAL HG22 1 1 9 8947 1 1 4 VAL HG23 H 8.177 2.980 2.777 1.00 . A A . 4 VAL HG23 1 1 9 8948 1 1 4 VAL N N 7.717 5.273 -0.342 1.00 . A A . 4 VAL N 1 1 9 8949 1 1 4 VAL O O 5.969 3.840 2.292 1.00 . A A . 4 VAL O 1 1 9 8950 1 1 5 PHE C C 3.540 2.718 -1.035 1.00 . A A . 5 PHE C 1 1 9 8951 1 1 5 PHE CA C 4.184 3.135 0.295 1.00 . A A . 5 PHE CA 1 1 9 8952 1 1 5 PHE CB C 3.385 4.268 0.936 1.00 . A A . 5 PHE CB 1 1 9 8953 1 1 5 PHE CD1 C 3.092 5.945 -0.908 1.00 . A A . 5 PHE CD1 1 1 9 8954 1 1 5 PHE CD2 C 4.442 6.543 0.964 1.00 . A A . 5 PHE CD2 1 1 9 8955 1 1 5 PHE CE1 C 3.329 7.181 -1.478 1.00 . A A . 5 PHE CE1 1 1 9 8956 1 1 5 PHE CE2 C 4.683 7.781 0.400 1.00 . A A . 5 PHE CE2 1 1 9 8957 1 1 5 PHE CG C 3.644 5.612 0.318 1.00 . A A . 5 PHE CG 1 1 9 8958 1 1 5 PHE CZ C 4.126 8.101 -0.824 1.00 . A A . 5 PHE CZ 1 1 9 8959 1 1 5 PHE H H 5.911 3.606 -0.812 1.00 . A A . 5 PHE H 1 1 9 8960 1 1 5 PHE HA H 4.198 2.281 0.972 1.00 . A A . 5 PHE HA 1 1 9 8961 1 1 5 PHE HB2 H 2.337 4.060 0.835 1.00 . A A . 5 PHE HB2 1 1 9 8962 1 1 5 PHE HB3 H 3.637 4.329 1.985 1.00 . A A . 5 PHE HB3 1 1 9 8963 1 1 5 PHE HD1 H 2.469 5.226 -1.421 1.00 . A A . 5 PHE HD1 1 1 9 8964 1 1 5 PHE HD2 H 4.879 6.294 1.921 1.00 . A A . 5 PHE HD2 1 1 9 8965 1 1 5 PHE HE1 H 2.893 7.428 -2.435 1.00 . A A . 5 PHE HE1 1 1 9 8966 1 1 5 PHE HE2 H 5.307 8.498 0.913 1.00 . A A . 5 PHE HE2 1 1 9 8967 1 1 5 PHE HZ H 4.313 9.067 -1.267 1.00 . A A . 5 PHE HZ 1 1 9 8968 1 1 5 PHE N N 5.556 3.566 0.096 1.00 . A A . 5 PHE N 1 1 9 8969 1 1 5 PHE O O 4.141 2.858 -2.101 1.00 . A A . 5 PHE O 1 1 9 8970 1 1 6 GLU C C 0.066 1.865 -1.824 1.00 . A A . 6 GLU C 1 1 9 8971 1 1 6 GLU CA C 1.561 1.750 -2.116 1.00 . A A . 6 GLU CA 1 1 9 8972 1 1 6 GLU CB C 1.926 0.299 -2.451 1.00 . A A . 6 GLU CB 1 1 9 8973 1 1 6 GLU CD C 1.174 0.383 -4.862 1.00 . A A . 6 GLU CD 1 1 9 8974 1 1 6 GLU CG C 1.042 -0.317 -3.524 1.00 . A A . 6 GLU CG 1 1 9 8975 1 1 6 GLU H H 1.882 2.174 -0.084 1.00 . A A . 6 GLU H 1 1 9 8976 1 1 6 GLU HA H 1.809 2.386 -2.952 1.00 . A A . 6 GLU HA 1 1 9 8977 1 1 6 GLU HB2 H 2.948 0.270 -2.798 1.00 . A A . 6 GLU HB2 1 1 9 8978 1 1 6 GLU HB3 H 1.843 -0.303 -1.554 1.00 . A A . 6 GLU HB3 1 1 9 8979 1 1 6 GLU HG2 H 1.319 -1.354 -3.647 1.00 . A A . 6 GLU HG2 1 1 9 8980 1 1 6 GLU HG3 H 0.013 -0.257 -3.202 1.00 . A A . 6 GLU HG3 1 1 9 8981 1 1 6 GLU N N 2.315 2.207 -0.952 1.00 . A A . 6 GLU N 1 1 9 8982 1 1 6 GLU O O -0.416 1.284 -0.856 1.00 . A A . 6 GLU O 1 1 9 8983 1 1 6 GLU OE1 O 2.047 -0.022 -5.659 1.00 . A A . 6 GLU OE1 1 1 9 8984 1 1 6 GLU OE2 O 0.406 1.334 -5.112 1.00 . A A . 6 GLU OE2 1 1 9 8985 1 1 7 TYR C C -2.937 1.650 -3.033 1.00 . A A . 7 TYR C 1 1 9 8986 1 1 7 TYR CA C -2.097 2.769 -2.436 1.00 . A A . 7 TYR CA 1 1 9 8987 1 1 7 TYR CB C -2.542 4.118 -3.002 1.00 . A A . 7 TYR CB 1 1 9 8988 1 1 7 TYR CD1 C -1.138 4.597 -5.046 1.00 . A A . 7 TYR CD1 1 1 9 8989 1 1 7 TYR CD2 C -3.424 3.998 -5.366 1.00 . A A . 7 TYR CD2 1 1 9 8990 1 1 7 TYR CE1 C -0.972 4.709 -6.413 1.00 . A A . 7 TYR CE1 1 1 9 8991 1 1 7 TYR CE2 C -3.265 4.108 -6.734 1.00 . A A . 7 TYR CE2 1 1 9 8992 1 1 7 TYR CG C -2.365 4.240 -4.500 1.00 . A A . 7 TYR CG 1 1 9 8993 1 1 7 TYR CZ C -2.038 4.464 -7.252 1.00 . A A . 7 TYR CZ 1 1 9 8994 1 1 7 TYR H H -0.262 2.996 -3.447 1.00 . A A . 7 TYR H 1 1 9 8995 1 1 7 TYR HA H -2.252 2.777 -1.376 1.00 . A A . 7 TYR HA 1 1 9 8996 1 1 7 TYR HB2 H -3.585 4.268 -2.777 1.00 . A A . 7 TYR HB2 1 1 9 8997 1 1 7 TYR HB3 H -1.963 4.902 -2.536 1.00 . A A . 7 TYR HB3 1 1 9 8998 1 1 7 TYR HD1 H -0.305 4.788 -4.385 1.00 . A A . 7 TYR HD1 1 1 9 8999 1 1 7 TYR HD2 H -4.384 3.720 -4.958 1.00 . A A . 7 TYR HD2 1 1 9 9000 1 1 7 TYR HE1 H -0.010 4.987 -6.818 1.00 . A A . 7 TYR HE1 1 1 9 9001 1 1 7 TYR HE2 H -4.100 3.916 -7.392 1.00 . A A . 7 TYR HE2 1 1 9 9002 1 1 7 TYR HH H -2.625 5.041 -8.989 1.00 . A A . 7 TYR HH 1 1 9 9003 1 1 7 TYR N N -0.674 2.580 -2.668 1.00 . A A . 7 TYR N 1 1 9 9004 1 1 7 TYR O O -3.145 1.588 -4.243 1.00 . A A . 7 TYR O 1 1 9 9005 1 1 7 TYR OH O -1.875 4.573 -8.614 1.00 . A A . 7 TYR OH 1 1 9 9006 1 1 8 ALA C C -5.723 0.126 -2.542 1.00 . A A . 8 ALA C 1 1 9 9007 1 1 8 ALA CA C -4.273 -0.338 -2.579 1.00 . A A . 8 ALA CA 1 1 9 9008 1 1 8 ALA CB C -4.069 -1.534 -1.663 1.00 . A A . 8 ALA CB 1 1 9 9009 1 1 8 ALA H H -3.194 0.860 -1.203 1.00 . A A . 8 ALA H 1 1 9 9010 1 1 8 ALA HA H -4.007 -0.619 -3.585 1.00 . A A . 8 ALA HA 1 1 9 9011 1 1 8 ALA HB1 H -4.496 -2.416 -2.115 1.00 . A A . 8 ALA HB1 1 1 9 9012 1 1 8 ALA HB2 H -4.550 -1.343 -0.719 1.00 . A A . 8 ALA HB2 1 1 9 9013 1 1 8 ALA HB3 H -3.011 -1.686 -1.499 1.00 . A A . 8 ALA HB3 1 1 9 9014 1 1 8 ALA N N -3.419 0.766 -2.160 1.00 . A A . 8 ALA N 1 1 9 9015 1 1 8 ALA O O -6.559 -0.457 -1.856 1.00 . A A . 8 ALA O 1 1 9 9016 1 1 9 GLU C C -7.977 1.726 -4.686 1.00 . A A . 9 GLU C 1 1 9 9017 1 1 9 GLU CA C -7.315 1.798 -3.333 1.00 . A A . 9 GLU CA 1 1 9 9018 1 1 9 GLU CB C -7.154 3.234 -2.827 1.00 . A A . 9 GLU CB 1 1 9 9019 1 1 9 GLU CD C -7.426 4.551 -4.976 1.00 . A A . 9 GLU CD 1 1 9 9020 1 1 9 GLU CG C -7.933 4.305 -3.566 1.00 . A A . 9 GLU CG 1 1 9 9021 1 1 9 GLU H H -5.303 1.559 -3.863 1.00 . A A . 9 GLU H 1 1 9 9022 1 1 9 GLU HA H -7.955 1.276 -2.657 1.00 . A A . 9 GLU HA 1 1 9 9023 1 1 9 GLU HB2 H -7.472 3.260 -1.799 1.00 . A A . 9 GLU HB2 1 1 9 9024 1 1 9 GLU HB3 H -6.106 3.495 -2.870 1.00 . A A . 9 GLU HB3 1 1 9 9025 1 1 9 GLU HG2 H -8.957 3.993 -3.612 1.00 . A A . 9 GLU HG2 1 1 9 9026 1 1 9 GLU HG3 H -7.861 5.222 -3.010 1.00 . A A . 9 GLU HG3 1 1 9 9027 1 1 9 GLU N N -6.003 1.181 -3.302 1.00 . A A . 9 GLU N 1 1 9 9028 1 1 9 GLU O O -7.333 1.753 -5.735 1.00 . A A . 9 GLU O 1 1 9 9029 1 1 9 GLU OE1 O -6.384 5.222 -5.121 1.00 . A A . 9 GLU OE1 1 1 9 9030 1 1 9 GLU OE2 O -8.074 4.078 -5.933 1.00 . A A . 9 GLU OE2 1 1 9 9031 1 1 10 VAL C C -10.484 2.950 -6.271 1.00 . A A . 10 VAL C 1 1 9 9032 1 1 10 VAL CA C -10.115 1.558 -5.788 1.00 . A A . 10 VAL CA 1 1 9 9033 1 1 10 VAL CB C -11.369 0.746 -5.487 1.00 . A A . 10 VAL CB 1 1 9 9034 1 1 10 VAL CG1 C -12.211 0.584 -6.742 1.00 . A A . 10 VAL CG1 1 1 9 9035 1 1 10 VAL CG2 C -10.981 -0.604 -4.903 1.00 . A A . 10 VAL CG2 1 1 9 9036 1 1 10 VAL H H -9.715 1.616 -3.734 1.00 . A A . 10 VAL H 1 1 9 9037 1 1 10 VAL HA H -9.567 1.058 -6.542 1.00 . A A . 10 VAL HA 1 1 9 9038 1 1 10 VAL HB H -11.935 1.277 -4.748 1.00 . A A . 10 VAL HB 1 1 9 9039 1 1 10 VAL HG11 H -11.966 -0.353 -7.221 1.00 . A A . 10 VAL HG11 1 1 9 9040 1 1 10 VAL HG12 H -12.004 1.398 -7.419 1.00 . A A . 10 VAL HG12 1 1 9 9041 1 1 10 VAL HG13 H -13.257 0.592 -6.481 1.00 . A A . 10 VAL HG13 1 1 9 9042 1 1 10 VAL HG21 H -11.842 -1.059 -4.443 1.00 . A A . 10 VAL HG21 1 1 9 9043 1 1 10 VAL HG22 H -10.211 -0.464 -4.160 1.00 . A A . 10 VAL HG22 1 1 9 9044 1 1 10 VAL HG23 H -10.612 -1.246 -5.690 1.00 . A A . 10 VAL HG23 1 1 9 9045 1 1 10 VAL N N -9.289 1.639 -4.618 1.00 . A A . 10 VAL N 1 1 9 9046 1 1 10 VAL O O -10.622 3.196 -7.469 1.00 . A A . 10 VAL O 1 1 9 9047 1 1 11 ASP C C -10.296 6.207 -4.642 1.00 . A A . 11 ASP C 1 1 9 9048 1 1 11 ASP CA C -10.964 5.244 -5.624 1.00 . A A . 11 ASP CA 1 1 9 9049 1 1 11 ASP CB C -12.474 5.462 -5.593 1.00 . A A . 11 ASP CB 1 1 9 9050 1 1 11 ASP CG C -12.878 6.813 -6.149 1.00 . A A . 11 ASP CG 1 1 9 9051 1 1 11 ASP H H -10.587 3.571 -4.389 1.00 . A A . 11 ASP H 1 1 9 9052 1 1 11 ASP HA H -10.601 5.455 -6.619 1.00 . A A . 11 ASP HA 1 1 9 9053 1 1 11 ASP HB2 H -12.950 4.696 -6.177 1.00 . A A . 11 ASP HB2 1 1 9 9054 1 1 11 ASP HB3 H -12.819 5.396 -4.571 1.00 . A A . 11 ASP HB3 1 1 9 9055 1 1 11 ASP N N -10.646 3.856 -5.320 1.00 . A A . 11 ASP N 1 1 9 9056 1 1 11 ASP O O -9.838 7.280 -5.035 1.00 . A A . 11 ASP O 1 1 9 9057 1 1 11 ASP OD1 O -12.645 7.831 -5.466 1.00 . A A . 11 ASP OD1 1 1 9 9058 1 1 11 ASP OD2 O -13.431 6.852 -7.269 1.00 . A A . 11 ASP OD2 1 1 9 9059 1 1 12 GLU C C -9.132 5.917 -1.145 1.00 . A A . 12 GLU C 1 1 9 9060 1 1 12 GLU CA C -9.667 6.697 -2.340 1.00 . A A . 12 GLU CA 1 1 9 9061 1 1 12 GLU CB C -10.718 7.700 -1.870 1.00 . A A . 12 GLU CB 1 1 9 9062 1 1 12 GLU CD C -9.814 9.677 -3.158 1.00 . A A . 12 GLU CD 1 1 9 9063 1 1 12 GLU CG C -11.014 8.791 -2.885 1.00 . A A . 12 GLU CG 1 1 9 9064 1 1 12 GLU H H -10.531 4.915 -3.123 1.00 . A A . 12 GLU H 1 1 9 9065 1 1 12 GLU HA H -8.842 7.233 -2.788 1.00 . A A . 12 GLU HA 1 1 9 9066 1 1 12 GLU HB2 H -11.637 7.166 -1.667 1.00 . A A . 12 GLU HB2 1 1 9 9067 1 1 12 GLU HB3 H -10.375 8.166 -0.959 1.00 . A A . 12 GLU HB3 1 1 9 9068 1 1 12 GLU HG2 H -11.318 8.330 -3.812 1.00 . A A . 12 GLU HG2 1 1 9 9069 1 1 12 GLU HG3 H -11.820 9.406 -2.509 1.00 . A A . 12 GLU HG3 1 1 9 9070 1 1 12 GLU N N -10.242 5.824 -3.366 1.00 . A A . 12 GLU N 1 1 9 9071 1 1 12 GLU O O -9.483 4.764 -0.940 1.00 . A A . 12 GLU O 1 1 9 9072 1 1 12 GLU OE1 O -8.979 9.300 -4.007 1.00 . A A . 12 GLU OE1 1 1 9 9073 1 1 12 GLU OE2 O -9.709 10.748 -2.524 1.00 . A A . 12 GLU OE2 1 1 9 9074 1 1 13 ILE C C -7.833 6.897 2.029 1.00 . A A . 13 ILE C 1 1 9 9075 1 1 13 ILE CA C -7.699 5.956 0.828 1.00 . A A . 13 ILE CA 1 1 9 9076 1 1 13 ILE CB C -6.201 5.623 0.594 1.00 . A A . 13 ILE CB 1 1 9 9077 1 1 13 ILE CD1 C -5.675 7.722 -0.725 1.00 . A A . 13 ILE CD1 1 1 9 9078 1 1 13 ILE CG1 C -5.369 6.904 0.512 1.00 . A A . 13 ILE CG1 1 1 9 9079 1 1 13 ILE CG2 C -6.044 4.841 -0.692 1.00 . A A . 13 ILE CG2 1 1 9 9080 1 1 13 ILE H H -8.075 7.505 -0.563 1.00 . A A . 13 ILE H 1 1 9 9081 1 1 13 ILE HA H -8.232 5.032 1.025 1.00 . A A . 13 ILE HA 1 1 9 9082 1 1 13 ILE HB H -5.841 5.003 1.411 1.00 . A A . 13 ILE HB 1 1 9 9083 1 1 13 ILE HD11 H -6.291 7.137 -1.398 1.00 . A A . 13 ILE HD11 1 1 9 9084 1 1 13 ILE HD12 H -4.753 7.988 -1.219 1.00 . A A . 13 ILE HD12 1 1 9 9085 1 1 13 ILE HD13 H -6.204 8.619 -0.441 1.00 . A A . 13 ILE HD13 1 1 9 9086 1 1 13 ILE HG12 H -5.572 7.517 1.377 1.00 . A A . 13 ILE HG12 1 1 9 9087 1 1 13 ILE HG13 H -4.319 6.648 0.492 1.00 . A A . 13 ILE HG13 1 1 9 9088 1 1 13 ILE HG21 H -5.115 5.115 -1.169 1.00 . A A . 13 ILE HG21 1 1 9 9089 1 1 13 ILE HG22 H -6.865 5.076 -1.347 1.00 . A A . 13 ILE HG22 1 1 9 9090 1 1 13 ILE HG23 H -6.039 3.784 -0.478 1.00 . A A . 13 ILE HG23 1 1 9 9091 1 1 13 ILE N N -8.293 6.573 -0.354 1.00 . A A . 13 ILE N 1 1 9 9092 1 1 13 ILE O O -8.605 7.854 1.997 1.00 . A A . 13 ILE O 1 1 9 9093 1 1 14 VAL C C -5.736 7.381 4.956 1.00 . A A . 14 VAL C 1 1 9 9094 1 1 14 VAL CA C -7.098 7.436 4.286 1.00 . A A . 14 VAL CA 1 1 9 9095 1 1 14 VAL CB C -8.183 6.973 5.280 1.00 . A A . 14 VAL CB 1 1 9 9096 1 1 14 VAL CG1 C -8.121 7.786 6.566 1.00 . A A . 14 VAL CG1 1 1 9 9097 1 1 14 VAL CG2 C -9.561 7.077 4.646 1.00 . A A . 14 VAL CG2 1 1 9 9098 1 1 14 VAL H H -6.490 5.835 3.048 1.00 . A A . 14 VAL H 1 1 9 9099 1 1 14 VAL HA H -7.306 8.454 3.998 1.00 . A A . 14 VAL HA 1 1 9 9100 1 1 14 VAL HB H -8.000 5.937 5.526 1.00 . A A . 14 VAL HB 1 1 9 9101 1 1 14 VAL HG11 H -8.904 7.461 7.235 1.00 . A A . 14 VAL HG11 1 1 9 9102 1 1 14 VAL HG12 H -8.255 8.833 6.336 1.00 . A A . 14 VAL HG12 1 1 9 9103 1 1 14 VAL HG13 H -7.161 7.642 7.037 1.00 . A A . 14 VAL HG13 1 1 9 9104 1 1 14 VAL HG21 H -9.763 8.106 4.389 1.00 . A A . 14 VAL HG21 1 1 9 9105 1 1 14 VAL HG22 H -10.307 6.730 5.347 1.00 . A A . 14 VAL HG22 1 1 9 9106 1 1 14 VAL HG23 H -9.595 6.469 3.755 1.00 . A A . 14 VAL HG23 1 1 9 9107 1 1 14 VAL N N -7.079 6.617 3.081 1.00 . A A . 14 VAL N 1 1 9 9108 1 1 14 VAL O O -5.063 8.398 5.113 1.00 . A A . 14 VAL O 1 1 9 9109 1 1 15 GLU C C -3.041 5.604 4.877 1.00 . A A . 15 GLU C 1 1 9 9110 1 1 15 GLU CA C -4.040 5.974 5.964 1.00 . A A . 15 GLU CA 1 1 9 9111 1 1 15 GLU CB C -4.108 4.871 7.025 1.00 . A A . 15 GLU CB 1 1 9 9112 1 1 15 GLU CD C -2.408 5.959 8.542 1.00 . A A . 15 GLU CD 1 1 9 9113 1 1 15 GLU CG C -2.816 4.698 7.805 1.00 . A A . 15 GLU CG 1 1 9 9114 1 1 15 GLU H H -5.947 5.411 5.212 1.00 . A A . 15 GLU H 1 1 9 9115 1 1 15 GLU HA H -3.735 6.901 6.427 1.00 . A A . 15 GLU HA 1 1 9 9116 1 1 15 GLU HB2 H -4.897 5.109 7.724 1.00 . A A . 15 GLU HB2 1 1 9 9117 1 1 15 GLU HB3 H -4.339 3.935 6.539 1.00 . A A . 15 GLU HB3 1 1 9 9118 1 1 15 GLU HG2 H -2.948 3.906 8.525 1.00 . A A . 15 GLU HG2 1 1 9 9119 1 1 15 GLU HG3 H -2.028 4.430 7.116 1.00 . A A . 15 GLU HG3 1 1 9 9120 1 1 15 GLU N N -5.343 6.179 5.346 1.00 . A A . 15 GLU N 1 1 9 9121 1 1 15 GLU O O -3.346 4.799 4.014 1.00 . A A . 15 GLU O 1 1 9 9122 1 1 15 GLU OE1 O -2.888 6.167 9.675 1.00 . A A . 15 GLU OE1 1 1 9 9123 1 1 15 GLU OE2 O -1.605 6.739 7.985 1.00 . A A . 15 GLU OE2 1 1 9 9124 1 1 16 LYS C C 0.564 6.091 4.335 1.00 . A A . 16 LYS C 1 1 9 9125 1 1 16 LYS CA C -0.881 5.907 3.851 1.00 . A A . 16 LYS CA 1 1 9 9126 1 1 16 LYS CB C -1.133 6.813 2.645 1.00 . A A . 16 LYS CB 1 1 9 9127 1 1 16 LYS CD C -1.341 9.162 1.759 1.00 . A A . 16 LYS CD 1 1 9 9128 1 1 16 LYS CE C -2.650 8.899 1.031 1.00 . A A . 16 LYS CE 1 1 9 9129 1 1 16 LYS CG C -1.207 8.293 3.000 1.00 . A A . 16 LYS CG 1 1 9 9130 1 1 16 LYS H H -1.665 6.863 5.581 1.00 . A A . 16 LYS H 1 1 9 9131 1 1 16 LYS HA H -1.032 4.875 3.547 1.00 . A A . 16 LYS HA 1 1 9 9132 1 1 16 LYS HB2 H -0.335 6.675 1.933 1.00 . A A . 16 LYS HB2 1 1 9 9133 1 1 16 LYS HB3 H -2.068 6.531 2.189 1.00 . A A . 16 LYS HB3 1 1 9 9134 1 1 16 LYS HD2 H -1.307 10.200 2.054 1.00 . A A . 16 LYS HD2 1 1 9 9135 1 1 16 LYS HD3 H -0.519 8.949 1.091 1.00 . A A . 16 LYS HD3 1 1 9 9136 1 1 16 LYS HE2 H -2.680 7.862 0.734 1.00 . A A . 16 LYS HE2 1 1 9 9137 1 1 16 LYS HE3 H -3.469 9.103 1.705 1.00 . A A . 16 LYS HE3 1 1 9 9138 1 1 16 LYS HG2 H -2.064 8.457 3.634 1.00 . A A . 16 LYS HG2 1 1 9 9139 1 1 16 LYS HG3 H -0.308 8.575 3.529 1.00 . A A . 16 LYS HG3 1 1 9 9140 1 1 16 LYS HZ1 H -2.031 9.548 -0.857 1.00 . A A . 16 LYS HZ1 1 1 9 9141 1 1 16 LYS HZ2 H -2.749 10.759 0.083 1.00 . A A . 16 LYS HZ2 1 1 9 9142 1 1 16 LYS HZ3 H -3.708 9.569 -0.641 1.00 . A A . 16 LYS HZ3 1 1 9 9143 1 1 16 LYS N N -1.867 6.208 4.886 1.00 . A A . 16 LYS N 1 1 9 9144 1 1 16 LYS NZ N -2.795 9.753 -0.180 1.00 . A A . 16 LYS NZ 1 1 9 9145 1 1 16 LYS O O 1.193 7.104 4.033 1.00 . A A . 16 LYS O 1 1 9 9146 1 1 17 ARG C C 3.092 3.865 5.810 1.00 . A A . 17 ARG C 1 1 9 9147 1 1 17 ARG CA C 2.474 5.236 5.572 1.00 . A A . 17 ARG CA 1 1 9 9148 1 1 17 ARG CB C 2.505 6.052 6.865 1.00 . A A . 17 ARG CB 1 1 9 9149 1 1 17 ARG CD C 3.894 7.121 8.670 1.00 . A A . 17 ARG CD 1 1 9 9150 1 1 17 ARG CG C 3.905 6.241 7.431 1.00 . A A . 17 ARG CG 1 1 9 9151 1 1 17 ARG CZ C 5.546 8.261 10.095 1.00 . A A . 17 ARG CZ 1 1 9 9152 1 1 17 ARG H H 0.585 4.307 5.265 1.00 . A A . 17 ARG H 1 1 9 9153 1 1 17 ARG HA H 3.054 5.751 4.821 1.00 . A A . 17 ARG HA 1 1 9 9154 1 1 17 ARG HB2 H 2.083 7.026 6.671 1.00 . A A . 17 ARG HB2 1 1 9 9155 1 1 17 ARG HB3 H 1.905 5.550 7.609 1.00 . A A . 17 ARG HB3 1 1 9 9156 1 1 17 ARG HD2 H 3.482 8.084 8.409 1.00 . A A . 17 ARG HD2 1 1 9 9157 1 1 17 ARG HD3 H 3.272 6.657 9.422 1.00 . A A . 17 ARG HD3 1 1 9 9158 1 1 17 ARG HE H 5.940 6.703 8.914 1.00 . A A . 17 ARG HE 1 1 9 9159 1 1 17 ARG HG2 H 4.311 5.275 7.692 1.00 . A A . 17 ARG HG2 1 1 9 9160 1 1 17 ARG HG3 H 4.526 6.703 6.677 1.00 . A A . 17 ARG HG3 1 1 9 9161 1 1 17 ARG HH11 H 3.678 9.028 10.181 1.00 . A A . 17 ARG HH11 1 1 9 9162 1 1 17 ARG HH12 H 4.850 9.817 11.181 1.00 . A A . 17 ARG HH12 1 1 9 9163 1 1 17 ARG HH21 H 7.492 7.735 10.229 1.00 . A A . 17 ARG HH21 1 1 9 9164 1 1 17 ARG HH22 H 7.019 9.083 11.208 1.00 . A A . 17 ARG HH22 1 1 9 9165 1 1 17 ARG N N 1.101 5.122 5.077 1.00 . A A . 17 ARG N 1 1 9 9166 1 1 17 ARG NE N 5.235 7.313 9.217 1.00 . A A . 17 ARG NE 1 1 9 9167 1 1 17 ARG NH1 N 4.615 9.104 10.521 1.00 . A A . 17 ARG NH1 1 1 9 9168 1 1 17 ARG NH2 N 6.787 8.368 10.548 1.00 . A A . 17 ARG NH2 1 1 9 9169 1 1 17 ARG O O 2.899 3.278 6.874 1.00 . A A . 17 ARG O 1 1 9 9170 1 1 18 GLY C C 5.697 1.813 4.248 1.00 . A A . 18 GLY C 1 1 9 9171 1 1 18 GLY CA C 4.425 2.039 5.029 1.00 . A A . 18 GLY CA 1 1 9 9172 1 1 18 GLY H H 3.993 3.847 4.002 1.00 . A A . 18 GLY H 1 1 9 9173 1 1 18 GLY HA2 H 4.643 1.911 6.078 1.00 . A A . 18 GLY HA2 1 1 9 9174 1 1 18 GLY HA3 H 3.708 1.295 4.737 1.00 . A A . 18 GLY HA3 1 1 9 9175 1 1 18 GLY N N 3.834 3.345 4.836 1.00 . A A . 18 GLY N 1 1 9 9176 1 1 18 GLY O O 6.618 2.624 4.283 1.00 . A A . 18 GLY O 1 1 9 9177 1 1 19 LYS C C 6.460 0.220 1.274 1.00 . A A . 19 LYS C 1 1 9 9178 1 1 19 LYS CA C 6.867 0.283 2.751 1.00 . A A . 19 LYS CA 1 1 9 9179 1 1 19 LYS CB C 7.326 -1.063 3.277 1.00 . A A . 19 LYS CB 1 1 9 9180 1 1 19 LYS CD C 8.351 -2.349 5.133 1.00 . A A . 19 LYS CD 1 1 9 9181 1 1 19 LYS CE C 8.940 -2.291 6.532 1.00 . A A . 19 LYS CE 1 1 9 9182 1 1 19 LYS CG C 7.917 -0.985 4.665 1.00 . A A . 19 LYS CG 1 1 9 9183 1 1 19 LYS H H 4.963 0.077 3.595 1.00 . A A . 19 LYS H 1 1 9 9184 1 1 19 LYS HA H 7.650 1.002 2.881 1.00 . A A . 19 LYS HA 1 1 9 9185 1 1 19 LYS HB2 H 6.465 -1.719 3.309 1.00 . A A . 19 LYS HB2 1 1 9 9186 1 1 19 LYS HB3 H 8.066 -1.480 2.613 1.00 . A A . 19 LYS HB3 1 1 9 9187 1 1 19 LYS HD2 H 7.492 -2.999 5.133 1.00 . A A . 19 LYS HD2 1 1 9 9188 1 1 19 LYS HD3 H 9.093 -2.728 4.448 1.00 . A A . 19 LYS HD3 1 1 9 9189 1 1 19 LYS HE2 H 8.167 -1.979 7.220 1.00 . A A . 19 LYS HE2 1 1 9 9190 1 1 19 LYS HE3 H 9.289 -3.274 6.805 1.00 . A A . 19 LYS HE3 1 1 9 9191 1 1 19 LYS HG2 H 8.774 -0.327 4.648 1.00 . A A . 19 LYS HG2 1 1 9 9192 1 1 19 LYS HG3 H 7.172 -0.599 5.345 1.00 . A A . 19 LYS HG3 1 1 9 9193 1 1 19 LYS HZ1 H 9.750 -0.371 6.394 1.00 . A A . 19 LYS HZ1 1 1 9 9194 1 1 19 LYS HZ2 H 10.820 -1.601 5.941 1.00 . A A . 19 LYS HZ2 1 1 9 9195 1 1 19 LYS HZ3 H 10.478 -1.338 7.576 1.00 . A A . 19 LYS HZ3 1 1 9 9196 1 1 19 LYS N N 5.732 0.683 3.554 1.00 . A A . 19 LYS N 1 1 9 9197 1 1 19 LYS NZ N 10.076 -1.334 6.617 1.00 . A A . 19 LYS NZ 1 1 9 9198 1 1 19 LYS O O 6.044 1.221 0.709 1.00 . A A . 19 LYS O 1 1 9 9199 1 1 20 GLY C C 4.778 -1.642 -0.721 1.00 . A A . 20 GLY C 1 1 9 9200 1 1 20 GLY CA C 6.167 -1.082 -0.722 1.00 . A A . 20 GLY CA 1 1 9 9201 1 1 20 GLY H H 6.956 -1.705 1.100 1.00 . A A . 20 GLY H 1 1 9 9202 1 1 20 GLY HA2 H 6.185 -0.125 -1.214 1.00 . A A . 20 GLY HA2 1 1 9 9203 1 1 20 GLY HA3 H 6.820 -1.772 -1.224 1.00 . A A . 20 GLY HA3 1 1 9 9204 1 1 20 GLY N N 6.590 -0.939 0.641 1.00 . A A . 20 GLY N 1 1 9 9205 1 1 20 GLY O O 3.910 -1.253 -1.501 1.00 . A A . 20 GLY O 1 1 9 9206 1 1 21 LYS C C 3.025 -3.356 1.919 1.00 . A A . 21 LYS C 1 1 9 9207 1 1 21 LYS CA C 3.333 -3.243 0.412 1.00 . A A . 21 LYS CA 1 1 9 9208 1 1 21 LYS CB C 3.374 -4.629 -0.225 1.00 . A A . 21 LYS CB 1 1 9 9209 1 1 21 LYS CD C 2.955 -4.010 -2.628 1.00 . A A . 21 LYS CD 1 1 9 9210 1 1 21 LYS CE C 3.605 -3.798 -3.986 1.00 . A A . 21 LYS CE 1 1 9 9211 1 1 21 LYS CG C 3.930 -4.631 -1.640 1.00 . A A . 21 LYS CG 1 1 9 9212 1 1 21 LYS H H 5.379 -2.863 0.717 1.00 . A A . 21 LYS H 1 1 9 9213 1 1 21 LYS HA H 2.561 -2.654 -0.066 1.00 . A A . 21 LYS HA 1 1 9 9214 1 1 21 LYS HB2 H 3.997 -5.268 0.380 1.00 . A A . 21 LYS HB2 1 1 9 9215 1 1 21 LYS HB3 H 2.375 -5.031 -0.254 1.00 . A A . 21 LYS HB3 1 1 9 9216 1 1 21 LYS HD2 H 2.107 -4.668 -2.745 1.00 . A A . 21 LYS HD2 1 1 9 9217 1 1 21 LYS HD3 H 2.625 -3.057 -2.243 1.00 . A A . 21 LYS HD3 1 1 9 9218 1 1 21 LYS HE2 H 2.830 -3.707 -4.732 1.00 . A A . 21 LYS HE2 1 1 9 9219 1 1 21 LYS HE3 H 4.184 -2.886 -3.956 1.00 . A A . 21 LYS HE3 1 1 9 9220 1 1 21 LYS HG2 H 4.849 -4.065 -1.656 1.00 . A A . 21 LYS HG2 1 1 9 9221 1 1 21 LYS HG3 H 4.127 -5.651 -1.937 1.00 . A A . 21 LYS HG3 1 1 9 9222 1 1 21 LYS HZ1 H 4.028 -5.836 -4.166 1.00 . A A . 21 LYS HZ1 1 1 9 9223 1 1 21 LYS HZ2 H 5.379 -4.887 -3.799 1.00 . A A . 21 LYS HZ2 1 1 9 9224 1 1 21 LYS HZ3 H 4.742 -4.881 -5.365 1.00 . A A . 21 LYS HZ3 1 1 9 9225 1 1 21 LYS N N 4.601 -2.581 0.193 1.00 . A A . 21 LYS N 1 1 9 9226 1 1 21 LYS NZ N 4.501 -4.930 -4.355 1.00 . A A . 21 LYS NZ 1 1 9 9227 1 1 21 LYS O O 1.992 -3.905 2.301 1.00 . A A . 21 LYS O 1 1 9 9228 1 1 22 ASP C C 2.944 -1.672 4.722 1.00 . A A . 22 ASP C 1 1 9 9229 1 1 22 ASP CA C 3.734 -2.868 4.220 1.00 . A A . 22 ASP CA 1 1 9 9230 1 1 22 ASP CB C 5.084 -2.894 4.931 1.00 . A A . 22 ASP CB 1 1 9 9231 1 1 22 ASP CG C 4.979 -3.348 6.375 1.00 . A A . 22 ASP CG 1 1 9 9232 1 1 22 ASP H H 4.706 -2.385 2.431 1.00 . A A . 22 ASP H 1 1 9 9233 1 1 22 ASP HA H 3.198 -3.755 4.440 1.00 . A A . 22 ASP HA 1 1 9 9234 1 1 22 ASP HB2 H 5.753 -3.551 4.405 1.00 . A A . 22 ASP HB2 1 1 9 9235 1 1 22 ASP HB3 H 5.495 -1.895 4.926 1.00 . A A . 22 ASP HB3 1 1 9 9236 1 1 22 ASP N N 3.918 -2.820 2.774 1.00 . A A . 22 ASP N 1 1 9 9237 1 1 22 ASP O O 2.846 -1.430 5.923 1.00 . A A . 22 ASP O 1 1 9 9238 1 1 22 ASP OD1 O 4.545 -4.492 6.610 1.00 . A A . 22 ASP OD1 1 1 9 9239 1 1 22 ASP OD2 O 5.330 -2.552 7.272 1.00 . A A . 22 ASP OD2 1 1 9 9240 1 1 23 VAL C C 0.143 -0.068 4.112 1.00 . A A . 23 VAL C 1 1 9 9241 1 1 23 VAL CA C 1.628 0.248 4.085 1.00 . A A . 23 VAL CA 1 1 9 9242 1 1 23 VAL CB C 1.885 1.287 3.007 1.00 . A A . 23 VAL CB 1 1 9 9243 1 1 23 VAL CG1 C 1.478 0.709 1.660 1.00 . A A . 23 VAL CG1 1 1 9 9244 1 1 23 VAL CG2 C 1.143 2.571 3.324 1.00 . A A . 23 VAL CG2 1 1 9 9245 1 1 23 VAL H H 2.548 -1.156 2.862 1.00 . A A . 23 VAL H 1 1 9 9246 1 1 23 VAL HA H 1.936 0.647 5.037 1.00 . A A . 23 VAL HA 1 1 9 9247 1 1 23 VAL HB H 2.946 1.494 2.980 1.00 . A A . 23 VAL HB 1 1 9 9248 1 1 23 VAL HG11 H 0.711 1.322 1.218 1.00 . A A . 23 VAL HG11 1 1 9 9249 1 1 23 VAL HG12 H 1.100 -0.294 1.794 1.00 . A A . 23 VAL HG12 1 1 9 9250 1 1 23 VAL HG13 H 2.338 0.680 1.009 1.00 . A A . 23 VAL HG13 1 1 9 9251 1 1 23 VAL HG21 H 1.233 2.777 4.377 1.00 . A A . 23 VAL HG21 1 1 9 9252 1 1 23 VAL HG22 H 0.101 2.460 3.067 1.00 . A A . 23 VAL HG22 1 1 9 9253 1 1 23 VAL HG23 H 1.572 3.387 2.761 1.00 . A A . 23 VAL HG23 1 1 9 9254 1 1 23 VAL N N 2.405 -0.924 3.789 1.00 . A A . 23 VAL N 1 1 9 9255 1 1 23 VAL O O -0.344 -0.878 3.324 1.00 . A A . 23 VAL O 1 1 9 9256 1 1 24 GLU C C -2.789 1.511 4.457 1.00 . A A . 24 GLU C 1 1 9 9257 1 1 24 GLU CA C -2.008 0.383 5.103 1.00 . A A . 24 GLU CA 1 1 9 9258 1 1 24 GLU CB C -2.432 0.239 6.563 1.00 . A A . 24 GLU CB 1 1 9 9259 1 1 24 GLU CD C -0.418 0.965 7.912 1.00 . A A . 24 GLU CD 1 1 9 9260 1 1 24 GLU CG C -1.839 1.288 7.491 1.00 . A A . 24 GLU CG 1 1 9 9261 1 1 24 GLU H H -0.147 1.293 5.533 1.00 . A A . 24 GLU H 1 1 9 9262 1 1 24 GLU HA H -2.234 -0.540 4.584 1.00 . A A . 24 GLU HA 1 1 9 9263 1 1 24 GLU HB2 H -3.508 0.316 6.610 1.00 . A A . 24 GLU HB2 1 1 9 9264 1 1 24 GLU HB3 H -2.137 -0.736 6.916 1.00 . A A . 24 GLU HB3 1 1 9 9265 1 1 24 GLU HG2 H -1.838 2.240 6.982 1.00 . A A . 24 GLU HG2 1 1 9 9266 1 1 24 GLU HG3 H -2.454 1.356 8.377 1.00 . A A . 24 GLU HG3 1 1 9 9267 1 1 24 GLU N N -0.579 0.609 4.983 1.00 . A A . 24 GLU N 1 1 9 9268 1 1 24 GLU O O -2.783 2.642 4.941 1.00 . A A . 24 GLU O 1 1 9 9269 1 1 24 GLU OE1 O 0.517 1.323 7.166 1.00 . A A . 24 GLU OE1 1 1 9 9270 1 1 24 GLU OE2 O -0.240 0.354 8.987 1.00 . A A . 24 GLU OE2 1 1 9 9271 1 1 25 TYR C C -5.724 1.810 2.721 1.00 . A A . 25 TYR C 1 1 9 9272 1 1 25 TYR CA C -4.252 2.168 2.645 1.00 . A A . 25 TYR CA 1 1 9 9273 1 1 25 TYR CB C -3.826 2.235 1.185 1.00 . A A . 25 TYR CB 1 1 9 9274 1 1 25 TYR CD1 C -1.357 2.742 1.182 1.00 . A A . 25 TYR CD1 1 1 9 9275 1 1 25 TYR CD2 C -2.854 4.440 0.460 1.00 . A A . 25 TYR CD2 1 1 9 9276 1 1 25 TYR CE1 C -0.285 3.588 0.979 1.00 . A A . 25 TYR CE1 1 1 9 9277 1 1 25 TYR CE2 C -1.790 5.294 0.261 1.00 . A A . 25 TYR CE2 1 1 9 9278 1 1 25 TYR CG C -2.657 3.153 0.925 1.00 . A A . 25 TYR CG 1 1 9 9279 1 1 25 TYR CZ C -0.505 4.820 0.374 1.00 . A A . 25 TYR CZ 1 1 9 9280 1 1 25 TYR H H -3.426 0.277 3.034 1.00 . A A . 25 TYR H 1 1 9 9281 1 1 25 TYR HA H -4.092 3.127 3.098 1.00 . A A . 25 TYR HA 1 1 9 9282 1 1 25 TYR HB2 H -3.549 1.246 0.854 1.00 . A A . 25 TYR HB2 1 1 9 9283 1 1 25 TYR HB3 H -4.660 2.583 0.592 1.00 . A A . 25 TYR HB3 1 1 9 9284 1 1 25 TYR HD1 H -1.187 1.744 1.536 1.00 . A A . 25 TYR HD1 1 1 9 9285 1 1 25 TYR HD2 H -3.860 4.776 0.254 1.00 . A A . 25 TYR HD2 1 1 9 9286 1 1 25 TYR HE1 H 0.719 3.248 1.183 1.00 . A A . 25 TYR HE1 1 1 9 9287 1 1 25 TYR HE2 H -1.963 6.288 -0.096 1.00 . A A . 25 TYR HE2 1 1 9 9288 1 1 25 TYR HH H 1.355 5.216 0.186 1.00 . A A . 25 TYR HH 1 1 9 9289 1 1 25 TYR N N -3.459 1.194 3.363 1.00 . A A . 25 TYR N 1 1 9 9290 1 1 25 TYR O O -6.084 0.640 2.769 1.00 . A A . 25 TYR O 1 1 9 9291 1 1 25 TYR OH O 0.552 5.723 0.328 1.00 . A A . 25 TYR OH 1 1 9 9292 1 1 26 LEU C C -8.495 2.538 1.351 1.00 . A A . 26 LEU C 1 1 9 9293 1 1 26 LEU CA C -7.994 2.621 2.770 1.00 . A A . 26 LEU CA 1 1 9 9294 1 1 26 LEU CB C -8.676 3.783 3.494 1.00 . A A . 26 LEU CB 1 1 9 9295 1 1 26 LEU CD1 C -10.888 4.485 4.457 1.00 . A A . 26 LEU CD1 1 1 9 9296 1 1 26 LEU CD2 C -10.482 4.703 1.999 1.00 . A A . 26 LEU CD2 1 1 9 9297 1 1 26 LEU CG C -10.184 3.891 3.252 1.00 . A A . 26 LEU CG 1 1 9 9298 1 1 26 LEU H H -6.225 3.722 2.676 1.00 . A A . 26 LEU H 1 1 9 9299 1 1 26 LEU HA H -8.201 1.694 3.283 1.00 . A A . 26 LEU HA 1 1 9 9300 1 1 26 LEU HB2 H -8.503 3.673 4.556 1.00 . A A . 26 LEU HB2 1 1 9 9301 1 1 26 LEU HB3 H -8.214 4.699 3.169 1.00 . A A . 26 LEU HB3 1 1 9 9302 1 1 26 LEU HD11 H -11.661 3.807 4.790 1.00 . A A . 26 LEU HD11 1 1 9 9303 1 1 26 LEU HD12 H -11.332 5.430 4.184 1.00 . A A . 26 LEU HD12 1 1 9 9304 1 1 26 LEU HD13 H -10.175 4.637 5.253 1.00 . A A . 26 LEU HD13 1 1 9 9305 1 1 26 LEU HD21 H -11.514 5.018 2.015 1.00 . A A . 26 LEU HD21 1 1 9 9306 1 1 26 LEU HD22 H -10.309 4.098 1.119 1.00 . A A . 26 LEU HD22 1 1 9 9307 1 1 26 LEU HD23 H -9.845 5.569 1.969 1.00 . A A . 26 LEU HD23 1 1 9 9308 1 1 26 LEU HG H -10.568 2.906 3.097 1.00 . A A . 26 LEU HG 1 1 9 9309 1 1 26 LEU N N -6.567 2.820 2.727 1.00 . A A . 26 LEU N 1 1 9 9310 1 1 26 LEU O O -7.818 2.990 0.431 1.00 . A A . 26 LEU O 1 1 9 9311 1 1 27 VAL C C -11.670 2.137 -0.298 1.00 . A A . 27 VAL C 1 1 9 9312 1 1 27 VAL CA C -10.170 1.893 -0.203 1.00 . A A . 27 VAL CA 1 1 9 9313 1 1 27 VAL CB C -9.756 0.584 -0.921 1.00 . A A . 27 VAL CB 1 1 9 9314 1 1 27 VAL CG1 C -8.616 -0.122 -0.196 1.00 . A A . 27 VAL CG1 1 1 9 9315 1 1 27 VAL CG2 C -10.917 -0.384 -1.152 1.00 . A A . 27 VAL CG2 1 1 9 9316 1 1 27 VAL H H -10.156 1.561 1.883 1.00 . A A . 27 VAL H 1 1 9 9317 1 1 27 VAL HA H -9.692 2.691 -0.746 1.00 . A A . 27 VAL HA 1 1 9 9318 1 1 27 VAL HB H -9.381 0.892 -1.874 1.00 . A A . 27 VAL HB 1 1 9 9319 1 1 27 VAL HG11 H -7.765 0.540 -0.135 1.00 . A A . 27 VAL HG11 1 1 9 9320 1 1 27 VAL HG12 H -8.341 -1.013 -0.740 1.00 . A A . 27 VAL HG12 1 1 9 9321 1 1 27 VAL HG13 H -8.934 -0.391 0.800 1.00 . A A . 27 VAL HG13 1 1 9 9322 1 1 27 VAL HG21 H -10.537 -1.324 -1.521 1.00 . A A . 27 VAL HG21 1 1 9 9323 1 1 27 VAL HG22 H -11.597 0.039 -1.878 1.00 . A A . 27 VAL HG22 1 1 9 9324 1 1 27 VAL HG23 H -11.440 -0.545 -0.223 1.00 . A A . 27 VAL HG23 1 1 9 9325 1 1 27 VAL N N -9.660 1.962 1.144 1.00 . A A . 27 VAL N 1 1 9 9326 1 1 27 VAL O O -12.481 1.334 0.165 1.00 . A A . 27 VAL O 1 1 9 9327 1 1 28 ARG C C -13.784 3.027 -2.465 1.00 . A A . 28 ARG C 1 1 9 9328 1 1 28 ARG CA C -13.408 3.598 -1.126 1.00 . A A . 28 ARG CA 1 1 9 9329 1 1 28 ARG CB C -13.639 5.105 -1.109 1.00 . A A . 28 ARG CB 1 1 9 9330 1 1 28 ARG CD C -13.325 7.282 0.108 1.00 . A A . 28 ARG CD 1 1 9 9331 1 1 28 ARG CG C -12.894 5.828 0.000 1.00 . A A . 28 ARG CG 1 1 9 9332 1 1 28 ARG CZ C -12.648 9.328 1.297 1.00 . A A . 28 ARG CZ 1 1 9 9333 1 1 28 ARG H H -11.323 3.890 -1.187 1.00 . A A . 28 ARG H 1 1 9 9334 1 1 28 ARG HA H -14.011 3.120 -0.372 1.00 . A A . 28 ARG HA 1 1 9 9335 1 1 28 ARG HB2 H -13.321 5.507 -2.056 1.00 . A A . 28 ARG HB2 1 1 9 9336 1 1 28 ARG HB3 H -14.696 5.294 -0.986 1.00 . A A . 28 ARG HB3 1 1 9 9337 1 1 28 ARG HD2 H -13.316 7.724 -0.877 1.00 . A A . 28 ARG HD2 1 1 9 9338 1 1 28 ARG HD3 H -14.329 7.316 0.506 1.00 . A A . 28 ARG HD3 1 1 9 9339 1 1 28 ARG HE H -11.659 7.595 1.352 1.00 . A A . 28 ARG HE 1 1 9 9340 1 1 28 ARG HG2 H -13.097 5.333 0.938 1.00 . A A . 28 ARG HG2 1 1 9 9341 1 1 28 ARG HG3 H -11.834 5.791 -0.206 1.00 . A A . 28 ARG HG3 1 1 9 9342 1 1 28 ARG HH11 H -14.349 9.495 0.218 1.00 . A A . 28 ARG HH11 1 1 9 9343 1 1 28 ARG HH12 H -13.855 10.930 1.054 1.00 . A A . 28 ARG HH12 1 1 9 9344 1 1 28 ARG HH21 H -11.002 9.479 2.459 1.00 . A A . 28 ARG HH21 1 1 9 9345 1 1 28 ARG HH22 H -11.953 10.920 2.329 1.00 . A A . 28 ARG HH22 1 1 9 9346 1 1 28 ARG N N -12.020 3.266 -0.895 1.00 . A A . 28 ARG N 1 1 9 9347 1 1 28 ARG NE N -12.444 8.051 0.983 1.00 . A A . 28 ARG NE 1 1 9 9348 1 1 28 ARG NH1 N -13.704 9.970 0.817 1.00 . A A . 28 ARG NH1 1 1 9 9349 1 1 28 ARG NH2 N -11.798 9.961 2.094 1.00 . A A . 28 ARG NH2 1 1 9 9350 1 1 28 ARG O O -13.830 3.739 -3.469 1.00 . A A . 28 ARG O 1 1 9 9351 1 1 29 TRP C C -15.094 1.801 -4.674 1.00 . A A . 29 TRP C 1 1 9 9352 1 1 29 TRP CA C -14.391 0.948 -3.638 1.00 . A A . 29 TRP CA 1 1 9 9353 1 1 29 TRP CB C -15.306 -0.197 -3.223 1.00 . A A . 29 TRP CB 1 1 9 9354 1 1 29 TRP CD1 C -14.106 -1.721 -4.905 1.00 . A A . 29 TRP CD1 1 1 9 9355 1 1 29 TRP CD2 C -15.517 -2.791 -3.538 1.00 . A A . 29 TRP CD2 1 1 9 9356 1 1 29 TRP CE2 C -14.928 -3.734 -4.402 1.00 . A A . 29 TRP CE2 1 1 9 9357 1 1 29 TRP CE3 C -16.440 -3.235 -2.587 1.00 . A A . 29 TRP CE3 1 1 9 9358 1 1 29 TRP CG C -14.975 -1.509 -3.873 1.00 . A A . 29 TRP CG 1 1 9 9359 1 1 29 TRP CH2 C -16.142 -5.497 -3.404 1.00 . A A . 29 TRP CH2 1 1 9 9360 1 1 29 TRP CZ2 C -15.233 -5.091 -4.344 1.00 . A A . 29 TRP CZ2 1 1 9 9361 1 1 29 TRP CZ3 C -16.744 -4.583 -2.531 1.00 . A A . 29 TRP CZ3 1 1 9 9362 1 1 29 TRP H H -13.958 1.251 -1.598 1.00 . A A . 29 TRP H 1 1 9 9363 1 1 29 TRP HA H -13.487 0.539 -4.068 1.00 . A A . 29 TRP HA 1 1 9 9364 1 1 29 TRP HB2 H -15.232 -0.323 -2.155 1.00 . A A . 29 TRP HB2 1 1 9 9365 1 1 29 TRP HB3 H -16.324 0.056 -3.480 1.00 . A A . 29 TRP HB3 1 1 9 9366 1 1 29 TRP HD1 H -13.531 -0.943 -5.386 1.00 . A A . 29 TRP HD1 1 1 9 9367 1 1 29 TRP HE1 H -13.519 -3.457 -5.931 1.00 . A A . 29 TRP HE1 1 1 9 9368 1 1 29 TRP HE3 H -16.915 -2.546 -1.905 1.00 . A A . 29 TRP HE3 1 1 9 9369 1 1 29 TRP HH2 H -16.409 -6.541 -3.325 1.00 . A A . 29 TRP HH2 1 1 9 9370 1 1 29 TRP HZ2 H -14.777 -5.808 -5.010 1.00 . A A . 29 TRP HZ2 1 1 9 9371 1 1 29 TRP HZ3 H -17.456 -4.944 -1.804 1.00 . A A . 29 TRP HZ3 1 1 9 9372 1 1 29 TRP N N -14.030 1.720 -2.452 1.00 . A A . 29 TRP N 1 1 9 9373 1 1 29 TRP NE1 N -14.070 -3.056 -5.226 1.00 . A A . 29 TRP NE1 1 1 9 9374 1 1 29 TRP O O -16.308 1.969 -4.632 1.00 . A A . 29 TRP O 1 1 9 9375 1 1 30 LYS C C -16.203 2.821 -7.112 1.00 . A A . 30 LYS C 1 1 9 9376 1 1 30 LYS CA C -14.795 3.240 -6.659 1.00 . A A . 30 LYS CA 1 1 9 9377 1 1 30 LYS CB C -13.827 3.194 -7.854 1.00 . A A . 30 LYS CB 1 1 9 9378 1 1 30 LYS CD C -12.850 1.838 -9.743 1.00 . A A . 30 LYS CD 1 1 9 9379 1 1 30 LYS CE C -13.008 2.739 -10.959 1.00 . A A . 30 LYS CE 1 1 9 9380 1 1 30 LYS CG C -14.012 1.989 -8.772 1.00 . A A . 30 LYS CG 1 1 9 9381 1 1 30 LYS H H -13.300 2.311 -5.419 1.00 . A A . 30 LYS H 1 1 9 9382 1 1 30 LYS HA H -14.843 4.255 -6.294 1.00 . A A . 30 LYS HA 1 1 9 9383 1 1 30 LYS HB2 H -13.962 4.088 -8.441 1.00 . A A . 30 LYS HB2 1 1 9 9384 1 1 30 LYS HB3 H -12.815 3.176 -7.476 1.00 . A A . 30 LYS HB3 1 1 9 9385 1 1 30 LYS HD2 H -11.933 2.097 -9.235 1.00 . A A . 30 LYS HD2 1 1 9 9386 1 1 30 LYS HD3 H -12.803 0.810 -10.073 1.00 . A A . 30 LYS HD3 1 1 9 9387 1 1 30 LYS HE2 H -12.134 2.633 -11.584 1.00 . A A . 30 LYS HE2 1 1 9 9388 1 1 30 LYS HE3 H -13.883 2.427 -11.511 1.00 . A A . 30 LYS HE3 1 1 9 9389 1 1 30 LYS HG2 H -14.087 1.096 -8.172 1.00 . A A . 30 LYS HG2 1 1 9 9390 1 1 30 LYS HG3 H -14.923 2.119 -9.337 1.00 . A A . 30 LYS HG3 1 1 9 9391 1 1 30 LYS HZ1 H -14.150 4.375 -10.340 1.00 . A A . 30 LYS HZ1 1 1 9 9392 1 1 30 LYS HZ2 H -12.876 4.781 -11.376 1.00 . A A . 30 LYS HZ2 1 1 9 9393 1 1 30 LYS HZ3 H -12.560 4.392 -9.761 1.00 . A A . 30 LYS HZ3 1 1 9 9394 1 1 30 LYS N N -14.286 2.394 -5.557 1.00 . A A . 30 LYS N 1 1 9 9395 1 1 30 LYS NZ N -13.159 4.172 -10.581 1.00 . A A . 30 LYS NZ 1 1 9 9396 1 1 30 LYS O O -17.026 3.662 -7.473 1.00 . A A . 30 LYS O 1 1 9 9397 1 1 31 ASP C C -18.385 0.248 -6.277 1.00 . A A . 31 ASP C 1 1 9 9398 1 1 31 ASP CA C -17.763 0.977 -7.466 1.00 . A A . 31 ASP CA 1 1 9 9399 1 1 31 ASP CB C -17.629 0.019 -8.653 1.00 . A A . 31 ASP CB 1 1 9 9400 1 1 31 ASP CG C -16.978 0.670 -9.857 1.00 . A A . 31 ASP CG 1 1 9 9401 1 1 31 ASP H H -15.748 0.895 -6.825 1.00 . A A . 31 ASP H 1 1 9 9402 1 1 31 ASP HA H -18.399 1.804 -7.745 1.00 . A A . 31 ASP HA 1 1 9 9403 1 1 31 ASP HB2 H -17.027 -0.828 -8.357 1.00 . A A . 31 ASP HB2 1 1 9 9404 1 1 31 ASP HB3 H -18.611 -0.326 -8.939 1.00 . A A . 31 ASP HB3 1 1 9 9405 1 1 31 ASP N N -16.459 1.515 -7.092 1.00 . A A . 31 ASP N 1 1 9 9406 1 1 31 ASP O O -18.740 -0.927 -6.370 1.00 . A A . 31 ASP O 1 1 9 9407 1 1 31 ASP OD1 O -17.622 1.537 -10.484 1.00 . A A . 31 ASP OD1 1 1 9 9408 1 1 31 ASP OD2 O -15.824 0.313 -10.172 1.00 . A A . 31 ASP OD2 1 1 9 9409 1 1 32 GLY C C -19.867 1.356 -3.130 1.00 . A A . 32 GLY C 1 1 9 9410 1 1 32 GLY CA C -19.070 0.366 -3.956 1.00 . A A . 32 GLY CA 1 1 9 9411 1 1 32 GLY H H -18.224 1.894 -5.151 1.00 . A A . 32 GLY H 1 1 9 9412 1 1 32 GLY HA2 H -19.712 -0.456 -4.234 1.00 . A A . 32 GLY HA2 1 1 9 9413 1 1 32 GLY HA3 H -18.256 -0.012 -3.349 1.00 . A A . 32 GLY HA3 1 1 9 9414 1 1 32 GLY N N -18.512 0.957 -5.159 1.00 . A A . 32 GLY N 1 1 9 9415 1 1 32 GLY O O -20.384 2.343 -3.655 1.00 . A A . 32 GLY O 1 1 9 9416 1 1 33 GLY C C -19.991 2.153 0.394 1.00 . A A . 33 GLY C 1 1 9 9417 1 1 33 GLY CA C -20.694 1.967 -0.938 1.00 . A A . 33 GLY CA 1 1 9 9418 1 1 33 GLY H H -19.530 0.284 -1.475 1.00 . A A . 33 GLY H 1 1 9 9419 1 1 33 GLY HA2 H -20.808 2.931 -1.412 1.00 . A A . 33 GLY HA2 1 1 9 9420 1 1 33 GLY HA3 H -21.673 1.546 -0.760 1.00 . A A . 33 GLY HA3 1 1 9 9421 1 1 33 GLY N N -19.962 1.089 -1.830 1.00 . A A . 33 GLY N 1 1 9 9422 1 1 33 GLY O O -19.879 3.273 0.893 1.00 . A A . 33 GLY O 1 1 9 9423 1 1 34 ASP C C -17.313 1.265 2.041 1.00 . A A . 34 ASP C 1 1 9 9424 1 1 34 ASP CA C -18.816 1.096 2.248 1.00 . A A . 34 ASP CA 1 1 9 9425 1 1 34 ASP CB C -19.090 -0.180 3.045 1.00 . A A . 34 ASP CB 1 1 9 9426 1 1 34 ASP CG C -18.387 -0.184 4.390 1.00 . A A . 34 ASP CG 1 1 9 9427 1 1 34 ASP H H -19.635 0.189 0.519 1.00 . A A . 34 ASP H 1 1 9 9428 1 1 34 ASP HA H -19.190 1.944 2.803 1.00 . A A . 34 ASP HA 1 1 9 9429 1 1 34 ASP HB2 H -20.152 -0.271 3.215 1.00 . A A . 34 ASP HB2 1 1 9 9430 1 1 34 ASP HB3 H -18.747 -1.032 2.477 1.00 . A A . 34 ASP HB3 1 1 9 9431 1 1 34 ASP N N -19.514 1.052 0.968 1.00 . A A . 34 ASP N 1 1 9 9432 1 1 34 ASP O O -16.799 1.037 0.947 1.00 . A A . 34 ASP O 1 1 9 9433 1 1 34 ASP OD1 O -18.911 0.440 5.336 1.00 . A A . 34 ASP OD1 1 1 9 9434 1 1 34 ASP OD2 O -17.313 -0.812 4.495 1.00 . A A . 34 ASP OD2 1 1 9 9435 1 1 35 CYS C C -14.441 0.876 3.936 1.00 . A A . 35 CYS C 1 1 9 9436 1 1 35 CYS CA C -15.172 1.865 3.032 1.00 . A A . 35 CYS CA 1 1 9 9437 1 1 35 CYS CB C -14.815 3.298 3.432 1.00 . A A . 35 CYS CB 1 1 9 9438 1 1 35 CYS H H -17.081 1.829 3.946 1.00 . A A . 35 CYS H 1 1 9 9439 1 1 35 CYS HA H -14.861 1.699 2.012 1.00 . A A . 35 CYS HA 1 1 9 9440 1 1 35 CYS HB2 H -15.140 3.472 4.447 1.00 . A A . 35 CYS HB2 1 1 9 9441 1 1 35 CYS HB3 H -13.743 3.422 3.377 1.00 . A A . 35 CYS HB3 1 1 9 9442 1 1 35 CYS HG H -15.688 4.072 1.165 1.00 . A A . 35 CYS HG 1 1 9 9443 1 1 35 CYS N N -16.615 1.666 3.100 1.00 . A A . 35 CYS N 1 1 9 9444 1 1 35 CYS O O -14.858 0.627 5.067 1.00 . A A . 35 CYS O 1 1 9 9445 1 1 35 CYS SG S -15.571 4.566 2.389 1.00 . A A . 35 CYS SG 1 1 9 9446 1 1 36 GLU C C -11.076 -0.276 4.145 1.00 . A A . 36 GLU C 1 1 9 9447 1 1 36 GLU CA C -12.556 -0.647 4.184 1.00 . A A . 36 GLU CA 1 1 9 9448 1 1 36 GLU CB C -12.760 -2.055 3.623 1.00 . A A . 36 GLU CB 1 1 9 9449 1 1 36 GLU CD C -14.644 -2.681 5.185 1.00 . A A . 36 GLU CD 1 1 9 9450 1 1 36 GLU CG C -14.191 -2.555 3.744 1.00 . A A . 36 GLU CG 1 1 9 9451 1 1 36 GLU H H -13.068 0.555 2.518 1.00 . A A . 36 GLU H 1 1 9 9452 1 1 36 GLU HA H -12.895 -0.623 5.208 1.00 . A A . 36 GLU HA 1 1 9 9453 1 1 36 GLU HB2 H -12.489 -2.057 2.579 1.00 . A A . 36 GLU HB2 1 1 9 9454 1 1 36 GLU HB3 H -12.117 -2.739 4.157 1.00 . A A . 36 GLU HB3 1 1 9 9455 1 1 36 GLU HG2 H -14.844 -1.861 3.236 1.00 . A A . 36 GLU HG2 1 1 9 9456 1 1 36 GLU HG3 H -14.262 -3.524 3.272 1.00 . A A . 36 GLU HG3 1 1 9 9457 1 1 36 GLU N N -13.349 0.316 3.427 1.00 . A A . 36 GLU N 1 1 9 9458 1 1 36 GLU O O -10.660 0.570 3.353 1.00 . A A . 36 GLU O 1 1 9 9459 1 1 36 GLU OE1 O -14.387 -3.739 5.798 1.00 . A A . 36 GLU OE1 1 1 9 9460 1 1 36 GLU OE2 O -15.257 -1.723 5.700 1.00 . A A . 36 GLU OE2 1 1 9 9461 1 1 37 TRP C C -8.039 -1.784 4.476 1.00 . A A . 37 TRP C 1 1 9 9462 1 1 37 TRP CA C -8.854 -0.641 5.071 1.00 . A A . 37 TRP CA 1 1 9 9463 1 1 37 TRP CB C -8.436 -0.416 6.523 1.00 . A A . 37 TRP CB 1 1 9 9464 1 1 37 TRP CD1 C -9.394 1.957 6.460 1.00 . A A . 37 TRP CD1 1 1 9 9465 1 1 37 TRP CD2 C -9.350 1.042 8.504 1.00 . A A . 37 TRP CD2 1 1 9 9466 1 1 37 TRP CE2 C -9.895 2.337 8.602 1.00 . A A . 37 TRP CE2 1 1 9 9467 1 1 37 TRP CE3 C -9.224 0.275 9.665 1.00 . A A . 37 TRP CE3 1 1 9 9468 1 1 37 TRP CG C -9.037 0.818 7.123 1.00 . A A . 37 TRP CG 1 1 9 9469 1 1 37 TRP CH2 C -10.179 2.107 10.935 1.00 . A A . 37 TRP CH2 1 1 9 9470 1 1 37 TRP CZ2 C -10.314 2.880 9.815 1.00 . A A . 37 TRP CZ2 1 1 9 9471 1 1 37 TRP CZ3 C -9.640 0.816 10.868 1.00 . A A . 37 TRP CZ3 1 1 9 9472 1 1 37 TRP H H -10.670 -1.579 5.607 1.00 . A A . 37 TRP H 1 1 9 9473 1 1 37 TRP HA H -8.659 0.257 4.507 1.00 . A A . 37 TRP HA 1 1 9 9474 1 1 37 TRP HB2 H -8.749 -1.263 7.115 1.00 . A A . 37 TRP HB2 1 1 9 9475 1 1 37 TRP HB3 H -7.363 -0.327 6.572 1.00 . A A . 37 TRP HB3 1 1 9 9476 1 1 37 TRP HD1 H -9.280 2.101 5.396 1.00 . A A . 37 TRP HD1 1 1 9 9477 1 1 37 TRP HE1 H -10.240 3.767 7.106 1.00 . A A . 37 TRP HE1 1 1 9 9478 1 1 37 TRP HE3 H -8.812 -0.722 9.635 1.00 . A A . 37 TRP HE3 1 1 9 9479 1 1 37 TRP HH2 H -10.489 2.488 11.897 1.00 . A A . 37 TRP HH2 1 1 9 9480 1 1 37 TRP HZ2 H -10.733 3.873 9.882 1.00 . A A . 37 TRP HZ2 1 1 9 9481 1 1 37 TRP HZ3 H -9.549 0.239 11.777 1.00 . A A . 37 TRP HZ3 1 1 9 9482 1 1 37 TRP N N -10.285 -0.912 5.003 1.00 . A A . 37 TRP N 1 1 9 9483 1 1 37 TRP NE1 N -9.912 2.874 7.342 1.00 . A A . 37 TRP NE1 1 1 9 9484 1 1 37 TRP O O -8.425 -2.949 4.569 1.00 . A A . 37 TRP O 1 1 9 9485 1 1 38 VAL C C -5.029 -2.955 4.301 1.00 . A A . 38 VAL C 1 1 9 9486 1 1 38 VAL CA C -6.028 -2.443 3.273 1.00 . A A . 38 VAL CA 1 1 9 9487 1 1 38 VAL CB C -5.259 -1.884 2.060 1.00 . A A . 38 VAL CB 1 1 9 9488 1 1 38 VAL CG1 C -4.351 -2.951 1.464 1.00 . A A . 38 VAL CG1 1 1 9 9489 1 1 38 VAL CG2 C -6.229 -1.354 1.019 1.00 . A A . 38 VAL CG2 1 1 9 9490 1 1 38 VAL H H -6.656 -0.489 3.814 1.00 . A A . 38 VAL H 1 1 9 9491 1 1 38 VAL HA H -6.642 -3.268 2.939 1.00 . A A . 38 VAL HA 1 1 9 9492 1 1 38 VAL HB H -4.642 -1.065 2.391 1.00 . A A . 38 VAL HB 1 1 9 9493 1 1 38 VAL HG11 H -3.905 -2.582 0.556 1.00 . A A . 38 VAL HG11 1 1 9 9494 1 1 38 VAL HG12 H -4.930 -3.836 1.247 1.00 . A A . 38 VAL HG12 1 1 9 9495 1 1 38 VAL HG13 H -3.572 -3.196 2.171 1.00 . A A . 38 VAL HG13 1 1 9 9496 1 1 38 VAL HG21 H -5.786 -0.513 0.508 1.00 . A A . 38 VAL HG21 1 1 9 9497 1 1 38 VAL HG22 H -7.141 -1.039 1.505 1.00 . A A . 38 VAL HG22 1 1 9 9498 1 1 38 VAL HG23 H -6.452 -2.132 0.306 1.00 . A A . 38 VAL HG23 1 1 9 9499 1 1 38 VAL N N -6.905 -1.441 3.871 1.00 . A A . 38 VAL N 1 1 9 9500 1 1 38 VAL O O -4.775 -2.299 5.311 1.00 . A A . 38 VAL O 1 1 9 9501 1 1 39 LYS C C -2.125 -4.112 4.812 1.00 . A A . 39 LYS C 1 1 9 9502 1 1 39 LYS CA C -3.508 -4.724 4.958 1.00 . A A . 39 LYS CA 1 1 9 9503 1 1 39 LYS CB C -3.441 -6.239 4.752 1.00 . A A . 39 LYS CB 1 1 9 9504 1 1 39 LYS CD C -2.291 -8.399 5.324 1.00 . A A . 39 LYS CD 1 1 9 9505 1 1 39 LYS CE C -1.372 -9.112 6.303 1.00 . A A . 39 LYS CE 1 1 9 9506 1 1 39 LYS CG C -2.500 -6.945 5.715 1.00 . A A . 39 LYS CG 1 1 9 9507 1 1 39 LYS H H -4.700 -4.602 3.216 1.00 . A A . 39 LYS H 1 1 9 9508 1 1 39 LYS HA H -3.856 -4.520 5.952 1.00 . A A . 39 LYS HA 1 1 9 9509 1 1 39 LYS HB2 H -4.431 -6.652 4.884 1.00 . A A . 39 LYS HB2 1 1 9 9510 1 1 39 LYS HB3 H -3.109 -6.439 3.743 1.00 . A A . 39 LYS HB3 1 1 9 9511 1 1 39 LYS HD2 H -3.247 -8.901 5.314 1.00 . A A . 39 LYS HD2 1 1 9 9512 1 1 39 LYS HD3 H -1.851 -8.438 4.338 1.00 . A A . 39 LYS HD3 1 1 9 9513 1 1 39 LYS HE2 H -0.450 -8.557 6.382 1.00 . A A . 39 LYS HE2 1 1 9 9514 1 1 39 LYS HE3 H -1.854 -9.147 7.269 1.00 . A A . 39 LYS HE3 1 1 9 9515 1 1 39 LYS HG2 H -1.546 -6.440 5.705 1.00 . A A . 39 LYS HG2 1 1 9 9516 1 1 39 LYS HG3 H -2.920 -6.905 6.708 1.00 . A A . 39 LYS HG3 1 1 9 9517 1 1 39 LYS HZ1 H -1.944 -11.035 5.720 1.00 . A A . 39 LYS HZ1 1 1 9 9518 1 1 39 LYS HZ2 H -0.493 -10.985 6.588 1.00 . A A . 39 LYS HZ2 1 1 9 9519 1 1 39 LYS HZ3 H -0.530 -10.486 4.973 1.00 . A A . 39 LYS HZ3 1 1 9 9520 1 1 39 LYS N N -4.465 -4.127 4.040 1.00 . A A . 39 LYS N 1 1 9 9521 1 1 39 LYS NZ N -1.063 -10.502 5.865 1.00 . A A . 39 LYS NZ 1 1 9 9522 1 1 39 LYS O O -1.344 -4.506 3.946 1.00 . A A . 39 LYS O 1 1 9 9523 1 1 40 GLY C C 0.465 -3.145 6.571 1.00 . A A . 40 GLY C 1 1 9 9524 1 1 40 GLY CA C -0.541 -2.494 5.647 1.00 . A A . 40 GLY CA 1 1 9 9525 1 1 40 GLY H H -2.510 -2.857 6.317 1.00 . A A . 40 GLY H 1 1 9 9526 1 1 40 GLY HA2 H -0.155 -2.538 4.642 1.00 . A A . 40 GLY HA2 1 1 9 9527 1 1 40 GLY HA3 H -0.660 -1.463 5.933 1.00 . A A . 40 GLY HA3 1 1 9 9528 1 1 40 GLY N N -1.833 -3.144 5.673 1.00 . A A . 40 GLY N 1 1 9 9529 1 1 40 GLY O O 1.171 -2.463 7.312 1.00 . A A . 40 GLY O 1 1 9 9530 1 1 41 VAL C C 2.377 -6.038 6.447 1.00 . A A . 41 VAL C 1 1 9 9531 1 1 41 VAL CA C 1.469 -5.215 7.349 1.00 . A A . 41 VAL CA 1 1 9 9532 1 1 41 VAL CB C 0.790 -6.182 8.339 1.00 . A A . 41 VAL CB 1 1 9 9533 1 1 41 VAL CG1 C 1.630 -6.327 9.598 1.00 . A A . 41 VAL CG1 1 1 9 9534 1 1 41 VAL CG2 C -0.626 -5.734 8.682 1.00 . A A . 41 VAL CG2 1 1 9 9535 1 1 41 VAL H H -0.105 -4.957 5.959 1.00 . A A . 41 VAL H 1 1 9 9536 1 1 41 VAL HA H 2.067 -4.510 7.908 1.00 . A A . 41 VAL HA 1 1 9 9537 1 1 41 VAL HB H 0.739 -7.151 7.863 1.00 . A A . 41 VAL HB 1 1 9 9538 1 1 41 VAL HG11 H 1.721 -5.366 10.083 1.00 . A A . 41 VAL HG11 1 1 9 9539 1 1 41 VAL HG12 H 2.613 -6.691 9.335 1.00 . A A . 41 VAL HG12 1 1 9 9540 1 1 41 VAL HG13 H 1.155 -7.026 10.270 1.00 . A A . 41 VAL HG13 1 1 9 9541 1 1 41 VAL HG21 H -0.594 -4.751 9.128 1.00 . A A . 41 VAL HG21 1 1 9 9542 1 1 41 VAL HG22 H -1.066 -6.433 9.378 1.00 . A A . 41 VAL HG22 1 1 9 9543 1 1 41 VAL HG23 H -1.220 -5.701 7.781 1.00 . A A . 41 VAL HG23 1 1 9 9544 1 1 41 VAL N N 0.515 -4.468 6.540 1.00 . A A . 41 VAL N 1 1 9 9545 1 1 41 VAL O O 3.091 -6.928 6.913 1.00 . A A . 41 VAL O 1 1 9 9546 1 1 42 HIS C C 4.551 -5.919 4.136 1.00 . A A . 42 HIS C 1 1 9 9547 1 1 42 HIS CA C 3.153 -6.469 4.194 1.00 . A A . 42 HIS CA 1 1 9 9548 1 1 42 HIS CB C 2.484 -6.475 2.821 1.00 . A A . 42 HIS CB 1 1 9 9549 1 1 42 HIS CD2 C 3.092 -8.789 1.817 1.00 . A A . 42 HIS CD2 1 1 9 9550 1 1 42 HIS CE1 C 1.079 -9.658 1.778 1.00 . A A . 42 HIS CE1 1 1 9 9551 1 1 42 HIS CG C 2.237 -7.858 2.302 1.00 . A A . 42 HIS CG 1 1 9 9552 1 1 42 HIS H H 1.780 -5.013 4.833 1.00 . A A . 42 HIS H 1 1 9 9553 1 1 42 HIS HA H 3.234 -7.470 4.543 1.00 . A A . 42 HIS HA 1 1 9 9554 1 1 42 HIS HB2 H 1.527 -5.970 2.892 1.00 . A A . 42 HIS HB2 1 1 9 9555 1 1 42 HIS HB3 H 3.112 -5.956 2.113 1.00 . A A . 42 HIS HB3 1 1 9 9556 1 1 42 HIS HD1 H 0.151 -8.008 2.552 1.00 . A A . 42 HIS HD1 1 1 9 9557 1 1 42 HIS HD2 H 4.162 -8.680 1.702 1.00 . A A . 42 HIS HD2 1 1 9 9558 1 1 42 HIS HE1 H 0.260 -10.347 1.633 1.00 . A A . 42 HIS HE1 1 1 9 9559 1 1 42 HIS HE2 H 2.703 -10.750 1.172 1.00 . A A . 42 HIS HE2 1 1 9 9560 1 1 42 HIS N N 2.346 -5.742 5.150 1.00 . A A . 42 HIS N 1 1 9 9561 1 1 42 HIS ND1 N 0.985 -8.433 2.263 1.00 . A A . 42 HIS ND1 1 1 9 9562 1 1 42 HIS NE2 N 2.347 -9.898 1.499 1.00 . A A . 42 HIS NE2 1 1 9 9563 1 1 42 HIS O O 4.903 -5.147 3.248 1.00 . A A . 42 HIS O 1 1 9 9564 1 1 43 VAL C C 7.554 -6.325 4.048 1.00 . A A . 43 VAL C 1 1 9 9565 1 1 43 VAL CA C 6.722 -5.956 5.261 1.00 . A A . 43 VAL CA 1 1 9 9566 1 1 43 VAL CB C 7.351 -6.568 6.531 1.00 . A A . 43 VAL CB 1 1 9 9567 1 1 43 VAL CG1 C 7.181 -8.079 6.546 1.00 . A A . 43 VAL CG1 1 1 9 9568 1 1 43 VAL CG2 C 8.822 -6.189 6.653 1.00 . A A . 43 VAL CG2 1 1 9 9569 1 1 43 VAL H H 4.928 -6.941 5.799 1.00 . A A . 43 VAL H 1 1 9 9570 1 1 43 VAL HA H 6.750 -4.888 5.360 1.00 . A A . 43 VAL HA 1 1 9 9571 1 1 43 VAL HB H 6.830 -6.165 7.385 1.00 . A A . 43 VAL HB 1 1 9 9572 1 1 43 VAL HG11 H 7.752 -8.515 5.739 1.00 . A A . 43 VAL HG11 1 1 9 9573 1 1 43 VAL HG12 H 6.137 -8.326 6.423 1.00 . A A . 43 VAL HG12 1 1 9 9574 1 1 43 VAL HG13 H 7.535 -8.472 7.488 1.00 . A A . 43 VAL HG13 1 1 9 9575 1 1 43 VAL HG21 H 9.398 -6.740 5.926 1.00 . A A . 43 VAL HG21 1 1 9 9576 1 1 43 VAL HG22 H 9.174 -6.428 7.646 1.00 . A A . 43 VAL HG22 1 1 9 9577 1 1 43 VAL HG23 H 8.936 -5.131 6.475 1.00 . A A . 43 VAL HG23 1 1 9 9578 1 1 43 VAL N N 5.329 -6.351 5.119 1.00 . A A . 43 VAL N 1 1 9 9579 1 1 43 VAL O O 8.369 -7.246 4.082 1.00 . A A . 43 VAL O 1 1 9 9580 1 1 44 ALA C C 9.273 -4.856 1.767 1.00 . A A . 44 ALA C 1 1 9 9581 1 1 44 ALA CA C 8.078 -5.787 1.753 1.00 . A A . 44 ALA CA 1 1 9 9582 1 1 44 ALA CB C 7.204 -5.540 0.533 1.00 . A A . 44 ALA CB 1 1 9 9583 1 1 44 ALA H H 6.633 -4.907 3.004 1.00 . A A . 44 ALA H 1 1 9 9584 1 1 44 ALA HA H 8.430 -6.807 1.732 1.00 . A A . 44 ALA HA 1 1 9 9585 1 1 44 ALA HB1 H 7.765 -5.762 -0.363 1.00 . A A . 44 ALA HB1 1 1 9 9586 1 1 44 ALA HB2 H 6.894 -4.506 0.515 1.00 . A A . 44 ALA HB2 1 1 9 9587 1 1 44 ALA HB3 H 6.333 -6.176 0.579 1.00 . A A . 44 ALA HB3 1 1 9 9588 1 1 44 ALA N N 7.328 -5.597 2.972 1.00 . A A . 44 ALA N 1 1 9 9589 1 1 44 ALA O O 9.511 -4.107 0.820 1.00 . A A . 44 ALA O 1 1 9 9590 1 1 45 GLU C C 12.040 -4.048 1.777 1.00 . A A . 45 GLU C 1 1 9 9591 1 1 45 GLU CA C 11.206 -4.069 3.043 1.00 . A A . 45 GLU CA 1 1 9 9592 1 1 45 GLU CB C 12.047 -4.562 4.221 1.00 . A A . 45 GLU CB 1 1 9 9593 1 1 45 GLU CD C 14.129 -4.251 5.619 1.00 . A A . 45 GLU CD 1 1 9 9594 1 1 45 GLU CG C 13.317 -3.756 4.438 1.00 . A A . 45 GLU CG 1 1 9 9595 1 1 45 GLU H H 9.791 -5.554 3.565 1.00 . A A . 45 GLU H 1 1 9 9596 1 1 45 GLU HA H 10.864 -3.067 3.249 1.00 . A A . 45 GLU HA 1 1 9 9597 1 1 45 GLU HB2 H 11.453 -4.507 5.122 1.00 . A A . 45 GLU HB2 1 1 9 9598 1 1 45 GLU HB3 H 12.325 -5.592 4.048 1.00 . A A . 45 GLU HB3 1 1 9 9599 1 1 45 GLU HG2 H 13.926 -3.823 3.550 1.00 . A A . 45 GLU HG2 1 1 9 9600 1 1 45 GLU HG3 H 13.048 -2.725 4.613 1.00 . A A . 45 GLU HG3 1 1 9 9601 1 1 45 GLU N N 10.027 -4.914 2.865 1.00 . A A . 45 GLU N 1 1 9 9602 1 1 45 GLU O O 12.738 -3.079 1.491 1.00 . A A . 45 GLU O 1 1 9 9603 1 1 45 GLU OE1 O 14.959 -5.165 5.427 1.00 . A A . 45 GLU OE1 1 1 9 9604 1 1 45 GLU OE2 O 13.937 -3.725 6.735 1.00 . A A . 45 GLU OE2 1 1 9 9605 1 1 46 ASP C C 12.095 -4.248 -1.239 1.00 . A A . 46 ASP C 1 1 9 9606 1 1 46 ASP CA C 12.682 -5.226 -0.236 1.00 . A A . 46 ASP CA 1 1 9 9607 1 1 46 ASP CB C 12.614 -6.647 -0.791 1.00 . A A . 46 ASP CB 1 1 9 9608 1 1 46 ASP CG C 13.143 -7.678 0.187 1.00 . A A . 46 ASP CG 1 1 9 9609 1 1 46 ASP H H 11.393 -5.880 1.317 1.00 . A A . 46 ASP H 1 1 9 9610 1 1 46 ASP HA H 13.715 -4.960 -0.058 1.00 . A A . 46 ASP HA 1 1 9 9611 1 1 46 ASP HB2 H 11.586 -6.885 -1.017 1.00 . A A . 46 ASP HB2 1 1 9 9612 1 1 46 ASP HB3 H 13.199 -6.699 -1.696 1.00 . A A . 46 ASP HB3 1 1 9 9613 1 1 46 ASP N N 11.957 -5.130 1.021 1.00 . A A . 46 ASP N 1 1 9 9614 1 1 46 ASP O O 12.815 -3.457 -1.846 1.00 . A A . 46 ASP O 1 1 9 9615 1 1 46 ASP OD1 O 14.370 -7.916 0.194 1.00 . A A . 46 ASP OD1 1 1 9 9616 1 1 46 ASP OD2 O 12.332 -8.246 0.947 1.00 . A A . 46 ASP OD2 1 1 9 9617 1 1 47 VAL C C 10.394 -1.957 -1.967 1.00 . A A . 47 VAL C 1 1 9 9618 1 1 47 VAL CA C 10.085 -3.405 -2.312 1.00 . A A . 47 VAL CA 1 1 9 9619 1 1 47 VAL CB C 8.561 -3.632 -2.282 1.00 . A A . 47 VAL CB 1 1 9 9620 1 1 47 VAL CG1 C 7.858 -2.669 -3.224 1.00 . A A . 47 VAL CG1 1 1 9 9621 1 1 47 VAL CG2 C 8.237 -5.071 -2.648 1.00 . A A . 47 VAL CG2 1 1 9 9622 1 1 47 VAL H H 10.252 -4.924 -0.849 1.00 . A A . 47 VAL H 1 1 9 9623 1 1 47 VAL HA H 10.443 -3.613 -3.308 1.00 . A A . 47 VAL HA 1 1 9 9624 1 1 47 VAL HB H 8.206 -3.448 -1.280 1.00 . A A . 47 VAL HB 1 1 9 9625 1 1 47 VAL HG11 H 8.198 -2.840 -4.234 1.00 . A A . 47 VAL HG11 1 1 9 9626 1 1 47 VAL HG12 H 8.084 -1.652 -2.935 1.00 . A A . 47 VAL HG12 1 1 9 9627 1 1 47 VAL HG13 H 6.791 -2.830 -3.171 1.00 . A A . 47 VAL HG13 1 1 9 9628 1 1 47 VAL HG21 H 8.505 -5.248 -3.679 1.00 . A A . 47 VAL HG21 1 1 9 9629 1 1 47 VAL HG22 H 7.179 -5.247 -2.516 1.00 . A A . 47 VAL HG22 1 1 9 9630 1 1 47 VAL HG23 H 8.796 -5.739 -2.012 1.00 . A A . 47 VAL HG23 1 1 9 9631 1 1 47 VAL N N 10.774 -4.292 -1.388 1.00 . A A . 47 VAL N 1 1 9 9632 1 1 47 VAL O O 10.712 -1.175 -2.831 1.00 . A A . 47 VAL O 1 1 9 9633 1 1 48 ALA C C 12.036 0.025 -0.211 1.00 . A A . 48 ALA C 1 1 9 9634 1 1 48 ALA CA C 10.560 -0.329 -0.111 1.00 . A A . 48 ALA CA 1 1 9 9635 1 1 48 ALA CB C 10.125 -0.306 1.346 1.00 . A A . 48 ALA CB 1 1 9 9636 1 1 48 ALA H H 10.033 -2.344 -0.096 1.00 . A A . 48 ALA H 1 1 9 9637 1 1 48 ALA HA H 9.978 0.406 -0.636 1.00 . A A . 48 ALA HA 1 1 9 9638 1 1 48 ALA HB1 H 9.047 -0.343 1.398 1.00 . A A . 48 ALA HB1 1 1 9 9639 1 1 48 ALA HB2 H 10.477 0.602 1.813 1.00 . A A . 48 ALA HB2 1 1 9 9640 1 1 48 ALA HB3 H 10.540 -1.161 1.860 1.00 . A A . 48 ALA HB3 1 1 9 9641 1 1 48 ALA N N 10.295 -1.650 -0.682 1.00 . A A . 48 ALA N 1 1 9 9642 1 1 48 ALA O O 12.405 1.027 -0.823 1.00 . A A . 48 ALA O 1 1 9 9643 1 1 49 LYS C C 14.790 -0.446 -1.066 1.00 . A A . 49 LYS C 1 1 9 9644 1 1 49 LYS CA C 14.317 -0.573 0.371 1.00 . A A . 49 LYS CA 1 1 9 9645 1 1 49 LYS CB C 15.065 -1.710 1.072 1.00 . A A . 49 LYS CB 1 1 9 9646 1 1 49 LYS CD C 15.513 -0.508 3.235 1.00 . A A . 49 LYS CD 1 1 9 9647 1 1 49 LYS CE C 15.371 -0.554 4.749 1.00 . A A . 49 LYS CE 1 1 9 9648 1 1 49 LYS CG C 14.879 -1.725 2.582 1.00 . A A . 49 LYS CG 1 1 9 9649 1 1 49 LYS H H 12.529 -1.599 0.856 1.00 . A A . 49 LYS H 1 1 9 9650 1 1 49 LYS HA H 14.515 0.354 0.889 1.00 . A A . 49 LYS HA 1 1 9 9651 1 1 49 LYS HB2 H 14.714 -2.651 0.678 1.00 . A A . 49 LYS HB2 1 1 9 9652 1 1 49 LYS HB3 H 16.120 -1.613 0.862 1.00 . A A . 49 LYS HB3 1 1 9 9653 1 1 49 LYS HD2 H 16.563 -0.482 2.982 1.00 . A A . 49 LYS HD2 1 1 9 9654 1 1 49 LYS HD3 H 15.028 0.382 2.863 1.00 . A A . 49 LYS HD3 1 1 9 9655 1 1 49 LYS HE2 H 14.322 -0.562 4.999 1.00 . A A . 49 LYS HE2 1 1 9 9656 1 1 49 LYS HE3 H 15.835 -1.459 5.114 1.00 . A A . 49 LYS HE3 1 1 9 9657 1 1 49 LYS HG2 H 13.823 -1.731 2.806 1.00 . A A . 49 LYS HG2 1 1 9 9658 1 1 49 LYS HG3 H 15.339 -2.617 2.980 1.00 . A A . 49 LYS HG3 1 1 9 9659 1 1 49 LYS HZ1 H 15.562 1.500 5.085 1.00 . A A . 49 LYS HZ1 1 1 9 9660 1 1 49 LYS HZ2 H 17.025 0.654 5.161 1.00 . A A . 49 LYS HZ2 1 1 9 9661 1 1 49 LYS HZ3 H 15.920 0.548 6.437 1.00 . A A . 49 LYS HZ3 1 1 9 9662 1 1 49 LYS N N 12.880 -0.806 0.397 1.00 . A A . 49 LYS N 1 1 9 9663 1 1 49 LYS NZ N 16.015 0.619 5.403 1.00 . A A . 49 LYS NZ 1 1 9 9664 1 1 49 LYS O O 15.728 0.291 -1.365 1.00 . A A . 49 LYS O 1 1 9 9665 1 1 50 ASP C C 13.639 -0.101 -4.091 1.00 . A A . 50 ASP C 1 1 9 9666 1 1 50 ASP CA C 14.484 -1.145 -3.361 1.00 . A A . 50 ASP CA 1 1 9 9667 1 1 50 ASP CB C 14.336 -2.543 -3.988 1.00 . A A . 50 ASP CB 1 1 9 9668 1 1 50 ASP CG C 12.946 -2.863 -4.526 1.00 . A A . 50 ASP CG 1 1 9 9669 1 1 50 ASP H H 13.420 -1.774 -1.651 1.00 . A A . 50 ASP H 1 1 9 9670 1 1 50 ASP HA H 15.521 -0.845 -3.430 1.00 . A A . 50 ASP HA 1 1 9 9671 1 1 50 ASP HB2 H 15.035 -2.631 -4.801 1.00 . A A . 50 ASP HB2 1 1 9 9672 1 1 50 ASP HB3 H 14.579 -3.278 -3.232 1.00 . A A . 50 ASP HB3 1 1 9 9673 1 1 50 ASP N N 14.144 -1.187 -1.953 1.00 . A A . 50 ASP N 1 1 9 9674 1 1 50 ASP O O 13.993 0.344 -5.183 1.00 . A A . 50 ASP O 1 1 9 9675 1 1 50 ASP OD1 O 12.412 -2.071 -5.330 1.00 . A A . 50 ASP OD1 1 1 9 9676 1 1 50 ASP OD2 O 12.405 -3.929 -4.163 1.00 . A A . 50 ASP OD2 1 1 9 9677 1 1 51 TYR C C 12.267 2.643 -3.996 1.00 . A A . 51 TYR C 1 1 9 9678 1 1 51 TYR CA C 11.638 1.268 -4.089 1.00 . A A . 51 TYR CA 1 1 9 9679 1 1 51 TYR CB C 10.268 1.320 -3.413 1.00 . A A . 51 TYR CB 1 1 9 9680 1 1 51 TYR CD1 C 9.425 -0.314 -5.185 1.00 . A A . 51 TYR CD1 1 1 9 9681 1 1 51 TYR CD2 C 7.838 0.664 -3.696 1.00 . A A . 51 TYR CD2 1 1 9 9682 1 1 51 TYR CE1 C 8.408 -1.006 -5.816 1.00 . A A . 51 TYR CE1 1 1 9 9683 1 1 51 TYR CE2 C 6.819 -0.029 -4.322 1.00 . A A . 51 TYR CE2 1 1 9 9684 1 1 51 TYR CG C 9.161 0.537 -4.111 1.00 . A A . 51 TYR CG 1 1 9 9685 1 1 51 TYR CZ C 7.109 -0.860 -5.382 1.00 . A A . 51 TYR CZ 1 1 9 9686 1 1 51 TYR H H 12.277 -0.097 -2.620 1.00 . A A . 51 TYR H 1 1 9 9687 1 1 51 TYR HA H 11.508 0.984 -5.096 1.00 . A A . 51 TYR HA 1 1 9 9688 1 1 51 TYR HB2 H 10.373 0.928 -2.431 1.00 . A A . 51 TYR HB2 1 1 9 9689 1 1 51 TYR HB3 H 9.949 2.350 -3.346 1.00 . A A . 51 TYR HB3 1 1 9 9690 1 1 51 TYR HD1 H 10.438 -0.439 -5.526 1.00 . A A . 51 TYR HD1 1 1 9 9691 1 1 51 TYR HD2 H 7.609 1.309 -2.861 1.00 . A A . 51 TYR HD2 1 1 9 9692 1 1 51 TYR HE1 H 8.635 -1.659 -6.645 1.00 . A A . 51 TYR HE1 1 1 9 9693 1 1 51 TYR HE2 H 5.800 0.086 -3.983 1.00 . A A . 51 TYR HE2 1 1 9 9694 1 1 51 TYR HH H 5.352 -0.960 -6.157 1.00 . A A . 51 TYR HH 1 1 9 9695 1 1 51 TYR N N 12.517 0.286 -3.485 1.00 . A A . 51 TYR N 1 1 9 9696 1 1 51 TYR O O 12.569 3.286 -5.001 1.00 . A A . 51 TYR O 1 1 9 9697 1 1 51 TYR OH O 6.096 -1.548 -6.010 1.00 . A A . 51 TYR OH 1 1 9 9698 1 1 52 GLU C C 14.547 4.304 -2.320 1.00 . A A . 52 GLU C 1 1 9 9699 1 1 52 GLU CA C 13.032 4.377 -2.468 1.00 . A A . 52 GLU CA 1 1 9 9700 1 1 52 GLU CB C 12.410 4.964 -1.197 1.00 . A A . 52 GLU CB 1 1 9 9701 1 1 52 GLU CD C 12.113 4.772 1.302 1.00 . A A . 52 GLU CD 1 1 9 9702 1 1 52 GLU CG C 12.842 4.259 0.077 1.00 . A A . 52 GLU CG 1 1 9 9703 1 1 52 GLU H H 12.242 2.471 -2.010 1.00 . A A . 52 GLU H 1 1 9 9704 1 1 52 GLU HA H 12.795 5.016 -3.295 1.00 . A A . 52 GLU HA 1 1 9 9705 1 1 52 GLU HB2 H 12.694 6.004 -1.121 1.00 . A A . 52 GLU HB2 1 1 9 9706 1 1 52 GLU HB3 H 11.335 4.899 -1.274 1.00 . A A . 52 GLU HB3 1 1 9 9707 1 1 52 GLU HG2 H 12.644 3.204 -0.025 1.00 . A A . 52 GLU HG2 1 1 9 9708 1 1 52 GLU HG3 H 13.902 4.414 0.216 1.00 . A A . 52 GLU HG3 1 1 9 9709 1 1 52 GLU N N 12.463 3.070 -2.754 1.00 . A A . 52 GLU N 1 1 9 9710 1 1 52 GLU O O 15.281 5.081 -2.931 1.00 . A A . 52 GLU O 1 1 9 9711 1 1 52 GLU OE1 O 12.447 5.880 1.771 1.00 . A A . 52 GLU OE1 1 1 9 9712 1 1 52 GLU OE2 O 11.208 4.067 1.794 1.00 . A A . 52 GLU OE2 1 1 9 9713 1 1 53 ASP C C 17.120 2.512 -2.439 1.00 . A A . 53 ASP C 1 1 9 9714 1 1 53 ASP CA C 16.431 3.189 -1.258 1.00 . A A . 53 ASP CA 1 1 9 9715 1 1 53 ASP CB C 16.646 2.379 0.022 1.00 . A A . 53 ASP CB 1 1 9 9716 1 1 53 ASP CG C 16.878 3.263 1.231 1.00 . A A . 53 ASP CG 1 1 9 9717 1 1 53 ASP H H 14.371 2.766 -1.057 1.00 . A A . 53 ASP H 1 1 9 9718 1 1 53 ASP HA H 16.863 4.170 -1.124 1.00 . A A . 53 ASP HA 1 1 9 9719 1 1 53 ASP HB2 H 15.767 1.777 0.206 1.00 . A A . 53 ASP HB2 1 1 9 9720 1 1 53 ASP HB3 H 17.503 1.735 -0.104 1.00 . A A . 53 ASP HB3 1 1 9 9721 1 1 53 ASP N N 15.007 3.364 -1.502 1.00 . A A . 53 ASP N 1 1 9 9722 1 1 53 ASP O O 18.337 2.606 -2.593 1.00 . A A . 53 ASP O 1 1 9 9723 1 1 53 ASP OD1 O 15.893 3.835 1.745 1.00 . A A . 53 ASP OD1 1 1 9 9724 1 1 53 ASP OD2 O 18.042 3.383 1.666 1.00 . A A . 53 ASP OD2 1 1 9 9725 1 1 54 GLY C C 17.423 2.146 -5.457 1.00 . A A . 54 GLY C 1 1 9 9726 1 1 54 GLY CA C 16.904 1.162 -4.428 1.00 . A A . 54 GLY CA 1 1 9 9727 1 1 54 GLY H H 15.376 1.778 -3.097 1.00 . A A . 54 GLY H 1 1 9 9728 1 1 54 GLY HA2 H 17.719 0.530 -4.105 1.00 . A A . 54 GLY HA2 1 1 9 9729 1 1 54 GLY HA3 H 16.144 0.546 -4.885 1.00 . A A . 54 GLY HA3 1 1 9 9730 1 1 54 GLY N N 16.339 1.830 -3.271 1.00 . A A . 54 GLY N 1 1 9 9731 1 1 54 GLY O O 18.503 1.961 -6.015 1.00 . A A . 54 GLY O 1 1 9 9732 1 1 55 LEU C C 18.003 5.217 -6.033 1.00 . A A . 55 LEU C 1 1 9 9733 1 1 55 LEU CA C 17.033 4.224 -6.666 1.00 . A A . 55 LEU CA 1 1 9 9734 1 1 55 LEU CB C 15.795 4.960 -7.184 1.00 . A A . 55 LEU CB 1 1 9 9735 1 1 55 LEU CD1 C 13.662 4.947 -8.500 1.00 . A A . 55 LEU CD1 1 1 9 9736 1 1 55 LEU CD2 C 15.575 3.505 -9.215 1.00 . A A . 55 LEU CD2 1 1 9 9737 1 1 55 LEU CG C 14.842 4.112 -8.028 1.00 . A A . 55 LEU CG 1 1 9 9738 1 1 55 LEU H H 15.796 3.287 -5.228 1.00 . A A . 55 LEU H 1 1 9 9739 1 1 55 LEU HA H 17.525 3.735 -7.494 1.00 . A A . 55 LEU HA 1 1 9 9740 1 1 55 LEU HB2 H 15.247 5.340 -6.334 1.00 . A A . 55 LEU HB2 1 1 9 9741 1 1 55 LEU HB3 H 16.124 5.796 -7.784 1.00 . A A . 55 LEU HB3 1 1 9 9742 1 1 55 LEU HD11 H 13.142 5.349 -7.643 1.00 . A A . 55 LEU HD11 1 1 9 9743 1 1 55 LEU HD12 H 12.988 4.327 -9.072 1.00 . A A . 55 LEU HD12 1 1 9 9744 1 1 55 LEU HD13 H 14.019 5.758 -9.118 1.00 . A A . 55 LEU HD13 1 1 9 9745 1 1 55 LEU HD21 H 14.880 2.931 -9.811 1.00 . A A . 55 LEU HD21 1 1 9 9746 1 1 55 LEU HD22 H 16.363 2.859 -8.860 1.00 . A A . 55 LEU HD22 1 1 9 9747 1 1 55 LEU HD23 H 15.999 4.294 -9.818 1.00 . A A . 55 LEU HD23 1 1 9 9748 1 1 55 LEU HG H 14.457 3.304 -7.422 1.00 . A A . 55 LEU HG 1 1 9 9749 1 1 55 LEU N N 16.648 3.199 -5.705 1.00 . A A . 55 LEU N 1 1 9 9750 1 1 55 LEU O O 19.158 5.325 -6.448 1.00 . A A . 55 LEU O 1 1 9 9751 1 1 56 GLU C C 19.184 6.249 -3.246 1.00 . A A . 56 GLU C 1 1 9 9752 1 1 56 GLU CA C 18.349 6.921 -4.329 1.00 . A A . 56 GLU CA 1 1 9 9753 1 1 56 GLU CB C 17.477 8.010 -3.712 1.00 . A A . 56 GLU CB 1 1 9 9754 1 1 56 GLU CD C 17.655 9.651 -5.624 1.00 . A A . 56 GLU CD 1 1 9 9755 1 1 56 GLU CG C 16.727 8.844 -4.738 1.00 . A A . 56 GLU CG 1 1 9 9756 1 1 56 GLU H H 16.595 5.812 -4.742 1.00 . A A . 56 GLU H 1 1 9 9757 1 1 56 GLU HA H 19.010 7.369 -5.049 1.00 . A A . 56 GLU HA 1 1 9 9758 1 1 56 GLU HB2 H 16.756 7.545 -3.062 1.00 . A A . 56 GLU HB2 1 1 9 9759 1 1 56 GLU HB3 H 18.101 8.672 -3.129 1.00 . A A . 56 GLU HB3 1 1 9 9760 1 1 56 GLU HG2 H 16.143 8.185 -5.361 1.00 . A A . 56 GLU HG2 1 1 9 9761 1 1 56 GLU HG3 H 16.067 9.524 -4.218 1.00 . A A . 56 GLU HG3 1 1 9 9762 1 1 56 GLU N N 17.525 5.941 -5.025 1.00 . A A . 56 GLU N 1 1 9 9763 1 1 56 GLU O O 19.046 6.550 -2.061 1.00 . A A . 56 GLU O 1 1 9 9764 1 1 56 GLU OE1 O 17.981 10.799 -5.254 1.00 . A A . 56 GLU OE1 1 1 9 9765 1 1 56 GLU OE2 O 18.058 9.135 -6.688 1.00 . A A . 56 GLU OE2 1 1 9 9766 1 1 57 TYR C C 22.168 5.411 -2.423 1.00 . A A . 57 TYR C 1 1 9 9767 1 1 57 TYR CA C 20.909 4.610 -2.738 1.00 . A A . 57 TYR CA 1 1 9 9768 1 1 57 TYR CB C 21.282 3.245 -3.321 1.00 . A A . 57 TYR CB 1 1 9 9769 1 1 57 TYR CD1 C 23.516 2.540 -2.382 1.00 . A A . 57 TYR CD1 1 1 9 9770 1 1 57 TYR CD2 C 21.557 1.465 -1.550 1.00 . A A . 57 TYR CD2 1 1 9 9771 1 1 57 TYR CE1 C 24.299 1.771 -1.544 1.00 . A A . 57 TYR CE1 1 1 9 9772 1 1 57 TYR CE2 C 22.335 0.693 -0.708 1.00 . A A . 57 TYR CE2 1 1 9 9773 1 1 57 TYR CG C 22.133 2.400 -2.401 1.00 . A A . 57 TYR CG 1 1 9 9774 1 1 57 TYR CZ C 23.694 0.841 -0.707 1.00 . A A . 57 TYR CZ 1 1 9 9775 1 1 57 TYR H H 20.116 5.144 -4.625 1.00 . A A . 57 TYR H 1 1 9 9776 1 1 57 TYR HA H 20.355 4.461 -1.823 1.00 . A A . 57 TYR HA 1 1 9 9777 1 1 57 TYR HB2 H 20.377 2.693 -3.533 1.00 . A A . 57 TYR HB2 1 1 9 9778 1 1 57 TYR HB3 H 21.831 3.393 -4.241 1.00 . A A . 57 TYR HB3 1 1 9 9779 1 1 57 TYR HD1 H 23.979 3.264 -3.036 1.00 . A A . 57 TYR HD1 1 1 9 9780 1 1 57 TYR HD2 H 20.484 1.344 -1.551 1.00 . A A . 57 TYR HD2 1 1 9 9781 1 1 57 TYR HE1 H 25.372 1.895 -1.544 1.00 . A A . 57 TYR HE1 1 1 9 9782 1 1 57 TYR HE2 H 21.869 -0.029 -0.053 1.00 . A A . 57 TYR HE2 1 1 9 9783 1 1 57 TYR HH H 24.162 -0.823 0.121 1.00 . A A . 57 TYR HH 1 1 9 9784 1 1 57 TYR N N 20.050 5.335 -3.666 1.00 . A A . 57 TYR N 1 1 9 9785 1 1 57 TYR O O 22.153 6.174 -1.434 1.00 . A A . 57 TYR O 1 1 9 9786 1 1 57 TYR OXT O 23.160 5.273 -3.171 1.00 . A A . 57 TYR OXT 1 1 9 9787 1 1 57 TYR OH O 24.482 0.082 0.127 1.00 . A A . 57 TYR OH 1 1 9 9788 2 2 1 ALA C C -14.524 -9.112 0.961 1.00 . B B . 1 ALA C 1 1 9 9789 2 2 1 ALA CA C -15.937 -9.494 0.526 1.00 . B B . 1 ALA CA 1 1 9 9790 2 2 1 ALA CB C -16.925 -8.423 0.959 1.00 . B B . 1 ALA CB 1 1 9 9791 2 2 1 ALA H1 H -17.299 -11.051 0.787 1.00 . B B . 1 ALA H1 1 1 9 9792 2 2 1 ALA H2 H -16.296 -10.785 2.123 1.00 . B B . 1 ALA H2 1 1 9 9793 2 2 1 ALA H3 H -15.683 -11.552 0.745 1.00 . B B . 1 ALA H3 1 1 9 9794 2 2 1 ALA HA H -15.966 -9.559 -0.552 1.00 . B B . 1 ALA HA 1 1 9 9795 2 2 1 ALA HB1 H -17.917 -8.691 0.626 1.00 . B B . 1 ALA HB1 1 1 9 9796 2 2 1 ALA HB2 H -16.645 -7.476 0.524 1.00 . B B . 1 ALA HB2 1 1 9 9797 2 2 1 ALA HB3 H -16.918 -8.340 2.036 1.00 . B B . 1 ALA HB3 1 1 9 9798 2 2 1 ALA N N -16.331 -10.812 1.084 1.00 . B B . 1 ALA N 1 1 9 9799 2 2 1 ALA O O -14.138 -9.343 2.107 1.00 . B B . 1 ALA O 1 1 9 9800 2 2 2 PRO C C -12.318 -6.863 1.236 1.00 . B B . 2 PRO C 1 1 9 9801 2 2 2 PRO CA C -12.361 -8.102 0.346 1.00 . B B . 2 PRO CA 1 1 9 9802 2 2 2 PRO CB C -11.782 -7.784 -1.035 1.00 . B B . 2 PRO CB 1 1 9 9803 2 2 2 PRO CD C -14.111 -8.219 -1.347 1.00 . B B . 2 PRO CD 1 1 9 9804 2 2 2 PRO CG C -12.962 -7.393 -1.854 1.00 . B B . 2 PRO CG 1 1 9 9805 2 2 2 PRO HA H -11.794 -8.900 0.803 1.00 . B B . 2 PRO HA 1 1 9 9806 2 2 2 PRO HB2 H -11.070 -6.975 -0.952 1.00 . B B . 2 PRO HB2 1 1 9 9807 2 2 2 PRO HB3 H -11.296 -8.661 -1.436 1.00 . B B . 2 PRO HB3 1 1 9 9808 2 2 2 PRO HD2 H -15.028 -7.651 -1.383 1.00 . B B . 2 PRO HD2 1 1 9 9809 2 2 2 PRO HD3 H -14.206 -9.127 -1.925 1.00 . B B . 2 PRO HD3 1 1 9 9810 2 2 2 PRO HG2 H -13.168 -6.341 -1.722 1.00 . B B . 2 PRO HG2 1 1 9 9811 2 2 2 PRO HG3 H -12.774 -7.611 -2.895 1.00 . B B . 2 PRO HG3 1 1 9 9812 2 2 2 PRO N N -13.733 -8.521 0.047 1.00 . B B . 2 PRO N 1 1 9 9813 2 2 2 PRO O O -13.106 -5.934 1.052 1.00 . B B . 2 PRO O 1 1 9 9814 2 2 3 PRO C C -10.628 -4.478 2.460 1.00 . B B . 3 PRO C 1 1 9 9815 2 2 3 PRO CA C -11.263 -5.692 3.130 1.00 . B B . 3 PRO CA 1 1 9 9816 2 2 3 PRO CB C -10.348 -6.234 4.228 1.00 . B B . 3 PRO CB 1 1 9 9817 2 2 3 PRO CD C -10.409 -7.887 2.499 1.00 . B B . 3 PRO CD 1 1 9 9818 2 2 3 PRO CG C -9.524 -7.271 3.549 1.00 . B B . 3 PRO CG 1 1 9 9819 2 2 3 PRO HA H -12.215 -5.412 3.555 1.00 . B B . 3 PRO HA 1 1 9 9820 2 2 3 PRO HB2 H -9.737 -5.434 4.619 1.00 . B B . 3 PRO HB2 1 1 9 9821 2 2 3 PRO HB3 H -10.944 -6.661 5.020 1.00 . B B . 3 PRO HB3 1 1 9 9822 2 2 3 PRO HD2 H -9.837 -8.129 1.617 1.00 . B B . 3 PRO HD2 1 1 9 9823 2 2 3 PRO HD3 H -10.895 -8.770 2.889 1.00 . B B . 3 PRO HD3 1 1 9 9824 2 2 3 PRO HG2 H -8.662 -6.812 3.088 1.00 . B B . 3 PRO HG2 1 1 9 9825 2 2 3 PRO HG3 H -9.214 -8.019 4.262 1.00 . B B . 3 PRO HG3 1 1 9 9826 2 2 3 PRO N N -11.395 -6.827 2.213 1.00 . B B . 3 PRO N 1 1 9 9827 2 2 3 PRO O O -9.482 -4.132 2.742 1.00 . B B . 3 PRO O 1 1 9 9828 2 2 4 GLY C C -9.484 -2.877 0.308 1.00 . B B . 4 GLY C 1 1 9 9829 2 2 4 GLY CA C -10.875 -2.666 0.871 1.00 . B B . 4 GLY CA 1 1 9 9830 2 2 4 GLY H H -12.285 -4.162 1.385 1.00 . B B . 4 GLY H 1 1 9 9831 2 2 4 GLY HA2 H -11.547 -2.436 0.058 1.00 . B B . 4 GLY HA2 1 1 9 9832 2 2 4 GLY HA3 H -10.853 -1.833 1.556 1.00 . B B . 4 GLY HA3 1 1 9 9833 2 2 4 GLY N N -11.380 -3.837 1.570 1.00 . B B . 4 GLY N 1 1 9 9834 2 2 4 GLY O O -8.492 -2.741 1.020 1.00 . B B . 4 GLY O 1 1 9 9835 2 2 5 THR C C -8.237 -3.218 -3.144 1.00 . B B . 5 THR C 1 1 9 9836 2 2 5 THR CA C -8.140 -3.461 -1.640 1.00 . B B . 5 THR CA 1 1 9 9837 2 2 5 THR CB C -7.636 -4.896 -1.397 1.00 . B B . 5 THR CB 1 1 9 9838 2 2 5 THR CG2 C -7.417 -5.150 0.086 1.00 . B B . 5 THR CG2 1 1 9 9839 2 2 5 THR H H -10.246 -3.274 -1.487 1.00 . B B . 5 THR H 1 1 9 9840 2 2 5 THR HA H -7.418 -2.774 -1.227 1.00 . B B . 5 THR HA 1 1 9 9841 2 2 5 THR HB H -6.694 -5.022 -1.911 1.00 . B B . 5 THR HB 1 1 9 9842 2 2 5 THR HG1 H -8.637 -5.748 -2.868 1.00 . B B . 5 THR HG1 1 1 9 9843 2 2 5 THR HG21 H -7.039 -6.152 0.227 1.00 . B B . 5 THR HG21 1 1 9 9844 2 2 5 THR HG22 H -8.354 -5.041 0.611 1.00 . B B . 5 THR HG22 1 1 9 9845 2 2 5 THR HG23 H -6.703 -4.438 0.471 1.00 . B B . 5 THR HG23 1 1 9 9846 2 2 5 THR N N -9.417 -3.220 -0.972 1.00 . B B . 5 THR N 1 1 9 9847 2 2 5 THR O O -9.273 -3.482 -3.756 1.00 . B B . 5 THR O 1 1 9 9848 2 2 5 THR OG1 O -8.580 -5.841 -1.914 1.00 . B B . 5 THR OG1 1 1 9 9849 2 2 6 ALA C C -5.766 -2.724 -5.807 1.00 . B B . 6 ALA C 1 1 9 9850 2 2 6 ALA CA C -7.139 -2.464 -5.179 1.00 . B B . 6 ALA CA 1 1 9 9851 2 2 6 ALA CB C -7.577 -1.048 -5.469 1.00 . B B . 6 ALA CB 1 1 9 9852 2 2 6 ALA H H -6.373 -2.482 -3.197 1.00 . B B . 6 ALA H 1 1 9 9853 2 2 6 ALA HA H -7.856 -3.131 -5.636 1.00 . B B . 6 ALA HA 1 1 9 9854 2 2 6 ALA HB1 H -8.582 -0.901 -5.108 1.00 . B B . 6 ALA HB1 1 1 9 9855 2 2 6 ALA HB2 H -7.547 -0.869 -6.533 1.00 . B B . 6 ALA HB2 1 1 9 9856 2 2 6 ALA HB3 H -6.912 -0.365 -4.969 1.00 . B B . 6 ALA HB3 1 1 9 9857 2 2 6 ALA N N -7.156 -2.715 -3.740 1.00 . B B . 6 ALA N 1 1 9 9858 2 2 6 ALA O O -5.505 -3.815 -6.312 1.00 . B B . 6 ALA O 1 1 9 9859 2 2 7 ARG C C -2.826 -3.064 -5.863 1.00 . B B . 7 ARG C 1 1 9 9860 2 2 7 ARG CA C -3.567 -1.826 -6.370 1.00 . B B . 7 ARG CA 1 1 9 9861 2 2 7 ARG CB C -2.757 -0.551 -6.118 1.00 . B B . 7 ARG CB 1 1 9 9862 2 2 7 ARG CD C -3.501 0.547 -8.254 1.00 . B B . 7 ARG CD 1 1 9 9863 2 2 7 ARG CG C -3.369 0.691 -6.746 1.00 . B B . 7 ARG CG 1 1 9 9864 2 2 7 ARG CZ C -2.051 0.083 -10.185 1.00 . B B . 7 ARG CZ 1 1 9 9865 2 2 7 ARG H H -5.146 -0.876 -5.337 1.00 . B B . 7 ARG H 1 1 9 9866 2 2 7 ARG HA H -3.706 -1.935 -7.436 1.00 . B B . 7 ARG HA 1 1 9 9867 2 2 7 ARG HB2 H -2.682 -0.391 -5.053 1.00 . B B . 7 ARG HB2 1 1 9 9868 2 2 7 ARG HB3 H -1.765 -0.683 -6.523 1.00 . B B . 7 ARG HB3 1 1 9 9869 2 2 7 ARG HD2 H -4.088 -0.335 -8.469 1.00 . B B . 7 ARG HD2 1 1 9 9870 2 2 7 ARG HD3 H -4.007 1.418 -8.642 1.00 . B B . 7 ARG HD3 1 1 9 9871 2 2 7 ARG HE H -1.402 0.599 -8.371 1.00 . B B . 7 ARG HE 1 1 9 9872 2 2 7 ARG HG2 H -4.350 0.850 -6.323 1.00 . B B . 7 ARG HG2 1 1 9 9873 2 2 7 ARG HG3 H -2.739 1.540 -6.528 1.00 . B B . 7 ARG HG3 1 1 9 9874 2 2 7 ARG HH11 H -4.032 -0.091 -10.545 1.00 . B B . 7 ARG HH11 1 1 9 9875 2 2 7 ARG HH12 H -3.001 -0.415 -11.899 1.00 . B B . 7 ARG HH12 1 1 9 9876 2 2 7 ARG HH21 H -0.033 0.176 -10.147 1.00 . B B . 7 ARG HH21 1 1 9 9877 2 2 7 ARG HH22 H -0.727 -0.264 -11.672 1.00 . B B . 7 ARG HH22 1 1 9 9878 2 2 7 ARG N N -4.895 -1.713 -5.776 1.00 . B B . 7 ARG N 1 1 9 9879 2 2 7 ARG NE N -2.202 0.422 -8.909 1.00 . B B . 7 ARG NE 1 1 9 9880 2 2 7 ARG NH1 N -3.116 -0.161 -10.939 1.00 . B B . 7 ARG NH1 1 1 9 9881 2 2 7 ARG NH2 N -0.838 -0.009 -10.711 1.00 . B B . 7 ARG NH2 1 1 9 9882 2 2 7 ARG O O -3.107 -4.174 -6.315 1.00 . B B . 7 ARG O 1 1 9 9883 2 2 8 ARG C C -0.511 -4.812 -5.570 1.00 . B B . 8 ARG C 1 1 9 9884 2 2 8 ARG CA C -1.142 -4.035 -4.415 1.00 . B B . 8 ARG CA 1 1 9 9885 2 2 8 ARG CB C -2.068 -4.939 -3.601 1.00 . B B . 8 ARG CB 1 1 9 9886 2 2 8 ARG CD C -3.293 -5.314 -1.436 1.00 . B B . 8 ARG CD 1 1 9 9887 2 2 8 ARG CG C -2.255 -4.476 -2.165 1.00 . B B . 8 ARG CG 1 1 9 9888 2 2 8 ARG CZ C -3.397 -7.576 -0.472 1.00 . B B . 8 ARG CZ 1 1 9 9889 2 2 8 ARG H H -1.700 -2.002 -4.566 1.00 . B B . 8 ARG H 1 1 9 9890 2 2 8 ARG HA H -0.357 -3.661 -3.774 1.00 . B B . 8 ARG HA 1 1 9 9891 2 2 8 ARG HB2 H -3.039 -4.957 -4.077 1.00 . B B . 8 ARG HB2 1 1 9 9892 2 2 8 ARG HB3 H -1.661 -5.938 -3.587 1.00 . B B . 8 ARG HB3 1 1 9 9893 2 2 8 ARG HD2 H -3.407 -4.930 -0.433 1.00 . B B . 8 ARG HD2 1 1 9 9894 2 2 8 ARG HD3 H -4.233 -5.233 -1.960 1.00 . B B . 8 ARG HD3 1 1 9 9895 2 2 8 ARG HE H -2.251 -7.045 -2.015 1.00 . B B . 8 ARG HE 1 1 9 9896 2 2 8 ARG HG2 H -1.312 -4.558 -1.645 1.00 . B B . 8 ARG HG2 1 1 9 9897 2 2 8 ARG HG3 H -2.577 -3.446 -2.170 1.00 . B B . 8 ARG HG3 1 1 9 9898 2 2 8 ARG HH11 H -4.587 -6.214 0.430 1.00 . B B . 8 ARG HH11 1 1 9 9899 2 2 8 ARG HH12 H -4.652 -7.812 1.095 1.00 . B B . 8 ARG HH12 1 1 9 9900 2 2 8 ARG HH21 H -2.329 -9.151 -1.151 1.00 . B B . 8 ARG HH21 1 1 9 9901 2 2 8 ARG HH22 H -3.368 -9.484 0.195 1.00 . B B . 8 ARG HH22 1 1 9 9902 2 2 8 ARG N N -1.888 -2.895 -4.925 1.00 . B B . 8 ARG N 1 1 9 9903 2 2 8 ARG NE N -2.908 -6.721 -1.364 1.00 . B B . 8 ARG NE 1 1 9 9904 2 2 8 ARG NH1 N -4.285 -7.167 0.424 1.00 . B B . 8 ARG NH1 1 1 9 9905 2 2 8 ARG NH2 N -2.999 -8.841 -0.477 1.00 . B B . 8 ARG NH2 1 1 9 9906 2 2 8 ARG O O -0.753 -4.509 -6.738 1.00 . B B . 8 ARG O 1 1 9 9907 2 2 9 LYS C C 1.165 -8.048 -5.789 1.00 . B B . 9 LYS C 1 1 9 9908 2 2 9 LYS CA C 0.964 -6.610 -6.268 1.00 . B B . 9 LYS CA 1 1 9 9909 2 2 9 LYS CB C 2.312 -5.982 -6.636 1.00 . B B . 9 LYS CB 1 1 9 9910 2 2 9 LYS CD C 1.533 -4.432 -8.458 1.00 . B B . 9 LYS CD 1 1 9 9911 2 2 9 LYS CE C 2.382 -5.061 -9.550 1.00 . B B . 9 LYS CE 1 1 9 9912 2 2 9 LYS CG C 2.206 -4.536 -7.098 1.00 . B B . 9 LYS CG 1 1 9 9913 2 2 9 LYS H H 0.469 -6.000 -4.298 1.00 . B B . 9 LYS H 1 1 9 9914 2 2 9 LYS HA H 0.330 -6.618 -7.141 1.00 . B B . 9 LYS HA 1 1 9 9915 2 2 9 LYS HB2 H 2.959 -6.014 -5.773 1.00 . B B . 9 LYS HB2 1 1 9 9916 2 2 9 LYS HB3 H 2.762 -6.554 -7.432 1.00 . B B . 9 LYS HB3 1 1 9 9917 2 2 9 LYS HD2 H 0.581 -4.942 -8.418 1.00 . B B . 9 LYS HD2 1 1 9 9918 2 2 9 LYS HD3 H 1.374 -3.389 -8.691 1.00 . B B . 9 LYS HD3 1 1 9 9919 2 2 9 LYS HE2 H 3.335 -4.555 -9.584 1.00 . B B . 9 LYS HE2 1 1 9 9920 2 2 9 LYS HE3 H 2.537 -6.104 -9.314 1.00 . B B . 9 LYS HE3 1 1 9 9921 2 2 9 LYS HG2 H 1.626 -3.980 -6.377 1.00 . B B . 9 LYS HG2 1 1 9 9922 2 2 9 LYS HG3 H 3.199 -4.117 -7.165 1.00 . B B . 9 LYS HG3 1 1 9 9923 2 2 9 LYS HZ1 H 2.332 -5.406 -11.610 1.00 . B B . 9 LYS HZ1 1 1 9 9924 2 2 9 LYS HZ2 H 1.592 -3.959 -11.140 1.00 . B B . 9 LYS HZ2 1 1 9 9925 2 2 9 LYS HZ3 H 0.810 -5.435 -10.875 1.00 . B B . 9 LYS HZ3 1 1 9 9926 2 2 9 LYS N N 0.305 -5.806 -5.244 1.00 . B B . 9 LYS N 1 1 9 9927 2 2 9 LYS NZ N 1.733 -4.958 -10.887 1.00 . B B . 9 LYS NZ 1 1 9 9928 2 2 9 LYS O O 0.573 -8.467 -4.795 1.00 . B B . 9 LYS O 1 1 9 9929 2 2 10 ARG C C 2.629 -10.324 -4.662 1.00 . B B . 10 ARG C 1 1 9 9930 2 2 10 ARG CA C 2.283 -10.189 -6.143 1.00 . B B . 10 ARG CA 1 1 9 9931 2 2 10 ARG CB C 3.429 -10.733 -6.995 1.00 . B B . 10 ARG CB 1 1 9 9932 2 2 10 ARG CD C 5.822 -10.493 -7.724 1.00 . B B . 10 ARG CD 1 1 9 9933 2 2 10 ARG CG C 4.657 -9.836 -7.004 1.00 . B B . 10 ARG CG 1 1 9 9934 2 2 10 ARG CZ C 8.165 -9.979 -8.269 1.00 . B B . 10 ARG CZ 1 1 9 9935 2 2 10 ARG H H 2.440 -8.420 -7.288 1.00 . B B . 10 ARG H 1 1 9 9936 2 2 10 ARG HA H 1.393 -10.766 -6.346 1.00 . B B . 10 ARG HA 1 1 9 9937 2 2 10 ARG HB2 H 3.718 -11.700 -6.612 1.00 . B B . 10 ARG HB2 1 1 9 9938 2 2 10 ARG HB3 H 3.085 -10.846 -8.013 1.00 . B B . 10 ARG HB3 1 1 9 9939 2 2 10 ARG HD2 H 6.130 -11.364 -7.164 1.00 . B B . 10 ARG HD2 1 1 9 9940 2 2 10 ARG HD3 H 5.497 -10.795 -8.708 1.00 . B B . 10 ARG HD3 1 1 9 9941 2 2 10 ARG HE H 6.825 -8.648 -7.631 1.00 . B B . 10 ARG HE 1 1 9 9942 2 2 10 ARG HG2 H 4.411 -8.913 -7.505 1.00 . B B . 10 ARG HG2 1 1 9 9943 2 2 10 ARG HG3 H 4.945 -9.628 -5.983 1.00 . B B . 10 ARG HG3 1 1 9 9944 2 2 10 ARG HH11 H 7.646 -11.920 -8.493 1.00 . B B . 10 ARG HH11 1 1 9 9945 2 2 10 ARG HH12 H 9.290 -11.541 -8.884 1.00 . B B . 10 ARG HH12 1 1 9 9946 2 2 10 ARG HH21 H 8.987 -8.137 -8.144 1.00 . B B . 10 ARG HH21 1 1 9 9947 2 2 10 ARG HH22 H 10.053 -9.391 -8.685 1.00 . B B . 10 ARG HH22 1 1 9 9948 2 2 10 ARG N N 2.004 -8.801 -6.501 1.00 . B B . 10 ARG N 1 1 9 9949 2 2 10 ARG NE N 6.962 -9.591 -7.857 1.00 . B B . 10 ARG NE 1 1 9 9950 2 2 10 ARG NH1 N 8.385 -11.251 -8.573 1.00 . B B . 10 ARG NH1 1 1 9 9951 2 2 10 ARG NH2 N 9.149 -9.097 -8.375 1.00 . B B . 10 ARG NH2 1 1 9 9952 2 2 10 ARG O O 2.475 -11.397 -4.079 1.00 . B B . 10 ARG O 1 1 9 9953 2 2 11 LYS C C 4.877 -9.768 -2.450 1.00 . B B . 11 LYS C 1 1 9 9954 2 2 11 LYS CA C 3.469 -9.212 -2.645 1.00 . B B . 11 LYS CA 1 1 9 9955 2 2 11 LYS CB C 2.470 -10.009 -1.793 1.00 . B B . 11 LYS CB 1 1 9 9956 2 2 11 LYS CD C 0.704 -8.242 -2.106 1.00 . B B . 11 LYS CD 1 1 9 9957 2 2 11 LYS CE C 0.878 -7.654 -0.716 1.00 . B B . 11 LYS CE 1 1 9 9958 2 2 11 LYS CG C 1.011 -9.730 -2.124 1.00 . B B . 11 LYS CG 1 1 9 9959 2 2 11 LYS H H 3.214 -8.412 -4.586 1.00 . B B . 11 LYS H 1 1 9 9960 2 2 11 LYS HA H 3.461 -8.182 -2.319 1.00 . B B . 11 LYS HA 1 1 9 9961 2 2 11 LYS HB2 H 2.653 -11.064 -1.936 1.00 . B B . 11 LYS HB2 1 1 9 9962 2 2 11 LYS HB3 H 2.632 -9.766 -0.755 1.00 . B B . 11 LYS HB3 1 1 9 9963 2 2 11 LYS HD2 H 1.375 -7.737 -2.784 1.00 . B B . 11 LYS HD2 1 1 9 9964 2 2 11 LYS HD3 H -0.316 -8.090 -2.427 1.00 . B B . 11 LYS HD3 1 1 9 9965 2 2 11 LYS HE2 H 0.282 -8.226 -0.021 1.00 . B B . 11 LYS HE2 1 1 9 9966 2 2 11 LYS HE3 H 1.919 -7.722 -0.437 1.00 . B B . 11 LYS HE3 1 1 9 9967 2 2 11 LYS HG2 H 0.791 -10.120 -3.106 1.00 . B B . 11 LYS HG2 1 1 9 9968 2 2 11 LYS HG3 H 0.388 -10.224 -1.393 1.00 . B B . 11 LYS HG3 1 1 9 9969 2 2 11 LYS HZ1 H 0.685 -5.823 0.269 1.00 . B B . 11 LYS HZ1 1 1 9 9970 2 2 11 LYS HZ2 H -0.576 -6.157 -0.810 1.00 . B B . 11 LYS HZ2 1 1 9 9971 2 2 11 LYS HZ3 H 0.938 -5.682 -1.397 1.00 . B B . 11 LYS HZ3 1 1 9 9972 2 2 11 LYS N N 3.099 -9.230 -4.061 1.00 . B B . 11 LYS N 1 1 9 9973 2 2 11 LYS NZ N 0.451 -6.229 -0.659 1.00 . B B . 11 LYS NZ 1 1 9 9974 2 2 11 LYS O O 5.053 -10.944 -2.133 1.00 . B B . 11 LYS O 1 1 9 9975 2 2 12 ALA C C 7.490 -10.062 -1.183 1.00 . B B . 12 ALA C 1 1 9 9976 2 2 12 ALA CA C 7.270 -9.312 -2.493 1.00 . B B . 12 ALA CA 1 1 9 9977 2 2 12 ALA CB C 8.178 -8.094 -2.559 1.00 . B B . 12 ALA CB 1 1 9 9978 2 2 12 ALA H H 5.669 -7.988 -2.897 1.00 . B B . 12 ALA H 1 1 9 9979 2 2 12 ALA HA H 7.521 -9.964 -3.317 1.00 . B B . 12 ALA HA 1 1 9 9980 2 2 12 ALA HB1 H 7.934 -7.510 -3.434 1.00 . B B . 12 ALA HB1 1 1 9 9981 2 2 12 ALA HB2 H 9.208 -8.415 -2.615 1.00 . B B . 12 ALA HB2 1 1 9 9982 2 2 12 ALA HB3 H 8.036 -7.493 -1.674 1.00 . B B . 12 ALA HB3 1 1 9 9983 2 2 12 ALA N N 5.876 -8.912 -2.644 1.00 . B B . 12 ALA N 1 1 9 9984 2 2 12 ALA O O 8.355 -10.933 -1.093 1.00 . B B . 12 ALA O 1 1 9 9985 2 2 13 ASP C C 5.600 -11.247 1.403 1.00 . B B . 13 ASP C 1 1 9 9986 2 2 13 ASP CA C 6.810 -10.358 1.135 1.00 . B B . 13 ASP CA 1 1 9 9987 2 2 13 ASP CB C 6.939 -9.303 2.235 1.00 . B B . 13 ASP CB 1 1 9 9988 2 2 13 ASP CG C 7.025 -9.916 3.620 1.00 . B B . 13 ASP CG 1 1 9 9989 2 2 13 ASP H H 6.031 -9.015 -0.303 1.00 . B B . 13 ASP H 1 1 9 9990 2 2 13 ASP HA H 7.698 -10.972 1.130 1.00 . B B . 13 ASP HA 1 1 9 9991 2 2 13 ASP HB2 H 7.833 -8.721 2.064 1.00 . B B . 13 ASP HB2 1 1 9 9992 2 2 13 ASP HB3 H 6.079 -8.650 2.202 1.00 . B B . 13 ASP HB3 1 1 9 9993 2 2 13 ASP N N 6.701 -9.717 -0.171 1.00 . B B . 13 ASP N 1 1 9 9994 2 2 13 ASP O O 4.837 -11.007 2.339 1.00 . B B . 13 ASP O 1 1 9 9995 2 2 13 ASP OD1 O 8.124 -10.370 4.001 1.00 . B B . 13 ASP OD1 1 1 9 9996 2 2 13 ASP OD2 O 5.992 -9.943 4.321 1.00 . B B . 13 ASP OD2 1 1 9 9997 2 2 14 SER C C 4.556 -14.161 1.877 1.00 . B B . 14 SER C 1 1 9 9998 2 2 14 SER CA C 4.316 -13.198 0.720 1.00 . B B . 14 SER CA 1 1 9 9999 2 2 14 SER CB C 4.106 -13.981 -0.577 1.00 . B B . 14 SER CB 1 1 9 10000 2 2 14 SER H H 6.072 -12.407 -0.152 1.00 . B B . 14 SER H 1 1 9 10001 2 2 14 SER HA H 3.429 -12.618 0.928 1.00 . B B . 14 SER HA 1 1 9 10002 2 2 14 SER HB2 H 3.881 -13.292 -1.378 1.00 . B B . 14 SER HB2 1 1 9 10003 2 2 14 SER HB3 H 5.008 -14.526 -0.816 1.00 . B B . 14 SER HB3 1 1 9 10004 2 2 14 SER HG H 2.785 -15.221 -1.323 1.00 . B B . 14 SER HG 1 1 9 10005 2 2 14 SER N N 5.431 -12.271 0.575 1.00 . B B . 14 SER N 1 1 9 10006 2 2 14 SER O O 5.141 -15.239 1.637 1.00 . B B . 14 SER O 1 1 9 10007 2 2 14 SER OXT O 4.160 -13.830 3.015 1.00 . B B . 14 SER OXT 1 1 9 10008 2 2 14 SER OG O 3.036 -14.900 -0.453 1.00 . B B . 14 SER OG 1 1 10 10009 1 1 1 GLY C C 10.913 4.849 -5.771 1.00 . A A . 1 GLY C 1 1 10 10010 1 1 1 GLY CA C 10.288 3.632 -6.427 1.00 . A A . 1 GLY CA 1 1 10 10011 1 1 1 GLY H1 H 8.332 4.357 -6.306 1.00 . A A . 1 GLY H1 1 1 10 10012 1 1 1 GLY H2 H 8.730 3.254 -5.086 1.00 . A A . 1 GLY H2 1 1 10 10013 1 1 1 GLY H3 H 8.431 2.705 -6.657 1.00 . A A . 1 GLY H3 1 1 10 10014 1 1 1 GLY HA2 H 10.817 2.749 -6.099 1.00 . A A . 1 GLY HA2 1 1 10 10015 1 1 1 GLY HA3 H 10.391 3.722 -7.498 1.00 . A A . 1 GLY HA3 1 1 10 10016 1 1 1 GLY N N 8.844 3.477 -6.096 1.00 . A A . 1 GLY N 1 1 10 10017 1 1 1 GLY O O 11.878 5.412 -6.290 1.00 . A A . 1 GLY O 1 1 10 10018 1 1 2 SER C C 10.052 6.680 -2.650 1.00 . A A . 2 SER C 1 1 10 10019 1 1 2 SER CA C 10.880 6.413 -3.898 1.00 . A A . 2 SER CA 1 1 10 10020 1 1 2 SER CB C 10.888 7.648 -4.795 1.00 . A A . 2 SER CB 1 1 10 10021 1 1 2 SER H H 9.606 4.759 -4.261 1.00 . A A . 2 SER H 1 1 10 10022 1 1 2 SER HA H 11.891 6.195 -3.594 1.00 . A A . 2 SER HA 1 1 10 10023 1 1 2 SER HB2 H 11.285 8.485 -4.242 1.00 . A A . 2 SER HB2 1 1 10 10024 1 1 2 SER HB3 H 11.509 7.457 -5.656 1.00 . A A . 2 SER HB3 1 1 10 10025 1 1 2 SER HG H 9.616 8.737 -5.811 1.00 . A A . 2 SER HG 1 1 10 10026 1 1 2 SER N N 10.369 5.253 -4.627 1.00 . A A . 2 SER N 1 1 10 10027 1 1 2 SER O O 10.579 7.116 -1.626 1.00 . A A . 2 SER O 1 1 10 10028 1 1 2 SER OG O 9.580 7.970 -5.236 1.00 . A A . 2 SER OG 1 1 10 10029 1 1 3 GLN C C 7.815 5.347 -0.775 1.00 . A A . 3 GLN C 1 1 10 10030 1 1 3 GLN CA C 7.867 6.616 -1.607 1.00 . A A . 3 GLN CA 1 1 10 10031 1 1 3 GLN CB C 6.472 6.997 -2.083 1.00 . A A . 3 GLN CB 1 1 10 10032 1 1 3 GLN CD C 5.006 8.729 -3.199 1.00 . A A . 3 GLN CD 1 1 10 10033 1 1 3 GLN CG C 6.408 8.361 -2.748 1.00 . A A . 3 GLN CG 1 1 10 10034 1 1 3 GLN H H 8.387 6.089 -3.582 1.00 . A A . 3 GLN H 1 1 10 10035 1 1 3 GLN HA H 8.261 7.414 -1.009 1.00 . A A . 3 GLN HA 1 1 10 10036 1 1 3 GLN HB2 H 6.145 6.261 -2.790 1.00 . A A . 3 GLN HB2 1 1 10 10037 1 1 3 GLN HB3 H 5.799 6.998 -1.238 1.00 . A A . 3 GLN HB3 1 1 10 10038 1 1 3 GLN HE21 H 5.337 7.908 -4.978 1.00 . A A . 3 GLN HE21 1 1 10 10039 1 1 3 GLN HE22 H 3.773 8.605 -4.752 1.00 . A A . 3 GLN HE22 1 1 10 10040 1 1 3 GLN HG2 H 6.749 9.106 -2.045 1.00 . A A . 3 GLN HG2 1 1 10 10041 1 1 3 GLN HG3 H 7.057 8.357 -3.611 1.00 . A A . 3 GLN HG3 1 1 10 10042 1 1 3 GLN N N 8.755 6.420 -2.738 1.00 . A A . 3 GLN N 1 1 10 10043 1 1 3 GLN NE2 N 4.672 8.378 -4.435 1.00 . A A . 3 GLN NE2 1 1 10 10044 1 1 3 GLN O O 7.781 4.243 -1.317 1.00 . A A . 3 GLN O 1 1 10 10045 1 1 3 GLN OE1 O 4.236 9.324 -2.445 1.00 . A A . 3 GLN OE1 1 1 10 10046 1 1 4 VAL C C 6.353 3.963 1.742 1.00 . A A . 4 VAL C 1 1 10 10047 1 1 4 VAL CA C 7.786 4.355 1.430 1.00 . A A . 4 VAL CA 1 1 10 10048 1 1 4 VAL CB C 8.536 4.634 2.748 1.00 . A A . 4 VAL CB 1 1 10 10049 1 1 4 VAL CG1 C 9.021 3.334 3.370 1.00 . A A . 4 VAL CG1 1 1 10 10050 1 1 4 VAL CG2 C 9.700 5.591 2.524 1.00 . A A . 4 VAL CG2 1 1 10 10051 1 1 4 VAL H H 7.818 6.402 0.917 1.00 . A A . 4 VAL H 1 1 10 10052 1 1 4 VAL HA H 8.272 3.532 0.929 1.00 . A A . 4 VAL HA 1 1 10 10053 1 1 4 VAL HB H 7.848 5.096 3.437 1.00 . A A . 4 VAL HB 1 1 10 10054 1 1 4 VAL HG11 H 8.176 2.695 3.569 1.00 . A A . 4 VAL HG11 1 1 10 10055 1 1 4 VAL HG12 H 9.538 3.547 4.294 1.00 . A A . 4 VAL HG12 1 1 10 10056 1 1 4 VAL HG13 H 9.695 2.839 2.687 1.00 . A A . 4 VAL HG13 1 1 10 10057 1 1 4 VAL HG21 H 10.281 5.255 1.678 1.00 . A A . 4 VAL HG21 1 1 10 10058 1 1 4 VAL HG22 H 10.324 5.613 3.404 1.00 . A A . 4 VAL HG22 1 1 10 10059 1 1 4 VAL HG23 H 9.318 6.581 2.328 1.00 . A A . 4 VAL HG23 1 1 10 10060 1 1 4 VAL N N 7.813 5.501 0.538 1.00 . A A . 4 VAL N 1 1 10 10061 1 1 4 VAL O O 5.977 3.806 2.904 1.00 . A A . 4 VAL O 1 1 10 10062 1 1 5 PHE C C 3.449 3.376 -0.502 1.00 . A A . 5 PHE C 1 1 10 10063 1 1 5 PHE CA C 4.159 3.430 0.853 1.00 . A A . 5 PHE CA 1 1 10 10064 1 1 5 PHE CB C 3.458 4.436 1.762 1.00 . A A . 5 PHE CB 1 1 10 10065 1 1 5 PHE CD1 C 3.068 6.341 0.172 1.00 . A A . 5 PHE CD1 1 1 10 10066 1 1 5 PHE CD2 C 4.417 6.730 2.099 1.00 . A A . 5 PHE CD2 1 1 10 10067 1 1 5 PHE CE1 C 3.246 7.653 -0.222 1.00 . A A . 5 PHE CE1 1 1 10 10068 1 1 5 PHE CE2 C 4.600 8.043 1.711 1.00 . A A . 5 PHE CE2 1 1 10 10069 1 1 5 PHE CG C 3.650 5.865 1.335 1.00 . A A . 5 PHE CG 1 1 10 10070 1 1 5 PHE CZ C 4.013 8.506 0.549 1.00 . A A . 5 PHE CZ 1 1 10 10071 1 1 5 PHE H H 5.910 3.952 -0.207 1.00 . A A . 5 PHE H 1 1 10 10072 1 1 5 PHE HA H 4.131 2.446 1.319 1.00 . A A . 5 PHE HA 1 1 10 10073 1 1 5 PHE HB2 H 2.402 4.231 1.767 1.00 . A A . 5 PHE HB2 1 1 10 10074 1 1 5 PHE HB3 H 3.846 4.334 2.761 1.00 . A A . 5 PHE HB3 1 1 10 10075 1 1 5 PHE HD1 H 2.468 5.676 -0.430 1.00 . A A . 5 PHE HD1 1 1 10 10076 1 1 5 PHE HD2 H 4.876 6.369 3.008 1.00 . A A . 5 PHE HD2 1 1 10 10077 1 1 5 PHE HE1 H 2.787 8.013 -1.131 1.00 . A A . 5 PHE HE1 1 1 10 10078 1 1 5 PHE HE2 H 5.200 8.708 2.315 1.00 . A A . 5 PHE HE2 1 1 10 10079 1 1 5 PHE HZ H 4.155 9.533 0.243 1.00 . A A . 5 PHE HZ 1 1 10 10080 1 1 5 PHE N N 5.553 3.810 0.694 1.00 . A A . 5 PHE N 1 1 10 10081 1 1 5 PHE O O 3.735 4.174 -1.395 1.00 . A A . 5 PHE O 1 1 10 10082 1 1 6 GLU C C 0.263 2.230 -1.596 1.00 . A A . 6 GLU C 1 1 10 10083 1 1 6 GLU CA C 1.766 2.275 -1.886 1.00 . A A . 6 GLU CA 1 1 10 10084 1 1 6 GLU CB C 2.200 1.005 -2.623 1.00 . A A . 6 GLU CB 1 1 10 10085 1 1 6 GLU CD C 1.506 1.968 -4.853 1.00 . A A . 6 GLU CD 1 1 10 10086 1 1 6 GLU CG C 1.448 0.771 -3.923 1.00 . A A . 6 GLU CG 1 1 10 10087 1 1 6 GLU H H 2.365 1.812 0.092 1.00 . A A . 6 GLU H 1 1 10 10088 1 1 6 GLU HA H 1.972 3.131 -2.509 1.00 . A A . 6 GLU HA 1 1 10 10089 1 1 6 GLU HB2 H 3.254 1.081 -2.851 1.00 . A A . 6 GLU HB2 1 1 10 10090 1 1 6 GLU HB3 H 2.042 0.151 -1.977 1.00 . A A . 6 GLU HB3 1 1 10 10091 1 1 6 GLU HG2 H 1.885 -0.077 -4.429 1.00 . A A . 6 GLU HG2 1 1 10 10092 1 1 6 GLU HG3 H 0.414 0.559 -3.694 1.00 . A A . 6 GLU HG3 1 1 10 10093 1 1 6 GLU N N 2.528 2.429 -0.647 1.00 . A A . 6 GLU N 1 1 10 10094 1 1 6 GLU O O -0.168 1.643 -0.606 1.00 . A A . 6 GLU O 1 1 10 10095 1 1 6 GLU OE1 O 2.509 2.102 -5.585 1.00 . A A . 6 GLU OE1 1 1 10 10096 1 1 6 GLU OE2 O 0.549 2.771 -4.846 1.00 . A A . 6 GLU OE2 1 1 10 10097 1 1 7 TYR C C -2.668 1.683 -2.904 1.00 . A A . 7 TYR C 1 1 10 10098 1 1 7 TYR CA C -1.977 2.880 -2.281 1.00 . A A . 7 TYR CA 1 1 10 10099 1 1 7 TYR CB C -2.538 4.179 -2.853 1.00 . A A . 7 TYR CB 1 1 10 10100 1 1 7 TYR CD1 C -3.139 3.851 -5.285 1.00 . A A . 7 TYR CD1 1 1 10 10101 1 1 7 TYR CD2 C -1.146 5.051 -4.769 1.00 . A A . 7 TYR CD2 1 1 10 10102 1 1 7 TYR CE1 C -2.894 4.018 -6.636 1.00 . A A . 7 TYR CE1 1 1 10 10103 1 1 7 TYR CE2 C -0.894 5.224 -6.115 1.00 . A A . 7 TYR CE2 1 1 10 10104 1 1 7 TYR CG C -2.269 4.363 -4.330 1.00 . A A . 7 TYR CG 1 1 10 10105 1 1 7 TYR CZ C -1.770 4.704 -7.045 1.00 . A A . 7 TYR CZ 1 1 10 10106 1 1 7 TYR H H -0.153 3.282 -3.250 1.00 . A A . 7 TYR H 1 1 10 10107 1 1 7 TYR HA H -2.176 2.855 -1.228 1.00 . A A . 7 TYR HA 1 1 10 10108 1 1 7 TYR HB2 H -3.600 4.194 -2.704 1.00 . A A . 7 TYR HB2 1 1 10 10109 1 1 7 TYR HB3 H -2.095 5.013 -2.330 1.00 . A A . 7 TYR HB3 1 1 10 10110 1 1 7 TYR HD1 H -4.017 3.314 -4.961 1.00 . A A . 7 TYR HD1 1 1 10 10111 1 1 7 TYR HD2 H -0.460 5.456 -4.038 1.00 . A A . 7 TYR HD2 1 1 10 10112 1 1 7 TYR HE1 H -3.581 3.612 -7.363 1.00 . A A . 7 TYR HE1 1 1 10 10113 1 1 7 TYR HE2 H -0.014 5.762 -6.436 1.00 . A A . 7 TYR HE2 1 1 10 10114 1 1 7 TYR HH H -2.337 5.107 -8.838 1.00 . A A . 7 TYR HH 1 1 10 10115 1 1 7 TYR N N -0.536 2.840 -2.470 1.00 . A A . 7 TYR N 1 1 10 10116 1 1 7 TYR O O -2.666 1.496 -4.121 1.00 . A A . 7 TYR O 1 1 10 10117 1 1 7 TYR OH O -1.522 4.873 -8.388 1.00 . A A . 7 TYR OH 1 1 10 10118 1 1 8 ALA C C -5.474 -0.037 -2.409 1.00 . A A . 8 ALA C 1 1 10 10119 1 1 8 ALA CA C -3.979 -0.312 -2.452 1.00 . A A . 8 ALA CA 1 1 10 10120 1 1 8 ALA CB C -3.628 -1.474 -1.540 1.00 . A A . 8 ALA CB 1 1 10 10121 1 1 8 ALA H H -3.192 1.078 -1.075 1.00 . A A . 8 ALA H 1 1 10 10122 1 1 8 ALA HA H -3.686 -0.561 -3.461 1.00 . A A . 8 ALA HA 1 1 10 10123 1 1 8 ALA HB1 H -2.579 -1.698 -1.636 1.00 . A A . 8 ALA HB1 1 1 10 10124 1 1 8 ALA HB2 H -4.210 -2.341 -1.813 1.00 . A A . 8 ALA HB2 1 1 10 10125 1 1 8 ALA HB3 H -3.842 -1.202 -0.516 1.00 . A A . 8 ALA HB3 1 1 10 10126 1 1 8 ALA N N -3.254 0.872 -2.036 1.00 . A A . 8 ALA N 1 1 10 10127 1 1 8 ALA O O -6.226 -0.747 -1.745 1.00 . A A . 8 ALA O 1 1 10 10128 1 1 9 GLU C C -7.883 1.339 -4.508 1.00 . A A . 9 GLU C 1 1 10 10129 1 1 9 GLU CA C -7.292 1.391 -3.126 1.00 . A A . 9 GLU CA 1 1 10 10130 1 1 9 GLU CB C -7.440 2.773 -2.489 1.00 . A A . 9 GLU CB 1 1 10 10131 1 1 9 GLU CD C -6.239 4.102 -4.284 1.00 . A A . 9 GLU CD 1 1 10 10132 1 1 9 GLU CG C -7.501 3.947 -3.458 1.00 . A A . 9 GLU CG 1 1 10 10133 1 1 9 GLU H H -5.258 1.541 -3.627 1.00 . A A . 9 GLU H 1 1 10 10134 1 1 9 GLU HA H -7.835 0.684 -2.534 1.00 . A A . 9 GLU HA 1 1 10 10135 1 1 9 GLU HB2 H -8.333 2.791 -1.898 1.00 . A A . 9 GLU HB2 1 1 10 10136 1 1 9 GLU HB3 H -6.597 2.921 -1.840 1.00 . A A . 9 GLU HB3 1 1 10 10137 1 1 9 GLU HG2 H -8.333 3.797 -4.125 1.00 . A A . 9 GLU HG2 1 1 10 10138 1 1 9 GLU HG3 H -7.658 4.850 -2.892 1.00 . A A . 9 GLU HG3 1 1 10 10139 1 1 9 GLU N N -5.898 1.010 -3.113 1.00 . A A . 9 GLU N 1 1 10 10140 1 1 9 GLU O O -7.174 1.284 -5.513 1.00 . A A . 9 GLU O 1 1 10 10141 1 1 9 GLU OE1 O -6.159 3.483 -5.366 1.00 . A A . 9 GLU OE1 1 1 10 10142 1 1 9 GLU OE2 O -5.335 4.844 -3.851 1.00 . A A . 9 GLU OE2 1 1 10 10143 1 1 10 VAL C C -10.368 2.649 -6.266 1.00 . A A . 10 VAL C 1 1 10 10144 1 1 10 VAL CA C -9.907 1.283 -5.779 1.00 . A A . 10 VAL CA 1 1 10 10145 1 1 10 VAL CB C -11.075 0.299 -5.674 1.00 . A A . 10 VAL CB 1 1 10 10146 1 1 10 VAL CG1 C -11.693 0.040 -7.038 1.00 . A A . 10 VAL CG1 1 1 10 10147 1 1 10 VAL CG2 C -10.597 -0.997 -5.033 1.00 . A A . 10 VAL CG2 1 1 10 10148 1 1 10 VAL H H -9.702 1.409 -3.697 1.00 . A A . 10 VAL H 1 1 10 10149 1 1 10 VAL HA H -9.228 0.900 -6.483 1.00 . A A . 10 VAL HA 1 1 10 10150 1 1 10 VAL HB H -11.816 0.729 -5.036 1.00 . A A . 10 VAL HB 1 1 10 10151 1 1 10 VAL HG11 H -12.695 -0.341 -6.914 1.00 . A A . 10 VAL HG11 1 1 10 10152 1 1 10 VAL HG12 H -11.096 -0.686 -7.571 1.00 . A A . 10 VAL HG12 1 1 10 10153 1 1 10 VAL HG13 H -11.724 0.959 -7.601 1.00 . A A . 10 VAL HG13 1 1 10 10154 1 1 10 VAL HG21 H -9.637 -1.269 -5.445 1.00 . A A . 10 VAL HG21 1 1 10 10155 1 1 10 VAL HG22 H -11.309 -1.783 -5.231 1.00 . A A . 10 VAL HG22 1 1 10 10156 1 1 10 VAL HG23 H -10.503 -0.856 -3.965 1.00 . A A . 10 VAL HG23 1 1 10 10157 1 1 10 VAL N N -9.200 1.355 -4.538 1.00 . A A . 10 VAL N 1 1 10 10158 1 1 10 VAL O O -10.641 2.831 -7.452 1.00 . A A . 10 VAL O 1 1 10 10159 1 1 11 ASP C C -10.185 6.025 -4.855 1.00 . A A . 11 ASP C 1 1 10 10160 1 1 11 ASP CA C -10.842 4.962 -5.731 1.00 . A A . 11 ASP CA 1 1 10 10161 1 1 11 ASP CB C -12.362 5.094 -5.627 1.00 . A A . 11 ASP CB 1 1 10 10162 1 1 11 ASP CG C -12.852 6.472 -6.031 1.00 . A A . 11 ASP CG 1 1 10 10163 1 1 11 ASP H H -10.195 3.417 -4.433 1.00 . A A . 11 ASP H 1 1 10 10164 1 1 11 ASP HA H -10.548 5.129 -6.756 1.00 . A A . 11 ASP HA 1 1 10 10165 1 1 11 ASP HB2 H -12.828 4.366 -6.271 1.00 . A A . 11 ASP HB2 1 1 10 10166 1 1 11 ASP HB3 H -12.663 4.910 -4.607 1.00 . A A . 11 ASP HB3 1 1 10 10167 1 1 11 ASP N N -10.426 3.616 -5.362 1.00 . A A . 11 ASP N 1 1 10 10168 1 1 11 ASP O O -9.732 7.057 -5.351 1.00 . A A . 11 ASP O 1 1 10 10169 1 1 11 ASP OD1 O -12.857 6.769 -7.243 1.00 . A A . 11 ASP OD1 1 1 10 10170 1 1 11 ASP OD2 O -13.234 7.251 -5.133 1.00 . A A . 11 ASP OD2 1 1 10 10171 1 1 12 GLU C C -9.034 6.072 -1.356 1.00 . A A . 12 GLU C 1 1 10 10172 1 1 12 GLU CA C -9.572 6.743 -2.611 1.00 . A A . 12 GLU CA 1 1 10 10173 1 1 12 GLU CB C -10.640 7.764 -2.228 1.00 . A A . 12 GLU CB 1 1 10 10174 1 1 12 GLU CD C -12.090 9.702 -2.949 1.00 . A A . 12 GLU CD 1 1 10 10175 1 1 12 GLU CG C -11.049 8.683 -3.368 1.00 . A A . 12 GLU CG 1 1 10 10176 1 1 12 GLU H H -10.417 4.883 -3.229 1.00 . A A . 12 GLU H 1 1 10 10177 1 1 12 GLU HA H -8.759 7.252 -3.105 1.00 . A A . 12 GLU HA 1 1 10 10178 1 1 12 GLU HB2 H -11.520 7.233 -1.891 1.00 . A A . 12 GLU HB2 1 1 10 10179 1 1 12 GLU HB3 H -10.266 8.371 -1.419 1.00 . A A . 12 GLU HB3 1 1 10 10180 1 1 12 GLU HG2 H -10.174 9.210 -3.721 1.00 . A A . 12 GLU HG2 1 1 10 10181 1 1 12 GLU HG3 H -11.454 8.083 -4.170 1.00 . A A . 12 GLU HG3 1 1 10 10182 1 1 12 GLU N N -10.132 5.768 -3.554 1.00 . A A . 12 GLU N 1 1 10 10183 1 1 12 GLU O O -9.314 4.912 -1.107 1.00 . A A . 12 GLU O 1 1 10 10184 1 1 12 GLU OE1 O -13.295 9.382 -3.016 1.00 . A A . 12 GLU OE1 1 1 10 10185 1 1 12 GLU OE2 O -11.699 10.820 -2.552 1.00 . A A . 12 GLU OE2 1 1 10 10186 1 1 13 ILE C C -7.776 7.301 1.801 1.00 . A A . 13 ILE C 1 1 10 10187 1 1 13 ILE CA C -7.703 6.262 0.675 1.00 . A A . 13 ILE CA 1 1 10 10188 1 1 13 ILE CB C -6.233 5.804 0.479 1.00 . A A . 13 ILE CB 1 1 10 10189 1 1 13 ILE CD1 C -5.569 7.846 -0.872 1.00 . A A . 13 ILE CD1 1 1 10 10190 1 1 13 ILE CG1 C -5.294 7.006 0.356 1.00 . A A . 13 ILE CG1 1 1 10 10191 1 1 13 ILE CG2 C -6.137 4.956 -0.769 1.00 . A A . 13 ILE CG2 1 1 10 10192 1 1 13 ILE H H -8.062 7.733 -0.812 1.00 . A A . 13 ILE H 1 1 10 10193 1 1 13 ILE HA H -8.295 5.393 0.948 1.00 . A A . 13 ILE HA 1 1 10 10194 1 1 13 ILE HB H -5.933 5.190 1.324 1.00 . A A . 13 ILE HB 1 1 10 10195 1 1 13 ILE HD11 H -4.662 8.347 -1.178 1.00 . A A . 13 ILE HD11 1 1 10 10196 1 1 13 ILE HD12 H -6.327 8.579 -0.643 1.00 . A A . 13 ILE HD12 1 1 10 10197 1 1 13 ILE HD13 H -5.917 7.207 -1.671 1.00 . A A . 13 ILE HD13 1 1 10 10198 1 1 13 ILE HG12 H -5.408 7.637 1.225 1.00 . A A . 13 ILE HG12 1 1 10 10199 1 1 13 ILE HG13 H -4.274 6.656 0.299 1.00 . A A . 13 ILE HG13 1 1 10 10200 1 1 13 ILE HG21 H -5.654 5.519 -1.554 1.00 . A A . 13 ILE HG21 1 1 10 10201 1 1 13 ILE HG22 H -7.122 4.681 -1.081 1.00 . A A . 13 ILE HG22 1 1 10 10202 1 1 13 ILE HG23 H -5.566 4.066 -0.559 1.00 . A A . 13 ILE HG23 1 1 10 10203 1 1 13 ILE N N -8.262 6.807 -0.562 1.00 . A A . 13 ILE N 1 1 10 10204 1 1 13 ILE O O -8.391 8.357 1.639 1.00 . A A . 13 ILE O 1 1 10 10205 1 1 14 VAL C C -5.816 7.802 4.820 1.00 . A A . 14 VAL C 1 1 10 10206 1 1 14 VAL CA C -7.138 7.914 4.075 1.00 . A A . 14 VAL CA 1 1 10 10207 1 1 14 VAL CB C -8.307 7.634 5.047 1.00 . A A . 14 VAL CB 1 1 10 10208 1 1 14 VAL CG1 C -8.201 8.497 6.298 1.00 . A A . 14 VAL CG1 1 1 10 10209 1 1 14 VAL CG2 C -9.641 7.868 4.354 1.00 . A A . 14 VAL CG2 1 1 10 10210 1 1 14 VAL H H -6.675 6.146 3.004 1.00 . A A . 14 VAL H 1 1 10 10211 1 1 14 VAL HA H -7.240 8.918 3.698 1.00 . A A . 14 VAL HA 1 1 10 10212 1 1 14 VAL HB H -8.260 6.597 5.347 1.00 . A A . 14 VAL HB 1 1 10 10213 1 1 14 VAL HG11 H -9.012 8.258 6.971 1.00 . A A . 14 VAL HG11 1 1 10 10214 1 1 14 VAL HG12 H -8.259 9.540 6.023 1.00 . A A . 14 VAL HG12 1 1 10 10215 1 1 14 VAL HG13 H -7.258 8.306 6.789 1.00 . A A . 14 VAL HG13 1 1 10 10216 1 1 14 VAL HG21 H -9.712 7.232 3.488 1.00 . A A . 14 VAL HG21 1 1 10 10217 1 1 14 VAL HG22 H -9.710 8.902 4.048 1.00 . A A . 14 VAL HG22 1 1 10 10218 1 1 14 VAL HG23 H -10.446 7.640 5.037 1.00 . A A . 14 VAL HG23 1 1 10 10219 1 1 14 VAL N N -7.149 7.001 2.934 1.00 . A A . 14 VAL N 1 1 10 10220 1 1 14 VAL O O -5.074 8.776 4.943 1.00 . A A . 14 VAL O 1 1 10 10221 1 1 15 GLU C C -3.232 5.822 5.072 1.00 . A A . 15 GLU C 1 1 10 10222 1 1 15 GLU CA C -4.282 6.369 6.034 1.00 . A A . 15 GLU CA 1 1 10 10223 1 1 15 GLU CB C -4.490 5.403 7.207 1.00 . A A . 15 GLU CB 1 1 10 10224 1 1 15 GLU CD C -6.373 3.856 6.531 1.00 . A A . 15 GLU CD 1 1 10 10225 1 1 15 GLU CG C -4.887 3.997 6.792 1.00 . A A . 15 GLU CG 1 1 10 10226 1 1 15 GLU H H -6.172 5.871 5.194 1.00 . A A . 15 GLU H 1 1 10 10227 1 1 15 GLU HA H -3.937 7.319 6.416 1.00 . A A . 15 GLU HA 1 1 10 10228 1 1 15 GLU HB2 H -3.571 5.340 7.771 1.00 . A A . 15 GLU HB2 1 1 10 10229 1 1 15 GLU HB3 H -5.265 5.798 7.848 1.00 . A A . 15 GLU HB3 1 1 10 10230 1 1 15 GLU HG2 H -4.358 3.742 5.890 1.00 . A A . 15 GLU HG2 1 1 10 10231 1 1 15 GLU HG3 H -4.609 3.310 7.579 1.00 . A A . 15 GLU HG3 1 1 10 10232 1 1 15 GLU N N -5.530 6.607 5.317 1.00 . A A . 15 GLU N 1 1 10 10233 1 1 15 GLU O O -3.532 4.972 4.247 1.00 . A A . 15 GLU O 1 1 10 10234 1 1 15 GLU OE1 O -7.166 4.169 7.443 1.00 . A A . 15 GLU OE1 1 1 10 10235 1 1 15 GLU OE2 O -6.743 3.433 5.416 1.00 . A A . 15 GLU OE2 1 1 10 10236 1 1 16 LYS C C 0.439 5.981 4.933 1.00 . A A . 16 LYS C 1 1 10 10237 1 1 16 LYS CA C -0.939 5.880 4.270 1.00 . A A . 16 LYS CA 1 1 10 10238 1 1 16 LYS CB C -0.949 6.742 3.013 1.00 . A A . 16 LYS CB 1 1 10 10239 1 1 16 LYS CD C -0.875 9.060 2.045 1.00 . A A . 16 LYS CD 1 1 10 10240 1 1 16 LYS CE C -0.947 10.547 2.346 1.00 . A A . 16 LYS CE 1 1 10 10241 1 1 16 LYS CG C -1.092 8.228 3.298 1.00 . A A . 16 LYS CG 1 1 10 10242 1 1 16 LYS H H -1.816 6.996 5.849 1.00 . A A . 16 LYS H 1 1 10 10243 1 1 16 LYS HA H -1.139 4.847 3.994 1.00 . A A . 16 LYS HA 1 1 10 10244 1 1 16 LYS HB2 H -0.022 6.591 2.481 1.00 . A A . 16 LYS HB2 1 1 10 10245 1 1 16 LYS HB3 H -1.772 6.436 2.384 1.00 . A A . 16 LYS HB3 1 1 10 10246 1 1 16 LYS HD2 H 0.099 8.832 1.638 1.00 . A A . 16 LYS HD2 1 1 10 10247 1 1 16 LYS HD3 H -1.638 8.810 1.321 1.00 . A A . 16 LYS HD3 1 1 10 10248 1 1 16 LYS HE2 H -1.944 10.785 2.685 1.00 . A A . 16 LYS HE2 1 1 10 10249 1 1 16 LYS HE3 H -0.237 10.779 3.127 1.00 . A A . 16 LYS HE3 1 1 10 10250 1 1 16 LYS HG2 H -2.087 8.416 3.675 1.00 . A A . 16 LYS HG2 1 1 10 10251 1 1 16 LYS HG3 H -0.363 8.513 4.041 1.00 . A A . 16 LYS HG3 1 1 10 10252 1 1 16 LYS HZ1 H -1.335 11.195 0.398 1.00 . A A . 16 LYS HZ1 1 1 10 10253 1 1 16 LYS HZ2 H 0.312 11.132 0.785 1.00 . A A . 16 LYS HZ2 1 1 10 10254 1 1 16 LYS HZ3 H -0.653 12.382 1.391 1.00 . A A . 16 LYS HZ3 1 1 10 10255 1 1 16 LYS N N -2.007 6.322 5.167 1.00 . A A . 16 LYS N 1 1 10 10256 1 1 16 LYS NZ N -0.634 11.371 1.146 1.00 . A A . 16 LYS NZ 1 1 10 10257 1 1 16 LYS O O 1.065 7.041 4.910 1.00 . A A . 16 LYS O 1 1 10 10258 1 1 17 ARG C C 2.796 3.481 6.261 1.00 . A A . 17 ARG C 1 1 10 10259 1 1 17 ARG CA C 2.214 4.887 6.194 1.00 . A A . 17 ARG CA 1 1 10 10260 1 1 17 ARG CB C 2.084 5.470 7.600 1.00 . A A . 17 ARG CB 1 1 10 10261 1 1 17 ARG CD C 1.698 7.496 9.030 1.00 . A A . 17 ARG CD 1 1 10 10262 1 1 17 ARG CG C 1.811 6.963 7.613 1.00 . A A . 17 ARG CG 1 1 10 10263 1 1 17 ARG CZ C 3.023 7.518 11.102 1.00 . A A . 17 ARG CZ 1 1 10 10264 1 1 17 ARG H H 0.406 4.046 5.453 1.00 . A A . 17 ARG H 1 1 10 10265 1 1 17 ARG HA H 2.882 5.509 5.619 1.00 . A A . 17 ARG HA 1 1 10 10266 1 1 17 ARG HB2 H 1.269 4.974 8.108 1.00 . A A . 17 ARG HB2 1 1 10 10267 1 1 17 ARG HB3 H 3.000 5.288 8.142 1.00 . A A . 17 ARG HB3 1 1 10 10268 1 1 17 ARG HD2 H 1.503 8.557 8.987 1.00 . A A . 17 ARG HD2 1 1 10 10269 1 1 17 ARG HD3 H 0.876 7.000 9.522 1.00 . A A . 17 ARG HD3 1 1 10 10270 1 1 17 ARG HE H 3.698 6.917 9.323 1.00 . A A . 17 ARG HE 1 1 10 10271 1 1 17 ARG HG2 H 2.620 7.472 7.110 1.00 . A A . 17 ARG HG2 1 1 10 10272 1 1 17 ARG HG3 H 0.884 7.154 7.091 1.00 . A A . 17 ARG HG3 1 1 10 10273 1 1 17 ARG HH11 H 1.125 8.183 11.299 1.00 . A A . 17 ARG HH11 1 1 10 10274 1 1 17 ARG HH12 H 2.068 8.186 12.751 1.00 . A A . 17 ARG HH12 1 1 10 10275 1 1 17 ARG HH21 H 4.948 6.917 11.231 1.00 . A A . 17 ARG HH21 1 1 10 10276 1 1 17 ARG HH22 H 4.241 7.469 12.712 1.00 . A A . 17 ARG HH22 1 1 10 10277 1 1 17 ARG N N 0.912 4.886 5.522 1.00 . A A . 17 ARG N 1 1 10 10278 1 1 17 ARG NE N 2.918 7.271 9.799 1.00 . A A . 17 ARG NE 1 1 10 10279 1 1 17 ARG NH1 N 1.987 8.002 11.772 1.00 . A A . 17 ARG NH1 1 1 10 10280 1 1 17 ARG NH2 N 4.165 7.281 11.733 1.00 . A A . 17 ARG NH2 1 1 10 10281 1 1 17 ARG O O 2.511 2.740 7.202 1.00 . A A . 17 ARG O 1 1 10 10282 1 1 18 GLY C C 5.482 1.606 4.601 1.00 . A A . 18 GLY C 1 1 10 10283 1 1 18 GLY CA C 4.154 1.760 5.302 1.00 . A A . 18 GLY CA 1 1 10 10284 1 1 18 GLY H H 3.848 3.727 4.564 1.00 . A A . 18 GLY H 1 1 10 10285 1 1 18 GLY HA2 H 4.272 1.453 6.329 1.00 . A A . 18 GLY HA2 1 1 10 10286 1 1 18 GLY HA3 H 3.447 1.106 4.829 1.00 . A A . 18 GLY HA3 1 1 10 10287 1 1 18 GLY N N 3.608 3.101 5.281 1.00 . A A . 18 GLY N 1 1 10 10288 1 1 18 GLY O O 6.416 2.379 4.810 1.00 . A A . 18 GLY O 1 1 10 10289 1 1 19 LYS C C 6.408 0.358 1.514 1.00 . A A . 19 LYS C 1 1 10 10290 1 1 19 LYS CA C 6.720 0.231 3.007 1.00 . A A . 19 LYS CA 1 1 10 10291 1 1 19 LYS CB C 7.113 -1.183 3.393 1.00 . A A . 19 LYS CB 1 1 10 10292 1 1 19 LYS CD C 7.995 -2.710 5.139 1.00 . A A . 19 LYS CD 1 1 10 10293 1 1 19 LYS CE C 8.613 -2.817 6.524 1.00 . A A . 19 LYS CE 1 1 10 10294 1 1 19 LYS CG C 7.620 -1.287 4.813 1.00 . A A . 19 LYS CG 1 1 10 10295 1 1 19 LYS H H 4.753 -0.001 3.669 1.00 . A A . 19 LYS H 1 1 10 10296 1 1 19 LYS HA H 7.508 0.904 3.272 1.00 . A A . 19 LYS HA 1 1 10 10297 1 1 19 LYS HB2 H 6.237 -1.811 3.294 1.00 . A A . 19 LYS HB2 1 1 10 10298 1 1 19 LYS HB3 H 7.882 -1.541 2.730 1.00 . A A . 19 LYS HB3 1 1 10 10299 1 1 19 LYS HD2 H 7.103 -3.314 5.097 1.00 . A A . 19 LYS HD2 1 1 10 10300 1 1 19 LYS HD3 H 8.702 -3.057 4.400 1.00 . A A . 19 LYS HD3 1 1 10 10301 1 1 19 LYS HE2 H 9.495 -2.195 6.559 1.00 . A A . 19 LYS HE2 1 1 10 10302 1 1 19 LYS HE3 H 7.897 -2.463 7.252 1.00 . A A . 19 LYS HE3 1 1 10 10303 1 1 19 LYS HG2 H 8.490 -0.659 4.924 1.00 . A A . 19 LYS HG2 1 1 10 10304 1 1 19 LYS HG3 H 6.845 -0.962 5.490 1.00 . A A . 19 LYS HG3 1 1 10 10305 1 1 19 LYS HZ1 H 9.679 -4.574 6.164 1.00 . A A . 19 LYS HZ1 1 1 10 10306 1 1 19 LYS HZ2 H 8.154 -4.825 6.854 1.00 . A A . 19 LYS HZ2 1 1 10 10307 1 1 19 LYS HZ3 H 9.428 -4.249 7.805 1.00 . A A . 19 LYS HZ3 1 1 10 10308 1 1 19 LYS N N 5.542 0.571 3.770 1.00 . A A . 19 LYS N 1 1 10 10309 1 1 19 LYS NZ N 8.995 -4.215 6.860 1.00 . A A . 19 LYS NZ 1 1 10 10310 1 1 19 LYS O O 6.001 1.415 1.062 1.00 . A A . 19 LYS O 1 1 10 10311 1 1 20 GLY C C 4.868 -1.161 -0.822 1.00 . A A . 20 GLY C 1 1 10 10312 1 1 20 GLY CA C 6.261 -0.641 -0.654 1.00 . A A . 20 GLY CA 1 1 10 10313 1 1 20 GLY H H 6.935 -1.523 1.110 1.00 . A A . 20 GLY H 1 1 10 10314 1 1 20 GLY HA2 H 6.325 0.375 -1.001 1.00 . A A . 20 GLY HA2 1 1 10 10315 1 1 20 GLY HA3 H 6.936 -1.266 -1.206 1.00 . A A . 20 GLY HA3 1 1 10 10316 1 1 20 GLY N N 6.596 -0.699 0.740 1.00 . A A . 20 GLY N 1 1 10 10317 1 1 20 GLY O O 4.051 -0.619 -1.565 1.00 . A A . 20 GLY O 1 1 10 10318 1 1 21 LYS C C 2.894 -3.168 1.389 1.00 . A A . 21 LYS C 1 1 10 10319 1 1 21 LYS CA C 3.337 -2.894 -0.061 1.00 . A A . 21 LYS CA 1 1 10 10320 1 1 21 LYS CB C 3.426 -4.217 -0.827 1.00 . A A . 21 LYS CB 1 1 10 10321 1 1 21 LYS CD C 3.776 -3.337 -3.162 1.00 . A A . 21 LYS CD 1 1 10 10322 1 1 21 LYS CE C 4.742 -3.245 -4.332 1.00 . A A . 21 LYS CE 1 1 10 10323 1 1 21 LYS CG C 4.352 -4.177 -2.036 1.00 . A A . 21 LYS CG 1 1 10 10324 1 1 21 LYS H H 5.359 -2.605 0.440 1.00 . A A . 21 LYS H 1 1 10 10325 1 1 21 LYS HA H 2.614 -2.250 -0.543 1.00 . A A . 21 LYS HA 1 1 10 10326 1 1 21 LYS HB2 H 3.790 -4.976 -0.156 1.00 . A A . 21 LYS HB2 1 1 10 10327 1 1 21 LYS HB3 H 2.441 -4.490 -1.166 1.00 . A A . 21 LYS HB3 1 1 10 10328 1 1 21 LYS HD2 H 2.859 -3.790 -3.504 1.00 . A A . 21 LYS HD2 1 1 10 10329 1 1 21 LYS HD3 H 3.575 -2.344 -2.793 1.00 . A A . 21 LYS HD3 1 1 10 10330 1 1 21 LYS HE2 H 5.751 -3.218 -3.949 1.00 . A A . 21 LYS HE2 1 1 10 10331 1 1 21 LYS HE3 H 4.619 -4.118 -4.954 1.00 . A A . 21 LYS HE3 1 1 10 10332 1 1 21 LYS HG2 H 5.298 -3.756 -1.737 1.00 . A A . 21 LYS HG2 1 1 10 10333 1 1 21 LYS HG3 H 4.503 -5.186 -2.393 1.00 . A A . 21 LYS HG3 1 1 10 10334 1 1 21 LYS HZ1 H 3.531 -2.031 -5.520 1.00 . A A . 21 LYS HZ1 1 1 10 10335 1 1 21 LYS HZ2 H 5.167 -1.995 -5.949 1.00 . A A . 21 LYS HZ2 1 1 10 10336 1 1 21 LYS HZ3 H 4.635 -1.174 -4.570 1.00 . A A . 21 LYS HZ3 1 1 10 10337 1 1 21 LYS N N 4.624 -2.230 -0.088 1.00 . A A . 21 LYS N 1 1 10 10338 1 1 21 LYS NZ N 4.502 -2.026 -5.150 1.00 . A A . 21 LYS NZ 1 1 10 10339 1 1 21 LYS O O 1.790 -3.660 1.616 1.00 . A A . 21 LYS O 1 1 10 10340 1 1 22 ASP C C 2.643 -1.922 4.393 1.00 . A A . 22 ASP C 1 1 10 10341 1 1 22 ASP CA C 3.443 -3.050 3.777 1.00 . A A . 22 ASP CA 1 1 10 10342 1 1 22 ASP CB C 4.734 -3.215 4.582 1.00 . A A . 22 ASP CB 1 1 10 10343 1 1 22 ASP CG C 4.500 -3.902 5.909 1.00 . A A . 22 ASP CG 1 1 10 10344 1 1 22 ASP H H 4.554 -2.344 2.153 1.00 . A A . 22 ASP H 1 1 10 10345 1 1 22 ASP HA H 2.877 -3.945 3.828 1.00 . A A . 22 ASP HA 1 1 10 10346 1 1 22 ASP HB2 H 5.447 -3.785 4.015 1.00 . A A . 22 ASP HB2 1 1 10 10347 1 1 22 ASP HB3 H 5.144 -2.236 4.782 1.00 . A A . 22 ASP HB3 1 1 10 10348 1 1 22 ASP N N 3.738 -2.804 2.372 1.00 . A A . 22 ASP N 1 1 10 10349 1 1 22 ASP O O 2.469 -1.859 5.608 1.00 . A A . 22 ASP O 1 1 10 10350 1 1 22 ASP OD1 O 3.328 -4.020 6.310 1.00 . A A . 22 ASP OD1 1 1 10 10351 1 1 22 ASP OD2 O 5.489 -4.309 6.553 1.00 . A A . 22 ASP OD2 1 1 10 10352 1 1 23 VAL C C -0.085 -0.203 4.065 1.00 . A A . 23 VAL C 1 1 10 10353 1 1 23 VAL CA C 1.401 0.092 4.011 1.00 . A A . 23 VAL CA 1 1 10 10354 1 1 23 VAL CB C 1.637 1.295 3.096 1.00 . A A . 23 VAL CB 1 1 10 10355 1 1 23 VAL CG1 C 0.933 1.112 1.757 1.00 . A A . 23 VAL CG1 1 1 10 10356 1 1 23 VAL CG2 C 1.178 2.564 3.771 1.00 . A A . 23 VAL CG2 1 1 10 10357 1 1 23 VAL H H 2.367 -1.124 2.610 1.00 . A A . 23 VAL H 1 1 10 10358 1 1 23 VAL HA H 1.740 0.353 4.996 1.00 . A A . 23 VAL HA 1 1 10 10359 1 1 23 VAL HB H 2.701 1.369 2.919 1.00 . A A . 23 VAL HB 1 1 10 10360 1 1 23 VAL HG11 H 1.456 0.368 1.175 1.00 . A A . 23 VAL HG11 1 1 10 10361 1 1 23 VAL HG12 H 0.931 2.047 1.228 1.00 . A A . 23 VAL HG12 1 1 10 10362 1 1 23 VAL HG13 H -0.085 0.795 1.915 1.00 . A A . 23 VAL HG13 1 1 10 10363 1 1 23 VAL HG21 H 1.860 3.366 3.535 1.00 . A A . 23 VAL HG21 1 1 10 10364 1 1 23 VAL HG22 H 1.158 2.409 4.838 1.00 . A A . 23 VAL HG22 1 1 10 10365 1 1 23 VAL HG23 H 0.187 2.818 3.425 1.00 . A A . 23 VAL HG23 1 1 10 10366 1 1 23 VAL N N 2.172 -1.035 3.556 1.00 . A A . 23 VAL N 1 1 10 10367 1 1 23 VAL O O -0.606 -1.015 3.300 1.00 . A A . 23 VAL O 1 1 10 10368 1 1 24 GLU C C -2.895 1.555 4.453 1.00 . A A . 24 GLU C 1 1 10 10369 1 1 24 GLU CA C -2.193 0.362 5.086 1.00 . A A . 24 GLU CA 1 1 10 10370 1 1 24 GLU CB C -2.588 0.252 6.557 1.00 . A A . 24 GLU CB 1 1 10 10371 1 1 24 GLU CD C -2.384 1.194 8.892 1.00 . A A . 24 GLU CD 1 1 10 10372 1 1 24 GLU CG C -1.964 1.320 7.440 1.00 . A A . 24 GLU CG 1 1 10 10373 1 1 24 GLU H H -0.287 1.170 5.482 1.00 . A A . 24 GLU H 1 1 10 10374 1 1 24 GLU HA H -2.484 -0.546 4.569 1.00 . A A . 24 GLU HA 1 1 10 10375 1 1 24 GLU HB2 H -3.661 0.337 6.630 1.00 . A A . 24 GLU HB2 1 1 10 10376 1 1 24 GLU HB3 H -2.288 -0.715 6.928 1.00 . A A . 24 GLU HB3 1 1 10 10377 1 1 24 GLU HG2 H -0.889 1.234 7.384 1.00 . A A . 24 GLU HG2 1 1 10 10378 1 1 24 GLU HG3 H -2.266 2.291 7.076 1.00 . A A . 24 GLU HG3 1 1 10 10379 1 1 24 GLU N N -0.763 0.511 4.938 1.00 . A A . 24 GLU N 1 1 10 10380 1 1 24 GLU O O -2.744 2.686 4.910 1.00 . A A . 24 GLU O 1 1 10 10381 1 1 24 GLU OE1 O -3.438 1.757 9.257 1.00 . A A . 24 GLU OE1 1 1 10 10382 1 1 24 GLU OE2 O -1.660 0.530 9.664 1.00 . A A . 24 GLU OE2 1 1 10 10383 1 1 25 TYR C C -5.854 2.057 2.715 1.00 . A A . 25 TYR C 1 1 10 10384 1 1 25 TYR CA C -4.364 2.348 2.695 1.00 . A A . 25 TYR CA 1 1 10 10385 1 1 25 TYR CB C -3.885 2.457 1.249 1.00 . A A . 25 TYR CB 1 1 10 10386 1 1 25 TYR CD1 C -1.484 3.166 1.607 1.00 . A A . 25 TYR CD1 1 1 10 10387 1 1 25 TYR CD2 C -2.887 4.585 0.311 1.00 . A A . 25 TYR CD2 1 1 10 10388 1 1 25 TYR CE1 C -0.432 4.042 1.445 1.00 . A A . 25 TYR CE1 1 1 10 10389 1 1 25 TYR CE2 C -1.836 5.468 0.147 1.00 . A A . 25 TYR CE2 1 1 10 10390 1 1 25 TYR CG C -2.731 3.419 1.043 1.00 . A A . 25 TYR CG 1 1 10 10391 1 1 25 TYR CZ C -0.616 5.171 0.614 1.00 . A A . 25 TYR CZ 1 1 10 10392 1 1 25 TYR H H -3.722 0.384 3.077 1.00 . A A . 25 TYR H 1 1 10 10393 1 1 25 TYR HA H -4.175 3.278 3.200 1.00 . A A . 25 TYR HA 1 1 10 10394 1 1 25 TYR HB2 H -3.569 1.480 0.913 1.00 . A A . 25 TYR HB2 1 1 10 10395 1 1 25 TYR HB3 H -4.708 2.791 0.634 1.00 . A A . 25 TYR HB3 1 1 10 10396 1 1 25 TYR HD1 H -1.340 2.269 2.173 1.00 . A A . 25 TYR HD1 1 1 10 10397 1 1 25 TYR HD2 H -3.846 4.802 -0.136 1.00 . A A . 25 TYR HD2 1 1 10 10398 1 1 25 TYR HE1 H 0.526 3.824 1.894 1.00 . A A . 25 TYR HE1 1 1 10 10399 1 1 25 TYR HE2 H -1.973 6.366 -0.428 1.00 . A A . 25 TYR HE2 1 1 10 10400 1 1 25 TYR HH H 1.220 5.586 0.300 1.00 . A A . 25 TYR HH 1 1 10 10401 1 1 25 TYR N N -3.643 1.300 3.392 1.00 . A A . 25 TYR N 1 1 10 10402 1 1 25 TYR O O -6.265 0.904 2.714 1.00 . A A . 25 TYR O 1 1 10 10403 1 1 25 TYR OH O 0.432 6.069 0.557 1.00 . A A . 25 TYR OH 1 1 10 10404 1 1 26 LEU C C -8.590 2.864 1.300 1.00 . A A . 26 LEU C 1 1 10 10405 1 1 26 LEU CA C -8.099 2.950 2.724 1.00 . A A . 26 LEU CA 1 1 10 10406 1 1 26 LEU CB C -8.764 4.131 3.439 1.00 . A A . 26 LEU CB 1 1 10 10407 1 1 26 LEU CD1 C -10.989 4.825 4.378 1.00 . A A . 26 LEU CD1 1 1 10 10408 1 1 26 LEU CD2 C -10.498 5.171 1.946 1.00 . A A . 26 LEU CD2 1 1 10 10409 1 1 26 LEU CG C -10.260 4.287 3.161 1.00 . A A . 26 LEU CG 1 1 10 10410 1 1 26 LEU H H -6.279 3.995 2.703 1.00 . A A . 26 LEU H 1 1 10 10411 1 1 26 LEU HA H -8.345 2.032 3.232 1.00 . A A . 26 LEU HA 1 1 10 10412 1 1 26 LEU HB2 H -8.625 4.010 4.502 1.00 . A A . 26 LEU HB2 1 1 10 10413 1 1 26 LEU HB3 H -8.267 5.037 3.131 1.00 . A A . 26 LEU HB3 1 1 10 10414 1 1 26 LEU HD11 H -11.116 4.031 5.100 1.00 . A A . 26 LEU HD11 1 1 10 10415 1 1 26 LEU HD12 H -11.958 5.200 4.082 1.00 . A A . 26 LEU HD12 1 1 10 10416 1 1 26 LEU HD13 H -10.414 5.623 4.820 1.00 . A A . 26 LEU HD13 1 1 10 10417 1 1 26 LEU HD21 H -11.527 5.501 1.937 1.00 . A A . 26 LEU HD21 1 1 10 10418 1 1 26 LEU HD22 H -10.293 4.607 1.047 1.00 . A A . 26 LEU HD22 1 1 10 10419 1 1 26 LEU HD23 H -9.844 6.028 1.988 1.00 . A A . 26 LEU HD23 1 1 10 10420 1 1 26 LEU HG H -10.660 3.321 2.935 1.00 . A A . 26 LEU HG 1 1 10 10421 1 1 26 LEU N N -6.660 3.102 2.718 1.00 . A A . 26 LEU N 1 1 10 10422 1 1 26 LEU O O -7.918 3.323 0.382 1.00 . A A . 26 LEU O 1 1 10 10423 1 1 27 VAL C C -11.765 2.362 -0.334 1.00 . A A . 27 VAL C 1 1 10 10424 1 1 27 VAL CA C -10.268 2.164 -0.240 1.00 . A A . 27 VAL CA 1 1 10 10425 1 1 27 VAL CB C -9.818 0.857 -0.958 1.00 . A A . 27 VAL CB 1 1 10 10426 1 1 27 VAL CG1 C -8.843 0.047 -0.113 1.00 . A A . 27 VAL CG1 1 1 10 10427 1 1 27 VAL CG2 C -10.971 -0.031 -1.432 1.00 . A A . 27 VAL CG2 1 1 10 10428 1 1 27 VAL H H -10.236 1.870 1.850 1.00 . A A . 27 VAL H 1 1 10 10429 1 1 27 VAL HA H -9.824 2.967 -0.792 1.00 . A A . 27 VAL HA 1 1 10 10430 1 1 27 VAL HB H -9.290 1.185 -1.825 1.00 . A A . 27 VAL HB 1 1 10 10431 1 1 27 VAL HG11 H -8.574 -0.856 -0.640 1.00 . A A . 27 VAL HG11 1 1 10 10432 1 1 27 VAL HG12 H -9.311 -0.212 0.826 1.00 . A A . 27 VAL HG12 1 1 10 10433 1 1 27 VAL HG13 H -7.956 0.633 0.076 1.00 . A A . 27 VAL HG13 1 1 10 10434 1 1 27 VAL HG21 H -11.617 -0.255 -0.603 1.00 . A A . 27 VAL HG21 1 1 10 10435 1 1 27 VAL HG22 H -10.574 -0.949 -1.839 1.00 . A A . 27 VAL HG22 1 1 10 10436 1 1 27 VAL HG23 H -11.532 0.486 -2.196 1.00 . A A . 27 VAL HG23 1 1 10 10437 1 1 27 VAL N N -9.750 2.266 1.102 1.00 . A A . 27 VAL N 1 1 10 10438 1 1 27 VAL O O -12.557 1.542 0.129 1.00 . A A . 27 VAL O 1 1 10 10439 1 1 28 ARG C C -13.825 3.014 -2.459 1.00 . A A . 28 ARG C 1 1 10 10440 1 1 28 ARG CA C -13.523 3.752 -1.193 1.00 . A A . 28 ARG CA 1 1 10 10441 1 1 28 ARG CB C -13.784 5.236 -1.379 1.00 . A A . 28 ARG CB 1 1 10 10442 1 1 28 ARG CD C -13.627 7.558 -0.432 1.00 . A A . 28 ARG CD 1 1 10 10443 1 1 28 ARG CG C -13.197 6.108 -0.280 1.00 . A A . 28 ARG CG 1 1 10 10444 1 1 28 ARG CZ C -15.707 8.864 -0.568 1.00 . A A . 28 ARG CZ 1 1 10 10445 1 1 28 ARG H H -11.458 4.141 -1.179 1.00 . A A . 28 ARG H 1 1 10 10446 1 1 28 ARG HA H -14.126 3.350 -0.399 1.00 . A A . 28 ARG HA 1 1 10 10447 1 1 28 ARG HB2 H -13.352 5.528 -2.320 1.00 . A A . 28 ARG HB2 1 1 10 10448 1 1 28 ARG HB3 H -14.851 5.402 -1.414 1.00 . A A . 28 ARG HB3 1 1 10 10449 1 1 28 ARG HD2 H -13.203 8.132 0.379 1.00 . A A . 28 ARG HD2 1 1 10 10450 1 1 28 ARG HD3 H -13.255 7.935 -1.373 1.00 . A A . 28 ARG HD3 1 1 10 10451 1 1 28 ARG HE H -15.614 6.895 -0.260 1.00 . A A . 28 ARG HE 1 1 10 10452 1 1 28 ARG HG2 H -13.537 5.741 0.677 1.00 . A A . 28 ARG HG2 1 1 10 10453 1 1 28 ARG HG3 H -12.120 6.053 -0.327 1.00 . A A . 28 ARG HG3 1 1 10 10454 1 1 28 ARG HH11 H -14.010 9.942 -0.778 1.00 . A A . 28 ARG HH11 1 1 10 10455 1 1 28 ARG HH12 H -15.482 10.848 -0.886 1.00 . A A . 28 ARG HH12 1 1 10 10456 1 1 28 ARG HH21 H -17.561 8.076 -0.395 1.00 . A A . 28 ARG HH21 1 1 10 10457 1 1 28 ARG HH22 H -17.503 9.786 -0.664 1.00 . A A . 28 ARG HH22 1 1 10 10458 1 1 28 ARG N N -12.137 3.482 -0.925 1.00 . A A . 28 ARG N 1 1 10 10459 1 1 28 ARG NE N -15.079 7.703 -0.404 1.00 . A A . 28 ARG NE 1 1 10 10460 1 1 28 ARG NH1 N -15.009 9.976 -0.760 1.00 . A A . 28 ARG NH1 1 1 10 10461 1 1 28 ARG NH2 N -17.032 8.913 -0.540 1.00 . A A . 28 ARG NH2 1 1 10 10462 1 1 28 ARG O O -14.032 3.614 -3.514 1.00 . A A . 28 ARG O 1 1 10 10463 1 1 29 TRP C C -14.836 1.374 -4.544 1.00 . A A . 29 TRP C 1 1 10 10464 1 1 29 TRP CA C -14.042 0.760 -3.415 1.00 . A A . 29 TRP CA 1 1 10 10465 1 1 29 TRP CB C -14.771 -0.456 -2.877 1.00 . A A . 29 TRP CB 1 1 10 10466 1 1 29 TRP CD1 C -13.687 -1.830 -4.741 1.00 . A A . 29 TRP CD1 1 1 10 10467 1 1 29 TRP CD2 C -15.116 -2.987 -3.465 1.00 . A A . 29 TRP CD2 1 1 10 10468 1 1 29 TRP CE2 C -14.593 -3.849 -4.447 1.00 . A A . 29 TRP CE2 1 1 10 10469 1 1 29 TRP CE3 C -16.040 -3.495 -2.547 1.00 . A A . 29 TRP CE3 1 1 10 10470 1 1 29 TRP CG C -14.522 -1.700 -3.671 1.00 . A A . 29 TRP CG 1 1 10 10471 1 1 29 TRP CH2 C -15.866 -5.659 -3.624 1.00 . A A . 29 TRP CH2 1 1 10 10472 1 1 29 TRP CZ2 C -14.962 -5.189 -4.536 1.00 . A A . 29 TRP CZ2 1 1 10 10473 1 1 29 TRP CZ3 C -16.404 -4.825 -2.636 1.00 . A A . 29 TRP CZ3 1 1 10 10474 1 1 29 TRP H H -13.660 1.324 -1.434 1.00 . A A . 29 TRP H 1 1 10 10475 1 1 29 TRP HA H -13.076 0.452 -3.787 1.00 . A A . 29 TRP HA 1 1 10 10476 1 1 29 TRP HB2 H -14.447 -0.621 -1.864 1.00 . A A . 29 TRP HB2 1 1 10 10477 1 1 29 TRP HB3 H -15.834 -0.261 -2.883 1.00 . A A . 29 TRP HB3 1 1 10 10478 1 1 29 TRP HD1 H -13.089 -1.027 -5.147 1.00 . A A . 29 TRP HD1 1 1 10 10479 1 1 29 TRP HE1 H -13.208 -3.461 -5.975 1.00 . A A . 29 TRP HE1 1 1 10 10480 1 1 29 TRP HE3 H -16.465 -2.867 -1.778 1.00 . A A . 29 TRP HE3 1 1 10 10481 1 1 29 TRP HH2 H -16.182 -6.692 -3.657 1.00 . A A . 29 TRP HH2 1 1 10 10482 1 1 29 TRP HZ2 H -14.555 -5.845 -5.292 1.00 . A A . 29 TRP HZ2 1 1 10 10483 1 1 29 TRP HZ3 H -17.117 -5.235 -1.935 1.00 . A A . 29 TRP HZ3 1 1 10 10484 1 1 29 TRP N N -13.827 1.692 -2.321 1.00 . A A . 29 TRP N 1 1 10 10485 1 1 29 TRP NE1 N -13.722 -3.119 -5.214 1.00 . A A . 29 TRP NE1 1 1 10 10486 1 1 29 TRP O O -16.062 1.375 -4.530 1.00 . A A . 29 TRP O 1 1 10 10487 1 1 30 LYS C C -16.007 1.953 -7.093 1.00 . A A . 30 LYS C 1 1 10 10488 1 1 30 LYS CA C -14.676 2.598 -6.686 1.00 . A A . 30 LYS CA 1 1 10 10489 1 1 30 LYS CB C -13.709 2.511 -7.866 1.00 . A A . 30 LYS CB 1 1 10 10490 1 1 30 LYS CD C -14.579 4.629 -8.906 1.00 . A A . 30 LYS CD 1 1 10 10491 1 1 30 LYS CE C -15.035 5.299 -10.193 1.00 . A A . 30 LYS CE 1 1 10 10492 1 1 30 LYS CG C -14.234 3.166 -9.133 1.00 . A A . 30 LYS CG 1 1 10 10493 1 1 30 LYS H H -13.102 2.014 -5.328 1.00 . A A . 30 LYS H 1 1 10 10494 1 1 30 LYS HA H -14.852 3.638 -6.455 1.00 . A A . 30 LYS HA 1 1 10 10495 1 1 30 LYS HB2 H -12.784 2.990 -7.597 1.00 . A A . 30 LYS HB2 1 1 10 10496 1 1 30 LYS HB3 H -13.518 1.470 -8.080 1.00 . A A . 30 LYS HB3 1 1 10 10497 1 1 30 LYS HD2 H -15.374 4.693 -8.178 1.00 . A A . 30 LYS HD2 1 1 10 10498 1 1 30 LYS HD3 H -13.704 5.140 -8.534 1.00 . A A . 30 LYS HD3 1 1 10 10499 1 1 30 LYS HE2 H -15.311 6.319 -9.974 1.00 . A A . 30 LYS HE2 1 1 10 10500 1 1 30 LYS HE3 H -14.215 5.291 -10.897 1.00 . A A . 30 LYS HE3 1 1 10 10501 1 1 30 LYS HG2 H -13.478 3.100 -9.901 1.00 . A A . 30 LYS HG2 1 1 10 10502 1 1 30 LYS HG3 H -15.122 2.641 -9.455 1.00 . A A . 30 LYS HG3 1 1 10 10503 1 1 30 LYS HZ1 H -17.003 4.600 -10.138 1.00 . A A . 30 LYS HZ1 1 1 10 10504 1 1 30 LYS HZ2 H -15.952 3.617 -11.029 1.00 . A A . 30 LYS HZ2 1 1 10 10505 1 1 30 LYS HZ3 H -16.491 5.085 -11.676 1.00 . A A . 30 LYS HZ3 1 1 10 10506 1 1 30 LYS N N -14.090 1.961 -5.485 1.00 . A A . 30 LYS N 1 1 10 10507 1 1 30 LYS NZ N -16.202 4.601 -10.801 1.00 . A A . 30 LYS NZ 1 1 10 10508 1 1 30 LYS O O -16.921 2.634 -7.554 1.00 . A A . 30 LYS O 1 1 10 10509 1 1 31 ASP C C -17.869 -0.751 -5.979 1.00 . A A . 31 ASP C 1 1 10 10510 1 1 31 ASP CA C -17.311 -0.102 -7.242 1.00 . A A . 31 ASP CA 1 1 10 10511 1 1 31 ASP CB C -17.029 -1.166 -8.303 1.00 . A A . 31 ASP CB 1 1 10 10512 1 1 31 ASP CG C -16.505 -0.569 -9.594 1.00 . A A . 31 ASP CG 1 1 10 10513 1 1 31 ASP H H -15.319 0.147 -6.581 1.00 . A A . 31 ASP H 1 1 10 10514 1 1 31 ASP HA H -18.037 0.600 -7.625 1.00 . A A . 31 ASP HA 1 1 10 10515 1 1 31 ASP HB2 H -16.290 -1.858 -7.923 1.00 . A A . 31 ASP HB2 1 1 10 10516 1 1 31 ASP HB3 H -17.941 -1.702 -8.518 1.00 . A A . 31 ASP HB3 1 1 10 10517 1 1 31 ASP N N -16.094 0.637 -6.924 1.00 . A A . 31 ASP N 1 1 10 10518 1 1 31 ASP O O -18.053 -1.968 -5.919 1.00 . A A . 31 ASP O 1 1 10 10519 1 1 31 ASP OD1 O -17.330 -0.233 -10.470 1.00 . A A . 31 ASP OD1 1 1 10 10520 1 1 31 ASP OD2 O -15.270 -0.438 -9.731 1.00 . A A . 31 ASP OD2 1 1 10 10521 1 1 32 GLY C C -19.561 0.577 -3.018 1.00 . A A . 32 GLY C 1 1 10 10522 1 1 32 GLY CA C -18.651 -0.420 -3.708 1.00 . A A . 32 GLY CA 1 1 10 10523 1 1 32 GLY H H -17.983 1.036 -5.089 1.00 . A A . 32 GLY H 1 1 10 10524 1 1 32 GLY HA2 H -19.200 -1.332 -3.885 1.00 . A A . 32 GLY HA2 1 1 10 10525 1 1 32 GLY HA3 H -17.814 -0.632 -3.055 1.00 . A A . 32 GLY HA3 1 1 10 10526 1 1 32 GLY N N -18.136 0.075 -4.972 1.00 . A A . 32 GLY N 1 1 10 10527 1 1 32 GLY O O -20.351 1.262 -3.667 1.00 . A A . 32 GLY O 1 1 10 10528 1 1 33 GLY C C -19.575 2.071 0.325 1.00 . A A . 33 GLY C 1 1 10 10529 1 1 33 GLY CA C -20.268 1.578 -0.932 1.00 . A A . 33 GLY CA 1 1 10 10530 1 1 33 GLY H H -18.794 0.089 -1.235 1.00 . A A . 33 GLY H 1 1 10 10531 1 1 33 GLY HA2 H -20.511 2.427 -1.552 1.00 . A A . 33 GLY HA2 1 1 10 10532 1 1 33 GLY HA3 H -21.183 1.077 -0.651 1.00 . A A . 33 GLY HA3 1 1 10 10533 1 1 33 GLY N N -19.445 0.658 -1.695 1.00 . A A . 33 GLY N 1 1 10 10534 1 1 33 GLY O O -19.547 3.271 0.596 1.00 . A A . 33 GLY O 1 1 10 10535 1 1 34 ASP C C -16.830 1.689 2.080 1.00 . A A . 34 ASP C 1 1 10 10536 1 1 34 ASP CA C -18.322 1.489 2.328 1.00 . A A . 34 ASP CA 1 1 10 10537 1 1 34 ASP CB C -18.532 0.396 3.378 1.00 . A A . 34 ASP CB 1 1 10 10538 1 1 34 ASP CG C -20.000 0.125 3.643 1.00 . A A . 34 ASP CG 1 1 10 10539 1 1 34 ASP H H -19.067 0.202 0.822 1.00 . A A . 34 ASP H 1 1 10 10540 1 1 34 ASP HA H -18.741 2.413 2.697 1.00 . A A . 34 ASP HA 1 1 10 10541 1 1 34 ASP HB2 H -18.073 -0.519 3.033 1.00 . A A . 34 ASP HB2 1 1 10 10542 1 1 34 ASP HB3 H -18.066 0.700 4.304 1.00 . A A . 34 ASP HB3 1 1 10 10543 1 1 34 ASP N N -19.015 1.142 1.093 1.00 . A A . 34 ASP N 1 1 10 10544 1 1 34 ASP O O -16.303 1.282 1.044 1.00 . A A . 34 ASP O 1 1 10 10545 1 1 34 ASP OD1 O -20.619 0.901 4.402 1.00 . A A . 34 ASP OD1 1 1 10 10546 1 1 34 ASP OD2 O -20.529 -0.862 3.093 1.00 . A A . 34 ASP OD2 1 1 10 10547 1 1 35 CYS C C -13.957 1.897 4.055 1.00 . A A . 35 CYS C 1 1 10 10548 1 1 35 CYS CA C -14.723 2.572 2.920 1.00 . A A . 35 CYS CA 1 1 10 10549 1 1 35 CYS CB C -14.447 4.076 2.925 1.00 . A A . 35 CYS CB 1 1 10 10550 1 1 35 CYS H H -16.630 2.621 3.838 1.00 . A A . 35 CYS H 1 1 10 10551 1 1 35 CYS HA H -14.390 2.157 1.982 1.00 . A A . 35 CYS HA 1 1 10 10552 1 1 35 CYS HB2 H -13.383 4.239 2.845 1.00 . A A . 35 CYS HB2 1 1 10 10553 1 1 35 CYS HB3 H -14.938 4.528 2.074 1.00 . A A . 35 CYS HB3 1 1 10 10554 1 1 35 CYS HG H -14.425 6.114 4.460 1.00 . A A . 35 CYS HG 1 1 10 10555 1 1 35 CYS N N -16.154 2.319 3.036 1.00 . A A . 35 CYS N 1 1 10 10556 1 1 35 CYS O O -14.050 2.309 5.211 1.00 . A A . 35 CYS O 1 1 10 10557 1 1 35 CYS SG S -15.022 4.932 4.411 1.00 . A A . 35 CYS SG 1 1 10 10558 1 1 36 GLU C C -10.924 0.322 4.472 1.00 . A A . 36 GLU C 1 1 10 10559 1 1 36 GLU CA C -12.421 0.123 4.705 1.00 . A A . 36 GLU CA 1 1 10 10560 1 1 36 GLU CB C -12.776 -1.363 4.658 1.00 . A A . 36 GLU CB 1 1 10 10561 1 1 36 GLU CD C -14.083 -1.280 6.817 1.00 . A A . 36 GLU CD 1 1 10 10562 1 1 36 GLU CG C -14.081 -1.699 5.360 1.00 . A A . 36 GLU CG 1 1 10 10563 1 1 36 GLU H H -13.171 0.573 2.781 1.00 . A A . 36 GLU H 1 1 10 10564 1 1 36 GLU HA H -12.675 0.512 5.679 1.00 . A A . 36 GLU HA 1 1 10 10565 1 1 36 GLU HB2 H -12.863 -1.668 3.626 1.00 . A A . 36 GLU HB2 1 1 10 10566 1 1 36 GLU HB3 H -11.984 -1.925 5.123 1.00 . A A . 36 GLU HB3 1 1 10 10567 1 1 36 GLU HG2 H -14.889 -1.192 4.854 1.00 . A A . 36 GLU HG2 1 1 10 10568 1 1 36 GLU HG3 H -14.239 -2.766 5.307 1.00 . A A . 36 GLU HG3 1 1 10 10569 1 1 36 GLU N N -13.203 0.856 3.717 1.00 . A A . 36 GLU N 1 1 10 10570 1 1 36 GLU O O -10.519 1.006 3.533 1.00 . A A . 36 GLU O 1 1 10 10571 1 1 36 GLU OE1 O -14.447 -0.119 7.100 1.00 . A A . 36 GLU OE1 1 1 10 10572 1 1 36 GLU OE2 O -13.720 -2.112 7.675 1.00 . A A . 36 GLU OE2 1 1 10 10573 1 1 37 TRP C C -8.022 -1.395 4.605 1.00 . A A . 37 TRP C 1 1 10 10574 1 1 37 TRP CA C -8.657 -0.160 5.230 1.00 . A A . 37 TRP CA 1 1 10 10575 1 1 37 TRP CB C -8.061 0.068 6.618 1.00 . A A . 37 TRP CB 1 1 10 10576 1 1 37 TRP CD1 C -9.122 2.396 6.711 1.00 . A A . 37 TRP CD1 1 1 10 10577 1 1 37 TRP CD2 C -8.714 1.492 8.719 1.00 . A A . 37 TRP CD2 1 1 10 10578 1 1 37 TRP CE2 C -9.294 2.762 8.908 1.00 . A A . 37 TRP CE2 1 1 10 10579 1 1 37 TRP CE3 C -8.371 0.735 9.843 1.00 . A A . 37 TRP CE3 1 1 10 10580 1 1 37 TRP CG C -8.614 1.278 7.306 1.00 . A A . 37 TRP CG 1 1 10 10581 1 1 37 TRP CH2 C -9.192 2.525 11.255 1.00 . A A . 37 TRP CH2 1 1 10 10582 1 1 37 TRP CZ2 C -9.538 3.287 10.173 1.00 . A A . 37 TRP CZ2 1 1 10 10583 1 1 37 TRP CZ3 C -8.613 1.259 11.099 1.00 . A A . 37 TRP CZ3 1 1 10 10584 1 1 37 TRP H H -10.487 -0.824 6.053 1.00 . A A . 37 TRP H 1 1 10 10585 1 1 37 TRP HA H -8.438 0.695 4.613 1.00 . A A . 37 TRP HA 1 1 10 10586 1 1 37 TRP HB2 H -8.266 -0.794 7.237 1.00 . A A . 37 TRP HB2 1 1 10 10587 1 1 37 TRP HB3 H -6.995 0.190 6.526 1.00 . A A . 37 TRP HB3 1 1 10 10588 1 1 37 TRP HD1 H -9.185 2.541 5.642 1.00 . A A . 37 TRP HD1 1 1 10 10589 1 1 37 TRP HE1 H -9.936 4.169 7.490 1.00 . A A . 37 TRP HE1 1 1 10 10590 1 1 37 TRP HE3 H -7.924 -0.244 9.742 1.00 . A A . 37 TRP HE3 1 1 10 10591 1 1 37 TRP HH2 H -9.362 2.894 12.256 1.00 . A A . 37 TRP HH2 1 1 10 10592 1 1 37 TRP HZ2 H -9.984 4.262 10.311 1.00 . A A . 37 TRP HZ2 1 1 10 10593 1 1 37 TRP HZ3 H -8.354 0.689 11.978 1.00 . A A . 37 TRP HZ3 1 1 10 10594 1 1 37 TRP N N -10.107 -0.285 5.331 1.00 . A A . 37 TRP N 1 1 10 10595 1 1 37 TRP NE1 N -9.534 3.292 7.667 1.00 . A A . 37 TRP NE1 1 1 10 10596 1 1 37 TRP O O -8.524 -2.510 4.754 1.00 . A A . 37 TRP O 1 1 10 10597 1 1 38 VAL C C -5.160 -2.850 4.247 1.00 . A A . 38 VAL C 1 1 10 10598 1 1 38 VAL CA C -6.188 -2.284 3.276 1.00 . A A . 38 VAL CA 1 1 10 10599 1 1 38 VAL CB C -5.478 -1.846 1.981 1.00 . A A . 38 VAL CB 1 1 10 10600 1 1 38 VAL CG1 C -4.808 -3.041 1.320 1.00 . A A . 38 VAL CG1 1 1 10 10601 1 1 38 VAL CG2 C -6.462 -1.188 1.030 1.00 . A A . 38 VAL CG2 1 1 10 10602 1 1 38 VAL H H -6.574 -0.268 3.800 1.00 . A A . 38 VAL H 1 1 10 10603 1 1 38 VAL HA H -6.900 -3.055 3.029 1.00 . A A . 38 VAL HA 1 1 10 10604 1 1 38 VAL HB H -4.715 -1.125 2.236 1.00 . A A . 38 VAL HB 1 1 10 10605 1 1 38 VAL HG11 H -4.506 -2.779 0.319 1.00 . A A . 38 VAL HG11 1 1 10 10606 1 1 38 VAL HG12 H -5.503 -3.867 1.281 1.00 . A A . 38 VAL HG12 1 1 10 10607 1 1 38 VAL HG13 H -3.940 -3.329 1.894 1.00 . A A . 38 VAL HG13 1 1 10 10608 1 1 38 VAL HG21 H -6.918 -1.942 0.408 1.00 . A A . 38 VAL HG21 1 1 10 10609 1 1 38 VAL HG22 H -5.941 -0.475 0.408 1.00 . A A . 38 VAL HG22 1 1 10 10610 1 1 38 VAL HG23 H -7.229 -0.681 1.597 1.00 . A A . 38 VAL HG23 1 1 10 10611 1 1 38 VAL N N -6.911 -1.187 3.904 1.00 . A A . 38 VAL N 1 1 10 10612 1 1 38 VAL O O -4.791 -2.192 5.219 1.00 . A A . 38 VAL O 1 1 10 10613 1 1 39 LYS C C -2.348 -4.103 4.758 1.00 . A A . 39 LYS C 1 1 10 10614 1 1 39 LYS CA C -3.738 -4.712 4.865 1.00 . A A . 39 LYS CA 1 1 10 10615 1 1 39 LYS CB C -3.682 -6.213 4.573 1.00 . A A . 39 LYS CB 1 1 10 10616 1 1 39 LYS CD C -4.136 -7.030 6.903 1.00 . A A . 39 LYS CD 1 1 10 10617 1 1 39 LYS CE C -3.691 -7.968 8.013 1.00 . A A . 39 LYS CE 1 1 10 10618 1 1 39 LYS CG C -3.165 -7.046 5.734 1.00 . A A . 39 LYS CG 1 1 10 10619 1 1 39 LYS H H -5.021 -4.542 3.193 1.00 . A A . 39 LYS H 1 1 10 10620 1 1 39 LYS HA H -4.083 -4.563 5.866 1.00 . A A . 39 LYS HA 1 1 10 10621 1 1 39 LYS HB2 H -4.676 -6.556 4.329 1.00 . A A . 39 LYS HB2 1 1 10 10622 1 1 39 LYS HB3 H -3.036 -6.378 3.723 1.00 . A A . 39 LYS HB3 1 1 10 10623 1 1 39 LYS HD2 H -4.196 -6.027 7.296 1.00 . A A . 39 LYS HD2 1 1 10 10624 1 1 39 LYS HD3 H -5.110 -7.340 6.552 1.00 . A A . 39 LYS HD3 1 1 10 10625 1 1 39 LYS HE2 H -3.578 -8.961 7.605 1.00 . A A . 39 LYS HE2 1 1 10 10626 1 1 39 LYS HE3 H -2.741 -7.627 8.397 1.00 . A A . 39 LYS HE3 1 1 10 10627 1 1 39 LYS HG2 H -3.033 -8.065 5.402 1.00 . A A . 39 LYS HG2 1 1 10 10628 1 1 39 LYS HG3 H -2.216 -6.644 6.059 1.00 . A A . 39 LYS HG3 1 1 10 10629 1 1 39 LYS HZ1 H -5.592 -8.367 8.782 1.00 . A A . 39 LYS HZ1 1 1 10 10630 1 1 39 LYS HZ2 H -4.810 -7.062 9.526 1.00 . A A . 39 LYS HZ2 1 1 10 10631 1 1 39 LYS HZ3 H -4.337 -8.646 9.881 1.00 . A A . 39 LYS HZ3 1 1 10 10632 1 1 39 LYS N N -4.700 -4.065 3.985 1.00 . A A . 39 LYS N 1 1 10 10633 1 1 39 LYS NZ N -4.676 -8.014 9.129 1.00 . A A . 39 LYS NZ 1 1 10 10634 1 1 39 LYS O O -1.605 -4.373 3.816 1.00 . A A . 39 LYS O 1 1 10 10635 1 1 40 GLY C C 0.338 -3.472 6.522 1.00 . A A . 40 GLY C 1 1 10 10636 1 1 40 GLY CA C -0.699 -2.657 5.779 1.00 . A A . 40 GLY CA 1 1 10 10637 1 1 40 GLY H H -2.642 -3.114 6.470 1.00 . A A . 40 GLY H 1 1 10 10638 1 1 40 GLY HA2 H -0.362 -2.524 4.766 1.00 . A A . 40 GLY HA2 1 1 10 10639 1 1 40 GLY HA3 H -0.784 -1.690 6.249 1.00 . A A . 40 GLY HA3 1 1 10 10640 1 1 40 GLY N N -2.001 -3.291 5.754 1.00 . A A . 40 GLY N 1 1 10 10641 1 1 40 GLY O O 1.128 -2.933 7.297 1.00 . A A . 40 GLY O 1 1 10 10642 1 1 41 VAL C C 2.130 -6.363 5.847 1.00 . A A . 41 VAL C 1 1 10 10643 1 1 41 VAL CA C 1.292 -5.671 6.915 1.00 . A A . 41 VAL CA 1 1 10 10644 1 1 41 VAL CB C 0.623 -6.759 7.768 1.00 . A A . 41 VAL CB 1 1 10 10645 1 1 41 VAL CG1 C 1.603 -7.300 8.797 1.00 . A A . 41 VAL CG1 1 1 10 10646 1 1 41 VAL CG2 C -0.636 -6.231 8.439 1.00 . A A . 41 VAL CG2 1 1 10 10647 1 1 41 VAL H H -0.353 -5.150 5.693 1.00 . A A . 41 VAL H 1 1 10 10648 1 1 41 VAL HA H 1.936 -5.084 7.553 1.00 . A A . 41 VAL HA 1 1 10 10649 1 1 41 VAL HB H 0.349 -7.571 7.110 1.00 . A A . 41 VAL HB 1 1 10 10650 1 1 41 VAL HG11 H 2.492 -7.655 8.295 1.00 . A A . 41 VAL HG11 1 1 10 10651 1 1 41 VAL HG12 H 1.145 -8.115 9.337 1.00 . A A . 41 VAL HG12 1 1 10 10652 1 1 41 VAL HG13 H 1.869 -6.514 9.488 1.00 . A A . 41 VAL HG13 1 1 10 10653 1 1 41 VAL HG21 H -1.036 -6.986 9.100 1.00 . A A . 41 VAL HG21 1 1 10 10654 1 1 41 VAL HG22 H -1.370 -5.984 7.687 1.00 . A A . 41 VAL HG22 1 1 10 10655 1 1 41 VAL HG23 H -0.394 -5.346 9.010 1.00 . A A . 41 VAL HG23 1 1 10 10656 1 1 41 VAL N N 0.324 -4.777 6.294 1.00 . A A . 41 VAL N 1 1 10 10657 1 1 41 VAL O O 2.876 -7.295 6.144 1.00 . A A . 41 VAL O 1 1 10 10658 1 1 42 HIS C C 4.182 -6.056 3.511 1.00 . A A . 42 HIS C 1 1 10 10659 1 1 42 HIS CA C 2.749 -6.510 3.508 1.00 . A A . 42 HIS CA 1 1 10 10660 1 1 42 HIS CB C 2.070 -6.243 2.167 1.00 . A A . 42 HIS CB 1 1 10 10661 1 1 42 HIS CD2 C 2.521 -8.114 0.426 1.00 . A A . 42 HIS CD2 1 1 10 10662 1 1 42 HIS CE1 C 0.728 -9.322 0.785 1.00 . A A . 42 HIS CE1 1 1 10 10663 1 1 42 HIS CG C 1.801 -7.496 1.393 1.00 . A A . 42 HIS CG 1 1 10 10664 1 1 42 HIS H H 1.423 -5.140 4.415 1.00 . A A . 42 HIS H 1 1 10 10665 1 1 42 HIS HA H 2.766 -7.558 3.683 1.00 . A A . 42 HIS HA 1 1 10 10666 1 1 42 HIS HB2 H 1.122 -5.745 2.341 1.00 . A A . 42 HIS HB2 1 1 10 10667 1 1 42 HIS HB3 H 2.705 -5.610 1.565 1.00 . A A . 42 HIS HB3 1 1 10 10668 1 1 42 HIS HD1 H -0.037 -8.094 2.231 1.00 . A A . 42 HIS HD1 1 1 10 10669 1 1 42 HIS HD2 H 3.461 -7.777 0.014 1.00 . A A . 42 HIS HD2 1 1 10 10670 1 1 42 HIS HE1 H -0.016 -10.103 0.720 1.00 . A A . 42 HIS HE1 1 1 10 10671 1 1 42 HIS HE2 H 2.180 -9.962 -0.507 1.00 . A A . 42 HIS HE2 1 1 10 10672 1 1 42 HIS N N 2.008 -5.905 4.600 1.00 . A A . 42 HIS N 1 1 10 10673 1 1 42 HIS ND1 N 0.682 -8.278 1.592 1.00 . A A . 42 HIS ND1 1 1 10 10674 1 1 42 HIS NE2 N 1.833 -9.247 0.067 1.00 . A A . 42 HIS NE2 1 1 10 10675 1 1 42 HIS O O 4.592 -5.215 2.715 1.00 . A A . 42 HIS O 1 1 10 10676 1 1 43 VAL C C 7.173 -6.601 3.358 1.00 . A A . 43 VAL C 1 1 10 10677 1 1 43 VAL CA C 6.345 -6.396 4.614 1.00 . A A . 43 VAL CA 1 1 10 10678 1 1 43 VAL CB C 6.922 -7.273 5.751 1.00 . A A . 43 VAL CB 1 1 10 10679 1 1 43 VAL CG1 C 8.422 -7.052 5.915 1.00 . A A . 43 VAL CG1 1 1 10 10680 1 1 43 VAL CG2 C 6.194 -7.002 7.057 1.00 . A A . 43 VAL CG2 1 1 10 10681 1 1 43 VAL H H 4.489 -7.335 5.001 1.00 . A A . 43 VAL H 1 1 10 10682 1 1 43 VAL HA H 6.440 -5.369 4.905 1.00 . A A . 43 VAL HA 1 1 10 10683 1 1 43 VAL HB H 6.765 -8.310 5.489 1.00 . A A . 43 VAL HB 1 1 10 10684 1 1 43 VAL HG11 H 8.677 -7.071 6.965 1.00 . A A . 43 VAL HG11 1 1 10 10685 1 1 43 VAL HG12 H 8.692 -6.096 5.494 1.00 . A A . 43 VAL HG12 1 1 10 10686 1 1 43 VAL HG13 H 8.958 -7.835 5.401 1.00 . A A . 43 VAL HG13 1 1 10 10687 1 1 43 VAL HG21 H 6.451 -7.765 7.778 1.00 . A A . 43 VAL HG21 1 1 10 10688 1 1 43 VAL HG22 H 5.128 -7.017 6.885 1.00 . A A . 43 VAL HG22 1 1 10 10689 1 1 43 VAL HG23 H 6.485 -6.035 7.439 1.00 . A A . 43 VAL HG23 1 1 10 10690 1 1 43 VAL N N 4.928 -6.676 4.416 1.00 . A A . 43 VAL N 1 1 10 10691 1 1 43 VAL O O 7.945 -7.554 3.252 1.00 . A A . 43 VAL O 1 1 10 10692 1 1 44 ALA C C 9.007 -4.850 1.366 1.00 . A A . 44 ALA C 1 1 10 10693 1 1 44 ALA CA C 7.775 -5.720 1.187 1.00 . A A . 44 ALA CA 1 1 10 10694 1 1 44 ALA CB C 6.936 -5.251 0.006 1.00 . A A . 44 ALA CB 1 1 10 10695 1 1 44 ALA H H 6.341 -4.985 2.541 1.00 . A A . 44 ALA H 1 1 10 10696 1 1 44 ALA HA H 8.091 -6.736 1.013 1.00 . A A . 44 ALA HA 1 1 10 10697 1 1 44 ALA HB1 H 6.012 -5.809 -0.021 1.00 . A A . 44 ALA HB1 1 1 10 10698 1 1 44 ALA HB2 H 7.482 -5.414 -0.911 1.00 . A A . 44 ALA HB2 1 1 10 10699 1 1 44 ALA HB3 H 6.719 -4.199 0.114 1.00 . A A . 44 ALA HB3 1 1 10 10700 1 1 44 ALA N N 7.005 -5.694 2.410 1.00 . A A . 44 ALA N 1 1 10 10701 1 1 44 ALA O O 9.309 -3.990 0.540 1.00 . A A . 44 ALA O 1 1 10 10702 1 1 45 GLU C C 11.787 -4.105 1.582 1.00 . A A . 45 GLU C 1 1 10 10703 1 1 45 GLU CA C 10.918 -4.327 2.812 1.00 . A A . 45 GLU CA 1 1 10 10704 1 1 45 GLU CB C 11.721 -5.051 3.904 1.00 . A A . 45 GLU CB 1 1 10 10705 1 1 45 GLU CD C 13.345 -6.892 4.514 1.00 . A A . 45 GLU CD 1 1 10 10706 1 1 45 GLU CG C 12.568 -6.217 3.402 1.00 . A A . 45 GLU CG 1 1 10 10707 1 1 45 GLU H H 9.414 -5.799 3.069 1.00 . A A . 45 GLU H 1 1 10 10708 1 1 45 GLU HA H 10.601 -3.366 3.190 1.00 . A A . 45 GLU HA 1 1 10 10709 1 1 45 GLU HB2 H 12.380 -4.337 4.377 1.00 . A A . 45 GLU HB2 1 1 10 10710 1 1 45 GLU HB3 H 11.032 -5.431 4.644 1.00 . A A . 45 GLU HB3 1 1 10 10711 1 1 45 GLU HG2 H 11.924 -6.948 2.938 1.00 . A A . 45 GLU HG2 1 1 10 10712 1 1 45 GLU HG3 H 13.271 -5.844 2.669 1.00 . A A . 45 GLU HG3 1 1 10 10713 1 1 45 GLU N N 9.713 -5.088 2.470 1.00 . A A . 45 GLU N 1 1 10 10714 1 1 45 GLU O O 12.488 -3.099 1.470 1.00 . A A . 45 GLU O 1 1 10 10715 1 1 45 GLU OE1 O 12.964 -6.725 5.692 1.00 . A A . 45 GLU OE1 1 1 10 10716 1 1 45 GLU OE2 O 14.334 -7.591 4.207 1.00 . A A . 45 GLU OE2 1 1 10 10717 1 1 46 ASP C C 11.967 -3.836 -1.429 1.00 . A A . 46 ASP C 1 1 10 10718 1 1 46 ASP CA C 12.493 -4.969 -0.571 1.00 . A A . 46 ASP CA 1 1 10 10719 1 1 46 ASP CB C 12.422 -6.288 -1.338 1.00 . A A . 46 ASP CB 1 1 10 10720 1 1 46 ASP CG C 11.016 -6.612 -1.803 1.00 . A A . 46 ASP CG 1 1 10 10721 1 1 46 ASP H H 11.141 -5.831 0.825 1.00 . A A . 46 ASP H 1 1 10 10722 1 1 46 ASP HA H 13.523 -4.757 -0.323 1.00 . A A . 46 ASP HA 1 1 10 10723 1 1 46 ASP HB2 H 13.063 -6.225 -2.205 1.00 . A A . 46 ASP HB2 1 1 10 10724 1 1 46 ASP HB3 H 12.765 -7.086 -0.697 1.00 . A A . 46 ASP HB3 1 1 10 10725 1 1 46 ASP N N 11.725 -5.055 0.666 1.00 . A A . 46 ASP N 1 1 10 10726 1 1 46 ASP O O 12.733 -3.019 -1.928 1.00 . A A . 46 ASP O 1 1 10 10727 1 1 46 ASP OD1 O 10.632 -6.153 -2.900 1.00 . A A . 46 ASP OD1 1 1 10 10728 1 1 46 ASP OD2 O 10.299 -7.328 -1.072 1.00 . A A . 46 ASP OD2 1 1 10 10729 1 1 47 VAL C C 10.385 -1.366 -1.789 1.00 . A A . 47 VAL C 1 1 10 10730 1 1 47 VAL CA C 10.044 -2.728 -2.376 1.00 . A A . 47 VAL CA 1 1 10 10731 1 1 47 VAL CB C 8.519 -2.893 -2.452 1.00 . A A . 47 VAL CB 1 1 10 10732 1 1 47 VAL CG1 C 7.916 -1.822 -3.345 1.00 . A A . 47 VAL CG1 1 1 10 10733 1 1 47 VAL CG2 C 8.163 -4.282 -2.956 1.00 . A A . 47 VAL CG2 1 1 10 10734 1 1 47 VAL H H 10.083 -4.437 -1.131 1.00 . A A . 47 VAL H 1 1 10 10735 1 1 47 VAL HA H 10.447 -2.790 -3.378 1.00 . A A . 47 VAL HA 1 1 10 10736 1 1 47 VAL HB H 8.113 -2.777 -1.459 1.00 . A A . 47 VAL HB 1 1 10 10737 1 1 47 VAL HG11 H 8.152 -2.038 -4.376 1.00 . A A . 47 VAL HG11 1 1 10 10738 1 1 47 VAL HG12 H 8.323 -0.859 -3.076 1.00 . A A . 47 VAL HG12 1 1 10 10739 1 1 47 VAL HG13 H 6.844 -1.807 -3.216 1.00 . A A . 47 VAL HG13 1 1 10 10740 1 1 47 VAL HG21 H 7.102 -4.444 -2.848 1.00 . A A . 47 VAL HG21 1 1 10 10741 1 1 47 VAL HG22 H 8.700 -5.019 -2.380 1.00 . A A . 47 VAL HG22 1 1 10 10742 1 1 47 VAL HG23 H 8.438 -4.369 -3.997 1.00 . A A . 47 VAL HG23 1 1 10 10743 1 1 47 VAL N N 10.654 -3.775 -1.580 1.00 . A A . 47 VAL N 1 1 10 10744 1 1 47 VAL O O 10.661 -0.442 -2.515 1.00 . A A . 47 VAL O 1 1 10 10745 1 1 48 ALA C C 12.149 0.254 0.227 1.00 . A A . 48 ALA C 1 1 10 10746 1 1 48 ALA CA C 10.674 -0.100 0.328 1.00 . A A . 48 ALA CA 1 1 10 10747 1 1 48 ALA CB C 10.304 -0.335 1.784 1.00 . A A . 48 ALA CB 1 1 10 10748 1 1 48 ALA H H 10.135 -2.088 0.001 1.00 . A A . 48 ALA H 1 1 10 10749 1 1 48 ALA HA H 10.080 0.724 -0.031 1.00 . A A . 48 ALA HA 1 1 10 10750 1 1 48 ALA HB1 H 10.603 0.521 2.373 1.00 . A A . 48 ALA HB1 1 1 10 10751 1 1 48 ALA HB2 H 10.811 -1.217 2.147 1.00 . A A . 48 ALA HB2 1 1 10 10752 1 1 48 ALA HB3 H 9.237 -0.473 1.865 1.00 . A A . 48 ALA HB3 1 1 10 10753 1 1 48 ALA N N 10.365 -1.298 -0.463 1.00 . A A . 48 ALA N 1 1 10 10754 1 1 48 ALA O O 12.505 1.359 -0.183 1.00 . A A . 48 ALA O 1 1 10 10755 1 1 49 LYS C C 14.845 -0.198 -0.912 1.00 . A A . 49 LYS C 1 1 10 10756 1 1 49 LYS CA C 14.449 -0.465 0.533 1.00 . A A . 49 LYS CA 1 1 10 10757 1 1 49 LYS CB C 15.212 -1.676 1.076 1.00 . A A . 49 LYS CB 1 1 10 10758 1 1 49 LYS CD C 15.331 -0.639 3.362 1.00 . A A . 49 LYS CD 1 1 10 10759 1 1 49 LYS CE C 14.078 0.188 3.612 1.00 . A A . 49 LYS CE 1 1 10 10760 1 1 49 LYS CG C 15.022 -1.898 2.567 1.00 . A A . 49 LYS CG 1 1 10 10761 1 1 49 LYS H H 12.673 -1.554 0.926 1.00 . A A . 49 LYS H 1 1 10 10762 1 1 49 LYS HA H 14.685 0.403 1.128 1.00 . A A . 49 LYS HA 1 1 10 10763 1 1 49 LYS HB2 H 14.875 -2.561 0.556 1.00 . A A . 49 LYS HB2 1 1 10 10764 1 1 49 LYS HB3 H 16.266 -1.537 0.886 1.00 . A A . 49 LYS HB3 1 1 10 10765 1 1 49 LYS HD2 H 15.759 -0.920 4.311 1.00 . A A . 49 LYS HD2 1 1 10 10766 1 1 49 LYS HD3 H 16.040 -0.041 2.809 1.00 . A A . 49 LYS HD3 1 1 10 10767 1 1 49 LYS HE2 H 13.547 0.308 2.681 1.00 . A A . 49 LYS HE2 1 1 10 10768 1 1 49 LYS HE3 H 13.451 -0.340 4.316 1.00 . A A . 49 LYS HE3 1 1 10 10769 1 1 49 LYS HG2 H 13.998 -2.184 2.752 1.00 . A A . 49 LYS HG2 1 1 10 10770 1 1 49 LYS HG3 H 15.683 -2.688 2.891 1.00 . A A . 49 LYS HG3 1 1 10 10771 1 1 49 LYS HZ1 H 13.526 2.065 4.343 1.00 . A A . 49 LYS HZ1 1 1 10 10772 1 1 49 LYS HZ2 H 14.988 2.064 3.489 1.00 . A A . 49 LYS HZ2 1 1 10 10773 1 1 49 LYS HZ3 H 14.924 1.436 5.058 1.00 . A A . 49 LYS HZ3 1 1 10 10774 1 1 49 LYS N N 13.011 -0.688 0.606 1.00 . A A . 49 LYS N 1 1 10 10775 1 1 49 LYS NZ N 14.402 1.532 4.164 1.00 . A A . 49 LYS NZ 1 1 10 10776 1 1 49 LYS O O 15.825 0.491 -1.194 1.00 . A A . 49 LYS O 1 1 10 10777 1 1 50 ASP C C 13.483 0.591 -3.771 1.00 . A A . 50 ASP C 1 1 10 10778 1 1 50 ASP CA C 14.306 -0.589 -3.246 1.00 . A A . 50 ASP CA 1 1 10 10779 1 1 50 ASP CB C 13.950 -1.872 -3.998 1.00 . A A . 50 ASP CB 1 1 10 10780 1 1 50 ASP CG C 14.606 -1.945 -5.364 1.00 . A A . 50 ASP CG 1 1 10 10781 1 1 50 ASP H H 13.316 -1.313 -1.537 1.00 . A A . 50 ASP H 1 1 10 10782 1 1 50 ASP HA H 15.355 -0.375 -3.387 1.00 . A A . 50 ASP HA 1 1 10 10783 1 1 50 ASP HB2 H 14.273 -2.728 -3.413 1.00 . A A . 50 ASP HB2 1 1 10 10784 1 1 50 ASP HB3 H 12.878 -1.918 -4.131 1.00 . A A . 50 ASP HB3 1 1 10 10785 1 1 50 ASP N N 14.074 -0.768 -1.826 1.00 . A A . 50 ASP N 1 1 10 10786 1 1 50 ASP O O 13.719 1.081 -4.876 1.00 . A A . 50 ASP O 1 1 10 10787 1 1 50 ASP OD1 O 14.027 -1.405 -6.329 1.00 . A A . 50 ASP OD1 1 1 10 10788 1 1 50 ASP OD2 O 15.698 -2.542 -5.467 1.00 . A A . 50 ASP OD2 1 1 10 10789 1 1 51 TYR C C 12.336 3.472 -3.035 1.00 . A A . 51 TYR C 1 1 10 10790 1 1 51 TYR CA C 11.657 2.153 -3.350 1.00 . A A . 51 TYR CA 1 1 10 10791 1 1 51 TYR CB C 10.310 2.123 -2.625 1.00 . A A . 51 TYR CB 1 1 10 10792 1 1 51 TYR CD1 C 9.405 0.814 -4.600 1.00 . A A . 51 TYR CD1 1 1 10 10793 1 1 51 TYR CD2 C 7.834 1.656 -3.013 1.00 . A A . 51 TYR CD2 1 1 10 10794 1 1 51 TYR CE1 C 8.372 0.250 -5.326 1.00 . A A . 51 TYR CE1 1 1 10 10795 1 1 51 TYR CE2 C 6.800 1.098 -3.740 1.00 . A A . 51 TYR CE2 1 1 10 10796 1 1 51 TYR CG C 9.160 1.526 -3.428 1.00 . A A . 51 TYR CG 1 1 10 10797 1 1 51 TYR CZ C 7.038 0.474 -4.901 1.00 . A A . 51 TYR CZ 1 1 10 10798 1 1 51 TYR H H 12.362 0.616 -2.112 1.00 . A A . 51 TYR H 1 1 10 10799 1 1 51 TYR HA H 11.482 2.060 -4.386 1.00 . A A . 51 TYR HA 1 1 10 10800 1 1 51 TYR HB2 H 10.425 1.552 -1.734 1.00 . A A . 51 TYR HB2 1 1 10 10801 1 1 51 TYR HB3 H 10.034 3.134 -2.360 1.00 . A A . 51 TYR HB3 1 1 10 10802 1 1 51 TYR HD1 H 10.419 0.704 -4.948 1.00 . A A . 51 TYR HD1 1 1 10 10803 1 1 51 TYR HD2 H 7.613 2.212 -2.118 1.00 . A A . 51 TYR HD2 1 1 10 10804 1 1 51 TYR HE1 H 8.587 -0.298 -6.231 1.00 . A A . 51 TYR HE1 1 1 10 10805 1 1 51 TYR HE2 H 5.781 1.211 -3.400 1.00 . A A . 51 TYR HE2 1 1 10 10806 1 1 51 TYR HH H 6.291 -1.055 -5.883 1.00 . A A . 51 TYR HH 1 1 10 10807 1 1 51 TYR N N 12.510 1.043 -2.969 1.00 . A A . 51 TYR N 1 1 10 10808 1 1 51 TYR O O 12.738 4.218 -3.927 1.00 . A A . 51 TYR O 1 1 10 10809 1 1 51 TYR OH O 6.045 -0.168 -5.611 1.00 . A A . 51 TYR OH 1 1 10 10810 1 1 52 GLU C C 14.594 4.846 -1.222 1.00 . A A . 52 GLU C 1 1 10 10811 1 1 52 GLU CA C 13.076 4.962 -1.256 1.00 . A A . 52 GLU CA 1 1 10 10812 1 1 52 GLU CB C 12.552 5.301 0.142 1.00 . A A . 52 GLU CB 1 1 10 10813 1 1 52 GLU CD C 12.458 4.662 2.588 1.00 . A A . 52 GLU CD 1 1 10 10814 1 1 52 GLU CG C 13.028 4.338 1.221 1.00 . A A . 52 GLU CG 1 1 10 10815 1 1 52 GLU H H 12.162 3.063 -1.087 1.00 . A A . 52 GLU H 1 1 10 10816 1 1 52 GLU HA H 12.797 5.747 -1.932 1.00 . A A . 52 GLU HA 1 1 10 10817 1 1 52 GLU HB2 H 12.882 6.295 0.406 1.00 . A A . 52 GLU HB2 1 1 10 10818 1 1 52 GLU HB3 H 11.472 5.282 0.124 1.00 . A A . 52 GLU HB3 1 1 10 10819 1 1 52 GLU HG2 H 12.726 3.338 0.951 1.00 . A A . 52 GLU HG2 1 1 10 10820 1 1 52 GLU HG3 H 14.104 4.387 1.279 1.00 . A A . 52 GLU HG3 1 1 10 10821 1 1 52 GLU N N 12.469 3.732 -1.738 1.00 . A A . 52 GLU N 1 1 10 10822 1 1 52 GLU O O 15.310 5.736 -1.682 1.00 . A A . 52 GLU O 1 1 10 10823 1 1 52 GLU OE1 O 12.799 5.731 3.136 1.00 . A A . 52 GLU OE1 1 1 10 10824 1 1 52 GLU OE2 O 11.672 3.845 3.113 1.00 . A A . 52 GLU OE2 1 1 10 10825 1 1 53 ASP C C 17.068 2.932 -1.866 1.00 . A A . 53 ASP C 1 1 10 10826 1 1 53 ASP CA C 16.504 3.493 -0.558 1.00 . A A . 53 ASP CA 1 1 10 10827 1 1 53 ASP CB C 16.768 2.536 0.610 1.00 . A A . 53 ASP CB 1 1 10 10828 1 1 53 ASP CG C 18.185 1.991 0.631 1.00 . A A . 53 ASP CG 1 1 10 10829 1 1 53 ASP H H 14.448 3.073 -0.322 1.00 . A A . 53 ASP H 1 1 10 10830 1 1 53 ASP HA H 16.988 4.436 -0.352 1.00 . A A . 53 ASP HA 1 1 10 10831 1 1 53 ASP HB2 H 16.599 3.065 1.537 1.00 . A A . 53 ASP HB2 1 1 10 10832 1 1 53 ASP HB3 H 16.078 1.708 0.550 1.00 . A A . 53 ASP HB3 1 1 10 10833 1 1 53 ASP N N 15.075 3.742 -0.668 1.00 . A A . 53 ASP N 1 1 10 10834 1 1 53 ASP O O 18.281 2.926 -2.073 1.00 . A A . 53 ASP O 1 1 10 10835 1 1 53 ASP OD1 O 19.063 2.643 1.234 1.00 . A A . 53 ASP OD1 1 1 10 10836 1 1 53 ASP OD2 O 18.414 0.912 0.046 1.00 . A A . 53 ASP OD2 1 1 10 10837 1 1 54 GLY C C 16.961 3.012 -5.012 1.00 . A A . 54 GLY C 1 1 10 10838 1 1 54 GLY CA C 16.629 1.919 -4.016 1.00 . A A . 54 GLY CA 1 1 10 10839 1 1 54 GLY H H 15.230 2.472 -2.528 1.00 . A A . 54 GLY H 1 1 10 10840 1 1 54 GLY HA2 H 17.508 1.313 -3.852 1.00 . A A . 54 GLY HA2 1 1 10 10841 1 1 54 GLY HA3 H 15.846 1.298 -4.425 1.00 . A A . 54 GLY HA3 1 1 10 10842 1 1 54 GLY N N 16.186 2.458 -2.744 1.00 . A A . 54 GLY N 1 1 10 10843 1 1 54 GLY O O 17.896 2.880 -5.803 1.00 . A A . 54 GLY O 1 1 10 10844 1 1 55 LEU C C 17.456 6.166 -5.289 1.00 . A A . 55 LEU C 1 1 10 10845 1 1 55 LEU CA C 16.407 5.224 -5.867 1.00 . A A . 55 LEU CA 1 1 10 10846 1 1 55 LEU CB C 15.091 5.974 -6.094 1.00 . A A . 55 LEU CB 1 1 10 10847 1 1 55 LEU CD1 C 13.706 7.512 -7.509 1.00 . A A . 55 LEU CD1 1 1 10 10848 1 1 55 LEU CD2 C 16.037 8.162 -6.881 1.00 . A A . 55 LEU CD2 1 1 10 10849 1 1 55 LEU CG C 15.112 7.005 -7.226 1.00 . A A . 55 LEU CG 1 1 10 10850 1 1 55 LEU H H 15.462 4.135 -4.318 1.00 . A A . 55 LEU H 1 1 10 10851 1 1 55 LEU HA H 16.763 4.838 -6.810 1.00 . A A . 55 LEU HA 1 1 10 10852 1 1 55 LEU HB2 H 14.321 5.247 -6.311 1.00 . A A . 55 LEU HB2 1 1 10 10853 1 1 55 LEU HB3 H 14.832 6.484 -5.180 1.00 . A A . 55 LEU HB3 1 1 10 10854 1 1 55 LEU HD11 H 13.740 8.244 -8.303 1.00 . A A . 55 LEU HD11 1 1 10 10855 1 1 55 LEU HD12 H 13.301 7.967 -6.617 1.00 . A A . 55 LEU HD12 1 1 10 10856 1 1 55 LEU HD13 H 13.079 6.685 -7.808 1.00 . A A . 55 LEU HD13 1 1 10 10857 1 1 55 LEU HD21 H 15.868 8.467 -5.859 1.00 . A A . 55 LEU HD21 1 1 10 10858 1 1 55 LEU HD22 H 15.837 8.992 -7.543 1.00 . A A . 55 LEU HD22 1 1 10 10859 1 1 55 LEU HD23 H 17.064 7.849 -6.998 1.00 . A A . 55 LEU HD23 1 1 10 10860 1 1 55 LEU HG H 15.483 6.535 -8.125 1.00 . A A . 55 LEU HG 1 1 10 10861 1 1 55 LEU N N 16.192 4.095 -4.970 1.00 . A A . 55 LEU N 1 1 10 10862 1 1 55 LEU O O 18.492 6.414 -5.906 1.00 . A A . 55 LEU O 1 1 10 10863 1 1 56 GLU C C 19.082 6.821 -2.560 1.00 . A A . 56 GLU C 1 1 10 10864 1 1 56 GLU CA C 18.103 7.598 -3.432 1.00 . A A . 56 GLU CA 1 1 10 10865 1 1 56 GLU CB C 17.339 8.608 -2.581 1.00 . A A . 56 GLU CB 1 1 10 10866 1 1 56 GLU CD C 15.616 10.454 -2.503 1.00 . A A . 56 GLU CD 1 1 10 10867 1 1 56 GLU CG C 16.352 9.452 -3.372 1.00 . A A . 56 GLU CG 1 1 10 10868 1 1 56 GLU H H 16.334 6.460 -3.660 1.00 . A A . 56 GLU H 1 1 10 10869 1 1 56 GLU HA H 18.655 8.125 -4.189 1.00 . A A . 56 GLU HA 1 1 10 10870 1 1 56 GLU HB2 H 16.796 8.076 -1.821 1.00 . A A . 56 GLU HB2 1 1 10 10871 1 1 56 GLU HB3 H 18.047 9.271 -2.106 1.00 . A A . 56 GLU HB3 1 1 10 10872 1 1 56 GLU HG2 H 16.891 9.991 -4.137 1.00 . A A . 56 GLU HG2 1 1 10 10873 1 1 56 GLU HG3 H 15.629 8.798 -3.834 1.00 . A A . 56 GLU HG3 1 1 10 10874 1 1 56 GLU N N 17.179 6.690 -4.099 1.00 . A A . 56 GLU N 1 1 10 10875 1 1 56 GLU O O 19.115 6.991 -1.341 1.00 . A A . 56 GLU O 1 1 10 10876 1 1 56 GLU OE1 O 16.139 11.572 -2.313 1.00 . A A . 56 GLU OE1 1 1 10 10877 1 1 56 GLU OE2 O 14.516 10.120 -2.014 1.00 . A A . 56 GLU OE2 1 1 10 10878 1 1 57 TYR C C 22.189 5.890 -2.372 1.00 . A A . 57 TYR C 1 1 10 10879 1 1 57 TYR CA C 20.855 5.158 -2.478 1.00 . A A . 57 TYR CA 1 1 10 10880 1 1 57 TYR CB C 21.052 3.812 -3.179 1.00 . A A . 57 TYR CB 1 1 10 10881 1 1 57 TYR CD1 C 23.400 2.964 -2.798 1.00 . A A . 57 TYR CD1 1 1 10 10882 1 1 57 TYR CD2 C 21.635 2.001 -1.518 1.00 . A A . 57 TYR CD2 1 1 10 10883 1 1 57 TYR CE1 C 24.313 2.140 -2.166 1.00 . A A . 57 TYR CE1 1 1 10 10884 1 1 57 TYR CE2 C 22.541 1.174 -0.882 1.00 . A A . 57 TYR CE2 1 1 10 10885 1 1 57 TYR CG C 22.048 2.909 -2.485 1.00 . A A . 57 TYR CG 1 1 10 10886 1 1 57 TYR CZ C 23.879 1.250 -1.208 1.00 . A A . 57 TYR CZ 1 1 10 10887 1 1 57 TYR H H 19.802 5.878 -4.168 1.00 . A A . 57 TYR H 1 1 10 10888 1 1 57 TYR HA H 20.475 4.983 -1.483 1.00 . A A . 57 TYR HA 1 1 10 10889 1 1 57 TYR HB2 H 20.106 3.292 -3.219 1.00 . A A . 57 TYR HB2 1 1 10 10890 1 1 57 TYR HB3 H 21.405 3.986 -4.185 1.00 . A A . 57 TYR HB3 1 1 10 10891 1 1 57 TYR HD1 H 23.738 3.665 -3.547 1.00 . A A . 57 TYR HD1 1 1 10 10892 1 1 57 TYR HD2 H 20.586 1.945 -1.265 1.00 . A A . 57 TYR HD2 1 1 10 10893 1 1 57 TYR HE1 H 25.361 2.198 -2.423 1.00 . A A . 57 TYR HE1 1 1 10 10894 1 1 57 TYR HE2 H 22.201 0.475 -0.133 1.00 . A A . 57 TYR HE2 1 1 10 10895 1 1 57 TYR HH H 24.436 -0.470 -0.547 1.00 . A A . 57 TYR HH 1 1 10 10896 1 1 57 TYR N N 19.875 5.966 -3.194 1.00 . A A . 57 TYR N 1 1 10 10897 1 1 57 TYR O O 23.029 5.722 -3.282 1.00 . A A . 57 TYR O 1 1 10 10898 1 1 57 TYR OXT O 22.382 6.626 -1.382 1.00 . A A . 57 TYR OXT 1 1 10 10899 1 1 57 TYR OH O 24.783 0.425 -0.578 1.00 . A A . 57 TYR OH 1 1 10 10900 2 2 1 ALA C C -14.756 -6.783 5.616 1.00 . B B . 1 ALA C 1 1 10 10901 2 2 1 ALA CA C -13.761 -7.457 6.558 1.00 . B B . 1 ALA CA 1 1 10 10902 2 2 1 ALA CB C -12.681 -8.175 5.761 1.00 . B B . 1 ALA CB 1 1 10 10903 2 2 1 ALA H1 H -14.906 -9.164 6.913 1.00 . B B . 1 ALA H1 1 1 10 10904 2 2 1 ALA H2 H -15.177 -7.915 8.020 1.00 . B B . 1 ALA H2 1 1 10 10905 2 2 1 ALA H3 H -13.764 -8.840 8.119 1.00 . B B . 1 ALA H3 1 1 10 10906 2 2 1 ALA HA H -13.283 -6.699 7.160 1.00 . B B . 1 ALA HA 1 1 10 10907 2 2 1 ALA HB1 H -12.156 -7.463 5.142 1.00 . B B . 1 ALA HB1 1 1 10 10908 2 2 1 ALA HB2 H -13.138 -8.929 5.135 1.00 . B B . 1 ALA HB2 1 1 10 10909 2 2 1 ALA HB3 H -11.985 -8.646 6.439 1.00 . B B . 1 ALA HB3 1 1 10 10910 2 2 1 ALA N N -14.450 -8.411 7.465 1.00 . B B . 1 ALA N 1 1 10 10911 2 2 1 ALA O O -14.912 -7.198 4.467 1.00 . B B . 1 ALA O 1 1 10 10912 2 2 2 PRO C C -15.872 -4.567 3.935 1.00 . B B . 2 PRO C 1 1 10 10913 2 2 2 PRO CA C -16.429 -5.000 5.289 1.00 . B B . 2 PRO CA 1 1 10 10914 2 2 2 PRO CB C -16.748 -3.776 6.150 1.00 . B B . 2 PRO CB 1 1 10 10915 2 2 2 PRO CD C -15.311 -5.172 7.452 1.00 . B B . 2 PRO CD 1 1 10 10916 2 2 2 PRO CG C -16.463 -4.210 7.546 1.00 . B B . 2 PRO CG 1 1 10 10917 2 2 2 PRO HA H -17.326 -5.582 5.139 1.00 . B B . 2 PRO HA 1 1 10 10918 2 2 2 PRO HB2 H -16.117 -2.950 5.854 1.00 . B B . 2 PRO HB2 1 1 10 10919 2 2 2 PRO HB3 H -17.786 -3.506 6.026 1.00 . B B . 2 PRO HB3 1 1 10 10920 2 2 2 PRO HD2 H -14.372 -4.649 7.564 1.00 . B B . 2 PRO HD2 1 1 10 10921 2 2 2 PRO HD3 H -15.405 -5.947 8.198 1.00 . B B . 2 PRO HD3 1 1 10 10922 2 2 2 PRO HG2 H -16.191 -3.356 8.148 1.00 . B B . 2 PRO HG2 1 1 10 10923 2 2 2 PRO HG3 H -17.330 -4.703 7.962 1.00 . B B . 2 PRO HG3 1 1 10 10924 2 2 2 PRO N N -15.442 -5.732 6.093 1.00 . B B . 2 PRO N 1 1 10 10925 2 2 2 PRO O O -14.679 -4.295 3.805 1.00 . B B . 2 PRO O 1 1 10 10926 2 2 3 PRO C C -15.566 -2.774 1.552 1.00 . B B . 3 PRO C 1 1 10 10927 2 2 3 PRO CA C -16.327 -4.095 1.555 1.00 . B B . 3 PRO CA 1 1 10 10928 2 2 3 PRO CB C -17.654 -3.945 0.807 1.00 . B B . 3 PRO CB 1 1 10 10929 2 2 3 PRO CD C -18.176 -4.811 2.977 1.00 . B B . 3 PRO CD 1 1 10 10930 2 2 3 PRO CG C -18.605 -4.830 1.536 1.00 . B B . 3 PRO CG 1 1 10 10931 2 2 3 PRO HA H -15.726 -4.857 1.080 1.00 . B B . 3 PRO HA 1 1 10 10932 2 2 3 PRO HB2 H -17.971 -2.913 0.836 1.00 . B B . 3 PRO HB2 1 1 10 10933 2 2 3 PRO HB3 H -17.529 -4.260 -0.218 1.00 . B B . 3 PRO HB3 1 1 10 10934 2 2 3 PRO HD2 H -18.711 -4.044 3.519 1.00 . B B . 3 PRO HD2 1 1 10 10935 2 2 3 PRO HD3 H -18.337 -5.776 3.432 1.00 . B B . 3 PRO HD3 1 1 10 10936 2 2 3 PRO HG2 H -19.609 -4.445 1.439 1.00 . B B . 3 PRO HG2 1 1 10 10937 2 2 3 PRO HG3 H -18.547 -5.834 1.142 1.00 . B B . 3 PRO HG3 1 1 10 10938 2 2 3 PRO N N -16.736 -4.499 2.905 1.00 . B B . 3 PRO N 1 1 10 10939 2 2 3 PRO O O -16.073 -1.753 2.016 1.00 . B B . 3 PRO O 1 1 10 10940 2 2 4 GLY C C -12.053 -1.899 1.079 1.00 . B B . 4 GLY C 1 1 10 10941 2 2 4 GLY CA C -13.535 -1.600 0.968 1.00 . B B . 4 GLY CA 1 1 10 10942 2 2 4 GLY H H -13.999 -3.643 0.662 1.00 . B B . 4 GLY H 1 1 10 10943 2 2 4 GLY HA2 H -13.721 -1.094 0.033 1.00 . B B . 4 GLY HA2 1 1 10 10944 2 2 4 GLY HA3 H -13.821 -0.949 1.780 1.00 . B B . 4 GLY HA3 1 1 10 10945 2 2 4 GLY N N -14.348 -2.801 1.022 1.00 . B B . 4 GLY N 1 1 10 10946 2 2 4 GLY O O -11.397 -1.495 2.038 1.00 . B B . 4 GLY O 1 1 10 10947 2 2 5 THR C C -9.566 -3.117 -1.336 1.00 . B B . 5 THR C 1 1 10 10948 2 2 5 THR CA C -10.109 -2.959 0.080 1.00 . B B . 5 THR CA 1 1 10 10949 2 2 5 THR CB C -9.857 -4.259 0.864 1.00 . B B . 5 THR CB 1 1 10 10950 2 2 5 THR CG2 C -10.768 -5.372 0.370 1.00 . B B . 5 THR CG2 1 1 10 10951 2 2 5 THR H H -12.087 -2.873 -0.663 1.00 . B B . 5 THR H 1 1 10 10952 2 2 5 THR HA H -9.567 -2.161 0.566 1.00 . B B . 5 THR HA 1 1 10 10953 2 2 5 THR HB H -10.067 -4.080 1.909 1.00 . B B . 5 THR HB 1 1 10 10954 2 2 5 THR HG1 H -8.027 -4.515 1.555 1.00 . B B . 5 THR HG1 1 1 10 10955 2 2 5 THR HG21 H -10.581 -6.270 0.941 1.00 . B B . 5 THR HG21 1 1 10 10956 2 2 5 THR HG22 H -10.571 -5.562 -0.675 1.00 . B B . 5 THR HG22 1 1 10 10957 2 2 5 THR HG23 H -11.799 -5.075 0.494 1.00 . B B . 5 THR HG23 1 1 10 10958 2 2 5 THR N N -11.521 -2.602 0.087 1.00 . B B . 5 THR N 1 1 10 10959 2 2 5 THR O O -10.309 -3.060 -2.314 1.00 . B B . 5 THR O 1 1 10 10960 2 2 5 THR OG1 O -8.488 -4.659 0.726 1.00 . B B . 5 THR OG1 1 1 10 10961 2 2 6 ALA C C -6.143 -3.951 -2.484 1.00 . B B . 6 ALA C 1 1 10 10962 2 2 6 ALA CA C -7.582 -3.497 -2.703 1.00 . B B . 6 ALA CA 1 1 10 10963 2 2 6 ALA CB C -7.618 -2.201 -3.497 1.00 . B B . 6 ALA CB 1 1 10 10964 2 2 6 ALA H H -7.730 -3.375 -0.601 1.00 . B B . 6 ALA H 1 1 10 10965 2 2 6 ALA HA H -8.109 -4.254 -3.263 1.00 . B B . 6 ALA HA 1 1 10 10966 2 2 6 ALA HB1 H -8.276 -2.317 -4.346 1.00 . B B . 6 ALA HB1 1 1 10 10967 2 2 6 ALA HB2 H -6.623 -1.962 -3.844 1.00 . B B . 6 ALA HB2 1 1 10 10968 2 2 6 ALA HB3 H -7.981 -1.402 -2.867 1.00 . B B . 6 ALA HB3 1 1 10 10969 2 2 6 ALA N N -8.257 -3.326 -1.424 1.00 . B B . 6 ALA N 1 1 10 10970 2 2 6 ALA O O -5.734 -4.216 -1.353 1.00 . B B . 6 ALA O 1 1 10 10971 2 2 7 ARG C C -3.052 -3.494 -4.187 1.00 . B B . 7 ARG C 1 1 10 10972 2 2 7 ARG CA C -3.987 -4.470 -3.476 1.00 . B B . 7 ARG CA 1 1 10 10973 2 2 7 ARG CB C -3.842 -5.864 -4.083 1.00 . B B . 7 ARG CB 1 1 10 10974 2 2 7 ARG CD C -2.326 -7.696 -4.867 1.00 . B B . 7 ARG CD 1 1 10 10975 2 2 7 ARG CG C -2.406 -6.342 -4.187 1.00 . B B . 7 ARG CG 1 1 10 10976 2 2 7 ARG CZ C -2.975 -8.704 -7.013 1.00 . B B . 7 ARG CZ 1 1 10 10977 2 2 7 ARG H H -5.751 -3.811 -4.439 1.00 . B B . 7 ARG H 1 1 10 10978 2 2 7 ARG HA H -3.717 -4.512 -2.432 1.00 . B B . 7 ARG HA 1 1 10 10979 2 2 7 ARG HB2 H -4.388 -6.567 -3.472 1.00 . B B . 7 ARG HB2 1 1 10 10980 2 2 7 ARG HB3 H -4.269 -5.857 -5.076 1.00 . B B . 7 ARG HB3 1 1 10 10981 2 2 7 ARG HD2 H -1.306 -8.047 -4.827 1.00 . B B . 7 ARG HD2 1 1 10 10982 2 2 7 ARG HD3 H -2.967 -8.387 -4.339 1.00 . B B . 7 ARG HD3 1 1 10 10983 2 2 7 ARG HE H -2.872 -6.744 -6.658 1.00 . B B . 7 ARG HE 1 1 10 10984 2 2 7 ARG HG2 H -1.838 -5.626 -4.763 1.00 . B B . 7 ARG HG2 1 1 10 10985 2 2 7 ARG HG3 H -1.990 -6.421 -3.194 1.00 . B B . 7 ARG HG3 1 1 10 10986 2 2 7 ARG HH11 H -2.524 -10.027 -5.554 1.00 . B B . 7 ARG HH11 1 1 10 10987 2 2 7 ARG HH12 H -2.987 -10.724 -7.070 1.00 . B B . 7 ARG HH12 1 1 10 10988 2 2 7 ARG HH21 H -3.482 -7.649 -8.660 1.00 . B B . 7 ARG HH21 1 1 10 10989 2 2 7 ARG HH22 H -3.529 -9.372 -8.837 1.00 . B B . 7 ARG HH22 1 1 10 10990 2 2 7 ARG N N -5.376 -4.038 -3.563 1.00 . B B . 7 ARG N 1 1 10 10991 2 2 7 ARG NE N -2.749 -7.631 -6.262 1.00 . B B . 7 ARG NE 1 1 10 10992 2 2 7 ARG NH1 N -2.816 -9.917 -6.504 1.00 . B B . 7 ARG NH1 1 1 10 10993 2 2 7 ARG NH2 N -3.361 -8.564 -8.274 1.00 . B B . 7 ARG NH2 1 1 10 10994 2 2 7 ARG O O -3.240 -3.192 -5.365 1.00 . B B . 7 ARG O 1 1 10 10995 2 2 8 ARG C C -0.580 -2.550 -5.401 1.00 . B B . 8 ARG C 1 1 10 10996 2 2 8 ARG CA C -1.085 -2.064 -4.042 1.00 . B B . 8 ARG CA 1 1 10 10997 2 2 8 ARG CB C 0.097 -1.855 -3.089 1.00 . B B . 8 ARG CB 1 1 10 10998 2 2 8 ARG CD C -0.042 -2.923 -0.814 1.00 . B B . 8 ARG CD 1 1 10 10999 2 2 8 ARG CG C 0.441 -3.076 -2.247 1.00 . B B . 8 ARG CG 1 1 10 11000 2 2 8 ARG CZ C -0.901 -4.395 0.955 1.00 . B B . 8 ARG CZ 1 1 10 11001 2 2 8 ARG H H -1.947 -3.266 -2.529 1.00 . B B . 8 ARG H 1 1 10 11002 2 2 8 ARG HA H -1.591 -1.120 -4.180 1.00 . B B . 8 ARG HA 1 1 10 11003 2 2 8 ARG HB2 H 0.968 -1.597 -3.671 1.00 . B B . 8 ARG HB2 1 1 10 11004 2 2 8 ARG HB3 H -0.133 -1.038 -2.421 1.00 . B B . 8 ARG HB3 1 1 10 11005 2 2 8 ARG HD2 H 0.670 -2.320 -0.270 1.00 . B B . 8 ARG HD2 1 1 10 11006 2 2 8 ARG HD3 H -1.000 -2.428 -0.820 1.00 . B B . 8 ARG HD3 1 1 10 11007 2 2 8 ARG HE H 0.282 -4.982 -0.539 1.00 . B B . 8 ARG HE 1 1 10 11008 2 2 8 ARG HG2 H -0.030 -3.945 -2.679 1.00 . B B . 8 ARG HG2 1 1 10 11009 2 2 8 ARG HG3 H 1.510 -3.206 -2.245 1.00 . B B . 8 ARG HG3 1 1 10 11010 2 2 8 ARG HH11 H -1.461 -2.458 1.107 1.00 . B B . 8 ARG HH11 1 1 10 11011 2 2 8 ARG HH12 H -2.067 -3.506 2.345 1.00 . B B . 8 ARG HH12 1 1 10 11012 2 2 8 ARG HH21 H -0.525 -6.377 1.083 1.00 . B B . 8 ARG HH21 1 1 10 11013 2 2 8 ARG HH22 H -1.542 -5.732 2.328 1.00 . B B . 8 ARG HH22 1 1 10 11014 2 2 8 ARG N N -2.045 -3.000 -3.468 1.00 . B B . 8 ARG N 1 1 10 11015 2 2 8 ARG NE N -0.179 -4.213 -0.145 1.00 . B B . 8 ARG NE 1 1 10 11016 2 2 8 ARG NH1 N -1.528 -3.369 1.513 1.00 . B B . 8 ARG NH1 1 1 10 11017 2 2 8 ARG NH2 N -0.997 -5.601 1.499 1.00 . B B . 8 ARG NH2 1 1 10 11018 2 2 8 ARG O O -0.833 -1.919 -6.428 1.00 . B B . 8 ARG O 1 1 10 11019 2 2 9 LYS C C 0.917 -5.741 -6.466 1.00 . B B . 9 LYS C 1 1 10 11020 2 2 9 LYS CA C 0.674 -4.240 -6.625 1.00 . B B . 9 LYS CA 1 1 10 11021 2 2 9 LYS CB C 1.979 -3.525 -6.987 1.00 . B B . 9 LYS CB 1 1 10 11022 2 2 9 LYS CD C 3.004 -1.436 -7.950 1.00 . B B . 9 LYS CD 1 1 10 11023 2 2 9 LYS CE C 3.155 -2.001 -9.354 1.00 . B B . 9 LYS CE 1 1 10 11024 2 2 9 LYS CG C 1.804 -2.034 -7.230 1.00 . B B . 9 LYS CG 1 1 10 11025 2 2 9 LYS H H 0.288 -4.138 -4.551 1.00 . B B . 9 LYS H 1 1 10 11026 2 2 9 LYS HA H -0.046 -4.081 -7.413 1.00 . B B . 9 LYS HA 1 1 10 11027 2 2 9 LYS HB2 H 2.681 -3.655 -6.175 1.00 . B B . 9 LYS HB2 1 1 10 11028 2 2 9 LYS HB3 H 2.388 -3.968 -7.879 1.00 . B B . 9 LYS HB3 1 1 10 11029 2 2 9 LYS HD2 H 2.874 -0.365 -8.017 1.00 . B B . 9 LYS HD2 1 1 10 11030 2 2 9 LYS HD3 H 3.898 -1.656 -7.386 1.00 . B B . 9 LYS HD3 1 1 10 11031 2 2 9 LYS HE2 H 3.351 -3.060 -9.285 1.00 . B B . 9 LYS HE2 1 1 10 11032 2 2 9 LYS HE3 H 2.234 -1.840 -9.895 1.00 . B B . 9 LYS HE3 1 1 10 11033 2 2 9 LYS HG2 H 0.923 -1.879 -7.835 1.00 . B B . 9 LYS HG2 1 1 10 11034 2 2 9 LYS HG3 H 1.682 -1.536 -6.280 1.00 . B B . 9 LYS HG3 1 1 10 11035 2 2 9 LYS HZ1 H 4.355 -1.766 -11.049 1.00 . B B . 9 LYS HZ1 1 1 10 11036 2 2 9 LYS HZ2 H 5.170 -1.496 -9.590 1.00 . B B . 9 LYS HZ2 1 1 10 11037 2 2 9 LYS HZ3 H 4.098 -0.333 -10.188 1.00 . B B . 9 LYS HZ3 1 1 10 11038 2 2 9 LYS N N 0.128 -3.676 -5.398 1.00 . B B . 9 LYS N 1 1 10 11039 2 2 9 LYS NZ N 4.272 -1.354 -10.097 1.00 . B B . 9 LYS NZ 1 1 10 11040 2 2 9 LYS O O 0.438 -6.353 -5.513 1.00 . B B . 9 LYS O 1 1 10 11041 2 2 10 ARG C C 2.371 -8.204 -5.956 1.00 . B B . 10 ARG C 1 1 10 11042 2 2 10 ARG CA C 1.963 -7.763 -7.360 1.00 . B B . 10 ARG CA 1 1 10 11043 2 2 10 ARG CB C 3.088 -8.089 -8.342 1.00 . B B . 10 ARG CB 1 1 10 11044 2 2 10 ARG CD C 5.526 -7.859 -8.904 1.00 . B B . 10 ARG CD 1 1 10 11045 2 2 10 ARG CG C 4.380 -7.342 -8.051 1.00 . B B . 10 ARG CG 1 1 10 11046 2 2 10 ARG CZ C 6.727 -9.968 -9.297 1.00 . B B . 10 ARG CZ 1 1 10 11047 2 2 10 ARG H H 2.003 -5.801 -8.149 1.00 . B B . 10 ARG H 1 1 10 11048 2 2 10 ARG HA H 1.075 -8.302 -7.651 1.00 . B B . 10 ARG HA 1 1 10 11049 2 2 10 ARG HB2 H 3.292 -9.149 -8.300 1.00 . B B . 10 ARG HB2 1 1 10 11050 2 2 10 ARG HB3 H 2.766 -7.832 -9.340 1.00 . B B . 10 ARG HB3 1 1 10 11051 2 2 10 ARG HD2 H 5.270 -7.726 -9.946 1.00 . B B . 10 ARG HD2 1 1 10 11052 2 2 10 ARG HD3 H 6.413 -7.287 -8.676 1.00 . B B . 10 ARG HD3 1 1 10 11053 2 2 10 ARG HE H 5.251 -9.724 -7.978 1.00 . B B . 10 ARG HE 1 1 10 11054 2 2 10 ARG HG2 H 4.232 -6.293 -8.260 1.00 . B B . 10 ARG HG2 1 1 10 11055 2 2 10 ARG HG3 H 4.631 -7.472 -7.007 1.00 . B B . 10 ARG HG3 1 1 10 11056 2 2 10 ARG HH11 H 7.342 -8.418 -10.438 1.00 . B B . 10 ARG HH11 1 1 10 11057 2 2 10 ARG HH12 H 8.181 -9.910 -10.701 1.00 . B B . 10 ARG HH12 1 1 10 11058 2 2 10 ARG HH21 H 6.347 -11.693 -8.316 1.00 . B B . 10 ARG HH21 1 1 10 11059 2 2 10 ARG HH22 H 7.615 -11.774 -9.493 1.00 . B B . 10 ARG HH22 1 1 10 11060 2 2 10 ARG N N 1.658 -6.334 -7.404 1.00 . B B . 10 ARG N 1 1 10 11061 2 2 10 ARG NE N 5.795 -9.272 -8.657 1.00 . B B . 10 ARG NE 1 1 10 11062 2 2 10 ARG NH1 N 7.478 -9.384 -10.221 1.00 . B B . 10 ARG NH1 1 1 10 11063 2 2 10 ARG NH2 N 6.912 -11.250 -9.012 1.00 . B B . 10 ARG NH2 1 1 10 11064 2 2 10 ARG O O 2.166 -9.355 -5.571 1.00 . B B . 10 ARG O 1 1 10 11065 2 2 11 LYS C C 4.687 -8.372 -3.844 1.00 . B B . 11 LYS C 1 1 10 11066 2 2 11 LYS CA C 3.398 -7.557 -3.836 1.00 . B B . 11 LYS CA 1 1 10 11067 2 2 11 LYS CB C 2.321 -8.301 -3.045 1.00 . B B . 11 LYS CB 1 1 10 11068 2 2 11 LYS CD C 0.040 -8.113 -2.024 1.00 . B B . 11 LYS CD 1 1 10 11069 2 2 11 LYS CE C -0.155 -9.621 -2.002 1.00 . B B . 11 LYS CE 1 1 10 11070 2 2 11 LYS CG C 0.940 -7.684 -3.168 1.00 . B B . 11 LYS CG 1 1 10 11071 2 2 11 LYS H H 3.082 -6.379 -5.564 1.00 . B B . 11 LYS H 1 1 10 11072 2 2 11 LYS HA H 3.593 -6.610 -3.357 1.00 . B B . 11 LYS HA 1 1 10 11073 2 2 11 LYS HB2 H 2.269 -9.321 -3.396 1.00 . B B . 11 LYS HB2 1 1 10 11074 2 2 11 LYS HB3 H 2.597 -8.304 -2.001 1.00 . B B . 11 LYS HB3 1 1 10 11075 2 2 11 LYS HD2 H 0.491 -7.804 -1.094 1.00 . B B . 11 LYS HD2 1 1 10 11076 2 2 11 LYS HD3 H -0.921 -7.636 -2.135 1.00 . B B . 11 LYS HD3 1 1 10 11077 2 2 11 LYS HE2 H 0.809 -10.095 -1.890 1.00 . B B . 11 LYS HE2 1 1 10 11078 2 2 11 LYS HE3 H -0.781 -9.878 -1.160 1.00 . B B . 11 LYS HE3 1 1 10 11079 2 2 11 LYS HG2 H 1.033 -6.608 -3.158 1.00 . B B . 11 LYS HG2 1 1 10 11080 2 2 11 LYS HG3 H 0.498 -8.002 -4.100 1.00 . B B . 11 LYS HG3 1 1 10 11081 2 2 11 LYS HZ1 H -0.217 -9.856 -4.077 1.00 . B B . 11 LYS HZ1 1 1 10 11082 2 2 11 LYS HZ2 H -1.741 -9.698 -3.358 1.00 . B B . 11 LYS HZ2 1 1 10 11083 2 2 11 LYS HZ3 H -0.888 -11.152 -3.221 1.00 . B B . 11 LYS HZ3 1 1 10 11084 2 2 11 LYS N N 2.951 -7.277 -5.198 1.00 . B B . 11 LYS N 1 1 10 11085 2 2 11 LYS NZ N -0.795 -10.117 -3.253 1.00 . B B . 11 LYS NZ 1 1 10 11086 2 2 11 LYS O O 4.669 -9.583 -4.068 1.00 . B B . 11 LYS O 1 1 10 11087 2 2 12 ALA C C 7.185 -9.381 -2.449 1.00 . B B . 12 ALA C 1 1 10 11088 2 2 12 ALA CA C 7.106 -8.353 -3.573 1.00 . B B . 12 ALA CA 1 1 10 11089 2 2 12 ALA CB C 8.213 -7.321 -3.421 1.00 . B B . 12 ALA CB 1 1 10 11090 2 2 12 ALA H H 5.749 -6.734 -3.427 1.00 . B B . 12 ALA H 1 1 10 11091 2 2 12 ALA HA H 7.243 -8.857 -4.519 1.00 . B B . 12 ALA HA 1 1 10 11092 2 2 12 ALA HB1 H 8.097 -6.555 -4.173 1.00 . B B . 12 ALA HB1 1 1 10 11093 2 2 12 ALA HB2 H 9.172 -7.802 -3.541 1.00 . B B . 12 ALA HB2 1 1 10 11094 2 2 12 ALA HB3 H 8.154 -6.875 -2.439 1.00 . B B . 12 ALA HB3 1 1 10 11095 2 2 12 ALA N N 5.803 -7.697 -3.598 1.00 . B B . 12 ALA N 1 1 10 11096 2 2 12 ALA O O 7.977 -10.320 -2.510 1.00 . B B . 12 ALA O 1 1 10 11097 2 2 13 ASP C C 5.049 -10.929 -0.274 1.00 . B B . 13 ASP C 1 1 10 11098 2 2 13 ASP CA C 6.335 -10.108 -0.287 1.00 . B B . 13 ASP CA 1 1 10 11099 2 2 13 ASP CB C 6.473 -9.328 1.023 1.00 . B B . 13 ASP CB 1 1 10 11100 2 2 13 ASP CG C 6.451 -10.230 2.241 1.00 . B B . 13 ASP CG 1 1 10 11101 2 2 13 ASP H H 5.747 -8.430 -1.433 1.00 . B B . 13 ASP H 1 1 10 11102 2 2 13 ASP HA H 7.175 -10.780 -0.386 1.00 . B B . 13 ASP HA 1 1 10 11103 2 2 13 ASP HB2 H 7.410 -8.789 1.016 1.00 . B B . 13 ASP HB2 1 1 10 11104 2 2 13 ASP HB3 H 5.659 -8.624 1.103 1.00 . B B . 13 ASP HB3 1 1 10 11105 2 2 13 ASP N N 6.358 -9.197 -1.425 1.00 . B B . 13 ASP N 1 1 10 11106 2 2 13 ASP O O 4.296 -10.907 0.699 1.00 . B B . 13 ASP O 1 1 10 11107 2 2 13 ASP OD1 O 7.488 -10.861 2.531 1.00 . B B . 13 ASP OD1 1 1 10 11108 2 2 13 ASP OD2 O 5.395 -10.305 2.904 1.00 . B B . 13 ASP OD2 1 1 10 11109 2 2 14 SER C C 3.760 -13.767 -0.667 1.00 . B B . 14 SER C 1 1 10 11110 2 2 14 SER CA C 3.612 -12.484 -1.478 1.00 . B B . 14 SER CA 1 1 10 11111 2 2 14 SER CB C 3.344 -12.820 -2.946 1.00 . B B . 14 SER CB 1 1 10 11112 2 2 14 SER H H 5.446 -11.632 -2.104 1.00 . B B . 14 SER H 1 1 10 11113 2 2 14 SER HA H 2.779 -11.920 -1.089 1.00 . B B . 14 SER HA 1 1 10 11114 2 2 14 SER HB2 H 3.193 -11.905 -3.500 1.00 . B B . 14 SER HB2 1 1 10 11115 2 2 14 SER HB3 H 4.191 -13.352 -3.353 1.00 . B B . 14 SER HB3 1 1 10 11116 2 2 14 SER HG H 1.862 -13.573 -3.981 1.00 . B B . 14 SER HG 1 1 10 11117 2 2 14 SER N N 4.806 -11.654 -1.362 1.00 . B B . 14 SER N 1 1 10 11118 2 2 14 SER O O 4.264 -14.765 -1.225 1.00 . B B . 14 SER O 1 1 10 11119 2 2 14 SER OXT O 3.371 -13.763 0.520 1.00 . B B . 14 SER OXT 1 1 10 11120 2 2 14 SER OG O 2.188 -13.628 -3.080 1.00 . B B . 14 SER OG 1 1 11 11121 1 1 1 GLY C C 10.740 3.917 -6.469 1.00 . A A . 1 GLY C 1 1 11 11122 1 1 1 GLY CA C 10.123 2.632 -6.992 1.00 . A A . 1 GLY CA 1 1 11 11123 1 1 1 GLY H1 H 8.505 2.474 -5.678 1.00 . A A . 1 GLY H1 1 1 11 11124 1 1 1 GLY H2 H 8.266 1.688 -7.155 1.00 . A A . 1 GLY H2 1 1 11 11125 1 1 1 GLY H3 H 8.172 3.374 -7.071 1.00 . A A . 1 GLY H3 1 1 11 11126 1 1 1 GLY HA2 H 10.625 1.791 -6.537 1.00 . A A . 1 GLY HA2 1 1 11 11127 1 1 1 GLY HA3 H 10.269 2.587 -8.061 1.00 . A A . 1 GLY HA3 1 1 11 11128 1 1 1 GLY N N 8.664 2.535 -6.703 1.00 . A A . 1 GLY N 1 1 11 11129 1 1 1 GLY O O 11.657 4.462 -7.083 1.00 . A A . 1 GLY O 1 1 11 11130 1 1 2 SER C C 9.944 6.028 -3.503 1.00 . A A . 2 SER C 1 1 11 11131 1 1 2 SER CA C 10.753 5.632 -4.731 1.00 . A A . 2 SER CA 1 1 11 11132 1 1 2 SER CB C 10.734 6.767 -5.754 1.00 . A A . 2 SER CB 1 1 11 11133 1 1 2 SER H H 9.525 3.908 -4.879 1.00 . A A . 2 SER H 1 1 11 11134 1 1 2 SER HA H 11.770 5.456 -4.423 1.00 . A A . 2 SER HA 1 1 11 11135 1 1 2 SER HB2 H 11.444 6.554 -6.537 1.00 . A A . 2 SER HB2 1 1 11 11136 1 1 2 SER HB3 H 9.744 6.848 -6.179 1.00 . A A . 2 SER HB3 1 1 11 11137 1 1 2 SER HG H 12.003 8.194 -5.315 1.00 . A A . 2 SER HG 1 1 11 11138 1 1 2 SER N N 10.244 4.397 -5.330 1.00 . A A . 2 SER N 1 1 11 11139 1 1 2 SER O O 10.475 6.623 -2.567 1.00 . A A . 2 SER O 1 1 11 11140 1 1 2 SER OG O 11.077 8.004 -5.153 1.00 . A A . 2 SER OG 1 1 11 11141 1 1 3 GLN C C 7.813 4.893 -1.365 1.00 . A A . 3 GLN C 1 1 11 11142 1 1 3 GLN CA C 7.792 6.015 -2.389 1.00 . A A . 3 GLN CA 1 1 11 11143 1 1 3 GLN CB C 6.367 6.255 -2.872 1.00 . A A . 3 GLN CB 1 1 11 11144 1 1 3 GLN CD C 6.410 8.778 -3.017 1.00 . A A . 3 GLN CD 1 1 11 11145 1 1 3 GLN CG C 6.221 7.474 -3.768 1.00 . A A . 3 GLN CG 1 1 11 11146 1 1 3 GLN H H 8.283 5.236 -4.286 1.00 . A A . 3 GLN H 1 1 11 11147 1 1 3 GLN HA H 8.157 6.911 -1.931 1.00 . A A . 3 GLN HA 1 1 11 11148 1 1 3 GLN HB2 H 6.049 5.393 -3.423 1.00 . A A . 3 GLN HB2 1 1 11 11149 1 1 3 GLN HB3 H 5.723 6.384 -2.014 1.00 . A A . 3 GLN HB3 1 1 11 11150 1 1 3 GLN HE21 H 5.187 9.709 -4.277 1.00 . A A . 3 GLN HE21 1 1 11 11151 1 1 3 GLN HE22 H 5.855 10.686 -3.019 1.00 . A A . 3 GLN HE22 1 1 11 11152 1 1 3 GLN HG2 H 6.961 7.419 -4.554 1.00 . A A . 3 GLN HG2 1 1 11 11153 1 1 3 GLN HG3 H 5.233 7.468 -4.205 1.00 . A A . 3 GLN HG3 1 1 11 11154 1 1 3 GLN N N 8.659 5.697 -3.509 1.00 . A A . 3 GLN N 1 1 11 11155 1 1 3 GLN NE2 N 5.751 9.830 -3.485 1.00 . A A . 3 GLN NE2 1 1 11 11156 1 1 3 GLN O O 7.850 3.713 -1.719 1.00 . A A . 3 GLN O 1 1 11 11157 1 1 3 GLN OE1 O 7.140 8.839 -2.028 1.00 . A A . 3 GLN OE1 1 1 11 11158 1 1 4 VAL C C 6.381 3.906 1.362 1.00 . A A . 4 VAL C 1 1 11 11159 1 1 4 VAL CA C 7.802 4.299 0.989 1.00 . A A . 4 VAL CA 1 1 11 11160 1 1 4 VAL CB C 8.524 4.860 2.229 1.00 . A A . 4 VAL CB 1 1 11 11161 1 1 4 VAL CG1 C 7.820 6.107 2.744 1.00 . A A . 4 VAL CG1 1 1 11 11162 1 1 4 VAL CG2 C 8.621 3.804 3.317 1.00 . A A . 4 VAL CG2 1 1 11 11163 1 1 4 VAL H H 7.743 6.216 0.122 1.00 . A A . 4 VAL H 1 1 11 11164 1 1 4 VAL HA H 8.334 3.422 0.649 1.00 . A A . 4 VAL HA 1 1 11 11165 1 1 4 VAL HB H 9.526 5.138 1.938 1.00 . A A . 4 VAL HB 1 1 11 11166 1 1 4 VAL HG11 H 7.818 6.864 1.973 1.00 . A A . 4 VAL HG11 1 1 11 11167 1 1 4 VAL HG12 H 8.340 6.480 3.614 1.00 . A A . 4 VAL HG12 1 1 11 11168 1 1 4 VAL HG13 H 6.803 5.862 3.011 1.00 . A A . 4 VAL HG13 1 1 11 11169 1 1 4 VAL HG21 H 9.647 3.715 3.643 1.00 . A A . 4 VAL HG21 1 1 11 11170 1 1 4 VAL HG22 H 8.284 2.854 2.929 1.00 . A A . 4 VAL HG22 1 1 11 11171 1 1 4 VAL HG23 H 8.002 4.092 4.155 1.00 . A A . 4 VAL HG23 1 1 11 11172 1 1 4 VAL N N 7.786 5.266 -0.093 1.00 . A A . 4 VAL N 1 1 11 11173 1 1 4 VAL O O 6.017 3.883 2.536 1.00 . A A . 4 VAL O 1 1 11 11174 1 1 5 PHE C C 3.515 2.932 -0.784 1.00 . A A . 5 PHE C 1 1 11 11175 1 1 5 PHE CA C 4.198 3.218 0.555 1.00 . A A . 5 PHE CA 1 1 11 11176 1 1 5 PHE CB C 3.462 4.328 1.304 1.00 . A A . 5 PHE CB 1 1 11 11177 1 1 5 PHE CD1 C 3.115 5.983 -0.549 1.00 . A A . 5 PHE CD1 1 1 11 11178 1 1 5 PHE CD2 C 4.367 6.667 1.362 1.00 . A A . 5 PHE CD2 1 1 11 11179 1 1 5 PHE CE1 C 3.289 7.232 -1.114 1.00 . A A . 5 PHE CE1 1 1 11 11180 1 1 5 PHE CE2 C 4.545 7.918 0.802 1.00 . A A . 5 PHE CE2 1 1 11 11181 1 1 5 PHE CG C 3.652 5.687 0.694 1.00 . A A . 5 PHE CG 1 1 11 11182 1 1 5 PHE CZ C 4.005 8.201 -0.438 1.00 . A A . 5 PHE CZ 1 1 11 11183 1 1 5 PHE H H 5.931 3.635 -0.564 1.00 . A A . 5 PHE H 1 1 11 11184 1 1 5 PHE HA H 4.192 2.315 1.161 1.00 . A A . 5 PHE HA 1 1 11 11185 1 1 5 PHE HB2 H 2.410 4.112 1.312 1.00 . A A . 5 PHE HB2 1 1 11 11186 1 1 5 PHE HB3 H 3.825 4.366 2.321 1.00 . A A . 5 PHE HB3 1 1 11 11187 1 1 5 PHE HD1 H 2.555 5.226 -1.078 1.00 . A A . 5 PHE HD1 1 1 11 11188 1 1 5 PHE HD2 H 4.791 6.448 2.331 1.00 . A A . 5 PHE HD2 1 1 11 11189 1 1 5 PHE HE1 H 2.866 7.450 -2.084 1.00 . A A . 5 PHE HE1 1 1 11 11190 1 1 5 PHE HE2 H 5.105 8.674 1.332 1.00 . A A . 5 PHE HE2 1 1 11 11191 1 1 5 PHE HZ H 4.143 9.177 -0.878 1.00 . A A . 5 PHE HZ 1 1 11 11192 1 1 5 PHE N N 5.581 3.604 0.347 1.00 . A A . 5 PHE N 1 1 11 11193 1 1 5 PHE O O 4.079 3.185 -1.848 1.00 . A A . 5 PHE O 1 1 11 11194 1 1 6 GLU C C 0.042 2.123 -1.569 1.00 . A A . 6 GLU C 1 1 11 11195 1 1 6 GLU CA C 1.531 2.057 -1.901 1.00 . A A . 6 GLU CA 1 1 11 11196 1 1 6 GLU CB C 1.934 0.655 -2.378 1.00 . A A . 6 GLU CB 1 1 11 11197 1 1 6 GLU CD C -0.231 0.065 -3.558 1.00 . A A . 6 GLU CD 1 1 11 11198 1 1 6 GLU CG C 1.273 0.212 -3.674 1.00 . A A . 6 GLU CG 1 1 11 11199 1 1 6 GLU H H 1.886 2.275 0.148 1.00 . A A . 6 GLU H 1 1 11 11200 1 1 6 GLU HA H 1.755 2.777 -2.674 1.00 . A A . 6 GLU HA 1 1 11 11201 1 1 6 GLU HB2 H 3.002 0.645 -2.533 1.00 . A A . 6 GLU HB2 1 1 11 11202 1 1 6 GLU HB3 H 1.688 -0.065 -1.606 1.00 . A A . 6 GLU HB3 1 1 11 11203 1 1 6 GLU HG2 H 1.487 0.944 -4.439 1.00 . A A . 6 GLU HG2 1 1 11 11204 1 1 6 GLU HG3 H 1.693 -0.739 -3.963 1.00 . A A . 6 GLU HG3 1 1 11 11205 1 1 6 GLU N N 2.298 2.403 -0.719 1.00 . A A . 6 GLU N 1 1 11 11206 1 1 6 GLU O O -0.409 1.505 -0.608 1.00 . A A . 6 GLU O 1 1 11 11207 1 1 6 GLU OE1 O -0.687 -0.819 -2.802 1.00 . A A . 6 GLU OE1 1 1 11 11208 1 1 6 GLU OE2 O -0.951 0.839 -4.218 1.00 . A A . 6 GLU OE2 1 1 11 11209 1 1 7 TYR C C -2.950 1.882 -2.781 1.00 . A A . 7 TYR C 1 1 11 11210 1 1 7 TYR CA C -2.147 2.988 -2.119 1.00 . A A . 7 TYR CA 1 1 11 11211 1 1 7 TYR CB C -2.634 4.349 -2.615 1.00 . A A . 7 TYR CB 1 1 11 11212 1 1 7 TYR CD1 C -1.293 4.903 -4.687 1.00 . A A . 7 TYR CD1 1 1 11 11213 1 1 7 TYR CD2 C -3.607 4.384 -4.944 1.00 . A A . 7 TYR CD2 1 1 11 11214 1 1 7 TYR CE1 C -1.180 5.089 -6.052 1.00 . A A . 7 TYR CE1 1 1 11 11215 1 1 7 TYR CE2 C -3.500 4.567 -6.310 1.00 . A A . 7 TYR CE2 1 1 11 11216 1 1 7 TYR CG C -2.507 4.547 -4.111 1.00 . A A . 7 TYR CG 1 1 11 11217 1 1 7 TYR CZ C -2.286 4.919 -6.858 1.00 . A A . 7 TYR CZ 1 1 11 11218 1 1 7 TYR H H -0.334 3.311 -3.134 1.00 . A A . 7 TYR H 1 1 11 11219 1 1 7 TYR HA H -2.301 2.931 -1.061 1.00 . A A . 7 TYR HA 1 1 11 11220 1 1 7 TYR HB2 H -3.670 4.454 -2.362 1.00 . A A . 7 TYR HB2 1 1 11 11221 1 1 7 TYR HB3 H -2.067 5.127 -2.126 1.00 . A A . 7 TYR HB3 1 1 11 11222 1 1 7 TYR HD1 H -0.430 5.034 -4.053 1.00 . A A . 7 TYR HD1 1 1 11 11223 1 1 7 TYR HD2 H -4.557 4.109 -4.512 1.00 . A A . 7 TYR HD2 1 1 11 11224 1 1 7 TYR HE1 H -0.228 5.364 -6.482 1.00 . A A . 7 TYR HE1 1 1 11 11225 1 1 7 TYR HE2 H -4.367 4.434 -6.940 1.00 . A A . 7 TYR HE2 1 1 11 11226 1 1 7 TYR HH H -1.379 4.675 -8.536 1.00 . A A . 7 TYR HH 1 1 11 11227 1 1 7 TYR N N -0.726 2.850 -2.370 1.00 . A A . 7 TYR N 1 1 11 11228 1 1 7 TYR O O -3.201 1.931 -3.981 1.00 . A A . 7 TYR O 1 1 11 11229 1 1 7 TYR OH O -2.177 5.103 -8.217 1.00 . A A . 7 TYR OH 1 1 11 11230 1 1 8 ALA C C -5.642 0.189 -2.520 1.00 . A A . 8 ALA C 1 1 11 11231 1 1 8 ALA CA C -4.176 -0.205 -2.522 1.00 . A A . 8 ALA CA 1 1 11 11232 1 1 8 ALA CB C -3.955 -1.474 -1.710 1.00 . A A . 8 ALA CB 1 1 11 11233 1 1 8 ALA H H -3.175 0.923 -1.016 1.00 . A A . 8 ALA H 1 1 11 11234 1 1 8 ALA HA H -3.860 -0.387 -3.533 1.00 . A A . 8 ALA HA 1 1 11 11235 1 1 8 ALA HB1 H -4.077 -2.337 -2.348 1.00 . A A . 8 ALA HB1 1 1 11 11236 1 1 8 ALA HB2 H -4.673 -1.516 -0.906 1.00 . A A . 8 ALA HB2 1 1 11 11237 1 1 8 ALA HB3 H -2.956 -1.471 -1.297 1.00 . A A . 8 ALA HB3 1 1 11 11238 1 1 8 ALA N N -3.385 0.899 -1.986 1.00 . A A . 8 ALA N 1 1 11 11239 1 1 8 ALA O O -6.478 -0.475 -1.918 1.00 . A A . 8 ALA O 1 1 11 11240 1 1 9 GLU C C -7.904 1.716 -4.662 1.00 . A A . 9 GLU C 1 1 11 11241 1 1 9 GLU CA C -7.267 1.844 -3.296 1.00 . A A . 9 GLU CA 1 1 11 11242 1 1 9 GLU CB C -7.162 3.302 -2.833 1.00 . A A . 9 GLU CB 1 1 11 11243 1 1 9 GLU CD C -7.443 4.564 -5.011 1.00 . A A . 9 GLU CD 1 1 11 11244 1 1 9 GLU CG C -7.975 4.320 -3.610 1.00 . A A . 9 GLU CG 1 1 11 11245 1 1 9 GLU H H -5.216 1.715 -3.734 1.00 . A A . 9 GLU H 1 1 11 11246 1 1 9 GLU HA H -7.902 1.318 -2.612 1.00 . A A . 9 GLU HA 1 1 11 11247 1 1 9 GLU HB2 H -7.479 3.352 -1.803 1.00 . A A . 9 GLU HB2 1 1 11 11248 1 1 9 GLU HB3 H -6.123 3.599 -2.884 1.00 . A A . 9 GLU HB3 1 1 11 11249 1 1 9 GLU HG2 H -8.985 3.963 -3.677 1.00 . A A . 9 GLU HG2 1 1 11 11250 1 1 9 GLU HG3 H -7.957 5.250 -3.071 1.00 . A A . 9 GLU HG3 1 1 11 11251 1 1 9 GLU N N -5.931 1.275 -3.230 1.00 . A A . 9 GLU N 1 1 11 11252 1 1 9 GLU O O -7.242 1.715 -5.699 1.00 . A A . 9 GLU O 1 1 11 11253 1 1 9 GLU OE1 O -6.430 5.281 -5.142 1.00 . A A . 9 GLU OE1 1 1 11 11254 1 1 9 GLU OE2 O -8.037 4.039 -5.974 1.00 . A A . 9 GLU OE2 1 1 11 11255 1 1 10 VAL C C -10.416 2.880 -6.289 1.00 . A A . 10 VAL C 1 1 11 11256 1 1 10 VAL CA C -10.031 1.498 -5.794 1.00 . A A . 10 VAL CA 1 1 11 11257 1 1 10 VAL CB C -11.289 0.680 -5.505 1.00 . A A . 10 VAL CB 1 1 11 11258 1 1 10 VAL CG1 C -12.120 0.521 -6.772 1.00 . A A . 10 VAL CG1 1 1 11 11259 1 1 10 VAL CG2 C -10.928 -0.672 -4.912 1.00 . A A . 10 VAL CG2 1 1 11 11260 1 1 10 VAL H H -9.659 1.610 -3.737 1.00 . A A . 10 VAL H 1 1 11 11261 1 1 10 VAL HA H -9.466 1.000 -6.540 1.00 . A A . 10 VAL HA 1 1 11 11262 1 1 10 VAL HB H -11.860 1.217 -4.775 1.00 . A A . 10 VAL HB 1 1 11 11263 1 1 10 VAL HG11 H -11.802 -0.364 -7.302 1.00 . A A . 10 VAL HG11 1 1 11 11264 1 1 10 VAL HG12 H -11.982 1.385 -7.402 1.00 . A A . 10 VAL HG12 1 1 11 11265 1 1 10 VAL HG13 H -13.164 0.430 -6.513 1.00 . A A . 10 VAL HG13 1 1 11 11266 1 1 10 VAL HG21 H -10.738 -1.377 -5.708 1.00 . A A . 10 VAL HG21 1 1 11 11267 1 1 10 VAL HG22 H -11.743 -1.029 -4.302 1.00 . A A . 10 VAL HG22 1 1 11 11268 1 1 10 VAL HG23 H -10.045 -0.571 -4.301 1.00 . A A . 10 VAL HG23 1 1 11 11269 1 1 10 VAL N N -9.219 1.613 -4.614 1.00 . A A . 10 VAL N 1 1 11 11270 1 1 10 VAL O O -10.482 3.131 -7.492 1.00 . A A . 10 VAL O 1 1 11 11271 1 1 11 ASP C C -10.393 6.143 -4.688 1.00 . A A . 11 ASP C 1 1 11 11272 1 1 11 ASP CA C -11.026 5.149 -5.663 1.00 . A A . 11 ASP CA 1 1 11 11273 1 1 11 ASP CB C -12.542 5.332 -5.644 1.00 . A A . 11 ASP CB 1 1 11 11274 1 1 11 ASP CG C -12.966 6.676 -6.201 1.00 . A A . 11 ASP CG 1 1 11 11275 1 1 11 ASP H H -10.657 3.485 -4.410 1.00 . A A . 11 ASP H 1 1 11 11276 1 1 11 ASP HA H -10.663 5.360 -6.656 1.00 . A A . 11 ASP HA 1 1 11 11277 1 1 11 ASP HB2 H -12.999 4.559 -6.235 1.00 . A A . 11 ASP HB2 1 1 11 11278 1 1 11 ASP HB3 H -12.894 5.258 -4.627 1.00 . A A . 11 ASP HB3 1 1 11 11279 1 1 11 ASP N N -10.673 3.772 -5.342 1.00 . A A . 11 ASP N 1 1 11 11280 1 1 11 ASP O O -9.971 7.227 -5.091 1.00 . A A . 11 ASP O 1 1 11 11281 1 1 11 ASP OD1 O -13.157 6.775 -7.432 1.00 . A A . 11 ASP OD1 1 1 11 11282 1 1 11 ASP OD2 O -13.107 7.629 -5.407 1.00 . A A . 11 ASP OD2 1 1 11 11283 1 1 12 GLU C C -9.204 5.947 -1.188 1.00 . A A . 12 GLU C 1 1 11 11284 1 1 12 GLU CA C -9.777 6.688 -2.394 1.00 . A A . 12 GLU CA 1 1 11 11285 1 1 12 GLU CB C -10.859 7.664 -1.931 1.00 . A A . 12 GLU CB 1 1 11 11286 1 1 12 GLU CD C -10.071 9.658 -3.271 1.00 . A A . 12 GLU CD 1 1 11 11287 1 1 12 GLU CG C -11.221 8.716 -2.968 1.00 . A A . 12 GLU CG 1 1 11 11288 1 1 12 GLU H H -10.576 4.861 -3.153 1.00 . A A . 12 GLU H 1 1 11 11289 1 1 12 GLU HA H -8.978 7.248 -2.856 1.00 . A A . 12 GLU HA 1 1 11 11290 1 1 12 GLU HB2 H -11.752 7.105 -1.691 1.00 . A A . 12 GLU HB2 1 1 11 11291 1 1 12 GLU HB3 H -10.514 8.169 -1.043 1.00 . A A . 12 GLU HB3 1 1 11 11292 1 1 12 GLU HG2 H -11.508 8.218 -3.883 1.00 . A A . 12 GLU HG2 1 1 11 11293 1 1 12 GLU HG3 H -12.054 9.296 -2.599 1.00 . A A . 12 GLU HG3 1 1 11 11294 1 1 12 GLU N N -10.323 5.777 -3.408 1.00 . A A . 12 GLU N 1 1 11 11295 1 1 12 GLU O O -9.584 4.820 -0.903 1.00 . A A . 12 GLU O 1 1 11 11296 1 1 12 GLU OE1 O -9.868 10.614 -2.495 1.00 . A A . 12 GLU OE1 1 1 11 11297 1 1 12 GLU OE2 O -9.375 9.439 -4.285 1.00 . A A . 12 GLU OE2 1 1 11 11298 1 1 13 ILE C C -7.826 7.005 1.889 1.00 . A A . 13 ILE C 1 1 11 11299 1 1 13 ILE CA C -7.668 6.038 0.711 1.00 . A A . 13 ILE CA 1 1 11 11300 1 1 13 ILE CB C -6.154 5.769 0.487 1.00 . A A . 13 ILE CB 1 1 11 11301 1 1 13 ILE CD1 C -5.696 7.781 -0.990 1.00 . A A . 13 ILE CD1 1 1 11 11302 1 1 13 ILE CG1 C -5.390 7.085 0.319 1.00 . A A . 13 ILE CG1 1 1 11 11303 1 1 13 ILE CG2 C -5.948 4.914 -0.744 1.00 . A A . 13 ILE CG2 1 1 11 11304 1 1 13 ILE H H -8.065 7.522 -0.747 1.00 . A A . 13 ILE H 1 1 11 11305 1 1 13 ILE HA H -8.163 5.095 0.932 1.00 . A A . 13 ILE HA 1 1 11 11306 1 1 13 ILE HB H -5.754 5.224 1.342 1.00 . A A . 13 ILE HB 1 1 11 11307 1 1 13 ILE HD11 H -4.778 7.961 -1.528 1.00 . A A . 13 ILE HD11 1 1 11 11308 1 1 13 ILE HD12 H -6.192 8.720 -0.793 1.00 . A A . 13 ILE HD12 1 1 11 11309 1 1 13 ILE HD13 H -6.346 7.148 -1.586 1.00 . A A . 13 ILE HD13 1 1 11 11310 1 1 13 ILE HG12 H -5.651 7.757 1.123 1.00 . A A . 13 ILE HG12 1 1 11 11311 1 1 13 ILE HG13 H -4.328 6.888 0.351 1.00 . A A . 13 ILE HG13 1 1 11 11312 1 1 13 ILE HG21 H -6.687 5.181 -1.480 1.00 . A A . 13 ILE HG21 1 1 11 11313 1 1 13 ILE HG22 H -6.039 3.872 -0.491 1.00 . A A . 13 ILE HG22 1 1 11 11314 1 1 13 ILE HG23 H -4.966 5.102 -1.143 1.00 . A A . 13 ILE HG23 1 1 11 11315 1 1 13 ILE N N -8.300 6.611 -0.477 1.00 . A A . 13 ILE N 1 1 11 11316 1 1 13 ILE O O -8.614 7.949 1.824 1.00 . A A . 13 ILE O 1 1 11 11317 1 1 14 VAL C C -5.771 7.580 4.836 1.00 . A A . 14 VAL C 1 1 11 11318 1 1 14 VAL CA C -7.119 7.617 4.137 1.00 . A A . 14 VAL CA 1 1 11 11319 1 1 14 VAL CB C -8.227 7.189 5.121 1.00 . A A . 14 VAL CB 1 1 11 11320 1 1 14 VAL CG1 C -8.190 8.042 6.382 1.00 . A A . 14 VAL CG1 1 1 11 11321 1 1 14 VAL CG2 C -9.590 7.281 4.453 1.00 . A A . 14 VAL CG2 1 1 11 11322 1 1 14 VAL H H -6.485 5.986 2.956 1.00 . A A . 14 VAL H 1 1 11 11323 1 1 14 VAL HA H -7.317 8.628 3.813 1.00 . A A . 14 VAL HA 1 1 11 11324 1 1 14 VAL HB H -8.056 6.160 5.402 1.00 . A A . 14 VAL HB 1 1 11 11325 1 1 14 VAL HG11 H -8.963 7.715 7.061 1.00 . A A . 14 VAL HG11 1 1 11 11326 1 1 14 VAL HG12 H -8.355 9.077 6.120 1.00 . A A . 14 VAL HG12 1 1 11 11327 1 1 14 VAL HG13 H -7.225 7.940 6.857 1.00 . A A . 14 VAL HG13 1 1 11 11328 1 1 14 VAL HG21 H -10.355 6.972 5.151 1.00 . A A . 14 VAL HG21 1 1 11 11329 1 1 14 VAL HG22 H -9.612 6.636 3.588 1.00 . A A . 14 VAL HG22 1 1 11 11330 1 1 14 VAL HG23 H -9.773 8.301 4.147 1.00 . A A . 14 VAL HG23 1 1 11 11331 1 1 14 VAL N N -7.079 6.763 2.957 1.00 . A A . 14 VAL N 1 1 11 11332 1 1 14 VAL O O -5.197 8.616 5.173 1.00 . A A . 14 VAL O 1 1 11 11333 1 1 15 GLU C C -2.924 5.893 4.613 1.00 . A A . 15 GLU C 1 1 11 11334 1 1 15 GLU CA C -3.978 6.172 5.679 1.00 . A A . 15 GLU CA 1 1 11 11335 1 1 15 GLU CB C -4.044 5.017 6.681 1.00 . A A . 15 GLU CB 1 1 11 11336 1 1 15 GLU CD C -5.102 4.089 8.781 1.00 . A A . 15 GLU CD 1 1 11 11337 1 1 15 GLU CG C -5.016 5.262 7.824 1.00 . A A . 15 GLU CG 1 1 11 11338 1 1 15 GLU H H -5.799 5.585 4.768 1.00 . A A . 15 GLU H 1 1 11 11339 1 1 15 GLU HA H -3.718 7.082 6.201 1.00 . A A . 15 GLU HA 1 1 11 11340 1 1 15 GLU HB2 H -4.353 4.122 6.161 1.00 . A A . 15 GLU HB2 1 1 11 11341 1 1 15 GLU HB3 H -3.062 4.860 7.099 1.00 . A A . 15 GLU HB3 1 1 11 11342 1 1 15 GLU HG2 H -4.692 6.132 8.375 1.00 . A A . 15 GLU HG2 1 1 11 11343 1 1 15 GLU HG3 H -5.999 5.444 7.412 1.00 . A A . 15 GLU HG3 1 1 11 11344 1 1 15 GLU N N -5.274 6.369 5.046 1.00 . A A . 15 GLU N 1 1 11 11345 1 1 15 GLU O O -3.223 5.308 3.579 1.00 . A A . 15 GLU O 1 1 11 11346 1 1 15 GLU OE1 O -4.244 3.994 9.683 1.00 . A A . 15 GLU OE1 1 1 11 11347 1 1 15 GLU OE2 O -6.029 3.267 8.630 1.00 . A A . 15 GLU OE2 1 1 11 11348 1 1 16 LYS C C 0.751 6.181 4.496 1.00 . A A . 16 LYS C 1 1 11 11349 1 1 16 LYS CA C -0.643 6.137 3.854 1.00 . A A . 16 LYS CA 1 1 11 11350 1 1 16 LYS CB C -0.725 7.182 2.742 1.00 . A A . 16 LYS CB 1 1 11 11351 1 1 16 LYS CD C -0.850 9.615 2.117 1.00 . A A . 16 LYS CD 1 1 11 11352 1 1 16 LYS CE C -0.923 11.040 2.637 1.00 . A A . 16 LYS CE 1 1 11 11353 1 1 16 LYS CG C -0.776 8.612 3.257 1.00 . A A . 16 LYS CG 1 1 11 11354 1 1 16 LYS H H -1.530 6.881 5.636 1.00 . A A . 16 LYS H 1 1 11 11355 1 1 16 LYS HA H -0.809 5.154 3.424 1.00 . A A . 16 LYS HA 1 1 11 11356 1 1 16 LYS HB2 H 0.140 7.082 2.105 1.00 . A A . 16 LYS HB2 1 1 11 11357 1 1 16 LYS HB3 H -1.615 7.002 2.160 1.00 . A A . 16 LYS HB3 1 1 11 11358 1 1 16 LYS HD2 H 0.032 9.511 1.502 1.00 . A A . 16 LYS HD2 1 1 11 11359 1 1 16 LYS HD3 H -1.730 9.409 1.526 1.00 . A A . 16 LYS HD3 1 1 11 11360 1 1 16 LYS HE2 H -0.054 11.233 3.248 1.00 . A A . 16 LYS HE2 1 1 11 11361 1 1 16 LYS HE3 H -0.928 11.717 1.795 1.00 . A A . 16 LYS HE3 1 1 11 11362 1 1 16 LYS HG2 H -1.649 8.728 3.881 1.00 . A A . 16 LYS HG2 1 1 11 11363 1 1 16 LYS HG3 H 0.112 8.808 3.839 1.00 . A A . 16 LYS HG3 1 1 11 11364 1 1 16 LYS HZ1 H -2.157 10.630 4.272 1.00 . A A . 16 LYS HZ1 1 1 11 11365 1 1 16 LYS HZ2 H -2.998 11.098 2.879 1.00 . A A . 16 LYS HZ2 1 1 11 11366 1 1 16 LYS HZ3 H -2.168 12.254 3.796 1.00 . A A . 16 LYS HZ3 1 1 11 11367 1 1 16 LYS N N -1.709 6.369 4.824 1.00 . A A . 16 LYS N 1 1 11 11368 1 1 16 LYS NZ N -2.147 11.272 3.453 1.00 . A A . 16 LYS NZ 1 1 11 11369 1 1 16 LYS O O 1.452 7.184 4.370 1.00 . A A . 16 LYS O 1 1 11 11370 1 1 17 ARG C C 3.051 3.704 5.960 1.00 . A A . 17 ARG C 1 1 11 11371 1 1 17 ARG CA C 2.486 5.113 5.818 1.00 . A A . 17 ARG CA 1 1 11 11372 1 1 17 ARG CB C 2.387 5.772 7.195 1.00 . A A . 17 ARG CB 1 1 11 11373 1 1 17 ARG CD C 3.465 6.239 9.409 1.00 . A A . 17 ARG CD 1 1 11 11374 1 1 17 ARG CG C 3.671 5.700 8.003 1.00 . A A . 17 ARG CG 1 1 11 11375 1 1 17 ARG CZ C 2.628 8.292 10.474 1.00 . A A . 17 ARG CZ 1 1 11 11376 1 1 17 ARG H H 0.600 4.312 5.231 1.00 . A A . 17 ARG H 1 1 11 11377 1 1 17 ARG HA H 3.155 5.695 5.202 1.00 . A A . 17 ARG HA 1 1 11 11378 1 1 17 ARG HB2 H 2.128 6.812 7.065 1.00 . A A . 17 ARG HB2 1 1 11 11379 1 1 17 ARG HB3 H 1.606 5.283 7.759 1.00 . A A . 17 ARG HB3 1 1 11 11380 1 1 17 ARG HD2 H 2.681 5.670 9.886 1.00 . A A . 17 ARG HD2 1 1 11 11381 1 1 17 ARG HD3 H 4.384 6.120 9.965 1.00 . A A . 17 ARG HD3 1 1 11 11382 1 1 17 ARG HE H 3.188 8.143 8.565 1.00 . A A . 17 ARG HE 1 1 11 11383 1 1 17 ARG HG2 H 3.992 4.671 8.066 1.00 . A A . 17 ARG HG2 1 1 11 11384 1 1 17 ARG HG3 H 4.430 6.289 7.509 1.00 . A A . 17 ARG HG3 1 1 11 11385 1 1 17 ARG HH11 H 2.716 6.680 11.689 1.00 . A A . 17 ARG HH11 1 1 11 11386 1 1 17 ARG HH12 H 2.133 8.134 12.427 1.00 . A A . 17 ARG HH12 1 1 11 11387 1 1 17 ARG HH21 H 2.421 10.065 9.525 1.00 . A A . 17 ARG HH21 1 1 11 11388 1 1 17 ARG HH22 H 1.965 10.060 11.196 1.00 . A A . 17 ARG HH22 1 1 11 11389 1 1 17 ARG N N 1.168 5.113 5.177 1.00 . A A . 17 ARG N 1 1 11 11390 1 1 17 ARG NE N 3.090 7.650 9.406 1.00 . A A . 17 ARG NE 1 1 11 11391 1 1 17 ARG NH1 N 2.480 7.649 11.623 1.00 . A A . 17 ARG NH1 1 1 11 11392 1 1 17 ARG NH2 N 2.312 9.577 10.392 1.00 . A A . 17 ARG NH2 1 1 11 11393 1 1 17 ARG O O 2.796 3.038 6.963 1.00 . A A . 17 ARG O 1 1 11 11394 1 1 18 GLY C C 5.636 1.668 4.309 1.00 . A A . 18 GLY C 1 1 11 11395 1 1 18 GLY CA C 4.355 1.896 5.078 1.00 . A A . 18 GLY CA 1 1 11 11396 1 1 18 GLY H H 4.014 3.794 4.184 1.00 . A A . 18 GLY H 1 1 11 11397 1 1 18 GLY HA2 H 4.543 1.684 6.119 1.00 . A A . 18 GLY HA2 1 1 11 11398 1 1 18 GLY HA3 H 3.620 1.205 4.721 1.00 . A A . 18 GLY HA3 1 1 11 11399 1 1 18 GLY N N 3.812 3.234 4.970 1.00 . A A . 18 GLY N 1 1 11 11400 1 1 18 GLY O O 6.584 2.447 4.390 1.00 . A A . 18 GLY O 1 1 11 11401 1 1 19 LYS C C 6.371 0.144 1.284 1.00 . A A . 19 LYS C 1 1 11 11402 1 1 19 LYS CA C 6.774 0.152 2.766 1.00 . A A . 19 LYS CA 1 1 11 11403 1 1 19 LYS CB C 7.203 -1.222 3.256 1.00 . A A . 19 LYS CB 1 1 11 11404 1 1 19 LYS CD C 8.102 -2.574 5.138 1.00 . A A . 19 LYS CD 1 1 11 11405 1 1 19 LYS CE C 8.830 -2.540 6.469 1.00 . A A . 19 LYS CE 1 1 11 11406 1 1 19 LYS CG C 7.853 -1.180 4.619 1.00 . A A . 19 LYS CG 1 1 11 11407 1 1 19 LYS H H 4.857 -0.021 3.588 1.00 . A A . 19 LYS H 1 1 11 11408 1 1 19 LYS HA H 7.573 0.849 2.917 1.00 . A A . 19 LYS HA 1 1 11 11409 1 1 19 LYS HB2 H 6.319 -1.848 3.318 1.00 . A A . 19 LYS HB2 1 1 11 11410 1 1 19 LYS HB3 H 7.899 -1.658 2.558 1.00 . A A . 19 LYS HB3 1 1 11 11411 1 1 19 LYS HD2 H 7.153 -3.068 5.263 1.00 . A A . 19 LYS HD2 1 1 11 11412 1 1 19 LYS HD3 H 8.700 -3.111 4.415 1.00 . A A . 19 LYS HD3 1 1 11 11413 1 1 19 LYS HE2 H 8.254 -1.946 7.163 1.00 . A A . 19 LYS HE2 1 1 11 11414 1 1 19 LYS HE3 H 8.917 -3.547 6.846 1.00 . A A . 19 LYS HE3 1 1 11 11415 1 1 19 LYS HG2 H 8.797 -0.658 4.544 1.00 . A A . 19 LYS HG2 1 1 11 11416 1 1 19 LYS HG3 H 7.203 -0.659 5.306 1.00 . A A . 19 LYS HG3 1 1 11 11417 1 1 19 LYS HZ1 H 10.663 -1.937 7.269 1.00 . A A . 19 LYS HZ1 1 1 11 11418 1 1 19 LYS HZ2 H 10.125 -0.977 5.983 1.00 . A A . 19 LYS HZ2 1 1 11 11419 1 1 19 LYS HZ3 H 10.764 -2.515 5.682 1.00 . A A . 19 LYS HZ3 1 1 11 11420 1 1 19 LYS N N 5.646 0.561 3.573 1.00 . A A . 19 LYS N 1 1 11 11421 1 1 19 LYS NZ N 10.191 -1.951 6.342 1.00 . A A . 19 LYS NZ 1 1 11 11422 1 1 19 LYS O O 5.987 1.176 0.746 1.00 . A A . 19 LYS O 1 1 11 11423 1 1 20 GLY C C 4.627 -1.575 -0.778 1.00 . A A . 20 GLY C 1 1 11 11424 1 1 20 GLY CA C 6.043 -1.089 -0.752 1.00 . A A . 20 GLY CA 1 1 11 11425 1 1 20 GLY H H 6.783 -1.797 1.059 1.00 . A A . 20 GLY H 1 1 11 11426 1 1 20 GLY HA2 H 6.117 -0.122 -1.217 1.00 . A A . 20 GLY HA2 1 1 11 11427 1 1 20 GLY HA3 H 6.664 -1.799 -1.266 1.00 . A A . 20 GLY HA3 1 1 11 11428 1 1 20 GLY N N 6.459 -1.003 0.619 1.00 . A A . 20 GLY N 1 1 11 11429 1 1 20 GLY O O 3.792 -1.121 -1.555 1.00 . A A . 20 GLY O 1 1 11 11430 1 1 21 LYS C C 2.737 -3.288 1.777 1.00 . A A . 21 LYS C 1 1 11 11431 1 1 21 LYS CA C 3.077 -3.115 0.284 1.00 . A A . 21 LYS CA 1 1 11 11432 1 1 21 LYS CB C 3.012 -4.454 -0.445 1.00 . A A . 21 LYS CB 1 1 11 11433 1 1 21 LYS CD C 2.825 -5.590 -2.679 1.00 . A A . 21 LYS CD 1 1 11 11434 1 1 21 LYS CE C 4.298 -5.665 -3.048 1.00 . A A . 21 LYS CE 1 1 11 11435 1 1 21 LYS CG C 2.515 -4.337 -1.878 1.00 . A A . 21 LYS CG 1 1 11 11436 1 1 21 LYS H H 5.143 -2.871 0.624 1.00 . A A . 21 LYS H 1 1 11 11437 1 1 21 LYS HA H 2.355 -2.441 -0.158 1.00 . A A . 21 LYS HA 1 1 11 11438 1 1 21 LYS HB2 H 4.003 -4.883 -0.467 1.00 . A A . 21 LYS HB2 1 1 11 11439 1 1 21 LYS HB3 H 2.350 -5.115 0.092 1.00 . A A . 21 LYS HB3 1 1 11 11440 1 1 21 LYS HD2 H 2.570 -6.454 -2.087 1.00 . A A . 21 LYS HD2 1 1 11 11441 1 1 21 LYS HD3 H 2.236 -5.582 -3.584 1.00 . A A . 21 LYS HD3 1 1 11 11442 1 1 21 LYS HE2 H 4.885 -5.639 -2.143 1.00 . A A . 21 LYS HE2 1 1 11 11443 1 1 21 LYS HE3 H 4.479 -6.594 -3.568 1.00 . A A . 21 LYS HE3 1 1 11 11444 1 1 21 LYS HG2 H 1.446 -4.185 -1.866 1.00 . A A . 21 LYS HG2 1 1 11 11445 1 1 21 LYS HG3 H 2.996 -3.490 -2.347 1.00 . A A . 21 LYS HG3 1 1 11 11446 1 1 21 LYS HZ1 H 4.096 -4.489 -4.763 1.00 . A A . 21 LYS HZ1 1 1 11 11447 1 1 21 LYS HZ2 H 5.694 -4.654 -4.230 1.00 . A A . 21 LYS HZ2 1 1 11 11448 1 1 21 LYS HZ3 H 4.629 -3.633 -3.403 1.00 . A A . 21 LYS HZ3 1 1 11 11449 1 1 21 LYS N N 4.389 -2.526 0.105 1.00 . A A . 21 LYS N 1 1 11 11450 1 1 21 LYS NZ N 4.708 -4.531 -3.922 1.00 . A A . 21 LYS NZ 1 1 11 11451 1 1 21 LYS O O 1.632 -3.705 2.111 1.00 . A A . 21 LYS O 1 1 11 11452 1 1 22 ASP C C 2.711 -1.827 4.671 1.00 . A A . 22 ASP C 1 1 11 11453 1 1 22 ASP CA C 3.442 -3.033 4.116 1.00 . A A . 22 ASP CA 1 1 11 11454 1 1 22 ASP CB C 4.768 -3.158 4.859 1.00 . A A . 22 ASP CB 1 1 11 11455 1 1 22 ASP CG C 4.589 -3.589 6.303 1.00 . A A . 22 ASP CG 1 1 11 11456 1 1 22 ASP H H 4.507 -2.557 2.375 1.00 . A A . 22 ASP H 1 1 11 11457 1 1 22 ASP HA H 2.856 -3.903 4.276 1.00 . A A . 22 ASP HA 1 1 11 11458 1 1 22 ASP HB2 H 5.395 -3.867 4.354 1.00 . A A . 22 ASP HB2 1 1 11 11459 1 1 22 ASP HB3 H 5.255 -2.195 4.858 1.00 . A A . 22 ASP HB3 1 1 11 11460 1 1 22 ASP N N 3.665 -2.911 2.677 1.00 . A A . 22 ASP N 1 1 11 11461 1 1 22 ASP O O 2.592 -1.655 5.882 1.00 . A A . 22 ASP O 1 1 11 11462 1 1 22 ASP OD1 O 4.489 -4.805 6.557 1.00 . A A . 22 ASP OD1 1 1 11 11463 1 1 22 ASP OD2 O 4.545 -2.703 7.183 1.00 . A A . 22 ASP OD2 1 1 11 11464 1 1 23 VAL C C 0.036 -0.094 4.232 1.00 . A A . 23 VAL C 1 1 11 11465 1 1 23 VAL CA C 1.522 0.193 4.133 1.00 . A A . 23 VAL CA 1 1 11 11466 1 1 23 VAL CB C 1.764 1.254 3.072 1.00 . A A . 23 VAL CB 1 1 11 11467 1 1 23 VAL CG1 C 1.246 0.751 1.735 1.00 . A A . 23 VAL CG1 1 1 11 11468 1 1 23 VAL CG2 C 1.123 2.565 3.479 1.00 . A A . 23 VAL CG2 1 1 11 11469 1 1 23 VAL H H 2.431 -1.156 2.843 1.00 . A A . 23 VAL H 1 1 11 11470 1 1 23 VAL HA H 1.885 0.556 5.079 1.00 . A A . 23 VAL HA 1 1 11 11471 1 1 23 VAL HB H 2.831 1.404 2.984 1.00 . A A . 23 VAL HB 1 1 11 11472 1 1 23 VAL HG11 H 0.563 1.471 1.321 1.00 . A A . 23 VAL HG11 1 1 11 11473 1 1 23 VAL HG12 H 0.740 -0.190 1.868 1.00 . A A . 23 VAL HG12 1 1 11 11474 1 1 23 VAL HG13 H 2.077 0.614 1.060 1.00 . A A . 23 VAL HG13 1 1 11 11475 1 1 23 VAL HG21 H 1.558 3.373 2.912 1.00 . A A . 23 VAL HG21 1 1 11 11476 1 1 23 VAL HG22 H 1.301 2.728 4.529 1.00 . A A . 23 VAL HG22 1 1 11 11477 1 1 23 VAL HG23 H 0.060 2.522 3.297 1.00 . A A . 23 VAL HG23 1 1 11 11478 1 1 23 VAL N N 2.250 -0.992 3.778 1.00 . A A . 23 VAL N 1 1 11 11479 1 1 23 VAL O O -0.517 -0.869 3.449 1.00 . A A . 23 VAL O 1 1 11 11480 1 1 24 GLU C C -2.846 1.505 4.887 1.00 . A A . 24 GLU C 1 1 11 11481 1 1 24 GLU CA C -2.038 0.317 5.370 1.00 . A A . 24 GLU CA 1 1 11 11482 1 1 24 GLU CB C -2.375 0.043 6.827 1.00 . A A . 24 GLU CB 1 1 11 11483 1 1 24 GLU CD C -1.850 0.494 9.255 1.00 . A A . 24 GLU CD 1 1 11 11484 1 1 24 GLU CG C -1.537 0.839 7.813 1.00 . A A . 24 GLU CG 1 1 11 11485 1 1 24 GLU H H -0.142 1.181 5.744 1.00 . A A . 24 GLU H 1 1 11 11486 1 1 24 GLU HA H -2.302 -0.557 4.784 1.00 . A A . 24 GLU HA 1 1 11 11487 1 1 24 GLU HB2 H -3.413 0.296 6.981 1.00 . A A . 24 GLU HB2 1 1 11 11488 1 1 24 GLU HB3 H -2.239 -1.007 7.024 1.00 . A A . 24 GLU HB3 1 1 11 11489 1 1 24 GLU HG2 H -0.493 0.632 7.628 1.00 . A A . 24 GLU HG2 1 1 11 11490 1 1 24 GLU HG3 H -1.727 1.892 7.659 1.00 . A A . 24 GLU HG3 1 1 11 11491 1 1 24 GLU N N -0.618 0.538 5.182 1.00 . A A . 24 GLU N 1 1 11 11492 1 1 24 GLU O O -3.009 2.496 5.599 1.00 . A A . 24 GLU O 1 1 11 11493 1 1 24 GLU OE1 O -1.229 -0.450 9.788 1.00 . A A . 24 GLU OE1 1 1 11 11494 1 1 24 GLU OE2 O -2.716 1.169 9.852 1.00 . A A . 24 GLU OE2 1 1 11 11495 1 1 25 TYR C C -5.632 2.139 3.314 1.00 . A A . 25 TYR C 1 1 11 11496 1 1 25 TYR CA C -4.154 2.436 3.083 1.00 . A A . 25 TYR CA 1 1 11 11497 1 1 25 TYR CB C -3.869 2.515 1.583 1.00 . A A . 25 TYR CB 1 1 11 11498 1 1 25 TYR CD1 C -1.396 2.946 1.408 1.00 . A A . 25 TYR CD1 1 1 11 11499 1 1 25 TYR CD2 C -2.881 4.650 0.677 1.00 . A A . 25 TYR CD2 1 1 11 11500 1 1 25 TYR CE1 C -0.318 3.734 1.059 1.00 . A A . 25 TYR CE1 1 1 11 11501 1 1 25 TYR CE2 C -1.811 5.444 0.321 1.00 . A A . 25 TYR CE2 1 1 11 11502 1 1 25 TYR CG C -2.693 3.389 1.226 1.00 . A A . 25 TYR CG 1 1 11 11503 1 1 25 TYR CZ C -0.530 4.981 0.514 1.00 . A A . 25 TYR CZ 1 1 11 11504 1 1 25 TYR H H -3.172 0.592 3.162 1.00 . A A . 25 TYR H 1 1 11 11505 1 1 25 TYR HA H -3.890 3.369 3.546 1.00 . A A . 25 TYR HA 1 1 11 11506 1 1 25 TYR HB2 H -3.661 1.523 1.215 1.00 . A A . 25 TYR HB2 1 1 11 11507 1 1 25 TYR HB3 H -4.736 2.902 1.073 1.00 . A A . 25 TYR HB3 1 1 11 11508 1 1 25 TYR HD1 H -1.232 1.968 1.835 1.00 . A A . 25 TYR HD1 1 1 11 11509 1 1 25 TYR HD2 H -3.882 5.009 0.529 1.00 . A A . 25 TYR HD2 1 1 11 11510 1 1 25 TYR HE1 H 0.682 3.371 1.207 1.00 . A A . 25 TYR HE1 1 1 11 11511 1 1 25 TYR HE2 H -1.980 6.422 -0.104 1.00 . A A . 25 TYR HE2 1 1 11 11512 1 1 25 TYR HH H 0.296 6.693 0.218 1.00 . A A . 25 TYR HH 1 1 11 11513 1 1 25 TYR N N -3.349 1.396 3.675 1.00 . A A . 25 TYR N 1 1 11 11514 1 1 25 TYR O O -5.985 1.264 4.100 1.00 . A A . 25 TYR O 1 1 11 11515 1 1 25 TYR OH O 0.544 5.768 0.159 1.00 . A A . 25 TYR OH 1 1 11 11516 1 1 26 LEU C C -8.450 2.599 1.302 1.00 . A A . 26 LEU C 1 1 11 11517 1 1 26 LEU CA C -7.917 2.709 2.712 1.00 . A A . 26 LEU CA 1 1 11 11518 1 1 26 LEU CB C -8.578 3.893 3.422 1.00 . A A . 26 LEU CB 1 1 11 11519 1 1 26 LEU CD1 C -10.764 4.612 4.432 1.00 . A A . 26 LEU CD1 1 1 11 11520 1 1 26 LEU CD2 C -10.431 4.785 1.959 1.00 . A A . 26 LEU CD2 1 1 11 11521 1 1 26 LEU CG C -10.094 3.994 3.219 1.00 . A A . 26 LEU CG 1 1 11 11522 1 1 26 LEU H H -6.131 3.604 2.084 1.00 . A A . 26 LEU H 1 1 11 11523 1 1 26 LEU HA H -8.124 1.797 3.246 1.00 . A A . 26 LEU HA 1 1 11 11524 1 1 26 LEU HB2 H -8.374 3.813 4.482 1.00 . A A . 26 LEU HB2 1 1 11 11525 1 1 26 LEU HB3 H -8.126 4.797 3.057 1.00 . A A . 26 LEU HB3 1 1 11 11526 1 1 26 LEU HD11 H -11.313 5.492 4.132 1.00 . A A . 26 LEU HD11 1 1 11 11527 1 1 26 LEU HD12 H -10.012 4.885 5.158 1.00 . A A . 26 LEU HD12 1 1 11 11528 1 1 26 LEU HD13 H -11.443 3.894 4.870 1.00 . A A . 26 LEU HD13 1 1 11 11529 1 1 26 LEU HD21 H -9.818 5.665 1.911 1.00 . A A . 26 LEU HD21 1 1 11 11530 1 1 26 LEU HD22 H -11.471 5.072 1.985 1.00 . A A . 26 LEU HD22 1 1 11 11531 1 1 26 LEU HD23 H -10.253 4.174 1.086 1.00 . A A . 26 LEU HD23 1 1 11 11532 1 1 26 LEU HG H -10.486 3.007 3.092 1.00 . A A . 26 LEU HG 1 1 11 11533 1 1 26 LEU N N -6.481 2.891 2.642 1.00 . A A . 26 LEU N 1 1 11 11534 1 1 26 LEU O O -7.790 3.032 0.363 1.00 . A A . 26 LEU O 1 1 11 11535 1 1 27 VAL C C -11.650 2.170 -0.320 1.00 . A A . 27 VAL C 1 1 11 11536 1 1 27 VAL CA C -10.149 1.937 -0.226 1.00 . A A . 27 VAL CA 1 1 11 11537 1 1 27 VAL CB C -9.742 0.620 -0.934 1.00 . A A . 27 VAL CB 1 1 11 11538 1 1 27 VAL CG1 C -8.509 0.004 -0.289 1.00 . A A . 27 VAL CG1 1 1 11 11539 1 1 27 VAL CG2 C -10.870 -0.411 -1.013 1.00 . A A . 27 VAL CG2 1 1 11 11540 1 1 27 VAL H H -10.122 1.640 1.871 1.00 . A A . 27 VAL H 1 1 11 11541 1 1 27 VAL HA H -9.677 2.729 -0.781 1.00 . A A . 27 VAL HA 1 1 11 11542 1 1 27 VAL HB H -9.476 0.902 -1.934 1.00 . A A . 27 VAL HB 1 1 11 11543 1 1 27 VAL HG11 H -8.706 -0.186 0.755 1.00 . A A . 27 VAL HG11 1 1 11 11544 1 1 27 VAL HG12 H -7.676 0.685 -0.380 1.00 . A A . 27 VAL HG12 1 1 11 11545 1 1 27 VAL HG13 H -8.273 -0.923 -0.786 1.00 . A A . 27 VAL HG13 1 1 11 11546 1 1 27 VAL HG21 H -10.456 -1.380 -1.255 1.00 . A A . 27 VAL HG21 1 1 11 11547 1 1 27 VAL HG22 H -11.573 -0.118 -1.778 1.00 . A A . 27 VAL HG22 1 1 11 11548 1 1 27 VAL HG23 H -11.376 -0.463 -0.065 1.00 . A A . 27 VAL HG23 1 1 11 11549 1 1 27 VAL N N -9.627 2.024 1.120 1.00 . A A . 27 VAL N 1 1 11 11550 1 1 27 VAL O O -12.457 1.385 0.177 1.00 . A A . 27 VAL O 1 1 11 11551 1 1 28 ARG C C -13.759 2.953 -2.508 1.00 . A A . 28 ARG C 1 1 11 11552 1 1 28 ARG CA C -13.400 3.581 -1.192 1.00 . A A . 28 ARG CA 1 1 11 11553 1 1 28 ARG CB C -13.651 5.080 -1.246 1.00 . A A . 28 ARG CB 1 1 11 11554 1 1 28 ARG CD C -15.260 6.979 -0.888 1.00 . A A . 28 ARG CD 1 1 11 11555 1 1 28 ARG CG C -15.080 5.469 -0.903 1.00 . A A . 28 ARG CG 1 1 11 11556 1 1 28 ARG CZ C -14.457 8.916 0.393 1.00 . A A . 28 ARG CZ 1 1 11 11557 1 1 28 ARG H H -11.318 3.900 -1.256 1.00 . A A . 28 ARG H 1 1 11 11558 1 1 28 ARG HA H -14.000 3.127 -0.421 1.00 . A A . 28 ARG HA 1 1 11 11559 1 1 28 ARG HB2 H -12.984 5.576 -0.558 1.00 . A A . 28 ARG HB2 1 1 11 11560 1 1 28 ARG HB3 H -13.443 5.415 -2.248 1.00 . A A . 28 ARG HB3 1 1 11 11561 1 1 28 ARG HD2 H -15.021 7.367 -1.866 1.00 . A A . 28 ARG HD2 1 1 11 11562 1 1 28 ARG HD3 H -16.291 7.202 -0.655 1.00 . A A . 28 ARG HD3 1 1 11 11563 1 1 28 ARG HE H -13.749 7.060 0.570 1.00 . A A . 28 ARG HE 1 1 11 11564 1 1 28 ARG HG2 H -15.745 5.047 -1.642 1.00 . A A . 28 ARG HG2 1 1 11 11565 1 1 28 ARG HG3 H -15.326 5.076 0.072 1.00 . A A . 28 ARG HG3 1 1 11 11566 1 1 28 ARG HH11 H -15.948 9.314 -0.911 1.00 . A A . 28 ARG HH11 1 1 11 11567 1 1 28 ARG HH12 H -15.373 10.673 -0.005 1.00 . A A . 28 ARG HH12 1 1 11 11568 1 1 28 ARG HH21 H -12.980 8.841 1.772 1.00 . A A . 28 ARG HH21 1 1 11 11569 1 1 28 ARG HH22 H -13.683 10.404 1.521 1.00 . A A . 28 ARG HH22 1 1 11 11570 1 1 28 ARG N N -12.009 3.274 -0.951 1.00 . A A . 28 ARG N 1 1 11 11571 1 1 28 ARG NE N -14.401 7.621 0.102 1.00 . A A . 28 ARG NE 1 1 11 11572 1 1 28 ARG NH1 N -15.330 9.698 -0.226 1.00 . A A . 28 ARG NH1 1 1 11 11573 1 1 28 ARG NH2 N -13.639 9.430 1.303 1.00 . A A . 28 ARG NH2 1 1 11 11574 1 1 28 ARG O O -13.842 3.631 -3.532 1.00 . A A . 28 ARG O 1 1 11 11575 1 1 29 TRP C C -15.011 1.610 -4.685 1.00 . A A . 29 TRP C 1 1 11 11576 1 1 29 TRP CA C -14.277 0.823 -3.616 1.00 . A A . 29 TRP CA 1 1 11 11577 1 1 29 TRP CB C -15.135 -0.350 -3.165 1.00 . A A . 29 TRP CB 1 1 11 11578 1 1 29 TRP CD1 C -14.090 -1.772 -5.027 1.00 . A A . 29 TRP CD1 1 1 11 11579 1 1 29 TRP CD2 C -15.780 -2.770 -3.947 1.00 . A A . 29 TRP CD2 1 1 11 11580 1 1 29 TRP CE2 C -15.298 -3.648 -4.937 1.00 . A A . 29 TRP CE2 1 1 11 11581 1 1 29 TRP CE3 C -16.844 -3.183 -3.141 1.00 . A A . 29 TRP CE3 1 1 11 11582 1 1 29 TRP CG C -14.992 -1.574 -4.022 1.00 . A A . 29 TRP CG 1 1 11 11583 1 1 29 TRP CH2 C -16.884 -5.291 -4.337 1.00 . A A . 29 TRP CH2 1 1 11 11584 1 1 29 TRP CZ2 C -15.844 -4.913 -5.141 1.00 . A A . 29 TRP CZ2 1 1 11 11585 1 1 29 TRP CZ3 C -17.384 -4.440 -3.344 1.00 . A A . 29 TRP CZ3 1 1 11 11586 1 1 29 TRP H H -13.869 1.198 -1.587 1.00 . A A . 29 TRP H 1 1 11 11587 1 1 29 TRP HA H -13.355 0.440 -4.031 1.00 . A A . 29 TRP HA 1 1 11 11588 1 1 29 TRP HB2 H -14.857 -0.606 -2.156 1.00 . A A . 29 TRP HB2 1 1 11 11589 1 1 29 TRP HB3 H -16.173 -0.051 -3.179 1.00 . A A . 29 TRP HB3 1 1 11 11590 1 1 29 TRP HD1 H -13.350 -1.049 -5.332 1.00 . A A . 29 TRP HD1 1 1 11 11591 1 1 29 TRP HE1 H -13.742 -3.391 -6.320 1.00 . A A . 29 TRP HE1 1 1 11 11592 1 1 29 TRP HE3 H -17.243 -2.541 -2.371 1.00 . A A . 29 TRP HE3 1 1 11 11593 1 1 29 TRP HH2 H -17.338 -6.264 -4.461 1.00 . A A . 29 TRP HH2 1 1 11 11594 1 1 29 TRP HZ2 H -15.470 -5.582 -5.901 1.00 . A A . 29 TRP HZ2 1 1 11 11595 1 1 29 TRP HZ3 H -18.207 -4.777 -2.730 1.00 . A A . 29 TRP HZ3 1 1 11 11596 1 1 29 TRP N N -13.952 1.640 -2.454 1.00 . A A . 29 TRP N 1 1 11 11597 1 1 29 TRP NE1 N -14.268 -3.017 -5.582 1.00 . A A . 29 TRP NE1 1 1 11 11598 1 1 29 TRP O O -16.231 1.723 -4.653 1.00 . A A . 29 TRP O 1 1 11 11599 1 1 30 LYS C C -16.146 2.482 -7.163 1.00 . A A . 30 LYS C 1 1 11 11600 1 1 30 LYS CA C -14.765 2.986 -6.724 1.00 . A A . 30 LYS CA 1 1 11 11601 1 1 30 LYS CB C -13.810 2.906 -7.920 1.00 . A A . 30 LYS CB 1 1 11 11602 1 1 30 LYS CD C -13.441 3.426 -10.355 1.00 . A A . 30 LYS CD 1 1 11 11603 1 1 30 LYS CE C -11.979 3.776 -10.136 1.00 . A A . 30 LYS CE 1 1 11 11604 1 1 30 LYS CG C -14.276 3.719 -9.119 1.00 . A A . 30 LYS CG 1 1 11 11605 1 1 30 LYS H H -13.241 2.194 -5.433 1.00 . A A . 30 LYS H 1 1 11 11606 1 1 30 LYS HA H -14.853 4.016 -6.414 1.00 . A A . 30 LYS HA 1 1 11 11607 1 1 30 LYS HB2 H -12.839 3.266 -7.622 1.00 . A A . 30 LYS HB2 1 1 11 11608 1 1 30 LYS HB3 H -13.723 1.874 -8.226 1.00 . A A . 30 LYS HB3 1 1 11 11609 1 1 30 LYS HD2 H -13.518 2.375 -10.590 1.00 . A A . 30 LYS HD2 1 1 11 11610 1 1 30 LYS HD3 H -13.822 4.011 -11.180 1.00 . A A . 30 LYS HD3 1 1 11 11611 1 1 30 LYS HE2 H -11.911 4.802 -9.808 1.00 . A A . 30 LYS HE2 1 1 11 11612 1 1 30 LYS HE3 H -11.580 3.127 -9.372 1.00 . A A . 30 LYS HE3 1 1 11 11613 1 1 30 LYS HG2 H -15.307 3.473 -9.328 1.00 . A A . 30 LYS HG2 1 1 11 11614 1 1 30 LYS HG3 H -14.196 4.769 -8.881 1.00 . A A . 30 LYS HG3 1 1 11 11615 1 1 30 LYS HZ1 H -10.184 3.870 -11.200 1.00 . A A . 30 LYS HZ1 1 1 11 11616 1 1 30 LYS HZ2 H -11.552 4.222 -12.131 1.00 . A A . 30 LYS HZ2 1 1 11 11617 1 1 30 LYS HZ3 H -11.210 2.623 -11.699 1.00 . A A . 30 LYS HZ3 1 1 11 11618 1 1 30 LYS N N -14.225 2.212 -5.585 1.00 . A A . 30 LYS N 1 1 11 11619 1 1 30 LYS NZ N -11.175 3.611 -11.379 1.00 . A A . 30 LYS NZ 1 1 11 11620 1 1 30 LYS O O -17.007 3.266 -7.558 1.00 . A A . 30 LYS O 1 1 11 11621 1 1 31 ASP C C -18.212 -0.145 -6.238 1.00 . A A . 31 ASP C 1 1 11 11622 1 1 31 ASP CA C -17.612 0.555 -7.456 1.00 . A A . 31 ASP CA 1 1 11 11623 1 1 31 ASP CB C -17.424 -0.446 -8.597 1.00 . A A . 31 ASP CB 1 1 11 11624 1 1 31 ASP CG C -18.734 -1.066 -9.040 1.00 . A A . 31 ASP CG 1 1 11 11625 1 1 31 ASP H H -15.599 0.591 -6.805 1.00 . A A . 31 ASP H 1 1 11 11626 1 1 31 ASP HA H -18.282 1.339 -7.776 1.00 . A A . 31 ASP HA 1 1 11 11627 1 1 31 ASP HB2 H -16.981 0.060 -9.442 1.00 . A A . 31 ASP HB2 1 1 11 11628 1 1 31 ASP HB3 H -16.765 -1.236 -8.269 1.00 . A A . 31 ASP HB3 1 1 11 11629 1 1 31 ASP N N -16.337 1.166 -7.097 1.00 . A A . 31 ASP N 1 1 11 11630 1 1 31 ASP O O -18.512 -1.338 -6.276 1.00 . A A . 31 ASP O 1 1 11 11631 1 1 31 ASP OD1 O -19.429 -0.450 -9.876 1.00 . A A . 31 ASP OD1 1 1 11 11632 1 1 31 ASP OD2 O -19.065 -2.167 -8.552 1.00 . A A . 31 ASP OD2 1 1 11 11633 1 1 32 GLY C C -19.731 1.078 -3.143 1.00 . A A . 32 GLY C 1 1 11 11634 1 1 32 GLY CA C -18.923 0.065 -3.930 1.00 . A A . 32 GLY CA 1 1 11 11635 1 1 32 GLY H H -18.138 1.562 -5.200 1.00 . A A . 32 GLY H 1 1 11 11636 1 1 32 GLY HA2 H -19.554 -0.778 -4.168 1.00 . A A . 32 GLY HA2 1 1 11 11637 1 1 32 GLY HA3 H -18.100 -0.273 -3.312 1.00 . A A . 32 GLY HA3 1 1 11 11638 1 1 32 GLY N N -18.383 0.614 -5.159 1.00 . A A . 32 GLY N 1 1 11 11639 1 1 32 GLY O O -20.127 2.116 -3.673 1.00 . A A . 32 GLY O 1 1 11 11640 1 1 33 GLY C C -20.327 1.568 0.435 1.00 . A A . 33 GLY C 1 1 11 11641 1 1 33 GLY CA C -20.732 1.673 -1.022 1.00 . A A . 33 GLY CA 1 1 11 11642 1 1 33 GLY H H -19.633 -0.070 -1.506 1.00 . A A . 33 GLY H 1 1 11 11643 1 1 33 GLY HA2 H -20.574 2.687 -1.357 1.00 . A A . 33 GLY HA2 1 1 11 11644 1 1 33 GLY HA3 H -21.782 1.435 -1.110 1.00 . A A . 33 GLY HA3 1 1 11 11645 1 1 33 GLY N N -19.973 0.774 -1.872 1.00 . A A . 33 GLY N 1 1 11 11646 1 1 33 GLY O O -21.163 1.690 1.330 1.00 . A A . 33 GLY O 1 1 11 11647 1 1 34 ASP C C -17.112 1.778 2.140 1.00 . A A . 34 ASP C 1 1 11 11648 1 1 34 ASP CA C -18.527 1.213 2.033 1.00 . A A . 34 ASP CA 1 1 11 11649 1 1 34 ASP CB C -18.535 -0.255 2.461 1.00 . A A . 34 ASP CB 1 1 11 11650 1 1 34 ASP CG C -19.891 -0.904 2.265 1.00 . A A . 34 ASP CG 1 1 11 11651 1 1 34 ASP H H -18.419 1.258 -0.081 1.00 . A A . 34 ASP H 1 1 11 11652 1 1 34 ASP HA H -19.177 1.774 2.686 1.00 . A A . 34 ASP HA 1 1 11 11653 1 1 34 ASP HB2 H -17.808 -0.799 1.877 1.00 . A A . 34 ASP HB2 1 1 11 11654 1 1 34 ASP HB3 H -18.273 -0.319 3.507 1.00 . A A . 34 ASP HB3 1 1 11 11655 1 1 34 ASP N N -19.039 1.341 0.674 1.00 . A A . 34 ASP N 1 1 11 11656 1 1 34 ASP O O -16.627 2.439 1.222 1.00 . A A . 34 ASP O 1 1 11 11657 1 1 34 ASP OD1 O -20.777 -0.694 3.120 1.00 . A A . 34 ASP OD1 1 1 11 11658 1 1 34 ASP OD2 O -20.066 -1.622 1.259 1.00 . A A . 34 ASP OD2 1 1 11 11659 1 1 35 CYS C C -14.287 0.983 4.294 1.00 . A A . 35 CYS C 1 1 11 11660 1 1 35 CYS CA C -15.102 1.998 3.497 1.00 . A A . 35 CYS CA 1 1 11 11661 1 1 35 CYS CB C -15.134 3.339 4.235 1.00 . A A . 35 CYS CB 1 1 11 11662 1 1 35 CYS H H -16.901 0.983 3.963 1.00 . A A . 35 CYS H 1 1 11 11663 1 1 35 CYS HA H -14.634 2.140 2.534 1.00 . A A . 35 CYS HA 1 1 11 11664 1 1 35 CYS HB2 H -14.121 3.673 4.400 1.00 . A A . 35 CYS HB2 1 1 11 11665 1 1 35 CYS HB3 H -15.653 4.064 3.626 1.00 . A A . 35 CYS HB3 1 1 11 11666 1 1 35 CYS HG H -16.253 2.012 6.105 1.00 . A A . 35 CYS HG 1 1 11 11667 1 1 35 CYS N N -16.459 1.515 3.268 1.00 . A A . 35 CYS N 1 1 11 11668 1 1 35 CYS O O -14.568 0.730 5.466 1.00 . A A . 35 CYS O 1 1 11 11669 1 1 35 CYS SG S -15.960 3.278 5.842 1.00 . A A . 35 CYS SG 1 1 11 11670 1 1 36 GLU C C -10.958 -0.121 4.278 1.00 . A A . 36 GLU C 1 1 11 11671 1 1 36 GLU CA C -12.414 -0.578 4.299 1.00 . A A . 36 GLU CA 1 1 11 11672 1 1 36 GLU CB C -12.546 -1.934 3.603 1.00 . A A . 36 GLU CB 1 1 11 11673 1 1 36 GLU CD C -14.459 -2.763 5.031 1.00 . A A . 36 GLU CD 1 1 11 11674 1 1 36 GLU CG C -13.959 -2.494 3.624 1.00 . A A . 36 GLU CG 1 1 11 11675 1 1 36 GLU H H -13.101 0.652 2.718 1.00 . A A . 36 GLU H 1 1 11 11676 1 1 36 GLU HA H -12.736 -0.676 5.325 1.00 . A A . 36 GLU HA 1 1 11 11677 1 1 36 GLU HB2 H -12.239 -1.828 2.575 1.00 . A A . 36 GLU HB2 1 1 11 11678 1 1 36 GLU HB3 H -11.895 -2.642 4.094 1.00 . A A . 36 GLU HB3 1 1 11 11679 1 1 36 GLU HG2 H -14.621 -1.783 3.155 1.00 . A A . 36 GLU HG2 1 1 11 11680 1 1 36 GLU HG3 H -13.974 -3.420 3.069 1.00 . A A . 36 GLU HG3 1 1 11 11681 1 1 36 GLU N N -13.275 0.408 3.651 1.00 . A A . 36 GLU N 1 1 11 11682 1 1 36 GLU O O -10.630 0.909 3.691 1.00 . A A . 36 GLU O 1 1 11 11683 1 1 36 GLU OE1 O -14.918 -1.807 5.690 1.00 . A A . 36 GLU OE1 1 1 11 11684 1 1 36 GLU OE2 O -14.392 -3.929 5.472 1.00 . A A . 36 GLU OE2 1 1 11 11685 1 1 37 TRP C C -7.819 -1.611 4.272 1.00 . A A . 37 TRP C 1 1 11 11686 1 1 37 TRP CA C -8.670 -0.563 4.978 1.00 . A A . 37 TRP CA 1 1 11 11687 1 1 37 TRP CB C -8.225 -0.435 6.433 1.00 . A A . 37 TRP CB 1 1 11 11688 1 1 37 TRP CD1 C -8.987 2.006 6.495 1.00 . A A . 37 TRP CD1 1 1 11 11689 1 1 37 TRP CD2 C -9.024 0.984 8.486 1.00 . A A . 37 TRP CD2 1 1 11 11690 1 1 37 TRP CE2 C -9.462 2.312 8.654 1.00 . A A . 37 TRP CE2 1 1 11 11691 1 1 37 TRP CE3 C -8.965 0.148 9.605 1.00 . A A . 37 TRP CE3 1 1 11 11692 1 1 37 TRP CG C -8.726 0.809 7.096 1.00 . A A . 37 TRP CG 1 1 11 11693 1 1 37 TRP CH2 C -9.769 1.982 10.972 1.00 . A A . 37 TRP CH2 1 1 11 11694 1 1 37 TRP CZ2 C -9.837 2.822 9.894 1.00 . A A . 37 TRP CZ2 1 1 11 11695 1 1 37 TRP CZ3 C -9.337 0.657 10.836 1.00 . A A . 37 TRP CZ3 1 1 11 11696 1 1 37 TRP H H -10.406 -1.703 5.370 1.00 . A A . 37 TRP H 1 1 11 11697 1 1 37 TRP HA H -8.529 0.386 4.487 1.00 . A A . 37 TRP HA 1 1 11 11698 1 1 37 TRP HB2 H -8.594 -1.283 6.992 1.00 . A A . 37 TRP HB2 1 1 11 11699 1 1 37 TRP HB3 H -7.149 -0.427 6.471 1.00 . A A . 37 TRP HB3 1 1 11 11700 1 1 37 TRP HD1 H -8.859 2.195 5.440 1.00 . A A . 37 TRP HD1 1 1 11 11701 1 1 37 TRP HE1 H -9.683 3.843 7.237 1.00 . A A . 37 TRP HE1 1 1 11 11702 1 1 37 TRP HE3 H -8.634 -0.877 9.520 1.00 . A A . 37 TRP HE3 1 1 11 11703 1 1 37 TRP HH2 H -10.049 2.335 11.952 1.00 . A A . 37 TRP HH2 1 1 11 11704 1 1 37 TRP HZ2 H -10.171 3.841 10.015 1.00 . A A . 37 TRP HZ2 1 1 11 11705 1 1 37 TRP HZ3 H -9.297 0.026 11.711 1.00 . A A . 37 TRP HZ3 1 1 11 11706 1 1 37 TRP N N -10.088 -0.895 4.920 1.00 . A A . 37 TRP N 1 1 11 11707 1 1 37 TRP NE1 N -9.430 2.915 7.425 1.00 . A A . 37 TRP NE1 1 1 11 11708 1 1 37 TRP O O -8.189 -2.783 4.194 1.00 . A A . 37 TRP O 1 1 11 11709 1 1 38 VAL C C -4.782 -2.693 4.063 1.00 . A A . 38 VAL C 1 1 11 11710 1 1 38 VAL CA C -5.750 -2.064 3.073 1.00 . A A . 38 VAL CA 1 1 11 11711 1 1 38 VAL CB C -4.952 -1.310 1.995 1.00 . A A . 38 VAL CB 1 1 11 11712 1 1 38 VAL CG1 C -3.970 -2.237 1.297 1.00 . A A . 38 VAL CG1 1 1 11 11713 1 1 38 VAL CG2 C -5.890 -0.651 0.998 1.00 . A A . 38 VAL CG2 1 1 11 11714 1 1 38 VAL H H -6.449 -0.223 3.840 1.00 . A A . 38 VAL H 1 1 11 11715 1 1 38 VAL HA H -6.322 -2.844 2.598 1.00 . A A . 38 VAL HA 1 1 11 11716 1 1 38 VAL HB H -4.390 -0.538 2.476 1.00 . A A . 38 VAL HB 1 1 11 11717 1 1 38 VAL HG11 H -3.357 -1.664 0.619 1.00 . A A . 38 VAL HG11 1 1 11 11718 1 1 38 VAL HG12 H -4.512 -2.989 0.744 1.00 . A A . 38 VAL HG12 1 1 11 11719 1 1 38 VAL HG13 H -3.339 -2.714 2.032 1.00 . A A . 38 VAL HG13 1 1 11 11720 1 1 38 VAL HG21 H -5.358 0.120 0.462 1.00 . A A . 38 VAL HG21 1 1 11 11721 1 1 38 VAL HG22 H -6.725 -0.213 1.524 1.00 . A A . 38 VAL HG22 1 1 11 11722 1 1 38 VAL HG23 H -6.247 -1.389 0.302 1.00 . A A . 38 VAL HG23 1 1 11 11723 1 1 38 VAL N N -6.673 -1.174 3.763 1.00 . A A . 38 VAL N 1 1 11 11724 1 1 38 VAL O O -4.486 -2.117 5.110 1.00 . A A . 38 VAL O 1 1 11 11725 1 1 39 LYS C C -1.994 -3.965 4.627 1.00 . A A . 39 LYS C 1 1 11 11726 1 1 39 LYS CA C -3.379 -4.597 4.598 1.00 . A A . 39 LYS CA 1 1 11 11727 1 1 39 LYS CB C -3.284 -6.062 4.170 1.00 . A A . 39 LYS CB 1 1 11 11728 1 1 39 LYS CD C -3.390 -7.148 6.436 1.00 . A A . 39 LYS CD 1 1 11 11729 1 1 39 LYS CE C -2.774 -8.200 7.346 1.00 . A A . 39 LYS CE 1 1 11 11730 1 1 39 LYS CG C -2.567 -6.954 5.172 1.00 . A A . 39 LYS CG 1 1 11 11731 1 1 39 LYS H H -4.551 -4.277 2.870 1.00 . A A . 39 LYS H 1 1 11 11732 1 1 39 LYS HA H -3.784 -4.546 5.589 1.00 . A A . 39 LYS HA 1 1 11 11733 1 1 39 LYS HB2 H -4.284 -6.448 4.031 1.00 . A A . 39 LYS HB2 1 1 11 11734 1 1 39 LYS HB3 H -2.755 -6.116 3.231 1.00 . A A . 39 LYS HB3 1 1 11 11735 1 1 39 LYS HD2 H -3.439 -6.210 6.969 1.00 . A A . 39 LYS HD2 1 1 11 11736 1 1 39 LYS HD3 H -4.387 -7.460 6.162 1.00 . A A . 39 LYS HD3 1 1 11 11737 1 1 39 LYS HE2 H -1.770 -7.897 7.599 1.00 . A A . 39 LYS HE2 1 1 11 11738 1 1 39 LYS HE3 H -3.367 -8.269 8.247 1.00 . A A . 39 LYS HE3 1 1 11 11739 1 1 39 LYS HG2 H -2.392 -7.918 4.719 1.00 . A A . 39 LYS HG2 1 1 11 11740 1 1 39 LYS HG3 H -1.623 -6.499 5.433 1.00 . A A . 39 LYS HG3 1 1 11 11741 1 1 39 LYS HZ1 H -3.684 -9.847 6.438 1.00 . A A . 39 LYS HZ1 1 1 11 11742 1 1 39 LYS HZ2 H -2.310 -10.238 7.344 1.00 . A A . 39 LYS HZ2 1 1 11 11743 1 1 39 LYS HZ3 H -2.144 -9.496 5.833 1.00 . A A . 39 LYS HZ3 1 1 11 11744 1 1 39 LYS N N -4.292 -3.877 3.726 1.00 . A A . 39 LYS N 1 1 11 11745 1 1 39 LYS NZ N -2.725 -9.539 6.694 1.00 . A A . 39 LYS NZ 1 1 11 11746 1 1 39 LYS O O -1.165 -4.212 3.751 1.00 . A A . 39 LYS O 1 1 11 11747 1 1 40 GLY C C 0.472 -3.268 6.693 1.00 . A A . 40 GLY C 1 1 11 11748 1 1 40 GLY CA C -0.471 -2.502 5.795 1.00 . A A . 40 GLY CA 1 1 11 11749 1 1 40 GLY H H -2.474 -2.963 6.285 1.00 . A A . 40 GLY H 1 1 11 11750 1 1 40 GLY HA2 H -0.016 -2.426 4.824 1.00 . A A . 40 GLY HA2 1 1 11 11751 1 1 40 GLY HA3 H -0.610 -1.511 6.196 1.00 . A A . 40 GLY HA3 1 1 11 11752 1 1 40 GLY N N -1.759 -3.146 5.646 1.00 . A A . 40 GLY N 1 1 11 11753 1 1 40 GLY O O 1.177 -2.685 7.518 1.00 . A A . 40 GLY O 1 1 11 11754 1 1 41 VAL C C 2.241 -6.234 6.350 1.00 . A A . 41 VAL C 1 1 11 11755 1 1 41 VAL CA C 1.363 -5.438 7.306 1.00 . A A . 41 VAL CA 1 1 11 11756 1 1 41 VAL CB C 0.624 -6.442 8.208 1.00 . A A . 41 VAL CB 1 1 11 11757 1 1 41 VAL CG1 C 1.459 -6.760 9.438 1.00 . A A . 41 VAL CG1 1 1 11 11758 1 1 41 VAL CG2 C -0.754 -5.930 8.605 1.00 . A A . 41 VAL CG2 1 1 11 11759 1 1 41 VAL H H -0.165 -4.989 5.919 1.00 . A A . 41 VAL H 1 1 11 11760 1 1 41 VAL HA H 1.988 -4.811 7.925 1.00 . A A . 41 VAL HA 1 1 11 11761 1 1 41 VAL HB H 0.503 -7.356 7.645 1.00 . A A . 41 VAL HB 1 1 11 11762 1 1 41 VAL HG11 H 0.941 -7.485 10.048 1.00 . A A . 41 VAL HG11 1 1 11 11763 1 1 41 VAL HG12 H 1.617 -5.857 10.009 1.00 . A A . 41 VAL HG12 1 1 11 11764 1 1 41 VAL HG13 H 2.412 -7.163 9.131 1.00 . A A . 41 VAL HG13 1 1 11 11765 1 1 41 VAL HG21 H -0.652 -4.993 9.133 1.00 . A A . 41 VAL HG21 1 1 11 11766 1 1 41 VAL HG22 H -1.236 -6.653 9.246 1.00 . A A . 41 VAL HG22 1 1 11 11767 1 1 41 VAL HG23 H -1.353 -5.780 7.719 1.00 . A A . 41 VAL HG23 1 1 11 11768 1 1 41 VAL N N 0.464 -4.581 6.551 1.00 . A A . 41 VAL N 1 1 11 11769 1 1 41 VAL O O 3.027 -7.080 6.777 1.00 . A A . 41 VAL O 1 1 11 11770 1 1 42 HIS C C 4.266 -6.112 3.953 1.00 . A A . 42 HIS C 1 1 11 11771 1 1 42 HIS CA C 2.879 -6.674 4.054 1.00 . A A . 42 HIS CA 1 1 11 11772 1 1 42 HIS CB C 2.153 -6.693 2.710 1.00 . A A . 42 HIS CB 1 1 11 11773 1 1 42 HIS CD2 C 1.210 -9.107 2.793 1.00 . A A . 42 HIS CD2 1 1 11 11774 1 1 42 HIS CE1 C -0.890 -8.643 2.363 1.00 . A A . 42 HIS CE1 1 1 11 11775 1 1 42 HIS CG C 1.115 -7.766 2.625 1.00 . A A . 42 HIS CG 1 1 11 11776 1 1 42 HIS H H 1.499 -5.252 4.759 1.00 . A A . 42 HIS H 1 1 11 11777 1 1 42 HIS HA H 2.988 -7.673 4.399 1.00 . A A . 42 HIS HA 1 1 11 11778 1 1 42 HIS HB2 H 1.654 -5.751 2.569 1.00 . A A . 42 HIS HB2 1 1 11 11779 1 1 42 HIS HB3 H 2.867 -6.848 1.917 1.00 . A A . 42 HIS HB3 1 1 11 11780 1 1 42 HIS HD1 H -0.602 -6.625 2.185 1.00 . A A . 42 HIS HD1 1 1 11 11781 1 1 42 HIS HD2 H 2.109 -9.663 3.017 1.00 . A A . 42 HIS HD2 1 1 11 11782 1 1 42 HIS HE1 H -1.950 -8.748 2.186 1.00 . A A . 42 HIS HE1 1 1 11 11783 1 1 42 HIS HE2 H -0.278 -10.580 2.630 1.00 . A A . 42 HIS HE2 1 1 11 11784 1 1 42 HIS N N 2.109 -5.961 5.050 1.00 . A A . 42 HIS N 1 1 11 11785 1 1 42 HIS ND1 N -0.213 -7.509 2.356 1.00 . A A . 42 HIS ND1 1 1 11 11786 1 1 42 HIS NE2 N -0.049 -9.627 2.626 1.00 . A A . 42 HIS NE2 1 1 11 11787 1 1 42 HIS O O 4.585 -5.331 3.060 1.00 . A A . 42 HIS O 1 1 11 11788 1 1 43 VAL C C 7.266 -6.428 3.760 1.00 . A A . 43 VAL C 1 1 11 11789 1 1 43 VAL CA C 6.472 -6.174 5.023 1.00 . A A . 43 VAL CA 1 1 11 11790 1 1 43 VAL CB C 7.147 -6.911 6.199 1.00 . A A . 43 VAL CB 1 1 11 11791 1 1 43 VAL CG1 C 8.594 -6.471 6.360 1.00 . A A . 43 VAL CG1 1 1 11 11792 1 1 43 VAL CG2 C 6.371 -6.681 7.488 1.00 . A A . 43 VAL CG2 1 1 11 11793 1 1 43 VAL H H 4.696 -7.192 5.562 1.00 . A A . 43 VAL H 1 1 11 11794 1 1 43 VAL HA H 6.501 -5.124 5.229 1.00 . A A . 43 VAL HA 1 1 11 11795 1 1 43 VAL HB H 7.139 -7.969 5.987 1.00 . A A . 43 VAL HB 1 1 11 11796 1 1 43 VAL HG11 H 8.626 -5.417 6.576 1.00 . A A . 43 VAL HG11 1 1 11 11797 1 1 43 VAL HG12 H 9.136 -6.666 5.447 1.00 . A A . 43 VAL HG12 1 1 11 11798 1 1 43 VAL HG13 H 9.049 -7.019 7.171 1.00 . A A . 43 VAL HG13 1 1 11 11799 1 1 43 VAL HG21 H 5.368 -7.062 7.378 1.00 . A A . 43 VAL HG21 1 1 11 11800 1 1 43 VAL HG22 H 6.333 -5.623 7.702 1.00 . A A . 43 VAL HG22 1 1 11 11801 1 1 43 VAL HG23 H 6.863 -7.193 8.301 1.00 . A A . 43 VAL HG23 1 1 11 11802 1 1 43 VAL N N 5.077 -6.575 4.895 1.00 . A A . 43 VAL N 1 1 11 11803 1 1 43 VAL O O 8.071 -7.353 3.689 1.00 . A A . 43 VAL O 1 1 11 11804 1 1 44 ALA C C 8.990 -4.807 1.579 1.00 . A A . 44 ALA C 1 1 11 11805 1 1 44 ALA CA C 7.748 -5.673 1.510 1.00 . A A . 44 ALA CA 1 1 11 11806 1 1 44 ALA CB C 6.856 -5.259 0.351 1.00 . A A . 44 ALA CB 1 1 11 11807 1 1 44 ALA H H 6.358 -4.885 2.880 1.00 . A A . 44 ALA H 1 1 11 11808 1 1 44 ALA HA H 8.048 -6.699 1.367 1.00 . A A . 44 ALA HA 1 1 11 11809 1 1 44 ALA HB1 H 6.639 -4.203 0.421 1.00 . A A . 44 ALA HB1 1 1 11 11810 1 1 44 ALA HB2 H 5.935 -5.819 0.387 1.00 . A A . 44 ALA HB2 1 1 11 11811 1 1 44 ALA HB3 H 7.363 -5.460 -0.580 1.00 . A A . 44 ALA HB3 1 1 11 11812 1 1 44 ALA N N 7.035 -5.585 2.764 1.00 . A A . 44 ALA N 1 1 11 11813 1 1 44 ALA O O 9.243 -3.980 0.702 1.00 . A A . 44 ALA O 1 1 11 11814 1 1 45 GLU C C 11.826 -4.238 1.587 1.00 . A A . 45 GLU C 1 1 11 11815 1 1 45 GLU CA C 10.995 -4.259 2.859 1.00 . A A . 45 GLU CA 1 1 11 11816 1 1 45 GLU CB C 11.800 -4.874 4.006 1.00 . A A . 45 GLU CB 1 1 11 11817 1 1 45 GLU CD C 13.923 -4.835 5.375 1.00 . A A . 45 GLU CD 1 1 11 11818 1 1 45 GLU CG C 13.147 -4.207 4.232 1.00 . A A . 45 GLU CG 1 1 11 11819 1 1 45 GLU H H 9.509 -5.701 3.285 1.00 . A A . 45 GLU H 1 1 11 11820 1 1 45 GLU HA H 10.724 -3.246 3.119 1.00 . A A . 45 GLU HA 1 1 11 11821 1 1 45 GLU HB2 H 11.226 -4.795 4.917 1.00 . A A . 45 GLU HB2 1 1 11 11822 1 1 45 GLU HB3 H 11.971 -5.919 3.790 1.00 . A A . 45 GLU HB3 1 1 11 11823 1 1 45 GLU HG2 H 13.733 -4.294 3.330 1.00 . A A . 45 GLU HG2 1 1 11 11824 1 1 45 GLU HG3 H 12.985 -3.164 4.456 1.00 . A A . 45 GLU HG3 1 1 11 11825 1 1 45 GLU N N 9.765 -5.011 2.642 1.00 . A A . 45 GLU N 1 1 11 11826 1 1 45 GLU O O 12.610 -3.318 1.354 1.00 . A A . 45 GLU O 1 1 11 11827 1 1 45 GLU OE1 O 14.655 -5.815 5.127 1.00 . A A . 45 GLU OE1 1 1 11 11828 1 1 45 GLU OE2 O 13.795 -4.345 6.516 1.00 . A A . 45 GLU OE2 1 1 11 11829 1 1 46 ASP C C 11.826 -4.326 -1.466 1.00 . A A . 46 ASP C 1 1 11 11830 1 1 46 ASP CA C 12.355 -5.367 -0.495 1.00 . A A . 46 ASP CA 1 1 11 11831 1 1 46 ASP CB C 12.196 -6.761 -1.093 1.00 . A A . 46 ASP CB 1 1 11 11832 1 1 46 ASP CG C 12.743 -7.849 -0.188 1.00 . A A . 46 ASP CG 1 1 11 11833 1 1 46 ASP H H 11.018 -5.980 1.031 1.00 . A A . 46 ASP H 1 1 11 11834 1 1 46 ASP HA H 13.403 -5.171 -0.317 1.00 . A A . 46 ASP HA 1 1 11 11835 1 1 46 ASP HB2 H 11.148 -6.952 -1.262 1.00 . A A . 46 ASP HB2 1 1 11 11836 1 1 46 ASP HB3 H 12.723 -6.802 -2.035 1.00 . A A . 46 ASP HB3 1 1 11 11837 1 1 46 ASP N N 11.646 -5.268 0.771 1.00 . A A . 46 ASP N 1 1 11 11838 1 1 46 ASP O O 12.594 -3.616 -2.108 1.00 . A A . 46 ASP O 1 1 11 11839 1 1 46 ASP OD1 O 11.983 -8.341 0.673 1.00 . A A . 46 ASP OD1 1 1 11 11840 1 1 46 ASP OD2 O 13.928 -8.210 -0.342 1.00 . A A . 46 ASP OD2 1 1 11 11841 1 1 47 VAL C C 10.270 -1.856 -2.021 1.00 . A A . 47 VAL C 1 1 11 11842 1 1 47 VAL CA C 9.885 -3.262 -2.449 1.00 . A A . 47 VAL CA 1 1 11 11843 1 1 47 VAL CB C 8.351 -3.399 -2.448 1.00 . A A . 47 VAL CB 1 1 11 11844 1 1 47 VAL CG1 C 7.721 -2.381 -3.385 1.00 . A A . 47 VAL CG1 1 1 11 11845 1 1 47 VAL CG2 C 7.949 -4.811 -2.839 1.00 . A A . 47 VAL CG2 1 1 11 11846 1 1 47 VAL H H 9.937 -4.818 -1.015 1.00 . A A . 47 VAL H 1 1 11 11847 1 1 47 VAL HA H 10.248 -3.440 -3.452 1.00 . A A . 47 VAL HA 1 1 11 11848 1 1 47 VAL HB H 7.990 -3.208 -1.447 1.00 . A A . 47 VAL HB 1 1 11 11849 1 1 47 VAL HG11 H 8.048 -1.389 -3.113 1.00 . A A . 47 VAL HG11 1 1 11 11850 1 1 47 VAL HG12 H 6.646 -2.440 -3.309 1.00 . A A . 47 VAL HG12 1 1 11 11851 1 1 47 VAL HG13 H 8.022 -2.593 -4.400 1.00 . A A . 47 VAL HG13 1 1 11 11852 1 1 47 VAL HG21 H 6.883 -4.927 -2.723 1.00 . A A . 47 VAL HG21 1 1 11 11853 1 1 47 VAL HG22 H 8.458 -5.520 -2.202 1.00 . A A . 47 VAL HG22 1 1 11 11854 1 1 47 VAL HG23 H 8.222 -4.993 -3.869 1.00 . A A . 47 VAL HG23 1 1 11 11855 1 1 47 VAL N N 10.505 -4.232 -1.562 1.00 . A A . 47 VAL N 1 1 11 11856 1 1 47 VAL O O 10.651 -1.046 -2.834 1.00 . A A . 47 VAL O 1 1 11 11857 1 1 48 ALA C C 11.988 -0.061 -0.120 1.00 . A A . 48 ALA C 1 1 11 11858 1 1 48 ALA CA C 10.498 -0.360 -0.056 1.00 . A A . 48 ALA CA 1 1 11 11859 1 1 48 ALA CB C 10.052 -0.424 1.396 1.00 . A A . 48 ALA CB 1 1 11 11860 1 1 48 ALA H H 9.879 -2.344 -0.183 1.00 . A A . 48 ALA H 1 1 11 11861 1 1 48 ALA HA H 9.949 0.434 -0.529 1.00 . A A . 48 ALA HA 1 1 11 11862 1 1 48 ALA HB1 H 8.975 -0.493 1.438 1.00 . A A . 48 ALA HB1 1 1 11 11863 1 1 48 ALA HB2 H 10.375 0.470 1.910 1.00 . A A . 48 ALA HB2 1 1 11 11864 1 1 48 ALA HB3 H 10.489 -1.290 1.869 1.00 . A A . 48 ALA HB3 1 1 11 11865 1 1 48 ALA N N 10.177 -1.626 -0.720 1.00 . A A . 48 ALA N 1 1 11 11866 1 1 48 ALA O O 12.401 0.977 -0.636 1.00 . A A . 48 ALA O 1 1 11 11867 1 1 49 LYS C C 14.729 -0.632 -1.027 1.00 . A A . 49 LYS C 1 1 11 11868 1 1 49 LYS CA C 14.242 -0.803 0.404 1.00 . A A . 49 LYS CA 1 1 11 11869 1 1 49 LYS CB C 14.925 -2.004 1.067 1.00 . A A . 49 LYS CB 1 1 11 11870 1 1 49 LYS CD C 17.247 -2.224 0.102 1.00 . A A . 49 LYS CD 1 1 11 11871 1 1 49 LYS CE C 17.134 -3.716 -0.172 1.00 . A A . 49 LYS CE 1 1 11 11872 1 1 49 LYS CG C 16.415 -1.811 1.308 1.00 . A A . 49 LYS CG 1 1 11 11873 1 1 49 LYS H H 12.410 -1.796 0.792 1.00 . A A . 49 LYS H 1 1 11 11874 1 1 49 LYS HA H 14.472 0.091 0.963 1.00 . A A . 49 LYS HA 1 1 11 11875 1 1 49 LYS HB2 H 14.451 -2.191 2.019 1.00 . A A . 49 LYS HB2 1 1 11 11876 1 1 49 LYS HB3 H 14.792 -2.869 0.435 1.00 . A A . 49 LYS HB3 1 1 11 11877 1 1 49 LYS HD2 H 16.903 -1.683 -0.765 1.00 . A A . 49 LYS HD2 1 1 11 11878 1 1 49 LYS HD3 H 18.282 -1.980 0.292 1.00 . A A . 49 LYS HD3 1 1 11 11879 1 1 49 LYS HE2 H 17.374 -4.255 0.733 1.00 . A A . 49 LYS HE2 1 1 11 11880 1 1 49 LYS HE3 H 16.119 -3.941 -0.465 1.00 . A A . 49 LYS HE3 1 1 11 11881 1 1 49 LYS HG2 H 16.602 -0.768 1.518 1.00 . A A . 49 LYS HG2 1 1 11 11882 1 1 49 LYS HG3 H 16.710 -2.408 2.159 1.00 . A A . 49 LYS HG3 1 1 11 11883 1 1 49 LYS HZ1 H 19.042 -3.946 -0.993 1.00 . A A . 49 LYS HZ1 1 1 11 11884 1 1 49 LYS HZ2 H 17.832 -3.657 -2.140 1.00 . A A . 49 LYS HZ2 1 1 11 11885 1 1 49 LYS HZ3 H 17.962 -5.179 -1.414 1.00 . A A . 49 LYS HZ3 1 1 11 11886 1 1 49 LYS N N 12.795 -0.978 0.407 1.00 . A A . 49 LYS N 1 1 11 11887 1 1 49 LYS NZ N 18.057 -4.155 -1.255 1.00 . A A . 49 LYS NZ 1 1 11 11888 1 1 49 LYS O O 15.709 0.063 -1.291 1.00 . A A . 49 LYS O 1 1 11 11889 1 1 50 ASP C C 13.576 -0.072 -4.028 1.00 . A A . 50 ASP C 1 1 11 11890 1 1 50 ASP CA C 14.359 -1.202 -3.356 1.00 . A A . 50 ASP CA 1 1 11 11891 1 1 50 ASP CB C 14.060 -2.535 -4.044 1.00 . A A . 50 ASP CB 1 1 11 11892 1 1 50 ASP CG C 14.808 -2.693 -5.353 1.00 . A A . 50 ASP CG 1 1 11 11893 1 1 50 ASP H H 13.260 -1.816 -1.666 1.00 . A A . 50 ASP H 1 1 11 11894 1 1 50 ASP HA H 15.415 -0.992 -3.439 1.00 . A A . 50 ASP HA 1 1 11 11895 1 1 50 ASP HB2 H 14.344 -3.347 -3.385 1.00 . A A . 50 ASP HB2 1 1 11 11896 1 1 50 ASP HB3 H 13.000 -2.597 -4.246 1.00 . A A . 50 ASP HB3 1 1 11 11897 1 1 50 ASP N N 14.030 -1.281 -1.945 1.00 . A A . 50 ASP N 1 1 11 11898 1 1 50 ASP O O 13.916 0.361 -5.130 1.00 . A A . 50 ASP O 1 1 11 11899 1 1 50 ASP OD1 O 15.976 -3.135 -5.320 1.00 . A A . 50 ASP OD1 1 1 11 11900 1 1 50 ASP OD2 O 14.227 -2.372 -6.411 1.00 . A A . 50 ASP OD2 1 1 11 11901 1 1 51 TYR C C 12.351 2.818 -3.703 1.00 . A A . 51 TYR C 1 1 11 11902 1 1 51 TYR CA C 11.692 1.465 -3.897 1.00 . A A . 51 TYR CA 1 1 11 11903 1 1 51 TYR CB C 10.313 1.504 -3.246 1.00 . A A . 51 TYR CB 1 1 11 11904 1 1 51 TYR CD1 C 9.508 -0.056 -5.089 1.00 . A A . 51 TYR CD1 1 1 11 11905 1 1 51 TYR CD2 C 7.872 1.039 -3.741 1.00 . A A . 51 TYR CD2 1 1 11 11906 1 1 51 TYR CE1 C 8.504 -0.672 -5.811 1.00 . A A . 51 TYR CE1 1 1 11 11907 1 1 51 TYR CE2 C 6.865 0.422 -4.458 1.00 . A A . 51 TYR CE2 1 1 11 11908 1 1 51 TYR CG C 9.213 0.813 -4.041 1.00 . A A . 51 TYR CG 1 1 11 11909 1 1 51 TYR CZ C 7.186 -0.431 -5.492 1.00 . A A . 51 TYR CZ 1 1 11 11910 1 1 51 TYR H H 12.292 0.022 -2.494 1.00 . A A . 51 TYR H 1 1 11 11911 1 1 51 TYR HA H 11.566 1.257 -4.925 1.00 . A A . 51 TYR HA 1 1 11 11912 1 1 51 TYR HB2 H 10.382 1.029 -2.298 1.00 . A A . 51 TYR HB2 1 1 11 11913 1 1 51 TYR HB3 H 10.019 2.534 -3.103 1.00 . A A . 51 TYR HB3 1 1 11 11914 1 1 51 TYR HD1 H 10.538 -0.252 -5.338 1.00 . A A . 51 TYR HD1 1 1 11 11915 1 1 51 TYR HD2 H 7.621 1.704 -2.928 1.00 . A A . 51 TYR HD2 1 1 11 11916 1 1 51 TYR HE1 H 8.755 -1.343 -6.620 1.00 . A A . 51 TYR HE1 1 1 11 11917 1 1 51 TYR HE2 H 5.832 0.612 -4.208 1.00 . A A . 51 TYR HE2 1 1 11 11918 1 1 51 TYR HH H 6.427 -1.959 -6.379 1.00 . A A . 51 TYR HH 1 1 11 11919 1 1 51 TYR N N 12.521 0.402 -3.358 1.00 . A A . 51 TYR N 1 1 11 11920 1 1 51 TYR O O 12.722 3.496 -4.662 1.00 . A A . 51 TYR O 1 1 11 11921 1 1 51 TYR OH O 6.185 -1.045 -6.209 1.00 . A A . 51 TYR OH 1 1 11 11922 1 1 52 GLU C C 14.595 4.364 -1.943 1.00 . A A . 52 GLU C 1 1 11 11923 1 1 52 GLU CA C 13.080 4.474 -2.071 1.00 . A A . 52 GLU CA 1 1 11 11924 1 1 52 GLU CB C 12.484 4.981 -0.754 1.00 . A A . 52 GLU CB 1 1 11 11925 1 1 52 GLU CD C 12.269 4.662 1.743 1.00 . A A . 52 GLU CD 1 1 11 11926 1 1 52 GLU CG C 12.886 4.153 0.455 1.00 . A A . 52 GLU CG 1 1 11 11927 1 1 52 GLU H H 12.192 2.588 -1.724 1.00 . A A . 52 GLU H 1 1 11 11928 1 1 52 GLU HA H 12.843 5.173 -2.851 1.00 . A A . 52 GLU HA 1 1 11 11929 1 1 52 GLU HB2 H 12.811 5.997 -0.592 1.00 . A A . 52 GLU HB2 1 1 11 11930 1 1 52 GLU HB3 H 11.407 4.967 -0.832 1.00 . A A . 52 GLU HB3 1 1 11 11931 1 1 52 GLU HG2 H 12.566 3.134 0.300 1.00 . A A . 52 GLU HG2 1 1 11 11932 1 1 52 GLU HG3 H 13.961 4.181 0.554 1.00 . A A . 52 GLU HG3 1 1 11 11933 1 1 52 GLU N N 12.489 3.196 -2.434 1.00 . A A . 52 GLU N 1 1 11 11934 1 1 52 GLU O O 15.337 5.206 -2.449 1.00 . A A . 52 GLU O 1 1 11 11935 1 1 52 GLU OE1 O 12.703 5.728 2.228 1.00 . A A . 52 GLU OE1 1 1 11 11936 1 1 52 GLU OE2 O 11.354 3.992 2.268 1.00 . A A . 52 GLU OE2 1 1 11 11937 1 1 53 ASP C C 17.102 2.398 -2.255 1.00 . A A . 53 ASP C 1 1 11 11938 1 1 53 ASP CA C 16.464 3.088 -1.051 1.00 . A A . 53 ASP CA 1 1 11 11939 1 1 53 ASP CB C 16.666 2.251 0.211 1.00 . A A . 53 ASP CB 1 1 11 11940 1 1 53 ASP CG C 16.663 3.096 1.469 1.00 . A A . 53 ASP CG 1 1 11 11941 1 1 53 ASP H H 14.397 2.681 -0.890 1.00 . A A . 53 ASP H 1 1 11 11942 1 1 53 ASP HA H 16.936 4.049 -0.912 1.00 . A A . 53 ASP HA 1 1 11 11943 1 1 53 ASP HB2 H 15.862 1.530 0.286 1.00 . A A . 53 ASP HB2 1 1 11 11944 1 1 53 ASP HB3 H 17.610 1.730 0.147 1.00 . A A . 53 ASP HB3 1 1 11 11945 1 1 53 ASP N N 15.042 3.318 -1.262 1.00 . A A . 53 ASP N 1 1 11 11946 1 1 53 ASP O O 18.320 2.435 -2.425 1.00 . A A . 53 ASP O 1 1 11 11947 1 1 53 ASP OD1 O 17.723 3.662 1.808 1.00 . A A . 53 ASP OD1 1 1 11 11948 1 1 53 ASP OD2 O 15.599 3.192 2.118 1.00 . A A . 53 ASP OD2 1 1 11 11949 1 1 54 GLY C C 17.157 2.057 -5.375 1.00 . A A . 54 GLY C 1 1 11 11950 1 1 54 GLY CA C 16.790 1.092 -4.263 1.00 . A A . 54 GLY CA 1 1 11 11951 1 1 54 GLY H H 15.315 1.768 -2.905 1.00 . A A . 54 GLY H 1 1 11 11952 1 1 54 GLY HA2 H 17.669 0.530 -3.986 1.00 . A A . 54 GLY HA2 1 1 11 11953 1 1 54 GLY HA3 H 16.039 0.409 -4.629 1.00 . A A . 54 GLY HA3 1 1 11 11954 1 1 54 GLY N N 16.277 1.772 -3.089 1.00 . A A . 54 GLY N 1 1 11 11955 1 1 54 GLY O O 18.109 1.823 -6.120 1.00 . A A . 54 GLY O 1 1 11 11956 1 1 55 LEU C C 17.786 5.076 -6.092 1.00 . A A . 55 LEU C 1 1 11 11957 1 1 55 LEU CA C 16.650 4.148 -6.512 1.00 . A A . 55 LEU CA 1 1 11 11958 1 1 55 LEU CB C 15.384 4.965 -6.778 1.00 . A A . 55 LEU CB 1 1 11 11959 1 1 55 LEU CD1 C 15.664 5.245 -9.255 1.00 . A A . 55 LEU CD1 1 1 11 11960 1 1 55 LEU CD2 C 14.266 6.869 -7.966 1.00 . A A . 55 LEU CD2 1 1 11 11961 1 1 55 LEU CG C 15.491 5.969 -7.928 1.00 . A A . 55 LEU CG 1 1 11 11962 1 1 55 LEU H H 15.654 3.271 -4.864 1.00 . A A . 55 LEU H 1 1 11 11963 1 1 55 LEU HA H 16.935 3.635 -7.418 1.00 . A A . 55 LEU HA 1 1 11 11964 1 1 55 LEU HB2 H 14.578 4.280 -7.000 1.00 . A A . 55 LEU HB2 1 1 11 11965 1 1 55 LEU HB3 H 15.135 5.508 -5.880 1.00 . A A . 55 LEU HB3 1 1 11 11966 1 1 55 LEU HD11 H 16.572 4.661 -9.231 1.00 . A A . 55 LEU HD11 1 1 11 11967 1 1 55 LEU HD12 H 15.722 5.967 -10.055 1.00 . A A . 55 LEU HD12 1 1 11 11968 1 1 55 LEU HD13 H 14.819 4.591 -9.420 1.00 . A A . 55 LEU HD13 1 1 11 11969 1 1 55 LEU HD21 H 14.203 7.431 -7.045 1.00 . A A . 55 LEU HD21 1 1 11 11970 1 1 55 LEU HD22 H 13.378 6.265 -8.080 1.00 . A A . 55 LEU HD22 1 1 11 11971 1 1 55 LEU HD23 H 14.346 7.552 -8.799 1.00 . A A . 55 LEU HD23 1 1 11 11972 1 1 55 LEU HG H 16.360 6.591 -7.774 1.00 . A A . 55 LEU HG 1 1 11 11973 1 1 55 LEU N N 16.400 3.143 -5.486 1.00 . A A . 55 LEU N 1 1 11 11974 1 1 55 LEU O O 18.879 5.030 -6.657 1.00 . A A . 55 LEU O 1 1 11 11975 1 1 56 GLU C C 19.338 6.234 -3.473 1.00 . A A . 56 GLU C 1 1 11 11976 1 1 56 GLU CA C 18.519 6.854 -4.599 1.00 . A A . 56 GLU CA 1 1 11 11977 1 1 56 GLU CB C 17.849 8.135 -4.112 1.00 . A A . 56 GLU CB 1 1 11 11978 1 1 56 GLU CD C 16.526 10.199 -4.718 1.00 . A A . 56 GLU CD 1 1 11 11979 1 1 56 GLU CG C 17.098 8.881 -5.202 1.00 . A A . 56 GLU CG 1 1 11 11980 1 1 56 GLU H H 16.630 5.905 -4.687 1.00 . A A . 56 GLU H 1 1 11 11981 1 1 56 GLU HA H 19.178 7.096 -5.413 1.00 . A A . 56 GLU HA 1 1 11 11982 1 1 56 GLU HB2 H 17.151 7.882 -3.334 1.00 . A A . 56 GLU HB2 1 1 11 11983 1 1 56 GLU HB3 H 18.603 8.793 -3.708 1.00 . A A . 56 GLU HB3 1 1 11 11984 1 1 56 GLU HG2 H 17.775 9.079 -6.019 1.00 . A A . 56 GLU HG2 1 1 11 11985 1 1 56 GLU HG3 H 16.286 8.260 -5.550 1.00 . A A . 56 GLU HG3 1 1 11 11986 1 1 56 GLU N N 17.520 5.916 -5.097 1.00 . A A . 56 GLU N 1 1 11 11987 1 1 56 GLU O O 19.289 6.692 -2.330 1.00 . A A . 56 GLU O 1 1 11 11988 1 1 56 GLU OE1 O 15.415 10.191 -4.148 1.00 . A A . 56 GLU OE1 1 1 11 11989 1 1 56 GLU OE2 O 17.191 11.239 -4.910 1.00 . A A . 56 GLU OE2 1 1 11 11990 1 1 57 TYR C C 22.246 5.235 -2.625 1.00 . A A . 57 TYR C 1 1 11 11991 1 1 57 TYR CA C 20.921 4.503 -2.820 1.00 . A A . 57 TYR CA 1 1 11 11992 1 1 57 TYR CB C 21.183 3.061 -3.260 1.00 . A A . 57 TYR CB 1 1 11 11993 1 1 57 TYR CD1 C 23.300 2.259 -2.144 1.00 . A A . 57 TYR CD1 1 1 11 11994 1 1 57 TYR CD2 C 21.217 1.430 -1.333 1.00 . A A . 57 TYR CD2 1 1 11 11995 1 1 57 TYR CE1 C 23.972 1.503 -1.201 1.00 . A A . 57 TYR CE1 1 1 11 11996 1 1 57 TYR CE2 C 21.881 0.673 -0.388 1.00 . A A . 57 TYR CE2 1 1 11 11997 1 1 57 TYR CG C 21.914 2.234 -2.226 1.00 . A A . 57 TYR CG 1 1 11 11998 1 1 57 TYR CZ C 23.258 0.713 -0.325 1.00 . A A . 57 TYR CZ 1 1 11 11999 1 1 57 TYR H H 20.082 4.869 -4.727 1.00 . A A . 57 TYR H 1 1 11 12000 1 1 57 TYR HA H 20.388 4.493 -1.882 1.00 . A A . 57 TYR HA 1 1 11 12001 1 1 57 TYR HB2 H 20.239 2.577 -3.464 1.00 . A A . 57 TYR HB2 1 1 11 12002 1 1 57 TYR HB3 H 21.779 3.070 -4.160 1.00 . A A . 57 TYR HB3 1 1 11 12003 1 1 57 TYR HD1 H 23.857 2.879 -2.831 1.00 . A A . 57 TYR HD1 1 1 11 12004 1 1 57 TYR HD2 H 20.139 1.401 -1.386 1.00 . A A . 57 TYR HD2 1 1 11 12005 1 1 57 TYR HE1 H 25.050 1.535 -1.152 1.00 . A A . 57 TYR HE1 1 1 11 12006 1 1 57 TYR HE2 H 21.321 0.054 0.298 1.00 . A A . 57 TYR HE2 1 1 11 12007 1 1 57 TYR HH H 23.544 -0.923 0.644 1.00 . A A . 57 TYR HH 1 1 11 12008 1 1 57 TYR N N 20.089 5.188 -3.801 1.00 . A A . 57 TYR N 1 1 11 12009 1 1 57 TYR O O 23.208 4.921 -3.358 1.00 . A A . 57 TYR O 1 1 11 12010 1 1 57 TYR OXT O 22.310 6.117 -1.743 1.00 . A A . 57 TYR OXT 1 1 11 12011 1 1 57 TYR OH O 23.922 -0.040 0.616 1.00 . A A . 57 TYR OH 1 1 11 12012 2 2 1 ALA C C -13.518 -9.128 1.731 1.00 . B B . 1 ALA C 1 1 11 12013 2 2 1 ALA CA C -13.485 -10.637 1.503 1.00 . B B . 1 ALA CA 1 1 11 12014 2 2 1 ALA CB C -13.042 -10.945 0.080 1.00 . B B . 1 ALA CB 1 1 11 12015 2 2 1 ALA H1 H -14.774 -12.274 1.616 1.00 . B B . 1 ALA H1 1 1 11 12016 2 2 1 ALA H2 H -15.527 -10.841 1.128 1.00 . B B . 1 ALA H2 1 1 11 12017 2 2 1 ALA H3 H -15.101 -11.061 2.751 1.00 . B B . 1 ALA H3 1 1 11 12018 2 2 1 ALA HA H -12.769 -11.081 2.177 1.00 . B B . 1 ALA HA 1 1 11 12019 2 2 1 ALA HB1 H -13.007 -12.013 -0.064 1.00 . B B . 1 ALA HB1 1 1 11 12020 2 2 1 ALA HB2 H -12.061 -10.526 -0.090 1.00 . B B . 1 ALA HB2 1 1 11 12021 2 2 1 ALA HB3 H -13.743 -10.510 -0.617 1.00 . B B . 1 ALA HB3 1 1 11 12022 2 2 1 ALA N N -14.815 -11.246 1.768 1.00 . B B . 1 ALA N 1 1 11 12023 2 2 1 ALA O O -14.024 -8.379 0.894 1.00 . B B . 1 ALA O 1 1 11 12024 2 2 2 PRO C C -12.537 -6.364 2.013 1.00 . B B . 2 PRO C 1 1 11 12025 2 2 2 PRO CA C -12.952 -7.231 3.201 1.00 . B B . 2 PRO CA 1 1 11 12026 2 2 2 PRO CB C -11.906 -7.158 4.310 1.00 . B B . 2 PRO CB 1 1 11 12027 2 2 2 PRO CD C -12.350 -9.478 3.926 1.00 . B B . 2 PRO CD 1 1 11 12028 2 2 2 PRO CG C -12.004 -8.476 4.996 1.00 . B B . 2 PRO CG 1 1 11 12029 2 2 2 PRO HA H -13.905 -6.894 3.580 1.00 . B B . 2 PRO HA 1 1 11 12030 2 2 2 PRO HB2 H -10.927 -7.007 3.877 1.00 . B B . 2 PRO HB2 1 1 11 12031 2 2 2 PRO HB3 H -12.141 -6.346 4.981 1.00 . B B . 2 PRO HB3 1 1 11 12032 2 2 2 PRO HD2 H -11.456 -9.959 3.557 1.00 . B B . 2 PRO HD2 1 1 11 12033 2 2 2 PRO HD3 H -13.046 -10.212 4.307 1.00 . B B . 2 PRO HD3 1 1 11 12034 2 2 2 PRO HG2 H -11.058 -8.725 5.451 1.00 . B B . 2 PRO HG2 1 1 11 12035 2 2 2 PRO HG3 H -12.784 -8.442 5.744 1.00 . B B . 2 PRO HG3 1 1 11 12036 2 2 2 PRO N N -12.979 -8.657 2.870 1.00 . B B . 2 PRO N 1 1 11 12037 2 2 2 PRO O O -11.365 -6.332 1.639 1.00 . B B . 2 PRO O 1 1 11 12038 2 2 3 PRO C C -12.411 -3.550 0.634 1.00 . B B . 3 PRO C 1 1 11 12039 2 2 3 PRO CA C -13.226 -4.781 0.252 1.00 . B B . 3 PRO CA 1 1 11 12040 2 2 3 PRO CB C -14.621 -4.372 -0.225 1.00 . B B . 3 PRO CB 1 1 11 12041 2 2 3 PRO CD C -14.924 -5.631 1.784 1.00 . B B . 3 PRO CD 1 1 11 12042 2 2 3 PRO CG C -15.486 -4.492 0.981 1.00 . B B . 3 PRO CG 1 1 11 12043 2 2 3 PRO HA H -12.716 -5.317 -0.535 1.00 . B B . 3 PRO HA 1 1 11 12044 2 2 3 PRO HB2 H -14.595 -3.356 -0.594 1.00 . B B . 3 PRO HB2 1 1 11 12045 2 2 3 PRO HB3 H -14.946 -5.038 -1.010 1.00 . B B . 3 PRO HB3 1 1 11 12046 2 2 3 PRO HD2 H -15.037 -5.441 2.840 1.00 . B B . 3 PRO HD2 1 1 11 12047 2 2 3 PRO HD3 H -15.406 -6.559 1.512 1.00 . B B . 3 PRO HD3 1 1 11 12048 2 2 3 PRO HG2 H -15.448 -3.576 1.553 1.00 . B B . 3 PRO HG2 1 1 11 12049 2 2 3 PRO HG3 H -16.502 -4.708 0.685 1.00 . B B . 3 PRO HG3 1 1 11 12050 2 2 3 PRO N N -13.499 -5.649 1.402 1.00 . B B . 3 PRO N 1 1 11 12051 2 2 3 PRO O O -12.906 -2.424 0.581 1.00 . B B . 3 PRO O 1 1 11 12052 2 2 4 GLY C C -8.953 -2.713 0.694 1.00 . B B . 4 GLY C 1 1 11 12053 2 2 4 GLY CA C -10.291 -2.675 1.405 1.00 . B B . 4 GLY CA 1 1 11 12054 2 2 4 GLY H H -10.820 -4.692 1.040 1.00 . B B . 4 GLY H 1 1 11 12055 2 2 4 GLY HA2 H -10.782 -1.745 1.181 1.00 . B B . 4 GLY HA2 1 1 11 12056 2 2 4 GLY HA3 H -10.118 -2.728 2.471 1.00 . B B . 4 GLY HA3 1 1 11 12057 2 2 4 GLY N N -11.158 -3.773 1.018 1.00 . B B . 4 GLY N 1 1 11 12058 2 2 4 GLY O O -7.931 -2.365 1.274 1.00 . B B . 4 GLY O 1 1 11 12059 2 2 5 THR C C -7.983 -3.051 -2.843 1.00 . B B . 5 THR C 1 1 11 12060 2 2 5 THR CA C -7.729 -3.224 -1.351 1.00 . B B . 5 THR CA 1 1 11 12061 2 2 5 THR CB C -7.036 -4.580 -1.116 1.00 . B B . 5 THR CB 1 1 11 12062 2 2 5 THR CG2 C -6.773 -4.800 0.365 1.00 . B B . 5 THR CG2 1 1 11 12063 2 2 5 THR H H -9.819 -3.322 -0.996 1.00 . B B . 5 THR H 1 1 11 12064 2 2 5 THR HA H -7.064 -2.445 -1.024 1.00 . B B . 5 THR HA 1 1 11 12065 2 2 5 THR HB H -6.091 -4.581 -1.639 1.00 . B B . 5 THR HB 1 1 11 12066 2 2 5 THR HG1 H -7.322 -6.434 -1.728 1.00 . B B . 5 THR HG1 1 1 11 12067 2 2 5 THR HG21 H -6.186 -3.981 0.753 1.00 . B B . 5 THR HG21 1 1 11 12068 2 2 5 THR HG22 H -6.234 -5.726 0.501 1.00 . B B . 5 THR HG22 1 1 11 12069 2 2 5 THR HG23 H -7.714 -4.850 0.894 1.00 . B B . 5 THR HG23 1 1 11 12070 2 2 5 THR N N -8.962 -3.121 -0.571 1.00 . B B . 5 THR N 1 1 11 12071 2 2 5 THR O O -9.080 -3.329 -3.328 1.00 . B B . 5 THR O 1 1 11 12072 2 2 5 THR OG1 O -7.854 -5.642 -1.622 1.00 . B B . 5 THR OG1 1 1 11 12073 2 2 6 ALA C C -5.777 -2.370 -5.768 1.00 . B B . 6 ALA C 1 1 11 12074 2 2 6 ALA CA C -7.112 -2.403 -5.019 1.00 . B B . 6 ALA CA 1 1 11 12075 2 2 6 ALA CB C -7.893 -1.136 -5.299 1.00 . B B . 6 ALA CB 1 1 11 12076 2 2 6 ALA H H -6.126 -2.342 -3.136 1.00 . B B . 6 ALA H 1 1 11 12077 2 2 6 ALA HA H -7.693 -3.232 -5.394 1.00 . B B . 6 ALA HA 1 1 11 12078 2 2 6 ALA HB1 H -8.799 -1.383 -5.829 1.00 . B B . 6 ALA HB1 1 1 11 12079 2 2 6 ALA HB2 H -7.295 -0.467 -5.900 1.00 . B B . 6 ALA HB2 1 1 11 12080 2 2 6 ALA HB3 H -8.138 -0.659 -4.365 1.00 . B B . 6 ALA HB3 1 1 11 12081 2 2 6 ALA N N -6.967 -2.587 -3.576 1.00 . B B . 6 ALA N 1 1 11 12082 2 2 6 ALA O O -5.354 -3.375 -6.341 1.00 . B B . 6 ALA O 1 1 11 12083 2 2 7 ARG C C -2.918 -2.234 -6.347 1.00 . B B . 7 ARG C 1 1 11 12084 2 2 7 ARG CA C -3.859 -1.035 -6.488 1.00 . B B . 7 ARG CA 1 1 11 12085 2 2 7 ARG CB C -3.159 0.253 -6.057 1.00 . B B . 7 ARG CB 1 1 11 12086 2 2 7 ARG CD C -2.357 0.857 -8.361 1.00 . B B . 7 ARG CD 1 1 11 12087 2 2 7 ARG CG C -1.954 0.606 -6.917 1.00 . B B . 7 ARG CG 1 1 11 12088 2 2 7 ARG CZ C -1.308 1.589 -10.460 1.00 . B B . 7 ARG CZ 1 1 11 12089 2 2 7 ARG H H -5.479 -0.461 -5.246 1.00 . B B . 7 ARG H 1 1 11 12090 2 2 7 ARG HA H -4.115 -0.942 -7.533 1.00 . B B . 7 ARG HA 1 1 11 12091 2 2 7 ARG HB2 H -3.864 1.069 -6.112 1.00 . B B . 7 ARG HB2 1 1 11 12092 2 2 7 ARG HB3 H -2.829 0.145 -5.044 1.00 . B B . 7 ARG HB3 1 1 11 12093 2 2 7 ARG HD2 H -2.847 -0.027 -8.743 1.00 . B B . 7 ARG HD2 1 1 11 12094 2 2 7 ARG HD3 H -3.046 1.689 -8.390 1.00 . B B . 7 ARG HD3 1 1 11 12095 2 2 7 ARG HE H -0.315 1.039 -8.820 1.00 . B B . 7 ARG HE 1 1 11 12096 2 2 7 ARG HG2 H -1.493 1.499 -6.522 1.00 . B B . 7 ARG HG2 1 1 11 12097 2 2 7 ARG HG3 H -1.250 -0.212 -6.885 1.00 . B B . 7 ARG HG3 1 1 11 12098 2 2 7 ARG HH11 H -3.329 1.591 -10.472 1.00 . B B . 7 ARG HH11 1 1 11 12099 2 2 7 ARG HH12 H -2.576 2.096 -11.949 1.00 . B B . 7 ARG HH12 1 1 11 12100 2 2 7 ARG HH21 H 0.688 1.702 -10.759 1.00 . B B . 7 ARG HH21 1 1 11 12101 2 2 7 ARG HH22 H -0.291 2.158 -12.112 1.00 . B B . 7 ARG HH22 1 1 11 12102 2 2 7 ARG N N -5.117 -1.212 -5.760 1.00 . B B . 7 ARG N 1 1 11 12103 2 2 7 ARG NE N -1.206 1.162 -9.205 1.00 . B B . 7 ARG NE 1 1 11 12104 2 2 7 ARG NH1 N -2.502 1.773 -11.005 1.00 . B B . 7 ARG NH1 1 1 11 12105 2 2 7 ARG NH2 N -0.214 1.837 -11.169 1.00 . B B . 7 ARG NH2 1 1 11 12106 2 2 7 ARG O O -3.037 -3.200 -7.100 1.00 . B B . 7 ARG O 1 1 11 12107 2 2 8 ARG C C -1.439 -4.239 -4.122 1.00 . B B . 8 ARG C 1 1 11 12108 2 2 8 ARG CA C -1.035 -3.283 -5.237 1.00 . B B . 8 ARG CA 1 1 11 12109 2 2 8 ARG CB C 0.366 -2.731 -4.983 1.00 . B B . 8 ARG CB 1 1 11 12110 2 2 8 ARG CD C 0.415 -2.075 -7.420 1.00 . B B . 8 ARG CD 1 1 11 12111 2 2 8 ARG CG C 0.807 -1.687 -6.004 1.00 . B B . 8 ARG CG 1 1 11 12112 2 2 8 ARG CZ C 0.746 -3.943 -8.985 1.00 . B B . 8 ARG CZ 1 1 11 12113 2 2 8 ARG H H -1.920 -1.414 -4.784 1.00 . B B . 8 ARG H 1 1 11 12114 2 2 8 ARG HA H -1.023 -3.832 -6.166 1.00 . B B . 8 ARG HA 1 1 11 12115 2 2 8 ARG HB2 H 0.387 -2.276 -4.005 1.00 . B B . 8 ARG HB2 1 1 11 12116 2 2 8 ARG HB3 H 1.072 -3.547 -5.007 1.00 . B B . 8 ARG HB3 1 1 11 12117 2 2 8 ARG HD2 H -0.664 -2.129 -7.477 1.00 . B B . 8 ARG HD2 1 1 11 12118 2 2 8 ARG HD3 H 0.771 -1.315 -8.099 1.00 . B B . 8 ARG HD3 1 1 11 12119 2 2 8 ARG HE H 1.555 -3.824 -7.165 1.00 . B B . 8 ARG HE 1 1 11 12120 2 2 8 ARG HG2 H 0.343 -0.743 -5.765 1.00 . B B . 8 ARG HG2 1 1 11 12121 2 2 8 ARG HG3 H 1.882 -1.583 -5.954 1.00 . B B . 8 ARG HG3 1 1 11 12122 2 2 8 ARG HH11 H -0.432 -2.452 -9.673 1.00 . B B . 8 ARG HH11 1 1 11 12123 2 2 8 ARG HH12 H -0.198 -3.778 -10.764 1.00 . B B . 8 ARG HH12 1 1 11 12124 2 2 8 ARG HH21 H 1.870 -5.576 -8.591 1.00 . B B . 8 ARG HH21 1 1 11 12125 2 2 8 ARG HH22 H 1.109 -5.557 -10.146 1.00 . B B . 8 ARG HH22 1 1 11 12126 2 2 8 ARG N N -1.980 -2.188 -5.392 1.00 . B B . 8 ARG N 1 1 11 12127 2 2 8 ARG NE N 0.978 -3.365 -7.812 1.00 . B B . 8 ARG NE 1 1 11 12128 2 2 8 ARG NH1 N -0.025 -3.342 -9.881 1.00 . B B . 8 ARG NH1 1 1 11 12129 2 2 8 ARG NH2 N 1.287 -5.121 -9.264 1.00 . B B . 8 ARG NH2 1 1 11 12130 2 2 8 ARG O O -1.534 -3.856 -2.956 1.00 . B B . 8 ARG O 1 1 11 12131 2 2 9 LYS C C -1.501 -7.891 -3.973 1.00 . B B . 9 LYS C 1 1 11 12132 2 2 9 LYS CA C -2.060 -6.529 -3.548 1.00 . B B . 9 LYS CA 1 1 11 12133 2 2 9 LYS CB C -3.586 -6.607 -3.431 1.00 . B B . 9 LYS CB 1 1 11 12134 2 2 9 LYS CD C -3.541 -7.032 -0.953 1.00 . B B . 9 LYS CD 1 1 11 12135 2 2 9 LYS CE C -4.233 -7.748 0.196 1.00 . B B . 9 LYS CE 1 1 11 12136 2 2 9 LYS CG C -4.068 -7.502 -2.300 1.00 . B B . 9 LYS CG 1 1 11 12137 2 2 9 LYS H H -1.594 -5.721 -5.454 1.00 . B B . 9 LYS H 1 1 11 12138 2 2 9 LYS HA H -1.650 -6.265 -2.583 1.00 . B B . 9 LYS HA 1 1 11 12139 2 2 9 LYS HB2 H -3.975 -5.614 -3.263 1.00 . B B . 9 LYS HB2 1 1 11 12140 2 2 9 LYS HB3 H -3.990 -6.990 -4.357 1.00 . B B . 9 LYS HB3 1 1 11 12141 2 2 9 LYS HD2 H -2.481 -7.231 -0.902 1.00 . B B . 9 LYS HD2 1 1 11 12142 2 2 9 LYS HD3 H -3.714 -5.969 -0.861 1.00 . B B . 9 LYS HD3 1 1 11 12143 2 2 9 LYS HE2 H -3.791 -7.420 1.125 1.00 . B B . 9 LYS HE2 1 1 11 12144 2 2 9 LYS HE3 H -5.282 -7.487 0.185 1.00 . B B . 9 LYS HE3 1 1 11 12145 2 2 9 LYS HG2 H -5.148 -7.488 -2.277 1.00 . B B . 9 LYS HG2 1 1 11 12146 2 2 9 LYS HG3 H -3.724 -8.509 -2.479 1.00 . B B . 9 LYS HG3 1 1 11 12147 2 2 9 LYS HZ1 H -3.099 -9.500 0.137 1.00 . B B . 9 LYS HZ1 1 1 11 12148 2 2 9 LYS HZ2 H -4.501 -9.561 -0.808 1.00 . B B . 9 LYS HZ2 1 1 11 12149 2 2 9 LYS HZ3 H -4.607 -9.687 0.875 1.00 . B B . 9 LYS HZ3 1 1 11 12150 2 2 9 LYS N N -1.675 -5.491 -4.502 1.00 . B B . 9 LYS N 1 1 11 12151 2 2 9 LYS NZ N -4.100 -9.227 0.092 1.00 . B B . 9 LYS NZ 1 1 11 12152 2 2 9 LYS O O -2.237 -8.876 -4.039 1.00 . B B . 9 LYS O 1 1 11 12153 2 2 10 ARG C C 1.385 -9.710 -3.602 1.00 . B B . 10 ARG C 1 1 11 12154 2 2 10 ARG CA C 0.444 -9.186 -4.684 1.00 . B B . 10 ARG CA 1 1 11 12155 2 2 10 ARG CB C 1.223 -8.969 -5.983 1.00 . B B . 10 ARG CB 1 1 11 12156 2 2 10 ARG CD C 3.092 -7.775 -7.170 1.00 . B B . 10 ARG CD 1 1 11 12157 2 2 10 ARG CG C 2.320 -7.922 -5.868 1.00 . B B . 10 ARG CG 1 1 11 12158 2 2 10 ARG CZ C 4.469 -9.160 -8.664 1.00 . B B . 10 ARG CZ 1 1 11 12159 2 2 10 ARG H H 0.349 -7.134 -4.186 1.00 . B B . 10 ARG H 1 1 11 12160 2 2 10 ARG HA H -0.331 -9.919 -4.857 1.00 . B B . 10 ARG HA 1 1 11 12161 2 2 10 ARG HB2 H 1.676 -9.903 -6.279 1.00 . B B . 10 ARG HB2 1 1 11 12162 2 2 10 ARG HB3 H 0.534 -8.653 -6.753 1.00 . B B . 10 ARG HB3 1 1 11 12163 2 2 10 ARG HD2 H 2.394 -7.556 -7.965 1.00 . B B . 10 ARG HD2 1 1 11 12164 2 2 10 ARG HD3 H 3.789 -6.958 -7.069 1.00 . B B . 10 ARG HD3 1 1 11 12165 2 2 10 ARG HE H 3.853 -9.708 -6.846 1.00 . B B . 10 ARG HE 1 1 11 12166 2 2 10 ARG HG2 H 1.873 -6.972 -5.618 1.00 . B B . 10 ARG HG2 1 1 11 12167 2 2 10 ARG HG3 H 3.004 -8.217 -5.086 1.00 . B B . 10 ARG HG3 1 1 11 12168 2 2 10 ARG HH11 H 3.952 -7.355 -9.410 1.00 . B B . 10 ARG HH11 1 1 11 12169 2 2 10 ARG HH12 H 4.931 -8.336 -10.450 1.00 . B B . 10 ARG HH12 1 1 11 12170 2 2 10 ARG HH21 H 5.142 -11.010 -8.208 1.00 . B B . 10 ARG HH21 1 1 11 12171 2 2 10 ARG HH22 H 5.606 -10.415 -9.767 1.00 . B B . 10 ARG HH22 1 1 11 12172 2 2 10 ARG N N -0.198 -7.944 -4.264 1.00 . B B . 10 ARG N 1 1 11 12173 2 2 10 ARG NE N 3.829 -8.988 -7.511 1.00 . B B . 10 ARG NE 1 1 11 12174 2 2 10 ARG NH1 N 4.449 -8.206 -9.584 1.00 . B B . 10 ARG NH1 1 1 11 12175 2 2 10 ARG NH2 N 5.126 -10.288 -8.898 1.00 . B B . 10 ARG NH2 1 1 11 12176 2 2 10 ARG O O 1.737 -10.889 -3.591 1.00 . B B . 10 ARG O 1 1 11 12177 2 2 11 LYS C C 4.061 -9.591 -2.142 1.00 . B B . 11 LYS C 1 1 11 12178 2 2 11 LYS CA C 2.690 -9.189 -1.611 1.00 . B B . 11 LYS CA 1 1 11 12179 2 2 11 LYS CB C 2.099 -10.332 -0.782 1.00 . B B . 11 LYS CB 1 1 11 12180 2 2 11 LYS CD C -0.391 -9.965 -0.977 1.00 . B B . 11 LYS CD 1 1 11 12181 2 2 11 LYS CE C -0.642 -11.342 -1.572 1.00 . B B . 11 LYS CE 1 1 11 12182 2 2 11 LYS CG C 0.816 -9.967 -0.051 1.00 . B B . 11 LYS CG 1 1 11 12183 2 2 11 LYS H H 1.484 -7.897 -2.764 1.00 . B B . 11 LYS H 1 1 11 12184 2 2 11 LYS HA H 2.807 -8.323 -0.976 1.00 . B B . 11 LYS HA 1 1 11 12185 2 2 11 LYS HB2 H 1.891 -11.165 -1.435 1.00 . B B . 11 LYS HB2 1 1 11 12186 2 2 11 LYS HB3 H 2.830 -10.639 -0.047 1.00 . B B . 11 LYS HB3 1 1 11 12187 2 2 11 LYS HD2 H -1.260 -9.668 -0.413 1.00 . B B . 11 LYS HD2 1 1 11 12188 2 2 11 LYS HD3 H -0.224 -9.261 -1.777 1.00 . B B . 11 LYS HD3 1 1 11 12189 2 2 11 LYS HE2 H 0.177 -11.591 -2.230 1.00 . B B . 11 LYS HE2 1 1 11 12190 2 2 11 LYS HE3 H -0.691 -12.063 -0.770 1.00 . B B . 11 LYS HE3 1 1 11 12191 2 2 11 LYS HG2 H 0.649 -10.685 0.736 1.00 . B B . 11 LYS HG2 1 1 11 12192 2 2 11 LYS HG3 H 0.929 -8.981 0.379 1.00 . B B . 11 LYS HG3 1 1 11 12193 2 2 11 LYS HZ1 H -2.057 -12.341 -2.740 1.00 . B B . 11 LYS HZ1 1 1 11 12194 2 2 11 LYS HZ2 H -1.881 -10.703 -3.128 1.00 . B B . 11 LYS HZ2 1 1 11 12195 2 2 11 LYS HZ3 H -2.717 -11.157 -1.730 1.00 . B B . 11 LYS HZ3 1 1 11 12196 2 2 11 LYS N N 1.793 -8.823 -2.698 1.00 . B B . 11 LYS N 1 1 11 12197 2 2 11 LYS NZ N -1.913 -11.389 -2.346 1.00 . B B . 11 LYS NZ 1 1 11 12198 2 2 11 LYS O O 4.276 -10.742 -2.524 1.00 . B B . 11 LYS O 1 1 11 12199 2 2 12 ALA C C 7.126 -9.688 -1.599 1.00 . B B . 12 ALA C 1 1 11 12200 2 2 12 ALA CA C 6.339 -8.895 -2.634 1.00 . B B . 12 ALA CA 1 1 11 12201 2 2 12 ALA CB C 7.048 -7.587 -2.945 1.00 . B B . 12 ALA CB 1 1 11 12202 2 2 12 ALA H H 4.754 -7.736 -1.849 1.00 . B B . 12 ALA H 1 1 11 12203 2 2 12 ALA HA H 6.273 -9.472 -3.546 1.00 . B B . 12 ALA HA 1 1 11 12204 2 2 12 ALA HB1 H 6.440 -6.999 -3.616 1.00 . B B . 12 ALA HB1 1 1 11 12205 2 2 12 ALA HB2 H 8.000 -7.796 -3.410 1.00 . B B . 12 ALA HB2 1 1 11 12206 2 2 12 ALA HB3 H 7.208 -7.039 -2.027 1.00 . B B . 12 ALA HB3 1 1 11 12207 2 2 12 ALA N N 4.986 -8.637 -2.161 1.00 . B B . 12 ALA N 1 1 11 12208 2 2 12 ALA O O 8.069 -10.406 -1.932 1.00 . B B . 12 ALA O 1 1 11 12209 2 2 13 ASP C C 6.479 -11.322 1.338 1.00 . B B . 13 ASP C 1 1 11 12210 2 2 13 ASP CA C 7.388 -10.246 0.754 1.00 . B B . 13 ASP CA 1 1 11 12211 2 2 13 ASP CB C 7.790 -9.247 1.842 1.00 . B B . 13 ASP CB 1 1 11 12212 2 2 13 ASP CG C 8.371 -9.927 3.068 1.00 . B B . 13 ASP CG 1 1 11 12213 2 2 13 ASP H H 5.972 -8.960 -0.140 1.00 . B B . 13 ASP H 1 1 11 12214 2 2 13 ASP HA H 8.278 -10.715 0.361 1.00 . B B . 13 ASP HA 1 1 11 12215 2 2 13 ASP HB2 H 8.533 -8.573 1.444 1.00 . B B . 13 ASP HB2 1 1 11 12216 2 2 13 ASP HB3 H 6.919 -8.677 2.143 1.00 . B B . 13 ASP HB3 1 1 11 12217 2 2 13 ASP N N 6.728 -9.549 -0.339 1.00 . B B . 13 ASP N 1 1 11 12218 2 2 13 ASP O O 6.947 -12.369 1.783 1.00 . B B . 13 ASP O 1 1 11 12219 2 2 13 ASP OD1 O 9.602 -10.130 3.106 1.00 . B B . 13 ASP OD1 1 1 11 12220 2 2 13 ASP OD2 O 7.594 -10.255 3.989 1.00 . B B . 13 ASP OD2 1 1 11 12221 2 2 14 SER C C 4.482 -12.305 3.328 1.00 . B B . 14 SER C 1 1 11 12222 2 2 14 SER CA C 4.202 -12.003 1.860 1.00 . B B . 14 SER CA 1 1 11 12223 2 2 14 SER CB C 4.224 -13.298 1.047 1.00 . B B . 14 SER CB 1 1 11 12224 2 2 14 SER H H 4.864 -10.205 0.961 1.00 . B B . 14 SER H 1 1 11 12225 2 2 14 SER HA H 3.224 -11.552 1.778 1.00 . B B . 14 SER HA 1 1 11 12226 2 2 14 SER HB2 H 3.950 -13.085 0.025 1.00 . B B . 14 SER HB2 1 1 11 12227 2 2 14 SER HB3 H 5.218 -13.720 1.071 1.00 . B B . 14 SER HB3 1 1 11 12228 2 2 14 SER HG H 3.753 -14.780 2.238 1.00 . B B . 14 SER HG 1 1 11 12229 2 2 14 SER N N 5.176 -11.057 1.331 1.00 . B B . 14 SER N 1 1 11 12230 2 2 14 SER O O 3.969 -11.564 4.193 1.00 . B B . 14 SER O 1 1 11 12231 2 2 14 SER OXT O 5.212 -13.281 3.603 1.00 . B B . 14 SER OXT 1 1 11 12232 2 2 14 SER OG O 3.312 -14.247 1.574 1.00 . B B . 14 SER OG 1 1 12 12233 1 1 1 GLY C C 10.686 5.028 -6.730 1.00 . A A . 1 GLY C 1 1 12 12234 1 1 1 GLY CA C 9.934 4.034 -7.597 1.00 . A A . 1 GLY CA 1 1 12 12235 1 1 1 GLY H1 H 8.058 4.916 -7.331 1.00 . A A . 1 GLY H1 1 1 12 12236 1 1 1 GLY H2 H 8.345 3.597 -6.311 1.00 . A A . 1 GLY H2 1 1 12 12237 1 1 1 GLY H3 H 7.995 3.340 -7.945 1.00 . A A . 1 GLY H3 1 1 12 12238 1 1 1 GLY HA2 H 10.368 3.055 -7.465 1.00 . A A . 1 GLY HA2 1 1 12 12239 1 1 1 GLY HA3 H 10.043 4.326 -8.632 1.00 . A A . 1 GLY HA3 1 1 12 12240 1 1 1 GLY N N 8.482 3.967 -7.273 1.00 . A A . 1 GLY N 1 1 12 12241 1 1 1 GLY O O 11.633 5.662 -7.192 1.00 . A A . 1 GLY O 1 1 12 12242 1 1 2 SER C C 10.045 6.377 -3.302 1.00 . A A . 2 SER C 1 1 12 12243 1 1 2 SER CA C 10.913 6.097 -4.528 1.00 . A A . 2 SER CA 1 1 12 12244 1 1 2 SER CB C 11.250 7.424 -5.213 1.00 . A A . 2 SER CB 1 1 12 12245 1 1 2 SER H H 9.523 4.604 -5.156 1.00 . A A . 2 SER H 1 1 12 12246 1 1 2 SER HA H 11.832 5.643 -4.189 1.00 . A A . 2 SER HA 1 1 12 12247 1 1 2 SER HB2 H 11.475 8.165 -4.461 1.00 . A A . 2 SER HB2 1 1 12 12248 1 1 2 SER HB3 H 12.110 7.289 -5.850 1.00 . A A . 2 SER HB3 1 1 12 12249 1 1 2 SER HG H 10.481 8.527 -6.639 1.00 . A A . 2 SER HG 1 1 12 12250 1 1 2 SER N N 10.268 5.162 -5.467 1.00 . A A . 2 SER N 1 1 12 12251 1 1 2 SER O O 10.543 6.867 -2.288 1.00 . A A . 2 SER O 1 1 12 12252 1 1 2 SER OG O 10.163 7.887 -5.996 1.00 . A A . 2 SER OG 1 1 12 12253 1 1 3 GLN C C 7.851 5.100 -1.332 1.00 . A A . 3 GLN C 1 1 12 12254 1 1 3 GLN CA C 7.857 6.298 -2.267 1.00 . A A . 3 GLN CA 1 1 12 12255 1 1 3 GLN CB C 6.447 6.581 -2.767 1.00 . A A . 3 GLN CB 1 1 12 12256 1 1 3 GLN CD C 7.186 8.222 -4.543 1.00 . A A . 3 GLN CD 1 1 12 12257 1 1 3 GLN CG C 6.276 7.972 -3.356 1.00 . A A . 3 GLN CG 1 1 12 12258 1 1 3 GLN H H 8.396 5.703 -4.212 1.00 . A A . 3 GLN H 1 1 12 12259 1 1 3 GLN HA H 8.209 7.153 -1.729 1.00 . A A . 3 GLN HA 1 1 12 12260 1 1 3 GLN HB2 H 6.209 5.863 -3.527 1.00 . A A . 3 GLN HB2 1 1 12 12261 1 1 3 GLN HB3 H 5.755 6.470 -1.948 1.00 . A A . 3 GLN HB3 1 1 12 12262 1 1 3 GLN HE21 H 7.225 10.168 -4.137 1.00 . A A . 3 GLN HE21 1 1 12 12263 1 1 3 GLN HE22 H 8.144 9.670 -5.513 1.00 . A A . 3 GLN HE22 1 1 12 12264 1 1 3 GLN HG2 H 5.251 8.090 -3.676 1.00 . A A . 3 GLN HG2 1 1 12 12265 1 1 3 GLN HG3 H 6.499 8.702 -2.591 1.00 . A A . 3 GLN HG3 1 1 12 12266 1 1 3 GLN N N 8.755 6.070 -3.385 1.00 . A A . 3 GLN N 1 1 12 12267 1 1 3 GLN NE2 N 7.556 9.480 -4.752 1.00 . A A . 3 GLN NE2 1 1 12 12268 1 1 3 GLN O O 7.919 3.953 -1.770 1.00 . A A . 3 GLN O 1 1 12 12269 1 1 3 GLN OE1 O 7.550 7.294 -5.266 1.00 . A A . 3 GLN OE1 1 1 12 12270 1 1 4 VAL C C 6.353 3.871 1.263 1.00 . A A . 4 VAL C 1 1 12 12271 1 1 4 VAL CA C 7.770 4.338 0.970 1.00 . A A . 4 VAL CA 1 1 12 12272 1 1 4 VAL CB C 8.440 4.818 2.274 1.00 . A A . 4 VAL CB 1 1 12 12273 1 1 4 VAL CG1 C 7.608 5.895 2.958 1.00 . A A . 4 VAL CG1 1 1 12 12274 1 1 4 VAL CG2 C 8.689 3.645 3.206 1.00 . A A . 4 VAL CG2 1 1 12 12275 1 1 4 VAL H H 7.703 6.312 0.243 1.00 . A A . 4 VAL H 1 1 12 12276 1 1 4 VAL HA H 8.337 3.504 0.586 1.00 . A A . 4 VAL HA 1 1 12 12277 1 1 4 VAL HB H 9.396 5.251 2.019 1.00 . A A . 4 VAL HB 1 1 12 12278 1 1 4 VAL HG11 H 6.789 5.437 3.492 1.00 . A A . 4 VAL HG11 1 1 12 12279 1 1 4 VAL HG12 H 7.216 6.574 2.216 1.00 . A A . 4 VAL HG12 1 1 12 12280 1 1 4 VAL HG13 H 8.228 6.442 3.653 1.00 . A A . 4 VAL HG13 1 1 12 12281 1 1 4 VAL HG21 H 8.433 3.925 4.218 1.00 . A A . 4 VAL HG21 1 1 12 12282 1 1 4 VAL HG22 H 9.730 3.364 3.163 1.00 . A A . 4 VAL HG22 1 1 12 12283 1 1 4 VAL HG23 H 8.080 2.810 2.898 1.00 . A A . 4 VAL HG23 1 1 12 12284 1 1 4 VAL N N 7.770 5.381 -0.038 1.00 . A A . 4 VAL N 1 1 12 12285 1 1 4 VAL O O 5.948 3.758 2.419 1.00 . A A . 4 VAL O 1 1 12 12286 1 1 5 PHE C C 3.597 2.818 -1.012 1.00 . A A . 5 PHE C 1 1 12 12287 1 1 5 PHE CA C 4.233 3.130 0.349 1.00 . A A . 5 PHE CA 1 1 12 12288 1 1 5 PHE CB C 3.413 4.187 1.088 1.00 . A A . 5 PHE CB 1 1 12 12289 1 1 5 PHE CD1 C 4.711 6.299 -0.010 1.00 . A A . 5 PHE CD1 1 1 12 12290 1 1 5 PHE CD2 C 4.044 5.133 1.959 1.00 . A A . 5 PHE CD2 1 1 12 12291 1 1 5 PHE CE1 C 5.954 6.534 0.546 1.00 . A A . 5 PHE CE1 1 1 12 12292 1 1 5 PHE CE2 C 5.286 5.362 2.520 1.00 . A A . 5 PHE CE2 1 1 12 12293 1 1 5 PHE CG C 3.742 5.598 0.690 1.00 . A A . 5 PHE CG 1 1 12 12294 1 1 5 PHE CZ C 4.340 8.215 -0.034 1.00 . A A . 5 PHE CZ 1 1 12 12295 1 1 5 PHE H H 5.980 3.693 -0.695 1.00 . A A . 5 PHE H 1 1 12 12296 1 1 5 PHE HA H 4.253 2.220 0.949 1.00 . A A . 5 PHE HA 1 1 12 12297 1 1 5 PHE HB2 H 2.370 4.027 0.887 1.00 . A A . 5 PHE HB2 1 1 12 12298 1 1 5 PHE HB3 H 3.591 4.090 2.149 1.00 . A A . 5 PHE HB3 1 1 12 12299 1 1 5 PHE HD1 H 4.485 6.668 -1.000 1.00 . A A . 5 PHE HD1 1 1 12 12300 1 1 5 PHE HD2 H 3.298 4.584 2.514 1.00 . A A . 5 PHE HD2 1 1 12 12301 1 1 5 PHE HE1 H 6.699 7.082 -0.011 1.00 . A A . 5 PHE HE1 1 1 12 12302 1 1 5 PHE HE2 H 5.509 4.993 3.511 1.00 . A A . 5 PHE HE2 1 1 12 12303 1 1 5 PHE HZ H 4.573 9.231 -0.315 1.00 . A A . 5 PHE HZ 1 1 12 12304 1 1 5 PHE N N 5.603 3.591 0.203 1.00 . A A . 5 PHE N 1 1 12 12305 1 1 5 PHE O O 4.188 3.070 -2.061 1.00 . A A . 5 PHE O 1 1 12 12306 1 1 6 GLU C C 0.144 1.952 -1.866 1.00 . A A . 6 GLU C 1 1 12 12307 1 1 6 GLU CA C 1.639 1.897 -2.168 1.00 . A A . 6 GLU CA 1 1 12 12308 1 1 6 GLU CB C 2.030 0.491 -2.635 1.00 . A A . 6 GLU CB 1 1 12 12309 1 1 6 GLU CD C 1.468 0.725 -5.087 1.00 . A A . 6 GLU CD 1 1 12 12310 1 1 6 GLU CG C 1.184 -0.013 -3.794 1.00 . A A . 6 GLU CG 1 1 12 12311 1 1 6 GLU H H 1.963 2.138 -0.104 1.00 . A A . 6 GLU H 1 1 12 12312 1 1 6 GLU HA H 1.870 2.611 -2.945 1.00 . A A . 6 GLU HA 1 1 12 12313 1 1 6 GLU HB2 H 3.063 0.505 -2.952 1.00 . A A . 6 GLU HB2 1 1 12 12314 1 1 6 GLU HB3 H 1.926 -0.202 -1.807 1.00 . A A . 6 GLU HB3 1 1 12 12315 1 1 6 GLU HG2 H 1.385 -1.062 -3.942 1.00 . A A . 6 GLU HG2 1 1 12 12316 1 1 6 GLU HG3 H 0.141 0.121 -3.543 1.00 . A A . 6 GLU HG3 1 1 12 12317 1 1 6 GLU N N 2.387 2.267 -0.971 1.00 . A A . 6 GLU N 1 1 12 12318 1 1 6 GLU O O -0.308 1.344 -0.900 1.00 . A A . 6 GLU O 1 1 12 12319 1 1 6 GLU OE1 O 2.362 0.283 -5.838 1.00 . A A . 6 GLU OE1 1 1 12 12320 1 1 6 GLU OE2 O 0.798 1.746 -5.349 1.00 . A A . 6 GLU OE2 1 1 12 12321 1 1 7 TYR C C -2.862 1.622 -3.053 1.00 . A A . 7 TYR C 1 1 12 12322 1 1 7 TYR CA C -2.056 2.772 -2.461 1.00 . A A . 7 TYR CA 1 1 12 12323 1 1 7 TYR CB C -2.553 4.103 -3.025 1.00 . A A . 7 TYR CB 1 1 12 12324 1 1 7 TYR CD1 C -1.197 4.694 -5.069 1.00 . A A . 7 TYR CD1 1 1 12 12325 1 1 7 TYR CD2 C -3.419 3.892 -5.387 1.00 . A A . 7 TYR CD2 1 1 12 12326 1 1 7 TYR CE1 C -1.040 4.815 -6.437 1.00 . A A . 7 TYR CE1 1 1 12 12327 1 1 7 TYR CE2 C -3.270 4.009 -6.756 1.00 . A A . 7 TYR CE2 1 1 12 12328 1 1 7 TYR CG C -2.386 4.231 -4.522 1.00 . A A . 7 TYR CG 1 1 12 12329 1 1 7 TYR CZ C -2.079 4.471 -7.275 1.00 . A A . 7 TYR CZ 1 1 12 12330 1 1 7 TYR H H -0.242 3.069 -3.488 1.00 . A A . 7 TYR H 1 1 12 12331 1 1 7 TYR HA H -2.204 2.775 -1.398 1.00 . A A . 7 TYR HA 1 1 12 12332 1 1 7 TYR HB2 H -3.600 4.210 -2.799 1.00 . A A . 7 TYR HB2 1 1 12 12333 1 1 7 TYR HB3 H -2.007 4.909 -2.559 1.00 . A A . 7 TYR HB3 1 1 12 12334 1 1 7 TYR HD1 H -0.385 4.962 -4.409 1.00 . A A . 7 TYR HD1 1 1 12 12335 1 1 7 TYR HD2 H -4.350 3.529 -4.977 1.00 . A A . 7 TYR HD2 1 1 12 12336 1 1 7 TYR HE1 H -0.108 5.177 -6.844 1.00 . A A . 7 TYR HE1 1 1 12 12337 1 1 7 TYR HE2 H -4.084 3.740 -7.412 1.00 . A A . 7 TYR HE2 1 1 12 12338 1 1 7 TYR HH H -1.066 4.254 -8.895 1.00 . A A . 7 TYR HH 1 1 12 12339 1 1 7 TYR N N -0.631 2.638 -2.703 1.00 . A A . 7 TYR N 1 1 12 12340 1 1 7 TYR O O -2.992 1.498 -4.272 1.00 . A A . 7 TYR O 1 1 12 12341 1 1 7 TYR OH O -1.927 4.591 -8.638 1.00 . A A . 7 TYR OH 1 1 12 12342 1 1 8 ALA C C -5.689 0.086 -2.611 1.00 . A A . 8 ALA C 1 1 12 12343 1 1 8 ALA CA C -4.228 -0.346 -2.593 1.00 . A A . 8 ALA CA 1 1 12 12344 1 1 8 ALA CB C -4.031 -1.536 -1.662 1.00 . A A . 8 ALA CB 1 1 12 12345 1 1 8 ALA H H -3.242 0.925 -1.208 1.00 . A A . 8 ALA H 1 1 12 12346 1 1 8 ALA HA H -3.925 -0.633 -3.587 1.00 . A A . 8 ALA HA 1 1 12 12347 1 1 8 ALA HB1 H -4.844 -1.578 -0.952 1.00 . A A . 8 ALA HB1 1 1 12 12348 1 1 8 ALA HB2 H -3.096 -1.431 -1.130 1.00 . A A . 8 ALA HB2 1 1 12 12349 1 1 8 ALA HB3 H -4.014 -2.446 -2.239 1.00 . A A . 8 ALA HB3 1 1 12 12350 1 1 8 ALA N N -3.401 0.781 -2.171 1.00 . A A . 8 ALA N 1 1 12 12351 1 1 8 ALA O O -6.559 -0.581 -2.052 1.00 . A A . 8 ALA O 1 1 12 12352 1 1 9 GLU C C -7.900 1.695 -4.698 1.00 . A A . 9 GLU C 1 1 12 12353 1 1 9 GLU CA C -7.261 1.807 -3.334 1.00 . A A . 9 GLU CA 1 1 12 12354 1 1 9 GLU CB C -7.138 3.257 -2.859 1.00 . A A . 9 GLU CB 1 1 12 12355 1 1 9 GLU CD C -7.367 4.524 -5.041 1.00 . A A . 9 GLU CD 1 1 12 12356 1 1 9 GLU CG C -7.913 4.298 -3.642 1.00 . A A . 9 GLU CG 1 1 12 12357 1 1 9 GLU H H -5.204 1.679 -3.705 1.00 . A A . 9 GLU H 1 1 12 12358 1 1 9 GLU HA H -7.897 1.286 -2.655 1.00 . A A . 9 GLU HA 1 1 12 12359 1 1 9 GLU HB2 H -7.479 3.303 -1.837 1.00 . A A . 9 GLU HB2 1 1 12 12360 1 1 9 GLU HB3 H -6.092 3.533 -2.882 1.00 . A A . 9 GLU HB3 1 1 12 12361 1 1 9 GLU HG2 H -8.933 3.975 -3.713 1.00 . A A . 9 GLU HG2 1 1 12 12362 1 1 9 GLU HG3 H -7.867 5.227 -3.103 1.00 . A A . 9 GLU HG3 1 1 12 12363 1 1 9 GLU N N -5.938 1.216 -3.264 1.00 . A A . 9 GLU N 1 1 12 12364 1 1 9 GLU O O -7.236 1.679 -5.735 1.00 . A A . 9 GLU O 1 1 12 12365 1 1 9 GLU OE1 O -6.323 5.198 -5.168 1.00 . A A . 9 GLU OE1 1 1 12 12366 1 1 9 GLU OE2 O -7.981 4.026 -6.007 1.00 . A A . 9 GLU OE2 1 1 12 12367 1 1 10 VAL C C -10.386 2.904 -6.343 1.00 . A A . 10 VAL C 1 1 12 12368 1 1 10 VAL CA C -10.024 1.519 -5.837 1.00 . A A . 10 VAL CA 1 1 12 12369 1 1 10 VAL CB C -11.285 0.709 -5.553 1.00 . A A . 10 VAL CB 1 1 12 12370 1 1 10 VAL CG1 C -12.128 0.572 -6.815 1.00 . A A . 10 VAL CG1 1 1 12 12371 1 1 10 VAL CG2 C -10.914 -0.655 -4.986 1.00 . A A . 10 VAL CG2 1 1 12 12372 1 1 10 VAL H H -9.660 1.631 -3.779 1.00 . A A . 10 VAL H 1 1 12 12373 1 1 10 VAL HA H -9.461 1.012 -6.574 1.00 . A A . 10 VAL HA 1 1 12 12374 1 1 10 VAL HB H -11.849 1.234 -4.811 1.00 . A A . 10 VAL HB 1 1 12 12375 1 1 10 VAL HG11 H -13.174 0.583 -6.556 1.00 . A A . 10 VAL HG11 1 1 12 12376 1 1 10 VAL HG12 H -11.888 -0.359 -7.307 1.00 . A A . 10 VAL HG12 1 1 12 12377 1 1 10 VAL HG13 H -11.914 1.395 -7.482 1.00 . A A . 10 VAL HG13 1 1 12 12378 1 1 10 VAL HG21 H -10.145 -0.532 -4.238 1.00 . A A . 10 VAL HG21 1 1 12 12379 1 1 10 VAL HG22 H -10.545 -1.287 -5.780 1.00 . A A . 10 VAL HG22 1 1 12 12380 1 1 10 VAL HG23 H -11.781 -1.109 -4.535 1.00 . A A . 10 VAL HG23 1 1 12 12381 1 1 10 VAL N N -9.217 1.621 -4.654 1.00 . A A . 10 VAL N 1 1 12 12382 1 1 10 VAL O O -10.467 3.143 -7.548 1.00 . A A . 10 VAL O 1 1 12 12383 1 1 11 ASP C C -10.268 6.172 -4.762 1.00 . A A . 11 ASP C 1 1 12 12384 1 1 11 ASP CA C -10.934 5.191 -5.728 1.00 . A A . 11 ASP CA 1 1 12 12385 1 1 11 ASP CB C -12.446 5.402 -5.699 1.00 . A A . 11 ASP CB 1 1 12 12386 1 1 11 ASP CG C -15.506 3.558 -5.997 1.00 . A A . 11 ASP CG 1 1 12 12387 1 1 11 ASP H H -10.587 3.532 -4.467 1.00 . A A . 11 ASP H 1 1 12 12388 1 1 11 ASP HA H -10.574 5.388 -6.726 1.00 . A A . 11 ASP HA 1 1 12 12389 1 1 11 ASP HB2 H -12.792 5.334 -4.679 1.00 . A A . 11 ASP HB2 1 1 12 12390 1 1 11 ASP HB3 H -12.921 4.635 -6.286 1.00 . A A . 11 ASP HB3 1 1 12 12391 1 1 11 ASP N N -10.609 3.810 -5.402 1.00 . A A . 11 ASP N 1 1 12 12392 1 1 11 ASP O O -9.800 7.234 -5.174 1.00 . A A . 11 ASP O 1 1 12 12393 1 1 11 ASP OD1 O -16.180 3.256 -7.004 1.00 . A A . 11 ASP OD1 1 1 12 12394 1 1 11 ASP OD2 O -16.009 4.013 -4.948 1.00 . A A . 11 ASP OD2 1 1 12 12395 1 1 12 GLU C C -9.141 5.965 -1.241 1.00 . A A . 12 GLU C 1 1 12 12396 1 1 12 GLU CA C -9.653 6.714 -2.468 1.00 . A A . 12 GLU CA 1 1 12 12397 1 1 12 GLU CB C -10.693 7.746 -2.040 1.00 . A A . 12 GLU CB 1 1 12 12398 1 1 12 GLU CD C -12.138 9.709 -2.699 1.00 . A A . 12 GLU CD 1 1 12 12399 1 1 12 GLU CG C -11.062 8.734 -3.135 1.00 . A A . 12 GLU CG 1 1 12 12400 1 1 12 GLU H H -10.517 4.916 -3.216 1.00 . A A . 12 GLU H 1 1 12 12401 1 1 12 GLU HA H -8.817 7.226 -2.924 1.00 . A A . 12 GLU HA 1 1 12 12402 1 1 12 GLU HB2 H -11.591 7.227 -1.736 1.00 . A A . 12 GLU HB2 1 1 12 12403 1 1 12 GLU HB3 H -10.308 8.300 -1.199 1.00 . A A . 12 GLU HB3 1 1 12 12404 1 1 12 GLU HG2 H -10.181 9.295 -3.409 1.00 . A A . 12 GLU HG2 1 1 12 12405 1 1 12 GLU HG3 H -11.420 8.185 -3.994 1.00 . A A . 12 GLU HG3 1 1 12 12406 1 1 12 GLU N N -10.226 5.818 -3.476 1.00 . A A . 12 GLU N 1 1 12 12407 1 1 12 GLU O O -9.573 4.857 -0.956 1.00 . A A . 12 GLU O 1 1 12 12408 1 1 12 GLU OE1 O -11.787 10.776 -2.155 1.00 . A A . 12 GLU OE1 1 1 12 12409 1 1 12 GLU OE2 O -13.333 9.407 -2.905 1.00 . A A . 12 GLU OE2 1 1 12 12410 1 1 13 ILE C C -7.801 6.999 1.867 1.00 . A A . 13 ILE C 1 1 12 12411 1 1 13 ILE CA C -7.656 6.017 0.699 1.00 . A A . 13 ILE CA 1 1 12 12412 1 1 13 ILE CB C -6.156 5.658 0.500 1.00 . A A . 13 ILE CB 1 1 12 12413 1 1 13 ILE CD1 C -5.565 7.766 -0.784 1.00 . A A . 13 ILE CD1 1 1 12 12414 1 1 13 ILE CG1 C -5.295 6.925 0.445 1.00 . A A . 13 ILE CG1 1 1 12 12415 1 1 13 ILE CG2 C -5.979 4.878 -0.787 1.00 . A A . 13 ILE CG2 1 1 12 12416 1 1 13 ILE H H -7.954 7.500 -0.783 1.00 . A A . 13 ILE H 1 1 12 12417 1 1 13 ILE HA H -8.204 5.107 0.922 1.00 . A A . 13 ILE HA 1 1 12 12418 1 1 13 ILE HB H -5.828 5.024 1.324 1.00 . A A . 13 ILE HB 1 1 12 12419 1 1 13 ILE HD11 H -4.650 8.235 -1.109 1.00 . A A . 13 ILE HD11 1 1 12 12420 1 1 13 ILE HD12 H -6.297 8.523 -0.547 1.00 . A A . 13 ILE HD12 1 1 12 12421 1 1 13 ILE HD13 H -5.949 7.134 -1.575 1.00 . A A . 13 ILE HD13 1 1 12 12422 1 1 13 ILE HG12 H -5.499 7.532 1.315 1.00 . A A . 13 ILE HG12 1 1 12 12423 1 1 13 ILE HG13 H -4.252 6.653 0.440 1.00 . A A . 13 ILE HG13 1 1 12 12424 1 1 13 ILE HG21 H -6.040 3.821 -0.586 1.00 . A A . 13 ILE HG21 1 1 12 12425 1 1 13 ILE HG22 H -5.016 5.109 -1.218 1.00 . A A . 13 ILE HG22 1 1 12 12426 1 1 13 ILE HG23 H -6.756 5.162 -1.478 1.00 . A A . 13 ILE HG23 1 1 12 12427 1 1 13 ILE N N -8.233 6.603 -0.509 1.00 . A A . 13 ILE N 1 1 12 12428 1 1 13 ILE O O -8.550 7.971 1.779 1.00 . A A . 13 ILE O 1 1 12 12429 1 1 14 VAL C C -5.790 7.556 4.852 1.00 . A A . 14 VAL C 1 1 12 12430 1 1 14 VAL CA C -7.120 7.611 4.122 1.00 . A A . 14 VAL CA 1 1 12 12431 1 1 14 VAL CB C -8.253 7.216 5.089 1.00 . A A . 14 VAL CB 1 1 12 12432 1 1 14 VAL CG1 C -8.250 8.116 6.316 1.00 . A A . 14 VAL CG1 1 1 12 12433 1 1 14 VAL CG2 C -9.598 7.274 4.383 1.00 . A A . 14 VAL CG2 1 1 12 12434 1 1 14 VAL H H -6.506 5.948 2.964 1.00 . A A . 14 VAL H 1 1 12 12435 1 1 14 VAL HA H -7.294 8.620 3.783 1.00 . A A . 14 VAL HA 1 1 12 12436 1 1 14 VAL HB H -8.085 6.200 5.414 1.00 . A A . 14 VAL HB 1 1 12 12437 1 1 14 VAL HG11 H -8.414 9.140 6.012 1.00 . A A . 14 VAL HG11 1 1 12 12438 1 1 14 VAL HG12 H -7.298 8.037 6.819 1.00 . A A . 14 VAL HG12 1 1 12 12439 1 1 14 VAL HG13 H -9.038 7.810 6.989 1.00 . A A . 14 VAL HG13 1 1 12 12440 1 1 14 VAL HG21 H -9.768 8.275 4.013 1.00 . A A . 14 VAL HG21 1 1 12 12441 1 1 14 VAL HG22 H -10.382 7.009 5.078 1.00 . A A . 14 VAL HG22 1 1 12 12442 1 1 14 VAL HG23 H -9.601 6.581 3.556 1.00 . A A . 14 VAL HG23 1 1 12 12443 1 1 14 VAL N N -7.081 6.743 2.950 1.00 . A A . 14 VAL N 1 1 12 12444 1 1 14 VAL O O -5.118 8.573 5.029 1.00 . A A . 14 VAL O 1 1 12 12445 1 1 15 GLU C C -3.113 5.656 4.963 1.00 . A A . 15 GLU C 1 1 12 12446 1 1 15 GLU CA C -4.154 6.145 5.963 1.00 . A A . 15 GLU CA 1 1 12 12447 1 1 15 GLU CB C -4.325 5.133 7.101 1.00 . A A . 15 GLU CB 1 1 12 12448 1 1 15 GLU CD C -5.207 2.880 7.832 1.00 . A A . 15 GLU CD 1 1 12 12449 1 1 15 GLU CG C -5.092 3.882 6.700 1.00 . A A . 15 GLU CG 1 1 12 12450 1 1 15 GLU H H -6.018 5.592 5.106 1.00 . A A . 15 GLU H 1 1 12 12451 1 1 15 GLU HA H -3.832 7.091 6.371 1.00 . A A . 15 GLU HA 1 1 12 12452 1 1 15 GLU HB2 H -3.348 4.833 7.450 1.00 . A A . 15 GLU HB2 1 1 12 12453 1 1 15 GLU HB3 H -4.856 5.609 7.913 1.00 . A A . 15 GLU HB3 1 1 12 12454 1 1 15 GLU HG2 H -6.087 4.167 6.395 1.00 . A A . 15 GLU HG2 1 1 12 12455 1 1 15 GLU HG3 H -4.582 3.412 5.872 1.00 . A A . 15 GLU HG3 1 1 12 12456 1 1 15 GLU N N -5.420 6.358 5.271 1.00 . A A . 15 GLU N 1 1 12 12457 1 1 15 GLU O O -3.397 4.785 4.156 1.00 . A A . 15 GLU O 1 1 12 12458 1 1 15 GLU OE1 O -6.161 2.989 8.628 1.00 . A A . 15 GLU OE1 1 1 12 12459 1 1 15 GLU OE2 O -4.339 1.985 7.922 1.00 . A A . 15 GLU OE2 1 1 12 12460 1 1 16 LYS C C 0.535 6.008 4.610 1.00 . A A . 16 LYS C 1 1 12 12461 1 1 16 LYS CA C -0.879 5.826 4.043 1.00 . A A . 16 LYS CA 1 1 12 12462 1 1 16 LYS CB C -1.027 6.648 2.765 1.00 . A A . 16 LYS CB 1 1 12 12463 1 1 16 LYS CD C -1.484 8.908 1.767 1.00 . A A . 16 LYS CD 1 1 12 12464 1 1 16 LYS CE C -1.435 10.411 1.989 1.00 . A A . 16 LYS CE 1 1 12 12465 1 1 16 LYS CG C -1.044 8.148 3.007 1.00 . A A . 16 LYS CG 1 1 12 12466 1 1 16 LYS H H -1.734 6.929 5.648 1.00 . A A . 16 LYS H 1 1 12 12467 1 1 16 LYS HA H -1.039 4.780 3.805 1.00 . A A . 16 LYS HA 1 1 12 12468 1 1 16 LYS HB2 H -0.202 6.423 2.106 1.00 . A A . 16 LYS HB2 1 1 12 12469 1 1 16 LYS HB3 H -1.952 6.375 2.283 1.00 . A A . 16 LYS HB3 1 1 12 12470 1 1 16 LYS HD2 H -0.827 8.653 0.949 1.00 . A A . 16 LYS HD2 1 1 12 12471 1 1 16 LYS HD3 H -2.497 8.622 1.522 1.00 . A A . 16 LYS HD3 1 1 12 12472 1 1 16 LYS HE2 H -2.026 10.652 2.861 1.00 . A A . 16 LYS HE2 1 1 12 12473 1 1 16 LYS HE3 H -0.409 10.703 2.161 1.00 . A A . 16 LYS HE3 1 1 12 12474 1 1 16 LYS HG2 H -1.731 8.366 3.811 1.00 . A A . 16 LYS HG2 1 1 12 12475 1 1 16 LYS HG3 H -0.051 8.471 3.281 1.00 . A A . 16 LYS HG3 1 1 12 12476 1 1 16 LYS HZ1 H -1.436 10.913 -0.038 1.00 . A A . 16 LYS HZ1 1 1 12 12477 1 1 16 LYS HZ2 H -1.874 12.188 0.984 1.00 . A A . 16 LYS HZ2 1 1 12 12478 1 1 16 LYS HZ3 H -2.970 10.937 0.674 1.00 . A A . 16 LYS HZ3 1 1 12 12479 1 1 16 LYS N N -1.917 6.228 4.992 1.00 . A A . 16 LYS N 1 1 12 12480 1 1 16 LYS NZ N -1.966 11.165 0.821 1.00 . A A . 16 LYS NZ 1 1 12 12481 1 1 16 LYS O O 1.142 7.065 4.439 1.00 . A A . 16 LYS O 1 1 12 12482 1 1 17 ARG C C 3.021 3.684 6.004 1.00 . A A . 17 ARG C 1 1 12 12483 1 1 17 ARG CA C 2.404 5.070 5.859 1.00 . A A . 17 ARG CA 1 1 12 12484 1 1 17 ARG CB C 2.354 5.760 7.222 1.00 . A A . 17 ARG CB 1 1 12 12485 1 1 17 ARG CD C 4.677 6.708 7.047 1.00 . A A . 17 ARG CD 1 1 12 12486 1 1 17 ARG CG C 3.713 5.888 7.890 1.00 . A A . 17 ARG CG 1 1 12 12487 1 1 17 ARG CZ C 4.812 8.973 6.095 1.00 . A A . 17 ARG CZ 1 1 12 12488 1 1 17 ARG H H 0.553 4.149 5.374 1.00 . A A . 17 ARG H 1 1 12 12489 1 1 17 ARG HA H 3.016 5.656 5.190 1.00 . A A . 17 ARG HA 1 1 12 12490 1 1 17 ARG HB2 H 1.942 6.749 7.094 1.00 . A A . 17 ARG HB2 1 1 12 12491 1 1 17 ARG HB3 H 1.707 5.193 7.876 1.00 . A A . 17 ARG HB3 1 1 12 12492 1 1 17 ARG HD2 H 5.657 6.666 7.499 1.00 . A A . 17 ARG HD2 1 1 12 12493 1 1 17 ARG HD3 H 4.721 6.281 6.056 1.00 . A A . 17 ARG HD3 1 1 12 12494 1 1 17 ARG HE H 3.550 8.414 7.538 1.00 . A A . 17 ARG HE 1 1 12 12495 1 1 17 ARG HG2 H 3.589 6.370 8.848 1.00 . A A . 17 ARG HG2 1 1 12 12496 1 1 17 ARG HG3 H 4.126 4.900 8.034 1.00 . A A . 17 ARG HG3 1 1 12 12497 1 1 17 ARG HH11 H 6.095 7.635 5.291 1.00 . A A . 17 ARG HH11 1 1 12 12498 1 1 17 ARG HH12 H 6.185 9.237 4.637 1.00 . A A . 17 ARG HH12 1 1 12 12499 1 1 17 ARG HH21 H 3.663 10.529 6.684 1.00 . A A . 17 ARG HH21 1 1 12 12500 1 1 17 ARG HH22 H 4.804 10.882 5.429 1.00 . A A . 17 ARG HH22 1 1 12 12501 1 1 17 ARG N N 1.061 4.986 5.285 1.00 . A A . 17 ARG N 1 1 12 12502 1 1 17 ARG NE N 4.265 8.106 6.943 1.00 . A A . 17 ARG NE 1 1 12 12503 1 1 17 ARG NH1 N 5.776 8.583 5.274 1.00 . A A . 17 ARG NH1 1 1 12 12504 1 1 17 ARG NH2 N 4.392 10.231 6.067 1.00 . A A . 17 ARG NH2 1 1 12 12505 1 1 17 ARG O O 2.811 3.020 7.019 1.00 . A A . 17 ARG O 1 1 12 12506 1 1 18 GLY C C 5.657 1.723 4.363 1.00 . A A . 18 GLY C 1 1 12 12507 1 1 18 GLY CA C 4.362 1.910 5.118 1.00 . A A . 18 GLY CA 1 1 12 12508 1 1 18 GLY H H 3.953 3.791 4.216 1.00 . A A . 18 GLY H 1 1 12 12509 1 1 18 GLY HA2 H 4.542 1.701 6.161 1.00 . A A . 18 GLY HA2 1 1 12 12510 1 1 18 GLY HA3 H 3.649 1.199 4.747 1.00 . A A . 18 GLY HA3 1 1 12 12511 1 1 18 GLY N N 3.781 3.233 5.008 1.00 . A A . 18 GLY N 1 1 12 12512 1 1 18 GLY O O 6.563 2.551 4.428 1.00 . A A . 18 GLY O 1 1 12 12513 1 1 19 LYS C C 6.518 0.225 1.384 1.00 . A A . 19 LYS C 1 1 12 12514 1 1 19 LYS CA C 6.881 0.223 2.871 1.00 . A A . 19 LYS CA 1 1 12 12515 1 1 19 LYS CB C 7.324 -1.147 3.352 1.00 . A A . 19 LYS CB 1 1 12 12516 1 1 19 LYS CD C 8.225 -2.514 5.224 1.00 . A A . 19 LYS CD 1 1 12 12517 1 1 19 LYS CE C 8.792 -2.508 6.635 1.00 . A A . 19 LYS CE 1 1 12 12518 1 1 19 LYS CG C 7.913 -1.119 4.746 1.00 . A A . 19 LYS CG 1 1 12 12519 1 1 19 LYS H H 4.951 -0.004 3.657 1.00 . A A . 19 LYS H 1 1 12 12520 1 1 19 LYS HA H 7.663 0.930 3.051 1.00 . A A . 19 LYS HA 1 1 12 12521 1 1 19 LYS HB2 H 6.455 -1.796 3.360 1.00 . A A . 19 LYS HB2 1 1 12 12522 1 1 19 LYS HB3 H 8.062 -1.548 2.677 1.00 . A A . 19 LYS HB3 1 1 12 12523 1 1 19 LYS HD2 H 7.314 -3.090 5.209 1.00 . A A . 19 LYS HD2 1 1 12 12524 1 1 19 LYS HD3 H 8.942 -2.955 4.551 1.00 . A A . 19 LYS HD3 1 1 12 12525 1 1 19 LYS HE2 H 8.053 -2.093 7.303 1.00 . A A . 19 LYS HE2 1 1 12 12526 1 1 19 LYS HE3 H 9.010 -3.524 6.927 1.00 . A A . 19 LYS HE3 1 1 12 12527 1 1 19 LYS HG2 H 8.823 -0.538 4.733 1.00 . A A . 19 LYS HG2 1 1 12 12528 1 1 19 LYS HG3 H 7.201 -0.665 5.421 1.00 . A A . 19 LYS HG3 1 1 12 12529 1 1 19 LYS HZ1 H 9.838 -0.705 6.497 1.00 . A A . 19 LYS HZ1 1 1 12 12530 1 1 19 LYS HZ2 H 10.753 -2.063 6.068 1.00 . A A . 19 LYS HZ2 1 1 12 12531 1 1 19 LYS HZ3 H 10.422 -1.746 7.696 1.00 . A A . 19 LYS HZ3 1 1 12 12532 1 1 19 LYS N N 5.723 0.602 3.653 1.00 . A A . 19 LYS N 1 1 12 12533 1 1 19 LYS NZ N 10.039 -1.699 6.730 1.00 . A A . 19 LYS NZ 1 1 12 12534 1 1 19 LYS O O 6.162 1.259 0.843 1.00 . A A . 19 LYS O 1 1 12 12535 1 1 20 GLY C C 4.827 -1.506 -0.717 1.00 . A A . 20 GLY C 1 1 12 12536 1 1 20 GLY CA C 6.223 -0.969 -0.666 1.00 . A A . 20 GLY CA 1 1 12 12537 1 1 20 GLY H H 6.951 -1.710 1.141 1.00 . A A . 20 GLY H 1 1 12 12538 1 1 20 GLY HA2 H 6.263 0.018 -1.096 1.00 . A A . 20 GLY HA2 1 1 12 12539 1 1 20 GLY HA3 H 6.874 -1.634 -1.199 1.00 . A A . 20 GLY HA3 1 1 12 12540 1 1 20 GLY N N 6.621 -0.911 0.710 1.00 . A A . 20 GLY N 1 1 12 12541 1 1 20 GLY O O 3.969 -1.029 -1.458 1.00 . A A . 20 GLY O 1 1 12 12542 1 1 21 LYS C C 2.981 -3.348 1.758 1.00 . A A . 21 LYS C 1 1 12 12543 1 1 21 LYS CA C 3.341 -3.172 0.267 1.00 . A A . 21 LYS CA 1 1 12 12544 1 1 21 LYS CB C 3.364 -4.533 -0.430 1.00 . A A . 21 LYS CB 1 1 12 12545 1 1 21 LYS CD C 3.193 -3.579 -2.751 1.00 . A A . 21 LYS CD 1 1 12 12546 1 1 21 LYS CE C 4.057 -3.101 -3.908 1.00 . A A . 21 LYS CE 1 1 12 12547 1 1 21 LYS CG C 3.974 -4.493 -1.821 1.00 . A A . 21 LYS CG 1 1 12 12548 1 1 21 LYS H H 5.397 -2.849 0.625 1.00 . A A . 21 LYS H 1 1 12 12549 1 1 21 LYS HA H 2.593 -2.545 -0.205 1.00 . A A . 21 LYS HA 1 1 12 12550 1 1 21 LYS HB2 H 3.938 -5.222 0.172 1.00 . A A . 21 LYS HB2 1 1 12 12551 1 1 21 LYS HB3 H 2.352 -4.899 -0.514 1.00 . A A . 21 LYS HB3 1 1 12 12552 1 1 21 LYS HD2 H 2.348 -4.123 -3.147 1.00 . A A . 21 LYS HD2 1 1 12 12553 1 1 21 LYS HD3 H 2.843 -2.725 -2.194 1.00 . A A . 21 LYS HD3 1 1 12 12554 1 1 21 LYS HE2 H 5.001 -2.754 -3.517 1.00 . A A . 21 LYS HE2 1 1 12 12555 1 1 21 LYS HE3 H 4.227 -3.930 -4.577 1.00 . A A . 21 LYS HE3 1 1 12 12556 1 1 21 LYS HG2 H 4.989 -4.132 -1.747 1.00 . A A . 21 LYS HG2 1 1 12 12557 1 1 21 LYS HG3 H 3.976 -5.492 -2.231 1.00 . A A . 21 LYS HG3 1 1 12 12558 1 1 21 LYS HZ1 H 3.316 -1.154 -4.060 1.00 . A A . 21 LYS HZ1 1 1 12 12559 1 1 21 LYS HZ2 H 2.470 -2.284 -4.993 1.00 . A A . 21 LYS HZ2 1 1 12 12560 1 1 21 LYS HZ3 H 3.992 -1.744 -5.494 1.00 . A A . 21 LYS HZ3 1 1 12 12561 1 1 21 LYS N N 4.628 -2.516 0.115 1.00 . A A . 21 LYS N 1 1 12 12562 1 1 21 LYS NZ N 3.413 -1.994 -4.666 1.00 . A A . 21 LYS NZ 1 1 12 12563 1 1 21 LYS O O 1.921 -3.884 2.078 1.00 . A A . 21 LYS O 1 1 12 12564 1 1 22 ASP C C 2.810 -1.816 4.622 1.00 . A A . 22 ASP C 1 1 12 12565 1 1 22 ASP CA C 3.611 -2.995 4.105 1.00 . A A . 22 ASP CA 1 1 12 12566 1 1 22 ASP CB C 4.923 -3.041 4.877 1.00 . A A . 22 ASP CB 1 1 12 12567 1 1 22 ASP CG C 4.737 -3.467 6.322 1.00 . A A . 22 ASP CG 1 1 12 12568 1 1 22 ASP H H 4.695 -2.508 2.375 1.00 . A A . 22 ASP H 1 1 12 12569 1 1 22 ASP HA H 3.065 -3.889 4.269 1.00 . A A . 22 ASP HA 1 1 12 12570 1 1 22 ASP HB2 H 5.599 -3.718 4.393 1.00 . A A . 22 ASP HB2 1 1 12 12571 1 1 22 ASP HB3 H 5.358 -2.052 4.878 1.00 . A A . 22 ASP HB3 1 1 12 12572 1 1 22 ASP N N 3.860 -2.890 2.668 1.00 . A A . 22 ASP N 1 1 12 12573 1 1 22 ASP O O 2.624 -1.650 5.825 1.00 . A A . 22 ASP O 1 1 12 12574 1 1 22 ASP OD1 O 4.569 -4.682 6.562 1.00 . A A . 22 ASP OD1 1 1 12 12575 1 1 22 ASP OD2 O 4.757 -2.595 7.212 1.00 . A A . 22 ASP OD2 1 1 12 12576 1 1 23 VAL C C 0.104 -0.144 4.040 1.00 . A A . 23 VAL C 1 1 12 12577 1 1 23 VAL CA C 1.588 0.168 4.020 1.00 . A A . 23 VAL CA 1 1 12 12578 1 1 23 VAL CB C 1.857 1.221 2.961 1.00 . A A . 23 VAL CB 1 1 12 12579 1 1 23 VAL CG1 C 1.477 0.653 1.603 1.00 . A A . 23 VAL CG1 1 1 12 12580 1 1 23 VAL CG2 C 1.105 2.501 3.275 1.00 . A A . 23 VAL CG2 1 1 12 12581 1 1 23 VAL H H 2.578 -1.174 2.781 1.00 . A A . 23 VAL H 1 1 12 12582 1 1 23 VAL HA H 1.892 0.549 4.980 1.00 . A A . 23 VAL HA 1 1 12 12583 1 1 23 VAL HB H 2.919 1.431 2.959 1.00 . A A . 23 VAL HB 1 1 12 12584 1 1 23 VAL HG11 H 2.355 0.607 0.975 1.00 . A A . 23 VAL HG11 1 1 12 12585 1 1 23 VAL HG12 H 0.735 1.281 1.141 1.00 . A A . 23 VAL HG12 1 1 12 12586 1 1 23 VAL HG13 H 1.074 -0.343 1.725 1.00 . A A . 23 VAL HG13 1 1 12 12587 1 1 23 VAL HG21 H 1.195 2.712 4.328 1.00 . A A . 23 VAL HG21 1 1 12 12588 1 1 23 VAL HG22 H 0.063 2.379 3.022 1.00 . A A . 23 VAL HG22 1 1 12 12589 1 1 23 VAL HG23 H 1.525 3.317 2.707 1.00 . A A . 23 VAL HG23 1 1 12 12590 1 1 23 VAL N N 2.363 -1.000 3.707 1.00 . A A . 23 VAL N 1 1 12 12591 1 1 23 VAL O O -0.387 -0.944 3.242 1.00 . A A . 23 VAL O 1 1 12 12592 1 1 24 GLU C C -2.808 1.468 4.432 1.00 . A A . 24 GLU C 1 1 12 12593 1 1 24 GLU CA C -2.041 0.314 5.052 1.00 . A A . 24 GLU CA 1 1 12 12594 1 1 24 GLU CB C -2.446 0.149 6.515 1.00 . A A . 24 GLU CB 1 1 12 12595 1 1 24 GLU CD C -1.948 0.691 8.933 1.00 . A A . 24 GLU CD 1 1 12 12596 1 1 24 GLU CG C -1.608 0.971 7.481 1.00 . A A . 24 GLU CG 1 1 12 12597 1 1 24 GLU H H -0.167 1.194 5.480 1.00 . A A . 24 GLU H 1 1 12 12598 1 1 24 GLU HA H -2.285 -0.596 4.519 1.00 . A A . 24 GLU HA 1 1 12 12599 1 1 24 GLU HB2 H -3.477 0.453 6.618 1.00 . A A . 24 GLU HB2 1 1 12 12600 1 1 24 GLU HB3 H -2.359 -0.890 6.785 1.00 . A A . 24 GLU HB3 1 1 12 12601 1 1 24 GLU HG2 H -0.565 0.738 7.323 1.00 . A A . 24 GLU HG2 1 1 12 12602 1 1 24 GLU HG3 H -1.776 2.019 7.284 1.00 . A A . 24 GLU HG3 1 1 12 12603 1 1 24 GLU N N -0.610 0.524 4.924 1.00 . A A . 24 GLU N 1 1 12 12604 1 1 24 GLU O O -2.786 2.587 4.940 1.00 . A A . 24 GLU O 1 1 12 12605 1 1 24 GLU OE1 O -1.547 -0.378 9.440 1.00 . A A . 24 GLU OE1 1 1 12 12606 1 1 24 GLU OE2 O -2.615 1.539 9.562 1.00 . A A . 24 GLU OE2 1 1 12 12607 1 1 25 TYR C C -5.744 1.851 2.696 1.00 . A A . 25 TYR C 1 1 12 12608 1 1 25 TYR CA C -4.264 2.180 2.629 1.00 . A A . 25 TYR CA 1 1 12 12609 1 1 25 TYR CB C -3.841 2.244 1.168 1.00 . A A . 25 TYR CB 1 1 12 12610 1 1 25 TYR CD1 C -1.369 2.701 1.092 1.00 . A A . 25 TYR CD1 1 1 12 12611 1 1 25 TYR CD2 C -2.849 4.435 0.432 1.00 . A A . 25 TYR CD2 1 1 12 12612 1 1 25 TYR CE1 C -0.290 3.518 0.822 1.00 . A A . 25 TYR CE1 1 1 12 12613 1 1 25 TYR CE2 C -1.778 5.258 0.153 1.00 . A A . 25 TYR CE2 1 1 12 12614 1 1 25 TYR CG C -2.663 3.146 0.903 1.00 . A A . 25 TYR CG 1 1 12 12615 1 1 25 TYR CZ C -0.500 4.794 0.350 1.00 . A A . 25 TYR CZ 1 1 12 12616 1 1 25 TYR H H -3.468 0.271 2.990 1.00 . A A . 25 TYR H 1 1 12 12617 1 1 25 TYR HA H -4.082 3.134 3.088 1.00 . A A . 25 TYR HA 1 1 12 12618 1 1 25 TYR HB2 H -3.575 1.251 0.836 1.00 . A A . 25 TYR HB2 1 1 12 12619 1 1 25 TYR HB3 H -4.672 2.602 0.578 1.00 . A A . 25 TYR HB3 1 1 12 12620 1 1 25 TYR HD1 H -1.205 1.699 1.461 1.00 . A A . 25 TYR HD1 1 1 12 12621 1 1 25 TYR HD2 H -3.849 4.794 0.285 1.00 . A A . 25 TYR HD2 1 1 12 12622 1 1 25 TYR HE1 H 0.708 3.156 0.973 1.00 . A A . 25 TYR HE1 1 1 12 12623 1 1 25 TYR HE2 H -1.946 6.259 -0.215 1.00 . A A . 25 TYR HE2 1 1 12 12624 1 1 25 TYR HH H 1.219 5.113 -0.441 1.00 . A A . 25 TYR HH 1 1 12 12625 1 1 25 TYR N N -3.486 1.182 3.333 1.00 . A A . 25 TYR N 1 1 12 12626 1 1 25 TYR O O -6.126 0.689 2.745 1.00 . A A . 25 TYR O 1 1 12 12627 1 1 25 TYR OH O 0.575 5.604 0.074 1.00 . A A . 25 TYR OH 1 1 12 12628 1 1 26 LEU C C -8.484 2.616 1.293 1.00 . A A . 26 LEU C 1 1 12 12629 1 1 26 LEU CA C -8.003 2.703 2.717 1.00 . A A . 26 LEU CA 1 1 12 12630 1 1 26 LEU CB C -8.678 3.887 3.416 1.00 . A A . 26 LEU CB 1 1 12 12631 1 1 26 LEU CD1 C -10.886 4.639 4.345 1.00 . A A . 26 LEU CD1 1 1 12 12632 1 1 26 LEU CD2 C -10.460 4.815 1.886 1.00 . A A . 26 LEU CD2 1 1 12 12633 1 1 26 LEU CG C -10.183 4.015 3.154 1.00 . A A . 26 LEU CG 1 1 12 12634 1 1 26 LEU H H -6.210 3.775 2.647 1.00 . A A . 26 LEU H 1 1 12 12635 1 1 26 LEU HA H -8.234 1.786 3.235 1.00 . A A . 26 LEU HA 1 1 12 12636 1 1 26 LEU HB2 H -8.521 3.787 4.480 1.00 . A A . 26 LEU HB2 1 1 12 12637 1 1 26 LEU HB3 H -8.199 4.792 3.083 1.00 . A A . 26 LEU HB3 1 1 12 12638 1 1 26 LEU HD11 H -11.502 5.459 4.009 1.00 . A A . 26 LEU HD11 1 1 12 12639 1 1 26 LEU HD12 H -10.151 5.001 5.047 1.00 . A A . 26 LEU HD12 1 1 12 12640 1 1 26 LEU HD13 H -11.507 3.896 4.823 1.00 . A A . 26 LEU HD13 1 1 12 12641 1 1 26 LEU HD21 H -9.815 5.676 1.853 1.00 . A A . 26 LEU HD21 1 1 12 12642 1 1 26 LEU HD22 H -11.490 5.135 1.884 1.00 . A A . 26 LEU HD22 1 1 12 12643 1 1 26 LEU HD23 H -10.280 4.197 1.018 1.00 . A A . 26 LEU HD23 1 1 12 12644 1 1 26 LEU HG H -10.584 3.034 3.011 1.00 . A A . 26 LEU HG 1 1 12 12645 1 1 26 LEU N N -6.569 2.878 2.692 1.00 . A A . 26 LEU N 1 1 12 12646 1 1 26 LEU O O -7.789 3.052 0.380 1.00 . A A . 26 LEU O 1 1 12 12647 1 1 27 VAL C C -11.639 2.247 -0.393 1.00 . A A . 27 VAL C 1 1 12 12648 1 1 27 VAL CA C -10.145 1.980 -0.278 1.00 . A A . 27 VAL CA 1 1 12 12649 1 1 27 VAL CB C -9.737 0.662 -0.989 1.00 . A A . 27 VAL CB 1 1 12 12650 1 1 27 VAL CG1 C -8.640 -0.077 -0.234 1.00 . A A . 27 VAL CG1 1 1 12 12651 1 1 27 VAL CG2 C -10.913 -0.275 -1.272 1.00 . A A . 27 VAL CG2 1 1 12 12652 1 1 27 VAL H H -10.163 1.661 1.811 1.00 . A A . 27 VAL H 1 1 12 12653 1 1 27 VAL HA H -9.648 2.770 -0.817 1.00 . A A . 27 VAL HA 1 1 12 12654 1 1 27 VAL HB H -9.325 0.968 -1.926 1.00 . A A . 27 VAL HB 1 1 12 12655 1 1 27 VAL HG11 H -7.769 0.557 -0.155 1.00 . A A . 27 VAL HG11 1 1 12 12656 1 1 27 VAL HG12 H -8.381 -0.979 -0.765 1.00 . A A . 27 VAL HG12 1 1 12 12657 1 1 27 VAL HG13 H -8.992 -0.329 0.755 1.00 . A A . 27 VAL HG13 1 1 12 12658 1 1 27 VAL HG21 H -10.544 -1.210 -1.662 1.00 . A A . 27 VAL HG21 1 1 12 12659 1 1 27 VAL HG22 H -11.570 0.183 -1.997 1.00 . A A . 27 VAL HG22 1 1 12 12660 1 1 27 VAL HG23 H -11.456 -0.452 -0.358 1.00 . A A . 27 VAL HG23 1 1 12 12661 1 1 27 VAL N N -9.652 2.051 1.075 1.00 . A A . 27 VAL N 1 1 12 12662 1 1 27 VAL O O -12.471 1.443 0.028 1.00 . A A . 27 VAL O 1 1 12 12663 1 1 28 ARG C C -13.714 3.108 -2.506 1.00 . A A . 28 ARG C 1 1 12 12664 1 1 28 ARG CA C -13.337 3.757 -1.208 1.00 . A A . 28 ARG CA 1 1 12 12665 1 1 28 ARG CB C -13.513 5.264 -1.323 1.00 . A A . 28 ARG CB 1 1 12 12666 1 1 28 ARG CD C -15.080 6.017 0.497 1.00 . A A . 28 ARG CD 1 1 12 12667 1 1 28 ARG CG C -14.914 5.752 -0.991 1.00 . A A . 28 ARG CG 1 1 12 12668 1 1 28 ARG CZ C -16.591 7.386 1.881 1.00 . A A . 28 ARG CZ 1 1 12 12669 1 1 28 ARG H H -11.248 4.028 -1.204 1.00 . A A . 28 ARG H 1 1 12 12670 1 1 28 ARG HA H -13.961 3.360 -0.426 1.00 . A A . 28 ARG HA 1 1 12 12671 1 1 28 ARG HB2 H -12.814 5.754 -0.662 1.00 . A A . 28 ARG HB2 1 1 12 12672 1 1 28 ARG HB3 H -13.295 5.542 -2.340 1.00 . A A . 28 ARG HB3 1 1 12 12673 1 1 28 ARG HD2 H -15.013 5.078 1.027 1.00 . A A . 28 ARG HD2 1 1 12 12674 1 1 28 ARG HD3 H -14.284 6.670 0.822 1.00 . A A . 28 ARG HD3 1 1 12 12675 1 1 28 ARG HE H -17.096 6.508 0.161 1.00 . A A . 28 ARG HE 1 1 12 12676 1 1 28 ARG HG2 H -15.102 6.668 -1.531 1.00 . A A . 28 ARG HG2 1 1 12 12677 1 1 28 ARG HG3 H -15.628 5.000 -1.295 1.00 . A A . 28 ARG HG3 1 1 12 12678 1 1 28 ARG HH11 H -14.728 7.169 2.637 1.00 . A A . 28 ARG HH11 1 1 12 12679 1 1 28 ARG HH12 H -15.805 8.139 3.584 1.00 . A A . 28 ARG HH12 1 1 12 12680 1 1 28 ARG HH21 H -18.515 7.783 1.407 1.00 . A A . 28 ARG HH21 1 1 12 12681 1 1 28 ARG HH22 H -17.954 8.487 2.886 1.00 . A A . 28 ARG HH22 1 1 12 12682 1 1 28 ARG N N -11.959 3.401 -0.954 1.00 . A A . 28 ARG N 1 1 12 12683 1 1 28 ARG NE N -16.364 6.644 0.800 1.00 . A A . 28 ARG NE 1 1 12 12684 1 1 28 ARG NH1 N -15.629 7.580 2.773 1.00 . A A . 28 ARG NH1 1 1 12 12685 1 1 28 ARG NH2 N -17.784 7.930 2.073 1.00 . A A . 28 ARG NH2 1 1 12 12686 1 1 28 ARG O O -13.802 3.770 -3.538 1.00 . A A . 28 ARG O 1 1 12 12687 1 1 29 TRP C C -14.998 1.743 -4.643 1.00 . A A . 29 TRP C 1 1 12 12688 1 1 29 TRP CA C -14.257 0.965 -3.575 1.00 . A A . 29 TRP CA 1 1 12 12689 1 1 29 TRP CB C -15.109 -0.198 -3.096 1.00 . A A . 29 TRP CB 1 1 12 12690 1 1 29 TRP CD1 C -14.220 -1.586 -5.060 1.00 . A A . 29 TRP CD1 1 1 12 12691 1 1 29 TRP CD2 C -15.884 -2.563 -3.923 1.00 . A A . 29 TRP CD2 1 1 12 12692 1 1 29 TRP CE2 C -15.492 -3.419 -4.969 1.00 . A A . 29 TRP CE2 1 1 12 12693 1 1 29 TRP CE3 C -16.917 -2.968 -3.072 1.00 . A A . 29 TRP CE3 1 1 12 12694 1 1 29 TRP CG C -15.058 -1.394 -3.999 1.00 . A A . 29 TRP CG 1 1 12 12695 1 1 29 TRP CH2 C -17.104 -5.025 -4.338 1.00 . A A . 29 TRP CH2 1 1 12 12696 1 1 29 TRP CZ2 C -16.096 -4.655 -5.186 1.00 . A A . 29 TRP CZ2 1 1 12 12697 1 1 29 TRP CZ3 C -17.516 -4.195 -3.288 1.00 . A A . 29 TRP CZ3 1 1 12 12698 1 1 29 TRP H H -13.824 1.367 -1.556 1.00 . A A . 29 TRP H 1 1 12 12699 1 1 29 TRP HA H -13.340 0.574 -3.995 1.00 . A A . 29 TRP HA 1 1 12 12700 1 1 29 TRP HB2 H -14.763 -0.491 -2.118 1.00 . A A . 29 TRP HB2 1 1 12 12701 1 1 29 TRP HB3 H -16.136 0.126 -3.024 1.00 . A A . 29 TRP HB3 1 1 12 12702 1 1 29 TRP HD1 H -13.470 -0.878 -5.380 1.00 . A A . 29 TRP HD1 1 1 12 12703 1 1 29 TRP HE1 H -14.006 -3.166 -6.427 1.00 . A A . 29 TRP HE1 1 1 12 12704 1 1 29 TRP HE3 H -17.247 -2.341 -2.257 1.00 . A A . 29 TRP HE3 1 1 12 12705 1 1 29 TRP HH2 H -17.601 -5.975 -4.470 1.00 . A A . 29 TRP HH2 1 1 12 12706 1 1 29 TRP HZ2 H -15.790 -5.307 -5.991 1.00 . A A . 29 TRP HZ2 1 1 12 12707 1 1 29 TRP HZ3 H -18.315 -4.524 -2.641 1.00 . A A . 29 TRP HZ3 1 1 12 12708 1 1 29 TRP N N -13.914 1.797 -2.430 1.00 . A A . 29 TRP N 1 1 12 12709 1 1 29 TRP NE1 N -14.475 -2.801 -5.649 1.00 . A A . 29 TRP NE1 1 1 12 12710 1 1 29 TRP O O -16.217 1.863 -4.603 1.00 . A A . 29 TRP O 1 1 12 12711 1 1 30 LYS C C -16.138 2.615 -7.123 1.00 . A A . 30 LYS C 1 1 12 12712 1 1 30 LYS CA C -14.752 3.105 -6.690 1.00 . A A . 30 LYS CA 1 1 12 12713 1 1 30 LYS CB C -13.790 3.031 -7.879 1.00 . A A . 30 LYS CB 1 1 12 12714 1 1 30 LYS CD C -12.953 4.113 -9.988 1.00 . A A . 30 LYS CD 1 1 12 12715 1 1 30 LYS CE C -12.891 2.804 -10.757 1.00 . A A . 30 LYS CE 1 1 12 12716 1 1 30 LYS CG C -14.051 4.091 -8.936 1.00 . A A . 30 LYS CG 1 1 12 12717 1 1 30 LYS H H -13.230 2.282 -5.422 1.00 . A A . 30 LYS H 1 1 12 12718 1 1 30 LYS HA H -14.833 4.135 -6.373 1.00 . A A . 30 LYS HA 1 1 12 12719 1 1 30 LYS HB2 H -12.779 3.151 -7.520 1.00 . A A . 30 LYS HB2 1 1 12 12720 1 1 30 LYS HB3 H -13.885 2.060 -8.343 1.00 . A A . 30 LYS HB3 1 1 12 12721 1 1 30 LYS HD2 H -13.149 4.916 -10.681 1.00 . A A . 30 LYS HD2 1 1 12 12722 1 1 30 LYS HD3 H -12.004 4.278 -9.499 1.00 . A A . 30 LYS HD3 1 1 12 12723 1 1 30 LYS HE2 H -12.761 1.994 -10.056 1.00 . A A . 30 LYS HE2 1 1 12 12724 1 1 30 LYS HE3 H -13.820 2.671 -11.292 1.00 . A A . 30 LYS HE3 1 1 12 12725 1 1 30 LYS HG2 H -14.994 3.879 -9.420 1.00 . A A . 30 LYS HG2 1 1 12 12726 1 1 30 LYS HG3 H -14.099 5.059 -8.458 1.00 . A A . 30 LYS HG3 1 1 12 12727 1 1 30 LYS HZ1 H -11.773 1.898 -12.271 1.00 . A A . 30 LYS HZ1 1 1 12 12728 1 1 30 LYS HZ2 H -10.858 2.867 -11.230 1.00 . A A . 30 LYS HZ2 1 1 12 12729 1 1 30 LYS HZ3 H -11.854 3.582 -12.394 1.00 . A A . 30 LYS HZ3 1 1 12 12730 1 1 30 LYS N N -14.216 2.328 -5.556 1.00 . A A . 30 LYS N 1 1 12 12731 1 1 30 LYS NZ N -11.766 2.786 -11.732 1.00 . A A . 30 LYS NZ 1 1 12 12732 1 1 30 LYS O O -16.990 3.407 -7.527 1.00 . A A . 30 LYS O 1 1 12 12733 1 1 31 ASP C C -18.210 -0.019 -6.172 1.00 . A A . 31 ASP C 1 1 12 12734 1 1 31 ASP CA C -17.631 0.703 -7.388 1.00 . A A . 31 ASP CA 1 1 12 12735 1 1 31 ASP CB C -17.467 -0.277 -8.553 1.00 . A A . 31 ASP CB 1 1 12 12736 1 1 31 ASP CG C -16.932 0.395 -9.803 1.00 . A A . 31 ASP CG 1 1 12 12737 1 1 31 ASP H H -15.617 0.723 -6.748 1.00 . A A . 31 ASP H 1 1 12 12738 1 1 31 ASP HA H -18.304 1.495 -7.681 1.00 . A A . 31 ASP HA 1 1 12 12739 1 1 31 ASP HB2 H -16.779 -1.057 -8.264 1.00 . A A . 31 ASP HB2 1 1 12 12740 1 1 31 ASP HB3 H -18.427 -0.716 -8.783 1.00 . A A . 31 ASP HB3 1 1 12 12741 1 1 31 ASP N N -16.348 1.303 -7.042 1.00 . A A . 31 ASP N 1 1 12 12742 1 1 31 ASP O O -18.505 -1.213 -6.225 1.00 . A A . 31 ASP O 1 1 12 12743 1 1 31 ASP OD1 O -17.739 0.986 -10.550 1.00 . A A . 31 ASP OD1 1 1 12 12744 1 1 31 ASP OD2 O -15.706 0.327 -10.034 1.00 . A A . 31 ASP OD2 1 1 12 12745 1 1 32 GLY C C -19.748 1.115 -3.063 1.00 . A A . 32 GLY C 1 1 12 12746 1 1 32 GLY CA C -18.884 0.148 -3.847 1.00 . A A . 32 GLY CA 1 1 12 12747 1 1 32 GLY H H -18.129 1.672 -5.105 1.00 . A A . 32 GLY H 1 1 12 12748 1 1 32 GLY HA2 H -19.466 -0.729 -4.086 1.00 . A A . 32 GLY HA2 1 1 12 12749 1 1 32 GLY HA3 H -18.045 -0.144 -3.225 1.00 . A A . 32 GLY HA3 1 1 12 12750 1 1 32 GLY N N -18.367 0.722 -5.077 1.00 . A A . 32 GLY N 1 1 12 12751 1 1 32 GLY O O -20.202 2.129 -3.595 1.00 . A A . 32 GLY O 1 1 12 12752 1 1 33 GLY C C -20.367 1.575 0.514 1.00 . A A . 33 GLY C 1 1 12 12753 1 1 33 GLY CA C -20.782 1.652 -0.942 1.00 . A A . 33 GLY CA 1 1 12 12754 1 1 33 GLY H H -19.586 -0.025 -1.428 1.00 . A A . 33 GLY H 1 1 12 12755 1 1 33 GLY HA2 H -20.689 2.674 -1.280 1.00 . A A . 33 GLY HA2 1 1 12 12756 1 1 33 GLY HA3 H -21.815 1.348 -1.027 1.00 . A A . 33 GLY HA3 1 1 12 12757 1 1 33 GLY N N -19.973 0.798 -1.792 1.00 . A A . 33 GLY N 1 1 12 12758 1 1 33 GLY O O -21.183 1.786 1.411 1.00 . A A . 33 GLY O 1 1 12 12759 1 1 34 ASP C C -17.161 1.726 2.211 1.00 . A A . 34 ASP C 1 1 12 12760 1 1 34 ASP CA C -18.575 1.162 2.110 1.00 . A A . 34 ASP CA 1 1 12 12761 1 1 34 ASP CB C -18.581 -0.300 2.553 1.00 . A A . 34 ASP CB 1 1 12 12762 1 1 34 ASP CG C -19.944 -0.943 2.395 1.00 . A A . 34 ASP CG 1 1 12 12763 1 1 34 ASP H H -18.488 1.122 -0.005 1.00 . A A . 34 ASP H 1 1 12 12764 1 1 34 ASP HA H -19.224 1.729 2.761 1.00 . A A . 34 ASP HA 1 1 12 12765 1 1 34 ASP HB2 H -17.870 -0.854 1.958 1.00 . A A . 34 ASP HB2 1 1 12 12766 1 1 34 ASP HB3 H -18.294 -0.357 3.593 1.00 . A A . 34 ASP HB3 1 1 12 12767 1 1 34 ASP N N -19.092 1.274 0.751 1.00 . A A . 34 ASP N 1 1 12 12768 1 1 34 ASP O O -16.606 2.222 1.229 1.00 . A A . 34 ASP O 1 1 12 12769 1 1 34 ASP OD1 O -20.776 -0.806 3.317 1.00 . A A . 34 ASP OD1 1 1 12 12770 1 1 34 ASP OD2 O -20.181 -1.583 1.348 1.00 . A A . 34 ASP OD2 1 1 12 12771 1 1 35 CYS C C -14.421 1.148 4.467 1.00 . A A . 35 CYS C 1 1 12 12772 1 1 35 CYS CA C -15.231 2.144 3.643 1.00 . A A . 35 CYS CA 1 1 12 12773 1 1 35 CYS CB C -15.282 3.493 4.361 1.00 . A A . 35 CYS CB 1 1 12 12774 1 1 35 CYS H H -17.076 1.236 4.148 1.00 . A A . 35 CYS H 1 1 12 12775 1 1 35 CYS HA H -14.753 2.274 2.683 1.00 . A A . 35 CYS HA 1 1 12 12776 1 1 35 CYS HB2 H -15.744 3.360 5.328 1.00 . A A . 35 CYS HB2 1 1 12 12777 1 1 35 CYS HB3 H -14.275 3.859 4.497 1.00 . A A . 35 CYS HB3 1 1 12 12778 1 1 35 CYS HG H -17.162 5.215 4.290 1.00 . A A . 35 CYS HG 1 1 12 12779 1 1 35 CYS N N -16.582 1.644 3.406 1.00 . A A . 35 CYS N 1 1 12 12780 1 1 35 CYS O O -14.694 0.939 5.649 1.00 . A A . 35 CYS O 1 1 12 12781 1 1 35 CYS SG S -16.217 4.763 3.479 1.00 . A A . 35 CYS SG 1 1 12 12782 1 1 36 GLU C C -11.103 -0.056 4.403 1.00 . A A . 36 GLU C 1 1 12 12783 1 1 36 GLU CA C -12.576 -0.439 4.512 1.00 . A A . 36 GLU CA 1 1 12 12784 1 1 36 GLU CB C -12.795 -1.830 3.917 1.00 . A A . 36 GLU CB 1 1 12 12785 1 1 36 GLU CD C -15.195 -1.502 3.195 1.00 . A A . 36 GLU CD 1 1 12 12786 1 1 36 GLU CG C -14.229 -2.325 4.023 1.00 . A A . 36 GLU CG 1 1 12 12787 1 1 36 GLU H H -13.251 0.751 2.895 1.00 . A A . 36 GLU H 1 1 12 12788 1 1 36 GLU HA H -12.855 -0.455 5.555 1.00 . A A . 36 GLU HA 1 1 12 12789 1 1 36 GLU HB2 H -12.522 -1.807 2.873 1.00 . A A . 36 GLU HB2 1 1 12 12790 1 1 36 GLU HB3 H -12.155 -2.533 4.431 1.00 . A A . 36 GLU HB3 1 1 12 12791 1 1 36 GLU HG2 H -14.269 -3.348 3.682 1.00 . A A . 36 GLU HG2 1 1 12 12792 1 1 36 GLU HG3 H -14.535 -2.280 5.059 1.00 . A A . 36 GLU HG3 1 1 12 12793 1 1 36 GLU N N -13.423 0.538 3.836 1.00 . A A . 36 GLU N 1 1 12 12794 1 1 36 GLU O O -10.746 0.884 3.692 1.00 . A A . 36 GLU O 1 1 12 12795 1 1 36 GLU OE1 O -15.081 -1.526 1.952 1.00 . A A . 36 GLU OE1 1 1 12 12796 1 1 36 GLU OE2 O -16.071 -0.838 3.789 1.00 . A A . 36 GLU OE2 1 1 12 12797 1 1 37 TRP C C -8.051 -1.694 4.482 1.00 . A A . 37 TRP C 1 1 12 12798 1 1 37 TRP CA C -8.821 -0.537 5.105 1.00 . A A . 37 TRP CA 1 1 12 12799 1 1 37 TRP CB C -8.327 -0.317 6.531 1.00 . A A . 37 TRP CB 1 1 12 12800 1 1 37 TRP CD1 C -9.264 2.061 6.632 1.00 . A A . 37 TRP CD1 1 1 12 12801 1 1 37 TRP CD2 C -9.359 0.953 8.575 1.00 . A A . 37 TRP CD2 1 1 12 12802 1 1 37 TRP CE2 C -9.902 2.237 8.764 1.00 . A A . 37 TRP CE2 1 1 12 12803 1 1 37 TRP CE3 C -9.314 0.074 9.661 1.00 . A A . 37 TRP CE3 1 1 12 12804 1 1 37 TRP CG C -8.958 0.860 7.203 1.00 . A A . 37 TRP CG 1 1 12 12805 1 1 37 TRP CH2 C -10.338 1.782 11.040 1.00 . A A . 37 TRP CH2 1 1 12 12806 1 1 37 TRP CZ2 C -10.395 2.664 9.995 1.00 . A A . 37 TRP CZ2 1 1 12 12807 1 1 37 TRP CZ3 C -9.803 0.497 10.882 1.00 . A A . 37 TRP CZ3 1 1 12 12808 1 1 37 TRP H H -10.599 -1.522 5.665 1.00 . A A . 37 TRP H 1 1 12 12809 1 1 37 TRP HA H -8.642 0.357 4.529 1.00 . A A . 37 TRP HA 1 1 12 12810 1 1 37 TRP HB2 H -8.548 -1.196 7.118 1.00 . A A . 37 TRP HB2 1 1 12 12811 1 1 37 TRP HB3 H -7.262 -0.166 6.513 1.00 . A A . 37 TRP HB3 1 1 12 12812 1 1 37 TRP HD1 H -9.080 2.305 5.596 1.00 . A A . 37 TRP HD1 1 1 12 12813 1 1 37 TRP HE1 H -10.140 3.811 7.395 1.00 . A A . 37 TRP HE1 1 1 12 12814 1 1 37 TRP HE3 H -8.904 -0.921 9.558 1.00 . A A . 37 TRP HE3 1 1 12 12815 1 1 37 TRP HH2 H -10.709 2.070 12.013 1.00 . A A . 37 TRP HH2 1 1 12 12816 1 1 37 TRP HZ2 H -10.812 3.651 10.135 1.00 . A A . 37 TRP HZ2 1 1 12 12817 1 1 37 TRP HZ3 H -9.776 -0.168 11.732 1.00 . A A . 37 TRP HZ3 1 1 12 12818 1 1 37 TRP N N -10.253 -0.793 5.113 1.00 . A A . 37 TRP N 1 1 12 12819 1 1 37 TRP NE1 N -9.833 2.895 7.563 1.00 . A A . 37 TRP NE1 1 1 12 12820 1 1 37 TRP O O -8.476 -2.847 4.555 1.00 . A A . 37 TRP O 1 1 12 12821 1 1 38 VAL C C -5.065 -2.928 4.267 1.00 . A A . 38 VAL C 1 1 12 12822 1 1 38 VAL CA C -6.070 -2.391 3.256 1.00 . A A . 38 VAL CA 1 1 12 12823 1 1 38 VAL CB C -5.317 -1.829 2.037 1.00 . A A . 38 VAL CB 1 1 12 12824 1 1 38 VAL CG1 C -4.400 -2.884 1.435 1.00 . A A . 38 VAL CG1 1 1 12 12825 1 1 38 VAL CG2 C -6.300 -1.314 1.005 1.00 . A A . 38 VAL CG2 1 1 12 12826 1 1 38 VAL H H -6.642 -0.428 3.825 1.00 . A A . 38 VAL H 1 1 12 12827 1 1 38 VAL HA H -6.704 -3.200 2.925 1.00 . A A . 38 VAL HA 1 1 12 12828 1 1 38 VAL HB H -4.709 -1.003 2.362 1.00 . A A . 38 VAL HB 1 1 12 12829 1 1 38 VAL HG11 H -3.950 -2.498 0.536 1.00 . A A . 38 VAL HG11 1 1 12 12830 1 1 38 VAL HG12 H -4.972 -3.768 1.200 1.00 . A A . 38 VAL HG12 1 1 12 12831 1 1 38 VAL HG13 H -3.624 -3.134 2.143 1.00 . A A . 38 VAL HG13 1 1 12 12832 1 1 38 VAL HG21 H -5.815 -0.583 0.376 1.00 . A A . 38 VAL HG21 1 1 12 12833 1 1 38 VAL HG22 H -7.138 -0.855 1.507 1.00 . A A . 38 VAL HG22 1 1 12 12834 1 1 38 VAL HG23 H -6.647 -2.136 0.402 1.00 . A A . 38 VAL HG23 1 1 12 12835 1 1 38 VAL N N -6.914 -1.376 3.874 1.00 . A A . 38 VAL N 1 1 12 12836 1 1 38 VAL O O -4.789 -2.288 5.281 1.00 . A A . 38 VAL O 1 1 12 12837 1 1 39 LYS C C -2.172 -4.112 4.769 1.00 . A A . 39 LYS C 1 1 12 12838 1 1 39 LYS CA C -3.558 -4.727 4.887 1.00 . A A . 39 LYS CA 1 1 12 12839 1 1 39 LYS CB C -3.488 -6.235 4.637 1.00 . A A . 39 LYS CB 1 1 12 12840 1 1 39 LYS CD C -2.496 -8.455 5.281 1.00 . A A . 39 LYS CD 1 1 12 12841 1 1 39 LYS CE C -3.870 -9.103 5.350 1.00 . A A . 39 LYS CE 1 1 12 12842 1 1 39 LYS CG C -2.561 -6.969 5.594 1.00 . A A . 39 LYS CG 1 1 12 12843 1 1 39 LYS H H -4.763 -4.563 3.156 1.00 . A A . 39 LYS H 1 1 12 12844 1 1 39 LYS HA H -3.909 -4.555 5.885 1.00 . A A . 39 LYS HA 1 1 12 12845 1 1 39 LYS HB2 H -4.480 -6.651 4.741 1.00 . A A . 39 LYS HB2 1 1 12 12846 1 1 39 LYS HB3 H -3.139 -6.406 3.630 1.00 . A A . 39 LYS HB3 1 1 12 12847 1 1 39 LYS HD2 H -2.098 -8.586 4.285 1.00 . A A . 39 LYS HD2 1 1 12 12848 1 1 39 LYS HD3 H -1.845 -8.935 5.997 1.00 . A A . 39 LYS HD3 1 1 12 12849 1 1 39 LYS HE2 H -4.516 -8.624 4.631 1.00 . A A . 39 LYS HE2 1 1 12 12850 1 1 39 LYS HE3 H -3.772 -10.150 5.102 1.00 . A A . 39 LYS HE3 1 1 12 12851 1 1 39 LYS HG2 H -1.570 -6.549 5.510 1.00 . A A . 39 LYS HG2 1 1 12 12852 1 1 39 LYS HG3 H -2.925 -6.837 6.603 1.00 . A A . 39 LYS HG3 1 1 12 12853 1 1 39 LYS HZ1 H -5.406 -9.450 6.722 1.00 . A A . 39 LYS HZ1 1 1 12 12854 1 1 39 LYS HZ2 H -4.601 -7.979 6.953 1.00 . A A . 39 LYS HZ2 1 1 12 12855 1 1 39 LYS HZ3 H -3.862 -9.429 7.414 1.00 . A A . 39 LYS HZ3 1 1 12 12856 1 1 39 LYS N N -4.516 -4.105 3.985 1.00 . A A . 39 LYS N 1 1 12 12857 1 1 39 LYS NZ N -4.477 -8.982 6.705 1.00 . A A . 39 LYS NZ 1 1 12 12858 1 1 39 LYS O O -1.387 -4.472 3.892 1.00 . A A . 39 LYS O 1 1 12 12859 1 1 40 GLY C C 0.408 -3.245 6.573 1.00 . A A . 40 GLY C 1 1 12 12860 1 1 40 GLY CA C -0.588 -2.530 5.683 1.00 . A A . 40 GLY CA 1 1 12 12861 1 1 40 GLY H H -2.566 -2.913 6.318 1.00 . A A . 40 GLY H 1 1 12 12862 1 1 40 GLY HA2 H -0.200 -2.518 4.678 1.00 . A A . 40 GLY HA2 1 1 12 12863 1 1 40 GLY HA3 H -0.702 -1.515 6.029 1.00 . A A . 40 GLY HA3 1 1 12 12864 1 1 40 GLY N N -1.883 -3.177 5.669 1.00 . A A . 40 GLY N 1 1 12 12865 1 1 40 GLY O O 1.085 -2.622 7.390 1.00 . A A . 40 GLY O 1 1 12 12866 1 1 41 VAL C C 2.348 -6.129 6.254 1.00 . A A . 41 VAL C 1 1 12 12867 1 1 41 VAL CA C 1.414 -5.374 7.194 1.00 . A A . 41 VAL CA 1 1 12 12868 1 1 41 VAL CB C 0.709 -6.410 8.090 1.00 . A A . 41 VAL CB 1 1 12 12869 1 1 41 VAL CG1 C 1.574 -6.749 9.294 1.00 . A A . 41 VAL CG1 1 1 12 12870 1 1 41 VAL CG2 C -0.664 -5.919 8.530 1.00 . A A . 41 VAL CG2 1 1 12 12871 1 1 41 VAL H H -0.129 -5.002 5.795 1.00 . A A . 41 VAL H 1 1 12 12872 1 1 41 VAL HA H 1.998 -4.717 7.822 1.00 . A A . 41 VAL HA 1 1 12 12873 1 1 41 VAL HB H 0.580 -7.312 7.509 1.00 . A A . 41 VAL HB 1 1 12 12874 1 1 41 VAL HG11 H 2.523 -7.141 8.956 1.00 . A A . 41 VAL HG11 1 1 12 12875 1 1 41 VAL HG12 H 1.074 -7.491 9.899 1.00 . A A . 41 VAL HG12 1 1 12 12876 1 1 41 VAL HG13 H 1.740 -5.859 9.881 1.00 . A A . 41 VAL HG13 1 1 12 12877 1 1 41 VAL HG21 H -1.116 -6.649 9.186 1.00 . A A . 41 VAL HG21 1 1 12 12878 1 1 41 VAL HG22 H -1.292 -5.776 7.663 1.00 . A A . 41 VAL HG22 1 1 12 12879 1 1 41 VAL HG23 H -0.559 -4.980 9.056 1.00 . A A . 41 VAL HG23 1 1 12 12880 1 1 41 VAL N N 0.474 -4.562 6.431 1.00 . A A . 41 VAL N 1 1 12 12881 1 1 41 VAL O O 3.182 -6.919 6.696 1.00 . A A . 41 VAL O 1 1 12 12882 1 1 42 HIS C C 4.414 -5.981 3.946 1.00 . A A . 42 HIS C 1 1 12 12883 1 1 42 HIS CA C 3.021 -6.549 3.959 1.00 . A A . 42 HIS CA 1 1 12 12884 1 1 42 HIS CB C 2.349 -6.488 2.587 1.00 . A A . 42 HIS CB 1 1 12 12885 1 1 42 HIS CD2 C 2.766 -8.795 1.475 1.00 . A A . 42 HIS CD2 1 1 12 12886 1 1 42 HIS CE1 C 0.724 -9.583 1.604 1.00 . A A . 42 HIS CE1 1 1 12 12887 1 1 42 HIS CG C 1.999 -7.844 2.057 1.00 . A A . 42 HIS CG 1 1 12 12888 1 1 42 HIS H H 1.554 -5.225 4.654 1.00 . A A . 42 HIS H 1 1 12 12889 1 1 42 HIS HA H 3.113 -7.566 4.255 1.00 . A A . 42 HIS HA 1 1 12 12890 1 1 42 HIS HB2 H 1.428 -5.919 2.669 1.00 . A A . 42 HIS HB2 1 1 12 12891 1 1 42 HIS HB3 H 3.008 -6.007 1.880 1.00 . A A . 42 HIS HB3 1 1 12 12892 1 1 42 HIS HD1 H -0.059 -7.919 2.499 1.00 . A A . 42 HIS HD1 1 1 12 12893 1 1 42 HIS HD2 H 3.824 -8.726 1.265 1.00 . A A . 42 HIS HD2 1 1 12 12894 1 1 42 HIS HE1 H -0.134 -10.232 1.520 1.00 . A A . 42 HIS HE1 1 1 12 12895 1 1 42 HIS HE2 H 2.254 -10.752 0.917 1.00 . A A . 42 HIS HE2 1 1 12 12896 1 1 42 HIS N N 2.206 -5.882 4.951 1.00 . A A . 42 HIS N 1 1 12 12897 1 1 42 HIS ND1 N 0.726 -8.368 2.122 1.00 . A A . 42 HIS ND1 1 1 12 12898 1 1 42 HIS NE2 N 1.949 -9.867 1.204 1.00 . A A . 42 HIS NE2 1 1 12 12899 1 1 42 HIS O O 4.776 -5.184 3.089 1.00 . A A . 42 HIS O 1 1 12 12900 1 1 43 VAL C C 7.460 -6.293 3.949 1.00 . A A . 43 VAL C 1 1 12 12901 1 1 43 VAL CA C 6.562 -6.045 5.146 1.00 . A A . 43 VAL CA 1 1 12 12902 1 1 43 VAL CB C 7.149 -6.757 6.384 1.00 . A A . 43 VAL CB 1 1 12 12903 1 1 43 VAL CG1 C 8.602 -6.361 6.611 1.00 . A A . 43 VAL CG1 1 1 12 12904 1 1 43 VAL CG2 C 6.310 -6.450 7.615 1.00 . A A . 43 VAL CG2 1 1 12 12905 1 1 43 VAL H H 4.768 -7.091 5.553 1.00 . A A . 43 VAL H 1 1 12 12906 1 1 43 VAL HA H 6.565 -4.994 5.340 1.00 . A A . 43 VAL HA 1 1 12 12907 1 1 43 VAL HB H 7.113 -7.822 6.211 1.00 . A A . 43 VAL HB 1 1 12 12908 1 1 43 VAL HG11 H 9.243 -6.989 6.009 1.00 . A A . 43 VAL HG11 1 1 12 12909 1 1 43 VAL HG12 H 8.851 -6.485 7.654 1.00 . A A . 43 VAL HG12 1 1 12 12910 1 1 43 VAL HG13 H 8.741 -5.330 6.327 1.00 . A A . 43 VAL HG13 1 1 12 12911 1 1 43 VAL HG21 H 5.292 -6.768 7.446 1.00 . A A . 43 VAL HG21 1 1 12 12912 1 1 43 VAL HG22 H 6.327 -5.387 7.806 1.00 . A A . 43 VAL HG22 1 1 12 12913 1 1 43 VAL HG23 H 6.715 -6.975 8.467 1.00 . A A . 43 VAL HG23 1 1 12 12914 1 1 43 VAL N N 5.178 -6.454 4.926 1.00 . A A . 43 VAL N 1 1 12 12915 1 1 43 VAL O O 8.383 -7.102 4.007 1.00 . A A . 43 VAL O 1 1 12 12916 1 1 44 ALA C C 9.123 -4.635 1.766 1.00 . A A . 44 ALA C 1 1 12 12917 1 1 44 ALA CA C 8.003 -5.657 1.680 1.00 . A A . 44 ALA CA 1 1 12 12918 1 1 44 ALA CB C 7.156 -5.442 0.434 1.00 . A A . 44 ALA CB 1 1 12 12919 1 1 44 ALA H H 6.427 -4.960 2.892 1.00 . A A . 44 ALA H 1 1 12 12920 1 1 44 ALA HA H 8.435 -6.643 1.641 1.00 . A A . 44 ALA HA 1 1 12 12921 1 1 44 ALA HB1 H 6.704 -4.463 0.470 1.00 . A A . 44 ALA HB1 1 1 12 12922 1 1 44 ALA HB2 H 6.383 -6.196 0.391 1.00 . A A . 44 ALA HB2 1 1 12 12923 1 1 44 ALA HB3 H 7.783 -5.519 -0.443 1.00 . A A . 44 ALA HB3 1 1 12 12924 1 1 44 ALA N N 7.196 -5.568 2.877 1.00 . A A . 44 ALA N 1 1 12 12925 1 1 44 ALA O O 9.310 -3.811 0.871 1.00 . A A . 44 ALA O 1 1 12 12926 1 1 45 GLU C C 11.885 -3.715 1.900 1.00 . A A . 45 GLU C 1 1 12 12927 1 1 45 GLU CA C 10.978 -3.793 3.115 1.00 . A A . 45 GLU CA 1 1 12 12928 1 1 45 GLU CB C 11.781 -4.247 4.336 1.00 . A A . 45 GLU CB 1 1 12 12929 1 1 45 GLU CD C 13.803 -3.878 5.803 1.00 . A A . 45 GLU CD 1 1 12 12930 1 1 45 GLU CG C 13.021 -3.407 4.592 1.00 . A A . 45 GLU CG 1 1 12 12931 1 1 45 GLU H H 9.669 -5.397 3.526 1.00 . A A . 45 GLU H 1 1 12 12932 1 1 45 GLU HA H 10.568 -2.813 3.308 1.00 . A A . 45 GLU HA 1 1 12 12933 1 1 45 GLU HB2 H 11.148 -4.192 5.209 1.00 . A A . 45 GLU HB2 1 1 12 12934 1 1 45 GLU HB3 H 12.089 -5.271 4.189 1.00 . A A . 45 GLU HB3 1 1 12 12935 1 1 45 GLU HG2 H 13.663 -3.461 3.726 1.00 . A A . 45 GLU HG2 1 1 12 12936 1 1 45 GLU HG3 H 12.719 -2.381 4.753 1.00 . A A . 45 GLU HG3 1 1 12 12937 1 1 45 GLU N N 9.867 -4.703 2.869 1.00 . A A . 45 GLU N 1 1 12 12938 1 1 45 GLU O O 12.599 -2.736 1.706 1.00 . A A . 45 GLU O 1 1 12 12939 1 1 45 GLU OE1 O 14.598 -4.831 5.662 1.00 . A A . 45 GLU OE1 1 1 12 12940 1 1 45 GLU OE2 O 13.620 -3.295 6.892 1.00 . A A . 45 GLU OE2 1 1 12 12941 1 1 46 ASP C C 12.145 -3.783 -1.123 1.00 . A A . 46 ASP C 1 1 12 12942 1 1 46 ASP CA C 12.664 -4.802 -0.121 1.00 . A A . 46 ASP CA 1 1 12 12943 1 1 46 ASP CB C 12.635 -6.200 -0.736 1.00 . A A . 46 ASP CB 1 1 12 12944 1 1 46 ASP CG C 13.577 -6.333 -1.916 1.00 . A A . 46 ASP CG 1 1 12 12945 1 1 46 ASP H H 11.293 -5.534 1.323 1.00 . A A . 46 ASP H 1 1 12 12946 1 1 46 ASP HA H 13.682 -4.546 0.133 1.00 . A A . 46 ASP HA 1 1 12 12947 1 1 46 ASP HB2 H 12.924 -6.921 0.015 1.00 . A A . 46 ASP HB2 1 1 12 12948 1 1 46 ASP HB3 H 11.632 -6.417 -1.071 1.00 . A A . 46 ASP HB3 1 1 12 12949 1 1 46 ASP N N 11.860 -4.764 1.092 1.00 . A A . 46 ASP N 1 1 12 12950 1 1 46 ASP O O 12.904 -2.979 -1.648 1.00 . A A . 46 ASP O 1 1 12 12951 1 1 46 ASP OD1 O 13.149 -6.043 -3.053 1.00 . A A . 46 ASP OD1 1 1 12 12952 1 1 46 ASP OD2 O 14.744 -6.725 -1.704 1.00 . A A . 46 ASP OD2 1 1 12 12953 1 1 47 VAL C C 10.467 -1.437 -1.879 1.00 . A A . 47 VAL C 1 1 12 12954 1 1 47 VAL CA C 10.227 -2.883 -2.308 1.00 . A A . 47 VAL CA 1 1 12 12955 1 1 47 VAL CB C 8.715 -3.135 -2.426 1.00 . A A . 47 VAL CB 1 1 12 12956 1 1 47 VAL CG1 C 8.104 -2.230 -3.481 1.00 . A A . 47 VAL CG1 1 1 12 12957 1 1 47 VAL CG2 C 8.442 -4.593 -2.755 1.00 . A A . 47 VAL CG2 1 1 12 12958 1 1 47 VAL H H 10.279 -4.447 -0.880 1.00 . A A . 47 VAL H 1 1 12 12959 1 1 47 VAL HA H 10.679 -3.044 -3.276 1.00 . A A . 47 VAL HA 1 1 12 12960 1 1 47 VAL HB H 8.259 -2.909 -1.474 1.00 . A A . 47 VAL HB 1 1 12 12961 1 1 47 VAL HG11 H 8.781 -1.417 -3.692 1.00 . A A . 47 VAL HG11 1 1 12 12962 1 1 47 VAL HG12 H 7.169 -1.833 -3.116 1.00 . A A . 47 VAL HG12 1 1 12 12963 1 1 47 VAL HG13 H 7.929 -2.796 -4.383 1.00 . A A . 47 VAL HG13 1 1 12 12964 1 1 47 VAL HG21 H 8.732 -4.792 -3.775 1.00 . A A . 47 VAL HG21 1 1 12 12965 1 1 47 VAL HG22 H 7.388 -4.798 -2.634 1.00 . A A . 47 VAL HG22 1 1 12 12966 1 1 47 VAL HG23 H 9.009 -5.223 -2.091 1.00 . A A . 47 VAL HG23 1 1 12 12967 1 1 47 VAL N N 10.842 -3.807 -1.363 1.00 . A A . 47 VAL N 1 1 12 12968 1 1 47 VAL O O 10.592 -0.554 -2.710 1.00 . A A . 47 VAL O 1 1 12 12969 1 1 48 ALA C C 12.246 0.386 0.046 1.00 . A A . 48 ALA C 1 1 12 12970 1 1 48 ALA CA C 10.768 0.051 0.080 1.00 . A A . 48 ALA CA 1 1 12 12971 1 1 48 ALA CB C 10.279 0.005 1.520 1.00 . A A . 48 ALA CB 1 1 12 12972 1 1 48 ALA H H 10.444 -2.011 -0.007 1.00 . A A . 48 ALA H 1 1 12 12973 1 1 48 ALA HA H 10.216 0.815 -0.437 1.00 . A A . 48 ALA HA 1 1 12 12974 1 1 48 ALA HB1 H 10.837 -0.743 2.065 1.00 . A A . 48 ALA HB1 1 1 12 12975 1 1 48 ALA HB2 H 9.229 -0.248 1.535 1.00 . A A . 48 ALA HB2 1 1 12 12976 1 1 48 ALA HB3 H 10.425 0.971 1.982 1.00 . A A . 48 ALA HB3 1 1 12 12977 1 1 48 ALA N N 10.536 -1.244 -0.565 1.00 . A A . 48 ALA N 1 1 12 12978 1 1 48 ALA O O 12.651 1.422 -0.480 1.00 . A A . 48 ALA O 1 1 12 12979 1 1 49 LYS C C 14.969 -0.198 -0.818 1.00 . A A . 49 LYS C 1 1 12 12980 1 1 49 LYS CA C 14.488 -0.329 0.620 1.00 . A A . 49 LYS CA 1 1 12 12981 1 1 49 LYS CB C 15.173 -1.518 1.298 1.00 . A A . 49 LYS CB 1 1 12 12982 1 1 49 LYS CD C 16.961 -0.197 2.470 1.00 . A A . 49 LYS CD 1 1 12 12983 1 1 49 LYS CE C 16.362 -0.475 3.838 1.00 . A A . 49 LYS CE 1 1 12 12984 1 1 49 LYS CG C 16.668 -1.327 1.495 1.00 . A A . 49 LYS CG 1 1 12 12985 1 1 49 LYS H H 12.660 -1.302 1.030 1.00 . A A . 49 LYS H 1 1 12 12986 1 1 49 LYS HA H 14.714 0.576 1.161 1.00 . A A . 49 LYS HA 1 1 12 12987 1 1 49 LYS HB2 H 14.722 -1.676 2.267 1.00 . A A . 49 LYS HB2 1 1 12 12988 1 1 49 LYS HB3 H 15.022 -2.399 0.692 1.00 . A A . 49 LYS HB3 1 1 12 12989 1 1 49 LYS HD2 H 18.030 -0.089 2.570 1.00 . A A . 49 LYS HD2 1 1 12 12990 1 1 49 LYS HD3 H 16.539 0.719 2.080 1.00 . A A . 49 LYS HD3 1 1 12 12991 1 1 49 LYS HE2 H 15.289 -0.543 3.741 1.00 . A A . 49 LYS HE2 1 1 12 12992 1 1 49 LYS HE3 H 16.749 -1.415 4.203 1.00 . A A . 49 LYS HE3 1 1 12 12993 1 1 49 LYS HG2 H 17.090 -2.242 1.884 1.00 . A A . 49 LYS HG2 1 1 12 12994 1 1 49 LYS HG3 H 17.120 -1.095 0.542 1.00 . A A . 49 LYS HG3 1 1 12 12995 1 1 49 LYS HZ1 H 17.721 0.674 4.930 1.00 . A A . 49 LYS HZ1 1 1 12 12996 1 1 49 LYS HZ2 H 16.267 0.377 5.743 1.00 . A A . 49 LYS HZ2 1 1 12 12997 1 1 49 LYS HZ3 H 16.319 1.509 4.488 1.00 . A A . 49 LYS HZ3 1 1 12 12998 1 1 49 LYS N N 13.048 -0.506 0.614 1.00 . A A . 49 LYS N 1 1 12 12999 1 1 49 LYS NZ N 16.691 0.596 4.818 1.00 . A A . 49 LYS NZ 1 1 12 13000 1 1 49 LYS O O 15.977 0.448 -1.102 1.00 . A A . 49 LYS O 1 1 12 13001 1 1 50 ASP C C 13.786 0.338 -3.808 1.00 . A A . 50 ASP C 1 1 12 13002 1 1 50 ASP CA C 14.546 -0.800 -3.135 1.00 . A A . 50 ASP CA 1 1 12 13003 1 1 50 ASP CB C 14.200 -2.134 -3.796 1.00 . A A . 50 ASP CB 1 1 12 13004 1 1 50 ASP CG C 14.916 -2.327 -5.117 1.00 . A A . 50 ASP CG 1 1 12 13005 1 1 50 ASP H H 13.460 -1.359 -1.423 1.00 . A A . 50 ASP H 1 1 12 13006 1 1 50 ASP HA H 15.606 -0.620 -3.237 1.00 . A A . 50 ASP HA 1 1 12 13007 1 1 50 ASP HB2 H 14.476 -2.942 -3.130 1.00 . A A . 50 ASP HB2 1 1 12 13008 1 1 50 ASP HB3 H 13.135 -2.171 -3.976 1.00 . A A . 50 ASP HB3 1 1 12 13009 1 1 50 ASP N N 14.236 -0.842 -1.721 1.00 . A A . 50 ASP N 1 1 12 13010 1 1 50 ASP O O 14.183 0.815 -4.870 1.00 . A A . 50 ASP O 1 1 12 13011 1 1 50 ASP OD1 O 14.448 -1.775 -6.135 1.00 . A A . 50 ASP OD1 1 1 12 13012 1 1 50 ASP OD2 O 15.948 -3.032 -5.135 1.00 . A A . 50 ASP OD2 1 1 12 13013 1 1 51 TYR C C 12.641 3.166 -3.606 1.00 . A A . 51 TYR C 1 1 12 13014 1 1 51 TYR CA C 11.900 1.857 -3.763 1.00 . A A . 51 TYR CA 1 1 12 13015 1 1 51 TYR CB C 10.533 2.024 -3.101 1.00 . A A . 51 TYR CB 1 1 12 13016 1 1 51 TYR CD1 C 9.362 1.606 -5.304 1.00 . A A . 51 TYR CD1 1 1 12 13017 1 1 51 TYR CD2 C 8.270 0.909 -3.302 1.00 . A A . 51 TYR CD2 1 1 12 13018 1 1 51 TYR CE1 C 8.305 1.124 -6.052 1.00 . A A . 51 TYR CE1 1 1 12 13019 1 1 51 TYR CE2 C 7.209 0.427 -4.046 1.00 . A A . 51 TYR CE2 1 1 12 13020 1 1 51 TYR CG C 9.364 1.508 -3.917 1.00 . A A . 51 TYR CG 1 1 12 13021 1 1 51 TYR CZ C 7.206 0.584 -5.412 1.00 . A A . 51 TYR CZ 1 1 12 13022 1 1 51 TYR H H 12.392 0.353 -2.361 1.00 . A A . 51 TYR H 1 1 12 13023 1 1 51 TYR HA H 11.756 1.624 -4.789 1.00 . A A . 51 TYR HA 1 1 12 13024 1 1 51 TYR HB2 H 10.547 1.507 -2.179 1.00 . A A . 51 TYR HB2 1 1 12 13025 1 1 51 TYR HB3 H 10.357 3.074 -2.909 1.00 . A A . 51 TYR HB3 1 1 12 13026 1 1 51 TYR HD1 H 10.204 2.068 -5.801 1.00 . A A . 51 TYR HD1 1 1 12 13027 1 1 51 TYR HD2 H 8.253 0.821 -2.228 1.00 . A A . 51 TYR HD2 1 1 12 13028 1 1 51 TYR HE1 H 8.323 1.208 -7.128 1.00 . A A . 51 TYR HE1 1 1 12 13029 1 1 51 TYR HE2 H 6.367 -0.033 -3.549 1.00 . A A . 51 TYR HE2 1 1 12 13030 1 1 51 TYR HH H 6.513 -0.410 -6.930 1.00 . A A . 51 TYR HH 1 1 12 13031 1 1 51 TYR N N 12.680 0.770 -3.196 1.00 . A A . 51 TYR N 1 1 12 13032 1 1 51 TYR O O 13.098 3.773 -4.575 1.00 . A A . 51 TYR O 1 1 12 13033 1 1 51 TYR OH O 6.177 0.056 -6.162 1.00 . A A . 51 TYR OH 1 1 12 13034 1 1 52 GLU C C 14.902 4.674 -1.868 1.00 . A A . 52 GLU C 1 1 12 13035 1 1 52 GLU CA C 13.392 4.836 -2.010 1.00 . A A . 52 GLU CA 1 1 12 13036 1 1 52 GLU CB C 12.802 5.409 -0.718 1.00 . A A . 52 GLU CB 1 1 12 13037 1 1 52 GLU CD C 12.417 5.110 1.761 1.00 . A A . 52 GLU CD 1 1 12 13038 1 1 52 GLU CG C 13.094 4.570 0.517 1.00 . A A . 52 GLU CG 1 1 12 13039 1 1 52 GLU H H 12.384 3.027 -1.629 1.00 . A A . 52 GLU H 1 1 12 13040 1 1 52 GLU HA H 13.186 5.513 -2.810 1.00 . A A . 52 GLU HA 1 1 12 13041 1 1 52 GLU HB2 H 13.207 6.397 -0.559 1.00 . A A . 52 GLU HB2 1 1 12 13042 1 1 52 GLU HB3 H 11.731 5.484 -0.830 1.00 . A A . 52 GLU HB3 1 1 12 13043 1 1 52 GLU HG2 H 12.746 3.564 0.344 1.00 . A A . 52 GLU HG2 1 1 12 13044 1 1 52 GLU HG3 H 14.161 4.557 0.683 1.00 . A A . 52 GLU HG3 1 1 12 13045 1 1 52 GLU N N 12.748 3.586 -2.349 1.00 . A A . 52 GLU N 1 1 12 13046 1 1 52 GLU O O 15.677 5.427 -2.458 1.00 . A A . 52 GLU O 1 1 12 13047 1 1 52 GLU OE1 O 12.872 6.150 2.280 1.00 . A A . 52 GLU OE1 1 1 12 13048 1 1 52 GLU OE2 O 11.433 4.491 2.217 1.00 . A A . 52 GLU OE2 1 1 12 13049 1 1 53 ASP C C 17.382 2.777 -2.064 1.00 . A A . 53 ASP C 1 1 12 13050 1 1 53 ASP CA C 16.723 3.427 -0.850 1.00 . A A . 53 ASP CA 1 1 12 13051 1 1 53 ASP CB C 16.886 2.537 0.381 1.00 . A A . 53 ASP CB 1 1 12 13052 1 1 53 ASP CG C 17.034 3.341 1.659 1.00 . A A . 53 ASP CG 1 1 12 13053 1 1 53 ASP H H 14.642 3.110 -0.656 1.00 . A A . 53 ASP H 1 1 12 13054 1 1 53 ASP HA H 17.204 4.374 -0.660 1.00 . A A . 53 ASP HA 1 1 12 13055 1 1 53 ASP HB2 H 16.012 1.913 0.477 1.00 . A A . 53 ASP HB2 1 1 12 13056 1 1 53 ASP HB3 H 17.761 1.916 0.261 1.00 . A A . 53 ASP HB3 1 1 12 13057 1 1 53 ASP N N 15.309 3.685 -1.085 1.00 . A A . 53 ASP N 1 1 12 13058 1 1 53 ASP O O 18.596 2.869 -2.242 1.00 . A A . 53 ASP O 1 1 12 13059 1 1 53 ASP OD1 O 15.999 3.682 2.268 1.00 . A A . 53 ASP OD1 1 1 12 13060 1 1 53 ASP OD2 O 18.185 3.628 2.049 1.00 . A A . 53 ASP OD2 1 1 12 13061 1 1 54 GLY C C 17.684 2.479 -5.068 1.00 . A A . 54 GLY C 1 1 12 13062 1 1 54 GLY CA C 17.114 1.479 -4.083 1.00 . A A . 54 GLY CA 1 1 12 13063 1 1 54 GLY H H 15.618 2.081 -2.708 1.00 . A A . 54 GLY H 1 1 12 13064 1 1 54 GLY HA2 H 17.894 0.795 -3.786 1.00 . A A . 54 GLY HA2 1 1 12 13065 1 1 54 GLY HA3 H 16.326 0.923 -4.566 1.00 . A A . 54 GLY HA3 1 1 12 13066 1 1 54 GLY N N 16.578 2.124 -2.898 1.00 . A A . 54 GLY N 1 1 12 13067 1 1 54 GLY O O 18.792 2.300 -5.575 1.00 . A A . 54 GLY O 1 1 12 13068 1 1 55 LEU C C 18.369 5.499 -5.595 1.00 . A A . 55 LEU C 1 1 12 13069 1 1 55 LEU CA C 17.362 4.574 -6.267 1.00 . A A . 55 LEU CA 1 1 12 13070 1 1 55 LEU CB C 16.165 5.384 -6.767 1.00 . A A . 55 LEU CB 1 1 12 13071 1 1 55 LEU CD1 C 14.203 5.582 -8.313 1.00 . A A . 55 LEU CD1 1 1 12 13072 1 1 55 LEU CD2 C 15.955 3.847 -8.735 1.00 . A A . 55 LEU CD2 1 1 12 13073 1 1 55 LEU CG C 15.194 4.624 -7.671 1.00 . A A . 55 LEU CG 1 1 12 13074 1 1 55 LEU H H 16.050 3.619 -4.908 1.00 . A A . 55 LEU H 1 1 12 13075 1 1 55 LEU HA H 17.838 4.091 -7.107 1.00 . A A . 55 LEU HA 1 1 12 13076 1 1 55 LEU HB2 H 15.616 5.744 -5.906 1.00 . A A . 55 LEU HB2 1 1 12 13077 1 1 55 LEU HB3 H 16.539 6.237 -7.315 1.00 . A A . 55 LEU HB3 1 1 12 13078 1 1 55 LEU HD11 H 13.450 5.020 -8.843 1.00 . A A . 55 LEU HD11 1 1 12 13079 1 1 55 LEU HD12 H 14.723 6.227 -9.006 1.00 . A A . 55 LEU HD12 1 1 12 13080 1 1 55 LEU HD13 H 13.734 6.182 -7.547 1.00 . A A . 55 LEU HD13 1 1 12 13081 1 1 55 LEU HD21 H 16.531 3.063 -8.267 1.00 . A A . 55 LEU HD21 1 1 12 13082 1 1 55 LEU HD22 H 16.619 4.515 -9.263 1.00 . A A . 55 LEU HD22 1 1 12 13083 1 1 55 LEU HD23 H 15.254 3.412 -9.433 1.00 . A A . 55 LEU HD23 1 1 12 13084 1 1 55 LEU HG H 14.637 3.917 -7.075 1.00 . A A . 55 LEU HG 1 1 12 13085 1 1 55 LEU N N 16.925 3.535 -5.341 1.00 . A A . 55 LEU N 1 1 12 13086 1 1 55 LEU O O 19.528 5.576 -6.003 1.00 . A A . 55 LEU O 1 1 12 13087 1 1 56 GLU C C 19.597 6.361 -2.792 1.00 . A A . 56 GLU C 1 1 12 13088 1 1 56 GLU CA C 18.775 7.118 -3.826 1.00 . A A . 56 GLU CA 1 1 12 13089 1 1 56 GLU CB C 17.940 8.201 -3.146 1.00 . A A . 56 GLU CB 1 1 12 13090 1 1 56 GLU CD C 16.402 10.185 -3.423 1.00 . A A . 56 GLU CD 1 1 12 13091 1 1 56 GLU CG C 17.209 9.109 -4.122 1.00 . A A . 56 GLU CG 1 1 12 13092 1 1 56 GLU H H 16.980 6.098 -4.289 1.00 . A A . 56 GLU H 1 1 12 13093 1 1 56 GLU HA H 19.443 7.581 -4.529 1.00 . A A . 56 GLU HA 1 1 12 13094 1 1 56 GLU HB2 H 17.209 7.724 -2.518 1.00 . A A . 56 GLU HB2 1 1 12 13095 1 1 56 GLU HB3 H 18.589 8.811 -2.535 1.00 . A A . 56 GLU HB3 1 1 12 13096 1 1 56 GLU HG2 H 17.935 9.584 -4.765 1.00 . A A . 56 GLU HG2 1 1 12 13097 1 1 56 GLU HG3 H 16.539 8.507 -4.720 1.00 . A A . 56 GLU HG3 1 1 12 13098 1 1 56 GLU N N 17.915 6.202 -4.563 1.00 . A A . 56 GLU N 1 1 12 13099 1 1 56 GLU O O 19.496 6.615 -1.591 1.00 . A A . 56 GLU O 1 1 12 13100 1 1 56 GLU OE1 O 15.258 9.896 -3.012 1.00 . A A . 56 GLU OE1 1 1 12 13101 1 1 56 GLU OE2 O 16.913 11.316 -3.287 1.00 . A A . 56 GLU OE2 1 1 12 13102 1 1 57 TYR C C 22.592 5.303 -2.142 1.00 . A A . 57 TYR C 1 1 12 13103 1 1 57 TYR CA C 21.253 4.618 -2.399 1.00 . A A . 57 TYR CA 1 1 12 13104 1 1 57 TYR CB C 21.482 3.242 -3.025 1.00 . A A . 57 TYR CB 1 1 12 13105 1 1 57 TYR CD1 C 23.604 2.226 -2.112 1.00 . A A . 57 TYR CD1 1 1 12 13106 1 1 57 TYR CD2 C 21.520 1.417 -1.282 1.00 . A A . 57 TYR CD2 1 1 12 13107 1 1 57 TYR CE1 C 24.279 1.346 -1.286 1.00 . A A . 57 TYR CE1 1 1 12 13108 1 1 57 TYR CE2 C 22.188 0.534 -0.454 1.00 . A A . 57 TYR CE2 1 1 12 13109 1 1 57 TYR CG C 22.215 2.276 -2.124 1.00 . A A . 57 TYR CG 1 1 12 13110 1 1 57 TYR CZ C 23.565 0.493 -0.470 1.00 . A A . 57 TYR CZ 1 1 12 13111 1 1 57 TYR H H 20.449 5.284 -4.240 1.00 . A A . 57 TYR H 1 1 12 13112 1 1 57 TYR HA H 20.737 4.496 -1.459 1.00 . A A . 57 TYR HA 1 1 12 13113 1 1 57 TYR HB2 H 20.526 2.804 -3.271 1.00 . A A . 57 TYR HB2 1 1 12 13114 1 1 57 TYR HB3 H 22.060 3.358 -3.930 1.00 . A A . 57 TYR HB3 1 1 12 13115 1 1 57 TYR HD1 H 24.158 2.888 -2.759 1.00 . A A . 57 TYR HD1 1 1 12 13116 1 1 57 TYR HD2 H 20.440 1.445 -1.280 1.00 . A A . 57 TYR HD2 1 1 12 13117 1 1 57 TYR HE1 H 25.358 1.321 -1.292 1.00 . A A . 57 TYR HE1 1 1 12 13118 1 1 57 TYR HE2 H 21.629 -0.125 0.194 1.00 . A A . 57 TYR HE2 1 1 12 13119 1 1 57 TYR HH H 23.843 -1.246 0.289 1.00 . A A . 57 TYR HH 1 1 12 13120 1 1 57 TYR N N 20.412 5.429 -3.271 1.00 . A A . 57 TYR N 1 1 12 13121 1 1 57 TYR O O 23.525 5.097 -2.945 1.00 . A A . 57 TYR O 1 1 12 13122 1 1 57 TYR OXT O 22.695 6.041 -1.139 1.00 . A A . 57 TYR OXT 1 1 12 13123 1 1 57 TYR OH O 24.235 -0.373 0.364 1.00 . A A . 57 TYR OH 1 1 12 13124 2 2 1 ALA C C -16.408 -7.896 2.754 1.00 . B B . 1 ALA C 1 1 12 13125 2 2 1 ALA CA C -17.475 -8.379 3.733 1.00 . B B . 1 ALA CA 1 1 12 13126 2 2 1 ALA CB C -16.928 -8.376 5.152 1.00 . B B . 1 ALA CB 1 1 12 13127 2 2 1 ALA H1 H -18.690 -10.047 4.038 1.00 . B B . 1 ALA H1 1 1 12 13128 2 2 1 ALA H2 H -17.168 -10.414 3.395 1.00 . B B . 1 ALA H2 1 1 12 13129 2 2 1 ALA H3 H -18.360 -9.727 2.410 1.00 . B B . 1 ALA H3 1 1 12 13130 2 2 1 ALA HA H -18.314 -7.700 3.696 1.00 . B B . 1 ALA HA 1 1 12 13131 2 2 1 ALA HB1 H -16.677 -7.366 5.439 1.00 . B B . 1 ALA HB1 1 1 12 13132 2 2 1 ALA HB2 H -16.044 -8.994 5.199 1.00 . B B . 1 ALA HB2 1 1 12 13133 2 2 1 ALA HB3 H -17.676 -8.768 5.827 1.00 . B B . 1 ALA HB3 1 1 12 13134 2 2 1 ALA N N -17.957 -9.737 3.369 1.00 . B B . 1 ALA N 1 1 12 13135 2 2 1 ALA O O -15.219 -8.152 2.944 1.00 . B B . 1 ALA O 1 1 12 13136 2 2 2 PRO C C -14.715 -5.924 1.291 1.00 . B B . 2 PRO C 1 1 12 13137 2 2 2 PRO CA C -15.901 -6.667 0.675 1.00 . B B . 2 PRO CA 1 1 12 13138 2 2 2 PRO CB C -16.772 -5.704 -0.131 1.00 . B B . 2 PRO CB 1 1 12 13139 2 2 2 PRO CD C -18.226 -6.831 1.395 1.00 . B B . 2 PRO CD 1 1 12 13140 2 2 2 PRO CG C -18.155 -6.237 0.014 1.00 . B B . 2 PRO CG 1 1 12 13141 2 2 2 PRO HA H -15.538 -7.453 0.031 1.00 . B B . 2 PRO HA 1 1 12 13142 2 2 2 PRO HB2 H -16.686 -4.707 0.276 1.00 . B B . 2 PRO HB2 1 1 12 13143 2 2 2 PRO HB3 H -16.456 -5.706 -1.164 1.00 . B B . 2 PRO HB3 1 1 12 13144 2 2 2 PRO HD2 H -18.595 -6.102 2.100 1.00 . B B . 2 PRO HD2 1 1 12 13145 2 2 2 PRO HD3 H -18.854 -7.710 1.395 1.00 . B B . 2 PRO HD3 1 1 12 13146 2 2 2 PRO HG2 H -18.870 -5.434 -0.086 1.00 . B B . 2 PRO HG2 1 1 12 13147 2 2 2 PRO HG3 H -18.336 -6.997 -0.731 1.00 . B B . 2 PRO HG3 1 1 12 13148 2 2 2 PRO N N -16.823 -7.186 1.690 1.00 . B B . 2 PRO N 1 1 12 13149 2 2 2 PRO O O -14.855 -4.789 1.746 1.00 . B B . 2 PRO O 1 1 12 13150 2 2 3 PRO C C -11.791 -4.811 1.008 1.00 . B B . 3 PRO C 1 1 12 13151 2 2 3 PRO CA C -12.320 -5.951 1.872 1.00 . B B . 3 PRO CA 1 1 12 13152 2 2 3 PRO CB C -11.320 -7.109 1.898 1.00 . B B . 3 PRO CB 1 1 12 13153 2 2 3 PRO CD C -13.277 -7.916 0.791 1.00 . B B . 3 PRO CD 1 1 12 13154 2 2 3 PRO CG C -11.778 -8.026 0.818 1.00 . B B . 3 PRO CG 1 1 12 13155 2 2 3 PRO HA H -12.486 -5.592 2.878 1.00 . B B . 3 PRO HA 1 1 12 13156 2 2 3 PRO HB2 H -10.324 -6.735 1.707 1.00 . B B . 3 PRO HB2 1 1 12 13157 2 2 3 PRO HB3 H -11.350 -7.593 2.863 1.00 . B B . 3 PRO HB3 1 1 12 13158 2 2 3 PRO HD2 H -13.644 -8.016 -0.221 1.00 . B B . 3 PRO HD2 1 1 12 13159 2 2 3 PRO HD3 H -13.722 -8.664 1.430 1.00 . B B . 3 PRO HD3 1 1 12 13160 2 2 3 PRO HG2 H -11.360 -7.713 -0.129 1.00 . B B . 3 PRO HG2 1 1 12 13161 2 2 3 PRO HG3 H -11.480 -9.039 1.045 1.00 . B B . 3 PRO HG3 1 1 12 13162 2 2 3 PRO N N -13.531 -6.559 1.311 1.00 . B B . 3 PRO N 1 1 12 13163 2 2 3 PRO O O -11.578 -4.977 -0.193 1.00 . B B . 3 PRO O 1 1 12 13164 2 2 4 GLY C C -9.686 -2.736 0.358 1.00 . B B . 4 GLY C 1 1 12 13165 2 2 4 GLY CA C -11.082 -2.502 0.896 1.00 . B B . 4 GLY CA 1 1 12 13166 2 2 4 GLY H H -11.770 -3.579 2.584 1.00 . B B . 4 GLY H 1 1 12 13167 2 2 4 GLY HA2 H -11.746 -2.301 0.068 1.00 . B B . 4 GLY HA2 1 1 12 13168 2 2 4 GLY HA3 H -11.067 -1.646 1.552 1.00 . B B . 4 GLY HA3 1 1 12 13169 2 2 4 GLY N N -11.584 -3.652 1.626 1.00 . B B . 4 GLY N 1 1 12 13170 2 2 4 GLY O O -8.700 -2.564 1.075 1.00 . B B . 4 GLY O 1 1 12 13171 2 2 5 THR C C -8.343 -3.207 -3.045 1.00 . B B . 5 THR C 1 1 12 13172 2 2 5 THR CA C -8.314 -3.413 -1.534 1.00 . B B . 5 THR CA 1 1 12 13173 2 2 5 THR CB C -7.857 -4.853 -1.240 1.00 . B B . 5 THR CB 1 1 12 13174 2 2 5 THR CG2 C -7.905 -7.053 0.063 1.00 . B B . 5 THR CG2 1 1 12 13175 2 2 5 THR H H -10.421 -3.196 -1.437 1.00 . B B . 5 THR H 1 1 12 13176 2 2 5 THR HA H -7.589 -2.740 -1.113 1.00 . B B . 5 THR HA 1 1 12 13177 2 2 5 THR HB H -7.795 -4.984 -0.169 1.00 . B B . 5 THR HB 1 1 12 13178 2 2 5 THR HG1 H -6.489 -4.130 0.261 1.00 . B B . 5 THR HG1 1 1 12 13179 2 2 5 THR HG21 H -7.894 -7.294 1.116 1.00 . B B . 5 THR HG21 1 1 12 13180 2 2 5 THR HG22 H -7.703 -7.943 -0.512 1.00 . B B . 5 THR HG22 1 1 12 13181 2 2 5 THR HG23 H -8.875 -6.662 -0.207 1.00 . B B . 5 THR HG23 1 1 12 13182 2 2 5 THR N N -9.602 -3.131 -0.906 1.00 . B B . 5 THR N 1 1 12 13183 2 2 5 THR O O -9.362 -3.432 -3.698 1.00 . B B . 5 THR O 1 1 12 13184 2 2 5 THR OG1 O -7.145 -4.798 0.474 1.00 . B B . 5 THR OG1 1 1 12 13185 2 2 6 ALA C C -5.637 -2.849 -5.484 1.00 . B B . 6 ALA C 1 1 12 13186 2 2 6 ALA CA C -7.069 -2.565 -5.027 1.00 . B B . 6 ALA CA 1 1 12 13187 2 2 6 ALA CB C -7.471 -1.149 -5.389 1.00 . B B . 6 ALA CB 1 1 12 13188 2 2 6 ALA H H -6.447 -2.581 -3.003 1.00 . B B . 6 ALA H 1 1 12 13189 2 2 6 ALA HA H -7.739 -3.246 -5.531 1.00 . B B . 6 ALA HA 1 1 12 13190 2 2 6 ALA HB1 H -8.521 -1.009 -5.186 1.00 . B B . 6 ALA HB1 1 1 12 13191 2 2 6 ALA HB2 H -7.281 -0.977 -6.438 1.00 . B B . 6 ALA HB2 1 1 12 13192 2 2 6 ALA HB3 H -6.896 -0.457 -4.799 1.00 . B B . 6 ALA HB3 1 1 12 13193 2 2 6 ALA N N -7.207 -2.779 -3.589 1.00 . B B . 6 ALA N 1 1 12 13194 2 2 6 ALA O O -5.321 -3.964 -5.900 1.00 . B B . 6 ALA O 1 1 12 13195 2 2 7 ARG C C -2.602 -2.723 -4.709 1.00 . B B . 7 ARG C 1 1 12 13196 2 2 7 ARG CA C -3.377 -1.987 -5.799 1.00 . B B . 7 ARG CA 1 1 12 13197 2 2 7 ARG CB C -2.757 -0.612 -6.064 1.00 . B B . 7 ARG CB 1 1 12 13198 2 2 7 ARG CD C -2.647 -0.857 -8.560 1.00 . B B . 7 ARG CD 1 1 12 13199 2 2 7 ARG CG C -1.860 -0.578 -7.290 1.00 . B B . 7 ARG CG 1 1 12 13200 2 2 7 ARG CZ C -4.707 -0.042 -9.634 1.00 . B B . 7 ARG CZ 1 1 12 13201 2 2 7 ARG H H -5.081 -0.970 -5.077 1.00 . B B . 7 ARG H 1 1 12 13202 2 2 7 ARG HA H -3.348 -2.571 -6.707 1.00 . B B . 7 ARG HA 1 1 12 13203 2 2 7 ARG HB2 H -3.550 0.108 -6.203 1.00 . B B . 7 ARG HB2 1 1 12 13204 2 2 7 ARG HB3 H -2.167 -0.326 -5.206 1.00 . B B . 7 ARG HB3 1 1 12 13205 2 2 7 ARG HD2 H -1.974 -0.820 -9.404 1.00 . B B . 7 ARG HD2 1 1 12 13206 2 2 7 ARG HD3 H -3.083 -1.843 -8.491 1.00 . B B . 7 ARG HD3 1 1 12 13207 2 2 7 ARG HE H -3.690 0.938 -8.227 1.00 . B B . 7 ARG HE 1 1 12 13208 2 2 7 ARG HG2 H -1.406 0.398 -7.367 1.00 . B B . 7 ARG HG2 1 1 12 13209 2 2 7 ARG HG3 H -1.090 -1.328 -7.182 1.00 . B B . 7 ARG HG3 1 1 12 13210 2 2 7 ARG HH11 H -4.069 -1.848 -10.278 1.00 . B B . 7 ARG HH11 1 1 12 13211 2 2 7 ARG HH12 H -5.516 -1.262 -11.028 1.00 . B B . 7 ARG HH12 1 1 12 13212 2 2 7 ARG HH21 H -5.596 1.723 -9.208 1.00 . B B . 7 ARG HH21 1 1 12 13213 2 2 7 ARG HH22 H -6.384 0.768 -10.420 1.00 . B B . 7 ARG HH22 1 1 12 13214 2 2 7 ARG N N -4.774 -1.837 -5.404 1.00 . B B . 7 ARG N 1 1 12 13215 2 2 7 ARG NE N -3.715 0.120 -8.765 1.00 . B B . 7 ARG NE 1 1 12 13216 2 2 7 ARG NH1 N -4.769 -1.140 -10.374 1.00 . B B . 7 ARG NH1 1 1 12 13217 2 2 7 ARG NH2 N -5.639 0.893 -9.765 1.00 . B B . 7 ARG NH2 1 1 12 13218 2 2 7 ARG O O -3.184 -3.497 -3.952 1.00 . B B . 7 ARG O 1 1 12 13219 2 2 8 ARG C C -0.823 -4.617 -3.450 1.00 . B B . 8 ARG C 1 1 12 13220 2 2 8 ARG CA C -0.453 -3.142 -3.617 1.00 . B B . 8 ARG CA 1 1 12 13221 2 2 8 ARG CB C -0.598 -2.411 -2.280 1.00 . B B . 8 ARG CB 1 1 12 13222 2 2 8 ARG CD C -0.843 -3.745 -0.170 1.00 . B B . 8 ARG CD 1 1 12 13223 2 2 8 ARG CG C 0.131 -3.077 -1.126 1.00 . B B . 8 ARG CG 1 1 12 13224 2 2 8 ARG CZ C -1.414 -6.022 0.571 1.00 . B B . 8 ARG CZ 1 1 12 13225 2 2 8 ARG H H -0.869 -1.856 -5.246 1.00 . B B . 8 ARG H 1 1 12 13226 2 2 8 ARG HA H 0.574 -3.076 -3.942 1.00 . B B . 8 ARG HA 1 1 12 13227 2 2 8 ARG HB2 H -0.212 -1.410 -2.388 1.00 . B B . 8 ARG HB2 1 1 12 13228 2 2 8 ARG HB3 H -1.646 -2.355 -2.029 1.00 . B B . 8 ARG HB3 1 1 12 13229 2 2 8 ARG HD2 H -0.731 -3.301 0.808 1.00 . B B . 8 ARG HD2 1 1 12 13230 2 2 8 ARG HD3 H -1.850 -3.578 -0.528 1.00 . B B . 8 ARG HD3 1 1 12 13231 2 2 8 ARG HE H 0.191 -5.544 -0.512 1.00 . B B . 8 ARG HE 1 1 12 13232 2 2 8 ARG HG2 H 0.805 -3.823 -1.519 1.00 . B B . 8 ARG HG2 1 1 12 13233 2 2 8 ARG HG3 H 0.694 -2.328 -0.587 1.00 . B B . 8 ARG HG3 1 1 12 13234 2 2 8 ARG HH11 H -2.693 -4.587 1.184 1.00 . B B . 8 ARG HH11 1 1 12 13235 2 2 8 ARG HH12 H -3.096 -6.197 1.676 1.00 . B B . 8 ARG HH12 1 1 12 13236 2 2 8 ARG HH21 H -0.332 -7.668 0.122 1.00 . B B . 8 ARG HH21 1 1 12 13237 2 2 8 ARG HH22 H -1.752 -7.950 1.073 1.00 . B B . 8 ARG HH22 1 1 12 13238 2 2 8 ARG N N -1.287 -2.490 -4.627 1.00 . B B . 8 ARG N 1 1 12 13239 2 2 8 ARG NE N -0.606 -5.184 -0.069 1.00 . B B . 8 ARG NE 1 1 12 13240 2 2 8 ARG NH1 N -2.490 -5.564 1.195 1.00 . B B . 8 ARG NH1 1 1 12 13241 2 2 8 ARG NH2 N -1.144 -7.320 0.590 1.00 . B B . 8 ARG NH2 1 1 12 13242 2 2 8 ARG O O -1.419 -5.003 -2.446 1.00 . B B . 8 ARG O 1 1 12 13243 2 2 9 LYS C C 0.254 -7.716 -5.082 1.00 . B B . 9 LYS C 1 1 12 13244 2 2 9 LYS CA C -0.796 -6.859 -4.369 1.00 . B B . 9 LYS CA 1 1 12 13245 2 2 9 LYS CB C -2.180 -7.123 -4.967 1.00 . B B . 9 LYS CB 1 1 12 13246 2 2 9 LYS CD C -2.961 -8.739 -3.212 1.00 . B B . 9 LYS CD 1 1 12 13247 2 2 9 LYS CE C -3.522 -10.124 -2.938 1.00 . B B . 9 LYS CE 1 1 12 13248 2 2 9 LYS CG C -2.708 -8.522 -4.694 1.00 . B B . 9 LYS CG 1 1 12 13249 2 2 9 LYS H H -0.032 -5.072 -5.233 1.00 . B B . 9 LYS H 1 1 12 13250 2 2 9 LYS HA H -0.818 -7.137 -3.325 1.00 . B B . 9 LYS HA 1 1 12 13251 2 2 9 LYS HB2 H -2.877 -6.414 -4.546 1.00 . B B . 9 LYS HB2 1 1 12 13252 2 2 9 LYS HB3 H -2.134 -6.981 -6.035 1.00 . B B . 9 LYS HB3 1 1 12 13253 2 2 9 LYS HD2 H -2.031 -8.625 -2.678 1.00 . B B . 9 LYS HD2 1 1 12 13254 2 2 9 LYS HD3 H -3.669 -7.999 -2.867 1.00 . B B . 9 LYS HD3 1 1 12 13255 2 2 9 LYS HE2 H -2.838 -10.861 -3.333 1.00 . B B . 9 LYS HE2 1 1 12 13256 2 2 9 LYS HE3 H -3.614 -10.256 -1.870 1.00 . B B . 9 LYS HE3 1 1 12 13257 2 2 9 LYS HG2 H -3.634 -8.658 -5.232 1.00 . B B . 9 LYS HG2 1 1 12 13258 2 2 9 LYS HG3 H -1.981 -9.243 -5.036 1.00 . B B . 9 LYS HG3 1 1 12 13259 2 2 9 LYS HZ1 H -5.522 -9.595 -3.226 1.00 . B B . 9 LYS HZ1 1 1 12 13260 2 2 9 LYS HZ2 H -5.232 -11.259 -3.330 1.00 . B B . 9 LYS HZ2 1 1 12 13261 2 2 9 LYS HZ3 H -4.780 -10.240 -4.602 1.00 . B B . 9 LYS HZ3 1 1 12 13262 2 2 9 LYS N N -0.484 -5.434 -4.440 1.00 . B B . 9 LYS N 1 1 12 13263 2 2 9 LYS NZ N -4.857 -10.318 -3.568 1.00 . B B . 9 LYS NZ 1 1 12 13264 2 2 9 LYS O O -0.086 -8.571 -5.900 1.00 . B B . 9 LYS O 1 1 12 13265 2 2 10 ARG C C 3.343 -9.067 -4.306 1.00 . B B . 10 ARG C 1 1 12 13266 2 2 10 ARG CA C 2.614 -8.259 -5.377 1.00 . B B . 10 ARG CA 1 1 12 13267 2 2 10 ARG CB C 3.601 -7.342 -6.103 1.00 . B B . 10 ARG CB 1 1 12 13268 2 2 10 ARG CD C 5.371 -5.567 -5.950 1.00 . B B . 10 ARG CD 1 1 12 13269 2 2 10 ARG CG C 4.405 -6.447 -5.174 1.00 . B B . 10 ARG CG 1 1 12 13270 2 2 10 ARG CZ C 7.425 -5.821 -7.277 1.00 . B B . 10 ARG CZ 1 1 12 13271 2 2 10 ARG H H 1.755 -6.773 -4.139 1.00 . B B . 10 ARG H 1 1 12 13272 2 2 10 ARG HA H 2.175 -8.941 -6.090 1.00 . B B . 10 ARG HA 1 1 12 13273 2 2 10 ARG HB2 H 4.292 -7.952 -6.666 1.00 . B B . 10 ARG HB2 1 1 12 13274 2 2 10 ARG HB3 H 3.051 -6.712 -6.787 1.00 . B B . 10 ARG HB3 1 1 12 13275 2 2 10 ARG HD2 H 4.809 -4.975 -6.658 1.00 . B B . 10 ARG HD2 1 1 12 13276 2 2 10 ARG HD3 H 5.878 -4.913 -5.258 1.00 . B B . 10 ARG HD3 1 1 12 13277 2 2 10 ARG HE H 6.233 -7.322 -6.722 1.00 . B B . 10 ARG HE 1 1 12 13278 2 2 10 ARG HG2 H 3.726 -5.817 -4.620 1.00 . B B . 10 ARG HG2 1 1 12 13279 2 2 10 ARG HG3 H 4.965 -7.066 -4.488 1.00 . B B . 10 ARG HG3 1 1 12 13280 2 2 10 ARG HH11 H 6.989 -3.923 -6.738 1.00 . B B . 10 ARG HH11 1 1 12 13281 2 2 10 ARG HH12 H 8.430 -4.114 -7.680 1.00 . B B . 10 ARG HH12 1 1 12 13282 2 2 10 ARG HH21 H 8.130 -7.587 -7.962 1.00 . B B . 10 ARG HH21 1 1 12 13283 2 2 10 ARG HH22 H 9.079 -6.198 -8.376 1.00 . B B . 10 ARG HH22 1 1 12 13284 2 2 10 ARG N N 1.532 -7.483 -4.775 1.00 . B B . 10 ARG N 1 1 12 13285 2 2 10 ARG NE N 6.365 -6.352 -6.678 1.00 . B B . 10 ARG NE 1 1 12 13286 2 2 10 ARG NH1 N 7.631 -4.512 -7.228 1.00 . B B . 10 ARG NH1 1 1 12 13287 2 2 10 ARG NH2 N 8.282 -6.600 -7.924 1.00 . B B . 10 ARG NH2 1 1 12 13288 2 2 10 ARG O O 3.943 -10.101 -4.596 1.00 . B B . 10 ARG O 1 1 12 13289 2 2 11 LYS C C 5.361 -9.636 -2.266 1.00 . B B . 11 LYS C 1 1 12 13290 2 2 11 LYS CA C 3.920 -9.260 -1.947 1.00 . B B . 11 LYS CA 1 1 12 13291 2 2 11 LYS CB C 3.138 -10.515 -1.564 1.00 . B B . 11 LYS CB 1 1 12 13292 2 2 11 LYS CD C 3.667 -6.238 -0.695 1.00 . B B . 11 LYS CD 1 1 12 13293 2 2 11 LYS CE C 3.825 -4.767 -1.036 1.00 . B B . 11 LYS CE 1 1 12 13294 2 2 11 LYS CG C 4.284 -7.122 -1.767 1.00 . B B . 11 LYS CG 1 1 12 13295 2 2 11 LYS H H 2.801 -7.753 -2.902 1.00 . B B . 11 LYS H 1 1 12 13296 2 2 11 LYS HA H 3.917 -8.580 -1.109 1.00 . B B . 11 LYS HA 1 1 12 13297 2 2 11 LYS HB2 H 3.349 -11.290 -2.284 1.00 . B B . 11 LYS HB2 1 1 12 13298 2 2 11 LYS HB3 H 3.470 -10.843 -0.589 1.00 . B B . 11 LYS HB3 1 1 12 13299 2 2 11 LYS HD2 H 2.616 -6.465 -0.615 1.00 . B B . 11 LYS HD2 1 1 12 13300 2 2 11 LYS HD3 H 4.156 -6.435 0.248 1.00 . B B . 11 LYS HD3 1 1 12 13301 2 2 11 LYS HE2 H 3.202 -4.186 -0.372 1.00 . B B . 11 LYS HE2 1 1 12 13302 2 2 11 LYS HE3 H 3.506 -4.611 -2.057 1.00 . B B . 11 LYS HE3 1 1 12 13303 2 2 11 LYS HG2 H 5.156 -6.627 -2.169 1.00 . B B . 11 LYS HG2 1 1 12 13304 2 2 11 LYS HG3 H 3.561 -7.273 -2.554 1.00 . B B . 11 LYS HG3 1 1 12 13305 2 2 11 LYS HZ1 H -1.600 -12.346 -2.683 1.00 . B B . 11 LYS HZ1 1 1 12 13306 2 2 11 LYS HZ2 H -0.147 -12.390 -1.816 1.00 . B B . 11 LYS HZ2 1 1 12 13307 2 2 11 LYS HZ3 H -0.137 -12.609 -3.494 1.00 . B B . 11 LYS HZ3 1 1 12 13308 2 2 11 LYS N N 3.284 -8.587 -3.068 1.00 . B B . 11 LYS N 1 1 12 13309 2 2 11 LYS NZ N -0.591 -12.096 -2.710 1.00 . B B . 11 LYS NZ 1 1 12 13310 2 2 11 LYS O O 5.658 -10.791 -2.573 1.00 . B B . 11 LYS O 1 1 12 13311 2 2 12 ALA C C 8.290 -9.639 -1.286 1.00 . B B . 12 ALA C 1 1 12 13312 2 2 12 ALA CA C 7.663 -8.891 -2.453 1.00 . B B . 12 ALA CA 1 1 12 13313 2 2 12 ALA CB C 8.386 -7.575 -2.683 1.00 . B B . 12 ALA CB 1 1 12 13314 2 2 12 ALA H H 5.952 -7.752 -1.958 1.00 . B B . 12 ALA H 1 1 12 13315 2 2 12 ALA HA H 7.749 -9.490 -3.348 1.00 . B B . 12 ALA HA 1 1 12 13316 2 2 12 ALA HB1 H 7.896 -7.028 -3.474 1.00 . B B . 12 ALA HB1 1 1 12 13317 2 2 12 ALA HB2 H 9.412 -7.771 -2.958 1.00 . B B . 12 ALA HB2 1 1 12 13318 2 2 12 ALA HB3 H 8.362 -6.994 -1.773 1.00 . B B . 12 ALA HB3 1 1 12 13319 2 2 12 ALA N N 6.251 -8.655 -2.193 1.00 . B B . 12 ALA N 1 1 12 13320 2 2 12 ALA O O 9.257 -10.383 -1.452 1.00 . B B . 12 ALA O 1 1 12 13321 2 2 13 ASP C C 7.191 -11.097 1.611 1.00 . B B . 13 ASP C 1 1 12 13322 2 2 13 ASP CA C 8.211 -10.078 1.108 1.00 . B B . 13 ASP CA 1 1 12 13323 2 2 13 ASP CB C 8.498 -9.029 2.185 1.00 . B B . 13 ASP CB 1 1 12 13324 2 2 13 ASP CG C 8.982 -9.646 3.484 1.00 . B B . 13 ASP CG 1 1 12 13325 2 2 13 ASP H H 6.964 -8.817 -0.037 1.00 . B B . 13 ASP H 1 1 12 13326 2 2 13 ASP HA H 9.128 -10.593 0.863 1.00 . B B . 13 ASP HA 1 1 12 13327 2 2 13 ASP HB2 H 9.264 -8.358 1.825 1.00 . B B . 13 ASP HB2 1 1 12 13328 2 2 13 ASP HB3 H 7.596 -8.462 2.387 1.00 . B B . 13 ASP HB3 1 1 12 13329 2 2 13 ASP N N 7.727 -9.430 -0.100 1.00 . B B . 13 ASP N 1 1 12 13330 2 2 13 ASP O O 6.923 -11.192 2.808 1.00 . B B . 13 ASP O 1 1 12 13331 2 2 13 ASP OD1 O 10.190 -9.944 3.586 1.00 . B B . 13 ASP OD1 1 1 12 13332 2 2 13 ASP OD2 O 8.152 -9.831 4.399 1.00 . B B . 13 ASP OD2 1 1 12 13333 2 2 14 SER C C 6.194 -13.859 2.036 1.00 . B B . 14 SER C 1 1 12 13334 2 2 14 SER CA C 5.632 -12.870 1.020 1.00 . B B . 14 SER CA 1 1 12 13335 2 2 14 SER CB C 5.187 -13.612 -0.240 1.00 . B B . 14 SER CB 1 1 12 13336 2 2 14 SER H H 6.872 -11.729 -0.258 1.00 . B B . 14 SER H 1 1 12 13337 2 2 14 SER HA H 4.779 -12.371 1.454 1.00 . B B . 14 SER HA 1 1 12 13338 2 2 14 SER HB2 H 6.049 -14.057 -0.713 1.00 . B B . 14 SER HB2 1 1 12 13339 2 2 14 SER HB3 H 4.485 -14.386 0.029 1.00 . B B . 14 SER HB3 1 1 12 13340 2 2 14 SER HG H 5.170 -12.017 -1.375 1.00 . B B . 14 SER HG 1 1 12 13341 2 2 14 SER N N 6.621 -11.855 0.681 1.00 . B B . 14 SER N 1 1 12 13342 2 2 14 SER O O 6.044 -13.607 3.250 1.00 . B B . 14 SER O 1 1 12 13343 2 2 14 SER OXT O 6.780 -14.876 1.609 1.00 . B B . 14 SER OXT 1 1 12 13344 2 2 14 SER OG O 4.567 -12.734 -1.161 1.00 . B B . 14 SER OG 1 1 13 13345 1 1 1 GLY C C 11.044 4.802 -5.775 1.00 . A A . 1 GLY C 1 1 13 13346 1 1 1 GLY CA C 10.414 3.595 -6.450 1.00 . A A . 1 GLY CA 1 1 13 13347 1 1 1 GLY H1 H 8.521 4.452 -6.668 1.00 . A A . 1 GLY H1 1 1 13 13348 1 1 1 GLY H2 H 8.664 3.449 -5.313 1.00 . A A . 1 GLY H2 1 1 13 13349 1 1 1 GLY H3 H 8.538 2.770 -6.856 1.00 . A A . 1 GLY H3 1 1 13 13350 1 1 1 GLY HA2 H 10.825 2.696 -6.010 1.00 . A A . 1 GLY HA2 1 1 13 13351 1 1 1 GLY HA3 H 10.665 3.615 -7.499 1.00 . A A . 1 GLY HA3 1 1 13 13352 1 1 1 GLY N N 8.931 3.565 -6.312 1.00 . A A . 1 GLY N 1 1 13 13353 1 1 1 GLY O O 12.049 5.328 -6.250 1.00 . A A . 1 GLY O 1 1 13 13354 1 1 2 SER C C 10.114 6.669 -2.696 1.00 . A A . 2 SER C 1 1 13 13355 1 1 2 SER CA C 10.964 6.391 -3.926 1.00 . A A . 2 SER CA 1 1 13 13356 1 1 2 SER CB C 11.007 7.621 -4.828 1.00 . A A . 2 SER CB 1 1 13 13357 1 1 2 SER H H 9.661 4.770 -4.329 1.00 . A A . 2 SER H 1 1 13 13358 1 1 2 SER HA H 11.964 6.163 -3.598 1.00 . A A . 2 SER HA 1 1 13 13359 1 1 2 SER HB2 H 11.472 8.436 -4.296 1.00 . A A . 2 SER HB2 1 1 13 13360 1 1 2 SER HB3 H 11.583 7.392 -5.711 1.00 . A A . 2 SER HB3 1 1 13 13361 1 1 2 SER HG H 9.502 7.641 -6.081 1.00 . A A . 2 SER HG 1 1 13 13362 1 1 2 SER N N 10.455 5.237 -4.663 1.00 . A A . 2 SER N 1 1 13 13363 1 1 2 SER O O 10.626 7.097 -1.661 1.00 . A A . 2 SER O 1 1 13 13364 1 1 2 SER OG O 9.703 8.015 -5.221 1.00 . A A . 2 SER OG 1 1 13 13365 1 1 3 GLN C C 7.850 5.363 -0.857 1.00 . A A . 3 GLN C 1 1 13 13366 1 1 3 GLN CA C 7.915 6.628 -1.698 1.00 . A A . 3 GLN CA 1 1 13 13367 1 1 3 GLN CB C 6.528 7.019 -2.216 1.00 . A A . 3 GLN CB 1 1 13 13368 1 1 3 GLN CD C 6.210 5.253 -3.999 1.00 . A A . 3 GLN CD 1 1 13 13369 1 1 3 GLN CG C 5.686 5.849 -2.708 1.00 . A A . 3 GLN CG 1 1 13 13370 1 1 3 GLN H H 8.453 6.125 -3.664 1.00 . A A . 3 GLN H 1 1 13 13371 1 1 3 GLN HA H 8.309 7.429 -1.092 1.00 . A A . 3 GLN HA 1 1 13 13372 1 1 3 GLN HB2 H 5.987 7.520 -1.428 1.00 . A A . 3 GLN HB2 1 1 13 13373 1 1 3 GLN HB3 H 6.661 7.702 -3.042 1.00 . A A . 3 GLN HB3 1 1 13 13374 1 1 3 GLN HE21 H 5.073 6.492 -5.059 1.00 . A A . 3 GLN HE21 1 1 13 13375 1 1 3 GLN HE22 H 6.049 5.401 -5.975 1.00 . A A . 3 GLN HE22 1 1 13 13376 1 1 3 GLN HG2 H 5.684 5.081 -1.950 1.00 . A A . 3 GLN HG2 1 1 13 13377 1 1 3 GLN HG3 H 4.676 6.194 -2.872 1.00 . A A . 3 GLN HG3 1 1 13 13378 1 1 3 GLN N N 8.816 6.425 -2.809 1.00 . A A . 3 GLN N 1 1 13 13379 1 1 3 GLN NE2 N 5.728 5.767 -5.125 1.00 . A A . 3 GLN NE2 1 1 13 13380 1 1 3 GLN O O 7.845 4.254 -1.389 1.00 . A A . 3 GLN O 1 1 13 13381 1 1 3 GLN OE1 O 7.036 4.341 -3.986 1.00 . A A . 3 GLN OE1 1 1 13 13382 1 1 4 VAL C C 6.328 3.966 1.606 1.00 . A A . 4 VAL C 1 1 13 13383 1 1 4 VAL CA C 7.761 4.398 1.356 1.00 . A A . 4 VAL CA 1 1 13 13384 1 1 4 VAL CB C 8.437 4.711 2.708 1.00 . A A . 4 VAL CB 1 1 13 13385 1 1 4 VAL CG1 C 8.967 3.436 3.345 1.00 . A A . 4 VAL CG1 1 1 13 13386 1 1 4 VAL CG2 C 9.554 5.734 2.542 1.00 . A A . 4 VAL CG2 1 1 13 13387 1 1 4 VAL H H 7.780 6.437 0.819 1.00 . A A . 4 VAL H 1 1 13 13388 1 1 4 VAL HA H 8.295 3.583 0.889 1.00 . A A . 4 VAL HA 1 1 13 13389 1 1 4 VAL HB H 7.693 5.128 3.367 1.00 . A A . 4 VAL HB 1 1 13 13390 1 1 4 VAL HG11 H 8.174 2.708 3.403 1.00 . A A . 4 VAL HG11 1 1 13 13391 1 1 4 VAL HG12 H 9.327 3.653 4.339 1.00 . A A . 4 VAL HG12 1 1 13 13392 1 1 4 VAL HG13 H 9.775 3.044 2.746 1.00 . A A . 4 VAL HG13 1 1 13 13393 1 1 4 VAL HG21 H 9.127 6.697 2.302 1.00 . A A . 4 VAL HG21 1 1 13 13394 1 1 4 VAL HG22 H 10.209 5.423 1.742 1.00 . A A . 4 VAL HG22 1 1 13 13395 1 1 4 VAL HG23 H 10.116 5.806 3.461 1.00 . A A . 4 VAL HG23 1 1 13 13396 1 1 4 VAL N N 7.799 5.533 0.453 1.00 . A A . 4 VAL N 1 1 13 13397 1 1 4 VAL O O 5.878 3.896 2.749 1.00 . A A . 4 VAL O 1 1 13 13398 1 1 5 PHE C C 3.588 3.102 -0.766 1.00 . A A . 5 PHE C 1 1 13 13399 1 1 5 PHE CA C 4.229 3.235 0.622 1.00 . A A . 5 PHE CA 1 1 13 13400 1 1 5 PHE CB C 3.432 4.224 1.473 1.00 . A A . 5 PHE CB 1 1 13 13401 1 1 5 PHE CD1 C 3.083 6.188 -0.051 1.00 . A A . 5 PHE CD1 1 1 13 13402 1 1 5 PHE CD2 C 4.443 6.484 1.886 1.00 . A A . 5 PHE CD2 1 1 13 13403 1 1 5 PHE CE1 C 3.288 7.509 -0.402 1.00 . A A . 5 PHE CE1 1 1 13 13404 1 1 5 PHE CE2 C 4.652 7.807 1.540 1.00 . A A . 5 PHE CE2 1 1 13 13405 1 1 5 PHE CG C 3.658 5.661 1.095 1.00 . A A . 5 PHE CG 1 1 13 13406 1 1 5 PHE CZ C 4.074 8.320 0.395 1.00 . A A . 5 PHE CZ 1 1 13 13407 1 1 5 PHE H H 6.026 3.763 -0.362 1.00 . A A . 5 PHE H 1 1 13 13408 1 1 5 PHE HA H 4.227 2.262 1.113 1.00 . A A . 5 PHE HA 1 1 13 13409 1 1 5 PHE HB2 H 2.384 4.016 1.364 1.00 . A A . 5 PHE HB2 1 1 13 13410 1 1 5 PHE HB3 H 3.712 4.105 2.510 1.00 . A A . 5 PHE HB3 1 1 13 13411 1 1 5 PHE HD1 H 2.470 5.555 -0.676 1.00 . A A . 5 PHE HD1 1 1 13 13412 1 1 5 PHE HD2 H 4.896 6.085 2.781 1.00 . A A . 5 PHE HD2 1 1 13 13413 1 1 5 PHE HE1 H 2.836 7.908 -1.298 1.00 . A A . 5 PHE HE1 1 1 13 13414 1 1 5 PHE HE2 H 5.266 8.438 2.166 1.00 . A A . 5 PHE HE2 1 1 13 13415 1 1 5 PHE HZ H 4.235 9.352 0.124 1.00 . A A . 5 PHE HZ 1 1 13 13416 1 1 5 PHE N N 5.612 3.678 0.522 1.00 . A A . 5 PHE N 1 1 13 13417 1 1 5 PHE O O 4.162 3.520 -1.771 1.00 . A A . 5 PHE O 1 1 13 13418 1 1 6 GLU C C 0.155 2.316 -1.729 1.00 . A A . 6 GLU C 1 1 13 13419 1 1 6 GLU CA C 1.645 2.315 -2.034 1.00 . A A . 6 GLU CA 1 1 13 13420 1 1 6 GLU CB C 2.033 1.001 -2.701 1.00 . A A . 6 GLU CB 1 1 13 13421 1 1 6 GLU CD C 3.593 -0.177 -4.299 1.00 . A A . 6 GLU CD 1 1 13 13422 1 1 6 GLU CG C 3.211 1.136 -3.642 1.00 . A A . 6 GLU CG 1 1 13 13423 1 1 6 GLU H H 1.996 2.214 0.031 1.00 . A A . 6 GLU H 1 1 13 13424 1 1 6 GLU HA H 1.869 3.135 -2.699 1.00 . A A . 6 GLU HA 1 1 13 13425 1 1 6 GLU HB2 H 2.280 0.275 -1.937 1.00 . A A . 6 GLU HB2 1 1 13 13426 1 1 6 GLU HB3 H 1.189 0.643 -3.266 1.00 . A A . 6 GLU HB3 1 1 13 13427 1 1 6 GLU HG2 H 2.950 1.846 -4.413 1.00 . A A . 6 GLU HG2 1 1 13 13428 1 1 6 GLU HG3 H 4.057 1.507 -3.084 1.00 . A A . 6 GLU HG3 1 1 13 13429 1 1 6 GLU N N 2.395 2.513 -0.801 1.00 . A A . 6 GLU N 1 1 13 13430 1 1 6 GLU O O -0.262 1.837 -0.676 1.00 . A A . 6 GLU O 1 1 13 13431 1 1 6 GLU OE1 O 2.877 -0.607 -5.227 1.00 . A A . 6 GLU OE1 1 1 13 13432 1 1 6 GLU OE2 O 4.608 -0.774 -3.884 1.00 . A A . 6 GLU OE2 1 1 13 13433 1 1 7 TYR C C -2.812 1.669 -2.931 1.00 . A A . 7 TYR C 1 1 13 13434 1 1 7 TYR CA C -2.075 2.901 -2.424 1.00 . A A . 7 TYR CA 1 1 13 13435 1 1 7 TYR CB C -2.643 4.158 -3.070 1.00 . A A . 7 TYR CB 1 1 13 13436 1 1 7 TYR CD1 C -1.550 4.461 -5.326 1.00 . A A . 7 TYR CD1 1 1 13 13437 1 1 7 TYR CD2 C -3.813 3.713 -5.263 1.00 . A A . 7 TYR CD2 1 1 13 13438 1 1 7 TYR CE1 C -1.570 4.420 -6.707 1.00 . A A . 7 TYR CE1 1 1 13 13439 1 1 7 TYR CE2 C -3.840 3.668 -6.645 1.00 . A A . 7 TYR CE2 1 1 13 13440 1 1 7 TYR CG C -2.669 4.108 -4.582 1.00 . A A . 7 TYR CG 1 1 13 13441 1 1 7 TYR CZ C -2.717 4.023 -7.361 1.00 . A A . 7 TYR CZ 1 1 13 13442 1 1 7 TYR H H -0.281 3.193 -3.475 1.00 . A A . 7 TYR H 1 1 13 13443 1 1 7 TYR HA H -2.224 2.961 -1.366 1.00 . A A . 7 TYR HA 1 1 13 13444 1 1 7 TYR HB2 H -3.649 4.299 -2.724 1.00 . A A . 7 TYR HB2 1 1 13 13445 1 1 7 TYR HB3 H -2.045 5.007 -2.775 1.00 . A A . 7 TYR HB3 1 1 13 13446 1 1 7 TYR HD1 H -0.653 4.772 -4.810 1.00 . A A . 7 TYR HD1 1 1 13 13447 1 1 7 TYR HD2 H -4.690 3.435 -4.699 1.00 . A A . 7 TYR HD2 1 1 13 13448 1 1 7 TYR HE1 H -0.690 4.698 -7.269 1.00 . A A . 7 TYR HE1 1 1 13 13449 1 1 7 TYR HE2 H -4.739 3.356 -7.157 1.00 . A A . 7 TYR HE2 1 1 13 13450 1 1 7 TYR HH H -1.916 3.610 -9.059 1.00 . A A . 7 TYR HH 1 1 13 13451 1 1 7 TYR N N -0.650 2.835 -2.646 1.00 . A A . 7 TYR N 1 1 13 13452 1 1 7 TYR O O -2.926 1.443 -4.136 1.00 . A A . 7 TYR O 1 1 13 13453 1 1 7 TYR OH O -2.741 3.980 -8.736 1.00 . A A . 7 TYR OH 1 1 13 13454 1 1 8 ALA C C -5.557 0.036 -2.324 1.00 . A A . 8 ALA C 1 1 13 13455 1 1 8 ALA CA C -4.077 -0.319 -2.302 1.00 . A A . 8 ALA CA 1 1 13 13456 1 1 8 ALA CB C -3.809 -1.401 -1.266 1.00 . A A . 8 ALA CB 1 1 13 13457 1 1 8 ALA H H -3.153 1.104 -1.042 1.00 . A A . 8 ALA H 1 1 13 13458 1 1 8 ALA HA H -3.773 -0.679 -3.275 1.00 . A A . 8 ALA HA 1 1 13 13459 1 1 8 ALA HB1 H -2.764 -1.400 -1.001 1.00 . A A . 8 ALA HB1 1 1 13 13460 1 1 8 ALA HB2 H -4.079 -2.365 -1.672 1.00 . A A . 8 ALA HB2 1 1 13 13461 1 1 8 ALA HB3 H -4.400 -1.205 -0.382 1.00 . A A . 8 ALA HB3 1 1 13 13462 1 1 8 ALA N N -3.310 0.877 -1.986 1.00 . A A . 8 ALA N 1 1 13 13463 1 1 8 ALA O O -6.370 -0.609 -1.664 1.00 . A A . 8 ALA O 1 1 13 13464 1 1 9 GLU C C -7.881 1.380 -4.526 1.00 . A A . 9 GLU C 1 1 13 13465 1 1 9 GLU CA C -7.261 1.548 -3.162 1.00 . A A . 9 GLU CA 1 1 13 13466 1 1 9 GLU CB C -7.257 3.009 -2.693 1.00 . A A . 9 GLU CB 1 1 13 13467 1 1 9 GLU CD C -7.410 4.223 -4.915 1.00 . A A . 9 GLU CD 1 1 13 13468 1 1 9 GLU CG C -8.028 4.009 -3.545 1.00 . A A . 9 GLU CG 1 1 13 13469 1 1 9 GLU H H -5.216 1.527 -3.614 1.00 . A A . 9 GLU H 1 1 13 13470 1 1 9 GLU HA H -7.851 0.973 -2.484 1.00 . A A . 9 GLU HA 1 1 13 13471 1 1 9 GLU HB2 H -7.671 3.046 -1.700 1.00 . A A . 9 GLU HB2 1 1 13 13472 1 1 9 GLU HB3 H -6.230 3.338 -2.647 1.00 . A A . 9 GLU HB3 1 1 13 13473 1 1 9 GLU HG2 H -9.030 3.651 -3.665 1.00 . A A . 9 GLU HG2 1 1 13 13474 1 1 9 GLU HG3 H -8.047 4.952 -3.029 1.00 . A A . 9 GLU HG3 1 1 13 13475 1 1 9 GLU N N -5.899 1.067 -3.091 1.00 . A A . 9 GLU N 1 1 13 13476 1 1 9 GLU O O -7.203 1.260 -5.546 1.00 . A A . 9 GLU O 1 1 13 13477 1 1 9 GLU OE1 O -6.397 4.947 -5.003 1.00 . A A . 9 GLU OE1 1 1 13 13478 1 1 9 GLU OE2 O -7.940 3.669 -5.901 1.00 . A A . 9 GLU OE2 1 1 13 13479 1 1 10 VAL C C -10.364 2.606 -6.245 1.00 . A A . 10 VAL C 1 1 13 13480 1 1 10 VAL CA C -9.982 1.241 -5.692 1.00 . A A . 10 VAL CA 1 1 13 13481 1 1 10 VAL CB C -11.213 0.382 -5.425 1.00 . A A . 10 VAL CB 1 1 13 13482 1 1 10 VAL CG1 C -12.021 0.195 -6.700 1.00 . A A . 10 VAL CG1 1 1 13 13483 1 1 10 VAL CG2 C -10.781 -0.959 -4.846 1.00 . A A . 10 VAL CG2 1 1 13 13484 1 1 10 VAL H H -9.659 1.475 -3.641 1.00 . A A . 10 VAL H 1 1 13 13485 1 1 10 VAL HA H -9.386 0.742 -6.401 1.00 . A A . 10 VAL HA 1 1 13 13486 1 1 10 VAL HB H -11.813 0.882 -4.695 1.00 . A A . 10 VAL HB 1 1 13 13487 1 1 10 VAL HG11 H -13.074 0.223 -6.472 1.00 . A A . 10 VAL HG11 1 1 13 13488 1 1 10 VAL HG12 H -11.775 -0.759 -7.144 1.00 . A A . 10 VAL HG12 1 1 13 13489 1 1 10 VAL HG13 H -11.780 0.985 -7.395 1.00 . A A . 10 VAL HG13 1 1 13 13490 1 1 10 VAL HG21 H -11.646 -1.508 -4.517 1.00 . A A . 10 VAL HG21 1 1 13 13491 1 1 10 VAL HG22 H -10.122 -0.790 -4.005 1.00 . A A . 10 VAL HG22 1 1 13 13492 1 1 10 VAL HG23 H -10.260 -1.527 -5.601 1.00 . A A . 10 VAL HG23 1 1 13 13493 1 1 10 VAL N N -9.200 1.381 -4.501 1.00 . A A . 10 VAL N 1 1 13 13494 1 1 10 VAL O O -10.420 2.804 -7.459 1.00 . A A . 10 VAL O 1 1 13 13495 1 1 11 ASP C C -10.320 5.951 -4.818 1.00 . A A . 11 ASP C 1 1 13 13496 1 1 11 ASP CA C -10.960 4.908 -5.740 1.00 . A A . 11 ASP CA 1 1 13 13497 1 1 11 ASP CB C -12.472 5.118 -5.746 1.00 . A A . 11 ASP CB 1 1 13 13498 1 1 11 ASP CG C -12.863 6.472 -6.307 1.00 . A A . 11 ASP CG 1 1 13 13499 1 1 11 ASP H H -10.659 3.300 -4.399 1.00 . A A . 11 ASP H 1 1 13 13500 1 1 11 ASP HA H -10.586 5.058 -6.742 1.00 . A A . 11 ASP HA 1 1 13 13501 1 1 11 ASP HB2 H -12.935 4.352 -6.343 1.00 . A A . 11 ASP HB2 1 1 13 13502 1 1 11 ASP HB3 H -12.839 5.051 -4.735 1.00 . A A . 11 ASP HB3 1 1 13 13503 1 1 11 ASP N N -10.632 3.544 -5.344 1.00 . A A . 11 ASP N 1 1 13 13504 1 1 11 ASP O O -9.863 6.995 -5.285 1.00 . A A . 11 ASP O 1 1 13 13505 1 1 11 ASP OD1 O -12.414 6.805 -7.423 1.00 . A A . 11 ASP OD1 1 1 13 13506 1 1 11 ASP OD2 O -13.618 7.199 -5.628 1.00 . A A . 11 ASP OD2 1 1 13 13507 1 1 12 GLU C C -9.240 6.007 -1.265 1.00 . A A . 12 GLU C 1 1 13 13508 1 1 12 GLU CA C -9.749 6.652 -2.553 1.00 . A A . 12 GLU CA 1 1 13 13509 1 1 12 GLU CB C -10.820 7.684 -2.214 1.00 . A A . 12 GLU CB 1 1 13 13510 1 1 12 GLU CD C -12.121 9.710 -2.978 1.00 . A A . 12 GLU CD 1 1 13 13511 1 1 12 GLU CG C -11.191 8.582 -3.382 1.00 . A A . 12 GLU CG 1 1 13 13512 1 1 12 GLU H H -10.538 4.774 -3.206 1.00 . A A . 12 GLU H 1 1 13 13513 1 1 12 GLU HA H -8.922 7.157 -3.029 1.00 . A A . 12 GLU HA 1 1 13 13514 1 1 12 GLU HB2 H -11.711 7.165 -1.888 1.00 . A A . 12 GLU HB2 1 1 13 13515 1 1 12 GLU HB3 H -10.461 8.303 -1.409 1.00 . A A . 12 GLU HB3 1 1 13 13516 1 1 12 GLU HG2 H -10.289 9.009 -3.792 1.00 . A A . 12 GLU HG2 1 1 13 13517 1 1 12 GLU HG3 H -11.681 7.984 -4.137 1.00 . A A . 12 GLU HG3 1 1 13 13518 1 1 12 GLU N N -10.284 5.674 -3.513 1.00 . A A . 12 GLU N 1 1 13 13519 1 1 12 GLU O O -9.712 4.953 -0.869 1.00 . A A . 12 GLU O 1 1 13 13520 1 1 12 GLU OE1 O -13.350 9.490 -2.968 1.00 . A A . 12 GLU OE1 1 1 13 13521 1 1 12 GLU OE2 O -11.619 10.813 -2.674 1.00 . A A . 12 GLU OE2 1 1 13 13522 1 1 13 ILE C C -7.814 7.220 1.757 1.00 . A A . 13 ILE C 1 1 13 13523 1 1 13 ILE CA C -7.737 6.161 0.653 1.00 . A A . 13 ILE CA 1 1 13 13524 1 1 13 ILE CB C -6.260 5.715 0.461 1.00 . A A . 13 ILE CB 1 1 13 13525 1 1 13 ILE CD1 C -5.556 7.737 -0.914 1.00 . A A . 13 ILE CD1 1 1 13 13526 1 1 13 ILE CG1 C -5.328 6.929 0.344 1.00 . A A . 13 ILE CG1 1 1 13 13527 1 1 13 ILE CG2 C -6.139 4.868 -0.787 1.00 . A A . 13 ILE CG2 1 1 13 13528 1 1 13 ILE H H -7.990 7.534 -0.945 1.00 . A A . 13 ILE H 1 1 13 13529 1 1 13 ILE HA H -8.320 5.299 0.949 1.00 . A A . 13 ILE HA 1 1 13 13530 1 1 13 ILE HB H -5.957 5.103 1.308 1.00 . A A . 13 ILE HB 1 1 13 13531 1 1 13 ILE HD11 H -5.871 7.080 -1.714 1.00 . A A . 13 ILE HD11 1 1 13 13532 1 1 13 ILE HD12 H -4.641 8.234 -1.195 1.00 . A A . 13 ILE HD12 1 1 13 13533 1 1 13 ILE HD13 H -6.323 8.475 -0.733 1.00 . A A . 13 ILE HD13 1 1 13 13534 1 1 13 ILE HG12 H -5.484 7.581 1.190 1.00 . A A . 13 ILE HG12 1 1 13 13535 1 1 13 ILE HG13 H -4.302 6.593 0.342 1.00 . A A . 13 ILE HG13 1 1 13 13536 1 1 13 ILE HG21 H -6.053 3.828 -0.514 1.00 . A A . 13 ILE HG21 1 1 13 13537 1 1 13 ILE HG22 H -5.263 5.169 -1.341 1.00 . A A . 13 ILE HG22 1 1 13 13538 1 1 13 ILE HG23 H -7.013 5.009 -1.398 1.00 . A A . 13 ILE HG23 1 1 13 13539 1 1 13 ILE N N -8.304 6.675 -0.595 1.00 . A A . 13 ILE N 1 1 13 13540 1 1 13 ILE O O -8.489 8.240 1.607 1.00 . A A . 13 ILE O 1 1 13 13541 1 1 14 VAL C C -5.762 7.780 4.729 1.00 . A A . 14 VAL C 1 1 13 13542 1 1 14 VAL CA C -7.086 7.900 3.983 1.00 . A A . 14 VAL CA 1 1 13 13543 1 1 14 VAL CB C -8.262 7.669 4.959 1.00 . A A . 14 VAL CB 1 1 13 13544 1 1 14 VAL CG1 C -8.133 8.554 6.192 1.00 . A A . 14 VAL CG1 1 1 13 13545 1 1 14 VAL CG2 C -9.586 7.930 4.258 1.00 . A A . 14 VAL CG2 1 1 13 13546 1 1 14 VAL H H -6.612 6.132 2.924 1.00 . A A . 14 VAL H 1 1 13 13547 1 1 14 VAL HA H -7.169 8.898 3.584 1.00 . A A . 14 VAL HA 1 1 13 13548 1 1 14 VAL HB H -8.244 6.637 5.278 1.00 . A A . 14 VAL HB 1 1 13 13549 1 1 14 VAL HG11 H -8.132 9.591 5.894 1.00 . A A . 14 VAL HG11 1 1 13 13550 1 1 14 VAL HG12 H -7.209 8.325 6.704 1.00 . A A . 14 VAL HG12 1 1 13 13551 1 1 14 VAL HG13 H -8.965 8.371 6.855 1.00 . A A . 14 VAL HG13 1 1 13 13552 1 1 14 VAL HG21 H -9.622 8.958 3.929 1.00 . A A . 14 VAL HG21 1 1 13 13553 1 1 14 VAL HG22 H -10.399 7.742 4.943 1.00 . A A . 14 VAL HG22 1 1 13 13554 1 1 14 VAL HG23 H -9.675 7.275 3.404 1.00 . A A . 14 VAL HG23 1 1 13 13555 1 1 14 VAL N N -7.119 6.967 2.862 1.00 . A A . 14 VAL N 1 1 13 13556 1 1 14 VAL O O -5.019 8.753 4.858 1.00 . A A . 14 VAL O 1 1 13 13557 1 1 15 GLU C C -3.185 5.784 4.970 1.00 . A A . 15 GLU C 1 1 13 13558 1 1 15 GLU CA C -4.233 6.324 5.936 1.00 . A A . 15 GLU CA 1 1 13 13559 1 1 15 GLU CB C -4.464 5.327 7.074 1.00 . A A . 15 GLU CB 1 1 13 13560 1 1 15 GLU CD C -2.638 6.322 8.509 1.00 . A A . 15 GLU CD 1 1 13 13561 1 1 15 GLU CG C -3.220 5.058 7.905 1.00 . A A . 15 GLU CG 1 1 13 13562 1 1 15 GLU H H -6.122 5.850 5.091 1.00 . A A . 15 GLU H 1 1 13 13563 1 1 15 GLU HA H -3.884 7.259 6.345 1.00 . A A . 15 GLU HA 1 1 13 13564 1 1 15 GLU HB2 H -5.231 5.715 7.727 1.00 . A A . 15 GLU HB2 1 1 13 13565 1 1 15 GLU HB3 H -4.799 4.391 6.654 1.00 . A A . 15 GLU HB3 1 1 13 13566 1 1 15 GLU HG2 H -3.477 4.382 8.707 1.00 . A A . 15 GLU HG2 1 1 13 13567 1 1 15 GLU HG3 H -2.473 4.601 7.275 1.00 . A A . 15 GLU HG3 1 1 13 13568 1 1 15 GLU N N -5.478 6.580 5.218 1.00 . A A . 15 GLU N 1 1 13 13569 1 1 15 GLU O O -3.483 4.924 4.153 1.00 . A A . 15 GLU O 1 1 13 13570 1 1 15 GLU OE1 O -3.122 6.746 9.579 1.00 . A A . 15 GLU OE1 1 1 13 13571 1 1 15 GLU OE2 O -1.699 6.888 7.911 1.00 . A A . 15 GLU OE2 1 1 13 13572 1 1 16 LYS C C 0.484 5.964 4.789 1.00 . A A . 16 LYS C 1 1 13 13573 1 1 16 LYS CA C -0.905 5.846 4.147 1.00 . A A . 16 LYS CA 1 1 13 13574 1 1 16 LYS CB C -0.937 6.692 2.876 1.00 . A A . 16 LYS CB 1 1 13 13575 1 1 16 LYS CD C -1.011 8.998 1.868 1.00 . A A . 16 LYS CD 1 1 13 13576 1 1 16 LYS CE C -2.288 8.810 1.065 1.00 . A A . 16 LYS CE 1 1 13 13577 1 1 16 LYS CG C -1.031 8.185 3.151 1.00 . A A . 16 LYS CG 1 1 13 13578 1 1 16 LYS H H -1.772 6.982 5.719 1.00 . A A . 16 LYS H 1 1 13 13579 1 1 16 LYS HA H -1.104 4.807 3.888 1.00 . A A . 16 LYS HA 1 1 13 13580 1 1 16 LYS HB2 H -0.033 6.510 2.315 1.00 . A A . 16 LYS HB2 1 1 13 13581 1 1 16 LYS HB3 H -1.789 6.401 2.280 1.00 . A A . 16 LYS HB3 1 1 13 13582 1 1 16 LYS HD2 H -0.908 10.043 2.117 1.00 . A A . 16 LYS HD2 1 1 13 13583 1 1 16 LYS HD3 H -0.170 8.684 1.267 1.00 . A A . 16 LYS HD3 1 1 13 13584 1 1 16 LYS HE2 H -2.355 7.778 0.754 1.00 . A A . 16 LYS HE2 1 1 13 13585 1 1 16 LYS HE3 H -3.133 9.051 1.694 1.00 . A A . 16 LYS HE3 1 1 13 13586 1 1 16 LYS HG2 H -1.952 8.386 3.677 1.00 . A A . 16 LYS HG2 1 1 13 13587 1 1 16 LYS HG3 H -0.193 8.481 3.766 1.00 . A A . 16 LYS HG3 1 1 13 13588 1 1 16 LYS HZ1 H -3.192 9.523 -0.679 1.00 . A A . 16 LYS HZ1 1 1 13 13589 1 1 16 LYS HZ2 H -1.502 9.473 -0.753 1.00 . A A . 16 LYS HZ2 1 1 13 13590 1 1 16 LYS HZ3 H -2.274 10.682 0.142 1.00 . A A . 16 LYS HZ3 1 1 13 13591 1 1 16 LYS N N -1.963 6.295 5.050 1.00 . A A . 16 LYS N 1 1 13 13592 1 1 16 LYS NZ N -2.317 9.683 -0.141 1.00 . A A . 16 LYS NZ 1 1 13 13593 1 1 16 LYS O O 1.131 7.004 4.672 1.00 . A A . 16 LYS O 1 1 13 13594 1 1 17 ARG C C 2.863 3.557 6.233 1.00 . A A . 17 ARG C 1 1 13 13595 1 1 17 ARG CA C 2.262 4.953 6.103 1.00 . A A . 17 ARG CA 1 1 13 13596 1 1 17 ARG CB C 2.149 5.610 7.478 1.00 . A A . 17 ARG CB 1 1 13 13597 1 1 17 ARG CD C 0.811 5.795 9.594 1.00 . A A . 17 ARG CD 1 1 13 13598 1 1 17 ARG CG C 1.180 4.909 8.415 1.00 . A A . 17 ARG CG 1 1 13 13599 1 1 17 ARG CZ C 2.008 7.156 11.256 1.00 . A A . 17 ARG CZ 1 1 13 13600 1 1 17 ARG H H 0.413 4.092 5.512 1.00 . A A . 17 ARG H 1 1 13 13601 1 1 17 ARG HA H 2.913 5.552 5.484 1.00 . A A . 17 ARG HA 1 1 13 13602 1 1 17 ARG HB2 H 3.123 5.620 7.943 1.00 . A A . 17 ARG HB2 1 1 13 13603 1 1 17 ARG HB3 H 1.812 6.625 7.344 1.00 . A A . 17 ARG HB3 1 1 13 13604 1 1 17 ARG HD2 H 0.376 6.708 9.217 1.00 . A A . 17 ARG HD2 1 1 13 13605 1 1 17 ARG HD3 H 0.086 5.275 10.204 1.00 . A A . 17 ARG HD3 1 1 13 13606 1 1 17 ARG HE H 2.763 5.554 10.337 1.00 . A A . 17 ARG HE 1 1 13 13607 1 1 17 ARG HG2 H 0.281 4.660 7.870 1.00 . A A . 17 ARG HG2 1 1 13 13608 1 1 17 ARG HG3 H 1.640 4.005 8.787 1.00 . A A . 17 ARG HG3 1 1 13 13609 1 1 17 ARG HH11 H 0.134 7.784 10.834 1.00 . A A . 17 ARG HH11 1 1 13 13610 1 1 17 ARG HH12 H 0.985 8.728 12.011 1.00 . A A . 17 ARG HH12 1 1 13 13611 1 1 17 ARG HH21 H 3.892 6.788 11.889 1.00 . A A . 17 ARG HH21 1 1 13 13612 1 1 17 ARG HH22 H 3.121 8.162 12.611 1.00 . A A . 17 ARG HH22 1 1 13 13613 1 1 17 ARG N N 0.948 4.913 5.462 1.00 . A A . 17 ARG N 1 1 13 13614 1 1 17 ARG NE N 1.972 6.128 10.414 1.00 . A A . 17 ARG NE 1 1 13 13615 1 1 17 ARG NH1 N 0.956 7.955 11.376 1.00 . A A . 17 ARG NH1 1 1 13 13616 1 1 17 ARG NH2 N 3.096 7.388 11.978 1.00 . A A . 17 ARG NH2 1 1 13 13617 1 1 17 ARG O O 2.608 2.862 7.215 1.00 . A A . 17 ARG O 1 1 13 13618 1 1 18 GLY C C 5.554 1.647 4.609 1.00 . A A . 18 GLY C 1 1 13 13619 1 1 18 GLY CA C 4.238 1.812 5.334 1.00 . A A . 18 GLY CA 1 1 13 13620 1 1 18 GLY H H 3.861 3.724 4.491 1.00 . A A . 18 GLY H 1 1 13 13621 1 1 18 GLY HA2 H 4.390 1.569 6.374 1.00 . A A . 18 GLY HA2 1 1 13 13622 1 1 18 GLY HA3 H 3.536 1.114 4.924 1.00 . A A . 18 GLY HA3 1 1 13 13623 1 1 18 GLY N N 3.660 3.137 5.253 1.00 . A A . 18 GLY N 1 1 13 13624 1 1 18 GLY O O 6.454 2.480 4.714 1.00 . A A . 18 GLY O 1 1 13 13625 1 1 19 LYS C C 6.538 0.307 1.612 1.00 . A A . 19 LYS C 1 1 13 13626 1 1 19 LYS CA C 6.825 0.188 3.112 1.00 . A A . 19 LYS CA 1 1 13 13627 1 1 19 LYS CB C 7.199 -1.229 3.501 1.00 . A A . 19 LYS CB 1 1 13 13628 1 1 19 LYS CD C 8.078 -2.781 5.211 1.00 . A A . 19 LYS CD 1 1 13 13629 1 1 19 LYS CE C 8.602 -2.946 6.629 1.00 . A A . 19 LYS CE 1 1 13 13630 1 1 19 LYS CG C 7.672 -1.358 4.930 1.00 . A A . 19 LYS CG 1 1 13 13631 1 1 19 LYS H H 4.872 -0.060 3.827 1.00 . A A . 19 LYS H 1 1 13 13632 1 1 19 LYS HA H 7.621 0.851 3.382 1.00 . A A . 19 LYS HA 1 1 13 13633 1 1 19 LYS HB2 H 6.320 -1.849 3.377 1.00 . A A . 19 LYS HB2 1 1 13 13634 1 1 19 LYS HB3 H 7.980 -1.589 2.851 1.00 . A A . 19 LYS HB3 1 1 13 13635 1 1 19 LYS HD2 H 7.215 -3.413 5.072 1.00 . A A . 19 LYS HD2 1 1 13 13636 1 1 19 LYS HD3 H 8.848 -3.061 4.509 1.00 . A A . 19 LYS HD3 1 1 13 13637 1 1 19 LYS HE2 H 7.831 -2.644 7.321 1.00 . A A . 19 LYS HE2 1 1 13 13638 1 1 19 LYS HE3 H 8.842 -3.987 6.792 1.00 . A A . 19 LYS HE3 1 1 13 13639 1 1 19 LYS HG2 H 8.521 -0.708 5.082 1.00 . A A . 19 LYS HG2 1 1 13 13640 1 1 19 LYS HG3 H 6.871 -1.079 5.598 1.00 . A A . 19 LYS HG3 1 1 13 13641 1 1 19 LYS HZ1 H 10.576 -2.404 6.217 1.00 . A A . 19 LYS HZ1 1 1 13 13642 1 1 19 LYS HZ2 H 10.153 -2.258 7.848 1.00 . A A . 19 LYS HZ2 1 1 13 13643 1 1 19 LYS HZ3 H 9.606 -1.117 6.727 1.00 . A A . 19 LYS HZ3 1 1 13 13644 1 1 19 LYS N N 5.643 0.545 3.868 1.00 . A A . 19 LYS N 1 1 13 13645 1 1 19 LYS NZ N 9.820 -2.124 6.872 1.00 . A A . 19 LYS NZ 1 1 13 13646 1 1 19 LYS O O 6.178 1.369 1.143 1.00 . A A . 19 LYS O 1 1 13 13647 1 1 20 GLY C C 4.979 -1.182 -0.722 1.00 . A A . 20 GLY C 1 1 13 13648 1 1 20 GLY CA C 6.390 -0.719 -0.548 1.00 . A A . 20 GLY CA 1 1 13 13649 1 1 20 GLY H H 7.008 -1.595 1.239 1.00 . A A . 20 GLY H 1 1 13 13650 1 1 20 GLY HA2 H 6.502 0.288 -0.913 1.00 . A A . 20 GLY HA2 1 1 13 13651 1 1 20 GLY HA3 H 7.043 -1.382 -1.080 1.00 . A A . 20 GLY HA3 1 1 13 13652 1 1 20 GLY N N 6.703 -0.766 0.852 1.00 . A A . 20 GLY N 1 1 13 13653 1 1 20 GLY O O 4.199 -0.634 -1.497 1.00 . A A . 20 GLY O 1 1 13 13654 1 1 21 LYS C C 2.952 -3.134 1.522 1.00 . A A . 21 LYS C 1 1 13 13655 1 1 21 LYS CA C 3.360 -2.814 0.072 1.00 . A A . 21 LYS CA 1 1 13 13656 1 1 21 LYS CB C 3.321 -4.086 -0.775 1.00 . A A . 21 LYS CB 1 1 13 13657 1 1 21 LYS CD C 4.592 -3.685 -2.907 1.00 . A A . 21 LYS CD 1 1 13 13658 1 1 21 LYS CE C 4.498 -3.654 -4.423 1.00 . A A . 21 LYS CE 1 1 13 13659 1 1 21 LYS CG C 3.220 -3.833 -2.271 1.00 . A A . 21 LYS CG 1 1 13 13660 1 1 21 LYS H H 5.396 -2.628 0.563 1.00 . A A . 21 LYS H 1 1 13 13661 1 1 21 LYS HA H 2.666 -2.094 -0.339 1.00 . A A . 21 LYS HA 1 1 13 13662 1 1 21 LYS HB2 H 4.225 -4.648 -0.592 1.00 . A A . 21 LYS HB2 1 1 13 13663 1 1 21 LYS HB3 H 2.471 -4.680 -0.473 1.00 . A A . 21 LYS HB3 1 1 13 13664 1 1 21 LYS HD2 H 5.040 -2.764 -2.566 1.00 . A A . 21 LYS HD2 1 1 13 13665 1 1 21 LYS HD3 H 5.209 -4.520 -2.610 1.00 . A A . 21 LYS HD3 1 1 13 13666 1 1 21 LYS HE2 H 3.936 -4.516 -4.754 1.00 . A A . 21 LYS HE2 1 1 13 13667 1 1 21 LYS HE3 H 3.982 -2.754 -4.721 1.00 . A A . 21 LYS HE3 1 1 13 13668 1 1 21 LYS HG2 H 2.708 -4.663 -2.733 1.00 . A A . 21 LYS HG2 1 1 13 13669 1 1 21 LYS HG3 H 2.658 -2.925 -2.433 1.00 . A A . 21 LYS HG3 1 1 13 13670 1 1 21 LYS HZ1 H 6.392 -2.846 -4.771 1.00 . A A . 21 LYS HZ1 1 1 13 13671 1 1 21 LYS HZ2 H 5.743 -3.670 -6.100 1.00 . A A . 21 LYS HZ2 1 1 13 13672 1 1 21 LYS HZ3 H 6.355 -4.538 -4.784 1.00 . A A . 21 LYS HZ3 1 1 13 13673 1 1 21 LYS N N 4.679 -2.223 0.032 1.00 . A A . 21 LYS N 1 1 13 13674 1 1 21 LYS NZ N 5.841 -3.679 -5.065 1.00 . A A . 21 LYS NZ 1 1 13 13675 1 1 21 LYS O O 1.861 -3.642 1.758 1.00 . A A . 21 LYS O 1 1 13 13676 1 1 22 ASP C C 2.735 -1.931 4.542 1.00 . A A . 22 ASP C 1 1 13 13677 1 1 22 ASP CA C 3.529 -3.057 3.906 1.00 . A A . 22 ASP CA 1 1 13 13678 1 1 22 ASP CB C 4.826 -3.234 4.694 1.00 . A A . 22 ASP CB 1 1 13 13679 1 1 22 ASP CG C 4.605 -3.929 6.022 1.00 . A A . 22 ASP CG 1 1 13 13680 1 1 22 ASP H H 4.628 -2.333 2.279 1.00 . A A . 22 ASP H 1 1 13 13681 1 1 22 ASP HA H 2.961 -3.953 3.948 1.00 . A A . 22 ASP HA 1 1 13 13682 1 1 22 ASP HB2 H 5.526 -3.806 4.111 1.00 . A A . 22 ASP HB2 1 1 13 13683 1 1 22 ASP HB3 H 5.246 -2.259 4.894 1.00 . A A . 22 ASP HB3 1 1 13 13684 1 1 22 ASP N N 3.809 -2.787 2.501 1.00 . A A . 22 ASP N 1 1 13 13685 1 1 22 ASP O O 2.573 -1.873 5.759 1.00 . A A . 22 ASP O 1 1 13 13686 1 1 22 ASP OD1 O 3.435 -4.050 6.434 1.00 . A A . 22 ASP OD1 1 1 13 13687 1 1 22 ASP OD2 O 5.599 -4.340 6.656 1.00 . A A . 22 ASP OD2 1 1 13 13688 1 1 23 VAL C C 0.007 -0.196 4.146 1.00 . A A . 23 VAL C 1 1 13 13689 1 1 23 VAL CA C 1.497 0.096 4.138 1.00 . A A . 23 VAL CA 1 1 13 13690 1 1 23 VAL CB C 1.771 1.247 3.183 1.00 . A A . 23 VAL CB 1 1 13 13691 1 1 23 VAL CG1 C 1.310 0.858 1.787 1.00 . A A . 23 VAL CG1 1 1 13 13692 1 1 23 VAL CG2 C 1.094 2.512 3.669 1.00 . A A . 23 VAL CG2 1 1 13 13693 1 1 23 VAL H H 2.455 -1.130 2.766 1.00 . A A . 23 VAL H 1 1 13 13694 1 1 23 VAL HA H 1.816 0.381 5.125 1.00 . A A . 23 VAL HA 1 1 13 13695 1 1 23 VAL HB H 2.842 1.412 3.154 1.00 . A A . 23 VAL HB 1 1 13 13696 1 1 23 VAL HG11 H 0.713 -0.039 1.839 1.00 . A A . 23 VAL HG11 1 1 13 13697 1 1 23 VAL HG12 H 2.172 0.676 1.164 1.00 . A A . 23 VAL HG12 1 1 13 13698 1 1 23 VAL HG13 H 0.721 1.656 1.366 1.00 . A A . 23 VAL HG13 1 1 13 13699 1 1 23 VAL HG21 H 0.043 2.477 3.423 1.00 . A A . 23 VAL HG21 1 1 13 13700 1 1 23 VAL HG22 H 1.548 3.371 3.199 1.00 . A A . 23 VAL HG22 1 1 13 13701 1 1 23 VAL HG23 H 1.211 2.582 4.739 1.00 . A A . 23 VAL HG23 1 1 13 13702 1 1 23 VAL N N 2.263 -1.040 3.709 1.00 . A A . 23 VAL N 1 1 13 13703 1 1 23 VAL O O -0.484 -1.026 3.381 1.00 . A A . 23 VAL O 1 1 13 13704 1 1 24 GLU C C -2.866 1.526 4.444 1.00 . A A . 24 GLU C 1 1 13 13705 1 1 24 GLU CA C -2.146 0.353 5.097 1.00 . A A . 24 GLU CA 1 1 13 13706 1 1 24 GLU CB C -2.571 0.236 6.559 1.00 . A A . 24 GLU CB 1 1 13 13707 1 1 24 GLU CD C -2.457 1.211 8.889 1.00 . A A . 24 GLU CD 1 1 13 13708 1 1 24 GLU CG C -1.966 1.303 7.457 1.00 . A A . 24 GLU CG 1 1 13 13709 1 1 24 GLU H H -0.262 1.202 5.533 1.00 . A A . 24 GLU H 1 1 13 13710 1 1 24 GLU HA H -2.404 -0.564 4.578 1.00 . A A . 24 GLU HA 1 1 13 13711 1 1 24 GLU HB2 H -3.647 0.320 6.612 1.00 . A A . 24 GLU HB2 1 1 13 13712 1 1 24 GLU HB3 H -2.277 -0.731 6.933 1.00 . A A . 24 GLU HB3 1 1 13 13713 1 1 24 GLU HG2 H -0.892 1.191 7.453 1.00 . A A . 24 GLU HG2 1 1 13 13714 1 1 24 GLU HG3 H -2.226 2.275 7.064 1.00 . A A . 24 GLU HG3 1 1 13 13715 1 1 24 GLU N N -0.709 0.524 4.988 1.00 . A A . 24 GLU N 1 1 13 13716 1 1 24 GLU O O -2.740 2.668 4.887 1.00 . A A . 24 GLU O 1 1 13 13717 1 1 24 GLU OE1 O -1.863 0.440 9.671 1.00 . A A . 24 GLU OE1 1 1 13 13718 1 1 24 GLU OE2 O -3.436 1.909 9.228 1.00 . A A . 24 GLU OE2 1 1 13 13719 1 1 25 TYR C C -5.844 1.978 2.725 1.00 . A A . 25 TYR C 1 1 13 13720 1 1 25 TYR CA C -4.354 2.266 2.680 1.00 . A A . 25 TYR CA 1 1 13 13721 1 1 25 TYR CB C -3.895 2.337 1.226 1.00 . A A . 25 TYR CB 1 1 13 13722 1 1 25 TYR CD1 C -1.460 2.958 1.420 1.00 . A A . 25 TYR CD1 1 1 13 13723 1 1 25 TYR CD2 C -2.922 4.483 0.327 1.00 . A A . 25 TYR CD2 1 1 13 13724 1 1 25 TYR CE1 C -0.401 3.812 1.192 1.00 . A A . 25 TYR CE1 1 1 13 13725 1 1 25 TYR CE2 C -1.868 5.340 0.091 1.00 . A A . 25 TYR CE2 1 1 13 13726 1 1 25 TYR CG C -2.737 3.279 0.992 1.00 . A A . 25 TYR CG 1 1 13 13727 1 1 25 TYR CZ C -0.608 4.999 0.525 1.00 . A A . 25 TYR CZ 1 1 13 13728 1 1 25 TYR H H -3.692 0.319 3.098 1.00 . A A . 25 TYR H 1 1 13 13729 1 1 25 TYR HA H -4.158 3.210 3.157 1.00 . A A . 25 TYR HA 1 1 13 13730 1 1 25 TYR HB2 H -3.589 1.352 0.905 1.00 . A A . 25 TYR HB2 1 1 13 13731 1 1 25 TYR HB3 H -4.721 2.668 0.612 1.00 . A A . 25 TYR HB3 1 1 13 13732 1 1 25 TYR HD1 H -1.298 2.026 1.942 1.00 . A A . 25 TYR HD1 1 1 13 13733 1 1 25 TYR HD2 H -3.905 4.745 -0.010 1.00 . A A . 25 TYR HD2 1 1 13 13734 1 1 25 TYR HE1 H 0.582 3.548 1.532 1.00 . A A . 25 TYR HE1 1 1 13 13735 1 1 25 TYR HE2 H -2.034 6.272 -0.429 1.00 . A A . 25 TYR HE2 1 1 13 13736 1 1 25 TYR HH H 0.157 6.758 0.392 1.00 . A A . 25 TYR HH 1 1 13 13737 1 1 25 TYR N N -3.619 1.241 3.394 1.00 . A A . 25 TYR N 1 1 13 13738 1 1 25 TYR O O -6.262 0.826 2.721 1.00 . A A . 25 TYR O 1 1 13 13739 1 1 25 TYR OH O 0.448 5.849 0.290 1.00 . A A . 25 TYR OH 1 1 13 13740 1 1 26 LEU C C -8.585 2.811 1.353 1.00 . A A . 26 LEU C 1 1 13 13741 1 1 26 LEU CA C -8.079 2.893 2.774 1.00 . A A . 26 LEU CA 1 1 13 13742 1 1 26 LEU CB C -8.715 4.083 3.495 1.00 . A A . 26 LEU CB 1 1 13 13743 1 1 26 LEU CD1 C -10.887 4.811 4.521 1.00 . A A . 26 LEU CD1 1 1 13 13744 1 1 26 LEU CD2 C -10.521 5.060 2.057 1.00 . A A . 26 LEU CD2 1 1 13 13745 1 1 26 LEU CG C -10.223 4.220 3.289 1.00 . A A . 26 LEU CG 1 1 13 13746 1 1 26 LEU H H -6.252 3.919 2.717 1.00 . A A . 26 LEU H 1 1 13 13747 1 1 26 LEU HA H -8.326 1.979 3.292 1.00 . A A . 26 LEU HA 1 1 13 13748 1 1 26 LEU HB2 H -8.520 3.985 4.553 1.00 . A A . 26 LEU HB2 1 1 13 13749 1 1 26 LEU HB3 H -8.241 4.986 3.142 1.00 . A A . 26 LEU HB3 1 1 13 13750 1 1 26 LEU HD11 H -11.916 5.049 4.295 1.00 . A A . 26 LEU HD11 1 1 13 13751 1 1 26 LEU HD12 H -10.365 5.707 4.818 1.00 . A A . 26 LEU HD12 1 1 13 13752 1 1 26 LEU HD13 H -10.854 4.091 5.327 1.00 . A A . 26 LEU HD13 1 1 13 13753 1 1 26 LEU HD21 H -9.865 5.916 2.036 1.00 . A A . 26 LEU HD21 1 1 13 13754 1 1 26 LEU HD22 H -11.548 5.391 2.088 1.00 . A A . 26 LEU HD22 1 1 13 13755 1 1 26 LEU HD23 H -10.363 4.463 1.170 1.00 . A A . 26 LEU HD23 1 1 13 13756 1 1 26 LEU HG H -10.637 3.243 3.125 1.00 . A A . 26 LEU HG 1 1 13 13757 1 1 26 LEU N N -6.640 3.030 2.743 1.00 . A A . 26 LEU N 1 1 13 13758 1 1 26 LEU O O -7.908 3.258 0.432 1.00 . A A . 26 LEU O 1 1 13 13759 1 1 27 VAL C C -11.765 2.352 -0.299 1.00 . A A . 27 VAL C 1 1 13 13760 1 1 27 VAL CA C -10.266 2.127 -0.197 1.00 . A A . 27 VAL CA 1 1 13 13761 1 1 27 VAL CB C -9.845 0.795 -0.892 1.00 . A A . 27 VAL CB 1 1 13 13762 1 1 27 VAL CG1 C -8.882 -0.017 -0.038 1.00 . A A . 27 VAL CG1 1 1 13 13763 1 1 27 VAL CG2 C -11.023 -0.078 -1.338 1.00 . A A . 27 VAL CG2 1 1 13 13764 1 1 27 VAL H H -10.252 1.857 1.903 1.00 . A A . 27 VAL H 1 1 13 13765 1 1 27 VAL HA H -9.793 2.908 -0.761 1.00 . A A . 27 VAL HA 1 1 13 13766 1 1 27 VAL HB H -9.316 1.094 -1.771 1.00 . A A . 27 VAL HB 1 1 13 13767 1 1 27 VAL HG11 H -9.409 -0.420 0.815 1.00 . A A . 27 VAL HG11 1 1 13 13768 1 1 27 VAL HG12 H -8.079 0.619 0.304 1.00 . A A . 27 VAL HG12 1 1 13 13769 1 1 27 VAL HG13 H -8.474 -0.826 -0.625 1.00 . A A . 27 VAL HG13 1 1 13 13770 1 1 27 VAL HG21 H -11.677 -0.259 -0.501 1.00 . A A . 27 VAL HG21 1 1 13 13771 1 1 27 VAL HG22 H -10.653 -1.019 -1.716 1.00 . A A . 27 VAL HG22 1 1 13 13772 1 1 27 VAL HG23 H -11.572 0.430 -2.118 1.00 . A A . 27 VAL HG23 1 1 13 13773 1 1 27 VAL N N -9.752 2.231 1.152 1.00 . A A . 27 VAL N 1 1 13 13774 1 1 27 VAL O O -12.569 1.575 0.212 1.00 . A A . 27 VAL O 1 1 13 13775 1 1 28 ARG C C -13.834 3.003 -2.494 1.00 . A A . 28 ARG C 1 1 13 13776 1 1 28 ARG CA C -13.512 3.724 -1.221 1.00 . A A . 28 ARG CA 1 1 13 13777 1 1 28 ARG CB C -13.768 5.214 -1.381 1.00 . A A . 28 ARG CB 1 1 13 13778 1 1 28 ARG CD C -15.445 7.089 -1.413 1.00 . A A . 28 ARG CD 1 1 13 13779 1 1 28 ARG CG C -15.231 5.597 -1.220 1.00 . A A . 28 ARG CG 1 1 13 13780 1 1 28 ARG CZ C -17.333 8.651 -1.603 1.00 . A A . 28 ARG CZ 1 1 13 13781 1 1 28 ARG H H -11.437 4.069 -1.261 1.00 . A A . 28 ARG H 1 1 13 13782 1 1 28 ARG HA H -14.117 3.315 -0.431 1.00 . A A . 28 ARG HA 1 1 13 13783 1 1 28 ARG HB2 H -13.187 5.756 -0.651 1.00 . A A . 28 ARG HB2 1 1 13 13784 1 1 28 ARG HB3 H -13.454 5.499 -2.371 1.00 . A A . 28 ARG HB3 1 1 13 13785 1 1 28 ARG HD2 H -14.867 7.621 -0.674 1.00 . A A . 28 ARG HD2 1 1 13 13786 1 1 28 ARG HD3 H -15.107 7.363 -2.401 1.00 . A A . 28 ARG HD3 1 1 13 13787 1 1 28 ARG HE H -17.464 6.787 -0.909 1.00 . A A . 28 ARG HE 1 1 13 13788 1 1 28 ARG HG2 H -15.816 5.062 -1.953 1.00 . A A . 28 ARG HG2 1 1 13 13789 1 1 28 ARG HG3 H -15.555 5.321 -0.227 1.00 . A A . 28 ARG HG3 1 1 13 13790 1 1 28 ARG HH11 H -15.555 9.383 -2.226 1.00 . A A . 28 ARG HH11 1 1 13 13791 1 1 28 ARG HH12 H -16.893 10.476 -2.350 1.00 . A A . 28 ARG HH12 1 1 13 13792 1 1 28 ARG HH21 H -19.233 8.217 -1.066 1.00 . A A . 28 ARG HH21 1 1 13 13793 1 1 28 ARG HH22 H -18.984 9.813 -1.692 1.00 . A A . 28 ARG HH22 1 1 13 13794 1 1 28 ARG N N -12.124 3.441 -0.954 1.00 . A A . 28 ARG N 1 1 13 13795 1 1 28 ARG NE N -16.851 7.459 -1.271 1.00 . A A . 28 ARG NE 1 1 13 13796 1 1 28 ARG NH1 N -16.527 9.580 -2.100 1.00 . A A . 28 ARG NH1 1 1 13 13797 1 1 28 ARG NH2 N -18.622 8.916 -1.440 1.00 . A A . 28 ARG NH2 1 1 13 13798 1 1 28 ARG O O -13.934 3.608 -3.560 1.00 . A A . 28 ARG O 1 1 13 13799 1 1 29 TRP C C -14.949 1.465 -4.607 1.00 . A A . 29 TRP C 1 1 13 13800 1 1 29 TRP CA C -14.251 0.781 -3.451 1.00 . A A . 29 TRP CA 1 1 13 13801 1 1 29 TRP CB C -15.108 -0.365 -2.940 1.00 . A A . 29 TRP CB 1 1 13 13802 1 1 29 TRP CD1 C -14.029 -1.867 -4.712 1.00 . A A . 29 TRP CD1 1 1 13 13803 1 1 29 TRP CD2 C -15.496 -2.918 -3.387 1.00 . A A . 29 TRP CD2 1 1 13 13804 1 1 29 TRP CE2 C -14.980 -3.846 -4.311 1.00 . A A . 29 TRP CE2 1 1 13 13805 1 1 29 TRP CE3 C -16.438 -3.352 -2.452 1.00 . A A . 29 TRP CE3 1 1 13 13806 1 1 29 TRP CG C -14.874 -1.657 -3.661 1.00 . A A . 29 TRP CG 1 1 13 13807 1 1 29 TRP CH2 C -16.298 -5.579 -3.397 1.00 . A A . 29 TRP CH2 1 1 13 13808 1 1 29 TRP CZ2 C -15.375 -5.182 -4.324 1.00 . A A . 29 TRP CZ2 1 1 13 13809 1 1 29 TRP CZ3 C -16.830 -4.678 -2.466 1.00 . A A . 29 TRP CZ3 1 1 13 13810 1 1 29 TRP H H -13.910 1.319 -1.450 1.00 . A A . 29 TRP H 1 1 13 13811 1 1 29 TRP HA H -13.307 0.382 -3.796 1.00 . A A . 29 TRP HA 1 1 13 13812 1 1 29 TRP HB2 H -14.891 -0.511 -1.895 1.00 . A A . 29 TRP HB2 1 1 13 13813 1 1 29 TRP HB3 H -16.150 -0.101 -3.052 1.00 . A A . 29 TRP HB3 1 1 13 13814 1 1 29 TRP HD1 H -13.410 -1.102 -5.156 1.00 . A A . 29 TRP HD1 1 1 13 13815 1 1 29 TRP HE1 H -13.570 -3.577 -5.842 1.00 . A A . 29 TRP HE1 1 1 13 13816 1 1 29 TRP HE3 H -16.859 -2.671 -1.726 1.00 . A A . 29 TRP HE3 1 1 13 13817 1 1 29 TRP HH2 H -16.634 -6.605 -3.372 1.00 . A A . 29 TRP HH2 1 1 13 13818 1 1 29 TRP HZ2 H -14.973 -5.889 -5.035 1.00 . A A . 29 TRP HZ2 1 1 13 13819 1 1 29 TRP HZ3 H -17.558 -5.030 -1.750 1.00 . A A . 29 TRP HZ3 1 1 13 13820 1 1 29 TRP N N -13.985 1.692 -2.349 1.00 . A A . 29 TRP N 1 1 13 13821 1 1 29 TRP NE1 N -14.086 -3.180 -5.107 1.00 . A A . 29 TRP NE1 1 1 13 13822 1 1 29 TRP O O -16.168 1.578 -4.630 1.00 . A A . 29 TRP O 1 1 13 13823 1 1 30 LYS C C -15.985 2.108 -7.196 1.00 . A A . 30 LYS C 1 1 13 13824 1 1 30 LYS CA C -14.629 2.664 -6.741 1.00 . A A . 30 LYS CA 1 1 13 13825 1 1 30 LYS CB C -13.619 2.512 -7.882 1.00 . A A . 30 LYS CB 1 1 13 13826 1 1 30 LYS CD C -14.214 4.732 -8.904 1.00 . A A . 30 LYS CD 1 1 13 13827 1 1 30 LYS CE C -14.610 5.460 -10.177 1.00 . A A . 30 LYS CE 1 1 13 13828 1 1 30 LYS CG C -14.024 3.245 -9.152 1.00 . A A . 30 LYS CG 1 1 13 13829 1 1 30 LYS H H -13.148 1.973 -5.338 1.00 . A A . 30 LYS H 1 1 13 13830 1 1 30 LYS HA H -14.745 3.712 -6.514 1.00 . A A . 30 LYS HA 1 1 13 13831 1 1 30 LYS HB2 H -12.662 2.893 -7.561 1.00 . A A . 30 LYS HB2 1 1 13 13832 1 1 30 LYS HB3 H -13.519 1.465 -8.120 1.00 . A A . 30 LYS HB3 1 1 13 13833 1 1 30 LYS HD2 H -14.990 4.868 -8.165 1.00 . A A . 30 LYS HD2 1 1 13 13834 1 1 30 LYS HD3 H -13.286 5.145 -8.536 1.00 . A A . 30 LYS HD3 1 1 13 13835 1 1 30 LYS HE2 H -13.830 5.324 -10.912 1.00 . A A . 30 LYS HE2 1 1 13 13836 1 1 30 LYS HE3 H -15.530 5.036 -10.548 1.00 . A A . 30 LYS HE3 1 1 13 13837 1 1 30 LYS HG2 H -13.253 3.110 -9.894 1.00 . A A . 30 LYS HG2 1 1 13 13838 1 1 30 LYS HG3 H -14.953 2.829 -9.514 1.00 . A A . 30 LYS HG3 1 1 13 13839 1 1 30 LYS HZ1 H -15.055 7.390 -10.838 1.00 . A A . 30 LYS HZ1 1 1 13 13840 1 1 30 LYS HZ2 H -13.933 7.341 -9.572 1.00 . A A . 30 LYS HZ2 1 1 13 13841 1 1 30 LYS HZ3 H -15.573 7.070 -9.260 1.00 . A A . 30 LYS HZ3 1 1 13 13842 1 1 30 LYS N N -14.130 1.989 -5.523 1.00 . A A . 30 LYS N 1 1 13 13843 1 1 30 LYS NZ N -14.806 6.917 -9.946 1.00 . A A . 30 LYS NZ 1 1 13 13844 1 1 30 LYS O O -16.829 2.846 -7.701 1.00 . A A . 30 LYS O 1 1 13 13845 1 1 31 ASP C C -18.078 -0.445 -6.133 1.00 . A A . 31 ASP C 1 1 13 13846 1 1 31 ASP CA C -17.428 0.149 -7.381 1.00 . A A . 31 ASP CA 1 1 13 13847 1 1 31 ASP CB C -17.182 -0.947 -8.420 1.00 . A A . 31 ASP CB 1 1 13 13848 1 1 31 ASP CG C -18.451 -1.687 -8.793 1.00 . A A . 31 ASP CG 1 1 13 13849 1 1 31 ASP H H -15.447 0.262 -6.648 1.00 . A A . 31 ASP H 1 1 13 13850 1 1 31 ASP HA H -18.086 0.896 -7.799 1.00 . A A . 31 ASP HA 1 1 13 13851 1 1 31 ASP HB2 H -16.771 -0.502 -9.315 1.00 . A A . 31 ASP HB2 1 1 13 13852 1 1 31 ASP HB3 H -16.475 -1.660 -8.021 1.00 . A A . 31 ASP HB3 1 1 13 13853 1 1 31 ASP N N -16.174 0.802 -7.022 1.00 . A A . 31 ASP N 1 1 13 13854 1 1 31 ASP O O -18.393 -1.635 -6.088 1.00 . A A . 31 ASP O 1 1 13 13855 1 1 31 ASP OD1 O -19.209 -1.175 -9.644 1.00 . A A . 31 ASP OD1 1 1 13 13856 1 1 31 ASP OD2 O -18.687 -2.779 -8.233 1.00 . A A . 31 ASP OD2 1 1 13 13857 1 1 32 GLY C C -19.644 1.042 -3.166 1.00 . A A . 32 GLY C 1 1 13 13858 1 1 32 GLY CA C -18.860 -0.047 -3.873 1.00 . A A . 32 GLY CA 1 1 13 13859 1 1 32 GLY H H -18.021 1.339 -5.230 1.00 . A A . 32 GLY H 1 1 13 13860 1 1 32 GLY HA2 H -19.516 -0.881 -4.069 1.00 . A A . 32 GLY HA2 1 1 13 13861 1 1 32 GLY HA3 H -18.060 -0.373 -3.217 1.00 . A A . 32 GLY HA3 1 1 13 13862 1 1 32 GLY N N -18.275 0.399 -5.123 1.00 . A A . 32 GLY N 1 1 13 13863 1 1 32 GLY O O -20.054 2.026 -3.781 1.00 . A A . 32 GLY O 1 1 13 13864 1 1 33 GLY C C -20.149 1.824 0.374 1.00 . A A . 33 GLY C 1 1 13 13865 1 1 33 GLY CA C -20.586 1.824 -1.078 1.00 . A A . 33 GLY CA 1 1 13 13866 1 1 33 GLY H H -19.506 0.043 -1.439 1.00 . A A . 33 GLY H 1 1 13 13867 1 1 33 GLY HA2 H -20.422 2.807 -1.492 1.00 . A A . 33 GLY HA2 1 1 13 13868 1 1 33 GLY HA3 H -21.640 1.594 -1.125 1.00 . A A . 33 GLY HA3 1 1 13 13869 1 1 33 GLY N N -19.856 0.852 -1.868 1.00 . A A . 33 GLY N 1 1 13 13870 1 1 33 GLY O O -20.936 2.133 1.268 1.00 . A A . 33 GLY O 1 1 13 13871 1 1 34 ASP C C -16.885 1.870 1.977 1.00 . A A . 34 ASP C 1 1 13 13872 1 1 34 ASP CA C -18.345 1.423 1.961 1.00 . A A . 34 ASP CA 1 1 13 13873 1 1 34 ASP CB C -18.464 0.005 2.528 1.00 . A A . 34 ASP CB 1 1 13 13874 1 1 34 ASP CG C -19.895 -0.500 2.529 1.00 . A A . 34 ASP CG 1 1 13 13875 1 1 34 ASP H H -18.308 1.236 -0.147 1.00 . A A . 34 ASP H 1 1 13 13876 1 1 34 ASP HA H -18.923 2.097 2.575 1.00 . A A . 34 ASP HA 1 1 13 13877 1 1 34 ASP HB2 H -17.867 -0.668 1.929 1.00 . A A . 34 ASP HB2 1 1 13 13878 1 1 34 ASP HB3 H -18.098 -0.003 3.544 1.00 . A A . 34 ASP HB3 1 1 13 13879 1 1 34 ASP N N -18.888 1.470 0.608 1.00 . A A . 34 ASP N 1 1 13 13880 1 1 34 ASP O O -16.303 2.153 0.930 1.00 . A A . 34 ASP O 1 1 13 13881 1 1 34 ASP OD1 O -20.377 -0.917 1.455 1.00 . A A . 34 ASP OD1 1 1 13 13882 1 1 34 ASP OD2 O -20.532 -0.476 3.603 1.00 . A A . 34 ASP OD2 1 1 13 13883 1 1 35 CYS C C -14.185 1.453 4.325 1.00 . A A . 35 CYS C 1 1 13 13884 1 1 35 CYS CA C -14.908 2.345 3.321 1.00 . A A . 35 CYS CA 1 1 13 13885 1 1 35 CYS CB C -14.830 3.806 3.768 1.00 . A A . 35 CYS CB 1 1 13 13886 1 1 35 CYS H H -16.818 1.697 3.968 1.00 . A A . 35 CYS H 1 1 13 13887 1 1 35 CYS HA H -14.428 2.246 2.358 1.00 . A A . 35 CYS HA 1 1 13 13888 1 1 35 CYS HB2 H -15.392 3.924 4.682 1.00 . A A . 35 CYS HB2 1 1 13 13889 1 1 35 CYS HB3 H -13.797 4.063 3.952 1.00 . A A . 35 CYS HB3 1 1 13 13890 1 1 35 CYS HG H -16.807 4.979 2.663 1.00 . A A . 35 CYS HG 1 1 13 13891 1 1 35 CYS N N -16.301 1.933 3.169 1.00 . A A . 35 CYS N 1 1 13 13892 1 1 35 CYS O O -14.630 1.293 5.461 1.00 . A A . 35 CYS O 1 1 13 13893 1 1 35 CYS SG S -15.486 4.985 2.564 1.00 . A A . 35 CYS SG 1 1 13 13894 1 1 36 GLU C C -10.789 0.177 4.514 1.00 . A A . 36 GLU C 1 1 13 13895 1 1 36 GLU CA C -12.284 -0.005 4.761 1.00 . A A . 36 GLU CA 1 1 13 13896 1 1 36 GLU CB C -12.680 -1.463 4.525 1.00 . A A . 36 GLU CB 1 1 13 13897 1 1 36 GLU CD C -12.415 -2.107 6.954 1.00 . A A . 36 GLU CD 1 1 13 13898 1 1 36 GLU CG C -12.058 -2.433 5.516 1.00 . A A . 36 GLU CG 1 1 13 13899 1 1 36 GLU H H -12.762 1.039 2.981 1.00 . A A . 36 GLU H 1 1 13 13900 1 1 36 GLU HA H -12.502 0.257 5.786 1.00 . A A . 36 GLU HA 1 1 13 13901 1 1 36 GLU HB2 H -13.755 -1.548 4.598 1.00 . A A . 36 GLU HB2 1 1 13 13902 1 1 36 GLU HB3 H -12.372 -1.751 3.532 1.00 . A A . 36 GLU HB3 1 1 13 13903 1 1 36 GLU HG2 H -12.408 -3.431 5.293 1.00 . A A . 36 GLU HG2 1 1 13 13904 1 1 36 GLU HG3 H -10.984 -2.398 5.410 1.00 . A A . 36 GLU HG3 1 1 13 13905 1 1 36 GLU N N -13.067 0.874 3.897 1.00 . A A . 36 GLU N 1 1 13 13906 1 1 36 GLU O O -10.381 0.749 3.503 1.00 . A A . 36 GLU O 1 1 13 13907 1 1 36 GLU OE1 O -13.521 -2.487 7.392 1.00 . A A . 36 GLU OE1 1 1 13 13908 1 1 36 GLU OE2 O -11.587 -1.473 7.642 1.00 . A A . 36 GLU OE2 1 1 13 13909 1 1 37 TRP C C -7.919 -1.452 4.715 1.00 . A A . 37 TRP C 1 1 13 13910 1 1 37 TRP CA C -8.527 -0.203 5.336 1.00 . A A . 37 TRP CA 1 1 13 13911 1 1 37 TRP CB C -7.912 0.019 6.716 1.00 . A A . 37 TRP CB 1 1 13 13912 1 1 37 TRP CD1 C -8.929 2.363 6.888 1.00 . A A . 37 TRP CD1 1 1 13 13913 1 1 37 TRP CD2 C -8.696 1.316 8.852 1.00 . A A . 37 TRP CD2 1 1 13 13914 1 1 37 TRP CE2 C -9.261 2.584 9.085 1.00 . A A . 37 TRP CE2 1 1 13 13915 1 1 37 TRP CE3 C -8.455 0.475 9.943 1.00 . A A . 37 TRP CE3 1 1 13 13916 1 1 37 TRP CG C -8.491 1.194 7.441 1.00 . A A . 37 TRP CG 1 1 13 13917 1 1 37 TRP CH2 C -9.345 2.186 11.410 1.00 . A A . 37 TRP CH2 1 1 13 13918 1 1 37 TRP CZ2 C -9.590 3.029 10.362 1.00 . A A . 37 TRP CZ2 1 1 13 13919 1 1 37 TRP CZ3 C -8.782 0.920 11.210 1.00 . A A . 37 TRP CZ3 1 1 13 13920 1 1 37 TRP H H -10.359 -0.754 6.231 1.00 . A A . 37 TRP H 1 1 13 13921 1 1 37 TRP HA H -8.302 0.646 4.710 1.00 . A A . 37 TRP HA 1 1 13 13922 1 1 37 TRP HB2 H -8.075 -0.861 7.320 1.00 . A A . 37 TRP HB2 1 1 13 13923 1 1 37 TRP HB3 H -6.851 0.180 6.606 1.00 . A A . 37 TRP HB3 1 1 13 13924 1 1 37 TRP HD1 H -8.908 2.580 5.831 1.00 . A A . 37 TRP HD1 1 1 13 13925 1 1 37 TRP HE1 H -9.762 4.101 7.723 1.00 . A A . 37 TRP HE1 1 1 13 13926 1 1 37 TRP HE3 H -8.023 -0.506 9.808 1.00 . A A . 37 TRP HE3 1 1 13 13927 1 1 37 TRP HH2 H -9.583 2.492 12.418 1.00 . A A . 37 TRP HH2 1 1 13 13928 1 1 37 TRP HZ2 H -10.024 4.003 10.532 1.00 . A A . 37 TRP HZ2 1 1 13 13929 1 1 37 TRP HZ3 H -8.604 0.283 12.065 1.00 . A A . 37 TRP HZ3 1 1 13 13930 1 1 37 TRP N N -9.975 -0.313 5.446 1.00 . A A . 37 TRP N 1 1 13 13931 1 1 37 TRP NE1 N -9.394 3.203 7.869 1.00 . A A . 37 TRP NE1 1 1 13 13932 1 1 37 TRP O O -8.410 -2.563 4.915 1.00 . A A . 37 TRP O 1 1 13 13933 1 1 38 VAL C C -5.074 -2.905 4.267 1.00 . A A . 38 VAL C 1 1 13 13934 1 1 38 VAL CA C -6.146 -2.370 3.331 1.00 . A A . 38 VAL CA 1 1 13 13935 1 1 38 VAL CB C -5.496 -1.958 1.998 1.00 . A A . 38 VAL CB 1 1 13 13936 1 1 38 VAL CG1 C -4.881 -3.169 1.314 1.00 . A A . 38 VAL CG1 1 1 13 13937 1 1 38 VAL CG2 C -6.517 -1.290 1.093 1.00 . A A . 38 VAL CG2 1 1 13 13938 1 1 38 VAL H H -6.511 -0.344 3.824 1.00 . A A . 38 VAL H 1 1 13 13939 1 1 38 VAL HA H -6.867 -3.151 3.136 1.00 . A A . 38 VAL HA 1 1 13 13940 1 1 38 VAL HB H -4.709 -1.249 2.206 1.00 . A A . 38 VAL HB 1 1 13 13941 1 1 38 VAL HG11 H -3.895 -3.349 1.718 1.00 . A A . 38 VAL HG11 1 1 13 13942 1 1 38 VAL HG12 H -4.809 -2.988 0.254 1.00 . A A . 38 VAL HG12 1 1 13 13943 1 1 38 VAL HG13 H -5.502 -4.033 1.487 1.00 . A A . 38 VAL HG13 1 1 13 13944 1 1 38 VAL HG21 H -7.275 -0.813 1.696 1.00 . A A . 38 VAL HG21 1 1 13 13945 1 1 38 VAL HG22 H -6.977 -2.032 0.459 1.00 . A A . 38 VAL HG22 1 1 13 13946 1 1 38 VAL HG23 H -6.023 -0.549 0.483 1.00 . A A . 38 VAL HG23 1 1 13 13947 1 1 38 VAL N N -6.842 -1.260 3.962 1.00 . A A . 38 VAL N 1 1 13 13948 1 1 38 VAL O O -4.663 -2.223 5.206 1.00 . A A . 38 VAL O 1 1 13 13949 1 1 39 LYS C C -2.265 -4.050 4.763 1.00 . A A . 39 LYS C 1 1 13 13950 1 1 39 LYS CA C -3.616 -4.741 4.860 1.00 . A A . 39 LYS CA 1 1 13 13951 1 1 39 LYS CB C -3.479 -6.228 4.526 1.00 . A A . 39 LYS CB 1 1 13 13952 1 1 39 LYS CD C -2.397 -8.433 5.070 1.00 . A A . 39 LYS CD 1 1 13 13953 1 1 39 LYS CE C -3.327 -9.159 6.030 1.00 . A A . 39 LYS CE 1 1 13 13954 1 1 39 LYS CG C -2.392 -6.933 5.320 1.00 . A A . 39 LYS CG 1 1 13 13955 1 1 39 LYS H H -4.978 -4.620 3.251 1.00 . A A . 39 LYS H 1 1 13 13956 1 1 39 LYS HA H -3.960 -4.640 5.870 1.00 . A A . 39 LYS HA 1 1 13 13957 1 1 39 LYS HB2 H -4.419 -6.719 4.728 1.00 . A A . 39 LYS HB2 1 1 13 13958 1 1 39 LYS HB3 H -3.251 -6.329 3.476 1.00 . A A . 39 LYS HB3 1 1 13 13959 1 1 39 LYS HD2 H -2.725 -8.619 4.059 1.00 . A A . 39 LYS HD2 1 1 13 13960 1 1 39 LYS HD3 H -1.394 -8.813 5.200 1.00 . A A . 39 LYS HD3 1 1 13 13961 1 1 39 LYS HE2 H -3.285 -10.217 5.820 1.00 . A A . 39 LYS HE2 1 1 13 13962 1 1 39 LYS HE3 H -2.990 -8.980 7.041 1.00 . A A . 39 LYS HE3 1 1 13 13963 1 1 39 LYS HG2 H -1.432 -6.535 5.028 1.00 . A A . 39 LYS HG2 1 1 13 13964 1 1 39 LYS HG3 H -2.553 -6.752 6.373 1.00 . A A . 39 LYS HG3 1 1 13 13965 1 1 39 LYS HZ1 H -5.010 -8.661 4.898 1.00 . A A . 39 LYS HZ1 1 1 13 13966 1 1 39 LYS HZ2 H -4.842 -7.750 6.312 1.00 . A A . 39 LYS HZ2 1 1 13 13967 1 1 39 LYS HZ3 H -5.375 -9.352 6.398 1.00 . A A . 39 LYS HZ3 1 1 13 13968 1 1 39 LYS N N -4.622 -4.123 4.014 1.00 . A A . 39 LYS N 1 1 13 13969 1 1 39 LYS NZ N -4.737 -8.698 5.900 1.00 . A A . 39 LYS NZ 1 1 13 13970 1 1 39 LYS O O -1.583 -4.119 3.741 1.00 . A A . 39 LYS O 1 1 13 13971 1 1 40 GLY C C 0.434 -3.522 6.621 1.00 . A A . 40 GLY C 1 1 13 13972 1 1 40 GLY CA C -0.616 -2.699 5.911 1.00 . A A . 40 GLY CA 1 1 13 13973 1 1 40 GLY H H -2.497 -3.346 6.616 1.00 . A A . 40 GLY H 1 1 13 13974 1 1 40 GLY HA2 H -0.279 -2.503 4.908 1.00 . A A . 40 GLY HA2 1 1 13 13975 1 1 40 GLY HA3 H -0.739 -1.763 6.432 1.00 . A A . 40 GLY HA3 1 1 13 13976 1 1 40 GLY N N -1.891 -3.383 5.851 1.00 . A A . 40 GLY N 1 1 13 13977 1 1 40 GLY O O 1.222 -3.000 7.410 1.00 . A A . 40 GLY O 1 1 13 13978 1 1 41 VAL C C 2.256 -6.372 5.859 1.00 . A A . 41 VAL C 1 1 13 13979 1 1 41 VAL CA C 1.393 -5.732 6.942 1.00 . A A . 41 VAL CA 1 1 13 13980 1 1 41 VAL CB C 0.710 -6.862 7.732 1.00 . A A . 41 VAL CB 1 1 13 13981 1 1 41 VAL CG1 C 1.675 -7.463 8.741 1.00 . A A . 41 VAL CG1 1 1 13 13982 1 1 41 VAL CG2 C -0.556 -6.366 8.417 1.00 . A A . 41 VAL CG2 1 1 13 13983 1 1 41 VAL H H -0.247 -5.173 5.735 1.00 . A A . 41 VAL H 1 1 13 13984 1 1 41 VAL HA H 2.021 -5.173 7.619 1.00 . A A . 41 VAL HA 1 1 13 13985 1 1 41 VAL HB H 0.439 -7.637 7.032 1.00 . A A . 41 VAL HB 1 1 13 13986 1 1 41 VAL HG11 H 1.179 -8.251 9.288 1.00 . A A . 41 VAL HG11 1 1 13 13987 1 1 41 VAL HG12 H 1.998 -6.696 9.430 1.00 . A A . 41 VAL HG12 1 1 13 13988 1 1 41 VAL HG13 H 2.532 -7.866 8.224 1.00 . A A . 41 VAL HG13 1 1 13 13989 1 1 41 VAL HG21 H -0.312 -5.545 9.074 1.00 . A A . 41 VAL HG21 1 1 13 13990 1 1 41 VAL HG22 H -0.993 -7.170 8.992 1.00 . A A . 41 VAL HG22 1 1 13 13991 1 1 41 VAL HG23 H -1.262 -6.033 7.671 1.00 . A A . 41 VAL HG23 1 1 13 13992 1 1 41 VAL N N 0.427 -4.819 6.351 1.00 . A A . 41 VAL N 1 1 13 13993 1 1 41 VAL O O 3.083 -7.236 6.148 1.00 . A A . 41 VAL O 1 1 13 13994 1 1 42 HIS C C 4.251 -6.022 3.521 1.00 . A A . 42 HIS C 1 1 13 13995 1 1 42 HIS CA C 2.825 -6.509 3.503 1.00 . A A . 42 HIS CA 1 1 13 13996 1 1 42 HIS CB C 2.133 -6.221 2.170 1.00 . A A . 42 HIS CB 1 1 13 13997 1 1 42 HIS CD2 C 0.622 -8.239 1.564 1.00 . A A . 42 HIS CD2 1 1 13 13998 1 1 42 HIS CE1 C 1.877 -9.119 -0.003 1.00 . A A . 42 HIS CE1 1 1 13 13999 1 1 42 HIS CG C 1.724 -7.461 1.439 1.00 . A A . 42 HIS CG 1 1 13 14000 1 1 42 HIS H H 1.418 -5.231 4.428 1.00 . A A . 42 HIS H 1 1 13 14001 1 1 42 HIS HA H 2.864 -7.561 3.650 1.00 . A A . 42 HIS HA 1 1 13 14002 1 1 42 HIS HB2 H 1.238 -5.639 2.357 1.00 . A A . 42 HIS HB2 1 1 13 14003 1 1 42 HIS HB3 H 2.799 -5.658 1.531 1.00 . A A . 42 HIS HB3 1 1 13 14004 1 1 42 HIS HD1 H 3.354 -7.708 0.128 1.00 . A A . 42 HIS HD1 1 1 13 14005 1 1 42 HIS HD2 H -0.198 -8.083 2.250 1.00 . A A . 42 HIS HD2 1 1 13 14006 1 1 42 HIS HE1 H 2.241 -9.770 -0.781 1.00 . A A . 42 HIS HE1 1 1 13 14007 1 1 42 HIS HE2 H 0.143 -10.035 0.587 1.00 . A A . 42 HIS HE2 1 1 13 14008 1 1 42 HIS N N 2.067 -5.946 4.608 1.00 . A A . 42 HIS N 1 1 13 14009 1 1 42 HIS ND1 N 2.490 -8.039 0.450 1.00 . A A . 42 HIS ND1 1 1 13 14010 1 1 42 HIS NE2 N 0.742 -9.262 0.656 1.00 . A A . 42 HIS NE2 1 1 13 14011 1 1 42 HIS O O 4.655 -5.174 2.727 1.00 . A A . 42 HIS O 1 1 13 14012 1 1 43 VAL C C 7.264 -6.525 3.426 1.00 . A A . 43 VAL C 1 1 13 14013 1 1 43 VAL CA C 6.405 -6.303 4.655 1.00 . A A . 43 VAL CA 1 1 13 14014 1 1 43 VAL CB C 6.977 -7.108 5.841 1.00 . A A . 43 VAL CB 1 1 13 14015 1 1 43 VAL CG1 C 6.762 -8.601 5.636 1.00 . A A . 43 VAL CG1 1 1 13 14016 1 1 43 VAL CG2 C 8.453 -6.799 6.054 1.00 . A A . 43 VAL CG2 1 1 13 14017 1 1 43 VAL H H 4.571 -7.287 5.020 1.00 . A A . 43 VAL H 1 1 13 14018 1 1 43 VAL HA H 6.468 -5.265 4.904 1.00 . A A . 43 VAL HA 1 1 13 14019 1 1 43 VAL HB H 6.441 -6.812 6.729 1.00 . A A . 43 VAL HB 1 1 13 14020 1 1 43 VAL HG11 H 5.712 -8.795 5.476 1.00 . A A . 43 VAL HG11 1 1 13 14021 1 1 43 VAL HG12 H 7.096 -9.135 6.513 1.00 . A A . 43 VAL HG12 1 1 13 14022 1 1 43 VAL HG13 H 7.324 -8.934 4.778 1.00 . A A . 43 VAL HG13 1 1 13 14023 1 1 43 VAL HG21 H 8.611 -5.733 5.983 1.00 . A A . 43 VAL HG21 1 1 13 14024 1 1 43 VAL HG22 H 9.040 -7.301 5.299 1.00 . A A . 43 VAL HG22 1 1 13 14025 1 1 43 VAL HG23 H 8.755 -7.143 7.032 1.00 . A A . 43 VAL HG23 1 1 13 14026 1 1 43 VAL N N 5.000 -6.618 4.441 1.00 . A A . 43 VAL N 1 1 13 14027 1 1 43 VAL O O 8.057 -7.464 3.357 1.00 . A A . 43 VAL O 1 1 13 14028 1 1 44 ALA C C 9.101 -4.780 1.442 1.00 . A A . 44 ALA C 1 1 13 14029 1 1 44 ALA CA C 7.894 -5.683 1.249 1.00 . A A . 44 ALA CA 1 1 13 14030 1 1 44 ALA CB C 7.074 -5.263 0.038 1.00 . A A . 44 ALA CB 1 1 13 14031 1 1 44 ALA H H 6.412 -4.952 2.557 1.00 . A A . 44 ALA H 1 1 13 14032 1 1 44 ALA HA H 8.237 -6.697 1.107 1.00 . A A . 44 ALA HA 1 1 13 14033 1 1 44 ALA HB1 H 6.796 -4.224 0.133 1.00 . A A . 44 ALA HB1 1 1 13 14034 1 1 44 ALA HB2 H 6.182 -5.871 -0.021 1.00 . A A . 44 ALA HB2 1 1 13 14035 1 1 44 ALA HB3 H 7.660 -5.399 -0.858 1.00 . A A . 44 ALA HB3 1 1 13 14036 1 1 44 ALA N N 7.095 -5.646 2.455 1.00 . A A . 44 ALA N 1 1 13 14037 1 1 44 ALA O O 9.405 -3.929 0.606 1.00 . A A . 44 ALA O 1 1 13 14038 1 1 45 GLU C C 11.861 -3.970 1.731 1.00 . A A . 45 GLU C 1 1 13 14039 1 1 45 GLU CA C 10.957 -4.190 2.931 1.00 . A A . 45 GLU CA 1 1 13 14040 1 1 45 GLU CB C 11.736 -4.884 4.050 1.00 . A A . 45 GLU CB 1 1 13 14041 1 1 45 GLU CD C 13.687 -4.796 5.647 1.00 . A A . 45 GLU CD 1 1 13 14042 1 1 45 GLU CG C 12.963 -4.113 4.505 1.00 . A A . 45 GLU CG 1 1 13 14043 1 1 45 GLU H H 9.501 -5.706 3.162 1.00 . A A . 45 GLU H 1 1 13 14044 1 1 45 GLU HA H 10.610 -3.232 3.288 1.00 . A A . 45 GLU HA 1 1 13 14045 1 1 45 GLU HB2 H 11.084 -5.013 4.900 1.00 . A A . 45 GLU HB2 1 1 13 14046 1 1 45 GLU HB3 H 12.057 -5.854 3.701 1.00 . A A . 45 GLU HB3 1 1 13 14047 1 1 45 GLU HG2 H 13.644 -4.019 3.672 1.00 . A A . 45 GLU HG2 1 1 13 14048 1 1 45 GLU HG3 H 12.655 -3.130 4.831 1.00 . A A . 45 GLU HG3 1 1 13 14049 1 1 45 GLU N N 9.785 -4.984 2.567 1.00 . A A . 45 GLU N 1 1 13 14050 1 1 45 GLU O O 12.541 -2.952 1.627 1.00 . A A . 45 GLU O 1 1 13 14051 1 1 45 GLU OE1 O 14.516 -5.690 5.373 1.00 . A A . 45 GLU OE1 1 1 13 14052 1 1 45 GLU OE2 O 13.424 -4.441 6.816 1.00 . A A . 45 GLU OE2 1 1 13 14053 1 1 46 ASP C C 12.143 -3.735 -1.282 1.00 . A A . 46 ASP C 1 1 13 14054 1 1 46 ASP CA C 12.666 -4.839 -0.382 1.00 . A A . 46 ASP CA 1 1 13 14055 1 1 46 ASP CB C 12.669 -6.169 -1.127 1.00 . A A . 46 ASP CB 1 1 13 14056 1 1 46 ASP CG C 11.274 -6.624 -1.503 1.00 . A A . 46 ASP CG 1 1 13 14057 1 1 46 ASP H H 11.274 -5.715 0.966 1.00 . A A . 46 ASP H 1 1 13 14058 1 1 46 ASP HA H 13.678 -4.593 -0.091 1.00 . A A . 46 ASP HA 1 1 13 14059 1 1 46 ASP HB2 H 13.250 -6.063 -2.029 1.00 . A A . 46 ASP HB2 1 1 13 14060 1 1 46 ASP HB3 H 13.118 -6.922 -0.498 1.00 . A A . 46 ASP HB3 1 1 13 14061 1 1 46 ASP N N 11.852 -4.929 0.824 1.00 . A A . 46 ASP N 1 1 13 14062 1 1 46 ASP O O 12.910 -2.914 -1.784 1.00 . A A . 46 ASP O 1 1 13 14063 1 1 46 ASP OD1 O 10.607 -7.258 -0.658 1.00 . A A . 46 ASP OD1 1 1 13 14064 1 1 46 ASP OD2 O 10.846 -6.346 -2.644 1.00 . A A . 46 ASP OD2 1 1 13 14065 1 1 47 VAL C C 10.530 -1.315 -1.750 1.00 . A A . 47 VAL C 1 1 13 14066 1 1 47 VAL CA C 10.209 -2.697 -2.302 1.00 . A A . 47 VAL CA 1 1 13 14067 1 1 47 VAL CB C 8.686 -2.890 -2.373 1.00 . A A . 47 VAL CB 1 1 13 14068 1 1 47 VAL CG1 C 8.052 -1.811 -3.236 1.00 . A A . 47 VAL CG1 1 1 13 14069 1 1 47 VAL CG2 C 8.349 -4.273 -2.910 1.00 . A A . 47 VAL CG2 1 1 13 14070 1 1 47 VAL H H 10.268 -4.385 -1.032 1.00 . A A . 47 VAL H 1 1 13 14071 1 1 47 VAL HA H 10.611 -2.782 -3.299 1.00 . A A . 47 VAL HA 1 1 13 14072 1 1 47 VAL HB H 8.285 -2.808 -1.374 1.00 . A A . 47 VAL HB 1 1 13 14073 1 1 47 VAL HG11 H 8.360 -1.947 -4.262 1.00 . A A . 47 VAL HG11 1 1 13 14074 1 1 47 VAL HG12 H 8.371 -0.839 -2.889 1.00 . A A . 47 VAL HG12 1 1 13 14075 1 1 47 VAL HG13 H 6.977 -1.882 -3.170 1.00 . A A . 47 VAL HG13 1 1 13 14076 1 1 47 VAL HG21 H 7.285 -4.438 -2.838 1.00 . A A . 47 VAL HG21 1 1 13 14077 1 1 47 VAL HG22 H 8.869 -5.020 -2.330 1.00 . A A . 47 VAL HG22 1 1 13 14078 1 1 47 VAL HG23 H 8.656 -4.342 -3.943 1.00 . A A . 47 VAL HG23 1 1 13 14079 1 1 47 VAL N N 10.830 -3.712 -1.472 1.00 . A A . 47 VAL N 1 1 13 14080 1 1 47 VAL O O 10.886 -0.425 -2.487 1.00 . A A . 47 VAL O 1 1 13 14081 1 1 48 ALA C C 12.156 0.374 0.326 1.00 . A A . 48 ALA C 1 1 13 14082 1 1 48 ALA CA C 10.673 0.026 0.334 1.00 . A A . 48 ALA CA 1 1 13 14083 1 1 48 ALA CB C 10.201 -0.164 1.768 1.00 . A A . 48 ALA CB 1 1 13 14084 1 1 48 ALA H H 10.121 -1.962 0.039 1.00 . A A . 48 ALA H 1 1 13 14085 1 1 48 ALA HA H 10.111 0.843 -0.087 1.00 . A A . 48 ALA HA 1 1 13 14086 1 1 48 ALA HB1 H 10.369 0.746 2.326 1.00 . A A . 48 ALA HB1 1 1 13 14087 1 1 48 ALA HB2 H 10.752 -0.972 2.224 1.00 . A A . 48 ALA HB2 1 1 13 14088 1 1 48 ALA HB3 H 9.148 -0.399 1.771 1.00 . A A . 48 ALA HB3 1 1 13 14089 1 1 48 ALA N N 10.406 -1.194 -0.434 1.00 . A A . 48 ALA N 1 1 13 14090 1 1 48 ALA O O 12.546 1.450 -0.124 1.00 . A A . 48 ALA O 1 1 13 14091 1 1 49 LYS C C 14.935 -0.017 -0.526 1.00 . A A . 49 LYS C 1 1 13 14092 1 1 49 LYS CA C 14.420 -0.314 0.871 1.00 . A A . 49 LYS CA 1 1 13 14093 1 1 49 LYS CB C 15.146 -1.527 1.460 1.00 . A A . 49 LYS CB 1 1 13 14094 1 1 49 LYS CD C 13.954 -1.129 3.639 1.00 . A A . 49 LYS CD 1 1 13 14095 1 1 49 LYS CE C 14.095 -1.059 5.151 1.00 . A A . 49 LYS CE 1 1 13 14096 1 1 49 LYS CG C 15.274 -1.481 2.974 1.00 . A A . 49 LYS CG 1 1 13 14097 1 1 49 LYS H H 12.619 -1.394 1.156 1.00 . A A . 49 LYS H 1 1 13 14098 1 1 49 LYS HA H 14.600 0.545 1.500 1.00 . A A . 49 LYS HA 1 1 13 14099 1 1 49 LYS HB2 H 14.606 -2.422 1.191 1.00 . A A . 49 LYS HB2 1 1 13 14100 1 1 49 LYS HB3 H 16.139 -1.576 1.037 1.00 . A A . 49 LYS HB3 1 1 13 14101 1 1 49 LYS HD2 H 13.622 -0.169 3.274 1.00 . A A . 49 LYS HD2 1 1 13 14102 1 1 49 LYS HD3 H 13.224 -1.884 3.391 1.00 . A A . 49 LYS HD3 1 1 13 14103 1 1 49 LYS HE2 H 14.402 -2.029 5.515 1.00 . A A . 49 LYS HE2 1 1 13 14104 1 1 49 LYS HE3 H 14.850 -0.327 5.395 1.00 . A A . 49 LYS HE3 1 1 13 14105 1 1 49 LYS HG2 H 15.597 -2.449 3.328 1.00 . A A . 49 LYS HG2 1 1 13 14106 1 1 49 LYS HG3 H 16.011 -0.736 3.241 1.00 . A A . 49 LYS HG3 1 1 13 14107 1 1 49 LYS HZ1 H 12.066 -1.348 5.550 1.00 . A A . 49 LYS HZ1 1 1 13 14108 1 1 49 LYS HZ2 H 12.531 0.278 5.512 1.00 . A A . 49 LYS HZ2 1 1 13 14109 1 1 49 LYS HZ3 H 12.931 -0.685 6.844 1.00 . A A . 49 LYS HZ3 1 1 13 14110 1 1 49 LYS N N 12.982 -0.543 0.828 1.00 . A A . 49 LYS N 1 1 13 14111 1 1 49 LYS NZ N 12.817 -0.677 5.810 1.00 . A A . 49 LYS NZ 1 1 13 14112 1 1 49 LYS O O 15.894 0.733 -0.706 1.00 . A A . 49 LYS O 1 1 13 14113 1 1 50 ASP C C 13.867 0.743 -3.501 1.00 . A A . 50 ASP C 1 1 13 14114 1 1 50 ASP CA C 14.678 -0.403 -2.896 1.00 . A A . 50 ASP CA 1 1 13 14115 1 1 50 ASP CB C 14.533 -1.708 -3.699 1.00 . A A . 50 ASP CB 1 1 13 14116 1 1 50 ASP CG C 13.180 -1.902 -4.374 1.00 . A A . 50 ASP CG 1 1 13 14117 1 1 50 ASP H H 13.557 -1.229 -1.310 1.00 . A A . 50 ASP H 1 1 13 14118 1 1 50 ASP HA H 15.721 -0.113 -2.898 1.00 . A A . 50 ASP HA 1 1 13 14119 1 1 50 ASP HB2 H 15.291 -1.729 -4.463 1.00 . A A . 50 ASP HB2 1 1 13 14120 1 1 50 ASP HB3 H 14.691 -2.538 -3.021 1.00 . A A . 50 ASP HB3 1 1 13 14121 1 1 50 ASP N N 14.300 -0.622 -1.514 1.00 . A A . 50 ASP N 1 1 13 14122 1 1 50 ASP O O 14.243 1.307 -4.529 1.00 . A A . 50 ASP O 1 1 13 14123 1 1 50 ASP OD1 O 12.747 -1.004 -5.127 1.00 . A A . 50 ASP OD1 1 1 13 14124 1 1 50 ASP OD2 O 12.571 -2.971 -4.172 1.00 . A A . 50 ASP OD2 1 1 13 14125 1 1 51 TYR C C 12.551 3.490 -3.040 1.00 . A A . 51 TYR C 1 1 13 14126 1 1 51 TYR CA C 11.903 2.157 -3.340 1.00 . A A . 51 TYR CA 1 1 13 14127 1 1 51 TYR CB C 10.521 2.142 -2.690 1.00 . A A . 51 TYR CB 1 1 13 14128 1 1 51 TYR CD1 C 9.739 0.730 -4.640 1.00 . A A . 51 TYR CD1 1 1 13 14129 1 1 51 TYR CD2 C 8.074 1.677 -3.217 1.00 . A A . 51 TYR CD2 1 1 13 14130 1 1 51 TYR CE1 C 8.753 0.141 -5.407 1.00 . A A . 51 TYR CE1 1 1 13 14131 1 1 51 TYR CE2 C 7.085 1.091 -3.984 1.00 . A A . 51 TYR CE2 1 1 13 14132 1 1 51 TYR CG C 9.422 1.508 -3.530 1.00 . A A . 51 TYR CG 1 1 13 14133 1 1 51 TYR CZ C 7.391 0.372 -5.063 1.00 . A A . 51 TYR CZ 1 1 13 14134 1 1 51 TYR H H 12.492 0.607 -2.051 1.00 . A A . 51 TYR H 1 1 13 14135 1 1 51 TYR HA H 11.789 2.018 -4.381 1.00 . A A . 51 TYR HA 1 1 13 14136 1 1 51 TYR HB2 H 10.589 1.602 -1.778 1.00 . A A . 51 TYR HB2 1 1 13 14137 1 1 51 TYR HB3 H 10.222 3.158 -2.474 1.00 . A A . 51 TYR HB3 1 1 13 14138 1 1 51 TYR HD1 H 10.775 0.589 -4.905 1.00 . A A . 51 TYR HD1 1 1 13 14139 1 1 51 TYR HD2 H 7.801 2.283 -2.369 1.00 . A A . 51 TYR HD2 1 1 13 14140 1 1 51 TYR HE1 H 9.022 -0.459 -6.264 1.00 . A A . 51 TYR HE1 1 1 13 14141 1 1 51 TYR HE2 H 6.046 1.234 -3.723 1.00 . A A . 51 TYR HE2 1 1 13 14142 1 1 51 TYR HH H 6.703 -1.163 -6.053 1.00 . A A . 51 TYR HH 1 1 13 14143 1 1 51 TYR N N 12.749 1.084 -2.859 1.00 . A A . 51 TYR N 1 1 13 14144 1 1 51 TYR O O 12.907 4.252 -3.938 1.00 . A A . 51 TYR O 1 1 13 14145 1 1 51 TYR OH O 6.446 -0.263 -5.837 1.00 . A A . 51 TYR OH 1 1 13 14146 1 1 52 GLU C C 14.805 4.867 -1.112 1.00 . A A . 52 GLU C 1 1 13 14147 1 1 52 GLU CA C 13.292 4.981 -1.265 1.00 . A A . 52 GLU CA 1 1 13 14148 1 1 52 GLU CB C 12.658 5.391 0.070 1.00 . A A . 52 GLU CB 1 1 13 14149 1 1 52 GLU CD C 12.447 4.957 2.554 1.00 . A A . 52 GLU CD 1 1 13 14150 1 1 52 GLU CG C 13.143 4.578 1.262 1.00 . A A . 52 GLU CG 1 1 13 14151 1 1 52 GLU H H 12.460 3.047 -1.097 1.00 . A A . 52 GLU H 1 1 13 14152 1 1 52 GLU HA H 13.071 5.734 -1.998 1.00 . A A . 52 GLU HA 1 1 13 14153 1 1 52 GLU HB2 H 12.885 6.431 0.258 1.00 . A A . 52 GLU HB2 1 1 13 14154 1 1 52 GLU HB3 H 11.587 5.275 -0.004 1.00 . A A . 52 GLU HB3 1 1 13 14155 1 1 52 GLU HG2 H 12.959 3.532 1.067 1.00 . A A . 52 GLU HG2 1 1 13 14156 1 1 52 GLU HG3 H 14.204 4.739 1.383 1.00 . A A . 52 GLU HG3 1 1 13 14157 1 1 52 GLU N N 12.714 3.739 -1.746 1.00 . A A . 52 GLU N 1 1 13 14158 1 1 52 GLU O O 15.558 5.708 -1.606 1.00 . A A . 52 GLU O 1 1 13 14159 1 1 52 GLU OE1 O 12.706 6.067 3.064 1.00 . A A . 52 GLU OE1 1 1 13 14160 1 1 52 GLU OE2 O 11.643 4.144 3.056 1.00 . A A . 52 GLU OE2 1 1 13 14161 1 1 53 ASP C C 17.356 3.091 -1.447 1.00 . A A . 53 ASP C 1 1 13 14162 1 1 53 ASP CA C 16.658 3.589 -0.185 1.00 . A A . 53 ASP CA 1 1 13 14163 1 1 53 ASP CB C 16.838 2.590 0.958 1.00 . A A . 53 ASP CB 1 1 13 14164 1 1 53 ASP CG C 17.086 3.274 2.288 1.00 . A A . 53 ASP CG 1 1 13 14165 1 1 53 ASP H H 14.591 3.175 -0.073 1.00 . A A . 53 ASP H 1 1 13 14166 1 1 53 ASP HA H 17.100 4.531 0.104 1.00 . A A . 53 ASP HA 1 1 13 14167 1 1 53 ASP HB2 H 15.939 1.995 1.047 1.00 . A A . 53 ASP HB2 1 1 13 14168 1 1 53 ASP HB3 H 17.676 1.946 0.739 1.00 . A A . 53 ASP HB3 1 1 13 14169 1 1 53 ASP N N 15.241 3.818 -0.423 1.00 . A A . 53 ASP N 1 1 13 14170 1 1 53 ASP O O 18.575 3.197 -1.573 1.00 . A A . 53 ASP O 1 1 13 14171 1 1 53 ASP OD1 O 16.114 3.786 2.883 1.00 . A A . 53 ASP OD1 1 1 13 14172 1 1 53 ASP OD2 O 18.252 3.299 2.735 1.00 . A A . 53 ASP OD2 1 1 13 14173 1 1 54 GLY C C 17.704 3.174 -4.474 1.00 . A A . 54 GLY C 1 1 13 14174 1 1 54 GLY CA C 17.148 2.053 -3.618 1.00 . A A . 54 GLY CA 1 1 13 14175 1 1 54 GLY H H 15.614 2.475 -2.223 1.00 . A A . 54 GLY H 1 1 13 14176 1 1 54 GLY HA2 H 17.946 1.363 -3.387 1.00 . A A . 54 GLY HA2 1 1 13 14177 1 1 54 GLY HA3 H 16.384 1.534 -4.175 1.00 . A A . 54 GLY HA3 1 1 13 14178 1 1 54 GLY N N 16.579 2.546 -2.378 1.00 . A A . 54 GLY N 1 1 13 14179 1 1 54 GLY O O 18.789 3.054 -5.041 1.00 . A A . 54 GLY O 1 1 13 14180 1 1 55 LEU C C 18.330 6.295 -4.543 1.00 . A A . 55 LEU C 1 1 13 14181 1 1 55 LEU CA C 17.379 5.422 -5.352 1.00 . A A . 55 LEU CA 1 1 13 14182 1 1 55 LEU CB C 16.170 6.244 -5.804 1.00 . A A . 55 LEU CB 1 1 13 14183 1 1 55 LEU CD1 C 14.189 6.527 -7.314 1.00 . A A . 55 LEU CD1 1 1 13 14184 1 1 55 LEU CD2 C 16.103 5.084 -8.028 1.00 . A A . 55 LEU CD2 1 1 13 14185 1 1 55 LEU CG C 15.275 5.570 -6.846 1.00 . A A . 55 LEU CG 1 1 13 14186 1 1 55 LEU H H 16.093 4.299 -4.100 1.00 . A A . 55 LEU H 1 1 13 14187 1 1 55 LEU HA H 17.900 5.054 -6.224 1.00 . A A . 55 LEU HA 1 1 13 14188 1 1 55 LEU HB2 H 15.568 6.469 -4.934 1.00 . A A . 55 LEU HB2 1 1 13 14189 1 1 55 LEU HB3 H 16.530 7.173 -6.220 1.00 . A A . 55 LEU HB3 1 1 13 14190 1 1 55 LEU HD11 H 14.643 7.385 -7.788 1.00 . A A . 55 LEU HD11 1 1 13 14191 1 1 55 LEU HD12 H 13.606 6.852 -6.465 1.00 . A A . 55 LEU HD12 1 1 13 14192 1 1 55 LEU HD13 H 13.545 6.023 -8.020 1.00 . A A . 55 LEU HD13 1 1 13 14193 1 1 55 LEU HD21 H 16.823 4.356 -7.687 1.00 . A A . 55 LEU HD21 1 1 13 14194 1 1 55 LEU HD22 H 16.620 5.921 -8.474 1.00 . A A . 55 LEU HD22 1 1 13 14195 1 1 55 LEU HD23 H 15.451 4.633 -8.762 1.00 . A A . 55 LEU HD23 1 1 13 14196 1 1 55 LEU HG H 14.795 4.713 -6.398 1.00 . A A . 55 LEU HG 1 1 13 14197 1 1 55 LEU N N 16.953 4.268 -4.569 1.00 . A A . 55 LEU N 1 1 13 14198 1 1 55 LEU O O 19.487 6.482 -4.918 1.00 . A A . 55 LEU O 1 1 13 14199 1 1 56 GLU C C 19.405 6.827 -1.546 1.00 . A A . 56 GLU C 1 1 13 14200 1 1 56 GLU CA C 18.646 7.672 -2.562 1.00 . A A . 56 GLU CA 1 1 13 14201 1 1 56 GLU CB C 17.771 8.694 -1.840 1.00 . A A . 56 GLU CB 1 1 13 14202 1 1 56 GLU CD C 17.906 10.392 -3.704 1.00 . A A . 56 GLU CD 1 1 13 14203 1 1 56 GLU CG C 17.000 9.609 -2.775 1.00 . A A . 56 GLU CG 1 1 13 14204 1 1 56 GLU H H 16.903 6.645 -3.186 1.00 . A A . 56 GLU H 1 1 13 14205 1 1 56 GLU HA H 19.355 8.194 -3.179 1.00 . A A . 56 GLU HA 1 1 13 14206 1 1 56 GLU HB2 H 17.064 8.165 -1.225 1.00 . A A . 56 GLU HB2 1 1 13 14207 1 1 56 GLU HB3 H 18.398 9.305 -1.209 1.00 . A A . 56 GLU HB3 1 1 13 14208 1 1 56 GLU HG2 H 16.329 9.010 -3.374 1.00 . A A . 56 GLU HG2 1 1 13 14209 1 1 56 GLU HG3 H 16.425 10.307 -2.184 1.00 . A A . 56 GLU HG3 1 1 13 14210 1 1 56 GLU N N 17.835 6.826 -3.429 1.00 . A A . 56 GLU N 1 1 13 14211 1 1 56 GLU O O 19.211 6.963 -0.339 1.00 . A A . 56 GLU O 1 1 13 14212 1 1 56 GLU OE1 O 18.444 11.434 -3.270 1.00 . A A . 56 GLU OE1 1 1 13 14213 1 1 56 GLU OE2 O 18.080 9.966 -4.864 1.00 . A A . 56 GLU OE2 1 1 13 14214 1 1 57 TYR C C 22.276 5.814 -0.634 1.00 . A A . 57 TYR C 1 1 13 14215 1 1 57 TYR CA C 21.063 5.077 -1.192 1.00 . A A . 57 TYR CA 1 1 13 14216 1 1 57 TYR CB C 21.512 3.841 -1.974 1.00 . A A . 57 TYR CB 1 1 13 14217 1 1 57 TYR CD1 C 21.896 1.933 -0.368 1.00 . A A . 57 TYR CD1 1 1 13 14218 1 1 57 TYR CD2 C 23.802 3.037 -1.277 1.00 . A A . 57 TYR CD2 1 1 13 14219 1 1 57 TYR CE1 C 22.721 1.090 0.351 1.00 . A A . 57 TYR CE1 1 1 13 14220 1 1 57 TYR CE2 C 24.635 2.197 -0.561 1.00 . A A . 57 TYR CE2 1 1 13 14221 1 1 57 TYR CG C 22.420 2.919 -1.192 1.00 . A A . 57 TYR CG 1 1 13 14222 1 1 57 TYR CZ C 24.091 1.218 0.242 1.00 . A A . 57 TYR CZ 1 1 13 14223 1 1 57 TYR H H 20.380 5.896 -3.020 1.00 . A A . 57 TYR H 1 1 13 14224 1 1 57 TYR HA H 20.437 4.765 -0.369 1.00 . A A . 57 TYR HA 1 1 13 14225 1 1 57 TYR HB2 H 20.641 3.274 -2.271 1.00 . A A . 57 TYR HB2 1 1 13 14226 1 1 57 TYR HB3 H 22.045 4.159 -2.859 1.00 . A A . 57 TYR HB3 1 1 13 14227 1 1 57 TYR HD1 H 20.823 1.828 -0.291 1.00 . A A . 57 TYR HD1 1 1 13 14228 1 1 57 TYR HD2 H 24.227 3.799 -1.913 1.00 . A A . 57 TYR HD2 1 1 13 14229 1 1 57 TYR HE1 H 22.294 0.328 0.987 1.00 . A A . 57 TYR HE1 1 1 13 14230 1 1 57 TYR HE2 H 25.706 2.303 -0.641 1.00 . A A . 57 TYR HE2 1 1 13 14231 1 1 57 TYR HH H 24.628 -0.521 0.850 1.00 . A A . 57 TYR HH 1 1 13 14232 1 1 57 TYR N N 20.271 5.953 -2.048 1.00 . A A . 57 TYR N 1 1 13 14233 1 1 57 TYR O O 22.158 6.404 0.461 1.00 . A A . 57 TYR O 1 1 13 14234 1 1 57 TYR OXT O 23.335 5.795 -1.296 1.00 . A A . 57 TYR OXT 1 1 13 14235 1 1 57 TYR OH O 24.916 0.388 0.965 1.00 . A A . 57 TYR OH 1 1 13 14236 2 2 1 ALA C C -15.299 -8.526 3.607 1.00 . B B . 1 ALA C 1 1 13 14237 2 2 1 ALA CA C -15.286 -10.033 3.363 1.00 . B B . 1 ALA CA 1 1 13 14238 2 2 1 ALA CB C -16.474 -10.440 2.505 1.00 . B B . 1 ALA CB 1 1 13 14239 2 2 1 ALA H1 H -16.154 -10.548 5.188 1.00 . B B . 1 ALA H1 1 1 13 14240 2 2 1 ALA H2 H -14.463 -10.528 5.214 1.00 . B B . 1 ALA H2 1 1 13 14241 2 2 1 ALA H3 H -15.283 -11.804 4.463 1.00 . B B . 1 ALA H3 1 1 13 14242 2 2 1 ALA HA H -14.383 -10.291 2.828 1.00 . B B . 1 ALA HA 1 1 13 14243 2 2 1 ALA HB1 H -17.391 -10.177 3.011 1.00 . B B . 1 ALA HB1 1 1 13 14244 2 2 1 ALA HB2 H -16.449 -11.507 2.338 1.00 . B B . 1 ALA HB2 1 1 13 14245 2 2 1 ALA HB3 H -16.426 -9.927 1.556 1.00 . B B . 1 ALA HB3 1 1 13 14246 2 2 1 ALA N N -15.297 -10.781 4.646 1.00 . B B . 1 ALA N 1 1 13 14247 2 2 1 ALA O O -16.362 -7.922 3.751 1.00 . B B . 1 ALA O 1 1 13 14248 2 2 2 PRO C C -14.391 -5.629 2.670 1.00 . B B . 2 PRO C 1 1 13 14249 2 2 2 PRO CA C -13.983 -6.455 3.889 1.00 . B B . 2 PRO CA 1 1 13 14250 2 2 2 PRO CB C -12.490 -6.278 4.170 1.00 . B B . 2 PRO CB 1 1 13 14251 2 2 2 PRO CD C -12.794 -8.551 3.498 1.00 . B B . 2 PRO CD 1 1 13 14252 2 2 2 PRO CG C -11.836 -7.393 3.432 1.00 . B B . 2 PRO CG 1 1 13 14253 2 2 2 PRO HA H -14.553 -6.140 4.749 1.00 . B B . 2 PRO HA 1 1 13 14254 2 2 2 PRO HB2 H -12.164 -5.315 3.804 1.00 . B B . 2 PRO HB2 1 1 13 14255 2 2 2 PRO HB3 H -12.309 -6.347 5.232 1.00 . B B . 2 PRO HB3 1 1 13 14256 2 2 2 PRO HD2 H -12.758 -9.123 2.583 1.00 . B B . 2 PRO HD2 1 1 13 14257 2 2 2 PRO HD3 H -12.571 -9.179 4.348 1.00 . B B . 2 PRO HD3 1 1 13 14258 2 2 2 PRO HG2 H -11.667 -7.104 2.405 1.00 . B B . 2 PRO HG2 1 1 13 14259 2 2 2 PRO HG3 H -10.903 -7.652 3.909 1.00 . B B . 2 PRO HG3 1 1 13 14260 2 2 2 PRO N N -14.110 -7.899 3.658 1.00 . B B . 2 PRO N 1 1 13 14261 2 2 2 PRO O O -13.696 -5.628 1.654 1.00 . B B . 2 PRO O 1 1 13 14262 2 2 3 PRO C C -15.205 -2.797 1.493 1.00 . B B . 3 PRO C 1 1 13 14263 2 2 3 PRO CA C -16.016 -4.079 1.650 1.00 . B B . 3 PRO CA 1 1 13 14264 2 2 3 PRO CB C -17.449 -3.754 2.069 1.00 . B B . 3 PRO CB 1 1 13 14265 2 2 3 PRO CD C -16.428 -4.866 3.922 1.00 . B B . 3 PRO CD 1 1 13 14266 2 2 3 PRO CG C -17.421 -3.796 3.557 1.00 . B B . 3 PRO CG 1 1 13 14267 2 2 3 PRO HA H -16.022 -4.620 0.716 1.00 . B B . 3 PRO HA 1 1 13 14268 2 2 3 PRO HB2 H -17.720 -2.774 1.703 1.00 . B B . 3 PRO HB2 1 1 13 14269 2 2 3 PRO HB3 H -18.123 -4.494 1.665 1.00 . B B . 3 PRO HB3 1 1 13 14270 2 2 3 PRO HD2 H -15.887 -4.589 4.815 1.00 . B B . 3 PRO HD2 1 1 13 14271 2 2 3 PRO HD3 H -16.928 -5.813 4.061 1.00 . B B . 3 PRO HD3 1 1 13 14272 2 2 3 PRO HG2 H -17.101 -2.840 3.944 1.00 . B B . 3 PRO HG2 1 1 13 14273 2 2 3 PRO HG3 H -18.400 -4.048 3.936 1.00 . B B . 3 PRO HG3 1 1 13 14274 2 2 3 PRO N N -15.527 -4.914 2.753 1.00 . B B . 3 PRO N 1 1 13 14275 2 2 3 PRO O O -15.732 -1.696 1.650 1.00 . B B . 3 PRO O 1 1 13 14276 2 2 4 GLY C C -11.591 -2.155 0.977 1.00 . B B . 4 GLY C 1 1 13 14277 2 2 4 GLY CA C -13.062 -1.788 1.010 1.00 . B B . 4 GLY CA 1 1 13 14278 2 2 4 GLY H H -13.556 -3.848 1.067 1.00 . B B . 4 GLY H 1 1 13 14279 2 2 4 GLY HA2 H -13.320 -1.297 0.084 1.00 . B B . 4 GLY HA2 1 1 13 14280 2 2 4 GLY HA3 H -13.232 -1.103 1.828 1.00 . B B . 4 GLY HA3 1 1 13 14281 2 2 4 GLY N N -13.922 -2.946 1.182 1.00 . B B . 4 GLY N 1 1 13 14282 2 2 4 GLY O O -10.869 -1.949 1.952 1.00 . B B . 4 GLY O 1 1 13 14283 2 2 5 THR C C -9.312 -3.040 -1.767 1.00 . B B . 5 THR C 1 1 13 14284 2 2 5 THR CA C -9.755 -3.100 -0.308 1.00 . B B . 5 THR CA 1 1 13 14285 2 2 5 THR CB C -9.518 -4.520 0.233 1.00 . B B . 5 THR CB 1 1 13 14286 2 2 5 THR CG2 C -9.829 -4.592 1.721 1.00 . B B . 5 THR CG2 1 1 13 14287 2 2 5 THR H H -11.769 -2.821 -0.898 1.00 . B B . 5 THR H 1 1 13 14288 2 2 5 THR HA H -9.149 -2.413 0.264 1.00 . B B . 5 THR HA 1 1 13 14289 2 2 5 THR HB H -8.479 -4.778 0.085 1.00 . B B . 5 THR HB 1 1 13 14290 2 2 5 THR HG1 H -11.208 -5.078 -0.617 1.00 . B B . 5 THR HG1 1 1 13 14291 2 2 5 THR HG21 H -9.631 -5.590 2.083 1.00 . B B . 5 THR HG21 1 1 13 14292 2 2 5 THR HG22 H -10.868 -4.349 1.882 1.00 . B B . 5 THR HG22 1 1 13 14293 2 2 5 THR HG23 H -9.207 -3.887 2.253 1.00 . B B . 5 THR HG23 1 1 13 14294 2 2 5 THR N N -11.148 -2.700 -0.151 1.00 . B B . 5 THR N 1 1 13 14295 2 2 5 THR O O -10.133 -2.935 -2.677 1.00 . B B . 5 THR O 1 1 13 14296 2 2 5 THR OG1 O -10.338 -5.458 -0.475 1.00 . B B . 5 THR OG1 1 1 13 14297 2 2 6 ALA C C -5.997 -3.608 -3.287 1.00 . B B . 6 ALA C 1 1 13 14298 2 2 6 ALA CA C -7.426 -3.076 -3.312 1.00 . B B . 6 ALA CA 1 1 13 14299 2 2 6 ALA CB C -7.468 -1.662 -3.875 1.00 . B B . 6 ALA CB 1 1 13 14300 2 2 6 ALA H H -7.402 -3.187 -1.202 1.00 . B B . 6 ALA H 1 1 13 14301 2 2 6 ALA HA H -8.026 -3.712 -3.949 1.00 . B B . 6 ALA HA 1 1 13 14302 2 2 6 ALA HB1 H -7.917 -0.999 -3.150 1.00 . B B . 6 ALA HB1 1 1 13 14303 2 2 6 ALA HB2 H -8.055 -1.654 -4.781 1.00 . B B . 6 ALA HB2 1 1 13 14304 2 2 6 ALA HB3 H -6.466 -1.331 -4.094 1.00 . B B . 6 ALA HB3 1 1 13 14305 2 2 6 ALA N N -8.001 -3.110 -1.973 1.00 . B B . 6 ALA N 1 1 13 14306 2 2 6 ALA O O -5.575 -4.217 -2.304 1.00 . B B . 6 ALA O 1 1 13 14307 2 2 7 ARG C C -3.036 -3.015 -5.392 1.00 . B B . 7 ARG C 1 1 13 14308 2 2 7 ARG CA C -3.874 -3.859 -4.438 1.00 . B B . 7 ARG CA 1 1 13 14309 2 2 7 ARG CB C -3.851 -5.323 -4.881 1.00 . B B . 7 ARG CB 1 1 13 14310 2 2 7 ARG CD C -4.524 -7.695 -4.411 1.00 . B B . 7 ARG CD 1 1 13 14311 2 2 7 ARG CG C -4.582 -6.255 -3.932 1.00 . B B . 7 ARG CG 1 1 13 14312 2 2 7 ARG CZ C -5.276 -9.916 -3.672 1.00 . B B . 7 ARG CZ 1 1 13 14313 2 2 7 ARG H H -5.633 -2.887 -5.118 1.00 . B B . 7 ARG H 1 1 13 14314 2 2 7 ARG HA H -3.448 -3.790 -3.448 1.00 . B B . 7 ARG HA 1 1 13 14315 2 2 7 ARG HB2 H -4.312 -5.400 -5.854 1.00 . B B . 7 ARG HB2 1 1 13 14316 2 2 7 ARG HB3 H -2.823 -5.649 -4.953 1.00 . B B . 7 ARG HB3 1 1 13 14317 2 2 7 ARG HD2 H -5.067 -7.774 -5.341 1.00 . B B . 7 ARG HD2 1 1 13 14318 2 2 7 ARG HD3 H -3.491 -7.965 -4.575 1.00 . B B . 7 ARG HD3 1 1 13 14319 2 2 7 ARG HE H -5.382 -8.253 -2.576 1.00 . B B . 7 ARG HE 1 1 13 14320 2 2 7 ARG HG2 H -4.124 -6.192 -2.955 1.00 . B B . 7 ARG HG2 1 1 13 14321 2 2 7 ARG HG3 H -5.616 -5.948 -3.866 1.00 . B B . 7 ARG HG3 1 1 13 14322 2 2 7 ARG HH11 H -4.524 -9.851 -5.547 1.00 . B B . 7 ARG HH11 1 1 13 14323 2 2 7 ARG HH12 H -5.048 -11.413 -5.011 1.00 . B B . 7 ARG HH12 1 1 13 14324 2 2 7 ARG HH21 H -6.075 -10.304 -1.857 1.00 . B B . 7 ARG HH21 1 1 13 14325 2 2 7 ARG HH22 H -5.930 -11.671 -2.912 1.00 . B B . 7 ARG HH22 1 1 13 14326 2 2 7 ARG N N -5.252 -3.382 -4.364 1.00 . B B . 7 ARG N 1 1 13 14327 2 2 7 ARG NE N -5.107 -8.618 -3.443 1.00 . B B . 7 ARG NE 1 1 13 14328 2 2 7 ARG NH1 N -4.920 -10.436 -4.839 1.00 . B B . 7 ARG NH1 1 1 13 14329 2 2 7 ARG NH2 N -5.803 -10.694 -2.737 1.00 . B B . 7 ARG NH2 1 1 13 14330 2 2 7 ARG O O -3.262 -3.011 -6.603 1.00 . B B . 7 ARG O 1 1 13 14331 2 2 8 ARG C C -0.425 -2.257 -6.674 1.00 . B B . 8 ARG C 1 1 13 14332 2 2 8 ARG CA C -1.177 -1.455 -5.615 1.00 . B B . 8 ARG CA 1 1 13 14333 2 2 8 ARG CB C -0.177 -0.742 -4.704 1.00 . B B . 8 ARG CB 1 1 13 14334 2 2 8 ARG CD C -0.399 -1.148 -2.236 1.00 . B B . 8 ARG CD 1 1 13 14335 2 2 8 ARG CG C 0.292 -1.582 -3.521 1.00 . B B . 8 ARG CG 1 1 13 14336 2 2 8 ARG CZ C -0.702 -3.031 -0.650 1.00 . B B . 8 ARG CZ 1 1 13 14337 2 2 8 ARG H H -1.954 -2.328 -3.860 1.00 . B B . 8 ARG H 1 1 13 14338 2 2 8 ARG HA H -1.784 -0.712 -6.111 1.00 . B B . 8 ARG HA 1 1 13 14339 2 2 8 ARG HB2 H 0.689 -0.468 -5.286 1.00 . B B . 8 ARG HB2 1 1 13 14340 2 2 8 ARG HB3 H -0.638 0.156 -4.318 1.00 . B B . 8 ARG HB3 1 1 13 14341 2 2 8 ARG HD2 H -0.126 -0.123 -2.031 1.00 . B B . 8 ARG HD2 1 1 13 14342 2 2 8 ARG HD3 H -1.463 -1.207 -2.378 1.00 . B B . 8 ARG HD3 1 1 13 14343 2 2 8 ARG HE H 0.793 -1.710 -0.603 1.00 . B B . 8 ARG HE 1 1 13 14344 2 2 8 ARG HG2 H 0.060 -2.618 -3.711 1.00 . B B . 8 ARG HG2 1 1 13 14345 2 2 8 ARG HG3 H 1.359 -1.462 -3.405 1.00 . B B . 8 ARG HG3 1 1 13 14346 2 2 8 ARG HH11 H -2.126 -2.965 -2.082 1.00 . B B . 8 ARG HH11 1 1 13 14347 2 2 8 ARG HH12 H -2.296 -4.238 -0.929 1.00 . B B . 8 ARG HH12 1 1 13 14348 2 2 8 ARG HH21 H 0.537 -3.381 0.901 1.00 . B B . 8 ARG HH21 1 1 13 14349 2 2 8 ARG HH22 H -0.794 -4.477 0.756 1.00 . B B . 8 ARG HH22 1 1 13 14350 2 2 8 ARG N N -2.066 -2.299 -4.831 1.00 . B B . 8 ARG N 1 1 13 14351 2 2 8 ARG NE N -0.016 -1.971 -1.088 1.00 . B B . 8 ARG NE 1 1 13 14352 2 2 8 ARG NH1 N -1.798 -3.443 -1.273 1.00 . B B . 8 ARG NH1 1 1 13 14353 2 2 8 ARG NH2 N -0.285 -3.683 0.424 1.00 . B B . 8 ARG NH2 1 1 13 14354 2 2 8 ARG O O -0.363 -1.854 -7.834 1.00 . B B . 8 ARG O 1 1 13 14355 2 2 9 LYS C C 0.853 -5.691 -6.804 1.00 . B B . 9 LYS C 1 1 13 14356 2 2 9 LYS CA C 0.900 -4.218 -7.207 1.00 . B B . 9 LYS CA 1 1 13 14357 2 2 9 LYS CB C 2.353 -3.745 -7.268 1.00 . B B . 9 LYS CB 1 1 13 14358 2 2 9 LYS CD C 3.977 -1.943 -7.935 1.00 . B B . 9 LYS CD 1 1 13 14359 2 2 9 LYS CE C 4.134 -0.561 -8.548 1.00 . B B . 9 LYS CE 1 1 13 14360 2 2 9 LYS CG C 2.514 -2.349 -7.848 1.00 . B B . 9 LYS CG 1 1 13 14361 2 2 9 LYS H H 0.066 -3.673 -5.342 1.00 . B B . 9 LYS H 1 1 13 14362 2 2 9 LYS HA H 0.449 -4.102 -8.183 1.00 . B B . 9 LYS HA 1 1 13 14363 2 2 9 LYS HB2 H 2.761 -3.744 -6.265 1.00 . B B . 9 LYS HB2 1 1 13 14364 2 2 9 LYS HB3 H 2.922 -4.432 -7.875 1.00 . B B . 9 LYS HB3 1 1 13 14365 2 2 9 LYS HD2 H 4.397 -1.935 -6.940 1.00 . B B . 9 LYS HD2 1 1 13 14366 2 2 9 LYS HD3 H 4.505 -2.662 -8.546 1.00 . B B . 9 LYS HD3 1 1 13 14367 2 2 9 LYS HE2 H 3.684 -0.564 -9.530 1.00 . B B . 9 LYS HE2 1 1 13 14368 2 2 9 LYS HE3 H 3.624 0.156 -7.921 1.00 . B B . 9 LYS HE3 1 1 13 14369 2 2 9 LYS HG2 H 2.088 -2.331 -8.841 1.00 . B B . 9 LYS HG2 1 1 13 14370 2 2 9 LYS HG3 H 1.990 -1.645 -7.217 1.00 . B B . 9 LYS HG3 1 1 13 14371 2 2 9 LYS HZ1 H 5.636 0.800 -9.051 1.00 . B B . 9 LYS HZ1 1 1 13 14372 2 2 9 LYS HZ2 H 6.059 -0.817 -9.316 1.00 . B B . 9 LYS HZ2 1 1 13 14373 2 2 9 LYS HZ3 H 6.027 -0.197 -7.743 1.00 . B B . 9 LYS HZ3 1 1 13 14374 2 2 9 LYS N N 0.148 -3.389 -6.275 1.00 . B B . 9 LYS N 1 1 13 14375 2 2 9 LYS NZ N 5.564 -0.166 -8.673 1.00 . B B . 9 LYS NZ 1 1 13 14376 2 2 9 LYS O O 0.143 -6.065 -5.871 1.00 . B B . 9 LYS O 1 1 13 14377 2 2 10 ARG C C 2.019 -8.179 -5.756 1.00 . B B . 10 ARG C 1 1 13 14378 2 2 10 ARG CA C 1.669 -7.947 -7.219 1.00 . B B . 10 ARG CA 1 1 13 14379 2 2 10 ARG CB C 2.730 -8.608 -8.093 1.00 . B B . 10 ARG CB 1 1 13 14380 2 2 10 ARG CD C 5.214 -8.877 -8.404 1.00 . B B . 10 ARG CD 1 1 13 14381 2 2 10 ARG CG C 4.095 -7.960 -7.938 1.00 . B B . 10 ARG CG 1 1 13 14382 2 2 10 ARG CZ C 7.672 -8.927 -8.404 1.00 . B B . 10 ARG CZ 1 1 13 14383 2 2 10 ARG H H 2.160 -6.171 -8.246 1.00 . B B . 10 ARG H 1 1 13 14384 2 2 10 ARG HA H 0.705 -8.381 -7.434 1.00 . B B . 10 ARG HA 1 1 13 14385 2 2 10 ARG HB2 H 2.812 -9.651 -7.820 1.00 . B B . 10 ARG HB2 1 1 13 14386 2 2 10 ARG HB3 H 2.432 -8.533 -9.127 1.00 . B B . 10 ARG HB3 1 1 13 14387 2 2 10 ARG HD2 H 5.152 -9.805 -7.856 1.00 . B B . 10 ARG HD2 1 1 13 14388 2 2 10 ARG HD3 H 5.089 -9.072 -9.458 1.00 . B B . 10 ARG HD3 1 1 13 14389 2 2 10 ARG HE H 6.565 -7.364 -7.850 1.00 . B B . 10 ARG HE 1 1 13 14390 2 2 10 ARG HG2 H 4.118 -7.054 -8.525 1.00 . B B . 10 ARG HG2 1 1 13 14391 2 2 10 ARG HG3 H 4.247 -7.714 -6.896 1.00 . B B . 10 ARG HG3 1 1 13 14392 2 2 10 ARG HH11 H 6.786 -10.630 -9.038 1.00 . B B . 10 ARG HH11 1 1 13 14393 2 2 10 ARG HH12 H 8.519 -10.654 -9.026 1.00 . B B . 10 ARG HH12 1 1 13 14394 2 2 10 ARG HH21 H 8.843 -7.385 -7.828 1.00 . B B . 10 ARG HH21 1 1 13 14395 2 2 10 ARG HH22 H 9.688 -8.810 -8.336 1.00 . B B . 10 ARG HH22 1 1 13 14396 2 2 10 ARG N N 1.615 -6.523 -7.512 1.00 . B B . 10 ARG N 1 1 13 14397 2 2 10 ARG NE N 6.531 -8.285 -8.183 1.00 . B B . 10 ARG NE 1 1 13 14398 2 2 10 ARG NH1 N 7.658 -10.173 -8.860 1.00 . B B . 10 ARG NH1 1 1 13 14399 2 2 10 ARG NH2 N 8.830 -8.325 -8.171 1.00 . B B . 10 ARG NH2 1 1 13 14400 2 2 10 ARG O O 1.606 -9.170 -5.153 1.00 . B B . 10 ARG O 1 1 13 14401 2 2 11 LYS C C 4.475 -8.189 -3.694 1.00 . B B . 11 LYS C 1 1 13 14402 2 2 11 LYS CA C 3.233 -7.315 -3.809 1.00 . B B . 11 LYS CA 1 1 13 14403 2 2 11 LYS CB C 2.140 -7.847 -2.883 1.00 . B B . 11 LYS CB 1 1 13 14404 2 2 11 LYS CD C -0.203 -7.657 -2.035 1.00 . B B . 11 LYS CD 1 1 13 14405 2 2 11 LYS CE C -1.566 -7.008 -2.216 1.00 . B B . 11 LYS CE 1 1 13 14406 2 2 11 LYS CG C 0.788 -7.187 -3.083 1.00 . B B . 11 LYS CG 1 1 13 14407 2 2 11 LYS H H 3.060 -6.478 -5.741 1.00 . B B . 11 LYS H 1 1 13 14408 2 2 11 LYS HA H 3.492 -6.312 -3.501 1.00 . B B . 11 LYS HA 1 1 13 14409 2 2 11 LYS HB2 H 2.027 -8.908 -3.045 1.00 . B B . 11 LYS HB2 1 1 13 14410 2 2 11 LYS HB3 H 2.446 -7.682 -1.862 1.00 . B B . 11 LYS HB3 1 1 13 14411 2 2 11 LYS HD2 H -0.313 -8.728 -2.114 1.00 . B B . 11 LYS HD2 1 1 13 14412 2 2 11 LYS HD3 H 0.181 -7.405 -1.057 1.00 . B B . 11 LYS HD3 1 1 13 14413 2 2 11 LYS HE2 H -1.459 -5.938 -2.104 1.00 . B B . 11 LYS HE2 1 1 13 14414 2 2 11 LYS HE3 H -1.928 -7.231 -3.208 1.00 . B B . 11 LYS HE3 1 1 13 14415 2 2 11 LYS HG2 H 0.903 -6.117 -3.004 1.00 . B B . 11 LYS HG2 1 1 13 14416 2 2 11 LYS HG3 H 0.412 -7.442 -4.063 1.00 . B B . 11 LYS HG3 1 1 13 14417 2 2 11 LYS HZ1 H -2.183 -7.374 -0.253 1.00 . B B . 11 LYS HZ1 1 1 13 14418 2 2 11 LYS HZ2 H -2.746 -8.511 -1.372 1.00 . B B . 11 LYS HZ2 1 1 13 14419 2 2 11 LYS HZ3 H -3.445 -6.973 -1.304 1.00 . B B . 11 LYS HZ3 1 1 13 14420 2 2 11 LYS N N 2.785 -7.245 -5.197 1.00 . B B . 11 LYS N 1 1 13 14421 2 2 11 LYS NZ N -2.555 -7.501 -1.216 1.00 . B B . 11 LYS NZ 1 1 13 14422 2 2 11 LYS O O 4.390 -9.416 -3.683 1.00 . B B . 11 LYS O 1 1 13 14423 2 2 12 ALA C C 6.854 -9.309 -2.405 1.00 . B B . 12 ALA C 1 1 13 14424 2 2 12 ALA CA C 6.902 -8.244 -3.497 1.00 . B B . 12 ALA CA 1 1 13 14425 2 2 12 ALA CB C 8.028 -7.257 -3.222 1.00 . B B . 12 ALA CB 1 1 13 14426 2 2 12 ALA H H 5.624 -6.562 -3.631 1.00 . B B . 12 ALA H 1 1 13 14427 2 2 12 ALA HA H 7.102 -8.725 -4.444 1.00 . B B . 12 ALA HA 1 1 13 14428 2 2 12 ALA HB1 H 8.071 -6.531 -4.020 1.00 . B B . 12 ALA HB1 1 1 13 14429 2 2 12 ALA HB2 H 8.966 -7.788 -3.168 1.00 . B B . 12 ALA HB2 1 1 13 14430 2 2 12 ALA HB3 H 7.844 -6.755 -2.285 1.00 . B B . 12 ALA HB3 1 1 13 14431 2 2 12 ALA N N 5.629 -7.541 -3.611 1.00 . B B . 12 ALA N 1 1 13 14432 2 2 12 ALA O O 7.611 -10.280 -2.441 1.00 . B B . 12 ALA O 1 1 13 14433 2 2 13 ASP C C 4.511 -10.841 -0.449 1.00 . B B . 13 ASP C 1 1 13 14434 2 2 13 ASP CA C 5.825 -10.074 -0.339 1.00 . B B . 13 ASP CA 1 1 13 14435 2 2 13 ASP CB C 5.893 -9.346 1.006 1.00 . B B . 13 ASP CB 1 1 13 14436 2 2 13 ASP CG C 5.880 -10.304 2.182 1.00 . B B . 13 ASP CG 1 1 13 14437 2 2 13 ASP H H 5.394 -8.328 -1.454 1.00 . B B . 13 ASP H 1 1 13 14438 2 2 13 ASP HA H 6.644 -10.775 -0.401 1.00 . B B . 13 ASP HA 1 1 13 14439 2 2 13 ASP HB2 H 6.802 -8.766 1.047 1.00 . B B . 13 ASP HB2 1 1 13 14440 2 2 13 ASP HB3 H 5.044 -8.685 1.093 1.00 . B B . 13 ASP HB3 1 1 13 14441 2 2 13 ASP N N 5.964 -9.123 -1.435 1.00 . B B . 13 ASP N 1 1 13 14442 2 2 13 ASP O O 3.762 -10.953 0.521 1.00 . B B . 13 ASP O 1 1 13 14443 2 2 13 ASP OD1 O 6.970 -10.758 2.588 1.00 . B B . 13 ASP OD1 1 1 13 14444 2 2 13 ASP OD2 O 4.781 -10.599 2.695 1.00 . B B . 13 ASP OD2 1 1 13 14445 2 2 14 SER C C 3.121 -13.532 -1.292 1.00 . B B . 14 SER C 1 1 13 14446 2 2 14 SER CA C 3.015 -12.127 -1.877 1.00 . B B . 14 SER CA 1 1 13 14447 2 2 14 SER CB C 2.723 -12.205 -3.376 1.00 . B B . 14 SER CB 1 1 13 14448 2 2 14 SER H H 4.876 -11.249 -2.372 1.00 . B B . 14 SER H 1 1 13 14449 2 2 14 SER HA H 2.205 -11.607 -1.388 1.00 . B B . 14 SER HA 1 1 13 14450 2 2 14 SER HB2 H 1.802 -12.747 -3.534 1.00 . B B . 14 SER HB2 1 1 13 14451 2 2 14 SER HB3 H 2.623 -11.205 -3.775 1.00 . B B . 14 SER HB3 1 1 13 14452 2 2 14 SER HG H 4.413 -12.226 -4.367 1.00 . B B . 14 SER HG 1 1 13 14453 2 2 14 SER N N 4.238 -11.371 -1.638 1.00 . B B . 14 SER N 1 1 13 14454 2 2 14 SER O O 3.581 -14.440 -2.017 1.00 . B B . 14 SER O 1 1 13 14455 2 2 14 SER OXT O 2.742 -13.712 -0.117 1.00 . B B . 14 SER OXT 1 1 13 14456 2 2 14 SER OG O 3.766 -12.870 -4.067 1.00 . B B . 14 SER OG 1 1 14 14457 1 1 1 GLY C C 10.781 4.989 -5.805 1.00 . A A . 1 GLY C 1 1 14 14458 1 1 1 GLY CA C 10.188 3.761 -6.473 1.00 . A A . 1 GLY CA 1 1 14 14459 1 1 1 GLY H1 H 8.264 4.548 -6.681 1.00 . A A . 1 GLY H1 1 1 14 14460 1 1 1 GLY H2 H 8.457 3.568 -5.315 1.00 . A A . 1 GLY H2 1 1 14 14461 1 1 1 GLY H3 H 8.339 2.867 -6.848 1.00 . A A . 1 GLY H3 1 1 14 14462 1 1 1 GLY HA2 H 10.634 2.877 -6.040 1.00 . A A . 1 GLY HA2 1 1 14 14463 1 1 1 GLY HA3 H 10.425 3.790 -7.527 1.00 . A A . 1 GLY HA3 1 1 14 14464 1 1 1 GLY N N 8.709 3.680 -6.318 1.00 . A A . 1 GLY N 1 1 14 14465 1 1 1 GLY O O 11.738 5.572 -6.312 1.00 . A A . 1 GLY O 1 1 14 14466 1 1 2 SER C C 9.860 6.795 -2.685 1.00 . A A . 2 SER C 1 1 14 14467 1 1 2 SER CA C 10.698 6.547 -3.931 1.00 . A A . 2 SER CA 1 1 14 14468 1 1 2 SER CB C 10.685 7.783 -4.826 1.00 . A A . 2 SER CB 1 1 14 14469 1 1 2 SER H H 9.464 4.865 -4.302 1.00 . A A . 2 SER H 1 1 14 14470 1 1 2 SER HA H 11.710 6.351 -3.623 1.00 . A A . 2 SER HA 1 1 14 14471 1 1 2 SER HB2 H 11.056 8.630 -4.269 1.00 . A A . 2 SER HB2 1 1 14 14472 1 1 2 SER HB3 H 11.321 7.610 -5.681 1.00 . A A . 2 SER HB3 1 1 14 14473 1 1 2 SER HG H 9.387 8.883 -5.800 1.00 . A A . 2 SER HG 1 1 14 14474 1 1 2 SER N N 10.217 5.379 -4.663 1.00 . A A . 2 SER N 1 1 14 14475 1 1 2 SER O O 10.371 7.253 -1.663 1.00 . A A . 2 SER O 1 1 14 14476 1 1 2 SER OG O 9.375 8.075 -5.282 1.00 . A A . 2 SER OG 1 1 14 14477 1 1 3 GLN C C 7.678 5.408 -0.787 1.00 . A A . 3 GLN C 1 1 14 14478 1 1 3 GLN CA C 7.681 6.664 -1.643 1.00 . A A . 3 GLN CA 1 1 14 14479 1 1 3 GLN CB C 6.269 6.979 -2.120 1.00 . A A . 3 GLN CB 1 1 14 14480 1 1 3 GLN CD C 4.737 8.615 -3.282 1.00 . A A . 3 GLN CD 1 1 14 14481 1 1 3 GLN CG C 6.155 8.311 -2.843 1.00 . A A . 3 GLN CG 1 1 14 14482 1 1 3 GLN H H 8.214 6.146 -3.614 1.00 . A A . 3 GLN H 1 1 14 14483 1 1 3 GLN HA H 8.042 7.487 -1.058 1.00 . A A . 3 GLN HA 1 1 14 14484 1 1 3 GLN HB2 H 5.958 6.203 -2.790 1.00 . A A . 3 GLN HB2 1 1 14 14485 1 1 3 GLN HB3 H 5.607 6.998 -1.268 1.00 . A A . 3 GLN HB3 1 1 14 14486 1 1 3 GLN HE21 H 5.066 10.565 -3.083 1.00 . A A . 3 GLN HE21 1 1 14 14487 1 1 3 GLN HE22 H 3.483 10.122 -3.612 1.00 . A A . 3 GLN HE22 1 1 14 14488 1 1 3 GLN HG2 H 6.485 9.096 -2.180 1.00 . A A . 3 GLN HG2 1 1 14 14489 1 1 3 GLN HG3 H 6.790 8.287 -3.716 1.00 . A A . 3 GLN HG3 1 1 14 14490 1 1 3 GLN N N 8.573 6.488 -2.771 1.00 . A A . 3 GLN N 1 1 14 14491 1 1 3 GLN NE2 N 4.394 9.897 -3.331 1.00 . A A . 3 GLN NE2 1 1 14 14492 1 1 3 GLN O O 7.708 4.294 -1.305 1.00 . A A . 3 GLN O 1 1 14 14493 1 1 3 GLN OE1 O 3.957 7.708 -3.574 1.00 . A A . 3 GLN OE1 1 1 14 14494 1 1 4 VAL C C 6.235 4.011 1.743 1.00 . A A . 4 VAL C 1 1 14 14495 1 1 4 VAL CA C 7.652 4.477 1.448 1.00 . A A . 4 VAL CA 1 1 14 14496 1 1 4 VAL CB C 8.359 4.851 2.765 1.00 . A A . 4 VAL CB 1 1 14 14497 1 1 4 VAL CG1 C 7.638 5.997 3.461 1.00 . A A . 4 VAL CG1 1 1 14 14498 1 1 4 VAL CG2 C 8.464 3.639 3.676 1.00 . A A . 4 VAL CG2 1 1 14 14499 1 1 4 VAL H H 7.606 6.505 0.873 1.00 . A A . 4 VAL H 1 1 14 14500 1 1 4 VAL HA H 8.197 3.666 0.988 1.00 . A A . 4 VAL HA 1 1 14 14501 1 1 4 VAL HB H 9.359 5.181 2.529 1.00 . A A . 4 VAL HB 1 1 14 14502 1 1 4 VAL HG11 H 8.173 6.265 4.360 1.00 . A A . 4 VAL HG11 1 1 14 14503 1 1 4 VAL HG12 H 6.635 5.691 3.718 1.00 . A A . 4 VAL HG12 1 1 14 14504 1 1 4 VAL HG13 H 7.596 6.849 2.799 1.00 . A A . 4 VAL HG13 1 1 14 14505 1 1 4 VAL HG21 H 8.239 3.930 4.691 1.00 . A A . 4 VAL HG21 1 1 14 14506 1 1 4 VAL HG22 H 9.465 3.238 3.629 1.00 . A A . 4 VAL HG22 1 1 14 14507 1 1 4 VAL HG23 H 7.763 2.888 3.352 1.00 . A A . 4 VAL HG23 1 1 14 14508 1 1 4 VAL N N 7.645 5.595 0.522 1.00 . A A . 4 VAL N 1 1 14 14509 1 1 4 VAL O O 5.852 3.836 2.899 1.00 . A A . 4 VAL O 1 1 14 14510 1 1 5 PHE C C 3.358 3.313 -0.515 1.00 . A A . 5 PHE C 1 1 14 14511 1 1 5 PHE CA C 4.080 3.360 0.833 1.00 . A A . 5 PHE CA 1 1 14 14512 1 1 5 PHE CB C 3.334 4.303 1.775 1.00 . A A . 5 PHE CB 1 1 14 14513 1 1 5 PHE CD1 C 4.514 6.328 0.650 1.00 . A A . 5 PHE CD1 1 1 14 14514 1 1 5 PHE CD2 C 4.369 5.358 2.825 1.00 . A A . 5 PHE CD2 1 1 14 14515 1 1 5 PHE CE1 C 5.870 6.525 0.825 1.00 . A A . 5 PHE CE1 1 1 14 14516 1 1 5 PHE CE2 C 5.725 5.554 3.005 1.00 . A A . 5 PHE CE2 1 1 14 14517 1 1 5 PHE CG C 3.748 5.744 1.647 1.00 . A A . 5 PHE CG 1 1 14 14518 1 1 5 PHE CZ C 4.518 8.405 1.413 1.00 . A A . 5 PHE CZ 1 1 14 14519 1 1 5 PHE H H 5.819 3.955 -0.215 1.00 . A A . 5 PHE H 1 1 14 14520 1 1 5 PHE HA H 4.096 2.364 1.270 1.00 . A A . 5 PHE HA 1 1 14 14521 1 1 5 PHE HB2 H 2.282 4.246 1.567 1.00 . A A . 5 PHE HB2 1 1 14 14522 1 1 5 PHE HB3 H 3.513 3.996 2.789 1.00 . A A . 5 PHE HB3 1 1 14 14523 1 1 5 PHE HD1 H 4.040 6.631 -0.272 1.00 . A A . 5 PHE HD1 1 1 14 14524 1 1 5 PHE HD2 H 3.783 4.901 3.608 1.00 . A A . 5 PHE HD2 1 1 14 14525 1 1 5 PHE HE1 H 6.455 6.981 0.040 1.00 . A A . 5 PHE HE1 1 1 14 14526 1 1 5 PHE HE2 H 6.198 5.251 3.927 1.00 . A A . 5 PHE HE2 1 1 14 14527 1 1 5 PHE HZ H 4.818 9.438 1.322 1.00 . A A . 5 PHE HZ 1 1 14 14528 1 1 5 PHE N N 5.458 3.806 0.683 1.00 . A A . 5 PHE N 1 1 14 14529 1 1 5 PHE O O 3.620 4.128 -1.400 1.00 . A A . 5 PHE O 1 1 14 14530 1 1 6 GLU C C 0.182 2.189 -1.594 1.00 . A A . 6 GLU C 1 1 14 14531 1 1 6 GLU CA C 1.672 2.205 -1.891 1.00 . A A . 6 GLU CA 1 1 14 14532 1 1 6 GLU CB C 2.052 0.925 -2.630 1.00 . A A . 6 GLU CB 1 1 14 14533 1 1 6 GLU CD C 3.586 -0.166 -4.312 1.00 . A A . 6 GLU CD 1 1 14 14534 1 1 6 GLU CG C 3.223 1.107 -3.572 1.00 . A A . 6 GLU CG 1 1 14 14535 1 1 6 GLU H H 2.303 1.721 0.075 1.00 . A A . 6 GLU H 1 1 14 14536 1 1 6 GLU HA H 1.891 3.053 -2.522 1.00 . A A . 6 GLU HA 1 1 14 14537 1 1 6 GLU HB2 H 2.304 0.164 -1.907 1.00 . A A . 6 GLU HB2 1 1 14 14538 1 1 6 GLU HB3 H 1.202 0.593 -3.207 1.00 . A A . 6 GLU HB3 1 1 14 14539 1 1 6 GLU HG2 H 2.962 1.865 -4.295 1.00 . A A . 6 GLU HG2 1 1 14 14540 1 1 6 GLU HG3 H 4.079 1.434 -3.001 1.00 . A A . 6 GLU HG3 1 1 14 14541 1 1 6 GLU N N 2.450 2.352 -0.660 1.00 . A A . 6 GLU N 1 1 14 14542 1 1 6 GLU O O -0.255 1.634 -0.591 1.00 . A A . 6 GLU O 1 1 14 14543 1 1 6 GLU OE1 O 2.817 -0.571 -5.210 1.00 . A A . 6 GLU OE1 1 1 14 14544 1 1 6 GLU OE2 O 4.638 -0.758 -3.994 1.00 . A A . 6 GLU OE2 1 1 14 14545 1 1 7 TYR C C -2.711 1.630 -2.916 1.00 . A A . 7 TYR C 1 1 14 14546 1 1 7 TYR CA C -2.032 2.830 -2.288 1.00 . A A . 7 TYR CA 1 1 14 14547 1 1 7 TYR CB C -2.597 4.126 -2.847 1.00 . A A . 7 TYR CB 1 1 14 14548 1 1 7 TYR CD1 C -3.138 3.826 -5.300 1.00 . A A . 7 TYR CD1 1 1 14 14549 1 1 7 TYR CD2 C -1.178 5.050 -4.718 1.00 . A A . 7 TYR CD2 1 1 14 14550 1 1 7 TYR CE1 C -2.865 4.019 -6.641 1.00 . A A . 7 TYR CE1 1 1 14 14551 1 1 7 TYR CE2 C -0.899 5.249 -6.057 1.00 . A A . 7 TYR CE2 1 1 14 14552 1 1 7 TYR CG C -2.302 4.338 -4.317 1.00 . A A . 7 TYR CG 1 1 14 14553 1 1 7 TYR CZ C -1.744 4.730 -7.014 1.00 . A A . 7 TYR CZ 1 1 14 14554 1 1 7 TYR H H -0.216 3.222 -3.261 1.00 . A A . 7 TYR H 1 1 14 14555 1 1 7 TYR HA H -2.220 2.794 -1.235 1.00 . A A . 7 TYR HA 1 1 14 14556 1 1 7 TYR HB2 H -3.658 4.123 -2.710 1.00 . A A . 7 TYR HB2 1 1 14 14557 1 1 7 TYR HB3 H -2.173 4.957 -2.305 1.00 . A A . 7 TYR HB3 1 1 14 14558 1 1 7 TYR HD1 H -4.014 3.268 -5.005 1.00 . A A . 7 TYR HD1 1 1 14 14559 1 1 7 TYR HD2 H -0.518 5.456 -3.967 1.00 . A A . 7 TYR HD2 1 1 14 14560 1 1 7 TYR HE1 H -3.529 3.613 -7.392 1.00 . A A . 7 TYR HE1 1 1 14 14561 1 1 7 TYR HE2 H -0.021 5.805 -6.349 1.00 . A A . 7 TYR HE2 1 1 14 14562 1 1 7 TYR HH H -0.529 4.790 -8.503 1.00 . A A . 7 TYR HH 1 1 14 14563 1 1 7 TYR N N -0.603 2.789 -2.476 1.00 . A A . 7 TYR N 1 1 14 14564 1 1 7 TYR O O -2.729 1.466 -4.136 1.00 . A A . 7 TYR O 1 1 14 14565 1 1 7 TYR OH O -1.467 4.924 -8.348 1.00 . A A . 7 TYR OH 1 1 14 14566 1 1 8 ALA C C -5.462 -0.167 -2.434 1.00 . A A . 8 ALA C 1 1 14 14567 1 1 8 ALA CA C -3.962 -0.403 -2.495 1.00 . A A . 8 ALA CA 1 1 14 14568 1 1 8 ALA CB C -3.573 -1.586 -1.623 1.00 . A A . 8 ALA CB 1 1 14 14569 1 1 8 ALA H H -3.197 0.979 -1.093 1.00 . A A . 8 ALA H 1 1 14 14570 1 1 8 ALA HA H -3.673 -0.616 -3.513 1.00 . A A . 8 ALA HA 1 1 14 14571 1 1 8 ALA HB1 H -3.417 -1.254 -0.605 1.00 . A A . 8 ALA HB1 1 1 14 14572 1 1 8 ALA HB2 H -2.661 -2.028 -1.998 1.00 . A A . 8 ALA HB2 1 1 14 14573 1 1 8 ALA HB3 H -4.362 -2.318 -1.641 1.00 . A A . 8 ALA HB3 1 1 14 14574 1 1 8 ALA N N -3.261 0.788 -2.057 1.00 . A A . 8 ALA N 1 1 14 14575 1 1 8 ALA O O -6.192 -0.909 -1.778 1.00 . A A . 8 ALA O 1 1 14 14576 1 1 9 GLU C C -7.953 1.123 -4.474 1.00 . A A . 9 GLU C 1 1 14 14577 1 1 9 GLU CA C -7.326 1.224 -3.116 1.00 . A A . 9 GLU CA 1 1 14 14578 1 1 9 GLU CB C -7.509 2.615 -2.516 1.00 . A A . 9 GLU CB 1 1 14 14579 1 1 9 GLU CD C -6.266 3.877 -4.329 1.00 . A A . 9 GLU CD 1 1 14 14580 1 1 9 GLU CG C -7.536 3.769 -3.511 1.00 . A A . 9 GLU CG 1 1 14 14581 1 1 9 GLU H H -5.297 1.427 -3.640 1.00 . A A . 9 GLU H 1 1 14 14582 1 1 9 GLU HA H -7.836 0.520 -2.496 1.00 . A A . 9 GLU HA 1 1 14 14583 1 1 9 GLU HB2 H -8.429 2.635 -1.968 1.00 . A A . 9 GLU HB2 1 1 14 14584 1 1 9 GLU HB3 H -6.697 2.780 -1.833 1.00 . A A . 9 GLU HB3 1 1 14 14585 1 1 9 GLU HG2 H -8.368 3.624 -4.182 1.00 . A A . 9 GLU HG2 1 1 14 14586 1 1 9 GLU HG3 H -7.676 4.689 -2.963 1.00 . A A . 9 GLU HG3 1 1 14 14587 1 1 9 GLU N N -5.920 0.876 -3.122 1.00 . A A . 9 GLU N 1 1 14 14588 1 1 9 GLU O O -7.280 1.039 -5.502 1.00 . A A . 9 GLU O 1 1 14 14589 1 1 9 GLU OE1 O -6.167 3.186 -5.364 1.00 . A A . 9 GLU OE1 1 1 14 14590 1 1 9 GLU OE2 O -5.374 4.660 -3.940 1.00 . A A . 9 GLU OE2 1 1 14 14591 1 1 10 VAL C C -10.338 2.385 -6.256 1.00 . A A . 10 VAL C 1 1 14 14592 1 1 10 VAL CA C -10.028 1.020 -5.650 1.00 . A A . 10 VAL CA 1 1 14 14593 1 1 10 VAL CB C -11.291 0.200 -5.395 1.00 . A A . 10 VAL CB 1 1 14 14594 1 1 10 VAL CG1 C -12.108 0.050 -6.669 1.00 . A A . 10 VAL CG1 1 1 14 14595 1 1 10 VAL CG2 C -10.909 -1.159 -4.825 1.00 . A A . 10 VAL CG2 1 1 14 14596 1 1 10 VAL H H -9.729 1.190 -3.588 1.00 . A A . 10 VAL H 1 1 14 14597 1 1 10 VAL HA H -9.435 0.486 -6.332 1.00 . A A . 10 VAL HA 1 1 14 14598 1 1 10 VAL HB H -11.871 0.712 -4.660 1.00 . A A . 10 VAL HB 1 1 14 14599 1 1 10 VAL HG11 H -13.157 0.162 -6.441 1.00 . A A . 10 VAL HG11 1 1 14 14600 1 1 10 VAL HG12 H -11.936 -0.929 -7.092 1.00 . A A . 10 VAL HG12 1 1 14 14601 1 1 10 VAL HG13 H -11.808 0.805 -7.379 1.00 . A A . 10 VAL HG13 1 1 14 14602 1 1 10 VAL HG21 H -10.009 -1.512 -5.306 1.00 . A A . 10 VAL HG21 1 1 14 14603 1 1 10 VAL HG22 H -11.707 -1.863 -4.994 1.00 . A A . 10 VAL HG22 1 1 14 14604 1 1 10 VAL HG23 H -10.733 -1.064 -3.761 1.00 . A A . 10 VAL HG23 1 1 14 14605 1 1 10 VAL N N -9.265 1.127 -4.450 1.00 . A A . 10 VAL N 1 1 14 14606 1 1 10 VAL O O -10.434 2.519 -7.474 1.00 . A A . 10 VAL O 1 1 14 14607 1 1 11 ASP C C -10.140 5.831 -4.960 1.00 . A A . 11 ASP C 1 1 14 14608 1 1 11 ASP CA C -10.735 4.759 -5.882 1.00 . A A . 11 ASP CA 1 1 14 14609 1 1 11 ASP CB C -12.251 4.972 -6.045 1.00 . A A . 11 ASP CB 1 1 14 14610 1 1 11 ASP CG C -12.635 6.427 -6.256 1.00 . A A . 11 ASP CG 1 1 14 14611 1 1 11 ASP H H -10.355 3.235 -4.450 1.00 . A A . 11 ASP H 1 1 14 14612 1 1 11 ASP HA H -10.271 4.859 -6.853 1.00 . A A . 11 ASP HA 1 1 14 14613 1 1 11 ASP HB2 H -12.588 4.418 -6.903 1.00 . A A . 11 ASP HB2 1 1 14 14614 1 1 11 ASP HB3 H -12.760 4.606 -5.166 1.00 . A A . 11 ASP HB3 1 1 14 14615 1 1 11 ASP N N -10.455 3.402 -5.408 1.00 . A A . 11 ASP N 1 1 14 14616 1 1 11 ASP O O -9.684 6.872 -5.432 1.00 . A A . 11 ASP O 1 1 14 14617 1 1 11 ASP OD1 O -12.380 6.956 -7.359 1.00 . A A . 11 ASP OD1 1 1 14 14618 1 1 11 ASP OD2 O -13.195 7.036 -5.319 1.00 . A A . 11 ASP OD2 1 1 14 14619 1 1 12 GLU C C -9.094 5.917 -1.432 1.00 . A A . 12 GLU C 1 1 14 14620 1 1 12 GLU CA C -9.623 6.571 -2.701 1.00 . A A . 12 GLU CA 1 1 14 14621 1 1 12 GLU CB C -10.717 7.576 -2.342 1.00 . A A . 12 GLU CB 1 1 14 14622 1 1 12 GLU CD C -12.123 9.541 -3.087 1.00 . A A . 12 GLU CD 1 1 14 14623 1 1 12 GLU CG C -11.084 8.511 -3.485 1.00 . A A . 12 GLU CG 1 1 14 14624 1 1 12 GLU H H -10.452 4.707 -3.329 1.00 . A A . 12 GLU H 1 1 14 14625 1 1 12 GLU HA H -8.812 7.097 -3.181 1.00 . A A . 12 GLU HA 1 1 14 14626 1 1 12 GLU HB2 H -11.604 7.033 -2.052 1.00 . A A . 12 GLU HB2 1 1 14 14627 1 1 12 GLU HB3 H -10.382 8.174 -1.509 1.00 . A A . 12 GLU HB3 1 1 14 14628 1 1 12 GLU HG2 H -10.194 9.027 -3.810 1.00 . A A . 12 GLU HG2 1 1 14 14629 1 1 12 GLU HG3 H -11.475 7.922 -4.302 1.00 . A A . 12 GLU HG3 1 1 14 14630 1 1 12 GLU N N -10.139 5.582 -3.653 1.00 . A A . 12 GLU N 1 1 14 14631 1 1 12 GLU O O -9.364 4.754 -1.173 1.00 . A A . 12 GLU O 1 1 14 14632 1 1 12 GLU OE1 O -13.329 9.223 -3.156 1.00 . A A . 12 GLU OE1 1 1 14 14633 1 1 12 GLU OE2 O -11.731 10.664 -2.707 1.00 . A A . 12 GLU OE2 1 1 14 14634 1 1 13 ILE C C -7.831 7.235 1.700 1.00 . A A . 13 ILE C 1 1 14 14635 1 1 13 ILE CA C -7.776 6.161 0.611 1.00 . A A . 13 ILE CA 1 1 14 14636 1 1 13 ILE CB C -6.306 5.690 0.421 1.00 . A A . 13 ILE CB 1 1 14 14637 1 1 13 ILE CD1 C -5.648 7.710 -0.963 1.00 . A A . 13 ILE CD1 1 1 14 14638 1 1 13 ILE CG1 C -5.365 6.890 0.275 1.00 . A A . 13 ILE CG1 1 1 14 14639 1 1 13 ILE CG2 C -6.211 4.822 -0.812 1.00 . A A . 13 ILE CG2 1 1 14 14640 1 1 13 ILE H H -8.158 7.601 -0.901 1.00 . A A . 13 ILE H 1 1 14 14641 1 1 13 ILE HA H -8.372 5.309 0.915 1.00 . A A . 13 ILE HA 1 1 14 14642 1 1 13 ILE HB H -6.006 5.089 1.279 1.00 . A A . 13 ILE HB 1 1 14 14643 1 1 13 ILE HD11 H -5.972 7.052 -1.761 1.00 . A A . 13 ILE HD11 1 1 14 14644 1 1 13 ILE HD12 H -4.752 8.230 -1.265 1.00 . A A . 13 ILE HD12 1 1 14 14645 1 1 13 ILE HD13 H -6.426 8.427 -0.749 1.00 . A A . 13 ILE HD13 1 1 14 14646 1 1 13 ILE HG12 H -5.477 7.536 1.133 1.00 . A A . 13 ILE HG12 1 1 14 14647 1 1 13 ILE HG13 H -4.346 6.543 0.219 1.00 . A A . 13 ILE HG13 1 1 14 14648 1 1 13 ILE HG21 H -7.195 4.509 -1.099 1.00 . A A . 13 ILE HG21 1 1 14 14649 1 1 13 ILE HG22 H -5.610 3.954 -0.596 1.00 . A A . 13 ILE HG22 1 1 14 14650 1 1 13 ILE HG23 H -5.761 5.381 -1.618 1.00 . A A . 13 ILE HG23 1 1 14 14651 1 1 13 ILE N N -8.339 6.674 -0.640 1.00 . A A . 13 ILE N 1 1 14 14652 1 1 13 ILE O O -8.454 8.282 1.523 1.00 . A A . 13 ILE O 1 1 14 14653 1 1 14 VAL C C -5.812 7.757 4.696 1.00 . A A . 14 VAL C 1 1 14 14654 1 1 14 VAL CA C -7.120 7.917 3.930 1.00 . A A . 14 VAL CA 1 1 14 14655 1 1 14 VAL CB C -8.322 7.743 4.886 1.00 . A A . 14 VAL CB 1 1 14 14656 1 1 14 VAL CG1 C -8.164 8.601 6.135 1.00 . A A . 14 VAL CG1 1 1 14 14657 1 1 14 VAL CG2 C -9.617 8.091 4.169 1.00 . A A . 14 VAL CG2 1 1 14 14658 1 1 14 VAL H H -6.700 6.114 2.905 1.00 . A A . 14 VAL H 1 1 14 14659 1 1 14 VAL HA H -7.159 8.912 3.514 1.00 . A A . 14 VAL HA 1 1 14 14660 1 1 14 VAL HB H -8.371 6.707 5.190 1.00 . A A . 14 VAL HB 1 1 14 14661 1 1 14 VAL HG11 H -7.283 8.289 6.677 1.00 . A A . 14 VAL HG11 1 1 14 14662 1 1 14 VAL HG12 H -9.034 8.486 6.765 1.00 . A A . 14 VAL HG12 1 1 14 14663 1 1 14 VAL HG13 H -8.062 9.638 5.848 1.00 . A A . 14 VAL HG13 1 1 14 14664 1 1 14 VAL HG21 H -10.456 7.867 4.811 1.00 . A A . 14 VAL HG21 1 1 14 14665 1 1 14 VAL HG22 H -9.692 7.511 3.262 1.00 . A A . 14 VAL HG22 1 1 14 14666 1 1 14 VAL HG23 H -9.621 9.143 3.925 1.00 . A A . 14 VAL HG23 1 1 14 14667 1 1 14 VAL N N -7.169 6.970 2.821 1.00 . A A . 14 VAL N 1 1 14 14668 1 1 14 VAL O O -5.086 8.725 4.919 1.00 . A A . 14 VAL O 1 1 14 14669 1 1 15 GLU C C -3.209 5.805 4.836 1.00 . A A . 15 GLU C 1 1 14 14670 1 1 15 GLU CA C -4.293 6.228 5.819 1.00 . A A . 15 GLU CA 1 1 14 14671 1 1 15 GLU CB C -4.531 5.123 6.850 1.00 . A A . 15 GLU CB 1 1 14 14672 1 1 15 GLU CD C -2.686 5.902 8.386 1.00 . A A . 15 GLU CD 1 1 14 14673 1 1 15 GLU CG C -3.282 4.735 7.624 1.00 . A A . 15 GLU CG 1 1 14 14674 1 1 15 GLU H H -6.153 5.802 4.901 1.00 . A A . 15 GLU H 1 1 14 14675 1 1 15 GLU HA H -3.976 7.127 6.326 1.00 . A A . 15 GLU HA 1 1 14 14676 1 1 15 GLU HB2 H -5.275 5.461 7.556 1.00 . A A . 15 GLU HB2 1 1 14 14677 1 1 15 GLU HB3 H -4.902 4.245 6.342 1.00 . A A . 15 GLU HB3 1 1 14 14678 1 1 15 GLU HG2 H -3.537 3.958 8.329 1.00 . A A . 15 GLU HG2 1 1 14 14679 1 1 15 GLU HG3 H -2.544 4.362 6.929 1.00 . A A . 15 GLU HG3 1 1 14 14680 1 1 15 GLU N N -5.523 6.527 5.097 1.00 . A A . 15 GLU N 1 1 14 14681 1 1 15 GLU O O -3.480 5.076 3.890 1.00 . A A . 15 GLU O 1 1 14 14682 1 1 15 GLU OE1 O -3.092 6.124 9.547 1.00 . A A . 15 GLU OE1 1 1 14 14683 1 1 15 GLU OE2 O -1.812 6.594 7.824 1.00 . A A . 15 GLU OE2 1 1 14 14684 1 1 16 LYS C C 0.453 6.000 4.865 1.00 . A A . 16 LYS C 1 1 14 14685 1 1 16 LYS CA C -0.894 5.936 4.139 1.00 . A A . 16 LYS CA 1 1 14 14686 1 1 16 LYS CB C -0.877 6.896 2.949 1.00 . A A . 16 LYS CB 1 1 14 14687 1 1 16 LYS CD C -0.949 9.271 2.127 1.00 . A A . 16 LYS CD 1 1 14 14688 1 1 16 LYS CE C -2.106 9.005 1.177 1.00 . A A . 16 LYS CE 1 1 14 14689 1 1 16 LYS CG C -1.007 8.359 3.343 1.00 . A A . 16 LYS CG 1 1 14 14690 1 1 16 LYS H H -1.826 6.877 5.797 1.00 . A A . 16 LYS H 1 1 14 14691 1 1 16 LYS HA H -1.072 4.925 3.779 1.00 . A A . 16 LYS HA 1 1 14 14692 1 1 16 LYS HB2 H 0.054 6.773 2.421 1.00 . A A . 16 LYS HB2 1 1 14 14693 1 1 16 LYS HB3 H -1.694 6.648 2.288 1.00 . A A . 16 LYS HB3 1 1 14 14694 1 1 16 LYS HD2 H -0.997 10.298 2.458 1.00 . A A . 16 LYS HD2 1 1 14 14695 1 1 16 LYS HD3 H -0.019 9.102 1.605 1.00 . A A . 16 LYS HD3 1 1 14 14696 1 1 16 LYS HE2 H -2.053 7.980 0.843 1.00 . A A . 16 LYS HE2 1 1 14 14697 1 1 16 LYS HE3 H -3.034 9.164 1.706 1.00 . A A . 16 LYS HE3 1 1 14 14698 1 1 16 LYS HG2 H -1.952 8.504 3.844 1.00 . A A . 16 LYS HG2 1 1 14 14699 1 1 16 LYS HG3 H -0.198 8.614 4.012 1.00 . A A . 16 LYS HG3 1 1 14 14700 1 1 16 LYS HZ1 H -2.881 9.712 -0.632 1.00 . A A . 16 LYS HZ1 1 1 14 14701 1 1 16 LYS HZ2 H -1.190 9.746 -0.549 1.00 . A A . 16 LYS HZ2 1 1 14 14702 1 1 16 LYS HZ3 H -2.101 10.897 0.290 1.00 . A A . 16 LYS HZ3 1 1 14 14703 1 1 16 LYS N N -1.992 6.285 5.035 1.00 . A A . 16 LYS N 1 1 14 14704 1 1 16 LYS NZ N -2.067 9.903 -0.011 1.00 . A A . 16 LYS NZ 1 1 14 14705 1 1 16 LYS O O 1.104 7.045 4.873 1.00 . A A . 16 LYS O 1 1 14 14706 1 1 17 ARG C C 2.711 3.470 6.283 1.00 . A A . 17 ARG C 1 1 14 14707 1 1 17 ARG CA C 2.141 4.879 6.208 1.00 . A A . 17 ARG CA 1 1 14 14708 1 1 17 ARG CB C 1.941 5.439 7.616 1.00 . A A . 17 ARG CB 1 1 14 14709 1 1 17 ARG CD C 4.292 6.306 7.798 1.00 . A A . 17 ARG CD 1 1 14 14710 1 1 17 ARG CG C 3.211 5.458 8.450 1.00 . A A . 17 ARG CG 1 1 14 14711 1 1 17 ARG CZ C 4.705 8.704 7.436 1.00 . A A . 17 ARG CZ 1 1 14 14712 1 1 17 ARG H H 0.360 4.062 5.380 1.00 . A A . 17 ARG H 1 1 14 14713 1 1 17 ARG HA H 2.840 5.507 5.677 1.00 . A A . 17 ARG HA 1 1 14 14714 1 1 17 ARG HB2 H 1.572 6.452 7.538 1.00 . A A . 17 ARG HB2 1 1 14 14715 1 1 17 ARG HB3 H 1.205 4.837 8.129 1.00 . A A . 17 ARG HB3 1 1 14 14716 1 1 17 ARG HD2 H 5.169 6.294 8.428 1.00 . A A . 17 ARG HD2 1 1 14 14717 1 1 17 ARG HD3 H 4.535 5.878 6.836 1.00 . A A . 17 ARG HD3 1 1 14 14718 1 1 17 ARG HE H 2.901 7.871 7.607 1.00 . A A . 17 ARG HE 1 1 14 14719 1 1 17 ARG HG2 H 2.986 5.867 9.424 1.00 . A A . 17 ARG HG2 1 1 14 14720 1 1 17 ARG HG3 H 3.575 4.446 8.557 1.00 . A A . 17 ARG HG3 1 1 14 14721 1 1 17 ARG HH11 H 6.369 7.562 7.558 1.00 . A A . 17 ARG HH11 1 1 14 14722 1 1 17 ARG HH12 H 6.645 9.252 7.303 1.00 . A A . 17 ARG HH12 1 1 14 14723 1 1 17 ARG HH21 H 3.252 10.098 7.269 1.00 . A A . 17 ARG HH21 1 1 14 14724 1 1 17 ARG HH22 H 4.872 10.695 7.139 1.00 . A A . 17 ARG HH22 1 1 14 14725 1 1 17 ARG N N 0.874 4.895 5.472 1.00 . A A . 17 ARG N 1 1 14 14726 1 1 17 ARG NE N 3.863 7.689 7.607 1.00 . A A . 17 ARG NE 1 1 14 14727 1 1 17 ARG NH1 N 6.014 8.488 7.432 1.00 . A A . 17 ARG NH1 1 1 14 14728 1 1 17 ARG NH2 N 4.239 9.933 7.267 1.00 . A A . 17 ARG NH2 1 1 14 14729 1 1 17 ARG O O 2.397 2.724 7.211 1.00 . A A . 17 ARG O 1 1 14 14730 1 1 18 GLY C C 5.429 1.614 4.667 1.00 . A A . 18 GLY C 1 1 14 14731 1 1 18 GLY CA C 4.085 1.752 5.338 1.00 . A A . 18 GLY CA 1 1 14 14732 1 1 18 GLY H H 3.808 3.725 4.621 1.00 . A A . 18 GLY H 1 1 14 14733 1 1 18 GLY HA2 H 4.179 1.432 6.364 1.00 . A A . 18 GLY HA2 1 1 14 14734 1 1 18 GLY HA3 H 3.389 1.104 4.839 1.00 . A A . 18 GLY HA3 1 1 14 14735 1 1 18 GLY N N 3.544 3.093 5.320 1.00 . A A . 18 GLY N 1 1 14 14736 1 1 18 GLY O O 6.356 2.382 4.921 1.00 . A A . 18 GLY O 1 1 14 14737 1 1 19 LYS C C 6.441 0.385 1.570 1.00 . A A . 19 LYS C 1 1 14 14738 1 1 19 LYS CA C 6.717 0.289 3.074 1.00 . A A . 19 LYS CA 1 1 14 14739 1 1 19 LYS CB C 7.136 -1.105 3.495 1.00 . A A . 19 LYS CB 1 1 14 14740 1 1 19 LYS CD C 7.978 -2.573 5.313 1.00 . A A . 19 LYS CD 1 1 14 14741 1 1 19 LYS CE C 8.571 -2.620 6.712 1.00 . A A . 19 LYS CE 1 1 14 14742 1 1 19 LYS CG C 7.602 -1.166 4.931 1.00 . A A . 19 LYS CG 1 1 14 14743 1 1 19 LYS H H 4.730 0.032 3.670 1.00 . A A . 19 LYS H 1 1 14 14744 1 1 19 LYS HA H 7.481 0.986 3.348 1.00 . A A . 19 LYS HA 1 1 14 14745 1 1 19 LYS HB2 H 6.277 -1.758 3.385 1.00 . A A . 19 LYS HB2 1 1 14 14746 1 1 19 LYS HB3 H 7.935 -1.455 2.862 1.00 . A A . 19 LYS HB3 1 1 14 14747 1 1 19 LYS HD2 H 7.090 -3.184 5.278 1.00 . A A . 19 LYS HD2 1 1 14 14748 1 1 19 LYS HD3 H 8.703 -2.943 4.601 1.00 . A A . 19 LYS HD3 1 1 14 14749 1 1 19 LYS HE2 H 9.460 -2.008 6.731 1.00 . A A . 19 LYS HE2 1 1 14 14750 1 1 19 LYS HE3 H 7.847 -2.223 7.408 1.00 . A A . 19 LYS HE3 1 1 14 14751 1 1 19 LYS HG2 H 8.463 -0.526 5.050 1.00 . A A . 19 LYS HG2 1 1 14 14752 1 1 19 LYS HG3 H 6.804 -0.826 5.576 1.00 . A A . 19 LYS HG3 1 1 14 14753 1 1 19 LYS HZ1 H 9.259 -4.005 8.111 1.00 . A A . 19 LYS HZ1 1 1 14 14754 1 1 19 LYS HZ2 H 9.687 -4.371 6.516 1.00 . A A . 19 LYS HZ2 1 1 14 14755 1 1 19 LYS HZ3 H 8.100 -4.624 7.047 1.00 . A A . 19 LYS HZ3 1 1 14 14756 1 1 19 LYS N N 5.514 0.604 3.809 1.00 . A A . 19 LYS N 1 1 14 14757 1 1 19 LYS NZ N 8.929 -4.002 7.124 1.00 . A A . 19 LYS NZ 1 1 14 14758 1 1 19 LYS O O 6.030 1.431 1.087 1.00 . A A . 19 LYS O 1 1 14 14759 1 1 20 GLY C C 4.996 -1.221 -0.775 1.00 . A A . 20 GLY C 1 1 14 14760 1 1 20 GLY CA C 6.374 -0.675 -0.578 1.00 . A A . 20 GLY CA 1 1 14 14761 1 1 20 GLY H H 7.015 -1.494 1.224 1.00 . A A . 20 GLY H 1 1 14 14762 1 1 20 GLY HA2 H 6.436 0.331 -0.957 1.00 . A A . 20 GLY HA2 1 1 14 14763 1 1 20 GLY HA3 H 7.071 -1.306 -1.088 1.00 . A A . 20 GLY HA3 1 1 14 14764 1 1 20 GLY N N 6.669 -0.686 0.825 1.00 . A A . 20 GLY N 1 1 14 14765 1 1 20 GLY O O 4.221 -0.753 -1.604 1.00 . A A . 20 GLY O 1 1 14 14766 1 1 21 LYS C C 2.975 -3.202 1.465 1.00 . A A . 21 LYS C 1 1 14 14767 1 1 21 LYS CA C 3.434 -2.903 0.025 1.00 . A A . 21 LYS CA 1 1 14 14768 1 1 21 LYS CB C 3.511 -4.190 -0.793 1.00 . A A . 21 LYS CB 1 1 14 14769 1 1 21 LYS CD C 1.068 -4.673 -1.118 1.00 . A A . 21 LYS CD 1 1 14 14770 1 1 21 LYS CE C 0.303 -3.421 -0.716 1.00 . A A . 21 LYS CE 1 1 14 14771 1 1 21 LYS CG C 2.386 -4.334 -1.799 1.00 . A A . 21 LYS CG 1 1 14 14772 1 1 21 LYS H H 5.441 -2.591 0.580 1.00 . A A . 21 LYS H 1 1 14 14773 1 1 21 LYS HA H 2.721 -2.235 -0.439 1.00 . A A . 21 LYS HA 1 1 14 14774 1 1 21 LYS HB2 H 4.448 -4.205 -1.330 1.00 . A A . 21 LYS HB2 1 1 14 14775 1 1 21 LYS HB3 H 3.478 -5.034 -0.124 1.00 . A A . 21 LYS HB3 1 1 14 14776 1 1 21 LYS HD2 H 0.461 -5.251 -1.797 1.00 . A A . 21 LYS HD2 1 1 14 14777 1 1 21 LYS HD3 H 1.274 -5.257 -0.232 1.00 . A A . 21 LYS HD3 1 1 14 14778 1 1 21 LYS HE2 H 0.922 -2.828 -0.061 1.00 . A A . 21 LYS HE2 1 1 14 14779 1 1 21 LYS HE3 H 0.073 -2.854 -1.605 1.00 . A A . 21 LYS HE3 1 1 14 14780 1 1 21 LYS HG2 H 2.277 -3.400 -2.332 1.00 . A A . 21 LYS HG2 1 1 14 14781 1 1 21 LYS HG3 H 2.638 -5.121 -2.495 1.00 . A A . 21 LYS HG3 1 1 14 14782 1 1 21 LYS HZ1 H -0.760 -4.235 0.888 1.00 . A A . 21 LYS HZ1 1 1 14 14783 1 1 21 LYS HZ2 H -1.553 -4.374 -0.600 1.00 . A A . 21 LYS HZ2 1 1 14 14784 1 1 21 LYS HZ3 H -1.500 -2.882 0.193 1.00 . A A . 21 LYS HZ3 1 1 14 14785 1 1 21 LYS N N 4.724 -2.245 0.013 1.00 . A A . 21 LYS N 1 1 14 14786 1 1 21 LYS NZ N -0.966 -3.751 -0.009 1.00 . A A . 21 LYS NZ 1 1 14 14787 1 1 21 LYS O O 1.888 -3.741 1.670 1.00 . A A . 21 LYS O 1 1 14 14788 1 1 22 ASP C C 2.631 -1.926 4.435 1.00 . A A . 22 ASP C 1 1 14 14789 1 1 22 ASP CA C 3.459 -3.054 3.865 1.00 . A A . 22 ASP CA 1 1 14 14790 1 1 22 ASP CB C 4.726 -3.177 4.707 1.00 . A A . 22 ASP CB 1 1 14 14791 1 1 22 ASP CG C 4.453 -3.740 6.092 1.00 . A A . 22 ASP CG 1 1 14 14792 1 1 22 ASP H H 4.625 -2.397 2.262 1.00 . A A . 22 ASP H 1 1 14 14793 1 1 22 ASP HA H 2.904 -3.956 3.917 1.00 . A A . 22 ASP HA 1 1 14 14794 1 1 22 ASP HB2 H 5.433 -3.808 4.203 1.00 . A A . 22 ASP HB2 1 1 14 14795 1 1 22 ASP HB3 H 5.156 -2.195 4.830 1.00 . A A . 22 ASP HB3 1 1 14 14796 1 1 22 ASP N N 3.790 -2.822 2.465 1.00 . A A . 22 ASP N 1 1 14 14797 1 1 22 ASP O O 2.430 -1.837 5.643 1.00 . A A . 22 ASP O 1 1 14 14798 1 1 22 ASP OD1 O 4.111 -2.948 6.995 1.00 . A A . 22 ASP OD1 1 1 14 14799 1 1 22 ASP OD2 O 4.582 -4.965 6.276 1.00 . A A . 22 ASP OD2 1 1 14 14800 1 1 23 VAL C C -0.111 -0.287 4.032 1.00 . A A . 23 VAL C 1 1 14 14801 1 1 23 VAL CA C 1.367 0.061 3.995 1.00 . A A . 23 VAL CA 1 1 14 14802 1 1 23 VAL CB C 1.589 1.268 3.082 1.00 . A A . 23 VAL CB 1 1 14 14803 1 1 23 VAL CG1 C 0.861 1.107 1.754 1.00 . A A . 23 VAL CG1 1 1 14 14804 1 1 23 VAL CG2 C 1.153 2.535 3.777 1.00 . A A . 23 VAL CG2 1 1 14 14805 1 1 23 VAL H H 2.410 -1.148 2.636 1.00 . A A . 23 VAL H 1 1 14 14806 1 1 23 VAL HA H 1.680 0.335 4.986 1.00 . A A . 23 VAL HA 1 1 14 14807 1 1 23 VAL HB H 2.650 1.338 2.887 1.00 . A A . 23 VAL HB 1 1 14 14808 1 1 23 VAL HG11 H 0.865 2.051 1.233 1.00 . A A . 23 VAL HG11 1 1 14 14809 1 1 23 VAL HG12 H -0.160 0.804 1.925 1.00 . A A . 23 VAL HG12 1 1 14 14810 1 1 23 VAL HG13 H 1.364 0.363 1.154 1.00 . A A . 23 VAL HG13 1 1 14 14811 1 1 23 VAL HG21 H 0.168 2.811 3.434 1.00 . A A . 23 VAL HG21 1 1 14 14812 1 1 23 VAL HG22 H 1.850 3.329 3.555 1.00 . A A . 23 VAL HG22 1 1 14 14813 1 1 23 VAL HG23 H 1.125 2.364 4.842 1.00 . A A . 23 VAL HG23 1 1 14 14814 1 1 23 VAL N N 2.172 -1.058 3.572 1.00 . A A . 23 VAL N 1 1 14 14815 1 1 23 VAL O O -0.594 -1.109 3.253 1.00 . A A . 23 VAL O 1 1 14 14816 1 1 24 GLU C C -3.026 1.356 4.527 1.00 . A A . 24 GLU C 1 1 14 14817 1 1 24 GLU CA C -2.248 0.157 5.058 1.00 . A A . 24 GLU CA 1 1 14 14818 1 1 24 GLU CB C -2.615 -0.088 6.520 1.00 . A A . 24 GLU CB 1 1 14 14819 1 1 24 GLU CD C -2.306 0.606 8.931 1.00 . A A . 24 GLU CD 1 1 14 14820 1 1 24 GLU CG C -1.971 0.898 7.481 1.00 . A A . 24 GLU CG 1 1 14 14821 1 1 24 GLU H H -0.380 1.059 5.461 1.00 . A A . 24 GLU H 1 1 14 14822 1 1 24 GLU HA H -2.498 -0.725 4.478 1.00 . A A . 24 GLU HA 1 1 14 14823 1 1 24 GLU HB2 H -3.687 -0.009 6.621 1.00 . A A . 24 GLU HB2 1 1 14 14824 1 1 24 GLU HB3 H -2.308 -1.084 6.795 1.00 . A A . 24 GLU HB3 1 1 14 14825 1 1 24 GLU HG2 H -0.899 0.851 7.360 1.00 . A A . 24 GLU HG2 1 1 14 14826 1 1 24 GLU HG3 H -2.317 1.893 7.240 1.00 . A A . 24 GLU HG3 1 1 14 14827 1 1 24 GLU N N -0.823 0.380 4.913 1.00 . A A . 24 GLU N 1 1 14 14828 1 1 24 GLU O O -3.132 2.386 5.193 1.00 . A A . 24 GLU O 1 1 14 14829 1 1 24 GLU OE1 O -1.619 -0.240 9.541 1.00 . A A . 24 GLU OE1 1 1 14 14830 1 1 24 GLU OE2 O -3.258 1.220 9.456 1.00 . A A . 24 GLU OE2 1 1 14 14831 1 1 25 TYR C C -5.812 1.970 2.767 1.00 . A A . 25 TYR C 1 1 14 14832 1 1 25 TYR CA C -4.325 2.279 2.696 1.00 . A A . 25 TYR CA 1 1 14 14833 1 1 25 TYR CB C -3.906 2.435 1.238 1.00 . A A . 25 TYR CB 1 1 14 14834 1 1 25 TYR CD1 C -1.525 3.176 1.600 1.00 . A A . 25 TYR CD1 1 1 14 14835 1 1 25 TYR CD2 C -2.932 4.543 0.255 1.00 . A A . 25 TYR CD2 1 1 14 14836 1 1 25 TYR CE1 C -0.480 4.056 1.400 1.00 . A A . 25 TYR CE1 1 1 14 14837 1 1 25 TYR CE2 C -1.891 5.424 0.047 1.00 . A A . 25 TYR CE2 1 1 14 14838 1 1 25 TYR CG C -2.766 3.403 1.031 1.00 . A A . 25 TYR CG 1 1 14 14839 1 1 25 TYR CZ C -0.667 5.177 0.621 1.00 . A A . 25 TYR CZ 1 1 14 14840 1 1 25 TYR H H -3.467 0.368 2.861 1.00 . A A . 25 TYR H 1 1 14 14841 1 1 25 TYR HA H -4.118 3.196 3.219 1.00 . A A . 25 TYR HA 1 1 14 14842 1 1 25 TYR HB2 H -3.597 1.474 0.856 1.00 . A A . 25 TYR HB2 1 1 14 14843 1 1 25 TYR HB3 H -4.750 2.787 0.666 1.00 . A A . 25 TYR HB3 1 1 14 14844 1 1 25 TYR HD1 H -1.378 2.298 2.211 1.00 . A A . 25 TYR HD1 1 1 14 14845 1 1 25 TYR HD2 H -3.888 4.730 -0.197 1.00 . A A . 25 TYR HD2 1 1 14 14846 1 1 25 TYR HE1 H 0.476 3.861 1.852 1.00 . A A . 25 TYR HE1 1 1 14 14847 1 1 25 TYR HE2 H -2.042 6.304 -0.561 1.00 . A A . 25 TYR HE2 1 1 14 14848 1 1 25 TYR HH H 1.172 5.553 0.208 1.00 . A A . 25 TYR HH 1 1 14 14849 1 1 25 TYR N N -3.565 1.216 3.327 1.00 . A A . 25 TYR N 1 1 14 14850 1 1 25 TYR O O -6.202 0.814 2.796 1.00 . A A . 25 TYR O 1 1 14 14851 1 1 25 TYR OH O 0.376 6.049 0.412 1.00 . A A . 25 TYR OH 1 1 14 14852 1 1 26 LEU C C -8.595 2.737 1.414 1.00 . A A . 26 LEU C 1 1 14 14853 1 1 26 LEU CA C -8.078 2.812 2.833 1.00 . A A . 26 LEU CA 1 1 14 14854 1 1 26 LEU CB C -8.745 3.967 3.590 1.00 . A A . 26 LEU CB 1 1 14 14855 1 1 26 LEU CD1 C -10.825 3.383 4.876 1.00 . A A . 26 LEU CD1 1 1 14 14856 1 1 26 LEU CD2 C -10.822 5.352 3.342 1.00 . A A . 26 LEU CD2 1 1 14 14857 1 1 26 LEU CG C -10.276 3.956 3.580 1.00 . A A . 26 LEU CG 1 1 14 14858 1 1 26 LEU H H -6.280 3.901 2.737 1.00 . A A . 26 LEU H 1 1 14 14859 1 1 26 LEU HA H -8.285 1.878 3.332 1.00 . A A . 26 LEU HA 1 1 14 14860 1 1 26 LEU HB2 H -8.411 3.934 4.618 1.00 . A A . 26 LEU HB2 1 1 14 14861 1 1 26 LEU HB3 H -8.412 4.897 3.154 1.00 . A A . 26 LEU HB3 1 1 14 14862 1 1 26 LEU HD11 H -10.480 3.976 5.708 1.00 . A A . 26 LEU HD11 1 1 14 14863 1 1 26 LEU HD12 H -10.484 2.368 4.990 1.00 . A A . 26 LEU HD12 1 1 14 14864 1 1 26 LEU HD13 H -11.905 3.397 4.847 1.00 . A A . 26 LEU HD13 1 1 14 14865 1 1 26 LEU HD21 H -10.709 5.938 4.240 1.00 . A A . 26 LEU HD21 1 1 14 14866 1 1 26 LEU HD22 H -11.868 5.289 3.082 1.00 . A A . 26 LEU HD22 1 1 14 14867 1 1 26 LEU HD23 H -10.277 5.817 2.534 1.00 . A A . 26 LEU HD23 1 1 14 14868 1 1 26 LEU HG H -10.614 3.328 2.779 1.00 . A A . 26 LEU HG 1 1 14 14869 1 1 26 LEU N N -6.639 2.999 2.784 1.00 . A A . 26 LEU N 1 1 14 14870 1 1 26 LEU O O -7.956 3.245 0.496 1.00 . A A . 26 LEU O 1 1 14 14871 1 1 27 VAL C C -11.739 2.219 -0.242 1.00 . A A . 27 VAL C 1 1 14 14872 1 1 27 VAL CA C -10.246 1.985 -0.140 1.00 . A A . 27 VAL CA 1 1 14 14873 1 1 27 VAL CB C -9.828 0.665 -0.851 1.00 . A A . 27 VAL CB 1 1 14 14874 1 1 27 VAL CG1 C -8.871 -0.156 -0.006 1.00 . A A . 27 VAL CG1 1 1 14 14875 1 1 27 VAL CG2 C -11.005 -0.206 -1.302 1.00 . A A . 27 VAL CG2 1 1 14 14876 1 1 27 VAL H H -10.190 1.657 1.952 1.00 . A A . 27 VAL H 1 1 14 14877 1 1 27 VAL HA H -9.780 2.774 -0.698 1.00 . A A . 27 VAL HA 1 1 14 14878 1 1 27 VAL HB H -9.296 0.974 -1.723 1.00 . A A . 27 VAL HB 1 1 14 14879 1 1 27 VAL HG11 H -8.528 -1.007 -0.576 1.00 . A A . 27 VAL HG11 1 1 14 14880 1 1 27 VAL HG12 H -9.380 -0.501 0.882 1.00 . A A . 27 VAL HG12 1 1 14 14881 1 1 27 VAL HG13 H -8.025 0.454 0.277 1.00 . A A . 27 VAL HG13 1 1 14 14882 1 1 27 VAL HG21 H -11.619 -0.453 -0.450 1.00 . A A . 27 VAL HG21 1 1 14 14883 1 1 27 VAL HG22 H -10.631 -1.114 -1.752 1.00 . A A . 27 VAL HG22 1 1 14 14884 1 1 27 VAL HG23 H -11.597 0.336 -2.025 1.00 . A A . 27 VAL HG23 1 1 14 14885 1 1 27 VAL N N -9.723 2.083 1.206 1.00 . A A . 27 VAL N 1 1 14 14886 1 1 27 VAL O O -12.552 1.408 0.200 1.00 . A A . 27 VAL O 1 1 14 14887 1 1 28 ARG C C -13.787 2.970 -2.383 1.00 . A A . 28 ARG C 1 1 14 14888 1 1 28 ARG CA C -13.453 3.672 -1.104 1.00 . A A . 28 ARG CA 1 1 14 14889 1 1 28 ARG CB C -13.655 5.172 -1.259 1.00 . A A . 28 ARG CB 1 1 14 14890 1 1 28 ARG CD C -13.296 7.466 -0.296 1.00 . A A . 28 ARG CD 1 1 14 14891 1 1 28 ARG CG C -12.892 6.002 -0.240 1.00 . A A . 28 ARG CG 1 1 14 14892 1 1 28 ARG CZ C -12.817 9.486 1.025 1.00 . A A . 28 ARG CZ 1 1 14 14893 1 1 28 ARG H H -11.377 3.985 -1.093 1.00 . A A . 28 ARG H 1 1 14 14894 1 1 28 ARG HA H -14.075 3.279 -0.318 1.00 . A A . 28 ARG HA 1 1 14 14895 1 1 28 ARG HB2 H -13.325 5.451 -2.246 1.00 . A A . 28 ARG HB2 1 1 14 14896 1 1 28 ARG HB3 H -14.708 5.396 -1.162 1.00 . A A . 28 ARG HB3 1 1 14 14897 1 1 28 ARG HD2 H -13.213 7.813 -1.316 1.00 . A A . 28 ARG HD2 1 1 14 14898 1 1 28 ARG HD3 H -14.322 7.554 0.030 1.00 . A A . 28 ARG HD3 1 1 14 14899 1 1 28 ARG HE H -11.569 7.948 0.797 1.00 . A A . 28 ARG HE 1 1 14 14900 1 1 28 ARG HG2 H -13.100 5.621 0.748 1.00 . A A . 28 ARG HG2 1 1 14 14901 1 1 28 ARG HG3 H -11.834 5.922 -0.443 1.00 . A A . 28 ARG HG3 1 1 14 14902 1 1 28 ARG HH11 H -14.636 9.466 0.143 1.00 . A A . 28 ARG HH11 1 1 14 14903 1 1 28 ARG HH12 H -14.280 10.880 1.076 1.00 . A A . 28 ARG HH12 1 1 14 14904 1 1 28 ARG HH21 H -11.090 9.805 2.024 1.00 . A A . 28 ARG HH21 1 1 14 14905 1 1 28 ARG HH22 H -12.263 11.074 2.146 1.00 . A A . 28 ARG HH22 1 1 14 14906 1 1 28 ARG N N -12.077 3.350 -0.833 1.00 . A A . 28 ARG N 1 1 14 14907 1 1 28 ARG NE N -12.454 8.295 0.559 1.00 . A A . 28 ARG NE 1 1 14 14908 1 1 28 ARG NH1 N -14.008 9.985 0.723 1.00 . A A . 28 ARG NH1 1 1 14 14909 1 1 28 ARG NH2 N -11.989 10.178 1.795 1.00 . A A . 28 ARG NH2 1 1 14 14910 1 1 28 ARG O O -13.814 3.580 -3.452 1.00 . A A . 28 ARG O 1 1 14 14911 1 1 29 TRP C C -14.959 1.515 -4.517 1.00 . A A . 29 TRP C 1 1 14 14912 1 1 29 TRP CA C -14.308 0.779 -3.364 1.00 . A A . 29 TRP CA 1 1 14 14913 1 1 29 TRP CB C -15.225 -0.333 -2.880 1.00 . A A . 29 TRP CB 1 1 14 14914 1 1 29 TRP CD1 C -14.097 -1.888 -4.569 1.00 . A A . 29 TRP CD1 1 1 14 14915 1 1 29 TRP CD2 C -15.577 -2.906 -3.232 1.00 . A A . 29 TRP CD2 1 1 14 14916 1 1 29 TRP CE2 C -15.031 -3.864 -4.109 1.00 . A A . 29 TRP CE2 1 1 14 14917 1 1 29 TRP CE3 C -16.532 -3.315 -2.298 1.00 . A A . 29 TRP CE3 1 1 14 14918 1 1 29 TRP CG C -14.964 -1.650 -3.543 1.00 . A A . 29 TRP CG 1 1 14 14919 1 1 29 TRP CH2 C -16.348 -5.576 -3.153 1.00 . A A . 29 TRP CH2 1 1 14 14920 1 1 29 TRP CZ2 C -15.411 -5.204 -4.077 1.00 . A A . 29 TRP CZ2 1 1 14 14921 1 1 29 TRP CZ3 C -16.908 -4.646 -2.268 1.00 . A A . 29 TRP CZ3 1 1 14 14922 1 1 29 TRP H H -13.979 1.282 -1.349 1.00 . A A . 29 TRP H 1 1 14 14923 1 1 29 TRP HA H -13.378 0.344 -3.705 1.00 . A A . 29 TRP HA 1 1 14 14924 1 1 29 TRP HB2 H -15.086 -0.451 -1.817 1.00 . A A . 29 TRP HB2 1 1 14 14925 1 1 29 TRP HB3 H -16.249 -0.055 -3.076 1.00 . A A . 29 TRP HB3 1 1 14 14926 1 1 29 TRP HD1 H -13.480 -1.131 -5.031 1.00 . A A . 29 TRP HD1 1 1 14 14927 1 1 29 TRP HE1 H -13.595 -3.634 -5.622 1.00 . A A . 29 TRP HE1 1 1 14 14928 1 1 29 TRP HE3 H -16.976 -2.613 -1.607 1.00 . A A . 29 TRP HE3 1 1 14 14929 1 1 29 TRP HH2 H -16.672 -6.604 -3.094 1.00 . A A . 29 TRP HH2 1 1 14 14930 1 1 29 TRP HZ2 H -14.987 -5.934 -4.752 1.00 . A A . 29 TRP HZ2 1 1 14 14931 1 1 29 TRP HZ3 H -17.646 -4.980 -1.554 1.00 . A A . 29 TRP HZ3 1 1 14 14932 1 1 29 TRP N N -14.014 1.667 -2.248 1.00 . A A . 29 TRP N 1 1 14 14933 1 1 29 TRP NE1 N -14.129 -3.217 -4.914 1.00 . A A . 29 TRP NE1 1 1 14 14934 1 1 29 TRP O O -16.170 1.710 -4.540 1.00 . A A . 29 TRP O 1 1 14 14935 1 1 30 LYS C C -15.945 2.302 -7.087 1.00 . A A . 30 LYS C 1 1 14 14936 1 1 30 LYS CA C -14.533 2.699 -6.646 1.00 . A A . 30 LYS CA 1 1 14 14937 1 1 30 LYS CB C -13.573 2.412 -7.800 1.00 . A A . 30 LYS CB 1 1 14 14938 1 1 30 LYS CD C -12.942 2.856 -10.194 1.00 . A A . 30 LYS CD 1 1 14 14939 1 1 30 LYS CE C -13.184 3.727 -11.416 1.00 . A A . 30 LYS CE 1 1 14 14940 1 1 30 LYS CG C -13.838 3.261 -9.034 1.00 . A A . 30 LYS CG 1 1 14 14941 1 1 30 LYS H H -13.123 1.886 -5.239 1.00 . A A . 30 LYS H 1 1 14 14942 1 1 30 LYS HA H -14.513 3.758 -6.428 1.00 . A A . 30 LYS HA 1 1 14 14943 1 1 30 LYS HB2 H -12.567 2.597 -7.470 1.00 . A A . 30 LYS HB2 1 1 14 14944 1 1 30 LYS HB3 H -13.664 1.373 -8.078 1.00 . A A . 30 LYS HB3 1 1 14 14945 1 1 30 LYS HD2 H -11.911 2.957 -9.892 1.00 . A A . 30 LYS HD2 1 1 14 14946 1 1 30 LYS HD3 H -13.145 1.827 -10.450 1.00 . A A . 30 LYS HD3 1 1 14 14947 1 1 30 LYS HE2 H -12.937 4.749 -11.169 1.00 . A A . 30 LYS HE2 1 1 14 14948 1 1 30 LYS HE3 H -12.544 3.387 -12.217 1.00 . A A . 30 LYS HE3 1 1 14 14949 1 1 30 LYS HG2 H -14.869 3.136 -9.329 1.00 . A A . 30 LYS HG2 1 1 14 14950 1 1 30 LYS HG3 H -13.653 4.297 -8.792 1.00 . A A . 30 LYS HG3 1 1 14 14951 1 1 30 LYS HZ1 H -14.866 2.690 -12.096 1.00 . A A . 30 LYS HZ1 1 1 14 14952 1 1 30 LYS HZ2 H -14.730 4.257 -12.719 1.00 . A A . 30 LYS HZ2 1 1 14 14953 1 1 30 LYS HZ3 H -15.233 4.023 -11.120 1.00 . A A . 30 LYS HZ3 1 1 14 14954 1 1 30 LYS N N -14.099 1.976 -5.430 1.00 . A A . 30 LYS N 1 1 14 14955 1 1 30 LYS NZ N -14.602 3.670 -11.869 1.00 . A A . 30 LYS NZ 1 1 14 14956 1 1 30 LYS O O -16.716 3.136 -7.558 1.00 . A A . 30 LYS O 1 1 14 14957 1 1 31 ASP C C -18.237 -0.124 -6.070 1.00 . A A . 31 ASP C 1 1 14 14958 1 1 31 ASP CA C -17.582 0.507 -7.294 1.00 . A A . 31 ASP CA 1 1 14 14959 1 1 31 ASP CB C -17.475 -0.517 -8.426 1.00 . A A . 31 ASP CB 1 1 14 14960 1 1 31 ASP CG C -16.949 0.092 -9.712 1.00 . A A . 31 ASP CG 1 1 14 14961 1 1 31 ASP H H -15.594 0.400 -6.586 1.00 . A A . 31 ASP H 1 1 14 14962 1 1 31 ASP HA H -18.186 1.341 -7.624 1.00 . A A . 31 ASP HA 1 1 14 14963 1 1 31 ASP HB2 H -16.806 -1.309 -8.126 1.00 . A A . 31 ASP HB2 1 1 14 14964 1 1 31 ASP HB3 H -18.454 -0.934 -8.620 1.00 . A A . 31 ASP HB3 1 1 14 14965 1 1 31 ASP N N -16.264 1.020 -6.942 1.00 . A A . 31 ASP N 1 1 14 14966 1 1 31 ASP O O -18.597 -1.302 -6.079 1.00 . A A . 31 ASP O 1 1 14 14967 1 1 31 ASP OD1 O -15.715 0.099 -9.904 1.00 . A A . 31 ASP OD1 1 1 14 14968 1 1 31 ASP OD2 O -17.771 0.563 -10.526 1.00 . A A . 31 ASP OD2 1 1 14 14969 1 1 32 GLY C C -19.731 1.264 -3.030 1.00 . A A . 32 GLY C 1 1 14 14970 1 1 32 GLY CA C -18.975 0.188 -3.781 1.00 . A A . 32 GLY CA 1 1 14 14971 1 1 32 GLY H H -18.088 1.605 -5.075 1.00 . A A . 32 GLY H 1 1 14 14972 1 1 32 GLY HA2 H -19.650 -0.623 -4.009 1.00 . A A . 32 GLY HA2 1 1 14 14973 1 1 32 GLY HA3 H -18.181 -0.182 -3.143 1.00 . A A . 32 GLY HA3 1 1 14 14974 1 1 32 GLY N N -18.385 0.673 -5.014 1.00 . A A . 32 GLY N 1 1 14 14975 1 1 32 GLY O O -20.110 2.287 -3.601 1.00 . A A . 32 GLY O 1 1 14 14976 1 1 33 GLY C C -20.084 2.068 0.492 1.00 . A A . 33 GLY C 1 1 14 14977 1 1 33 GLY CA C -20.655 1.989 -0.912 1.00 . A A . 33 GLY CA 1 1 14 14978 1 1 33 GLY H H -19.629 0.191 -1.346 1.00 . A A . 33 GLY H 1 1 14 14979 1 1 33 GLY HA2 H -20.588 2.964 -1.373 1.00 . A A . 33 GLY HA2 1 1 14 14980 1 1 33 GLY HA3 H -21.694 1.701 -0.851 1.00 . A A . 33 GLY HA3 1 1 14 14981 1 1 33 GLY N N -19.949 1.029 -1.740 1.00 . A A . 33 GLY N 1 1 14 14982 1 1 33 GLY O O -20.728 2.592 1.402 1.00 . A A . 33 GLY O 1 1 14 14983 1 1 34 ASP C C -16.742 1.928 1.831 1.00 . A A . 34 ASP C 1 1 14 14984 1 1 34 ASP CA C -18.215 1.559 1.971 1.00 . A A . 34 ASP CA 1 1 14 14985 1 1 34 ASP CB C -18.347 0.190 2.641 1.00 . A A . 34 ASP CB 1 1 14 14986 1 1 34 ASP CG C -19.787 -0.165 2.954 1.00 . A A . 34 ASP CG 1 1 14 14987 1 1 34 ASP H H -18.404 1.152 -0.094 1.00 . A A . 34 ASP H 1 1 14 14988 1 1 34 ASP HA H -18.704 2.299 2.585 1.00 . A A . 34 ASP HA 1 1 14 14989 1 1 34 ASP HB2 H -17.945 -0.567 1.981 1.00 . A A . 34 ASP HB2 1 1 14 14990 1 1 34 ASP HB3 H -17.786 0.191 3.564 1.00 . A A . 34 ASP HB3 1 1 14 14991 1 1 34 ASP N N -18.871 1.548 0.670 1.00 . A A . 34 ASP N 1 1 14 14992 1 1 34 ASP O O -16.247 2.136 0.724 1.00 . A A . 34 ASP O 1 1 14 14993 1 1 34 ASP OD1 O -20.510 -0.581 2.024 1.00 . A A . 34 ASP OD1 1 1 14 14994 1 1 34 ASP OD2 O -20.192 -0.025 4.127 1.00 . A A . 34 ASP OD2 1 1 14 14995 1 1 35 CYS C C -13.892 1.624 4.079 1.00 . A A . 35 CYS C 1 1 14 14996 1 1 35 CYS CA C -14.631 2.352 2.961 1.00 . A A . 35 CYS CA 1 1 14 14997 1 1 35 CYS CB C -14.456 3.864 3.122 1.00 . A A . 35 CYS CB 1 1 14 14998 1 1 35 CYS H H -16.495 1.825 3.813 1.00 . A A . 35 CYS H 1 1 14 14999 1 1 35 CYS HA H -14.214 2.049 2.012 1.00 . A A . 35 CYS HA 1 1 14 15000 1 1 35 CYS HB2 H -14.828 4.161 4.090 1.00 . A A . 35 CYS HB2 1 1 14 15001 1 1 35 CYS HB3 H -13.405 4.105 3.055 1.00 . A A . 35 CYS HB3 1 1 14 15002 1 1 35 CYS HG H -15.177 6.123 2.185 1.00 . A A . 35 CYS HG 1 1 14 15003 1 1 35 CYS N N -16.046 2.006 2.960 1.00 . A A . 35 CYS N 1 1 14 15004 1 1 35 CYS O O -14.064 1.937 5.257 1.00 . A A . 35 CYS O 1 1 14 15005 1 1 35 CYS SG S -15.325 4.844 1.875 1.00 . A A . 35 CYS SG 1 1 14 15006 1 1 36 GLU C C -10.805 0.057 4.473 1.00 . A A . 36 GLU C 1 1 14 15007 1 1 36 GLU CA C -12.305 -0.120 4.681 1.00 . A A . 36 GLU CA 1 1 14 15008 1 1 36 GLU CB C -12.667 -1.600 4.592 1.00 . A A . 36 GLU CB 1 1 14 15009 1 1 36 GLU CD C -14.897 -1.265 5.723 1.00 . A A . 36 GLU CD 1 1 14 15010 1 1 36 GLU CG C -14.163 -1.858 4.537 1.00 . A A . 36 GLU CG 1 1 14 15011 1 1 36 GLU H H -12.962 0.454 2.749 1.00 . A A . 36 GLU H 1 1 14 15012 1 1 36 GLU HA H -12.564 0.246 5.663 1.00 . A A . 36 GLU HA 1 1 14 15013 1 1 36 GLU HB2 H -12.215 -2.016 3.706 1.00 . A A . 36 GLU HB2 1 1 14 15014 1 1 36 GLU HB3 H -12.269 -2.108 5.459 1.00 . A A . 36 GLU HB3 1 1 14 15015 1 1 36 GLU HG2 H -14.558 -1.421 3.633 1.00 . A A . 36 GLU HG2 1 1 14 15016 1 1 36 GLU HG3 H -14.332 -2.925 4.524 1.00 . A A . 36 GLU HG3 1 1 14 15017 1 1 36 GLU N N -13.065 0.652 3.703 1.00 . A A . 36 GLU N 1 1 14 15018 1 1 36 GLU O O -10.364 0.570 3.445 1.00 . A A . 36 GLU O 1 1 14 15019 1 1 36 GLU OE1 O -15.006 -1.954 6.760 1.00 . A A . 36 GLU OE1 1 1 14 15020 1 1 36 GLU OE2 O -15.364 -0.113 5.615 1.00 . A A . 36 GLU OE2 1 1 14 15021 1 1 37 TRP C C -7.939 -1.473 4.750 1.00 . A A . 37 TRP C 1 1 14 15022 1 1 37 TRP CA C -8.579 -0.260 5.410 1.00 . A A . 37 TRP CA 1 1 14 15023 1 1 37 TRP CB C -8.010 -0.110 6.824 1.00 . A A . 37 TRP CB 1 1 14 15024 1 1 37 TRP CD1 C -8.783 2.323 6.929 1.00 . A A . 37 TRP CD1 1 1 14 15025 1 1 37 TRP CD2 C -8.561 1.344 8.928 1.00 . A A . 37 TRP CD2 1 1 14 15026 1 1 37 TRP CE2 C -8.988 2.671 9.125 1.00 . A A . 37 TRP CE2 1 1 14 15027 1 1 37 TRP CE3 C -8.352 0.530 10.046 1.00 . A A . 37 TRP CE3 1 1 14 15028 1 1 37 TRP CG C -8.440 1.143 7.517 1.00 . A A . 37 TRP CG 1 1 14 15029 1 1 37 TRP CH2 C -8.997 2.381 11.469 1.00 . A A . 37 TRP CH2 1 1 14 15030 1 1 37 TRP CZ2 C -9.211 3.201 10.393 1.00 . A A . 37 TRP CZ2 1 1 14 15031 1 1 37 TRP CZ3 C -8.573 1.057 11.305 1.00 . A A . 37 TRP CZ3 1 1 14 15032 1 1 37 TRP H H -10.447 -0.777 6.247 1.00 . A A . 37 TRP H 1 1 14 15033 1 1 37 TRP HA H -8.333 0.621 4.839 1.00 . A A . 37 TRP HA 1 1 14 15034 1 1 37 TRP HB2 H -8.333 -0.948 7.423 1.00 . A A . 37 TRP HB2 1 1 14 15035 1 1 37 TRP HB3 H -6.931 -0.110 6.769 1.00 . A A . 37 TRP HB3 1 1 14 15036 1 1 37 TRP HD1 H -8.788 2.490 5.863 1.00 . A A . 37 TRP HD1 1 1 14 15037 1 1 37 TRP HE1 H -9.402 4.170 7.716 1.00 . A A . 37 TRP HE1 1 1 14 15038 1 1 37 TRP HE3 H -8.025 -0.494 9.938 1.00 . A A . 37 TRP HE3 1 1 14 15039 1 1 37 TRP HH2 H -9.156 2.752 12.472 1.00 . A A . 37 TRP HH2 1 1 14 15040 1 1 37 TRP HZ2 H -9.539 4.219 10.539 1.00 . A A . 37 TRP HZ2 1 1 14 15041 1 1 37 TRP HZ3 H -8.416 0.443 12.180 1.00 . A A . 37 TRP HZ3 1 1 14 15042 1 1 37 TRP N N -10.030 -0.376 5.461 1.00 . A A . 37 TRP N 1 1 14 15043 1 1 37 TRP NE1 N -9.117 3.248 7.888 1.00 . A A . 37 TRP NE1 1 1 14 15044 1 1 37 TRP O O -8.419 -2.599 4.885 1.00 . A A . 37 TRP O 1 1 14 15045 1 1 38 VAL C C -5.061 -2.860 4.317 1.00 . A A . 38 VAL C 1 1 14 15046 1 1 38 VAL CA C -6.107 -2.292 3.372 1.00 . A A . 38 VAL CA 1 1 14 15047 1 1 38 VAL CB C -5.412 -1.788 2.092 1.00 . A A . 38 VAL CB 1 1 14 15048 1 1 38 VAL CG1 C -4.601 -2.899 1.443 1.00 . A A . 38 VAL CG1 1 1 14 15049 1 1 38 VAL CG2 C -6.433 -1.238 1.118 1.00 . A A . 38 VAL CG2 1 1 14 15050 1 1 38 VAL H H -6.543 -0.296 3.938 1.00 . A A . 38 VAL H 1 1 14 15051 1 1 38 VAL HA H -6.804 -3.073 3.102 1.00 . A A . 38 VAL HA 1 1 14 15052 1 1 38 VAL HB H -4.738 -0.991 2.362 1.00 . A A . 38 VAL HB 1 1 14 15053 1 1 38 VAL HG11 H -4.326 -2.606 0.443 1.00 . A A . 38 VAL HG11 1 1 14 15054 1 1 38 VAL HG12 H -5.193 -3.801 1.403 1.00 . A A . 38 VAL HG12 1 1 14 15055 1 1 38 VAL HG13 H -3.709 -3.079 2.023 1.00 . A A . 38 VAL HG13 1 1 14 15056 1 1 38 VAL HG21 H -6.864 -2.049 0.556 1.00 . A A . 38 VAL HG21 1 1 14 15057 1 1 38 VAL HG22 H -5.953 -0.546 0.443 1.00 . A A . 38 VAL HG22 1 1 14 15058 1 1 38 VAL HG23 H -7.213 -0.729 1.665 1.00 . A A . 38 VAL HG23 1 1 14 15059 1 1 38 VAL N N -6.848 -1.228 4.036 1.00 . A A . 38 VAL N 1 1 14 15060 1 1 38 VAL O O -4.705 -2.229 5.312 1.00 . A A . 38 VAL O 1 1 14 15061 1 1 39 LYS C C -2.198 -4.085 4.712 1.00 . A A . 39 LYS C 1 1 14 15062 1 1 39 LYS CA C -3.582 -4.694 4.852 1.00 . A A . 39 LYS CA 1 1 14 15063 1 1 39 LYS CB C -3.534 -6.195 4.567 1.00 . A A . 39 LYS CB 1 1 14 15064 1 1 39 LYS CD C -2.547 -8.438 5.114 1.00 . A A . 39 LYS CD 1 1 14 15065 1 1 39 LYS CE C -1.627 -9.215 6.043 1.00 . A A . 39 LYS CE 1 1 14 15066 1 1 39 LYS CG C -2.550 -6.954 5.443 1.00 . A A . 39 LYS CG 1 1 14 15067 1 1 39 LYS H H -4.885 -4.509 3.202 1.00 . A A . 39 LYS H 1 1 14 15068 1 1 39 LYS HA H -3.897 -4.541 5.862 1.00 . A A . 39 LYS HA 1 1 14 15069 1 1 39 LYS HB2 H -4.518 -6.611 4.727 1.00 . A A . 39 LYS HB2 1 1 14 15070 1 1 39 LYS HB3 H -3.253 -6.345 3.536 1.00 . A A . 39 LYS HB3 1 1 14 15071 1 1 39 LYS HD2 H -3.551 -8.821 5.215 1.00 . A A . 39 LYS HD2 1 1 14 15072 1 1 39 LYS HD3 H -2.210 -8.570 4.097 1.00 . A A . 39 LYS HD3 1 1 14 15073 1 1 39 LYS HE2 H -0.621 -8.838 5.931 1.00 . A A . 39 LYS HE2 1 1 14 15074 1 1 39 LYS HE3 H -1.954 -9.065 7.061 1.00 . A A . 39 LYS HE3 1 1 14 15075 1 1 39 LYS HG2 H -1.558 -6.557 5.282 1.00 . A A . 39 LYS HG2 1 1 14 15076 1 1 39 LYS HG3 H -2.828 -6.823 6.478 1.00 . A A . 39 LYS HG3 1 1 14 15077 1 1 39 LYS HZ1 H -1.009 -11.178 6.399 1.00 . A A . 39 LYS HZ1 1 1 14 15078 1 1 39 LYS HZ2 H -1.304 -10.838 4.768 1.00 . A A . 39 LYS HZ2 1 1 14 15079 1 1 39 LYS HZ3 H -2.598 -11.052 5.836 1.00 . A A . 39 LYS HZ3 1 1 14 15080 1 1 39 LYS N N -4.568 -4.048 4.006 1.00 . A A . 39 LYS N 1 1 14 15081 1 1 39 LYS NZ N -1.635 -10.673 5.740 1.00 . A A . 39 LYS NZ 1 1 14 15082 1 1 39 LYS O O -1.489 -4.322 3.735 1.00 . A A . 39 LYS O 1 1 14 15083 1 1 40 GLY C C 0.479 -3.474 6.524 1.00 . A A . 40 GLY C 1 1 14 15084 1 1 40 GLY CA C -0.525 -2.672 5.731 1.00 . A A . 40 GLY CA 1 1 14 15085 1 1 40 GLY H H -2.460 -3.119 6.439 1.00 . A A . 40 GLY H 1 1 14 15086 1 1 40 GLY HA2 H -0.170 -2.594 4.719 1.00 . A A . 40 GLY HA2 1 1 14 15087 1 1 40 GLY HA3 H -0.603 -1.684 6.158 1.00 . A A . 40 GLY HA3 1 1 14 15088 1 1 40 GLY N N -1.830 -3.294 5.714 1.00 . A A . 40 GLY N 1 1 14 15089 1 1 40 GLY O O 1.193 -2.942 7.374 1.00 . A A . 40 GLY O 1 1 14 15090 1 1 41 VAL C C 2.329 -6.337 5.852 1.00 . A A . 41 VAL C 1 1 14 15091 1 1 41 VAL CA C 1.449 -5.669 6.903 1.00 . A A . 41 VAL CA 1 1 14 15092 1 1 41 VAL CB C 0.750 -6.772 7.717 1.00 . A A . 41 VAL CB 1 1 14 15093 1 1 41 VAL CG1 C 1.678 -7.304 8.799 1.00 . A A . 41 VAL CG1 1 1 14 15094 1 1 41 VAL CG2 C -0.554 -6.269 8.318 1.00 . A A . 41 VAL CG2 1 1 14 15095 1 1 41 VAL H H -0.130 -5.136 5.608 1.00 . A A . 41 VAL H 1 1 14 15096 1 1 41 VAL HA H 2.069 -5.088 7.570 1.00 . A A . 41 VAL HA 1 1 14 15097 1 1 41 VAL HB H 0.525 -7.587 7.044 1.00 . A A . 41 VAL HB 1 1 14 15098 1 1 41 VAL HG11 H 2.538 -7.769 8.340 1.00 . A A . 41 VAL HG11 1 1 14 15099 1 1 41 VAL HG12 H 1.151 -8.032 9.398 1.00 . A A . 41 VAL HG12 1 1 14 15100 1 1 41 VAL HG13 H 2.003 -6.488 9.427 1.00 . A A . 41 VAL HG13 1 1 14 15101 1 1 41 VAL HG21 H -0.996 -7.047 8.923 1.00 . A A . 41 VAL HG21 1 1 14 15102 1 1 41 VAL HG22 H -1.236 -5.999 7.526 1.00 . A A . 41 VAL HG22 1 1 14 15103 1 1 41 VAL HG23 H -0.356 -5.404 8.933 1.00 . A A . 41 VAL HG23 1 1 14 15104 1 1 41 VAL N N 0.507 -4.771 6.259 1.00 . A A . 41 VAL N 1 1 14 15105 1 1 41 VAL O O 3.191 -7.151 6.181 1.00 . A A . 41 VAL O 1 1 14 15106 1 1 42 HIS C C 4.288 -6.021 3.522 1.00 . A A . 42 HIS C 1 1 14 15107 1 1 42 HIS CA C 2.881 -6.563 3.497 1.00 . A A . 42 HIS CA 1 1 14 15108 1 1 42 HIS CB C 2.187 -6.321 2.156 1.00 . A A . 42 HIS CB 1 1 14 15109 1 1 42 HIS CD2 C 2.612 -8.657 1.108 1.00 . A A . 42 HIS CD2 1 1 14 15110 1 1 42 HIS CE1 C 0.597 -9.024 0.324 1.00 . A A . 42 HIS CE1 1 1 14 15111 1 1 42 HIS CG C 1.850 -7.582 1.423 1.00 . A A . 42 HIS CG 1 1 14 15112 1 1 42 HIS H H 1.426 -5.320 4.370 1.00 . A A . 42 HIS H 1 1 14 15113 1 1 42 HIS HA H 2.952 -7.608 3.673 1.00 . A A . 42 HIS HA 1 1 14 15114 1 1 42 HIS HB2 H 1.260 -5.786 2.329 1.00 . A A . 42 HIS HB2 1 1 14 15115 1 1 42 HIS HB3 H 2.827 -5.728 1.525 1.00 . A A . 42 HIS HB3 1 1 14 15116 1 1 42 HIS HD1 H -0.184 -7.252 0.983 1.00 . A A . 42 HIS HD1 1 1 14 15117 1 1 42 HIS HD2 H 3.657 -8.796 1.350 1.00 . A A . 42 HIS HD2 1 1 14 15118 1 1 42 HIS HE1 H -0.247 -9.488 -0.163 1.00 . A A . 42 HIS HE1 1 1 14 15119 1 1 42 HIS HE2 H 2.062 -10.446 0.155 1.00 . A A . 42 HIS HE2 1 1 14 15120 1 1 42 HIS N N 2.109 -5.988 4.580 1.00 . A A . 42 HIS N 1 1 14 15121 1 1 42 HIS ND1 N 0.595 -7.843 0.917 1.00 . A A . 42 HIS ND1 1 1 14 15122 1 1 42 HIS NE2 N 1.810 -9.538 0.426 1.00 . A A . 42 HIS NE2 1 1 14 15123 1 1 42 HIS O O 4.662 -5.159 2.734 1.00 . A A . 42 HIS O 1 1 14 15124 1 1 43 VAL C C 7.326 -6.351 3.461 1.00 . A A . 43 VAL C 1 1 14 15125 1 1 43 VAL CA C 6.442 -6.228 4.689 1.00 . A A . 43 VAL CA 1 1 14 15126 1 1 43 VAL CB C 7.035 -7.085 5.834 1.00 . A A . 43 VAL CB 1 1 14 15127 1 1 43 VAL CG1 C 8.515 -6.791 6.044 1.00 . A A . 43 VAL CG1 1 1 14 15128 1 1 43 VAL CG2 C 6.259 -6.861 7.122 1.00 . A A . 43 VAL CG2 1 1 14 15129 1 1 43 VAL H H 4.641 -7.289 5.006 1.00 . A A . 43 VAL H 1 1 14 15130 1 1 43 VAL HA H 6.458 -5.205 5.000 1.00 . A A . 43 VAL HA 1 1 14 15131 1 1 43 VAL HB H 6.937 -8.126 5.560 1.00 . A A . 43 VAL HB 1 1 14 15132 1 1 43 VAL HG11 H 8.741 -6.824 7.100 1.00 . A A . 43 VAL HG11 1 1 14 15133 1 1 43 VAL HG12 H 8.745 -5.812 5.654 1.00 . A A . 43 VAL HG12 1 1 14 15134 1 1 43 VAL HG13 H 9.106 -7.532 5.526 1.00 . A A . 43 VAL HG13 1 1 14 15135 1 1 43 VAL HG21 H 5.228 -7.148 6.975 1.00 . A A . 43 VAL HG21 1 1 14 15136 1 1 43 VAL HG22 H 6.308 -5.818 7.395 1.00 . A A . 43 VAL HG22 1 1 14 15137 1 1 43 VAL HG23 H 6.689 -7.461 7.909 1.00 . A A . 43 VAL HG23 1 1 14 15138 1 1 43 VAL N N 5.050 -6.597 4.442 1.00 . A A . 43 VAL N 1 1 14 15139 1 1 43 VAL O O 8.211 -7.198 3.408 1.00 . A A . 43 VAL O 1 1 14 15140 1 1 44 ALA C C 9.086 -4.508 1.500 1.00 . A A . 44 ALA C 1 1 14 15141 1 1 44 ALA CA C 7.908 -5.447 1.295 1.00 . A A . 44 ALA CA 1 1 14 15142 1 1 44 ALA CB C 7.077 -5.028 0.093 1.00 . A A . 44 ALA CB 1 1 14 15143 1 1 44 ALA H H 6.369 -4.831 2.597 1.00 . A A . 44 ALA H 1 1 14 15144 1 1 44 ALA HA H 8.286 -6.441 1.125 1.00 . A A . 44 ALA HA 1 1 14 15145 1 1 44 ALA HB1 H 6.710 -4.023 0.242 1.00 . A A . 44 ALA HB1 1 1 14 15146 1 1 44 ALA HB2 H 6.242 -5.704 -0.021 1.00 . A A . 44 ALA HB2 1 1 14 15147 1 1 44 ALA HB3 H 7.689 -5.058 -0.796 1.00 . A A . 44 ALA HB3 1 1 14 15148 1 1 44 ALA N N 7.102 -5.474 2.498 1.00 . A A . 44 ALA N 1 1 14 15149 1 1 44 ALA O O 9.335 -3.611 0.695 1.00 . A A . 44 ALA O 1 1 14 15150 1 1 45 GLU C C 11.874 -3.736 1.734 1.00 . A A . 45 GLU C 1 1 14 15151 1 1 45 GLU CA C 10.969 -3.914 2.943 1.00 . A A . 45 GLU CA 1 1 14 15152 1 1 45 GLU CB C 11.753 -4.556 4.090 1.00 . A A . 45 GLU CB 1 1 14 15153 1 1 45 GLU CD C 13.777 -4.455 5.597 1.00 . A A . 45 GLU CD 1 1 14 15154 1 1 45 GLU CG C 13.036 -3.819 4.437 1.00 . A A . 45 GLU CG 1 1 14 15155 1 1 45 GLU H H 9.562 -5.478 3.179 1.00 . A A . 45 GLU H 1 1 14 15156 1 1 45 GLU HA H 10.612 -2.945 3.258 1.00 . A A . 45 GLU HA 1 1 14 15157 1 1 45 GLU HB2 H 11.127 -4.579 4.970 1.00 . A A . 45 GLU HB2 1 1 14 15158 1 1 45 GLU HB3 H 12.007 -5.568 3.814 1.00 . A A . 45 GLU HB3 1 1 14 15159 1 1 45 GLU HG2 H 13.682 -3.822 3.572 1.00 . A A . 45 GLU HG2 1 1 14 15160 1 1 45 GLU HG3 H 12.791 -2.800 4.699 1.00 . A A . 45 GLU HG3 1 1 14 15161 1 1 45 GLU N N 9.809 -4.731 2.597 1.00 . A A . 45 GLU N 1 1 14 15162 1 1 45 GLU O O 12.602 -2.752 1.624 1.00 . A A . 45 GLU O 1 1 14 15163 1 1 45 GLU OE1 O 14.574 -5.387 5.354 1.00 . A A . 45 GLU OE1 1 1 14 15164 1 1 45 GLU OE2 O 13.562 -4.022 6.749 1.00 . A A . 45 GLU OE2 1 1 14 15165 1 1 46 ASP C C 12.080 -3.594 -1.319 1.00 . A A . 46 ASP C 1 1 14 15166 1 1 46 ASP CA C 12.620 -4.659 -0.383 1.00 . A A . 46 ASP CA 1 1 14 15167 1 1 46 ASP CB C 12.616 -6.015 -1.082 1.00 . A A . 46 ASP CB 1 1 14 15168 1 1 46 ASP CG C 13.203 -7.114 -0.219 1.00 . A A . 46 ASP CG 1 1 14 15169 1 1 46 ASP H H 11.230 -5.478 0.997 1.00 . A A . 46 ASP H 1 1 14 15170 1 1 46 ASP HA H 13.635 -4.398 -0.117 1.00 . A A . 46 ASP HA 1 1 14 15171 1 1 46 ASP HB2 H 11.601 -6.279 -1.330 1.00 . A A . 46 ASP HB2 1 1 14 15172 1 1 46 ASP HB3 H 13.198 -5.944 -1.990 1.00 . A A . 46 ASP HB3 1 1 14 15173 1 1 46 ASP N N 11.821 -4.708 0.835 1.00 . A A . 46 ASP N 1 1 14 15174 1 1 46 ASP O O 12.838 -2.822 -1.891 1.00 . A A . 46 ASP O 1 1 14 15175 1 1 46 ASP OD1 O 12.447 -7.716 0.572 1.00 . A A . 46 ASP OD1 1 1 14 15176 1 1 46 ASP OD2 O 14.419 -7.375 -0.335 1.00 . A A . 46 ASP OD2 1 1 14 15177 1 1 47 VAL C C 10.396 -1.158 -1.782 1.00 . A A . 47 VAL C 1 1 14 15178 1 1 47 VAL CA C 10.144 -2.554 -2.328 1.00 . A A . 47 VAL CA 1 1 14 15179 1 1 47 VAL CB C 8.631 -2.793 -2.457 1.00 . A A . 47 VAL CB 1 1 14 15180 1 1 47 VAL CG1 C 7.980 -1.709 -3.304 1.00 . A A . 47 VAL CG1 1 1 14 15181 1 1 47 VAL CG2 C 8.363 -4.167 -3.044 1.00 . A A . 47 VAL CG2 1 1 14 15182 1 1 47 VAL H H 10.197 -4.163 -0.952 1.00 . A A . 47 VAL H 1 1 14 15183 1 1 47 VAL HA H 10.592 -2.638 -3.309 1.00 . A A . 47 VAL HA 1 1 14 15184 1 1 47 VAL HB H 8.201 -2.759 -1.467 1.00 . A A . 47 VAL HB 1 1 14 15185 1 1 47 VAL HG11 H 8.196 -0.740 -2.877 1.00 . A A . 47 VAL HG11 1 1 14 15186 1 1 47 VAL HG12 H 6.911 -1.862 -3.325 1.00 . A A . 47 VAL HG12 1 1 14 15187 1 1 47 VAL HG13 H 8.371 -1.754 -4.310 1.00 . A A . 47 VAL HG13 1 1 14 15188 1 1 47 VAL HG21 H 9.007 -4.890 -2.568 1.00 . A A . 47 VAL HG21 1 1 14 15189 1 1 47 VAL HG22 H 8.565 -4.151 -4.105 1.00 . A A . 47 VAL HG22 1 1 14 15190 1 1 47 VAL HG23 H 7.331 -4.437 -2.877 1.00 . A A . 47 VAL HG23 1 1 14 15191 1 1 47 VAL N N 10.764 -3.541 -1.458 1.00 . A A . 47 VAL N 1 1 14 15192 1 1 47 VAL O O 10.668 -0.245 -2.528 1.00 . A A . 47 VAL O 1 1 14 15193 1 1 48 ALA C C 11.989 0.558 0.315 1.00 . A A . 48 ALA C 1 1 14 15194 1 1 48 ALA CA C 10.518 0.178 0.299 1.00 . A A . 48 ALA CA 1 1 14 15195 1 1 48 ALA CB C 10.021 -0.014 1.724 1.00 . A A . 48 ALA CB 1 1 14 15196 1 1 48 ALA H H 10.103 -1.841 0.014 1.00 . A A . 48 ALA H 1 1 14 15197 1 1 48 ALA HA H 9.943 0.968 -0.145 1.00 . A A . 48 ALA HA 1 1 14 15198 1 1 48 ALA HB1 H 10.572 -0.815 2.194 1.00 . A A . 48 ALA HB1 1 1 14 15199 1 1 48 ALA HB2 H 8.970 -0.259 1.709 1.00 . A A . 48 ALA HB2 1 1 14 15200 1 1 48 ALA HB3 H 10.170 0.900 2.281 1.00 . A A . 48 ALA HB3 1 1 14 15201 1 1 48 ALA N N 10.309 -1.054 -0.464 1.00 . A A . 48 ALA N 1 1 14 15202 1 1 48 ALA O O 12.363 1.649 -0.116 1.00 . A A . 48 ALA O 1 1 14 15203 1 1 49 LYS C C 14.770 0.186 -0.525 1.00 . A A . 49 LYS C 1 1 14 15204 1 1 49 LYS CA C 14.255 -0.111 0.874 1.00 . A A . 49 LYS CA 1 1 14 15205 1 1 49 LYS CB C 14.979 -1.327 1.454 1.00 . A A . 49 LYS CB 1 1 14 15206 1 1 49 LYS CD C 16.824 -0.129 2.669 1.00 . A A . 49 LYS CD 1 1 14 15207 1 1 49 LYS CE C 16.434 -0.641 4.046 1.00 . A A . 49 LYS CE 1 1 14 15208 1 1 49 LYS CG C 16.481 -1.136 1.583 1.00 . A A . 49 LYS CG 1 1 14 15209 1 1 49 LYS H H 12.464 -1.206 1.137 1.00 . A A . 49 LYS H 1 1 14 15210 1 1 49 LYS HA H 14.430 0.748 1.506 1.00 . A A . 49 LYS HA 1 1 14 15211 1 1 49 LYS HB2 H 14.578 -1.535 2.437 1.00 . A A . 49 LYS HB2 1 1 14 15212 1 1 49 LYS HB3 H 14.799 -2.179 0.815 1.00 . A A . 49 LYS HB3 1 1 14 15213 1 1 49 LYS HD2 H 17.888 0.055 2.653 1.00 . A A . 49 LYS HD2 1 1 14 15214 1 1 49 LYS HD3 H 16.295 0.792 2.472 1.00 . A A . 49 LYS HD3 1 1 14 15215 1 1 49 LYS HE2 H 15.367 -0.808 4.065 1.00 . A A . 49 LYS HE2 1 1 14 15216 1 1 49 LYS HE3 H 16.947 -1.574 4.229 1.00 . A A . 49 LYS HE3 1 1 14 15217 1 1 49 LYS HG2 H 16.937 -2.084 1.829 1.00 . A A . 49 LYS HG2 1 1 14 15218 1 1 49 LYS HG3 H 16.871 -0.781 0.639 1.00 . A A . 49 LYS HG3 1 1 14 15219 1 1 49 LYS HZ1 H 16.546 -0.067 6.052 1.00 . A A . 49 LYS HZ1 1 1 14 15220 1 1 49 LYS HZ2 H 16.272 1.218 4.986 1.00 . A A . 49 LYS HZ2 1 1 14 15221 1 1 49 LYS HZ3 H 17.811 0.524 5.100 1.00 . A A . 49 LYS HZ3 1 1 14 15222 1 1 49 LYS N N 12.821 -0.350 0.816 1.00 . A A . 49 LYS N 1 1 14 15223 1 1 49 LYS NZ N 16.790 0.326 5.122 1.00 . A A . 49 LYS NZ 1 1 14 15224 1 1 49 LYS O O 15.741 0.919 -0.708 1.00 . A A . 49 LYS O 1 1 14 15225 1 1 50 ASP C C 13.674 0.947 -3.497 1.00 . A A . 50 ASP C 1 1 14 15226 1 1 50 ASP CA C 14.474 -0.209 -2.898 1.00 . A A . 50 ASP CA 1 1 14 15227 1 1 50 ASP CB C 14.234 -1.491 -3.694 1.00 . A A . 50 ASP CB 1 1 14 15228 1 1 50 ASP CG C 14.986 -1.508 -5.010 1.00 . A A . 50 ASP CG 1 1 14 15229 1 1 50 ASP H H 13.352 -0.986 -1.295 1.00 . A A . 50 ASP H 1 1 14 15230 1 1 50 ASP HA H 15.524 0.035 -2.933 1.00 . A A . 50 ASP HA 1 1 14 15231 1 1 50 ASP HB2 H 14.554 -2.340 -3.102 1.00 . A A . 50 ASP HB2 1 1 14 15232 1 1 50 ASP HB3 H 13.178 -1.583 -3.902 1.00 . A A . 50 ASP HB3 1 1 14 15233 1 1 50 ASP N N 14.112 -0.407 -1.509 1.00 . A A . 50 ASP N 1 1 14 15234 1 1 50 ASP O O 14.067 1.524 -4.512 1.00 . A A . 50 ASP O 1 1 14 15235 1 1 50 ASP OD1 O 14.467 -0.948 -5.998 1.00 . A A . 50 ASP OD1 1 1 14 15236 1 1 50 ASP OD2 O 16.095 -2.082 -5.052 1.00 . A A . 50 ASP OD2 1 1 14 15237 1 1 51 TYR C C 12.315 3.709 -3.023 1.00 . A A . 51 TYR C 1 1 14 15238 1 1 51 TYR CA C 11.699 2.360 -3.346 1.00 . A A . 51 TYR CA 1 1 14 15239 1 1 51 TYR CB C 10.297 2.319 -2.744 1.00 . A A . 51 TYR CB 1 1 14 15240 1 1 51 TYR CD1 C 9.584 0.896 -4.730 1.00 . A A . 51 TYR CD1 1 1 14 15241 1 1 51 TYR CD2 C 7.884 1.901 -3.391 1.00 . A A . 51 TYR CD2 1 1 14 15242 1 1 51 TYR CE1 C 8.614 0.338 -5.542 1.00 . A A . 51 TYR CE1 1 1 14 15243 1 1 51 TYR CE2 C 6.913 1.343 -4.198 1.00 . A A . 51 TYR CE2 1 1 14 15244 1 1 51 TYR CG C 9.238 1.690 -3.637 1.00 . A A . 51 TYR CG 1 1 14 15245 1 1 51 TYR CZ C 7.282 0.565 -5.273 1.00 . A A . 51 TYR CZ 1 1 14 15246 1 1 51 TYR H H 12.280 0.797 -2.064 1.00 . A A . 51 TYR H 1 1 14 15247 1 1 51 TYR HA H 11.615 2.230 -4.391 1.00 . A A . 51 TYR HA 1 1 14 15248 1 1 51 TYR HB2 H 10.340 1.762 -1.841 1.00 . A A . 51 TYR HB2 1 1 14 15249 1 1 51 TYR HB3 H 9.980 3.328 -2.519 1.00 . A A . 51 TYR HB3 1 1 14 15250 1 1 51 TYR HD1 H 10.625 0.714 -4.939 1.00 . A A . 51 TYR HD1 1 1 14 15251 1 1 51 TYR HD2 H 7.592 2.508 -2.548 1.00 . A A . 51 TYR HD2 1 1 14 15252 1 1 51 TYR HE1 H 8.903 -0.274 -6.383 1.00 . A A . 51 TYR HE1 1 1 14 15253 1 1 51 TYR HE2 H 5.868 1.519 -3.987 1.00 . A A . 51 TYR HE2 1 1 14 15254 1 1 51 TYR HH H 6.573 -0.874 -6.329 1.00 . A A . 51 TYR HH 1 1 14 15255 1 1 51 TYR N N 12.545 1.283 -2.863 1.00 . A A . 51 TYR N 1 1 14 15256 1 1 51 TYR O O 12.733 4.453 -3.909 1.00 . A A . 51 TYR O 1 1 14 15257 1 1 51 TYR OH O 6.315 0.015 -6.082 1.00 . A A . 51 TYR OH 1 1 14 15258 1 1 52 GLU C C 14.413 5.189 -1.059 1.00 . A A . 52 GLU C 1 1 14 15259 1 1 52 GLU CA C 12.902 5.266 -1.242 1.00 . A A . 52 GLU CA 1 1 14 15260 1 1 52 GLU CB C 12.236 5.660 0.081 1.00 . A A . 52 GLU CB 1 1 14 15261 1 1 52 GLU CD C 11.974 5.203 2.553 1.00 . A A . 52 GLU CD 1 1 14 15262 1 1 52 GLU CG C 12.690 4.827 1.270 1.00 . A A . 52 GLU CG 1 1 14 15263 1 1 52 GLU H H 12.039 3.345 -1.075 1.00 . A A . 52 GLU H 1 1 14 15264 1 1 52 GLU HA H 12.675 6.013 -1.979 1.00 . A A . 52 GLU HA 1 1 14 15265 1 1 52 GLU HB2 H 12.460 6.695 0.288 1.00 . A A . 52 GLU HB2 1 1 14 15266 1 1 52 GLU HB3 H 11.167 5.547 -0.021 1.00 . A A . 52 GLU HB3 1 1 14 15267 1 1 52 GLU HG2 H 12.498 3.786 1.060 1.00 . A A . 52 GLU HG2 1 1 14 15268 1 1 52 GLU HG3 H 13.751 4.975 1.412 1.00 . A A . 52 GLU HG3 1 1 14 15269 1 1 52 GLU N N 12.365 4.004 -1.725 1.00 . A A . 52 GLU N 1 1 14 15270 1 1 52 GLU O O 15.152 6.062 -1.515 1.00 . A A . 52 GLU O 1 1 14 15271 1 1 52 GLU OE1 O 12.112 6.364 2.993 1.00 . A A . 52 GLU OE1 1 1 14 15272 1 1 52 GLU OE2 O 11.281 4.333 3.121 1.00 . A A . 52 GLU OE2 1 1 14 15273 1 1 53 ASP C C 16.996 3.411 -1.374 1.00 . A A . 53 ASP C 1 1 14 15274 1 1 53 ASP CA C 16.281 3.936 -0.132 1.00 . A A . 53 ASP CA 1 1 14 15275 1 1 53 ASP CB C 16.465 2.971 1.038 1.00 . A A . 53 ASP CB 1 1 14 15276 1 1 53 ASP CG C 16.384 3.669 2.382 1.00 . A A . 53 ASP CG 1 1 14 15277 1 1 53 ASP H H 14.220 3.474 -0.058 1.00 . A A . 53 ASP H 1 1 14 15278 1 1 53 ASP HA H 16.707 4.892 0.132 1.00 . A A . 53 ASP HA 1 1 14 15279 1 1 53 ASP HB2 H 15.688 2.222 1.002 1.00 . A A . 53 ASP HB2 1 1 14 15280 1 1 53 ASP HB3 H 17.430 2.492 0.958 1.00 . A A . 53 ASP HB3 1 1 14 15281 1 1 53 ASP N N 14.862 4.137 -0.388 1.00 . A A . 53 ASP N 1 1 14 15282 1 1 53 ASP O O 18.214 3.533 -1.495 1.00 . A A . 53 ASP O 1 1 14 15283 1 1 53 ASP OD1 O 17.427 4.162 2.859 1.00 . A A . 53 ASP OD1 1 1 14 15284 1 1 53 ASP OD2 O 15.276 3.723 2.957 1.00 . A A . 53 ASP OD2 1 1 14 15285 1 1 54 GLY C C 17.017 3.385 -4.559 1.00 . A A . 54 GLY C 1 1 14 15286 1 1 54 GLY CA C 16.818 2.307 -3.514 1.00 . A A . 54 GLY CA 1 1 14 15287 1 1 54 GLY H H 15.270 2.746 -2.142 1.00 . A A . 54 GLY H 1 1 14 15288 1 1 54 GLY HA2 H 17.776 1.862 -3.284 1.00 . A A . 54 GLY HA2 1 1 14 15289 1 1 54 GLY HA3 H 16.168 1.548 -3.919 1.00 . A A . 54 GLY HA3 1 1 14 15290 1 1 54 GLY N N 16.234 2.827 -2.293 1.00 . A A . 54 GLY N 1 1 14 15291 1 1 54 GLY O O 17.957 3.328 -5.353 1.00 . A A . 54 GLY O 1 1 14 15292 1 1 55 LEU C C 17.288 6.464 -5.094 1.00 . A A . 55 LEU C 1 1 14 15293 1 1 55 LEU CA C 16.205 5.473 -5.511 1.00 . A A . 55 LEU CA 1 1 14 15294 1 1 55 LEU CB C 14.850 6.178 -5.616 1.00 . A A . 55 LEU CB 1 1 14 15295 1 1 55 LEU CD1 C 15.728 8.045 -7.046 1.00 . A A . 55 LEU CD1 1 1 14 15296 1 1 55 LEU CD2 C 14.594 6.086 -8.109 1.00 . A A . 55 LEU CD2 1 1 14 15297 1 1 55 LEU CG C 14.637 6.998 -6.892 1.00 . A A . 55 LEU CG 1 1 14 15298 1 1 55 LEU H H 15.400 4.361 -3.901 1.00 . A A . 55 LEU H 1 1 14 15299 1 1 55 LEU HA H 16.463 5.059 -6.475 1.00 . A A . 55 LEU HA 1 1 14 15300 1 1 55 LEU HB2 H 14.074 5.429 -5.562 1.00 . A A . 55 LEU HB2 1 1 14 15301 1 1 55 LEU HB3 H 14.745 6.840 -4.769 1.00 . A A . 55 LEU HB3 1 1 14 15302 1 1 55 LEU HD11 H 16.681 7.556 -7.178 1.00 . A A . 55 LEU HD11 1 1 14 15303 1 1 55 LEU HD12 H 15.760 8.666 -6.163 1.00 . A A . 55 LEU HD12 1 1 14 15304 1 1 55 LEU HD13 H 15.517 8.660 -7.909 1.00 . A A . 55 LEU HD13 1 1 14 15305 1 1 55 LEU HD21 H 14.402 6.675 -8.994 1.00 . A A . 55 LEU HD21 1 1 14 15306 1 1 55 LEU HD22 H 13.806 5.358 -7.984 1.00 . A A . 55 LEU HD22 1 1 14 15307 1 1 55 LEU HD23 H 15.540 5.577 -8.211 1.00 . A A . 55 LEU HD23 1 1 14 15308 1 1 55 LEU HG H 13.688 7.512 -6.825 1.00 . A A . 55 LEU HG 1 1 14 15309 1 1 55 LEU N N 16.127 4.373 -4.559 1.00 . A A . 55 LEU N 1 1 14 15310 1 1 55 LEU O O 18.322 6.582 -5.752 1.00 . A A . 55 LEU O 1 1 14 15311 1 1 56 GLU C C 18.968 7.497 -2.503 1.00 . A A . 56 GLU C 1 1 14 15312 1 1 56 GLU CA C 18.007 8.147 -3.489 1.00 . A A . 56 GLU CA 1 1 14 15313 1 1 56 GLU CB C 17.284 9.318 -2.829 1.00 . A A . 56 GLU CB 1 1 14 15314 1 1 56 GLU CD C 17.217 10.797 -4.874 1.00 . A A . 56 GLU CD 1 1 14 15315 1 1 56 GLU CG C 16.413 10.112 -3.787 1.00 . A A . 56 GLU CG 1 1 14 15316 1 1 56 GLU H H 16.206 7.038 -3.512 1.00 . A A . 56 GLU H 1 1 14 15317 1 1 56 GLU HA H 18.572 8.514 -4.326 1.00 . A A . 56 GLU HA 1 1 14 15318 1 1 56 GLU HB2 H 16.661 8.934 -2.041 1.00 . A A . 56 GLU HB2 1 1 14 15319 1 1 56 GLU HB3 H 18.018 9.986 -2.404 1.00 . A A . 56 GLU HB3 1 1 14 15320 1 1 56 GLU HG2 H 15.708 9.440 -4.252 1.00 . A A . 56 GLU HG2 1 1 14 15321 1 1 56 GLU HG3 H 15.877 10.865 -3.226 1.00 . A A . 56 GLU HG3 1 1 14 15322 1 1 56 GLU N N 17.047 7.173 -3.995 1.00 . A A . 56 GLU N 1 1 14 15323 1 1 56 GLU O O 19.102 7.938 -1.362 1.00 . A A . 56 GLU O 1 1 14 15324 1 1 56 GLU OE1 O 17.449 10.167 -5.928 1.00 . A A . 56 GLU OE1 1 1 14 15325 1 1 56 GLU OE2 O 17.615 11.964 -4.673 1.00 . A A . 56 GLU OE2 1 1 14 15326 1 1 57 TYR C C 21.893 6.493 -1.995 1.00 . A A . 57 TYR C 1 1 14 15327 1 1 57 TYR CA C 20.586 5.717 -2.129 1.00 . A A . 57 TYR CA 1 1 14 15328 1 1 57 TYR CB C 20.856 4.334 -2.726 1.00 . A A . 57 TYR CB 1 1 14 15329 1 1 57 TYR CD1 C 21.241 2.743 -0.803 1.00 . A A . 57 TYR CD1 1 1 14 15330 1 1 57 TYR CD2 C 23.116 3.380 -2.130 1.00 . A A . 57 TYR CD2 1 1 14 15331 1 1 57 TYR CE1 C 22.061 1.952 -0.018 1.00 . A A . 57 TYR CE1 1 1 14 15332 1 1 57 TYR CE2 C 23.941 2.592 -1.351 1.00 . A A . 57 TYR CE2 1 1 14 15333 1 1 57 TYR CG C 21.754 3.469 -1.870 1.00 . A A . 57 TYR CG 1 1 14 15334 1 1 57 TYR CZ C 23.403 1.875 -0.296 1.00 . A A . 57 TYR CZ 1 1 14 15335 1 1 57 TYR H H 19.475 6.150 -3.879 1.00 . A A . 57 TYR H 1 1 14 15336 1 1 57 TYR HA H 20.148 5.598 -1.150 1.00 . A A . 57 TYR HA 1 1 14 15337 1 1 57 TYR HB2 H 19.918 3.815 -2.852 1.00 . A A . 57 TYR HB2 1 1 14 15338 1 1 57 TYR HB3 H 21.329 4.453 -3.690 1.00 . A A . 57 TYR HB3 1 1 14 15339 1 1 57 TYR HD1 H 20.185 2.800 -0.588 1.00 . A A . 57 TYR HD1 1 1 14 15340 1 1 57 TYR HD2 H 23.531 3.941 -2.956 1.00 . A A . 57 TYR HD2 1 1 14 15341 1 1 57 TYR HE1 H 21.643 1.394 0.806 1.00 . A A . 57 TYR HE1 1 1 14 15342 1 1 57 TYR HE2 H 24.997 2.537 -1.569 1.00 . A A . 57 TYR HE2 1 1 14 15343 1 1 57 TYR HH H 23.804 0.249 0.640 1.00 . A A . 57 TYR HH 1 1 14 15344 1 1 57 TYR N N 19.633 6.445 -2.959 1.00 . A A . 57 TYR N 1 1 14 15345 1 1 57 TYR O O 22.023 7.264 -1.021 1.00 . A A . 57 TYR O 1 1 14 15346 1 1 57 TYR OXT O 22.774 6.321 -2.862 1.00 . A A . 57 TYR OXT 1 1 14 15347 1 1 57 TYR OH O 24.228 1.096 0.482 1.00 . A A . 57 TYR OH 1 1 14 15348 2 2 1 ALA C C -13.527 -9.033 0.560 1.00 . B B . 1 ALA C 1 1 14 15349 2 2 1 ALA CA C -12.716 -10.129 -0.125 1.00 . B B . 1 ALA CA 1 1 14 15350 2 2 1 ALA CB C -12.950 -10.095 -1.628 1.00 . B B . 1 ALA CB 1 1 14 15351 2 2 1 ALA H1 H -12.482 -12.200 -0.040 1.00 . B B . 1 ALA H1 1 1 14 15352 2 2 1 ALA H2 H -14.064 -11.676 0.246 1.00 . B B . 1 ALA H2 1 1 14 15353 2 2 1 ALA H3 H -12.884 -11.492 1.445 1.00 . B B . 1 ALA H3 1 1 14 15354 2 2 1 ALA HA H -11.665 -9.949 0.054 1.00 . B B . 1 ALA HA 1 1 14 15355 2 2 1 ALA HB1 H -14.003 -10.226 -1.831 1.00 . B B . 1 ALA HB1 1 1 14 15356 2 2 1 ALA HB2 H -12.391 -10.891 -2.098 1.00 . B B . 1 ALA HB2 1 1 14 15357 2 2 1 ALA HB3 H -12.623 -9.145 -2.023 1.00 . B B . 1 ALA HB3 1 1 14 15358 2 2 1 ALA N N -13.060 -11.467 0.420 1.00 . B B . 1 ALA N 1 1 14 15359 2 2 1 ALA O O -14.640 -8.719 0.139 1.00 . B B . 1 ALA O 1 1 14 15360 2 2 2 PRO C C -14.132 -6.239 1.466 1.00 . B B . 2 PRO C 1 1 14 15361 2 2 2 PRO CA C -13.653 -7.368 2.375 1.00 . B B . 2 PRO CA 1 1 14 15362 2 2 2 PRO CB C -12.574 -6.863 3.335 1.00 . B B . 2 PRO CB 1 1 14 15363 2 2 2 PRO CD C -11.649 -8.746 2.195 1.00 . B B . 2 PRO CD 1 1 14 15364 2 2 2 PRO CG C -11.652 -8.019 3.511 1.00 . B B . 2 PRO CG 1 1 14 15365 2 2 2 PRO HA H -14.490 -7.753 2.940 1.00 . B B . 2 PRO HA 1 1 14 15366 2 2 2 PRO HB2 H -12.068 -6.015 2.897 1.00 . B B . 2 PRO HB2 1 1 14 15367 2 2 2 PRO HB3 H -13.028 -6.575 4.272 1.00 . B B . 2 PRO HB3 1 1 14 15368 2 2 2 PRO HD2 H -10.860 -8.372 1.559 1.00 . B B . 2 PRO HD2 1 1 14 15369 2 2 2 PRO HD3 H -11.538 -9.810 2.353 1.00 . B B . 2 PRO HD3 1 1 14 15370 2 2 2 PRO HG2 H -10.660 -7.665 3.746 1.00 . B B . 2 PRO HG2 1 1 14 15371 2 2 2 PRO HG3 H -12.016 -8.664 4.296 1.00 . B B . 2 PRO HG3 1 1 14 15372 2 2 2 PRO N N -12.975 -8.434 1.630 1.00 . B B . 2 PRO N 1 1 14 15373 2 2 2 PRO O O -13.542 -5.987 0.416 1.00 . B B . 2 PRO O 1 1 14 15374 2 2 3 PRO C C -15.050 -3.124 1.334 1.00 . B B . 3 PRO C 1 1 14 15375 2 2 3 PRO CA C -15.772 -4.443 1.080 1.00 . B B . 3 PRO CA 1 1 14 15376 2 2 3 PRO CB C -17.209 -4.373 1.584 1.00 . B B . 3 PRO CB 1 1 14 15377 2 2 3 PRO CD C -15.983 -5.788 3.096 1.00 . B B . 3 PRO CD 1 1 14 15378 2 2 3 PRO CG C -17.125 -4.803 3.010 1.00 . B B . 3 PRO CG 1 1 14 15379 2 2 3 PRO HA H -15.767 -4.660 0.022 1.00 . B B . 3 PRO HA 1 1 14 15380 2 2 3 PRO HB2 H -17.578 -3.362 1.495 1.00 . B B . 3 PRO HB2 1 1 14 15381 2 2 3 PRO HB3 H -17.830 -5.043 1.007 1.00 . B B . 3 PRO HB3 1 1 14 15382 2 2 3 PRO HD2 H -15.380 -5.588 3.969 1.00 . B B . 3 PRO HD2 1 1 14 15383 2 2 3 PRO HD3 H -16.361 -6.800 3.121 1.00 . B B . 3 PRO HD3 1 1 14 15384 2 2 3 PRO HG2 H -16.927 -3.948 3.638 1.00 . B B . 3 PRO HG2 1 1 14 15385 2 2 3 PRO HG3 H -18.049 -5.278 3.304 1.00 . B B . 3 PRO HG3 1 1 14 15386 2 2 3 PRO N N -15.213 -5.546 1.860 1.00 . B B . 3 PRO N 1 1 14 15387 2 2 3 PRO O O -15.653 -2.152 1.793 1.00 . B B . 3 PRO O 1 1 14 15388 2 2 4 GLY C C -11.482 -2.174 1.256 1.00 . B B . 4 GLY C 1 1 14 15389 2 2 4 GLY CA C -12.971 -1.892 1.238 1.00 . B B . 4 GLY CA 1 1 14 15390 2 2 4 GLY H H -13.330 -3.902 0.673 1.00 . B B . 4 GLY H 1 1 14 15391 2 2 4 GLY HA2 H -13.185 -1.198 0.439 1.00 . B B . 4 GLY HA2 1 1 14 15392 2 2 4 GLY HA3 H -13.254 -1.443 2.177 1.00 . B B . 4 GLY HA3 1 1 14 15393 2 2 4 GLY N N -13.756 -3.096 1.035 1.00 . B B . 4 GLY N 1 1 14 15394 2 2 4 GLY O O -10.757 -1.681 2.120 1.00 . B B . 4 GLY O 1 1 14 15395 2 2 5 THR C C -9.203 -3.585 -1.249 1.00 . B B . 5 THR C 1 1 14 15396 2 2 5 THR CA C -9.616 -3.322 0.196 1.00 . B B . 5 THR CA 1 1 14 15397 2 2 5 THR CB C -9.291 -4.562 1.049 1.00 . B B . 5 THR CB 1 1 14 15398 2 2 5 THR CG2 C -7.989 -6.144 -0.090 1.00 . B B . 5 THR CG2 1 1 14 15399 2 2 5 THR H H -11.652 -3.311 -0.371 1.00 . B B . 5 THR H 1 1 14 15400 2 2 5 THR HA H -9.040 -2.492 0.573 1.00 . B B . 5 THR HA 1 1 14 15401 2 2 5 THR HB H -8.229 -4.753 0.991 1.00 . B B . 5 THR HB 1 1 14 15402 2 2 5 THR HG1 H -10.168 -5.697 1.726 1.00 . B B . 5 THR HG1 1 1 14 15403 2 2 5 THR HG21 H -8.784 -5.733 -0.695 1.00 . B B . 5 THR HG21 1 1 14 15404 2 2 5 THR HG22 H -7.968 -7.218 -0.204 1.00 . B B . 5 THR HG22 1 1 14 15405 2 2 5 THR HG23 H -7.044 -5.729 -0.409 1.00 . B B . 5 THR HG23 1 1 14 15406 2 2 5 THR N N -11.027 -2.965 0.293 1.00 . B B . 5 THR N 1 1 14 15407 2 2 5 THR O O -10.045 -3.826 -2.116 1.00 . B B . 5 THR O 1 1 14 15408 2 2 5 THR OG1 O -9.473 -6.355 1.804 1.00 . B B . 5 THR OG1 1 1 14 15409 2 2 6 ALA C C -5.832 -3.863 -2.782 1.00 . B B . 6 ALA C 1 1 14 15410 2 2 6 ALA CA C -7.355 -3.762 -2.829 1.00 . B B . 6 ALA CA 1 1 14 15411 2 2 6 ALA CB C -7.786 -2.650 -3.774 1.00 . B B . 6 ALA CB 1 1 14 15412 2 2 6 ALA H H -7.282 -3.347 -0.763 1.00 . B B . 6 ALA H 1 1 14 15413 2 2 6 ALA HA H -7.757 -4.695 -3.199 1.00 . B B . 6 ALA HA 1 1 14 15414 2 2 6 ALA HB1 H -8.864 -2.610 -3.814 1.00 . B B . 6 ALA HB1 1 1 14 15415 2 2 6 ALA HB2 H -7.395 -2.844 -4.761 1.00 . B B . 6 ALA HB2 1 1 14 15416 2 2 6 ALA HB3 H -7.404 -1.706 -3.415 1.00 . B B . 6 ALA HB3 1 1 14 15417 2 2 6 ALA N N -7.899 -3.534 -1.498 1.00 . B B . 6 ALA N 1 1 14 15418 2 2 6 ALA O O -5.140 -3.281 -3.617 1.00 . B B . 6 ALA O 1 1 14 15419 2 2 7 ARG C C -3.158 -4.938 -2.960 1.00 . B B . 7 ARG C 1 1 14 15420 2 2 7 ARG CA C -3.874 -4.789 -1.618 1.00 . B B . 7 ARG CA 1 1 14 15421 2 2 7 ARG CB C -3.617 -6.030 -0.762 1.00 . B B . 7 ARG CB 1 1 14 15422 2 2 7 ARG CD C -4.036 -8.482 -0.404 1.00 . B B . 7 ARG CD 1 1 14 15423 2 2 7 ARG CG C -4.317 -7.274 -1.281 1.00 . B B . 7 ARG CG 1 1 14 15424 2 2 7 ARG CZ C -4.719 -9.275 1.822 1.00 . B B . 7 ARG CZ 1 1 14 15425 2 2 7 ARG H H -5.931 -5.031 -1.161 1.00 . B B . 7 ARG H 1 1 14 15426 2 2 7 ARG HA H -3.480 -3.930 -1.105 1.00 . B B . 7 ARG HA 1 1 14 15427 2 2 7 ARG HB2 H -2.555 -6.223 -0.735 1.00 . B B . 7 ARG HB2 1 1 14 15428 2 2 7 ARG HB3 H -3.965 -5.838 0.242 1.00 . B B . 7 ARG HB3 1 1 14 15429 2 2 7 ARG HD2 H -4.542 -9.340 -0.821 1.00 . B B . 7 ARG HD2 1 1 14 15430 2 2 7 ARG HD3 H -2.972 -8.664 -0.394 1.00 . B B . 7 ARG HD3 1 1 14 15431 2 2 7 ARG HE H -4.647 -7.360 1.265 1.00 . B B . 7 ARG HE 1 1 14 15432 2 2 7 ARG HG2 H -5.382 -7.096 -1.299 1.00 . B B . 7 ARG HG2 1 1 14 15433 2 2 7 ARG HG3 H -3.968 -7.479 -2.283 1.00 . B B . 7 ARG HG3 1 1 14 15434 2 2 7 ARG HH11 H -4.214 -10.734 0.517 1.00 . B B . 7 ARG HH11 1 1 14 15435 2 2 7 ARG HH12 H -4.697 -11.278 2.090 1.00 . B B . 7 ARG HH12 1 1 14 15436 2 2 7 ARG HH21 H -5.282 -8.066 3.341 1.00 . B B . 7 ARG HH21 1 1 14 15437 2 2 7 ARG HH22 H -5.304 -9.761 3.694 1.00 . B B . 7 ARG HH22 1 1 14 15438 2 2 7 ARG N N -5.319 -4.600 -1.793 1.00 . B B . 7 ARG N 1 1 14 15439 2 2 7 ARG NE N -4.497 -8.282 0.967 1.00 . B B . 7 ARG NE 1 1 14 15440 2 2 7 ARG NH1 N -4.528 -10.532 1.445 1.00 . B B . 7 ARG NH1 1 1 14 15441 2 2 7 ARG NH2 N -5.136 -9.013 3.053 1.00 . B B . 7 ARG NH2 1 1 14 15442 2 2 7 ARG O O -3.633 -5.662 -3.835 1.00 . B B . 7 ARG O 1 1 14 15443 2 2 8 ARG C C -1.177 -5.794 -4.857 1.00 . B B . 8 ARG C 1 1 14 15444 2 2 8 ARG CA C -1.268 -4.341 -4.390 1.00 . B B . 8 ARG CA 1 1 14 15445 2 2 8 ARG CB C 0.135 -3.756 -4.225 1.00 . B B . 8 ARG CB 1 1 14 15446 2 2 8 ARG CD C 0.207 -2.951 -6.606 1.00 . B B . 8 ARG CD 1 1 14 15447 2 2 8 ARG CG C 0.936 -3.721 -5.517 1.00 . B B . 8 ARG CG 1 1 14 15448 2 2 8 ARG CZ C 0.665 -2.131 -8.878 1.00 . B B . 8 ARG CZ 1 1 14 15449 2 2 8 ARG H H -1.685 -3.668 -2.411 1.00 . B B . 8 ARG H 1 1 14 15450 2 2 8 ARG HA H -1.802 -3.770 -5.137 1.00 . B B . 8 ARG HA 1 1 14 15451 2 2 8 ARG HB2 H 0.050 -2.747 -3.851 1.00 . B B . 8 ARG HB2 1 1 14 15452 2 2 8 ARG HB3 H 0.675 -4.352 -3.509 1.00 . B B . 8 ARG HB3 1 1 14 15453 2 2 8 ARG HD2 H -0.752 -3.418 -6.779 1.00 . B B . 8 ARG HD2 1 1 14 15454 2 2 8 ARG HD3 H 0.056 -1.935 -6.271 1.00 . B B . 8 ARG HD3 1 1 14 15455 2 2 8 ARG HE H 1.714 -3.547 -7.945 1.00 . B B . 8 ARG HE 1 1 14 15456 2 2 8 ARG HG2 H 1.885 -3.243 -5.327 1.00 . B B . 8 ARG HG2 1 1 14 15457 2 2 8 ARG HG3 H 1.101 -4.734 -5.854 1.00 . B B . 8 ARG HG3 1 1 14 15458 2 2 8 ARG HH11 H -0.903 -1.252 -7.957 1.00 . B B . 8 ARG HH11 1 1 14 15459 2 2 8 ARG HH12 H -0.572 -0.684 -9.559 1.00 . B B . 8 ARG HH12 1 1 14 15460 2 2 8 ARG HH21 H 2.164 -2.808 -10.055 1.00 . B B . 8 ARG HH21 1 1 14 15461 2 2 8 ARG HH22 H 1.173 -1.570 -10.753 1.00 . B B . 8 ARG HH22 1 1 14 15462 2 2 8 ARG N N -2.021 -4.250 -3.134 1.00 . B B . 8 ARG N 1 1 14 15463 2 2 8 ARG NE N 0.957 -2.932 -7.859 1.00 . B B . 8 ARG NE 1 1 14 15464 2 2 8 ARG NH1 N -0.353 -1.287 -8.791 1.00 . B B . 8 ARG NH1 1 1 14 15465 2 2 8 ARG NH2 N 1.395 -2.173 -9.986 1.00 . B B . 8 ARG NH2 1 1 14 15466 2 2 8 ARG O O -1.371 -6.092 -6.035 1.00 . B B . 8 ARG O 1 1 14 15467 2 2 9 LYS C C 0.587 -8.552 -4.695 1.00 . B B . 9 LYS C 1 1 14 15468 2 2 9 LYS CA C -0.788 -8.145 -4.178 1.00 . B B . 9 LYS CA 1 1 14 15469 2 2 9 LYS CB C -1.856 -8.578 -5.184 1.00 . B B . 9 LYS CB 1 1 14 15470 2 2 9 LYS CD C -3.089 -10.473 -6.286 1.00 . B B . 9 LYS CD 1 1 14 15471 2 2 9 LYS CE C -3.328 -11.974 -6.300 1.00 . B B . 9 LYS CE 1 1 14 15472 2 2 9 LYS CG C -2.055 -10.085 -5.241 1.00 . B B . 9 LYS CG 1 1 14 15473 2 2 9 LYS H H -0.699 -6.342 -2.995 1.00 . B B . 9 LYS H 1 1 14 15474 2 2 9 LYS HA H -0.966 -8.687 -3.250 1.00 . B B . 9 LYS HA 1 1 14 15475 2 2 9 LYS HB2 H -2.795 -8.121 -4.911 1.00 . B B . 9 LYS HB2 1 1 14 15476 2 2 9 LYS HB3 H -1.569 -8.239 -6.166 1.00 . B B . 9 LYS HB3 1 1 14 15477 2 2 9 LYS HD2 H -4.019 -9.972 -6.062 1.00 . B B . 9 LYS HD2 1 1 14 15478 2 2 9 LYS HD3 H -2.736 -10.164 -7.259 1.00 . B B . 9 LYS HD3 1 1 14 15479 2 2 9 LYS HE2 H -2.398 -12.472 -6.535 1.00 . B B . 9 LYS HE2 1 1 14 15480 2 2 9 LYS HE3 H -3.662 -12.282 -5.320 1.00 . B B . 9 LYS HE3 1 1 14 15481 2 2 9 LYS HG2 H -1.115 -10.552 -5.489 1.00 . B B . 9 LYS HG2 1 1 14 15482 2 2 9 LYS HG3 H -2.388 -10.431 -4.274 1.00 . B B . 9 LYS HG3 1 1 14 15483 2 2 9 LYS HZ1 H -4.534 -13.389 -7.253 1.00 . B B . 9 LYS HZ1 1 1 14 15484 2 2 9 LYS HZ2 H -4.023 -12.132 -8.265 1.00 . B B . 9 LYS HZ2 1 1 14 15485 2 2 9 LYS HZ3 H -5.243 -11.858 -7.125 1.00 . B B . 9 LYS HZ3 1 1 14 15486 2 2 9 LYS N N -0.880 -6.684 -3.906 1.00 . B B . 9 LYS N 1 1 14 15487 2 2 9 LYS NZ N -4.354 -12.366 -7.306 1.00 . B B . 9 LYS NZ 1 1 14 15488 2 2 9 LYS O O 0.947 -9.728 -4.631 1.00 . B B . 9 LYS O 1 1 14 15489 2 2 10 ARG C C 3.478 -8.713 -4.684 1.00 . B B . 10 ARG C 1 1 14 15490 2 2 10 ARG CA C 2.693 -7.914 -5.719 1.00 . B B . 10 ARG CA 1 1 14 15491 2 2 10 ARG CB C 3.454 -6.637 -6.089 1.00 . B B . 10 ARG CB 1 1 14 15492 2 2 10 ARG CD C 4.856 -4.711 -5.300 1.00 . B B . 10 ARG CD 1 1 14 15493 2 2 10 ARG CG C 3.929 -5.842 -4.887 1.00 . B B . 10 ARG CG 1 1 14 15494 2 2 10 ARG CZ C 7.062 -4.439 -6.358 1.00 . B B . 10 ARG CZ 1 1 14 15495 2 2 10 ARG H H 1.040 -6.675 -5.240 1.00 . B B . 10 ARG H 1 1 14 15496 2 2 10 ARG HA H 2.570 -8.518 -6.605 1.00 . B B . 10 ARG HA 1 1 14 15497 2 2 10 ARG HB2 H 4.317 -6.905 -6.680 1.00 . B B . 10 ARG HB2 1 1 14 15498 2 2 10 ARG HB3 H 2.807 -6.005 -6.679 1.00 . B B . 10 ARG HB3 1 1 14 15499 2 2 10 ARG HD2 H 4.370 -4.124 -6.065 1.00 . B B . 10 ARG HD2 1 1 14 15500 2 2 10 ARG HD3 H 5.049 -4.088 -4.438 1.00 . B B . 10 ARG HD3 1 1 14 15501 2 2 10 ARG HE H 6.289 -6.176 -5.760 1.00 . B B . 10 ARG HE 1 1 14 15502 2 2 10 ARG HG2 H 3.072 -5.428 -4.380 1.00 . B B . 10 ARG HG2 1 1 14 15503 2 2 10 ARG HG3 H 4.462 -6.505 -4.220 1.00 . B B . 10 ARG HG3 1 1 14 15504 2 2 10 ARG HH11 H 6.015 -2.727 -6.127 1.00 . B B . 10 ARG HH11 1 1 14 15505 2 2 10 ARG HH12 H 7.573 -2.550 -6.863 1.00 . B B . 10 ARG HH12 1 1 14 15506 2 2 10 ARG HH21 H 8.341 -5.958 -6.725 1.00 . B B . 10 ARG HH21 1 1 14 15507 2 2 10 ARG HH22 H 8.896 -4.389 -7.205 1.00 . B B . 10 ARG HH22 1 1 14 15508 2 2 10 ARG N N 1.362 -7.599 -5.207 1.00 . B B . 10 ARG N 1 1 14 15509 2 2 10 ARG NE N 6.126 -5.213 -5.819 1.00 . B B . 10 ARG NE 1 1 14 15510 2 2 10 ARG NH1 N 6.867 -3.132 -6.458 1.00 . B B . 10 ARG NH1 1 1 14 15511 2 2 10 ARG NH2 N 8.192 -4.972 -6.799 1.00 . B B . 10 ARG NH2 1 1 14 15512 2 2 10 ARG O O 4.305 -9.557 -5.029 1.00 . B B . 10 ARG O 1 1 14 15513 2 2 11 LYS C C 5.333 -9.386 -2.574 1.00 . B B . 11 LYS C 1 1 14 15514 2 2 11 LYS CA C 3.854 -9.132 -2.298 1.00 . B B . 11 LYS CA 1 1 14 15515 2 2 11 LYS CB C 3.152 -10.459 -2.025 1.00 . B B . 11 LYS CB 1 1 14 15516 2 2 11 LYS CD C 2.947 -12.849 -2.762 1.00 . B B . 11 LYS CD 1 1 14 15517 2 2 11 LYS CE C 1.486 -13.067 -2.403 1.00 . B B . 11 LYS CE 1 1 14 15518 2 2 11 LYS CG C 3.208 -11.421 -3.201 1.00 . B B . 11 LYS CG 1 1 14 15519 2 2 11 LYS H H 2.537 -7.747 -3.209 1.00 . B B . 11 LYS H 1 1 14 15520 2 2 11 LYS HA H 3.767 -8.507 -1.422 1.00 . B B . 11 LYS HA 1 1 14 15521 2 2 11 LYS HB2 H 3.620 -10.932 -1.174 1.00 . B B . 11 LYS HB2 1 1 14 15522 2 2 11 LYS HB3 H 2.115 -10.264 -1.794 1.00 . B B . 11 LYS HB3 1 1 14 15523 2 2 11 LYS HD2 H 3.214 -13.515 -3.567 1.00 . B B . 11 LYS HD2 1 1 14 15524 2 2 11 LYS HD3 H 3.556 -13.061 -1.897 1.00 . B B . 11 LYS HD3 1 1 14 15525 2 2 11 LYS HE2 H 1.225 -12.408 -1.590 1.00 . B B . 11 LYS HE2 1 1 14 15526 2 2 11 LYS HE3 H 0.878 -12.835 -3.265 1.00 . B B . 11 LYS HE3 1 1 14 15527 2 2 11 LYS HG2 H 2.460 -11.135 -3.923 1.00 . B B . 11 LYS HG2 1 1 14 15528 2 2 11 LYS HG3 H 4.187 -11.366 -3.654 1.00 . B B . 11 LYS HG3 1 1 14 15529 2 2 11 LYS HZ1 H 0.210 -14.606 -1.795 1.00 . B B . 11 LYS HZ1 1 1 14 15530 2 2 11 LYS HZ2 H 1.765 -14.699 -1.131 1.00 . B B . 11 LYS HZ2 1 1 14 15531 2 2 11 LYS HZ3 H 1.508 -15.127 -2.747 1.00 . B B . 11 LYS HZ3 1 1 14 15532 2 2 11 LYS N N 3.201 -8.439 -3.409 1.00 . B B . 11 LYS N 1 1 14 15533 2 2 11 LYS NZ N 1.224 -14.473 -1.990 1.00 . B B . 11 LYS NZ 1 1 14 15534 2 2 11 LYS O O 5.809 -10.518 -2.482 1.00 . B B . 11 LYS O 1 1 14 15535 2 2 12 ALA C C 8.195 -9.221 -2.116 1.00 . B B . 12 ALA C 1 1 14 15536 2 2 12 ALA CA C 7.478 -8.430 -3.202 1.00 . B B . 12 ALA CA 1 1 14 15537 2 2 12 ALA CB C 8.089 -7.049 -3.331 1.00 . B B . 12 ALA CB 1 1 14 15538 2 2 12 ALA H H 5.618 -7.455 -2.960 1.00 . B B . 12 ALA H 1 1 14 15539 2 2 12 ALA HA H 7.588 -8.940 -4.147 1.00 . B B . 12 ALA HA 1 1 14 15540 2 2 12 ALA HB1 H 7.547 -6.481 -4.073 1.00 . B B . 12 ALA HB1 1 1 14 15541 2 2 12 ALA HB2 H 9.124 -7.139 -3.632 1.00 . B B . 12 ALA HB2 1 1 14 15542 2 2 12 ALA HB3 H 8.035 -6.543 -2.378 1.00 . B B . 12 ALA HB3 1 1 14 15543 2 2 12 ALA N N 6.054 -8.326 -2.910 1.00 . B B . 12 ALA N 1 1 14 15544 2 2 12 ALA O O 9.214 -9.864 -2.364 1.00 . B B . 12 ALA O 1 1 14 15545 2 2 13 ASP C C 7.301 -11.003 0.669 1.00 . B B . 13 ASP C 1 1 14 15546 2 2 13 ASP CA C 8.218 -9.867 0.228 1.00 . B B . 13 ASP CA 1 1 14 15547 2 2 13 ASP CB C 8.455 -8.899 1.388 1.00 . B B . 13 ASP CB 1 1 14 15548 2 2 13 ASP CG C 9.000 -9.602 2.617 1.00 . B B . 13 ASP CG 1 1 14 15549 2 2 13 ASP H H 6.837 -8.627 -0.778 1.00 . B B . 13 ASP H 1 1 14 15550 2 2 13 ASP HA H 9.165 -10.284 -0.082 1.00 . B B . 13 ASP HA 1 1 14 15551 2 2 13 ASP HB2 H 9.169 -8.148 1.081 1.00 . B B . 13 ASP HB2 1 1 14 15552 2 2 13 ASP HB3 H 7.521 -8.413 1.651 1.00 . B B . 13 ASP HB3 1 1 14 15553 2 2 13 ASP N N 7.648 -9.161 -0.908 1.00 . B B . 13 ASP N 1 1 14 15554 2 2 13 ASP O O 6.926 -11.097 1.837 1.00 . B B . 13 ASP O 1 1 14 15555 2 2 13 ASP OD1 O 10.224 -9.841 2.671 1.00 . B B . 13 ASP OD1 1 1 14 15556 2 2 13 ASP OD2 O 8.202 -9.914 3.525 1.00 . B B . 13 ASP OD2 1 1 14 15557 2 2 14 SER C C 6.631 -13.853 1.129 1.00 . B B . 14 SER C 1 1 14 15558 2 2 14 SER CA C 6.066 -12.990 0.004 1.00 . B B . 14 SER CA 1 1 14 15559 2 2 14 SER CB C 5.871 -13.836 -1.254 1.00 . B B . 14 SER CB 1 1 14 15560 2 2 14 SER H H 7.274 -11.732 -1.191 1.00 . B B . 14 SER H 1 1 14 15561 2 2 14 SER HA H 5.110 -12.596 0.314 1.00 . B B . 14 SER HA 1 1 14 15562 2 2 14 SER HB2 H 5.487 -13.212 -2.047 1.00 . B B . 14 SER HB2 1 1 14 15563 2 2 14 SER HB3 H 6.820 -14.255 -1.553 1.00 . B B . 14 SER HB3 1 1 14 15564 2 2 14 SER HG H 4.137 -14.539 -0.673 1.00 . B B . 14 SER HG 1 1 14 15565 2 2 14 SER N N 6.942 -11.861 -0.278 1.00 . B B . 14 SER N 1 1 14 15566 2 2 14 SER O O 6.307 -13.579 2.304 1.00 . B B . 14 SER O 1 1 14 15567 2 2 14 SER OXT O 7.391 -14.797 0.826 1.00 . B B . 14 SER OXT 1 1 14 15568 2 2 14 SER OG O 4.958 -14.895 -1.022 1.00 . B B . 14 SER OG 1 1 15 15569 1 1 1 GLY C C 11.317 4.014 -6.249 1.00 . A A . 1 GLY C 1 1 15 15570 1 1 1 GLY CA C 10.724 2.762 -6.873 1.00 . A A . 1 GLY CA 1 1 15 15571 1 1 1 GLY H1 H 8.872 1.898 -7.308 1.00 . A A . 1 GLY H1 1 1 15 15572 1 1 1 GLY H2 H 8.864 3.589 -7.350 1.00 . A A . 1 GLY H2 1 1 15 15573 1 1 1 GLY H3 H 8.892 2.780 -5.865 1.00 . A A . 1 GLY H3 1 1 15 15574 1 1 1 GLY HA2 H 11.086 1.897 -6.337 1.00 . A A . 1 GLY HA2 1 1 15 15575 1 1 1 GLY HA3 H 11.052 2.697 -7.901 1.00 . A A . 1 GLY HA3 1 1 15 15576 1 1 1 GLY N N 9.234 2.758 -6.847 1.00 . A A . 1 GLY N 1 1 15 15577 1 1 1 GLY O O 12.307 4.548 -6.751 1.00 . A A . 1 GLY O 1 1 15 15578 1 1 2 SER C C 10.296 6.048 -3.290 1.00 . A A . 2 SER C 1 1 15 15579 1 1 2 SER CA C 11.198 5.677 -4.460 1.00 . A A . 2 SER CA 1 1 15 15580 1 1 2 SER CB C 11.293 6.858 -5.427 1.00 . A A . 2 SER CB 1 1 15 15581 1 1 2 SER H H 9.948 3.994 -4.789 1.00 . A A . 2 SER H 1 1 15 15582 1 1 2 SER HA H 12.180 5.466 -4.071 1.00 . A A . 2 SER HA 1 1 15 15583 1 1 2 SER HB2 H 11.651 7.726 -4.894 1.00 . A A . 2 SER HB2 1 1 15 15584 1 1 2 SER HB3 H 11.980 6.617 -6.223 1.00 . A A . 2 SER HB3 1 1 15 15585 1 1 2 SER HG H 9.838 8.095 -5.863 1.00 . A A . 2 SER HG 1 1 15 15586 1 1 2 SER N N 10.720 4.477 -5.150 1.00 . A A . 2 SER N 1 1 15 15587 1 1 2 SER O O 10.754 6.636 -2.310 1.00 . A A . 2 SER O 1 1 15 15588 1 1 2 SER OG O 10.029 7.163 -5.990 1.00 . A A . 2 SER OG 1 1 15 15589 1 1 3 GLN C C 8.047 4.888 -1.306 1.00 . A A . 3 GLN C 1 1 15 15590 1 1 3 GLN CA C 8.077 6.012 -2.328 1.00 . A A . 3 GLN CA 1 1 15 15591 1 1 3 GLN CB C 6.688 6.234 -2.908 1.00 . A A . 3 GLN CB 1 1 15 15592 1 1 3 GLN CD C 5.256 7.510 -4.550 1.00 . A A . 3 GLN CD 1 1 15 15593 1 1 3 GLN CG C 6.605 7.410 -3.865 1.00 . A A . 3 GLN CG 1 1 15 15594 1 1 3 GLN H H 8.696 5.260 -4.193 1.00 . A A . 3 GLN H 1 1 15 15595 1 1 3 GLN HA H 8.400 6.912 -1.846 1.00 . A A . 3 GLN HA 1 1 15 15596 1 1 3 GLN HB2 H 6.402 5.348 -3.439 1.00 . A A . 3 GLN HB2 1 1 15 15597 1 1 3 GLN HB3 H 5.992 6.403 -2.099 1.00 . A A . 3 GLN HB3 1 1 15 15598 1 1 3 GLN HE21 H 4.577 8.686 -3.097 1.00 . A A . 3 GLN HE21 1 1 15 15599 1 1 3 GLN HE22 H 3.455 8.332 -4.363 1.00 . A A . 3 GLN HE22 1 1 15 15600 1 1 3 GLN HG2 H 6.779 8.322 -3.313 1.00 . A A . 3 GLN HG2 1 1 15 15601 1 1 3 GLN HG3 H 7.369 7.298 -4.621 1.00 . A A . 3 GLN HG3 1 1 15 15602 1 1 3 GLN N N 9.018 5.709 -3.388 1.00 . A A . 3 GLN N 1 1 15 15603 1 1 3 GLN NE2 N 4.337 8.251 -3.943 1.00 . A A . 3 GLN NE2 1 1 15 15604 1 1 3 GLN O O 8.153 3.711 -1.653 1.00 . A A . 3 GLN O 1 1 15 15605 1 1 3 GLN OE1 O 5.043 6.929 -5.614 1.00 . A A . 3 GLN OE1 1 1 15 15606 1 1 4 VAL C C 6.422 3.902 1.349 1.00 . A A . 4 VAL C 1 1 15 15607 1 1 4 VAL CA C 7.859 4.298 1.039 1.00 . A A . 4 VAL CA 1 1 15 15608 1 1 4 VAL CB C 8.523 4.871 2.306 1.00 . A A . 4 VAL CB 1 1 15 15609 1 1 4 VAL CG1 C 7.737 6.061 2.833 1.00 . A A . 4 VAL CG1 1 1 15 15610 1 1 4 VAL CG2 C 8.663 3.797 3.373 1.00 . A A . 4 VAL CG2 1 1 15 15611 1 1 4 VAL H H 7.803 6.209 0.162 1.00 . A A . 4 VAL H 1 1 15 15612 1 1 4 VAL HA H 8.409 3.422 0.731 1.00 . A A . 4 VAL HA 1 1 15 15613 1 1 4 VAL HB H 9.514 5.214 2.044 1.00 . A A . 4 VAL HB 1 1 15 15614 1 1 4 VAL HG11 H 6.744 5.742 3.115 1.00 . A A . 4 VAL HG11 1 1 15 15615 1 1 4 VAL HG12 H 7.667 6.815 2.063 1.00 . A A . 4 VAL HG12 1 1 15 15616 1 1 4 VAL HG13 H 8.240 6.473 3.695 1.00 . A A . 4 VAL HG13 1 1 15 15617 1 1 4 VAL HG21 H 9.707 3.637 3.592 1.00 . A A . 4 VAL HG21 1 1 15 15618 1 1 4 VAL HG22 H 8.224 2.878 3.016 1.00 . A A . 4 VAL HG22 1 1 15 15619 1 1 4 VAL HG23 H 8.151 4.114 4.270 1.00 . A A . 4 VAL HG23 1 1 15 15620 1 1 4 VAL N N 7.899 5.260 -0.045 1.00 . A A . 4 VAL N 1 1 15 15621 1 1 4 VAL O O 6.041 3.763 2.510 1.00 . A A . 4 VAL O 1 1 15 15622 1 1 5 PHE C C 3.522 3.224 -0.896 1.00 . A A . 5 PHE C 1 1 15 15623 1 1 5 PHE CA C 4.229 3.344 0.461 1.00 . A A . 5 PHE CA 1 1 15 15624 1 1 5 PHE CB C 3.522 4.390 1.319 1.00 . A A . 5 PHE CB 1 1 15 15625 1 1 5 PHE CD1 C 3.452 6.260 -0.351 1.00 . A A . 5 PHE CD1 1 1 15 15626 1 1 5 PHE CD2 C 4.490 6.663 1.758 1.00 . A A . 5 PHE CD2 1 1 15 15627 1 1 5 PHE CE1 C 3.735 7.555 -0.741 1.00 . A A . 5 PHE CE1 1 1 15 15628 1 1 5 PHE CE2 C 4.774 7.959 1.373 1.00 . A A . 5 PHE CE2 1 1 15 15629 1 1 5 PHE CG C 3.826 5.799 0.900 1.00 . A A . 5 PHE CG 1 1 15 15630 1 1 5 PHE CZ C 4.397 8.405 0.122 1.00 . A A . 5 PHE CZ 1 1 15 15631 1 1 5 PHE H H 5.984 3.841 -0.605 1.00 . A A . 5 PHE H 1 1 15 15632 1 1 5 PHE HA H 4.200 2.383 0.972 1.00 . A A . 5 PHE HA 1 1 15 15633 1 1 5 PHE HB2 H 2.459 4.245 1.248 1.00 . A A . 5 PHE HB2 1 1 15 15634 1 1 5 PHE HB3 H 3.830 4.272 2.345 1.00 . A A . 5 PHE HB3 1 1 15 15635 1 1 5 PHE HD1 H 2.934 5.596 -1.027 1.00 . A A . 5 PHE HD1 1 1 15 15636 1 1 5 PHE HD2 H 4.785 6.315 2.736 1.00 . A A . 5 PHE HD2 1 1 15 15637 1 1 5 PHE HE1 H 3.439 7.902 -1.721 1.00 . A A . 5 PHE HE1 1 1 15 15638 1 1 5 PHE HE2 H 5.293 8.622 2.050 1.00 . A A . 5 PHE HE2 1 1 15 15639 1 1 5 PHE HZ H 4.619 9.418 -0.181 1.00 . A A . 5 PHE HZ 1 1 15 15640 1 1 5 PHE N N 5.625 3.720 0.297 1.00 . A A . 5 PHE N 1 1 15 15641 1 1 5 PHE O O 3.975 3.782 -1.893 1.00 . A A . 5 PHE O 1 1 15 15642 1 1 6 GLU C C 0.121 2.296 -1.771 1.00 . A A . 6 GLU C 1 1 15 15643 1 1 6 GLU CA C 1.604 2.294 -2.115 1.00 . A A . 6 GLU CA 1 1 15 15644 1 1 6 GLU CB C 1.960 0.958 -2.767 1.00 . A A . 6 GLU CB 1 1 15 15645 1 1 6 GLU CD C 4.221 1.746 -3.577 1.00 . A A . 6 GLU CD 1 1 15 15646 1 1 6 GLU CG C 2.908 1.087 -3.945 1.00 . A A . 6 GLU CG 1 1 15 15647 1 1 6 GLU H H 2.088 2.115 -0.073 1.00 . A A . 6 GLU H 1 1 15 15648 1 1 6 GLU HA H 1.811 3.098 -2.805 1.00 . A A . 6 GLU HA 1 1 15 15649 1 1 6 GLU HB2 H 2.414 0.318 -2.024 1.00 . A A . 6 GLU HB2 1 1 15 15650 1 1 6 GLU HB3 H 1.049 0.492 -3.115 1.00 . A A . 6 GLU HB3 1 1 15 15651 1 1 6 GLU HG2 H 3.113 0.102 -4.333 1.00 . A A . 6 GLU HG2 1 1 15 15652 1 1 6 GLU HG3 H 2.427 1.679 -4.709 1.00 . A A . 6 GLU HG3 1 1 15 15653 1 1 6 GLU N N 2.400 2.506 -0.907 1.00 . A A . 6 GLU N 1 1 15 15654 1 1 6 GLU O O -0.275 1.764 -0.737 1.00 . A A . 6 GLU O 1 1 15 15655 1 1 6 GLU OE1 O 4.983 1.154 -2.788 1.00 . A A . 6 GLU OE1 1 1 15 15656 1 1 6 GLU OE2 O 4.486 2.859 -4.079 1.00 . A A . 6 GLU OE2 1 1 15 15657 1 1 7 TYR C C -2.840 1.696 -2.928 1.00 . A A . 7 TYR C 1 1 15 15658 1 1 7 TYR CA C -2.127 2.924 -2.394 1.00 . A A . 7 TYR CA 1 1 15 15659 1 1 7 TYR CB C -2.716 4.195 -2.995 1.00 . A A . 7 TYR CB 1 1 15 15660 1 1 7 TYR CD1 C -3.493 3.777 -5.363 1.00 . A A . 7 TYR CD1 1 1 15 15661 1 1 7 TYR CD2 C -1.435 4.937 -5.042 1.00 . A A . 7 TYR CD2 1 1 15 15662 1 1 7 TYR CE1 C -3.340 3.878 -6.732 1.00 . A A . 7 TYR CE1 1 1 15 15663 1 1 7 TYR CE2 C -1.276 5.041 -6.410 1.00 . A A . 7 TYR CE2 1 1 15 15664 1 1 7 TYR CG C -2.545 4.303 -4.495 1.00 . A A . 7 TYR CG 1 1 15 15665 1 1 7 TYR CZ C -2.231 4.510 -7.251 1.00 . A A . 7 TYR CZ 1 1 15 15666 1 1 7 TYR H H -0.349 3.270 -3.457 1.00 . A A . 7 TYR H 1 1 15 15667 1 1 7 TYR HA H -2.271 2.947 -1.333 1.00 . A A . 7 TYR HA 1 1 15 15668 1 1 7 TYR HB2 H -3.766 4.226 -2.777 1.00 . A A . 7 TYR HB2 1 1 15 15669 1 1 7 TYR HB3 H -2.235 5.051 -2.544 1.00 . A A . 7 TYR HB3 1 1 15 15670 1 1 7 TYR HD1 H -4.360 3.282 -4.953 1.00 . A A . 7 TYR HD1 1 1 15 15671 1 1 7 TYR HD2 H -0.688 5.351 -4.382 1.00 . A A . 7 TYR HD2 1 1 15 15672 1 1 7 TYR HE1 H -4.089 3.461 -7.391 1.00 . A A . 7 TYR HE1 1 1 15 15673 1 1 7 TYR HE2 H -0.407 5.536 -6.817 1.00 . A A . 7 TYR HE2 1 1 15 15674 1 1 7 TYR HH H -2.890 4.938 -9.006 1.00 . A A . 7 TYR HH 1 1 15 15675 1 1 7 TYR N N -0.703 2.867 -2.642 1.00 . A A . 7 TYR N 1 1 15 15676 1 1 7 TYR O O -2.929 1.475 -4.135 1.00 . A A . 7 TYR O 1 1 15 15677 1 1 7 TYR OH O -2.076 4.613 -8.614 1.00 . A A . 7 TYR OH 1 1 15 15678 1 1 8 ALA C C -5.560 -0.037 -2.341 1.00 . A A . 8 ALA C 1 1 15 15679 1 1 8 ALA CA C -4.063 -0.318 -2.329 1.00 . A A . 8 ALA CA 1 1 15 15680 1 1 8 ALA CB C -3.724 -1.405 -1.317 1.00 . A A . 8 ALA CB 1 1 15 15681 1 1 8 ALA H H -3.216 1.132 -1.047 1.00 . A A . 8 ALA H 1 1 15 15682 1 1 8 ALA HA H -3.750 -0.647 -3.309 1.00 . A A . 8 ALA HA 1 1 15 15683 1 1 8 ALA HB1 H -3.983 -1.067 -0.323 1.00 . A A . 8 ALA HB1 1 1 15 15684 1 1 8 ALA HB2 H -2.665 -1.616 -1.357 1.00 . A A . 8 ALA HB2 1 1 15 15685 1 1 8 ALA HB3 H -4.276 -2.301 -1.544 1.00 . A A . 8 ALA HB3 1 1 15 15686 1 1 8 ALA N N -3.339 0.895 -1.997 1.00 . A A . 8 ALA N 1 1 15 15687 1 1 8 ALA O O -6.349 -0.801 -1.782 1.00 . A A . 8 ALA O 1 1 15 15688 1 1 9 GLU C C -7.898 1.465 -4.440 1.00 . A A . 9 GLU C 1 1 15 15689 1 1 9 GLU CA C -7.342 1.461 -3.034 1.00 . A A . 9 GLU CA 1 1 15 15690 1 1 9 GLU CB C -7.490 2.824 -2.356 1.00 . A A . 9 GLU CB 1 1 15 15691 1 1 9 GLU CD C -6.475 4.270 -4.180 1.00 . A A . 9 GLU CD 1 1 15 15692 1 1 9 GLU CG C -7.673 4.020 -3.285 1.00 . A A . 9 GLU CG 1 1 15 15693 1 1 9 GLU H H -5.284 1.632 -3.421 1.00 . A A . 9 GLU H 1 1 15 15694 1 1 9 GLU HA H -7.902 0.742 -2.478 1.00 . A A . 9 GLU HA 1 1 15 15695 1 1 9 GLU HB2 H -8.331 2.789 -1.694 1.00 . A A . 9 GLU HB2 1 1 15 15696 1 1 9 GLU HB3 H -6.603 2.989 -1.773 1.00 . A A . 9 GLU HB3 1 1 15 15697 1 1 9 GLU HG2 H -8.533 3.840 -3.907 1.00 . A A . 9 GLU HG2 1 1 15 15698 1 1 9 GLU HG3 H -7.847 4.898 -2.688 1.00 . A A . 9 GLU HG3 1 1 15 15699 1 1 9 GLU N N -5.949 1.066 -2.984 1.00 . A A . 9 GLU N 1 1 15 15700 1 1 9 GLU O O -7.161 1.432 -5.425 1.00 . A A . 9 GLU O 1 1 15 15701 1 1 9 GLU OE1 O -5.554 4.996 -3.750 1.00 . A A . 9 GLU OE1 1 1 15 15702 1 1 9 GLU OE2 O -6.462 3.746 -5.313 1.00 . A A . 9 GLU OE2 1 1 15 15703 1 1 10 VAL C C -10.404 2.862 -6.174 1.00 . A A . 10 VAL C 1 1 15 15704 1 1 10 VAL CA C -9.891 1.487 -5.776 1.00 . A A . 10 VAL CA 1 1 15 15705 1 1 10 VAL CB C -11.034 0.471 -5.776 1.00 . A A . 10 VAL CB 1 1 15 15706 1 1 10 VAL CG1 C -11.531 0.231 -7.195 1.00 . A A . 10 VAL CG1 1 1 15 15707 1 1 10 VAL CG2 C -10.591 -0.828 -5.115 1.00 . A A . 10 VAL CG2 1 1 15 15708 1 1 10 VAL H H -9.751 1.519 -3.691 1.00 . A A . 10 VAL H 1 1 15 15709 1 1 10 VAL HA H -9.184 1.179 -6.486 1.00 . A A . 10 VAL HA 1 1 15 15710 1 1 10 VAL HB H -11.832 0.881 -5.199 1.00 . A A . 10 VAL HB 1 1 15 15711 1 1 10 VAL HG11 H -10.746 -0.230 -7.775 1.00 . A A . 10 VAL HG11 1 1 15 15712 1 1 10 VAL HG12 H -11.801 1.175 -7.643 1.00 . A A . 10 VAL HG12 1 1 15 15713 1 1 10 VAL HG13 H -12.392 -0.417 -7.174 1.00 . A A . 10 VAL HG13 1 1 15 15714 1 1 10 VAL HG21 H -10.256 -0.623 -4.106 1.00 . A A . 10 VAL HG21 1 1 15 15715 1 1 10 VAL HG22 H -9.781 -1.261 -5.681 1.00 . A A . 10 VAL HG22 1 1 15 15716 1 1 10 VAL HG23 H -11.417 -1.520 -5.084 1.00 . A A . 10 VAL HG23 1 1 15 15717 1 1 10 VAL N N -9.221 1.499 -4.512 1.00 . A A . 10 VAL N 1 1 15 15718 1 1 10 VAL O O -10.650 3.121 -7.351 1.00 . A A . 10 VAL O 1 1 15 15719 1 1 11 ASP C C -10.377 6.131 -4.572 1.00 . A A . 11 ASP C 1 1 15 15720 1 1 11 ASP CA C -11.034 5.093 -5.477 1.00 . A A . 11 ASP CA 1 1 15 15721 1 1 11 ASP CB C -12.551 5.160 -5.293 1.00 . A A . 11 ASP CB 1 1 15 15722 1 1 11 ASP CG C -13.154 6.418 -5.885 1.00 . A A . 11 ASP CG 1 1 15 15723 1 1 11 ASP H H -10.365 3.483 -4.276 1.00 . A A . 11 ASP H 1 1 15 15724 1 1 11 ASP HA H -10.797 5.324 -6.503 1.00 . A A . 11 ASP HA 1 1 15 15725 1 1 11 ASP HB2 H -13.004 4.308 -5.770 1.00 . A A . 11 ASP HB2 1 1 15 15726 1 1 11 ASP HB3 H -12.778 5.138 -4.238 1.00 . A A . 11 ASP HB3 1 1 15 15727 1 1 11 ASP N N -10.558 3.746 -5.198 1.00 . A A . 11 ASP N 1 1 15 15728 1 1 11 ASP O O -9.958 7.192 -5.036 1.00 . A A . 11 ASP O 1 1 15 15729 1 1 11 ASP OD1 O -13.330 6.469 -7.120 1.00 . A A . 11 ASP OD1 1 1 15 15730 1 1 11 ASP OD2 O -13.450 7.354 -5.113 1.00 . A A . 11 ASP OD2 1 1 15 15731 1 1 12 GLU C C -9.171 6.071 -1.085 1.00 . A A . 12 GLU C 1 1 15 15732 1 1 12 GLU CA C -9.728 6.771 -2.317 1.00 . A A . 12 GLU CA 1 1 15 15733 1 1 12 GLU CB C -10.805 7.768 -1.895 1.00 . A A . 12 GLU CB 1 1 15 15734 1 1 12 GLU CD C -12.349 9.645 -2.583 1.00 . A A . 12 GLU CD 1 1 15 15735 1 1 12 GLU CG C -11.254 8.691 -3.016 1.00 . A A . 12 GLU CG 1 1 15 15736 1 1 12 GLU H H -10.527 4.911 -2.993 1.00 . A A . 12 GLU H 1 1 15 15737 1 1 12 GLU HA H -8.926 7.307 -2.802 1.00 . A A . 12 GLU HA 1 1 15 15738 1 1 12 GLU HB2 H -11.665 7.218 -1.544 1.00 . A A . 12 GLU HB2 1 1 15 15739 1 1 12 GLU HB3 H -10.422 8.373 -1.089 1.00 . A A . 12 GLU HB3 1 1 15 15740 1 1 12 GLU HG2 H -10.406 9.270 -3.350 1.00 . A A . 12 GLU HG2 1 1 15 15741 1 1 12 GLU HG3 H -11.623 8.089 -3.834 1.00 . A A . 12 GLU HG3 1 1 15 15742 1 1 12 GLU N N -10.286 5.821 -3.285 1.00 . A A . 12 GLU N 1 1 15 15743 1 1 12 GLU O O -9.499 4.930 -0.822 1.00 . A A . 12 GLU O 1 1 15 15744 1 1 12 GLU OE1 O -12.018 10.746 -2.093 1.00 . A A . 12 GLU OE1 1 1 15 15745 1 1 12 GLU OE2 O -13.539 9.294 -2.733 1.00 . A A . 12 GLU OE2 1 1 15 15746 1 1 13 ILE C C -7.850 7.189 2.053 1.00 . A A . 13 ILE C 1 1 15 15747 1 1 13 ILE CA C -7.761 6.192 0.893 1.00 . A A . 13 ILE CA 1 1 15 15748 1 1 13 ILE CB C -6.280 5.787 0.673 1.00 . A A . 13 ILE CB 1 1 15 15749 1 1 13 ILE CD1 C -5.688 7.863 -0.661 1.00 . A A . 13 ILE CD1 1 1 15 15750 1 1 13 ILE CG1 C -5.383 7.020 0.557 1.00 . A A . 13 ILE CG1 1 1 15 15751 1 1 13 ILE CG2 C -6.171 4.961 -0.586 1.00 . A A . 13 ILE CG2 1 1 15 15752 1 1 13 ILE H H -8.114 7.688 -0.570 1.00 . A A . 13 ILE H 1 1 15 15753 1 1 13 ILE HA H -8.329 5.295 1.133 1.00 . A A . 13 ILE HA 1 1 15 15754 1 1 13 ILE HB H -5.949 5.170 1.506 1.00 . A A . 13 ILE HB 1 1 15 15755 1 1 13 ILE HD11 H -4.784 8.344 -1.003 1.00 . A A . 13 ILE HD11 1 1 15 15756 1 1 13 ILE HD12 H -6.421 8.612 -0.406 1.00 . A A . 13 ILE HD12 1 1 15 15757 1 1 13 ILE HD13 H -6.080 7.228 -1.446 1.00 . A A . 13 ILE HD13 1 1 15 15758 1 1 13 ILE HG12 H -5.517 7.640 1.432 1.00 . A A . 13 ILE HG12 1 1 15 15759 1 1 13 ILE HG13 H -4.351 6.706 0.497 1.00 . A A . 13 ILE HG13 1 1 15 15760 1 1 13 ILE HG21 H -5.630 5.516 -1.339 1.00 . A A . 13 ILE HG21 1 1 15 15761 1 1 13 ILE HG22 H -7.157 4.737 -0.945 1.00 . A A . 13 ILE HG22 1 1 15 15762 1 1 13 ILE HG23 H -5.651 4.041 -0.372 1.00 . A A . 13 ILE HG23 1 1 15 15763 1 1 13 ILE N N -8.340 6.769 -0.319 1.00 . A A . 13 ILE N 1 1 15 15764 1 1 13 ILE O O -8.546 8.200 1.959 1.00 . A A . 13 ILE O 1 1 15 15765 1 1 14 VAL C C -5.784 7.655 5.019 1.00 . A A . 14 VAL C 1 1 15 15766 1 1 14 VAL CA C -7.121 7.777 4.303 1.00 . A A . 14 VAL CA 1 1 15 15767 1 1 14 VAL CB C -8.274 7.465 5.280 1.00 . A A . 14 VAL CB 1 1 15 15768 1 1 14 VAL CG1 C -8.171 8.324 6.532 1.00 . A A . 14 VAL CG1 1 1 15 15769 1 1 14 VAL CG2 C -9.614 7.679 4.594 1.00 . A A . 14 VAL CG2 1 1 15 15770 1 1 14 VAL H H -6.617 6.072 3.156 1.00 . A A . 14 VAL H 1 1 15 15771 1 1 14 VAL HA H -7.236 8.792 3.954 1.00 . A A . 14 VAL HA 1 1 15 15772 1 1 14 VAL HB H -8.203 6.428 5.572 1.00 . A A . 14 VAL HB 1 1 15 15773 1 1 14 VAL HG11 H -7.240 8.114 7.037 1.00 . A A . 14 VAL HG11 1 1 15 15774 1 1 14 VAL HG12 H -8.997 8.099 7.192 1.00 . A A . 14 VAL HG12 1 1 15 15775 1 1 14 VAL HG13 H -8.205 9.368 6.258 1.00 . A A . 14 VAL HG13 1 1 15 15776 1 1 14 VAL HG21 H -10.412 7.498 5.299 1.00 . A A . 14 VAL HG21 1 1 15 15777 1 1 14 VAL HG22 H -9.707 6.994 3.764 1.00 . A A . 14 VAL HG22 1 1 15 15778 1 1 14 VAL HG23 H -9.676 8.694 4.231 1.00 . A A . 14 VAL HG23 1 1 15 15779 1 1 14 VAL N N -7.142 6.900 3.137 1.00 . A A . 14 VAL N 1 1 15 15780 1 1 14 VAL O O -5.104 8.651 5.268 1.00 . A A . 14 VAL O 1 1 15 15781 1 1 15 GLU C C -3.126 5.744 4.950 1.00 . A A . 15 GLU C 1 1 15 15782 1 1 15 GLU CA C -4.143 6.159 6.006 1.00 . A A . 15 GLU CA 1 1 15 15783 1 1 15 GLU CB C -4.295 5.057 7.057 1.00 . A A . 15 GLU CB 1 1 15 15784 1 1 15 GLU CD C -4.820 6.609 8.979 1.00 . A A . 15 GLU CD 1 1 15 15785 1 1 15 GLU CG C -5.268 5.408 8.171 1.00 . A A . 15 GLU CG 1 1 15 15786 1 1 15 GLU H H -6.026 5.677 5.151 1.00 . A A . 15 GLU H 1 1 15 15787 1 1 15 GLU HA H -3.810 7.069 6.482 1.00 . A A . 15 GLU HA 1 1 15 15788 1 1 15 GLU HB2 H -4.646 4.158 6.571 1.00 . A A . 15 GLU HB2 1 1 15 15789 1 1 15 GLU HB3 H -3.330 4.863 7.500 1.00 . A A . 15 GLU HB3 1 1 15 15790 1 1 15 GLU HG2 H -6.232 5.625 7.735 1.00 . A A . 15 GLU HG2 1 1 15 15791 1 1 15 GLU HG3 H -5.357 4.559 8.834 1.00 . A A . 15 GLU HG3 1 1 15 15792 1 1 15 GLU N N -5.419 6.426 5.351 1.00 . A A . 15 GLU N 1 1 15 15793 1 1 15 GLU O O -3.450 4.979 4.058 1.00 . A A . 15 GLU O 1 1 15 15794 1 1 15 GLU OE1 O -5.177 7.745 8.601 1.00 . A A . 15 GLU OE1 1 1 15 15795 1 1 15 GLU OE2 O -4.113 6.414 9.990 1.00 . A A . 15 GLU OE2 1 1 15 15796 1 1 16 LYS C C 0.529 6.072 4.572 1.00 . A A . 16 LYS C 1 1 15 15797 1 1 16 LYS CA C -0.898 5.930 4.022 1.00 . A A . 16 LYS CA 1 1 15 15798 1 1 16 LYS CB C -1.053 6.834 2.801 1.00 . A A . 16 LYS CB 1 1 15 15799 1 1 16 LYS CD C -1.301 9.167 1.900 1.00 . A A . 16 LYS CD 1 1 15 15800 1 1 16 LYS CE C -1.407 10.643 2.247 1.00 . A A . 16 LYS CE 1 1 15 15801 1 1 16 LYS CG C -1.183 8.308 3.149 1.00 . A A . 16 LYS CG 1 1 15 15802 1 1 16 LYS H H -1.704 6.912 5.729 1.00 . A A . 16 LYS H 1 1 15 15803 1 1 16 LYS HA H -1.075 4.896 3.722 1.00 . A A . 16 LYS HA 1 1 15 15804 1 1 16 LYS HB2 H -0.188 6.716 2.170 1.00 . A A . 16 LYS HB2 1 1 15 15805 1 1 16 LYS HB3 H -1.935 6.536 2.256 1.00 . A A . 16 LYS HB3 1 1 15 15806 1 1 16 LYS HD2 H -0.425 9.014 1.287 1.00 . A A . 16 LYS HD2 1 1 15 15807 1 1 16 LYS HD3 H -2.183 8.870 1.353 1.00 . A A . 16 LYS HD3 1 1 15 15808 1 1 16 LYS HE2 H -2.277 10.793 2.869 1.00 . A A . 16 LYS HE2 1 1 15 15809 1 1 16 LYS HE3 H -0.521 10.937 2.791 1.00 . A A . 16 LYS HE3 1 1 15 15810 1 1 16 LYS HG2 H -2.065 8.449 3.756 1.00 . A A . 16 LYS HG2 1 1 15 15811 1 1 16 LYS HG3 H -0.309 8.614 3.706 1.00 . A A . 16 LYS HG3 1 1 15 15812 1 1 16 LYS HZ1 H -0.700 11.367 0.420 1.00 . A A . 16 LYS HZ1 1 1 15 15813 1 1 16 LYS HZ2 H -1.605 12.494 1.299 1.00 . A A . 16 LYS HZ2 1 1 15 15814 1 1 16 LYS HZ3 H -2.383 11.227 0.494 1.00 . A A . 16 LYS HZ3 1 1 15 15815 1 1 16 LYS N N -1.915 6.279 5.015 1.00 . A A . 16 LYS N 1 1 15 15816 1 1 16 LYS NZ N -1.533 11.492 1.030 1.00 . A A . 16 LYS NZ 1 1 15 15817 1 1 16 LYS O O 1.159 7.114 4.381 1.00 . A A . 16 LYS O 1 1 15 15818 1 1 17 ARG C C 3.024 3.735 5.961 1.00 . A A . 17 ARG C 1 1 15 15819 1 1 17 ARG CA C 2.404 5.121 5.802 1.00 . A A . 17 ARG CA 1 1 15 15820 1 1 17 ARG CB C 2.382 5.839 7.152 1.00 . A A . 17 ARG CB 1 1 15 15821 1 1 17 ARG CD C 3.679 6.735 9.106 1.00 . A A . 17 ARG CD 1 1 15 15822 1 1 17 ARG CG C 3.743 5.919 7.826 1.00 . A A . 17 ARG CG 1 1 15 15823 1 1 17 ARG CZ C 5.901 7.765 9.318 1.00 . A A . 17 ARG CZ 1 1 15 15824 1 1 17 ARG H H 0.527 4.218 5.348 1.00 . A A . 17 ARG H 1 1 15 15825 1 1 17 ARG HA H 3.008 5.693 5.114 1.00 . A A . 17 ARG HA 1 1 15 15826 1 1 17 ARG HB2 H 2.019 6.845 7.006 1.00 . A A . 17 ARG HB2 1 1 15 15827 1 1 17 ARG HB3 H 1.708 5.316 7.814 1.00 . A A . 17 ARG HB3 1 1 15 15828 1 1 17 ARG HD2 H 3.288 7.714 8.875 1.00 . A A . 17 ARG HD2 1 1 15 15829 1 1 17 ARG HD3 H 3.018 6.239 9.802 1.00 . A A . 17 ARG HD3 1 1 15 15830 1 1 17 ARG HE H 5.203 6.309 10.491 1.00 . A A . 17 ARG HE 1 1 15 15831 1 1 17 ARG HG2 H 4.076 4.920 8.063 1.00 . A A . 17 ARG HG2 1 1 15 15832 1 1 17 ARG HG3 H 4.443 6.384 7.147 1.00 . A A . 17 ARG HG3 1 1 15 15833 1 1 17 ARG HH11 H 4.771 8.477 7.800 1.00 . A A . 17 ARG HH11 1 1 15 15834 1 1 17 ARG HH12 H 6.332 9.208 7.971 1.00 . A A . 17 ARG HH12 1 1 15 15835 1 1 17 ARG HH21 H 7.259 7.270 10.730 1.00 . A A . 17 ARG HH21 1 1 15 15836 1 1 17 ARG HH22 H 7.747 8.522 9.637 1.00 . A A . 17 ARG HH22 1 1 15 15837 1 1 17 ARG N N 1.046 5.047 5.247 1.00 . A A . 17 ARG N 1 1 15 15838 1 1 17 ARG NE N 4.992 6.886 9.727 1.00 . A A . 17 ARG NE 1 1 15 15839 1 1 17 ARG NH1 N 5.648 8.548 8.278 1.00 . A A . 17 ARG NH1 1 1 15 15840 1 1 17 ARG NH2 N 7.064 7.861 9.947 1.00 . A A . 17 ARG NH2 1 1 15 15841 1 1 17 ARG O O 2.789 3.070 6.971 1.00 . A A . 17 ARG O 1 1 15 15842 1 1 18 GLY C C 5.694 1.767 4.365 1.00 . A A . 18 GLY C 1 1 15 15843 1 1 18 GLY CA C 4.395 1.962 5.110 1.00 . A A . 18 GLY CA 1 1 15 15844 1 1 18 GLY H H 4.010 3.844 4.201 1.00 . A A . 18 GLY H 1 1 15 15845 1 1 18 GLY HA2 H 4.571 1.763 6.155 1.00 . A A . 18 GLY HA2 1 1 15 15846 1 1 18 GLY HA3 H 3.689 1.248 4.745 1.00 . A A . 18 GLY HA3 1 1 15 15847 1 1 18 GLY N N 3.812 3.283 4.984 1.00 . A A . 18 GLY N 1 1 15 15848 1 1 18 GLY O O 6.637 2.537 4.513 1.00 . A A . 18 GLY O 1 1 15 15849 1 1 19 LYS C C 6.520 0.311 1.292 1.00 . A A . 19 LYS C 1 1 15 15850 1 1 19 LYS CA C 6.875 0.316 2.788 1.00 . A A . 19 LYS CA 1 1 15 15851 1 1 19 LYS CB C 7.293 -1.060 3.271 1.00 . A A . 19 LYS CB 1 1 15 15852 1 1 19 LYS CD C 8.074 -2.484 5.140 1.00 . A A . 19 LYS CD 1 1 15 15853 1 1 19 LYS CE C 8.727 -2.524 6.512 1.00 . A A . 19 LYS CE 1 1 15 15854 1 1 19 LYS CG C 7.839 -1.067 4.679 1.00 . A A . 19 LYS CG 1 1 15 15855 1 1 19 LYS H H 4.932 0.120 3.531 1.00 . A A . 19 LYS H 1 1 15 15856 1 1 19 LYS HA H 7.667 1.013 2.972 1.00 . A A . 19 LYS HA 1 1 15 15857 1 1 19 LYS HB2 H 6.414 -1.692 3.245 1.00 . A A . 19 LYS HB2 1 1 15 15858 1 1 19 LYS HB3 H 8.044 -1.463 2.611 1.00 . A A . 19 LYS HB3 1 1 15 15859 1 1 19 LYS HD2 H 7.123 -2.990 5.183 1.00 . A A . 19 LYS HD2 1 1 15 15860 1 1 19 LYS HD3 H 8.715 -2.977 4.423 1.00 . A A . 19 LYS HD3 1 1 15 15861 1 1 19 LYS HE2 H 9.700 -2.059 6.447 1.00 . A A . 19 LYS HE2 1 1 15 15862 1 1 19 LYS HE3 H 8.110 -1.971 7.206 1.00 . A A . 19 LYS HE3 1 1 15 15863 1 1 19 LYS HG2 H 8.775 -0.528 4.699 1.00 . A A . 19 LYS HG2 1 1 15 15864 1 1 19 LYS HG3 H 7.129 -0.594 5.339 1.00 . A A . 19 LYS HG3 1 1 15 15865 1 1 19 LYS HZ1 H 9.364 -3.909 7.939 1.00 . A A . 19 LYS HZ1 1 1 15 15866 1 1 19 LYS HZ2 H 9.467 -4.468 6.346 1.00 . A A . 19 LYS HZ2 1 1 15 15867 1 1 19 LYS HZ3 H 7.962 -4.370 7.113 1.00 . A A . 19 LYS HZ3 1 1 15 15868 1 1 19 LYS N N 5.723 0.696 3.574 1.00 . A A . 19 LYS N 1 1 15 15869 1 1 19 LYS NZ N 8.892 -3.915 7.013 1.00 . A A . 19 LYS NZ 1 1 15 15870 1 1 19 LYS O O 6.091 1.325 0.759 1.00 . A A . 19 LYS O 1 1 15 15871 1 1 20 GLY C C 4.919 -1.336 -0.896 1.00 . A A . 20 GLY C 1 1 15 15872 1 1 20 GLY CA C 6.344 -0.904 -0.780 1.00 . A A . 20 GLY CA 1 1 15 15873 1 1 20 GLY H H 7.023 -1.610 1.057 1.00 . A A . 20 GLY H 1 1 15 15874 1 1 20 GLY HA2 H 6.483 0.055 -1.249 1.00 . A A . 20 GLY HA2 1 1 15 15875 1 1 20 GLY HA3 H 6.966 -1.638 -1.250 1.00 . A A . 20 GLY HA3 1 1 15 15876 1 1 20 GLY N N 6.691 -0.821 0.612 1.00 . A A . 20 GLY N 1 1 15 15877 1 1 20 GLY O O 4.165 -0.869 -1.743 1.00 . A A . 20 GLY O 1 1 15 15878 1 1 21 LYS C C 2.851 -3.112 1.514 1.00 . A A . 21 LYS C 1 1 15 15879 1 1 21 LYS CA C 3.233 -2.794 0.057 1.00 . A A . 21 LYS CA 1 1 15 15880 1 1 21 LYS CB C 3.086 -4.035 -0.822 1.00 . A A . 21 LYS CB 1 1 15 15881 1 1 21 LYS CD C 0.970 -3.288 -1.949 1.00 . A A . 21 LYS CD 1 1 15 15882 1 1 21 LYS CE C 0.165 -4.302 -1.153 1.00 . A A . 21 LYS CE 1 1 15 15883 1 1 21 LYS CG C 2.405 -3.748 -2.149 1.00 . A A . 21 LYS CG 1 1 15 15884 1 1 21 LYS H H 5.285 -2.655 0.528 1.00 . A A . 21 LYS H 1 1 15 15885 1 1 21 LYS HA H 2.567 -2.025 -0.316 1.00 . A A . 21 LYS HA 1 1 15 15886 1 1 21 LYS HB2 H 4.069 -4.436 -1.025 1.00 . A A . 21 LYS HB2 1 1 15 15887 1 1 21 LYS HB3 H 2.505 -4.774 -0.292 1.00 . A A . 21 LYS HB3 1 1 15 15888 1 1 21 LYS HD2 H 0.973 -2.349 -1.417 1.00 . A A . 21 LYS HD2 1 1 15 15889 1 1 21 LYS HD3 H 0.507 -3.154 -2.917 1.00 . A A . 21 LYS HD3 1 1 15 15890 1 1 21 LYS HE2 H 0.208 -5.256 -1.660 1.00 . A A . 21 LYS HE2 1 1 15 15891 1 1 21 LYS HE3 H 0.603 -4.399 -0.171 1.00 . A A . 21 LYS HE3 1 1 15 15892 1 1 21 LYS HG2 H 2.951 -2.971 -2.663 1.00 . A A . 21 LYS HG2 1 1 15 15893 1 1 21 LYS HG3 H 2.405 -4.644 -2.747 1.00 . A A . 21 LYS HG3 1 1 15 15894 1 1 21 LYS HZ1 H -1.787 -4.615 -0.480 1.00 . A A . 21 LYS HZ1 1 1 15 15895 1 1 21 LYS HZ2 H -1.693 -3.781 -1.950 1.00 . A A . 21 LYS HZ2 1 1 15 15896 1 1 21 LYS HZ3 H -1.322 -2.989 -0.502 1.00 . A A . 21 LYS HZ3 1 1 15 15897 1 1 21 LYS N N 4.582 -2.273 -0.035 1.00 . A A . 21 LYS N 1 1 15 15898 1 1 21 LYS NZ N -1.259 -3.893 -1.011 1.00 . A A . 21 LYS NZ 1 1 15 15899 1 1 21 LYS O O 1.752 -3.594 1.770 1.00 . A A . 21 LYS O 1 1 15 15900 1 1 22 ASP C C 2.768 -1.866 4.521 1.00 . A A . 22 ASP C 1 1 15 15901 1 1 22 ASP CA C 3.480 -3.047 3.883 1.00 . A A . 22 ASP CA 1 1 15 15902 1 1 22 ASP CB C 4.780 -3.287 4.633 1.00 . A A . 22 ASP CB 1 1 15 15903 1 1 22 ASP CG C 4.557 -3.764 6.054 1.00 . A A . 22 ASP CG 1 1 15 15904 1 1 22 ASP H H 4.579 -2.388 2.235 1.00 . A A . 22 ASP H 1 1 15 15905 1 1 22 ASP HA H 2.868 -3.904 3.951 1.00 . A A . 22 ASP HA 1 1 15 15906 1 1 22 ASP HB2 H 5.371 -4.014 4.113 1.00 . A A . 22 ASP HB2 1 1 15 15907 1 1 22 ASP HB3 H 5.317 -2.361 4.667 1.00 . A A . 22 ASP HB3 1 1 15 15908 1 1 22 ASP N N 3.742 -2.800 2.473 1.00 . A A . 22 ASP N 1 1 15 15909 1 1 22 ASP O O 2.664 -1.766 5.742 1.00 . A A . 22 ASP O 1 1 15 15910 1 1 22 ASP OD1 O 4.361 -4.983 6.248 1.00 . A A . 22 ASP OD1 1 1 15 15911 1 1 22 ASP OD2 O 4.575 -2.919 6.975 1.00 . A A . 22 ASP OD2 1 1 15 15912 1 1 23 VAL C C 0.120 -0.007 4.222 1.00 . A A . 23 VAL C 1 1 15 15913 1 1 23 VAL CA C 1.614 0.214 4.109 1.00 . A A . 23 VAL CA 1 1 15 15914 1 1 23 VAL CB C 1.856 1.319 3.087 1.00 . A A . 23 VAL CB 1 1 15 15915 1 1 23 VAL CG1 C 1.326 0.869 1.736 1.00 . A A . 23 VAL CG1 1 1 15 15916 1 1 23 VAL CG2 C 1.206 2.611 3.539 1.00 . A A . 23 VAL CG2 1 1 15 15917 1 1 23 VAL H H 2.468 -1.087 2.737 1.00 . A A . 23 VAL H 1 1 15 15918 1 1 23 VAL HA H 2.003 0.528 5.060 1.00 . A A . 23 VAL HA 1 1 15 15919 1 1 23 VAL HB H 2.921 1.475 2.999 1.00 . A A . 23 VAL HB 1 1 15 15920 1 1 23 VAL HG11 H 0.669 0.023 1.868 1.00 . A A . 23 VAL HG11 1 1 15 15921 1 1 23 VAL HG12 H 2.153 0.585 1.103 1.00 . A A . 23 VAL HG12 1 1 15 15922 1 1 23 VAL HG13 H 0.780 1.675 1.275 1.00 . A A . 23 VAL HG13 1 1 15 15923 1 1 23 VAL HG21 H 1.694 3.448 3.062 1.00 . A A . 23 VAL HG21 1 1 15 15924 1 1 23 VAL HG22 H 1.307 2.697 4.607 1.00 . A A . 23 VAL HG22 1 1 15 15925 1 1 23 VAL HG23 H 0.159 2.600 3.274 1.00 . A A . 23 VAL HG23 1 1 15 15926 1 1 23 VAL N N 2.308 -0.969 3.683 1.00 . A A . 23 VAL N 1 1 15 15927 1 1 23 VAL O O -0.454 -0.853 3.540 1.00 . A A . 23 VAL O 1 1 15 15928 1 1 24 GLU C C -2.604 1.771 4.389 1.00 . A A . 24 GLU C 1 1 15 15929 1 1 24 GLU CA C -1.933 0.715 5.255 1.00 . A A . 24 GLU CA 1 1 15 15930 1 1 24 GLU CB C -2.322 0.960 6.713 1.00 . A A . 24 GLU CB 1 1 15 15931 1 1 24 GLU CD C -2.165 0.245 9.129 1.00 . A A . 24 GLU CD 1 1 15 15932 1 1 24 GLU CG C -1.789 -0.070 7.694 1.00 . A A . 24 GLU CG 1 1 15 15933 1 1 24 GLU H H 0.015 1.461 5.556 1.00 . A A . 24 GLU H 1 1 15 15934 1 1 24 GLU HA H -2.256 -0.278 4.951 1.00 . A A . 24 GLU HA 1 1 15 15935 1 1 24 GLU HB2 H -1.951 1.930 7.007 1.00 . A A . 24 GLU HB2 1 1 15 15936 1 1 24 GLU HB3 H -3.399 0.965 6.780 1.00 . A A . 24 GLU HB3 1 1 15 15937 1 1 24 GLU HG2 H -2.196 -1.037 7.437 1.00 . A A . 24 GLU HG2 1 1 15 15938 1 1 24 GLU HG3 H -0.712 -0.101 7.617 1.00 . A A . 24 GLU HG3 1 1 15 15939 1 1 24 GLU N N -0.501 0.792 5.065 1.00 . A A . 24 GLU N 1 1 15 15940 1 1 24 GLU O O -2.235 2.942 4.440 1.00 . A A . 24 GLU O 1 1 15 15941 1 1 24 GLU OE1 O -1.431 1.019 9.779 1.00 . A A . 24 GLU OE1 1 1 15 15942 1 1 24 GLU OE2 O -3.193 -0.282 9.603 1.00 . A A . 24 GLU OE2 1 1 15 15943 1 1 25 TYR C C -5.779 1.944 2.755 1.00 . A A . 25 TYR C 1 1 15 15944 1 1 25 TYR CA C -4.296 2.276 2.739 1.00 . A A . 25 TYR CA 1 1 15 15945 1 1 25 TYR CB C -3.757 2.223 1.313 1.00 . A A . 25 TYR CB 1 1 15 15946 1 1 25 TYR CD1 C -1.335 2.932 1.385 1.00 . A A . 25 TYR CD1 1 1 15 15947 1 1 25 TYR CD2 C -2.913 4.434 0.427 1.00 . A A . 25 TYR CD2 1 1 15 15948 1 1 25 TYR CE1 C -0.321 3.832 1.120 1.00 . A A . 25 TYR CE1 1 1 15 15949 1 1 25 TYR CE2 C -1.904 5.334 0.156 1.00 . A A . 25 TYR CE2 1 1 15 15950 1 1 25 TYR CG C -2.648 3.217 1.043 1.00 . A A . 25 TYR CG 1 1 15 15951 1 1 25 TYR CZ C -0.610 5.027 0.505 1.00 . A A . 25 TYR CZ 1 1 15 15952 1 1 25 TYR H H -3.818 0.425 3.589 1.00 . A A . 25 TYR H 1 1 15 15953 1 1 25 TYR HA H -4.153 3.269 3.127 1.00 . A A . 25 TYR HA 1 1 15 15954 1 1 25 TYR HB2 H -3.367 1.234 1.121 1.00 . A A . 25 TYR HB2 1 1 15 15955 1 1 25 TYR HB3 H -4.562 2.427 0.624 1.00 . A A . 25 TYR HB3 1 1 15 15956 1 1 25 TYR HD1 H -1.110 1.993 1.867 1.00 . A A . 25 TYR HD1 1 1 15 15957 1 1 25 TYR HD2 H -3.922 4.673 0.157 1.00 . A A . 25 TYR HD2 1 1 15 15958 1 1 25 TYR HE1 H 0.691 3.594 1.392 1.00 . A A . 25 TYR HE1 1 1 15 15959 1 1 25 TYR HE2 H -2.133 6.274 -0.324 1.00 . A A . 25 TYR HE2 1 1 15 15960 1 1 25 TYR HH H 1.141 5.456 -0.162 1.00 . A A . 25 TYR HH 1 1 15 15961 1 1 25 TYR N N -3.576 1.362 3.597 1.00 . A A . 25 TYR N 1 1 15 15962 1 1 25 TYR O O -6.165 0.777 2.745 1.00 . A A . 25 TYR O 1 1 15 15963 1 1 25 TYR OH O 0.400 5.921 0.234 1.00 . A A . 25 TYR OH 1 1 15 15964 1 1 26 LEU C C -8.556 2.765 1.390 1.00 . A A . 26 LEU C 1 1 15 15965 1 1 26 LEU CA C -8.037 2.812 2.803 1.00 . A A . 26 LEU CA 1 1 15 15966 1 1 26 LEU CB C -8.689 3.969 3.564 1.00 . A A . 26 LEU CB 1 1 15 15967 1 1 26 LEU CD1 C -10.878 4.621 4.616 1.00 . A A . 26 LEU CD1 1 1 15 15968 1 1 26 LEU CD2 C -10.514 4.965 2.161 1.00 . A A . 26 LEU CD2 1 1 15 15969 1 1 26 LEU CG C -10.200 4.091 3.366 1.00 . A A . 26 LEU CG 1 1 15 15970 1 1 26 LEU H H -6.234 3.868 2.747 1.00 . A A . 26 LEU H 1 1 15 15971 1 1 26 LEU HA H -8.271 1.878 3.291 1.00 . A A . 26 LEU HA 1 1 15 15972 1 1 26 LEU HB2 H -8.488 3.842 4.617 1.00 . A A . 26 LEU HB2 1 1 15 15973 1 1 26 LEU HB3 H -8.230 4.891 3.238 1.00 . A A . 26 LEU HB3 1 1 15 15974 1 1 26 LEU HD11 H -10.274 5.401 5.051 1.00 . A A . 26 LEU HD11 1 1 15 15975 1 1 26 LEU HD12 H -10.997 3.818 5.328 1.00 . A A . 26 LEU HD12 1 1 15 15976 1 1 26 LEU HD13 H -11.849 5.018 4.358 1.00 . A A . 26 LEU HD13 1 1 15 15977 1 1 26 LEU HD21 H -11.550 5.266 2.196 1.00 . A A . 26 LEU HD21 1 1 15 15978 1 1 26 LEU HD22 H -10.333 4.404 1.254 1.00 . A A . 26 LEU HD22 1 1 15 15979 1 1 26 LEU HD23 H -9.883 5.840 2.176 1.00 . A A . 26 LEU HD23 1 1 15 15980 1 1 26 LEU HG H -10.594 3.116 3.165 1.00 . A A . 26 LEU HG 1 1 15 15981 1 1 26 LEU N N -6.602 2.974 2.778 1.00 . A A . 26 LEU N 1 1 15 15982 1 1 26 LEU O O -7.904 3.252 0.471 1.00 . A A . 26 LEU O 1 1 15 15983 1 1 27 VAL C C -11.759 2.266 -0.214 1.00 . A A . 27 VAL C 1 1 15 15984 1 1 27 VAL CA C -10.254 2.115 -0.136 1.00 . A A . 27 VAL CA 1 1 15 15985 1 1 27 VAL CB C -9.772 0.856 -0.901 1.00 . A A . 27 VAL CB 1 1 15 15986 1 1 27 VAL CG1 C -8.588 0.190 -0.211 1.00 . A A . 27 VAL CG1 1 1 15 15987 1 1 27 VAL CG2 C -10.876 -0.168 -1.166 1.00 . A A . 27 VAL CG2 1 1 15 15988 1 1 27 VAL H H -10.201 1.771 1.943 1.00 . A A . 27 VAL H 1 1 15 15989 1 1 27 VAL HA H -9.843 2.947 -0.668 1.00 . A A . 27 VAL HA 1 1 15 15990 1 1 27 VAL HB H -9.427 1.221 -1.842 1.00 . A A . 27 VAL HB 1 1 15 15991 1 1 27 VAL HG11 H -8.288 -0.682 -0.774 1.00 . A A . 27 VAL HG11 1 1 15 15992 1 1 27 VAL HG12 H -8.873 -0.105 0.787 1.00 . A A . 27 VAL HG12 1 1 15 15993 1 1 27 VAL HG13 H -7.763 0.886 -0.159 1.00 . A A . 27 VAL HG13 1 1 15 15994 1 1 27 VAL HG21 H -10.445 -1.056 -1.601 1.00 . A A . 27 VAL HG21 1 1 15 15995 1 1 27 VAL HG22 H -11.600 0.253 -1.848 1.00 . A A . 27 VAL HG22 1 1 15 15996 1 1 27 VAL HG23 H -11.363 -0.417 -0.237 1.00 . A A . 27 VAL HG23 1 1 15 15997 1 1 27 VAL N N -9.722 2.181 1.198 1.00 . A A . 27 VAL N 1 1 15 15998 1 1 27 VAL O O -12.520 1.411 0.242 1.00 . A A . 27 VAL O 1 1 15 15999 1 1 28 ARG C C -13.823 2.959 -2.371 1.00 . A A . 28 ARG C 1 1 15 16000 1 1 28 ARG CA C -13.559 3.627 -1.060 1.00 . A A . 28 ARG CA 1 1 15 16001 1 1 28 ARG CB C -13.861 5.119 -1.150 1.00 . A A . 28 ARG CB 1 1 15 16002 1 1 28 ARG CD C -13.675 7.397 -0.108 1.00 . A A . 28 ARG CD 1 1 15 16003 1 1 28 ARG CG C -13.243 5.942 -0.032 1.00 . A A . 28 ARG CG 1 1 15 16004 1 1 28 ARG CZ C -13.158 9.536 0.993 1.00 . A A . 28 ARG CZ 1 1 15 16005 1 1 28 ARG H H -11.506 4.037 -1.074 1.00 . A A . 28 ARG H 1 1 15 16006 1 1 28 ARG HA H -14.158 3.157 -0.300 1.00 . A A . 28 ARG HA 1 1 15 16007 1 1 28 ARG HB2 H -13.483 5.482 -2.091 1.00 . A A . 28 ARG HB2 1 1 15 16008 1 1 28 ARG HB3 H -14.931 5.260 -1.124 1.00 . A A . 28 ARG HB3 1 1 15 16009 1 1 28 ARG HD2 H -13.468 7.771 -1.100 1.00 . A A . 28 ARG HD2 1 1 15 16010 1 1 28 ARG HD3 H -14.737 7.454 0.081 1.00 . A A . 28 ARG HD3 1 1 15 16011 1 1 28 ARG HE H -12.330 7.782 1.460 1.00 . A A . 28 ARG HE 1 1 15 16012 1 1 28 ARG HG2 H -13.557 5.533 0.918 1.00 . A A . 28 ARG HG2 1 1 15 16013 1 1 28 ARG HG3 H -12.167 5.889 -0.111 1.00 . A A . 28 ARG HG3 1 1 15 16014 1 1 28 ARG HH11 H -14.533 9.655 -0.484 1.00 . A A . 28 ARG HH11 1 1 15 16015 1 1 28 ARG HH12 H -14.156 11.152 0.302 1.00 . A A . 28 ARG HH12 1 1 15 16016 1 1 28 ARG HH21 H -11.828 9.745 2.499 1.00 . A A . 28 ARG HH21 1 1 15 16017 1 1 28 ARG HH22 H -12.617 11.204 1.998 1.00 . A A . 28 ARG HH22 1 1 15 16018 1 1 28 ARG N N -12.167 3.376 -0.800 1.00 . A A . 28 ARG N 1 1 15 16019 1 1 28 ARG NE N -12.973 8.226 0.867 1.00 . A A . 28 ARG NE 1 1 15 16020 1 1 28 ARG NH1 N -14.019 10.166 0.205 1.00 . A A . 28 ARG NH1 1 1 15 16021 1 1 28 ARG NH2 N -12.479 10.218 1.904 1.00 . A A . 28 ARG NH2 1 1 15 16022 1 1 28 ARG O O -14.088 3.609 -3.382 1.00 . A A . 28 ARG O 1 1 15 16023 1 1 29 TRP C C -14.736 1.377 -4.545 1.00 . A A . 29 TRP C 1 1 15 16024 1 1 29 TRP CA C -13.871 0.760 -3.461 1.00 . A A . 29 TRP CA 1 1 15 16025 1 1 29 TRP CB C -14.480 -0.543 -2.993 1.00 . A A . 29 TRP CB 1 1 15 16026 1 1 29 TRP CD1 C -14.041 -1.603 -5.275 1.00 . A A . 29 TRP CD1 1 1 15 16027 1 1 29 TRP CD2 C -15.747 -2.521 -4.150 1.00 . A A . 29 TRP CD2 1 1 15 16028 1 1 29 TRP CE2 C -15.609 -3.190 -5.382 1.00 . A A . 29 TRP CE2 1 1 15 16029 1 1 29 TRP CE3 C -16.754 -2.927 -3.271 1.00 . A A . 29 TRP CE3 1 1 15 16030 1 1 29 TRP CG C -14.735 -1.510 -4.104 1.00 . A A . 29 TRP CG 1 1 15 16031 1 1 29 TRP CH2 C -17.420 -4.618 -4.872 1.00 . A A . 29 TRP CH2 1 1 15 16032 1 1 29 TRP CZ2 C -16.443 -4.242 -5.754 1.00 . A A . 29 TRP CZ2 1 1 15 16033 1 1 29 TRP CZ3 C -17.580 -3.971 -3.641 1.00 . A A . 29 TRP CZ3 1 1 15 16034 1 1 29 TRP H H -13.525 1.222 -1.459 1.00 . A A . 29 TRP H 1 1 15 16035 1 1 29 TRP HA H -12.891 0.559 -3.856 1.00 . A A . 29 TRP HA 1 1 15 16036 1 1 29 TRP HB2 H -13.808 -1.013 -2.287 1.00 . A A . 29 TRP HB2 1 1 15 16037 1 1 29 TRP HB3 H -15.412 -0.320 -2.501 1.00 . A A . 29 TRP HB3 1 1 15 16038 1 1 29 TRP HD1 H -13.204 -0.967 -5.541 1.00 . A A . 29 TRP HD1 1 1 15 16039 1 1 29 TRP HE1 H -14.237 -2.873 -6.939 1.00 . A A . 29 TRP HE1 1 1 15 16040 1 1 29 TRP HE3 H -16.892 -2.439 -2.317 1.00 . A A . 29 TRP HE3 1 1 15 16041 1 1 29 TRP HH2 H -18.089 -5.429 -5.120 1.00 . A A . 29 TRP HH2 1 1 15 16042 1 1 29 TRP HZ2 H -16.333 -4.753 -6.699 1.00 . A A . 29 TRP HZ2 1 1 15 16043 1 1 29 TRP HZ3 H -18.364 -4.298 -2.974 1.00 . A A . 29 TRP HZ3 1 1 15 16044 1 1 29 TRP N N -13.720 1.634 -2.318 1.00 . A A . 29 TRP N 1 1 15 16045 1 1 29 TRP NE1 N -14.562 -2.611 -6.052 1.00 . A A . 29 TRP NE1 1 1 15 16046 1 1 29 TRP O O -15.954 1.238 -4.541 1.00 . A A . 29 TRP O 1 1 15 16047 1 1 30 LYS C C -15.979 2.071 -7.041 1.00 . A A . 30 LYS C 1 1 15 16048 1 1 30 LYS CA C -14.710 2.789 -6.574 1.00 . A A . 30 LYS CA 1 1 15 16049 1 1 30 LYS CB C -13.739 2.898 -7.751 1.00 . A A . 30 LYS CB 1 1 15 16050 1 1 30 LYS CD C -13.256 3.887 -10.014 1.00 . A A . 30 LYS CD 1 1 15 16051 1 1 30 LYS CE C -13.807 4.720 -11.160 1.00 . A A . 30 LYS CE 1 1 15 16052 1 1 30 LYS CG C -14.277 3.739 -8.898 1.00 . A A . 30 LYS CG 1 1 15 16053 1 1 30 LYS H H -13.087 2.237 -5.282 1.00 . A A . 30 LYS H 1 1 15 16054 1 1 30 LYS HA H -14.976 3.784 -6.251 1.00 . A A . 30 LYS HA 1 1 15 16055 1 1 30 LYS HB2 H -12.817 3.342 -7.409 1.00 . A A . 30 LYS HB2 1 1 15 16056 1 1 30 LYS HB3 H -13.534 1.907 -8.127 1.00 . A A . 30 LYS HB3 1 1 15 16057 1 1 30 LYS HD2 H -12.375 4.371 -9.620 1.00 . A A . 30 LYS HD2 1 1 15 16058 1 1 30 LYS HD3 H -12.997 2.906 -10.385 1.00 . A A . 30 LYS HD3 1 1 15 16059 1 1 30 LYS HE2 H -13.035 4.839 -11.906 1.00 . A A . 30 LYS HE2 1 1 15 16060 1 1 30 LYS HE3 H -14.649 4.201 -11.594 1.00 . A A . 30 LYS HE3 1 1 15 16061 1 1 30 LYS HG2 H -15.161 3.263 -9.294 1.00 . A A . 30 LYS HG2 1 1 15 16062 1 1 30 LYS HG3 H -14.531 4.719 -8.522 1.00 . A A . 30 LYS HG3 1 1 15 16063 1 1 30 LYS HZ1 H -13.457 6.577 -10.267 1.00 . A A . 30 LYS HZ1 1 1 15 16064 1 1 30 LYS HZ2 H -15.016 5.973 -10.005 1.00 . A A . 30 LYS HZ2 1 1 15 16065 1 1 30 LYS HZ3 H -14.601 6.620 -11.512 1.00 . A A . 30 LYS HZ3 1 1 15 16066 1 1 30 LYS N N -14.062 2.109 -5.434 1.00 . A A . 30 LYS N 1 1 15 16067 1 1 30 LYS NZ N -14.251 6.067 -10.704 1.00 . A A . 30 LYS NZ 1 1 15 16068 1 1 30 LYS O O -16.952 2.713 -7.439 1.00 . A A . 30 LYS O 1 1 15 16069 1 1 31 ASP C C -17.758 -0.689 -6.167 1.00 . A A . 31 ASP C 1 1 15 16070 1 1 31 ASP CA C -17.115 -0.051 -7.396 1.00 . A A . 31 ASP CA 1 1 15 16071 1 1 31 ASP CB C -16.703 -1.131 -8.398 1.00 . A A . 31 ASP CB 1 1 15 16072 1 1 31 ASP CG C -17.893 -1.879 -8.964 1.00 . A A . 31 ASP CG 1 1 15 16073 1 1 31 ASP H H -15.149 0.289 -6.691 1.00 . A A . 31 ASP H 1 1 15 16074 1 1 31 ASP HA H -17.830 0.611 -7.861 1.00 . A A . 31 ASP HA 1 1 15 16075 1 1 31 ASP HB2 H -16.169 -0.670 -9.215 1.00 . A A . 31 ASP HB2 1 1 15 16076 1 1 31 ASP HB3 H -16.055 -1.841 -7.905 1.00 . A A . 31 ASP HB3 1 1 15 16077 1 1 31 ASP N N -15.960 0.744 -6.998 1.00 . A A . 31 ASP N 1 1 15 16078 1 1 31 ASP O O -17.944 -1.905 -6.108 1.00 . A A . 31 ASP O 1 1 15 16079 1 1 31 ASP OD1 O -18.470 -1.408 -9.966 1.00 . A A . 31 ASP OD1 1 1 15 16080 1 1 31 ASP OD2 O -18.246 -2.940 -8.406 1.00 . A A . 31 ASP OD2 1 1 15 16081 1 1 32 GLY C C -19.620 0.668 -3.314 1.00 . A A . 32 GLY C 1 1 15 16082 1 1 32 GLY CA C -18.693 -0.344 -3.959 1.00 . A A . 32 GLY CA 1 1 15 16083 1 1 32 GLY H H -17.929 1.105 -5.297 1.00 . A A . 32 GLY H 1 1 15 16084 1 1 32 GLY HA2 H -19.252 -1.242 -4.174 1.00 . A A . 32 GLY HA2 1 1 15 16085 1 1 32 GLY HA3 H -17.901 -0.580 -3.258 1.00 . A A . 32 GLY HA3 1 1 15 16086 1 1 32 GLY N N -18.093 0.145 -5.185 1.00 . A A . 32 GLY N 1 1 15 16087 1 1 32 GLY O O -20.382 1.352 -3.997 1.00 . A A . 32 GLY O 1 1 15 16088 1 1 33 GLY C C -19.703 2.182 0.008 1.00 . A A . 33 GLY C 1 1 15 16089 1 1 33 GLY CA C -20.382 1.692 -1.256 1.00 . A A . 33 GLY CA 1 1 15 16090 1 1 33 GLY H H -18.923 0.181 -1.505 1.00 . A A . 33 GLY H 1 1 15 16091 1 1 33 GLY HA2 H -20.599 2.539 -1.889 1.00 . A A . 33 GLY HA2 1 1 15 16092 1 1 33 GLY HA3 H -21.308 1.203 -0.989 1.00 . A A . 33 GLY HA3 1 1 15 16093 1 1 33 GLY N N -19.549 0.757 -1.990 1.00 . A A . 33 GLY N 1 1 15 16094 1 1 33 GLY O O -19.700 3.377 0.299 1.00 . A A . 33 GLY O 1 1 15 16095 1 1 34 ASP C C -16.920 1.481 1.790 1.00 . A A . 34 ASP C 1 1 15 16096 1 1 34 ASP CA C -18.428 1.579 1.995 1.00 . A A . 34 ASP CA 1 1 15 16097 1 1 34 ASP CB C -18.871 0.643 3.121 1.00 . A A . 34 ASP CB 1 1 15 16098 1 1 34 ASP CG C -18.208 0.972 4.444 1.00 . A A . 34 ASP CG 1 1 15 16099 1 1 34 ASP H H -19.173 0.311 0.474 1.00 . A A . 34 ASP H 1 1 15 16100 1 1 34 ASP HA H -18.680 2.595 2.259 1.00 . A A . 34 ASP HA 1 1 15 16101 1 1 34 ASP HB2 H -19.940 0.721 3.247 1.00 . A A . 34 ASP HB2 1 1 15 16102 1 1 34 ASP HB3 H -18.618 -0.374 2.855 1.00 . A A . 34 ASP HB3 1 1 15 16103 1 1 34 ASP N N -19.128 1.249 0.760 1.00 . A A . 34 ASP N 1 1 15 16104 1 1 34 ASP O O -16.458 0.889 0.814 1.00 . A A . 34 ASP O 1 1 15 16105 1 1 34 ASP OD1 O -18.733 1.841 5.171 1.00 . A A . 34 ASP OD1 1 1 15 16106 1 1 34 ASP OD2 O -17.162 0.362 4.753 1.00 . A A . 34 ASP OD2 1 1 15 16107 1 1 35 CYS C C -14.072 1.374 3.827 1.00 . A A . 35 CYS C 1 1 15 16108 1 1 35 CYS CA C -14.702 2.034 2.606 1.00 . A A . 35 CYS CA 1 1 15 16109 1 1 35 CYS CB C -14.156 3.452 2.445 1.00 . A A . 35 CYS CB 1 1 15 16110 1 1 35 CYS H H -16.577 2.515 3.468 1.00 . A A . 35 CYS H 1 1 15 16111 1 1 35 CYS HA H -14.443 1.459 1.730 1.00 . A A . 35 CYS HA 1 1 15 16112 1 1 35 CYS HB2 H -13.081 3.408 2.350 1.00 . A A . 35 CYS HB2 1 1 15 16113 1 1 35 CYS HB3 H -14.574 3.890 1.550 1.00 . A A . 35 CYS HB3 1 1 15 16114 1 1 35 CYS HG H -13.670 5.552 3.809 1.00 . A A . 35 CYS HG 1 1 15 16115 1 1 35 CYS N N -16.156 2.060 2.707 1.00 . A A . 35 CYS N 1 1 15 16116 1 1 35 CYS O O -14.498 1.598 4.960 1.00 . A A . 35 CYS O 1 1 15 16117 1 1 35 CYS SG S -14.539 4.552 3.827 1.00 . A A . 35 CYS SG 1 1 15 16118 1 1 36 GLU C C -10.841 0.057 4.493 1.00 . A A . 36 GLU C 1 1 15 16119 1 1 36 GLU CA C -12.347 -0.132 4.655 1.00 . A A . 36 GLU CA 1 1 15 16120 1 1 36 GLU CB C -12.702 -1.621 4.650 1.00 . A A . 36 GLU CB 1 1 15 16121 1 1 36 GLU CD C -12.844 -1.637 7.172 1.00 . A A . 36 GLU CD 1 1 15 16122 1 1 36 GLU CG C -12.335 -2.349 5.933 1.00 . A A . 36 GLU CG 1 1 15 16123 1 1 36 GLU H H -12.767 0.416 2.657 1.00 . A A . 36 GLU H 1 1 15 16124 1 1 36 GLU HA H -12.655 0.303 5.594 1.00 . A A . 36 GLU HA 1 1 15 16125 1 1 36 GLU HB2 H -13.766 -1.725 4.496 1.00 . A A . 36 GLU HB2 1 1 15 16126 1 1 36 GLU HB3 H -12.182 -2.099 3.833 1.00 . A A . 36 GLU HB3 1 1 15 16127 1 1 36 GLU HG2 H -12.766 -3.339 5.906 1.00 . A A . 36 GLU HG2 1 1 15 16128 1 1 36 GLU HG3 H -11.260 -2.430 5.995 1.00 . A A . 36 GLU HG3 1 1 15 16129 1 1 36 GLU N N -13.052 0.559 3.585 1.00 . A A . 36 GLU N 1 1 15 16130 1 1 36 GLU O O -10.377 0.536 3.459 1.00 . A A . 36 GLU O 1 1 15 16131 1 1 36 GLU OE1 O -14.009 -1.870 7.555 1.00 . A A . 36 GLU OE1 1 1 15 16132 1 1 36 GLU OE2 O -12.076 -0.847 7.760 1.00 . A A . 36 GLU OE2 1 1 15 16133 1 1 37 TRP C C -7.983 -1.420 4.859 1.00 . A A . 37 TRP C 1 1 15 16134 1 1 37 TRP CA C -8.631 -0.185 5.471 1.00 . A A . 37 TRP CA 1 1 15 16135 1 1 37 TRP CB C -8.081 0.034 6.882 1.00 . A A . 37 TRP CB 1 1 15 16136 1 1 37 TRP CD1 C -9.118 2.372 6.994 1.00 . A A . 37 TRP CD1 1 1 15 16137 1 1 37 TRP CD2 C -8.922 1.361 8.982 1.00 . A A . 37 TRP CD2 1 1 15 16138 1 1 37 TRP CE2 C -9.501 2.630 9.177 1.00 . A A . 37 TRP CE2 1 1 15 16139 1 1 37 TRP CE3 C -8.703 0.542 10.094 1.00 . A A . 37 TRP CE3 1 1 15 16140 1 1 37 TRP CG C -8.686 1.217 7.576 1.00 . A A . 37 TRP CG 1 1 15 16141 1 1 37 TRP CH2 C -9.635 2.276 11.508 1.00 . A A . 37 TRP CH2 1 1 15 16142 1 1 37 TRP CZ2 C -9.862 3.098 10.439 1.00 . A A . 37 TRP CZ2 1 1 15 16143 1 1 37 TRP CZ3 C -9.062 1.009 11.345 1.00 . A A . 37 TRP CZ3 1 1 15 16144 1 1 37 TRP H H -10.501 -0.692 6.316 1.00 . A A . 37 TRP H 1 1 15 16145 1 1 37 TRP HA H -8.393 0.675 4.863 1.00 . A A . 37 TRP HA 1 1 15 16146 1 1 37 TRP HB2 H -8.280 -0.844 7.478 1.00 . A A . 37 TRP HB2 1 1 15 16147 1 1 37 TRP HB3 H -7.014 0.188 6.823 1.00 . A A . 37 TRP HB3 1 1 15 16148 1 1 37 TRP HD1 H -9.074 2.571 5.934 1.00 . A A . 37 TRP HD1 1 1 15 16149 1 1 37 TRP HE1 H -9.978 4.119 7.780 1.00 . A A . 37 TRP HE1 1 1 15 16150 1 1 37 TRP HE3 H -8.262 -0.437 9.989 1.00 . A A . 37 TRP HE3 1 1 15 16151 1 1 37 TRP HH2 H -9.899 2.600 12.505 1.00 . A A . 37 TRP HH2 1 1 15 16152 1 1 37 TRP HZ2 H -10.305 4.072 10.582 1.00 . A A . 37 TRP HZ2 1 1 15 16153 1 1 37 TRP HZ3 H -8.900 0.390 12.216 1.00 . A A . 37 TRP HZ3 1 1 15 16154 1 1 37 TRP N N -10.081 -0.322 5.513 1.00 . A A . 37 TRP N 1 1 15 16155 1 1 37 TRP NE1 N -9.610 3.227 7.950 1.00 . A A . 37 TRP NE1 1 1 15 16156 1 1 37 TRP O O -8.446 -2.541 5.063 1.00 . A A . 37 TRP O 1 1 15 16157 1 1 38 VAL C C -5.134 -2.850 4.427 1.00 . A A . 38 VAL C 1 1 15 16158 1 1 38 VAL CA C -6.192 -2.307 3.482 1.00 . A A . 38 VAL CA 1 1 15 16159 1 1 38 VAL CB C -5.518 -1.880 2.161 1.00 . A A . 38 VAL CB 1 1 15 16160 1 1 38 VAL CG1 C -4.732 -3.039 1.563 1.00 . A A . 38 VAL CG1 1 1 15 16161 1 1 38 VAL CG2 C -6.553 -1.374 1.172 1.00 . A A . 38 VAL CG2 1 1 15 16162 1 1 38 VAL H H -6.588 -0.286 3.974 1.00 . A A . 38 VAL H 1 1 15 16163 1 1 38 VAL HA H -6.905 -3.089 3.266 1.00 . A A . 38 VAL HA 1 1 15 16164 1 1 38 VAL HB H -4.828 -1.076 2.375 1.00 . A A . 38 VAL HB 1 1 15 16165 1 1 38 VAL HG11 H -5.393 -3.879 1.409 1.00 . A A . 38 VAL HG11 1 1 15 16166 1 1 38 VAL HG12 H -3.940 -3.325 2.241 1.00 . A A . 38 VAL HG12 1 1 15 16167 1 1 38 VAL HG13 H -4.307 -2.737 0.620 1.00 . A A . 38 VAL HG13 1 1 15 16168 1 1 38 VAL HG21 H -7.054 -2.214 0.718 1.00 . A A . 38 VAL HG21 1 1 15 16169 1 1 38 VAL HG22 H -6.063 -0.791 0.405 1.00 . A A . 38 VAL HG22 1 1 15 16170 1 1 38 VAL HG23 H -7.276 -0.760 1.687 1.00 . A A . 38 VAL HG23 1 1 15 16171 1 1 38 VAL N N -6.906 -1.205 4.110 1.00 . A A . 38 VAL N 1 1 15 16172 1 1 38 VAL O O -4.643 -2.137 5.302 1.00 . A A . 38 VAL O 1 1 15 16173 1 1 39 LYS C C -2.422 -4.140 4.913 1.00 . A A . 39 LYS C 1 1 15 16174 1 1 39 LYS CA C -3.798 -4.753 5.096 1.00 . A A . 39 LYS CA 1 1 15 16175 1 1 39 LYS CB C -3.751 -6.258 4.826 1.00 . A A . 39 LYS CB 1 1 15 16176 1 1 39 LYS CD C -2.833 -8.509 5.465 1.00 . A A . 39 LYS CD 1 1 15 16177 1 1 39 LYS CE C -2.411 -8.835 4.042 1.00 . A A . 39 LYS CE 1 1 15 16178 1 1 39 LYS CG C -2.792 -7.012 5.732 1.00 . A A . 39 LYS CG 1 1 15 16179 1 1 39 LYS H H -5.200 -4.627 3.521 1.00 . A A . 39 LYS H 1 1 15 16180 1 1 39 LYS HA H -4.102 -4.588 6.112 1.00 . A A . 39 LYS HA 1 1 15 16181 1 1 39 LYS HB2 H -4.741 -6.667 4.965 1.00 . A A . 39 LYS HB2 1 1 15 16182 1 1 39 LYS HB3 H -3.447 -6.418 3.803 1.00 . A A . 39 LYS HB3 1 1 15 16183 1 1 39 LYS HD2 H -2.162 -9.006 6.151 1.00 . A A . 39 LYS HD2 1 1 15 16184 1 1 39 LYS HD3 H -3.841 -8.865 5.624 1.00 . A A . 39 LYS HD3 1 1 15 16185 1 1 39 LYS HE2 H -3.036 -8.279 3.359 1.00 . A A . 39 LYS HE2 1 1 15 16186 1 1 39 LYS HE3 H -1.381 -8.538 3.909 1.00 . A A . 39 LYS HE3 1 1 15 16187 1 1 39 LYS HG2 H -1.789 -6.654 5.556 1.00 . A A . 39 LYS HG2 1 1 15 16188 1 1 39 LYS HG3 H -3.066 -6.831 6.761 1.00 . A A . 39 LYS HG3 1 1 15 16189 1 1 39 LYS HZ1 H -3.536 -10.577 3.796 1.00 . A A . 39 LYS HZ1 1 1 15 16190 1 1 39 LYS HZ2 H -1.991 -10.844 4.431 1.00 . A A . 39 LYS HZ2 1 1 15 16191 1 1 39 LYS HZ3 H -2.181 -10.490 2.788 1.00 . A A . 39 LYS HZ3 1 1 15 16192 1 1 39 LYS N N -4.785 -4.113 4.245 1.00 . A A . 39 LYS N 1 1 15 16193 1 1 39 LYS NZ N -2.538 -10.288 3.743 1.00 . A A . 39 LYS NZ 1 1 15 16194 1 1 39 LYS O O -1.736 -4.397 3.922 1.00 . A A . 39 LYS O 1 1 15 16195 1 1 40 GLY C C 0.333 -3.493 6.550 1.00 . A A . 40 GLY C 1 1 15 16196 1 1 40 GLY CA C -0.728 -2.691 5.831 1.00 . A A . 40 GLY CA 1 1 15 16197 1 1 40 GLY H H -2.627 -3.145 6.633 1.00 . A A . 40 GLY H 1 1 15 16198 1 1 40 GLY HA2 H -0.437 -2.588 4.798 1.00 . A A . 40 GLY HA2 1 1 15 16199 1 1 40 GLY HA3 H -0.791 -1.715 6.275 1.00 . A A . 40 GLY HA3 1 1 15 16200 1 1 40 GLY N N -2.026 -3.324 5.882 1.00 . A A . 40 GLY N 1 1 15 16201 1 1 40 GLY O O 1.193 -2.936 7.228 1.00 . A A . 40 GLY O 1 1 15 16202 1 1 41 VAL C C 2.034 -6.388 5.931 1.00 . A A . 41 VAL C 1 1 15 16203 1 1 41 VAL CA C 1.230 -5.694 7.026 1.00 . A A . 41 VAL CA 1 1 15 16204 1 1 41 VAL CB C 0.579 -6.774 7.908 1.00 . A A . 41 VAL CB 1 1 15 16205 1 1 41 VAL CG1 C 1.574 -7.296 8.932 1.00 . A A . 41 VAL CG1 1 1 15 16206 1 1 41 VAL CG2 C -0.672 -6.242 8.593 1.00 . A A . 41 VAL CG2 1 1 15 16207 1 1 41 VAL H H -0.493 -5.193 5.916 1.00 . A A . 41 VAL H 1 1 15 16208 1 1 41 VAL HA H 1.896 -5.102 7.636 1.00 . A A . 41 VAL HA 1 1 15 16209 1 1 41 VAL HB H 0.294 -7.599 7.271 1.00 . A A . 41 VAL HB 1 1 15 16210 1 1 41 VAL HG11 H 2.444 -7.684 8.423 1.00 . A A . 41 VAL HG11 1 1 15 16211 1 1 41 VAL HG12 H 1.116 -8.082 9.512 1.00 . A A . 41 VAL HG12 1 1 15 16212 1 1 41 VAL HG13 H 1.871 -6.490 9.588 1.00 . A A . 41 VAL HG13 1 1 15 16213 1 1 41 VAL HG21 H -0.407 -5.417 9.237 1.00 . A A . 41 VAL HG21 1 1 15 16214 1 1 41 VAL HG22 H -1.122 -7.028 9.182 1.00 . A A . 41 VAL HG22 1 1 15 16215 1 1 41 VAL HG23 H -1.376 -5.904 7.847 1.00 . A A . 41 VAL HG23 1 1 15 16216 1 1 41 VAL N N 0.248 -4.807 6.425 1.00 . A A . 41 VAL N 1 1 15 16217 1 1 41 VAL O O 2.819 -7.295 6.207 1.00 . A A . 41 VAL O 1 1 15 16218 1 1 42 HIS C C 3.984 -6.113 3.559 1.00 . A A . 42 HIS C 1 1 15 16219 1 1 42 HIS CA C 2.540 -6.546 3.559 1.00 . A A . 42 HIS CA 1 1 15 16220 1 1 42 HIS CB C 1.834 -6.197 2.249 1.00 . A A . 42 HIS CB 1 1 15 16221 1 1 42 HIS CD2 C 1.802 -8.256 0.670 1.00 . A A . 42 HIS CD2 1 1 15 16222 1 1 42 HIS CE1 C -0.283 -8.859 0.976 1.00 . A A . 42 HIS CE1 1 1 15 16223 1 1 42 HIS CG C 1.252 -7.385 1.548 1.00 . A A . 42 HIS CG 1 1 15 16224 1 1 42 HIS H H 1.226 -5.203 4.517 1.00 . A A . 42 HIS H 1 1 15 16225 1 1 42 HIS HA H 2.530 -7.605 3.694 1.00 . A A . 42 HIS HA 1 1 15 16226 1 1 42 HIS HB2 H 1.022 -5.514 2.464 1.00 . A A . 42 HIS HB2 1 1 15 16227 1 1 42 HIS HB3 H 2.537 -5.721 1.581 1.00 . A A . 42 HIS HB3 1 1 15 16228 1 1 42 HIS HD1 H -0.718 -7.358 2.296 1.00 . A A . 42 HIS HD1 1 1 15 16229 1 1 42 HIS HD2 H 2.819 -8.238 0.304 1.00 . A A . 42 HIS HD2 1 1 15 16230 1 1 42 HIS HE1 H -1.219 -9.393 0.906 1.00 . A A . 42 HIS HE1 1 1 15 16231 1 1 42 HIS HE2 H 0.965 -9.968 -0.210 1.00 . A A . 42 HIS HE2 1 1 15 16232 1 1 42 HIS N N 1.839 -5.952 4.683 1.00 . A A . 42 HIS N 1 1 15 16233 1 1 42 HIS ND1 N -0.055 -7.791 1.718 1.00 . A A . 42 HIS ND1 1 1 15 16234 1 1 42 HIS NE2 N 0.828 -9.162 0.331 1.00 . A A . 42 HIS NE2 1 1 15 16235 1 1 42 HIS O O 4.406 -5.287 2.755 1.00 . A A . 42 HIS O 1 1 15 16236 1 1 43 VAL C C 6.987 -6.630 3.420 1.00 . A A . 43 VAL C 1 1 15 16237 1 1 43 VAL CA C 6.141 -6.472 4.675 1.00 . A A . 43 VAL CA 1 1 15 16238 1 1 43 VAL CB C 6.713 -7.380 5.787 1.00 . A A . 43 VAL CB 1 1 15 16239 1 1 43 VAL CG1 C 8.188 -7.090 6.028 1.00 . A A . 43 VAL CG1 1 1 15 16240 1 1 43 VAL CG2 C 5.917 -7.212 7.073 1.00 . A A . 43 VAL CG2 1 1 15 16241 1 1 43 VAL H H 4.288 -7.423 5.022 1.00 . A A . 43 VAL H 1 1 15 16242 1 1 43 VAL HA H 6.226 -5.458 5.005 1.00 . A A . 43 VAL HA 1 1 15 16243 1 1 43 VAL HB H 6.620 -8.407 5.466 1.00 . A A . 43 VAL HB 1 1 15 16244 1 1 43 VAL HG11 H 8.328 -6.029 6.165 1.00 . A A . 43 VAL HG11 1 1 15 16245 1 1 43 VAL HG12 H 8.765 -7.424 5.179 1.00 . A A . 43 VAL HG12 1 1 15 16246 1 1 43 VAL HG13 H 8.517 -7.615 6.913 1.00 . A A . 43 VAL HG13 1 1 15 16247 1 1 43 VAL HG21 H 5.973 -6.185 7.401 1.00 . A A . 43 VAL HG21 1 1 15 16248 1 1 43 VAL HG22 H 6.328 -7.856 7.837 1.00 . A A . 43 VAL HG22 1 1 15 16249 1 1 43 VAL HG23 H 4.886 -7.478 6.896 1.00 . A A . 43 VAL HG23 1 1 15 16250 1 1 43 VAL N N 4.726 -6.748 4.459 1.00 . A A . 43 VAL N 1 1 15 16251 1 1 43 VAL O O 7.730 -7.599 3.270 1.00 . A A . 43 VAL O 1 1 15 16252 1 1 44 ALA C C 8.899 -4.817 1.535 1.00 . A A . 44 ALA C 1 1 15 16253 1 1 44 ALA CA C 7.650 -5.646 1.306 1.00 . A A . 44 ALA CA 1 1 15 16254 1 1 44 ALA CB C 6.841 -5.108 0.137 1.00 . A A . 44 ALA CB 1 1 15 16255 1 1 44 ALA H H 6.213 -4.948 2.675 1.00 . A A . 44 ALA H 1 1 15 16256 1 1 44 ALA HA H 7.948 -6.658 1.089 1.00 . A A . 44 ALA HA 1 1 15 16257 1 1 44 ALA HB1 H 5.882 -5.605 0.105 1.00 . A A . 44 ALA HB1 1 1 15 16258 1 1 44 ALA HB2 H 7.374 -5.294 -0.782 1.00 . A A . 44 ALA HB2 1 1 15 16259 1 1 44 ALA HB3 H 6.693 -4.045 0.260 1.00 . A A . 44 ALA HB3 1 1 15 16260 1 1 44 ALA N N 6.860 -5.666 2.519 1.00 . A A . 44 ALA N 1 1 15 16261 1 1 44 ALA O O 9.234 -3.934 0.745 1.00 . A A . 44 ALA O 1 1 15 16262 1 1 45 GLU C C 11.738 -4.306 1.811 1.00 . A A . 45 GLU C 1 1 15 16263 1 1 45 GLU CA C 10.803 -4.408 3.003 1.00 . A A . 45 GLU CA 1 1 15 16264 1 1 45 GLU CB C 11.503 -5.119 4.163 1.00 . A A . 45 GLU CB 1 1 15 16265 1 1 45 GLU CD C 12.541 -3.019 5.104 1.00 . A A . 45 GLU CD 1 1 15 16266 1 1 45 GLU CG C 12.783 -4.433 4.614 1.00 . A A . 45 GLU CG 1 1 15 16267 1 1 45 GLU H H 9.268 -5.853 3.195 1.00 . A A . 45 GLU H 1 1 15 16268 1 1 45 GLU HA H 10.524 -3.413 3.312 1.00 . A A . 45 GLU HA 1 1 15 16269 1 1 45 GLU HB2 H 10.828 -5.162 5.005 1.00 . A A . 45 GLU HB2 1 1 15 16270 1 1 45 GLU HB3 H 11.748 -6.126 3.859 1.00 . A A . 45 GLU HB3 1 1 15 16271 1 1 45 GLU HG2 H 13.218 -5.007 5.418 1.00 . A A . 45 GLU HG2 1 1 15 16272 1 1 45 GLU HG3 H 13.471 -4.399 3.782 1.00 . A A . 45 GLU HG3 1 1 15 16273 1 1 45 GLU N N 9.584 -5.119 2.632 1.00 . A A . 45 GLU N 1 1 15 16274 1 1 45 GLU O O 12.555 -3.389 1.719 1.00 . A A . 45 GLU O 1 1 15 16275 1 1 45 GLU OE1 O 12.501 -2.098 4.261 1.00 . A A . 45 GLU OE1 1 1 15 16276 1 1 45 GLU OE2 O 12.393 -2.833 6.331 1.00 . A A . 45 GLU OE2 1 1 15 16277 1 1 46 ASP C C 11.955 -4.198 -1.266 1.00 . A A . 46 ASP C 1 1 15 16278 1 1 46 ASP CA C 12.426 -5.273 -0.300 1.00 . A A . 46 ASP CA 1 1 15 16279 1 1 46 ASP CB C 12.367 -6.641 -0.972 1.00 . A A . 46 ASP CB 1 1 15 16280 1 1 46 ASP CG C 12.852 -7.754 -0.063 1.00 . A A . 46 ASP CG 1 1 15 16281 1 1 46 ASP H H 10.953 -5.977 1.049 1.00 . A A . 46 ASP H 1 1 15 16282 1 1 46 ASP HA H 13.446 -5.061 -0.017 1.00 . A A . 46 ASP HA 1 1 15 16283 1 1 46 ASP HB2 H 11.346 -6.849 -1.254 1.00 . A A . 46 ASP HB2 1 1 15 16284 1 1 46 ASP HB3 H 12.986 -6.625 -1.856 1.00 . A A . 46 ASP HB3 1 1 15 16285 1 1 46 ASP N N 11.611 -5.260 0.902 1.00 . A A . 46 ASP N 1 1 15 16286 1 1 46 ASP O O 12.762 -3.431 -1.790 1.00 . A A . 46 ASP O 1 1 15 16287 1 1 46 ASP OD1 O 14.071 -7.815 0.201 1.00 . A A . 46 ASP OD1 1 1 15 16288 1 1 46 ASP OD2 O 12.013 -8.563 0.385 1.00 . A A . 46 ASP OD2 1 1 15 16289 1 1 47 VAL C C 10.470 -1.737 -1.933 1.00 . A A . 47 VAL C 1 1 15 16290 1 1 47 VAL CA C 10.084 -3.137 -2.391 1.00 . A A . 47 VAL CA 1 1 15 16291 1 1 47 VAL CB C 8.550 -3.252 -2.477 1.00 . A A . 47 VAL CB 1 1 15 16292 1 1 47 VAL CG1 C 7.976 -2.170 -3.380 1.00 . A A . 47 VAL CG1 1 1 15 16293 1 1 47 VAL CG2 C 8.152 -4.632 -2.979 1.00 . A A . 47 VAL CG2 1 1 15 16294 1 1 47 VAL H H 10.037 -4.740 -1.005 1.00 . A A . 47 VAL H 1 1 15 16295 1 1 47 VAL HA H 10.493 -3.311 -3.374 1.00 . A A . 47 VAL HA 1 1 15 16296 1 1 47 VAL HB H 8.142 -3.122 -1.485 1.00 . A A . 47 VAL HB 1 1 15 16297 1 1 47 VAL HG11 H 8.254 -2.374 -4.403 1.00 . A A . 47 VAL HG11 1 1 15 16298 1 1 47 VAL HG12 H 8.370 -1.209 -3.084 1.00 . A A . 47 VAL HG12 1 1 15 16299 1 1 47 VAL HG13 H 6.900 -2.162 -3.294 1.00 . A A . 47 VAL HG13 1 1 15 16300 1 1 47 VAL HG21 H 8.581 -5.386 -2.336 1.00 . A A . 47 VAL HG21 1 1 15 16301 1 1 47 VAL HG22 H 8.516 -4.767 -3.986 1.00 . A A . 47 VAL HG22 1 1 15 16302 1 1 47 VAL HG23 H 7.075 -4.722 -2.971 1.00 . A A . 47 VAL HG23 1 1 15 16303 1 1 47 VAL N N 10.642 -4.128 -1.483 1.00 . A A . 47 VAL N 1 1 15 16304 1 1 47 VAL O O 10.913 -0.929 -2.719 1.00 . A A . 47 VAL O 1 1 15 16305 1 1 48 ALA C C 12.110 -0.003 0.080 1.00 . A A . 48 ALA C 1 1 15 16306 1 1 48 ALA CA C 10.610 -0.242 0.032 1.00 . A A . 48 ALA CA 1 1 15 16307 1 1 48 ALA CB C 10.054 -0.268 1.447 1.00 . A A . 48 ALA CB 1 1 15 16308 1 1 48 ALA H H 9.946 -2.208 -0.124 1.00 . A A . 48 ALA H 1 1 15 16309 1 1 48 ALA HA H 10.134 0.567 -0.490 1.00 . A A . 48 ALA HA 1 1 15 16310 1 1 48 ALA HB1 H 8.975 -0.257 1.410 1.00 . A A . 48 ALA HB1 1 1 15 16311 1 1 48 ALA HB2 H 10.404 0.598 1.988 1.00 . A A . 48 ALA HB2 1 1 15 16312 1 1 48 ALA HB3 H 10.388 -1.165 1.949 1.00 . A A . 48 ALA HB3 1 1 15 16313 1 1 48 ALA N N 10.298 -1.503 -0.643 1.00 . A A . 48 ALA N 1 1 15 16314 1 1 48 ALA O O 12.605 1.006 -0.423 1.00 . A A . 48 ALA O 1 1 15 16315 1 1 49 LYS C C 14.884 -0.619 -0.577 1.00 . A A . 49 LYS C 1 1 15 16316 1 1 49 LYS CA C 14.277 -0.822 0.802 1.00 . A A . 49 LYS CA 1 1 15 16317 1 1 49 LYS CB C 14.868 -2.066 1.469 1.00 . A A . 49 LYS CB 1 1 15 16318 1 1 49 LYS CD C 16.872 -3.141 2.536 1.00 . A A . 49 LYS CD 1 1 15 16319 1 1 49 LYS CE C 16.538 -4.483 1.905 1.00 . A A . 49 LYS CE 1 1 15 16320 1 1 49 LYS CG C 16.370 -1.985 1.686 1.00 . A A . 49 LYS CG 1 1 15 16321 1 1 49 LYS H H 12.384 -1.732 1.057 1.00 . A A . 49 LYS H 1 1 15 16322 1 1 49 LYS HA H 14.495 0.045 1.410 1.00 . A A . 49 LYS HA 1 1 15 16323 1 1 49 LYS HB2 H 14.394 -2.205 2.429 1.00 . A A . 49 LYS HB2 1 1 15 16324 1 1 49 LYS HB3 H 14.662 -2.925 0.847 1.00 . A A . 49 LYS HB3 1 1 15 16325 1 1 49 LYS HD2 H 17.945 -3.061 2.638 1.00 . A A . 49 LYS HD2 1 1 15 16326 1 1 49 LYS HD3 H 16.411 -3.086 3.512 1.00 . A A . 49 LYS HD3 1 1 15 16327 1 1 49 LYS HE2 H 15.467 -4.558 1.794 1.00 . A A . 49 LYS HE2 1 1 15 16328 1 1 49 LYS HE3 H 17.005 -4.534 0.932 1.00 . A A . 49 LYS HE3 1 1 15 16329 1 1 49 LYS HG2 H 16.865 -2.016 0.728 1.00 . A A . 49 LYS HG2 1 1 15 16330 1 1 49 LYS HG3 H 16.602 -1.056 2.186 1.00 . A A . 49 LYS HG3 1 1 15 16331 1 1 49 LYS HZ1 H 16.758 -6.524 2.288 1.00 . A A . 49 LYS HZ1 1 1 15 16332 1 1 49 LYS HZ2 H 16.592 -5.581 3.681 1.00 . A A . 49 LYS HZ2 1 1 15 16333 1 1 49 LYS HZ3 H 18.054 -5.582 2.831 1.00 . A A . 49 LYS HZ3 1 1 15 16334 1 1 49 LYS N N 12.832 -0.939 0.689 1.00 . A A . 49 LYS N 1 1 15 16335 1 1 49 LYS NZ N 17.019 -5.622 2.734 1.00 . A A . 49 LYS NZ 1 1 15 16336 1 1 49 LYS O O 15.891 0.068 -0.735 1.00 . A A . 49 LYS O 1 1 15 16337 1 1 50 ASP C C 14.025 0.046 -3.647 1.00 . A A . 50 ASP C 1 1 15 16338 1 1 50 ASP CA C 14.731 -1.110 -2.941 1.00 . A A . 50 ASP CA 1 1 15 16339 1 1 50 ASP CB C 14.538 -2.438 -3.696 1.00 . A A . 50 ASP CB 1 1 15 16340 1 1 50 ASP CG C 13.205 -2.575 -4.426 1.00 . A A . 50 ASP CG 1 1 15 16341 1 1 50 ASP H H 13.483 -1.793 -1.381 1.00 . A A . 50 ASP H 1 1 15 16342 1 1 50 ASP HA H 15.787 -0.888 -2.903 1.00 . A A . 50 ASP HA 1 1 15 16343 1 1 50 ASP HB2 H 15.326 -2.539 -4.420 1.00 . A A . 50 ASP HB2 1 1 15 16344 1 1 50 ASP HB3 H 14.612 -3.245 -2.979 1.00 . A A . 50 ASP HB3 1 1 15 16345 1 1 50 ASP N N 14.267 -1.236 -1.574 1.00 . A A . 50 ASP N 1 1 15 16346 1 1 50 ASP O O 14.512 0.559 -4.654 1.00 . A A . 50 ASP O 1 1 15 16347 1 1 50 ASP OD1 O 12.891 -1.707 -5.268 1.00 . A A . 50 ASP OD1 1 1 15 16348 1 1 50 ASP OD2 O 12.490 -3.565 -4.172 1.00 . A A . 50 ASP OD2 1 1 15 16349 1 1 51 TYR C C 12.814 2.856 -3.496 1.00 . A A . 51 TYR C 1 1 15 16350 1 1 51 TYR CA C 12.117 1.531 -3.724 1.00 . A A . 51 TYR CA 1 1 15 16351 1 1 51 TYR CB C 10.697 1.631 -3.178 1.00 . A A . 51 TYR CB 1 1 15 16352 1 1 51 TYR CD1 C 9.983 0.034 -5.021 1.00 . A A . 51 TYR CD1 1 1 15 16353 1 1 51 TYR CD2 C 8.299 1.311 -3.916 1.00 . A A . 51 TYR CD2 1 1 15 16354 1 1 51 TYR CE1 C 9.020 -0.553 -5.819 1.00 . A A . 51 TYR CE1 1 1 15 16355 1 1 51 TYR CE2 C 7.331 0.724 -4.711 1.00 . A A . 51 TYR CE2 1 1 15 16356 1 1 51 TYR CG C 9.641 0.979 -4.055 1.00 . A A . 51 TYR CG 1 1 15 16357 1 1 51 TYR CZ C 7.697 -0.205 -5.659 1.00 . A A . 51 TYR CZ 1 1 15 16358 1 1 51 TYR H H 12.523 0.014 -2.317 1.00 . A A . 51 TYR H 1 1 15 16359 1 1 51 TYR HA H 12.058 1.312 -4.757 1.00 . A A . 51 TYR HA 1 1 15 16360 1 1 51 TYR HB2 H 10.671 1.163 -2.225 1.00 . A A . 51 TYR HB2 1 1 15 16361 1 1 51 TYR HB3 H 10.433 2.674 -3.066 1.00 . A A . 51 TYR HB3 1 1 15 16362 1 1 51 TYR HD1 H 11.019 -0.241 -5.145 1.00 . A A . 51 TYR HD1 1 1 15 16363 1 1 51 TYR HD2 H 8.012 2.038 -3.170 1.00 . A A . 51 TYR HD2 1 1 15 16364 1 1 51 TYR HE1 H 9.306 -1.283 -6.561 1.00 . A A . 51 TYR HE1 1 1 15 16365 1 1 51 TYR HE2 H 6.294 0.997 -4.586 1.00 . A A . 51 TYR HE2 1 1 15 16366 1 1 51 TYR HH H 6.906 -1.731 -6.519 1.00 . A A . 51 TYR HH 1 1 15 16367 1 1 51 TYR N N 12.871 0.451 -3.120 1.00 . A A . 51 TYR N 1 1 15 16368 1 1 51 TYR O O 13.225 3.540 -4.433 1.00 . A A . 51 TYR O 1 1 15 16369 1 1 51 TYR OH O 6.736 -0.790 -6.451 1.00 . A A . 51 TYR OH 1 1 15 16370 1 1 52 GLU C C 15.047 4.278 -1.564 1.00 . A A . 52 GLU C 1 1 15 16371 1 1 52 GLU CA C 13.553 4.452 -1.819 1.00 . A A . 52 GLU CA 1 1 15 16372 1 1 52 GLU CB C 12.871 5.009 -0.566 1.00 . A A . 52 GLU CB 1 1 15 16373 1 1 52 GLU CD C 12.393 4.729 1.897 1.00 . A A . 52 GLU CD 1 1 15 16374 1 1 52 GLU CG C 13.155 4.210 0.694 1.00 . A A . 52 GLU CG 1 1 15 16375 1 1 52 GLU H H 12.610 2.582 -1.533 1.00 . A A . 52 GLU H 1 1 15 16376 1 1 52 GLU HA H 13.418 5.147 -2.624 1.00 . A A . 52 GLU HA 1 1 15 16377 1 1 52 GLU HB2 H 13.209 6.022 -0.407 1.00 . A A . 52 GLU HB2 1 1 15 16378 1 1 52 GLU HB3 H 11.803 5.017 -0.728 1.00 . A A . 52 GLU HB3 1 1 15 16379 1 1 52 GLU HG2 H 12.875 3.181 0.526 1.00 . A A . 52 GLU HG2 1 1 15 16380 1 1 52 GLU HG3 H 14.213 4.263 0.909 1.00 . A A . 52 GLU HG3 1 1 15 16381 1 1 52 GLU N N 12.933 3.202 -2.221 1.00 . A A . 52 GLU N 1 1 15 16382 1 1 52 GLU O O 15.868 5.044 -2.067 1.00 . A A . 52 GLU O 1 1 15 16383 1 1 52 GLU OE1 O 12.798 5.771 2.451 1.00 . A A . 52 GLU OE1 1 1 15 16384 1 1 52 GLU OE2 O 11.391 4.093 2.286 1.00 . A A . 52 GLU OE2 1 1 15 16385 1 1 53 ASP C C 17.519 2.367 -1.614 1.00 . A A . 53 ASP C 1 1 15 16386 1 1 53 ASP CA C 16.773 2.986 -0.436 1.00 . A A . 53 ASP CA 1 1 15 16387 1 1 53 ASP CB C 16.832 2.059 0.776 1.00 . A A . 53 ASP CB 1 1 15 16388 1 1 53 ASP CG C 17.071 2.814 2.070 1.00 . A A . 53 ASP CG 1 1 15 16389 1 1 53 ASP H H 14.683 2.684 -0.419 1.00 . A A . 53 ASP H 1 1 15 16390 1 1 53 ASP HA H 17.245 3.923 -0.182 1.00 . A A . 53 ASP HA 1 1 15 16391 1 1 53 ASP HB2 H 15.890 1.532 0.860 1.00 . A A . 53 ASP HB2 1 1 15 16392 1 1 53 ASP HB3 H 17.632 1.345 0.641 1.00 . A A . 53 ASP HB3 1 1 15 16393 1 1 53 ASP N N 15.385 3.265 -0.777 1.00 . A A . 53 ASP N 1 1 15 16394 1 1 53 ASP O O 18.741 2.475 -1.711 1.00 . A A . 53 ASP O 1 1 15 16395 1 1 53 ASP OD1 O 18.249 3.039 2.415 1.00 . A A . 53 ASP OD1 1 1 15 16396 1 1 53 ASP OD2 O 16.080 3.178 2.736 1.00 . A A . 53 ASP OD2 1 1 15 16397 1 1 54 GLY C C 18.045 2.115 -4.583 1.00 . A A . 54 GLY C 1 1 15 16398 1 1 54 GLY CA C 17.398 1.098 -3.665 1.00 . A A . 54 GLY CA 1 1 15 16399 1 1 54 GLY H H 15.811 1.658 -2.378 1.00 . A A . 54 GLY H 1 1 15 16400 1 1 54 GLY HA2 H 18.152 0.401 -3.327 1.00 . A A . 54 GLY HA2 1 1 15 16401 1 1 54 GLY HA3 H 16.645 0.557 -4.216 1.00 . A A . 54 GLY HA3 1 1 15 16402 1 1 54 GLY N N 16.780 1.717 -2.507 1.00 . A A . 54 GLY N 1 1 15 16403 1 1 54 GLY O O 19.185 1.937 -5.013 1.00 . A A . 54 GLY O 1 1 15 16404 1 1 55 LEU C C 18.823 5.119 -5.011 1.00 . A A . 55 LEU C 1 1 15 16405 1 1 55 LEU CA C 17.824 4.238 -5.756 1.00 . A A . 55 LEU CA 1 1 15 16406 1 1 55 LEU CB C 16.671 5.087 -6.291 1.00 . A A . 55 LEU CB 1 1 15 16407 1 1 55 LEU CD1 C 14.679 5.309 -7.796 1.00 . A A . 55 LEU CD1 1 1 15 16408 1 1 55 LEU CD2 C 16.372 3.519 -8.228 1.00 . A A . 55 LEU CD2 1 1 15 16409 1 1 55 LEU CG C 15.659 4.337 -7.160 1.00 . A A . 55 LEU CG 1 1 15 16410 1 1 55 LEU H H 16.414 3.270 -4.509 1.00 . A A . 55 LEU H 1 1 15 16411 1 1 55 LEU HA H 18.328 3.766 -6.586 1.00 . A A . 55 LEU HA 1 1 15 16412 1 1 55 LEU HB2 H 16.143 5.513 -5.449 1.00 . A A . 55 LEU HB2 1 1 15 16413 1 1 55 LEU HB3 H 17.086 5.893 -6.879 1.00 . A A . 55 LEU HB3 1 1 15 16414 1 1 55 LEU HD11 H 15.215 5.994 -8.436 1.00 . A A . 55 LEU HD11 1 1 15 16415 1 1 55 LEU HD12 H 14.169 5.863 -7.023 1.00 . A A . 55 LEU HD12 1 1 15 16416 1 1 55 LEU HD13 H 13.956 4.760 -8.382 1.00 . A A . 55 LEU HD13 1 1 15 16417 1 1 55 LEU HD21 H 15.640 3.052 -8.871 1.00 . A A . 55 LEU HD21 1 1 15 16418 1 1 55 LEU HD22 H 16.976 2.758 -7.756 1.00 . A A . 55 LEU HD22 1 1 15 16419 1 1 55 LEU HD23 H 17.004 4.169 -8.816 1.00 . A A . 55 LEU HD23 1 1 15 16420 1 1 55 LEU HG H 15.096 3.656 -6.537 1.00 . A A . 55 LEU HG 1 1 15 16421 1 1 55 LEU N N 17.316 3.185 -4.884 1.00 . A A . 55 LEU N 1 1 15 16422 1 1 55 LEU O O 20.029 5.050 -5.256 1.00 . A A . 55 LEU O 1 1 15 16423 1 1 56 GLU C C 19.856 6.060 -2.202 1.00 . A A . 56 GLU C 1 1 15 16424 1 1 56 GLU CA C 19.165 6.832 -3.319 1.00 . A A . 56 GLU CA 1 1 15 16425 1 1 56 GLU CB C 18.348 7.979 -2.732 1.00 . A A . 56 GLU CB 1 1 15 16426 1 1 56 GLU CD C 17.104 10.136 -3.152 1.00 . A A . 56 GLU CD 1 1 15 16427 1 1 56 GLU CG C 17.865 8.979 -3.769 1.00 . A A . 56 GLU CG 1 1 15 16428 1 1 56 GLU H H 17.346 5.963 -3.961 1.00 . A A . 56 GLU H 1 1 15 16429 1 1 56 GLU HA H 19.915 7.238 -3.975 1.00 . A A . 56 GLU HA 1 1 15 16430 1 1 56 GLU HB2 H 17.487 7.567 -2.235 1.00 . A A . 56 GLU HB2 1 1 15 16431 1 1 56 GLU HB3 H 18.953 8.506 -2.009 1.00 . A A . 56 GLU HB3 1 1 15 16432 1 1 56 GLU HG2 H 18.722 9.373 -4.296 1.00 . A A . 56 GLU HG2 1 1 15 16433 1 1 56 GLU HG3 H 17.216 8.471 -4.467 1.00 . A A . 56 GLU HG3 1 1 15 16434 1 1 56 GLU N N 18.315 5.947 -4.104 1.00 . A A . 56 GLU N 1 1 15 16435 1 1 56 GLU O O 19.657 6.343 -1.021 1.00 . A A . 56 GLU O 1 1 15 16436 1 1 56 GLU OE1 O 17.749 11.135 -2.768 1.00 . A A . 56 GLU OE1 1 1 15 16437 1 1 56 GLU OE2 O 15.862 10.043 -3.051 1.00 . A A . 56 GLU OE2 1 1 15 16438 1 1 57 TYR C C 22.669 4.953 -1.171 1.00 . A A . 57 TYR C 1 1 15 16439 1 1 57 TYR CA C 21.388 4.261 -1.623 1.00 . A A . 57 TYR CA 1 1 15 16440 1 1 57 TYR CB C 21.716 2.897 -2.233 1.00 . A A . 57 TYR CB 1 1 15 16441 1 1 57 TYR CD1 C 21.949 1.356 -0.249 1.00 . A A . 57 TYR CD1 1 1 15 16442 1 1 57 TYR CD2 C 23.894 1.821 -1.545 1.00 . A A . 57 TYR CD2 1 1 15 16443 1 1 57 TYR CE1 C 22.693 0.542 0.584 1.00 . A A . 57 TYR CE1 1 1 15 16444 1 1 57 TYR CE2 C 24.646 1.008 -0.718 1.00 . A A . 57 TYR CE2 1 1 15 16445 1 1 57 TYR CG C 22.536 2.008 -1.325 1.00 . A A . 57 TYR CG 1 1 15 16446 1 1 57 TYR CZ C 24.046 0.373 0.342 1.00 . A A . 57 TYR CZ 1 1 15 16447 1 1 57 TYR H H 20.782 4.909 -3.545 1.00 . A A . 57 TYR H 1 1 15 16448 1 1 57 TYR HA H 20.748 4.117 -0.766 1.00 . A A . 57 TYR HA 1 1 15 16449 1 1 57 TYR HB2 H 20.795 2.381 -2.459 1.00 . A A . 57 TYR HB2 1 1 15 16450 1 1 57 TYR HB3 H 22.273 3.044 -3.146 1.00 . A A . 57 TYR HB3 1 1 15 16451 1 1 57 TYR HD1 H 20.894 1.492 -0.064 1.00 . A A . 57 TYR HD1 1 1 15 16452 1 1 57 TYR HD2 H 24.366 2.321 -2.378 1.00 . A A . 57 TYR HD2 1 1 15 16453 1 1 57 TYR HE1 H 22.219 0.043 1.416 1.00 . A A . 57 TYR HE1 1 1 15 16454 1 1 57 TYR HE2 H 25.701 0.875 -0.905 1.00 . A A . 57 TYR HE2 1 1 15 16455 1 1 57 TYR HH H 25.619 -0.009 1.375 1.00 . A A . 57 TYR HH 1 1 15 16456 1 1 57 TYR N N 20.666 5.082 -2.587 1.00 . A A . 57 TYR N 1 1 15 16457 1 1 57 TYR O O 23.710 4.757 -1.831 1.00 . A A . 57 TYR O 1 1 15 16458 1 1 57 TYR OXT O 22.619 5.684 -0.160 1.00 . A A . 57 TYR OXT 1 1 15 16459 1 1 57 TYR OH O 24.785 -0.439 1.172 1.00 . A A . 57 TYR OH 1 1 15 16460 2 2 1 ALA C C -17.736 -5.989 4.999 1.00 . B B . 1 ALA C 1 1 15 16461 2 2 1 ALA CA C -18.624 -6.695 6.021 1.00 . B B . 1 ALA CA 1 1 15 16462 2 2 1 ALA CB C -18.090 -8.091 6.309 1.00 . B B . 1 ALA CB 1 1 15 16463 2 2 1 ALA H1 H -20.074 -7.312 4.656 1.00 . B B . 1 ALA H1 1 1 15 16464 2 2 1 ALA H2 H -20.402 -5.817 5.376 1.00 . B B . 1 ALA H2 1 1 15 16465 2 2 1 ALA H3 H -20.621 -7.244 6.256 1.00 . B B . 1 ALA H3 1 1 15 16466 2 2 1 ALA HA H -18.608 -6.133 6.944 1.00 . B B . 1 ALA HA 1 1 15 16467 2 2 1 ALA HB1 H -17.078 -8.020 6.680 1.00 . B B . 1 ALA HB1 1 1 15 16468 2 2 1 ALA HB2 H -18.101 -8.675 5.401 1.00 . B B . 1 ALA HB2 1 1 15 16469 2 2 1 ALA HB3 H -18.712 -8.567 7.053 1.00 . B B . 1 ALA HB3 1 1 15 16470 2 2 1 ALA N N -20.028 -6.772 5.544 1.00 . B B . 1 ALA N 1 1 15 16471 2 2 1 ALA O O -17.051 -6.638 4.209 1.00 . B B . 1 ALA O 1 1 15 16472 2 2 2 PRO C C -15.455 -4.248 4.097 1.00 . B B . 2 PRO C 1 1 15 16473 2 2 2 PRO CA C -16.932 -3.850 4.070 1.00 . B B . 2 PRO CA 1 1 15 16474 2 2 2 PRO CB C -17.106 -2.417 4.580 1.00 . B B . 2 PRO CB 1 1 15 16475 2 2 2 PRO CD C -18.535 -3.795 5.908 1.00 . B B . 2 PRO CD 1 1 15 16476 2 2 2 PRO CG C -18.408 -2.426 5.303 1.00 . B B . 2 PRO CG 1 1 15 16477 2 2 2 PRO HA H -17.310 -3.922 3.061 1.00 . B B . 2 PRO HA 1 1 15 16478 2 2 2 PRO HB2 H -16.288 -2.165 5.241 1.00 . B B . 2 PRO HB2 1 1 15 16479 2 2 2 PRO HB3 H -17.123 -1.734 3.745 1.00 . B B . 2 PRO HB3 1 1 15 16480 2 2 2 PRO HD2 H -18.124 -3.806 6.907 1.00 . B B . 2 PRO HD2 1 1 15 16481 2 2 2 PRO HD3 H -19.569 -4.108 5.921 1.00 . B B . 2 PRO HD3 1 1 15 16482 2 2 2 PRO HG2 H -18.405 -1.672 6.076 1.00 . B B . 2 PRO HG2 1 1 15 16483 2 2 2 PRO HG3 H -19.215 -2.247 4.607 1.00 . B B . 2 PRO HG3 1 1 15 16484 2 2 2 PRO N N -17.741 -4.645 5.001 1.00 . B B . 2 PRO N 1 1 15 16485 2 2 2 PRO O O -14.768 -4.030 5.094 1.00 . B B . 2 PRO O 1 1 15 16486 2 2 3 PRO C C -12.616 -4.117 2.550 1.00 . B B . 3 PRO C 1 1 15 16487 2 2 3 PRO CA C -13.551 -5.266 2.910 1.00 . B B . 3 PRO CA 1 1 15 16488 2 2 3 PRO CB C -13.586 -6.297 1.787 1.00 . B B . 3 PRO CB 1 1 15 16489 2 2 3 PRO CD C -15.695 -5.148 1.766 1.00 . B B . 3 PRO CD 1 1 15 16490 2 2 3 PRO CG C -14.676 -5.829 0.886 1.00 . B B . 3 PRO CG 1 1 15 16491 2 2 3 PRO HA H -13.216 -5.732 3.824 1.00 . B B . 3 PRO HA 1 1 15 16492 2 2 3 PRO HB2 H -12.631 -6.316 1.281 1.00 . B B . 3 PRO HB2 1 1 15 16493 2 2 3 PRO HB3 H -13.802 -7.273 2.196 1.00 . B B . 3 PRO HB3 1 1 15 16494 2 2 3 PRO HD2 H -16.050 -4.241 1.297 1.00 . B B . 3 PRO HD2 1 1 15 16495 2 2 3 PRO HD3 H -16.520 -5.814 1.971 1.00 . B B . 3 PRO HD3 1 1 15 16496 2 2 3 PRO HG2 H -14.279 -5.131 0.164 1.00 . B B . 3 PRO HG2 1 1 15 16497 2 2 3 PRO HG3 H -15.122 -6.673 0.383 1.00 . B B . 3 PRO HG3 1 1 15 16498 2 2 3 PRO N N -14.948 -4.840 3.001 1.00 . B B . 3 PRO N 1 1 15 16499 2 2 3 PRO O O -11.501 -4.025 3.064 1.00 . B B . 3 PRO O 1 1 15 16500 2 2 4 GLY C C -10.848 -2.502 0.884 1.00 . B B . 4 GLY C 1 1 15 16501 2 2 4 GLY CA C -12.271 -2.110 1.240 1.00 . B B . 4 GLY CA 1 1 15 16502 2 2 4 GLY H H -13.970 -3.372 1.279 1.00 . B B . 4 GLY H 1 1 15 16503 2 2 4 GLY HA2 H -12.732 -1.655 0.377 1.00 . B B . 4 GLY HA2 1 1 15 16504 2 2 4 GLY HA3 H -12.243 -1.386 2.041 1.00 . B B . 4 GLY HA3 1 1 15 16505 2 2 4 GLY N N -13.075 -3.244 1.658 1.00 . B B . 4 GLY N 1 1 15 16506 2 2 4 GLY O O -9.944 -2.405 1.714 1.00 . B B . 4 GLY O 1 1 15 16507 2 2 5 THR C C -9.179 -3.170 -2.322 1.00 . B B . 5 THR C 1 1 15 16508 2 2 5 THR CA C -9.333 -3.361 -0.816 1.00 . B B . 5 THR CA 1 1 15 16509 2 2 5 THR CB C -9.053 -4.834 -0.468 1.00 . B B . 5 THR CB 1 1 15 16510 2 2 5 THR CG2 C -9.071 -5.046 1.037 1.00 . B B . 5 THR CG2 1 1 15 16511 2 2 5 THR H H -11.412 -2.976 -0.970 1.00 . B B . 5 THR H 1 1 15 16512 2 2 5 THR HA H -8.601 -2.748 -0.315 1.00 . B B . 5 THR HA 1 1 15 16513 2 2 5 THR HB H -8.073 -5.098 -0.842 1.00 . B B . 5 THR HB 1 1 15 16514 2 2 5 THR HG1 H -10.284 -5.311 -1.933 1.00 . B B . 5 THR HG1 1 1 15 16515 2 2 5 THR HG21 H -8.313 -4.428 1.497 1.00 . B B . 5 THR HG21 1 1 15 16516 2 2 5 THR HG22 H -8.870 -6.085 1.258 1.00 . B B . 5 THR HG22 1 1 15 16517 2 2 5 THR HG23 H -10.041 -4.776 1.428 1.00 . B B . 5 THR HG23 1 1 15 16518 2 2 5 THR N N -10.654 -2.946 -0.352 1.00 . B B . 5 THR N 1 1 15 16519 2 2 5 THR O O -10.163 -3.114 -3.058 1.00 . B B . 5 THR O 1 1 15 16520 2 2 5 THR OG1 O -10.031 -5.680 -1.085 1.00 . B B . 5 THR OG1 1 1 15 16521 2 2 6 ALA C C -6.304 -3.540 -4.576 1.00 . B B . 6 ALA C 1 1 15 16522 2 2 6 ALA CA C -7.634 -2.895 -4.189 1.00 . B B . 6 ALA CA 1 1 15 16523 2 2 6 ALA CB C -7.616 -1.417 -4.533 1.00 . B B . 6 ALA CB 1 1 15 16524 2 2 6 ALA H H -7.190 -3.107 -2.128 1.00 . B B . 6 ALA H 1 1 15 16525 2 2 6 ALA HA H -8.428 -3.360 -4.756 1.00 . B B . 6 ALA HA 1 1 15 16526 2 2 6 ALA HB1 H -7.858 -1.284 -5.575 1.00 . B B . 6 ALA HB1 1 1 15 16527 2 2 6 ALA HB2 H -6.634 -1.013 -4.335 1.00 . B B . 6 ALA HB2 1 1 15 16528 2 2 6 ALA HB3 H -8.345 -0.900 -3.926 1.00 . B B . 6 ALA HB3 1 1 15 16529 2 2 6 ALA N N -7.929 -3.073 -2.770 1.00 . B B . 6 ALA N 1 1 15 16530 2 2 6 ALA O O -6.197 -4.181 -5.622 1.00 . B B . 6 ALA O 1 1 15 16531 2 2 7 ARG C C -3.226 -3.118 -5.044 1.00 . B B . 7 ARG C 1 1 15 16532 2 2 7 ARG CA C -3.961 -3.919 -3.973 1.00 . B B . 7 ARG CA 1 1 15 16533 2 2 7 ARG CB C -4.062 -5.386 -4.398 1.00 . B B . 7 ARG CB 1 1 15 16534 2 2 7 ARG CD C -5.145 -7.624 -4.054 1.00 . B B . 7 ARG CD 1 1 15 16535 2 2 7 ARG CG C -4.982 -6.213 -3.516 1.00 . B B . 7 ARG CG 1 1 15 16536 2 2 7 ARG CZ C -6.322 -9.703 -3.473 1.00 . B B . 7 ARG CZ 1 1 15 16537 2 2 7 ARG H H -5.447 -2.837 -2.920 1.00 . B B . 7 ARG H 1 1 15 16538 2 2 7 ARG HA H -3.403 -3.859 -3.050 1.00 . B B . 7 ARG HA 1 1 15 16539 2 2 7 ARG HB2 H -4.432 -5.433 -5.412 1.00 . B B . 7 ARG HB2 1 1 15 16540 2 2 7 ARG HB3 H -3.076 -5.827 -4.365 1.00 . B B . 7 ARG HB3 1 1 15 16541 2 2 7 ARG HD2 H -5.560 -7.571 -5.049 1.00 . B B . 7 ARG HD2 1 1 15 16542 2 2 7 ARG HD3 H -4.174 -8.092 -4.096 1.00 . B B . 7 ARG HD3 1 1 15 16543 2 2 7 ARG HE H -6.414 -8.009 -2.423 1.00 . B B . 7 ARG HE 1 1 15 16544 2 2 7 ARG HG2 H -4.564 -6.263 -2.522 1.00 . B B . 7 ARG HG2 1 1 15 16545 2 2 7 ARG HG3 H -5.953 -5.737 -3.478 1.00 . B B . 7 ARG HG3 1 1 15 16546 2 2 7 ARG HH11 H -5.195 -9.801 -5.148 1.00 . B B . 7 ARG HH11 1 1 15 16547 2 2 7 ARG HH12 H -6.033 -11.258 -4.730 1.00 . B B . 7 ARG HH12 1 1 15 16548 2 2 7 ARG HH21 H -7.519 -9.925 -1.860 1.00 . B B . 7 ARG HH21 1 1 15 16549 2 2 7 ARG HH22 H -7.354 -11.329 -2.860 1.00 . B B . 7 ARG HH22 1 1 15 16550 2 2 7 ARG N N -5.294 -3.360 -3.729 1.00 . B B . 7 ARG N 1 1 15 16551 2 2 7 ARG NE N -6.025 -8.434 -3.215 1.00 . B B . 7 ARG NE 1 1 15 16552 2 2 7 ARG NH1 N -5.808 -10.303 -4.538 1.00 . B B . 7 ARG NH1 1 1 15 16553 2 2 7 ARG NH2 N -7.131 -10.374 -2.665 1.00 . B B . 7 ARG NH2 1 1 15 16554 2 2 7 ARG O O -3.665 -3.053 -6.193 1.00 . B B . 7 ARG O 1 1 15 16555 2 2 8 ARG C C -0.582 -2.568 -6.618 1.00 . B B . 8 ARG C 1 1 15 16556 2 2 8 ARG CA C -1.324 -1.702 -5.598 1.00 . B B . 8 ARG CA 1 1 15 16557 2 2 8 ARG CB C -0.330 -0.823 -4.841 1.00 . B B . 8 ARG CB 1 1 15 16558 2 2 8 ARG CD C 0.330 0.441 -6.910 1.00 . B B . 8 ARG CD 1 1 15 16559 2 2 8 ARG CG C -0.141 0.548 -5.470 1.00 . B B . 8 ARG CG 1 1 15 16560 2 2 8 ARG CZ C 1.081 1.953 -8.698 1.00 . B B . 8 ARG CZ 1 1 15 16561 2 2 8 ARG H H -1.798 -2.588 -3.733 1.00 . B B . 8 ARG H 1 1 15 16562 2 2 8 ARG HA H -2.012 -1.064 -6.130 1.00 . B B . 8 ARG HA 1 1 15 16563 2 2 8 ARG HB2 H -0.683 -0.687 -3.829 1.00 . B B . 8 ARG HB2 1 1 15 16564 2 2 8 ARG HB3 H 0.629 -1.319 -4.815 1.00 . B B . 8 ARG HB3 1 1 15 16565 2 2 8 ARG HD2 H 1.283 -0.064 -6.928 1.00 . B B . 8 ARG HD2 1 1 15 16566 2 2 8 ARG HD3 H -0.394 -0.134 -7.471 1.00 . B B . 8 ARG HD3 1 1 15 16567 2 2 8 ARG HE H 0.104 2.525 -7.058 1.00 . B B . 8 ARG HE 1 1 15 16568 2 2 8 ARG HG2 H -1.084 1.074 -5.449 1.00 . B B . 8 ARG HG2 1 1 15 16569 2 2 8 ARG HG3 H 0.592 1.099 -4.900 1.00 . B B . 8 ARG HG3 1 1 15 16570 2 2 8 ARG HH11 H 1.523 0.003 -8.993 1.00 . B B . 8 ARG HH11 1 1 15 16571 2 2 8 ARG HH12 H 2.048 1.080 -10.244 1.00 . B B . 8 ARG HH12 1 1 15 16572 2 2 8 ARG HH21 H 0.787 3.952 -8.696 1.00 . B B . 8 ARG HH21 1 1 15 16573 2 2 8 ARG HH22 H 1.630 3.327 -10.074 1.00 . B B . 8 ARG HH22 1 1 15 16574 2 2 8 ARG N N -2.103 -2.507 -4.665 1.00 . B B . 8 ARG N 1 1 15 16575 2 2 8 ARG NE N 0.475 1.753 -7.533 1.00 . B B . 8 ARG NE 1 1 15 16576 2 2 8 ARG NH1 N 1.592 0.928 -9.366 1.00 . B B . 8 ARG NH1 1 1 15 16577 2 2 8 ARG NH2 N 1.174 3.177 -9.197 1.00 . B B . 8 ARG NH2 1 1 15 16578 2 2 8 ARG O O -0.718 -2.361 -7.822 1.00 . B B . 8 ARG O 1 1 15 16579 2 2 9 LYS C C 0.851 -5.868 -6.622 1.00 . B B . 9 LYS C 1 1 15 16580 2 2 9 LYS CA C 0.955 -4.403 -7.043 1.00 . B B . 9 LYS CA 1 1 15 16581 2 2 9 LYS CB C 2.427 -3.977 -7.091 1.00 . B B . 9 LYS CB 1 1 15 16582 2 2 9 LYS CD C 4.088 -2.194 -7.709 1.00 . B B . 9 LYS CD 1 1 15 16583 2 2 9 LYS CE C 4.569 -2.894 -8.972 1.00 . B B . 9 LYS CE 1 1 15 16584 2 2 9 LYS CG C 2.628 -2.506 -7.419 1.00 . B B . 9 LYS CG 1 1 15 16585 2 2 9 LYS H H 0.272 -3.671 -5.173 1.00 . B B . 9 LYS H 1 1 15 16586 2 2 9 LYS HA H 0.529 -4.294 -8.030 1.00 . B B . 9 LYS HA 1 1 15 16587 2 2 9 LYS HB2 H 2.880 -4.175 -6.130 1.00 . B B . 9 LYS HB2 1 1 15 16588 2 2 9 LYS HB3 H 2.932 -4.561 -7.843 1.00 . B B . 9 LYS HB3 1 1 15 16589 2 2 9 LYS HD2 H 4.199 -1.128 -7.838 1.00 . B B . 9 LYS HD2 1 1 15 16590 2 2 9 LYS HD3 H 4.689 -2.522 -6.875 1.00 . B B . 9 LYS HD3 1 1 15 16591 2 2 9 LYS HE2 H 4.473 -3.960 -8.837 1.00 . B B . 9 LYS HE2 1 1 15 16592 2 2 9 LYS HE3 H 3.950 -2.581 -9.799 1.00 . B B . 9 LYS HE3 1 1 15 16593 2 2 9 LYS HG2 H 2.037 -2.256 -8.286 1.00 . B B . 9 LYS HG2 1 1 15 16594 2 2 9 LYS HG3 H 2.303 -1.913 -6.576 1.00 . B B . 9 LYS HG3 1 1 15 16595 2 2 9 LYS HZ1 H 6.276 -3.040 -10.167 1.00 . B B . 9 LYS HZ1 1 1 15 16596 2 2 9 LYS HZ2 H 6.607 -2.904 -8.513 1.00 . B B . 9 LYS HZ2 1 1 15 16597 2 2 9 LYS HZ3 H 6.109 -1.547 -9.391 1.00 . B B . 9 LYS HZ3 1 1 15 16598 2 2 9 LYS N N 0.203 -3.535 -6.141 1.00 . B B . 9 LYS N 1 1 15 16599 2 2 9 LYS NZ N 5.990 -2.574 -9.281 1.00 . B B . 9 LYS NZ 1 1 15 16600 2 2 9 LYS O O 0.031 -6.223 -5.775 1.00 . B B . 9 LYS O 1 1 15 16601 2 2 10 ARG C C 1.676 -8.383 -5.407 1.00 . B B . 10 ARG C 1 1 15 16602 2 2 10 ARG CA C 1.698 -8.143 -6.911 1.00 . B B . 10 ARG CA 1 1 15 16603 2 2 10 ARG CB C 2.947 -8.795 -7.497 1.00 . B B . 10 ARG CB 1 1 15 16604 2 2 10 ARG CD C 5.413 -9.184 -7.209 1.00 . B B . 10 ARG CD 1 1 15 16605 2 2 10 ARG CG C 4.232 -8.291 -6.864 1.00 . B B . 10 ARG CG 1 1 15 16606 2 2 10 ARG CZ C 7.824 -9.330 -6.742 1.00 . B B . 10 ARG CZ 1 1 15 16607 2 2 10 ARG H H 2.320 -6.374 -7.887 1.00 . B B . 10 ARG H 1 1 15 16608 2 2 10 ARG HA H 0.824 -8.590 -7.356 1.00 . B B . 10 ARG HA 1 1 15 16609 2 2 10 ARG HB2 H 2.888 -9.864 -7.346 1.00 . B B . 10 ARG HB2 1 1 15 16610 2 2 10 ARG HB3 H 2.985 -8.590 -8.556 1.00 . B B . 10 ARG HB3 1 1 15 16611 2 2 10 ARG HD2 H 5.206 -10.183 -6.858 1.00 . B B . 10 ARG HD2 1 1 15 16612 2 2 10 ARG HD3 H 5.537 -9.198 -8.281 1.00 . B B . 10 ARG HD3 1 1 15 16613 2 2 10 ARG HE H 6.611 -7.908 -6.044 1.00 . B B . 10 ARG HE 1 1 15 16614 2 2 10 ARG HG2 H 4.429 -7.293 -7.226 1.00 . B B . 10 ARG HG2 1 1 15 16615 2 2 10 ARG HG3 H 4.107 -8.266 -5.787 1.00 . B B . 10 ARG HG3 1 1 15 16616 2 2 10 ARG HH11 H 7.095 -10.795 -7.927 1.00 . B B . 10 ARG HH11 1 1 15 16617 2 2 10 ARG HH12 H 8.792 -10.887 -7.592 1.00 . B B . 10 ARG HH12 1 1 15 16618 2 2 10 ARG HH21 H 8.845 -8.017 -5.594 1.00 . B B . 10 ARG HH21 1 1 15 16619 2 2 10 ARG HH22 H 9.787 -9.307 -6.264 1.00 . B B . 10 ARG HH22 1 1 15 16620 2 2 10 ARG N N 1.689 -6.716 -7.219 1.00 . B B . 10 ARG N 1 1 15 16621 2 2 10 ARG NE N 6.654 -8.717 -6.595 1.00 . B B . 10 ARG NE 1 1 15 16622 2 2 10 ARG NH1 N 7.910 -10.428 -7.481 1.00 . B B . 10 ARG NH1 1 1 15 16623 2 2 10 ARG NH2 N 8.907 -8.845 -6.151 1.00 . B B . 10 ARG NH2 1 1 15 16624 2 2 10 ARG O O 1.181 -9.406 -4.938 1.00 . B B . 10 ARG O 1 1 15 16625 2 2 11 LYS C C 3.394 -8.487 -2.794 1.00 . B B . 11 LYS C 1 1 15 16626 2 2 11 LYS CA C 2.287 -7.528 -3.207 1.00 . B B . 11 LYS CA 1 1 15 16627 2 2 11 LYS CB C 0.949 -7.990 -2.628 1.00 . B B . 11 LYS CB 1 1 15 16628 2 2 11 LYS CD C -1.452 -7.358 -2.298 1.00 . B B . 11 LYS CD 1 1 15 16629 2 2 11 LYS CE C -2.192 -8.675 -2.480 1.00 . B B . 11 LYS CE 1 1 15 16630 2 2 11 LYS CG C -0.245 -7.259 -3.212 1.00 . B B . 11 LYS CG 1 1 15 16631 2 2 11 LYS H H 2.587 -6.632 -5.098 1.00 . B B . 11 LYS H 1 1 15 16632 2 2 11 LYS HA H 2.518 -6.549 -2.821 1.00 . B B . 11 LYS HA 1 1 15 16633 2 2 11 LYS HB2 H 0.830 -9.045 -2.818 1.00 . B B . 11 LYS HB2 1 1 15 16634 2 2 11 LYS HB3 H 0.956 -7.825 -1.562 1.00 . B B . 11 LYS HB3 1 1 15 16635 2 2 11 LYS HD2 H -1.117 -7.283 -1.275 1.00 . B B . 11 LYS HD2 1 1 15 16636 2 2 11 LYS HD3 H -2.124 -6.542 -2.520 1.00 . B B . 11 LYS HD3 1 1 15 16637 2 2 11 LYS HE2 H -3.080 -8.661 -1.868 1.00 . B B . 11 LYS HE2 1 1 15 16638 2 2 11 LYS HE3 H -2.473 -8.771 -3.517 1.00 . B B . 11 LYS HE3 1 1 15 16639 2 2 11 LYS HG2 H 0.010 -6.218 -3.346 1.00 . B B . 11 LYS HG2 1 1 15 16640 2 2 11 LYS HG3 H -0.491 -7.698 -4.168 1.00 . B B . 11 LYS HG3 1 1 15 16641 2 2 11 LYS HZ1 H -1.969 -10.641 -1.818 1.00 . B B . 11 LYS HZ1 1 1 15 16642 2 2 11 LYS HZ2 H -0.743 -9.600 -1.295 1.00 . B B . 11 LYS HZ2 1 1 15 16643 2 2 11 LYS HZ3 H -0.767 -10.143 -2.897 1.00 . B B . 11 LYS HZ3 1 1 15 16644 2 2 11 LYS N N 2.220 -7.428 -4.660 1.00 . B B . 11 LYS N 1 1 15 16645 2 2 11 LYS NZ N -1.359 -9.846 -2.095 1.00 . B B . 11 LYS NZ 1 1 15 16646 2 2 11 LYS O O 3.190 -9.699 -2.732 1.00 . B B . 11 LYS O 1 1 15 16647 2 2 12 ALA C C 5.929 -8.686 -0.607 1.00 . B B . 12 ALA C 1 1 15 16648 2 2 12 ALA CA C 5.710 -8.743 -2.113 1.00 . B B . 12 ALA CA 1 1 15 16649 2 2 12 ALA CB C 6.961 -8.275 -2.839 1.00 . B B . 12 ALA CB 1 1 15 16650 2 2 12 ALA H H 4.665 -6.960 -2.560 1.00 . B B . 12 ALA H 1 1 15 16651 2 2 12 ALA HA H 5.514 -9.765 -2.406 1.00 . B B . 12 ALA HA 1 1 15 16652 2 2 12 ALA HB1 H 6.697 -7.931 -3.828 1.00 . B B . 12 ALA HB1 1 1 15 16653 2 2 12 ALA HB2 H 7.661 -9.093 -2.916 1.00 . B B . 12 ALA HB2 1 1 15 16654 2 2 12 ALA HB3 H 7.415 -7.465 -2.284 1.00 . B B . 12 ALA HB3 1 1 15 16655 2 2 12 ALA N N 4.567 -7.936 -2.510 1.00 . B B . 12 ALA N 1 1 15 16656 2 2 12 ALA O O 6.502 -7.730 -0.098 1.00 . B B . 12 ALA O 1 1 15 16657 2 2 13 ASP C C 6.379 -11.009 1.979 1.00 . B B . 13 ASP C 1 1 15 16658 2 2 13 ASP CA C 5.635 -9.749 1.554 1.00 . B B . 13 ASP CA 1 1 15 16659 2 2 13 ASP CB C 4.274 -9.682 2.249 1.00 . B B . 13 ASP CB 1 1 15 16660 2 2 13 ASP CG C 3.373 -10.841 1.865 1.00 . B B . 13 ASP CG 1 1 15 16661 2 2 13 ASP H H 5.017 -10.447 -0.349 1.00 . B B . 13 ASP H 1 1 15 16662 2 2 13 ASP HA H 6.218 -8.888 1.845 1.00 . B B . 13 ASP HA 1 1 15 16663 2 2 13 ASP HB2 H 4.421 -9.704 3.319 1.00 . B B . 13 ASP HB2 1 1 15 16664 2 2 13 ASP HB3 H 3.783 -8.759 1.975 1.00 . B B . 13 ASP HB3 1 1 15 16665 2 2 13 ASP N N 5.471 -9.707 0.105 1.00 . B B . 13 ASP N 1 1 15 16666 2 2 13 ASP O O 5.961 -11.711 2.899 1.00 . B B . 13 ASP O 1 1 15 16667 2 2 13 ASP OD1 O 2.727 -10.764 0.799 1.00 . B B . 13 ASP OD1 1 1 15 16668 2 2 13 ASP OD2 O 3.317 -11.827 2.629 1.00 . B B . 13 ASP OD2 1 1 15 16669 2 2 14 SER C C 7.521 -13.743 1.327 1.00 . B B . 14 SER C 1 1 15 16670 2 2 14 SER CA C 8.296 -12.458 1.601 1.00 . B B . 14 SER CA 1 1 15 16671 2 2 14 SER CB C 8.756 -12.427 3.058 1.00 . B B . 14 SER CB 1 1 15 16672 2 2 14 SER H H 7.764 -10.686 0.576 1.00 . B B . 14 SER H 1 1 15 16673 2 2 14 SER HA H 9.164 -12.431 0.959 1.00 . B B . 14 SER HA 1 1 15 16674 2 2 14 SER HB2 H 7.891 -12.407 3.705 1.00 . B B . 14 SER HB2 1 1 15 16675 2 2 14 SER HB3 H 9.343 -13.309 3.268 1.00 . B B . 14 SER HB3 1 1 15 16676 2 2 14 SER HG H 10.448 -11.548 3.511 1.00 . B B . 14 SER HG 1 1 15 16677 2 2 14 SER N N 7.486 -11.286 1.300 1.00 . B B . 14 SER N 1 1 15 16678 2 2 14 SER O O 6.826 -14.221 2.248 1.00 . B B . 14 SER O 1 1 15 16679 2 2 14 SER OXT O 7.615 -14.261 0.194 1.00 . B B . 14 SER OXT 1 1 15 16680 2 2 14 SER OG O 9.545 -11.280 3.321 1.00 . B B . 14 SER OG 1 1 16 16681 1 1 1 GLY C C 13.532 7.185 -2.549 1.00 . A A . 1 GLY C 1 1 16 16682 1 1 1 GLY CA C 13.139 7.918 -3.818 1.00 . A A . 1 GLY CA 1 1 16 16683 1 1 1 GLY H1 H 11.289 8.677 -3.213 1.00 . A A . 1 GLY H1 1 1 16 16684 1 1 1 GLY H2 H 11.203 7.135 -3.902 1.00 . A A . 1 GLY H2 1 1 16 16685 1 1 1 GLY H3 H 11.438 8.489 -4.887 1.00 . A A . 1 GLY H3 1 1 16 16686 1 1 1 GLY HA2 H 13.520 7.372 -4.668 1.00 . A A . 1 GLY HA2 1 1 16 16687 1 1 1 GLY HA3 H 13.587 8.900 -3.805 1.00 . A A . 1 GLY HA3 1 1 16 16688 1 1 1 GLY N N 11.665 8.065 -3.966 1.00 . A A . 1 GLY N 1 1 16 16689 1 1 1 GLY O O 14.665 6.723 -2.418 1.00 . A A . 1 GLY O 1 1 16 16690 1 1 2 SER C C 11.554 6.148 0.401 1.00 . A A . 2 SER C 1 1 16 16691 1 1 2 SER CA C 12.857 6.396 -0.348 1.00 . A A . 2 SER CA 1 1 16 16692 1 1 2 SER CB C 13.809 7.225 0.514 1.00 . A A . 2 SER CB 1 1 16 16693 1 1 2 SER H H 11.712 7.468 -1.765 1.00 . A A . 2 SER H 1 1 16 16694 1 1 2 SER HA H 13.317 5.447 -0.573 1.00 . A A . 2 SER HA 1 1 16 16695 1 1 2 SER HB2 H 13.934 6.747 1.473 1.00 . A A . 2 SER HB2 1 1 16 16696 1 1 2 SER HB3 H 14.767 7.297 0.019 1.00 . A A . 2 SER HB3 1 1 16 16697 1 1 2 SER HG H 13.711 9.137 0.097 1.00 . A A . 2 SER HG 1 1 16 16698 1 1 2 SER N N 12.597 7.078 -1.609 1.00 . A A . 2 SER N 1 1 16 16699 1 1 2 SER O O 11.247 5.020 0.786 1.00 . A A . 2 SER O 1 1 16 16700 1 1 2 SER OG O 13.303 8.533 0.720 1.00 . A A . 2 SER OG 1 1 16 16701 1 1 3 GLN C C 8.376 7.254 0.291 1.00 . A A . 3 GLN C 1 1 16 16702 1 1 3 GLN CA C 9.517 7.134 1.294 1.00 . A A . 3 GLN CA 1 1 16 16703 1 1 3 GLN CB C 9.422 8.239 2.334 1.00 . A A . 3 GLN CB 1 1 16 16704 1 1 3 GLN CD C 7.953 9.526 3.932 1.00 . A A . 3 GLN CD 1 1 16 16705 1 1 3 GLN CG C 8.071 8.322 3.020 1.00 . A A . 3 GLN CG 1 1 16 16706 1 1 3 GLN H H 11.101 8.088 0.274 1.00 . A A . 3 GLN H 1 1 16 16707 1 1 3 GLN HA H 9.461 6.182 1.785 1.00 . A A . 3 GLN HA 1 1 16 16708 1 1 3 GLN HB2 H 10.176 8.072 3.089 1.00 . A A . 3 GLN HB2 1 1 16 16709 1 1 3 GLN HB3 H 9.615 9.174 1.848 1.00 . A A . 3 GLN HB3 1 1 16 16710 1 1 3 GLN HE21 H 7.213 10.616 2.443 1.00 . A A . 3 GLN HE21 1 1 16 16711 1 1 3 GLN HE22 H 7.380 11.431 3.958 1.00 . A A . 3 GLN HE22 1 1 16 16712 1 1 3 GLN HG2 H 7.299 8.384 2.265 1.00 . A A . 3 GLN HG2 1 1 16 16713 1 1 3 GLN HG3 H 7.928 7.428 3.607 1.00 . A A . 3 GLN HG3 1 1 16 16714 1 1 3 GLN N N 10.794 7.217 0.603 1.00 . A A . 3 GLN N 1 1 16 16715 1 1 3 GLN NE2 N 7.466 10.637 3.390 1.00 . A A . 3 GLN NE2 1 1 16 16716 1 1 3 GLN O O 8.128 8.332 -0.247 1.00 . A A . 3 GLN O 1 1 16 16717 1 1 3 GLN OE1 O 8.293 9.461 5.113 1.00 . A A . 3 GLN OE1 1 1 16 16718 1 1 4 VAL C C 5.418 5.279 -0.509 1.00 . A A . 4 VAL C 1 1 16 16719 1 1 4 VAL CA C 6.593 6.158 -0.927 1.00 . A A . 4 VAL CA 1 1 16 16720 1 1 4 VAL CB C 7.094 5.686 -2.306 1.00 . A A . 4 VAL CB 1 1 16 16721 1 1 4 VAL CG1 C 5.972 5.727 -3.333 1.00 . A A . 4 VAL CG1 1 1 16 16722 1 1 4 VAL CG2 C 8.276 6.529 -2.762 1.00 . A A . 4 VAL CG2 1 1 16 16723 1 1 4 VAL H H 7.901 5.321 0.514 1.00 . A A . 4 VAL H 1 1 16 16724 1 1 4 VAL HA H 6.246 7.171 -1.028 1.00 . A A . 4 VAL HA 1 1 16 16725 1 1 4 VAL HB H 7.429 4.660 -2.210 1.00 . A A . 4 VAL HB 1 1 16 16726 1 1 4 VAL HG11 H 5.165 5.087 -3.011 1.00 . A A . 4 VAL HG11 1 1 16 16727 1 1 4 VAL HG12 H 6.345 5.383 -4.287 1.00 . A A . 4 VAL HG12 1 1 16 16728 1 1 4 VAL HG13 H 5.611 6.741 -3.431 1.00 . A A . 4 VAL HG13 1 1 16 16729 1 1 4 VAL HG21 H 9.090 6.416 -2.061 1.00 . A A . 4 VAL HG21 1 1 16 16730 1 1 4 VAL HG22 H 7.981 7.567 -2.807 1.00 . A A . 4 VAL HG22 1 1 16 16731 1 1 4 VAL HG23 H 8.595 6.201 -3.740 1.00 . A A . 4 VAL HG23 1 1 16 16732 1 1 4 VAL N N 7.680 6.150 0.042 1.00 . A A . 4 VAL N 1 1 16 16733 1 1 4 VAL O O 4.286 5.750 -0.402 1.00 . A A . 4 VAL O 1 1 16 16734 1 1 5 PHE C C 3.745 2.833 -1.133 1.00 . A A . 5 PHE C 1 1 16 16735 1 1 5 PHE CA C 4.647 3.050 0.083 1.00 . A A . 5 PHE CA 1 1 16 16736 1 1 5 PHE CB C 3.815 3.537 1.280 1.00 . A A . 5 PHE CB 1 1 16 16737 1 1 5 PHE CD1 C 5.664 4.236 2.828 1.00 . A A . 5 PHE CD1 1 1 16 16738 1 1 5 PHE CD2 C 3.953 5.815 2.314 1.00 . A A . 5 PHE CD2 1 1 16 16739 1 1 5 PHE CE1 C 6.281 5.168 3.642 1.00 . A A . 5 PHE CE1 1 1 16 16740 1 1 5 PHE CE2 C 4.563 6.748 3.127 1.00 . A A . 5 PHE CE2 1 1 16 16741 1 1 5 PHE CG C 4.496 4.550 2.155 1.00 . A A . 5 PHE CG 1 1 16 16742 1 1 5 PHE CZ C 5.728 6.424 3.793 1.00 . A A . 5 PHE CZ 1 1 16 16743 1 1 5 PHE H H 6.620 3.697 -0.345 1.00 . A A . 5 PHE H 1 1 16 16744 1 1 5 PHE HA H 5.125 2.110 0.341 1.00 . A A . 5 PHE HA 1 1 16 16745 1 1 5 PHE HB2 H 2.903 3.979 0.922 1.00 . A A . 5 PHE HB2 1 1 16 16746 1 1 5 PHE HB3 H 3.570 2.687 1.893 1.00 . A A . 5 PHE HB3 1 1 16 16747 1 1 5 PHE HD1 H 6.097 3.253 2.710 1.00 . A A . 5 PHE HD1 1 1 16 16748 1 1 5 PHE HD2 H 3.041 6.068 1.793 1.00 . A A . 5 PHE HD2 1 1 16 16749 1 1 5 PHE HE1 H 7.193 4.912 4.161 1.00 . A A . 5 PHE HE1 1 1 16 16750 1 1 5 PHE HE2 H 4.129 7.731 3.242 1.00 . A A . 5 PHE HE2 1 1 16 16751 1 1 5 PHE HZ H 6.205 7.152 4.431 1.00 . A A . 5 PHE HZ 1 1 16 16752 1 1 5 PHE N N 5.693 4.004 -0.275 1.00 . A A . 5 PHE N 1 1 16 16753 1 1 5 PHE O O 4.164 3.082 -2.264 1.00 . A A . 5 PHE O 1 1 16 16754 1 1 6 GLU C C 0.144 2.269 -1.610 1.00 . A A . 6 GLU C 1 1 16 16755 1 1 6 GLU CA C 1.596 2.135 -2.028 1.00 . A A . 6 GLU CA 1 1 16 16756 1 1 6 GLU CB C 1.814 0.749 -2.627 1.00 . A A . 6 GLU CB 1 1 16 16757 1 1 6 GLU CD C 3.278 -0.715 -4.067 1.00 . A A . 6 GLU CD 1 1 16 16758 1 1 6 GLU CG C 2.977 0.694 -3.596 1.00 . A A . 6 GLU CG 1 1 16 16759 1 1 6 GLU H H 2.209 2.231 0.005 1.00 . A A . 6 GLU H 1 1 16 16760 1 1 6 GLU HA H 1.803 2.875 -2.787 1.00 . A A . 6 GLU HA 1 1 16 16761 1 1 6 GLU HB2 H 1.995 0.047 -1.829 1.00 . A A . 6 GLU HB2 1 1 16 16762 1 1 6 GLU HB3 H 0.920 0.455 -3.156 1.00 . A A . 6 GLU HB3 1 1 16 16763 1 1 6 GLU HG2 H 2.735 1.302 -4.454 1.00 . A A . 6 GLU HG2 1 1 16 16764 1 1 6 GLU HG3 H 3.853 1.092 -3.108 1.00 . A A . 6 GLU HG3 1 1 16 16765 1 1 6 GLU N N 2.515 2.376 -0.915 1.00 . A A . 6 GLU N 1 1 16 16766 1 1 6 GLU O O -0.217 1.957 -0.477 1.00 . A A . 6 GLU O 1 1 16 16767 1 1 6 GLU OE1 O 2.387 -1.339 -4.681 1.00 . A A . 6 GLU OE1 1 1 16 16768 1 1 6 GLU OE2 O 4.405 -1.195 -3.821 1.00 . A A . 6 GLU OE2 1 1 16 16769 1 1 7 TYR C C -2.888 1.716 -2.864 1.00 . A A . 7 TYR C 1 1 16 16770 1 1 7 TYR CA C -2.099 2.869 -2.273 1.00 . A A . 7 TYR CA 1 1 16 16771 1 1 7 TYR CB C -2.597 4.206 -2.812 1.00 . A A . 7 TYR CB 1 1 16 16772 1 1 7 TYR CD1 C -3.037 4.032 -5.292 1.00 . A A . 7 TYR CD1 1 1 16 16773 1 1 7 TYR CD2 C -1.054 5.144 -4.575 1.00 . A A . 7 TYR CD2 1 1 16 16774 1 1 7 TYR CE1 C -2.698 4.270 -6.610 1.00 . A A . 7 TYR CE1 1 1 16 16775 1 1 7 TYR CE2 C -0.709 5.386 -5.891 1.00 . A A . 7 TYR CE2 1 1 16 16776 1 1 7 TYR CG C -2.222 4.463 -4.253 1.00 . A A . 7 TYR CG 1 1 16 16777 1 1 7 TYR CZ C -1.533 4.948 -6.904 1.00 . A A . 7 TYR CZ 1 1 16 16778 1 1 7 TYR H H -0.349 2.970 -3.418 1.00 . A A . 7 TYR H 1 1 16 16779 1 1 7 TYR HA H -2.231 2.846 -1.215 1.00 . A A . 7 TYR HA 1 1 16 16780 1 1 7 TYR HB2 H -3.664 4.228 -2.738 1.00 . A A . 7 TYR HB2 1 1 16 16781 1 1 7 TYR HB3 H -2.182 5.003 -2.213 1.00 . A A . 7 TYR HB3 1 1 16 16782 1 1 7 TYR HD1 H -3.947 3.502 -5.059 1.00 . A A . 7 TYR HD1 1 1 16 16783 1 1 7 TYR HD2 H -0.409 5.486 -3.778 1.00 . A A . 7 TYR HD2 1 1 16 16784 1 1 7 TYR HE1 H -3.345 3.926 -7.405 1.00 . A A . 7 TYR HE1 1 1 16 16785 1 1 7 TYR HE2 H 0.204 5.917 -6.120 1.00 . A A . 7 TYR HE2 1 1 16 16786 1 1 7 TYR HH H -0.255 5.026 -8.339 1.00 . A A . 7 TYR HH 1 1 16 16787 1 1 7 TYR N N -0.690 2.719 -2.539 1.00 . A A . 7 TYR N 1 1 16 16788 1 1 7 TYR O O -3.143 1.661 -4.066 1.00 . A A . 7 TYR O 1 1 16 16789 1 1 7 TYR OH O -1.193 5.189 -8.216 1.00 . A A . 7 TYR OH 1 1 16 16790 1 1 8 ALA C C -5.529 -0.073 -2.362 1.00 . A A . 8 ALA C 1 1 16 16791 1 1 8 ALA CA C -4.039 -0.371 -2.409 1.00 . A A . 8 ALA CA 1 1 16 16792 1 1 8 ALA CB C -3.705 -1.562 -1.522 1.00 . A A . 8 ALA CB 1 1 16 16793 1 1 8 ALA H H -3.054 0.913 -1.046 1.00 . A A . 8 ALA H 1 1 16 16794 1 1 8 ALA HA H -3.758 -0.614 -3.423 1.00 . A A . 8 ALA HA 1 1 16 16795 1 1 8 ALA HB1 H -2.778 -2.008 -1.851 1.00 . A A . 8 ALA HB1 1 1 16 16796 1 1 8 ALA HB2 H -4.496 -2.292 -1.587 1.00 . A A . 8 ALA HB2 1 1 16 16797 1 1 8 ALA HB3 H -3.602 -1.237 -0.494 1.00 . A A . 8 ALA HB3 1 1 16 16798 1 1 8 ALA N N -3.278 0.796 -1.995 1.00 . A A . 8 ALA N 1 1 16 16799 1 1 8 ALA O O -6.300 -0.803 -1.739 1.00 . A A . 8 ALA O 1 1 16 16800 1 1 9 GLU C C -7.891 1.350 -4.447 1.00 . A A . 9 GLU C 1 1 16 16801 1 1 9 GLU CA C -7.322 1.401 -3.052 1.00 . A A . 9 GLU CA 1 1 16 16802 1 1 9 GLU CB C -7.464 2.787 -2.421 1.00 . A A . 9 GLU CB 1 1 16 16803 1 1 9 GLU CD C -6.247 4.097 -4.221 1.00 . A A . 9 GLU CD 1 1 16 16804 1 1 9 GLU CG C -7.509 3.959 -3.393 1.00 . A A . 9 GLU CG 1 1 16 16805 1 1 9 GLU H H -5.276 1.551 -3.507 1.00 . A A . 9 GLU H 1 1 16 16806 1 1 9 GLU HA H -7.874 0.699 -2.463 1.00 . A A . 9 GLU HA 1 1 16 16807 1 1 9 GLU HB2 H -8.362 2.810 -1.841 1.00 . A A . 9 GLU HB2 1 1 16 16808 1 1 9 GLU HB3 H -6.626 2.934 -1.762 1.00 . A A . 9 GLU HB3 1 1 16 16809 1 1 9 GLU HG2 H -8.345 3.820 -4.058 1.00 . A A . 9 GLU HG2 1 1 16 16810 1 1 9 GLU HG3 H -7.652 4.863 -2.828 1.00 . A A . 9 GLU HG3 1 1 16 16811 1 1 9 GLU N N -5.931 1.004 -3.029 1.00 . A A . 9 GLU N 1 1 16 16812 1 1 9 GLU O O -7.166 1.211 -5.432 1.00 . A A . 9 GLU O 1 1 16 16813 1 1 9 GLU OE1 O -6.120 3.380 -5.235 1.00 . A A . 9 GLU OE1 1 1 16 16814 1 1 9 GLU OE2 O -5.390 4.930 -3.859 1.00 . A A . 9 GLU OE2 1 1 16 16815 1 1 10 VAL C C -10.383 2.757 -6.232 1.00 . A A . 10 VAL C 1 1 16 16816 1 1 10 VAL CA C -9.874 1.395 -5.785 1.00 . A A . 10 VAL CA 1 1 16 16817 1 1 10 VAL CB C -11.014 0.380 -5.751 1.00 . A A . 10 VAL CB 1 1 16 16818 1 1 10 VAL CG1 C -11.538 0.117 -7.154 1.00 . A A . 10 VAL CG1 1 1 16 16819 1 1 10 VAL CG2 C -10.548 -0.907 -5.083 1.00 . A A . 10 VAL CG2 1 1 16 16820 1 1 10 VAL H H -9.734 1.550 -3.702 1.00 . A A . 10 VAL H 1 1 16 16821 1 1 10 VAL HA H -9.164 1.062 -6.486 1.00 . A A . 10 VAL HA 1 1 16 16822 1 1 10 VAL HB H -11.802 0.792 -5.161 1.00 . A A . 10 VAL HB 1 1 16 16823 1 1 10 VAL HG11 H -10.791 -0.416 -7.722 1.00 . A A . 10 VAL HG11 1 1 16 16824 1 1 10 VAL HG12 H -11.754 1.057 -7.638 1.00 . A A . 10 VAL HG12 1 1 16 16825 1 1 10 VAL HG13 H -12.439 -0.475 -7.100 1.00 . A A . 10 VAL HG13 1 1 16 16826 1 1 10 VAL HG21 H -10.326 -0.712 -4.042 1.00 . A A . 10 VAL HG21 1 1 16 16827 1 1 10 VAL HG22 H -9.658 -1.267 -5.578 1.00 . A A . 10 VAL HG22 1 1 16 16828 1 1 10 VAL HG23 H -11.323 -1.654 -5.152 1.00 . A A . 10 VAL HG23 1 1 16 16829 1 1 10 VAL N N -9.205 1.451 -4.520 1.00 . A A . 10 VAL N 1 1 16 16830 1 1 10 VAL O O -10.681 2.954 -7.408 1.00 . A A . 10 VAL O 1 1 16 16831 1 1 11 ASP C C -10.262 6.098 -4.760 1.00 . A A . 11 ASP C 1 1 16 16832 1 1 11 ASP CA C -10.929 5.038 -5.630 1.00 . A A . 11 ASP CA 1 1 16 16833 1 1 11 ASP CB C -12.446 5.123 -5.455 1.00 . A A . 11 ASP CB 1 1 16 16834 1 1 11 ASP CG C -13.023 6.401 -6.029 1.00 . A A . 11 ASP CG 1 1 16 16835 1 1 11 ASP H H -10.212 3.487 -4.382 1.00 . A A . 11 ASP H 1 1 16 16836 1 1 11 ASP HA H -10.685 5.232 -6.663 1.00 . A A . 11 ASP HA 1 1 16 16837 1 1 11 ASP HB2 H -12.910 4.286 -5.949 1.00 . A A . 11 ASP HB2 1 1 16 16838 1 1 11 ASP HB3 H -12.680 5.087 -4.401 1.00 . A A . 11 ASP HB3 1 1 16 16839 1 1 11 ASP N N -10.461 3.699 -5.303 1.00 . A A . 11 ASP N 1 1 16 16840 1 1 11 ASP O O -9.845 7.145 -5.254 1.00 . A A . 11 ASP O 1 1 16 16841 1 1 11 ASP OD1 O -13.322 6.426 -7.241 1.00 . A A . 11 ASP OD1 1 1 16 16842 1 1 11 ASP OD2 O -13.180 7.378 -5.265 1.00 . A A . 11 ASP OD2 1 1 16 16843 1 1 12 GLU C C -9.007 6.089 -1.297 1.00 . A A . 12 GLU C 1 1 16 16844 1 1 12 GLU CA C -9.590 6.784 -2.520 1.00 . A A . 12 GLU CA 1 1 16 16845 1 1 12 GLU CB C -10.662 7.782 -2.083 1.00 . A A . 12 GLU CB 1 1 16 16846 1 1 12 GLU CD C -10.000 9.698 -3.589 1.00 . A A . 12 GLU CD 1 1 16 16847 1 1 12 GLU CG C -11.097 8.733 -3.185 1.00 . A A . 12 GLU CG 1 1 16 16848 1 1 12 GLU H H -10.428 4.927 -3.146 1.00 . A A . 12 GLU H 1 1 16 16849 1 1 12 GLU HA H -8.801 7.318 -3.028 1.00 . A A . 12 GLU HA 1 1 16 16850 1 1 12 GLU HB2 H -11.530 7.234 -1.746 1.00 . A A . 12 GLU HB2 1 1 16 16851 1 1 12 GLU HB3 H -10.277 8.367 -1.262 1.00 . A A . 12 GLU HB3 1 1 16 16852 1 1 12 GLU HG2 H -11.381 8.154 -4.050 1.00 . A A . 12 GLU HG2 1 1 16 16853 1 1 12 GLU HG3 H -11.947 9.302 -2.838 1.00 . A A . 12 GLU HG3 1 1 16 16854 1 1 12 GLU N N -10.165 5.822 -3.464 1.00 . A A . 12 GLU N 1 1 16 16855 1 1 12 GLU O O -9.227 4.909 -1.094 1.00 . A A . 12 GLU O 1 1 16 16856 1 1 12 GLU OE1 O -9.881 10.765 -2.951 1.00 . A A . 12 GLU OE1 1 1 16 16857 1 1 12 GLU OE2 O -9.259 9.388 -4.546 1.00 . A A . 12 GLU OE2 1 1 16 16858 1 1 13 ILE C C -7.766 7.276 1.872 1.00 . A A . 13 ILE C 1 1 16 16859 1 1 13 ILE CA C -7.673 6.258 0.730 1.00 . A A . 13 ILE CA 1 1 16 16860 1 1 13 ILE CB C -6.192 5.841 0.528 1.00 . A A . 13 ILE CB 1 1 16 16861 1 1 13 ILE CD1 C -5.598 7.863 -0.884 1.00 . A A . 13 ILE CD1 1 1 16 16862 1 1 13 ILE CG1 C -5.296 7.071 0.370 1.00 . A A . 13 ILE CG1 1 1 16 16863 1 1 13 ILE CG2 C -6.071 4.967 -0.698 1.00 . A A . 13 ILE CG2 1 1 16 16864 1 1 13 ILE H H -8.078 7.760 -0.712 1.00 . A A . 13 ILE H 1 1 16 16865 1 1 13 ILE HA H -8.251 5.372 0.984 1.00 . A A . 13 ILE HA 1 1 16 16866 1 1 13 ILE HB H -5.863 5.258 1.387 1.00 . A A . 13 ILE HB 1 1 16 16867 1 1 13 ILE HD11 H -5.983 7.198 -1.646 1.00 . A A . 13 ILE HD11 1 1 16 16868 1 1 13 ILE HD12 H -4.695 8.334 -1.238 1.00 . A A . 13 ILE HD12 1 1 16 16869 1 1 13 ILE HD13 H -6.336 8.618 -0.661 1.00 . A A . 13 ILE HD13 1 1 16 16870 1 1 13 ILE HG12 H -5.436 7.723 1.218 1.00 . A A . 13 ILE HG12 1 1 16 16871 1 1 13 ILE HG13 H -4.264 6.756 0.325 1.00 . A A . 13 ILE HG13 1 1 16 16872 1 1 13 ILE HG21 H -7.053 4.694 -1.032 1.00 . A A . 13 ILE HG21 1 1 16 16873 1 1 13 ILE HG22 H -5.513 4.076 -0.452 1.00 . A A . 13 ILE HG22 1 1 16 16874 1 1 13 ILE HG23 H -5.560 5.508 -1.480 1.00 . A A . 13 ILE HG23 1 1 16 16875 1 1 13 ILE N N -8.253 6.823 -0.487 1.00 . A A . 13 ILE N 1 1 16 16876 1 1 13 ILE O O -8.439 8.299 1.746 1.00 . A A . 13 ILE O 1 1 16 16877 1 1 14 VAL C C -5.774 7.767 4.880 1.00 . A A . 14 VAL C 1 1 16 16878 1 1 14 VAL CA C -7.088 7.891 4.128 1.00 . A A . 14 VAL CA 1 1 16 16879 1 1 14 VAL CB C -8.265 7.607 5.085 1.00 . A A . 14 VAL CB 1 1 16 16880 1 1 14 VAL CG1 C -8.186 8.491 6.324 1.00 . A A . 14 VAL CG1 1 1 16 16881 1 1 14 VAL CG2 C -9.590 7.812 4.366 1.00 . A A . 14 VAL CG2 1 1 16 16882 1 1 14 VAL H H -6.578 6.158 3.024 1.00 . A A . 14 VAL H 1 1 16 16883 1 1 14 VAL HA H -7.183 8.901 3.760 1.00 . A A . 14 VAL HA 1 1 16 16884 1 1 14 VAL HB H -8.207 6.576 5.401 1.00 . A A . 14 VAL HB 1 1 16 16885 1 1 14 VAL HG11 H -9.011 8.262 6.983 1.00 . A A . 14 VAL HG11 1 1 16 16886 1 1 14 VAL HG12 H -8.237 9.529 6.030 1.00 . A A . 14 VAL HG12 1 1 16 16887 1 1 14 VAL HG13 H -7.254 8.308 6.837 1.00 . A A . 14 VAL HG13 1 1 16 16888 1 1 14 VAL HG21 H -10.403 7.684 5.066 1.00 . A A . 14 VAL HG21 1 1 16 16889 1 1 14 VAL HG22 H -9.683 7.089 3.571 1.00 . A A . 14 VAL HG22 1 1 16 16890 1 1 14 VAL HG23 H -9.625 8.810 3.952 1.00 . A A . 14 VAL HG23 1 1 16 16891 1 1 14 VAL N N -7.091 6.992 2.978 1.00 . A A . 14 VAL N 1 1 16 16892 1 1 14 VAL O O -5.036 8.740 5.035 1.00 . A A . 14 VAL O 1 1 16 16893 1 1 15 GLU C C -3.193 5.811 5.081 1.00 . A A . 15 GLU C 1 1 16 16894 1 1 15 GLU CA C -4.247 6.304 6.064 1.00 . A A . 15 GLU CA 1 1 16 16895 1 1 15 GLU CB C -4.467 5.271 7.169 1.00 . A A . 15 GLU CB 1 1 16 16896 1 1 15 GLU CD C -2.834 6.329 8.778 1.00 . A A . 15 GLU CD 1 1 16 16897 1 1 15 GLU CG C -3.251 5.063 8.055 1.00 . A A . 15 GLU CG 1 1 16 16898 1 1 15 GLU H H -6.129 5.830 5.207 1.00 . A A . 15 GLU H 1 1 16 16899 1 1 15 GLU HA H -3.915 7.233 6.503 1.00 . A A . 15 GLU HA 1 1 16 16900 1 1 15 GLU HB2 H -5.288 5.596 7.792 1.00 . A A . 15 GLU HB2 1 1 16 16901 1 1 15 GLU HB3 H -4.722 4.324 6.717 1.00 . A A . 15 GLU HB3 1 1 16 16902 1 1 15 GLU HG2 H -3.480 4.307 8.790 1.00 . A A . 15 GLU HG2 1 1 16 16903 1 1 15 GLU HG3 H -2.427 4.730 7.441 1.00 . A A . 15 GLU HG3 1 1 16 16904 1 1 15 GLU N N -5.489 6.563 5.349 1.00 . A A . 15 GLU N 1 1 16 16905 1 1 15 GLU O O -3.478 4.977 4.238 1.00 . A A . 15 GLU O 1 1 16 16906 1 1 15 GLU OE1 O -2.044 7.109 8.204 1.00 . A A . 15 GLU OE1 1 1 16 16907 1 1 15 GLU OE2 O -3.299 6.543 9.917 1.00 . A A . 15 GLU OE2 1 1 16 16908 1 1 16 LYS C C 0.456 6.069 4.928 1.00 . A A . 16 LYS C 1 1 16 16909 1 1 16 LYS CA C -0.915 5.937 4.262 1.00 . A A . 16 LYS CA 1 1 16 16910 1 1 16 LYS CB C -0.960 6.813 3.011 1.00 . A A . 16 LYS CB 1 1 16 16911 1 1 16 LYS CD C -1.208 9.127 2.050 1.00 . A A . 16 LYS CD 1 1 16 16912 1 1 16 LYS CE C 0.200 9.443 1.572 1.00 . A A . 16 LYS CE 1 1 16 16913 1 1 16 LYS CG C -1.195 8.285 3.316 1.00 . A A . 16 LYS CG 1 1 16 16914 1 1 16 LYS H H -1.805 7.014 5.861 1.00 . A A . 16 LYS H 1 1 16 16915 1 1 16 LYS HA H -1.090 4.901 3.980 1.00 . A A . 16 LYS HA 1 1 16 16916 1 1 16 LYS HB2 H -0.021 6.721 2.485 1.00 . A A . 16 LYS HB2 1 1 16 16917 1 1 16 LYS HB3 H -1.758 6.468 2.372 1.00 . A A . 16 LYS HB3 1 1 16 16918 1 1 16 LYS HD2 H -1.726 8.584 1.274 1.00 . A A . 16 LYS HD2 1 1 16 16919 1 1 16 LYS HD3 H -1.726 10.054 2.251 1.00 . A A . 16 LYS HD3 1 1 16 16920 1 1 16 LYS HE2 H 0.699 10.029 2.329 1.00 . A A . 16 LYS HE2 1 1 16 16921 1 1 16 LYS HE3 H 0.735 8.518 1.424 1.00 . A A . 16 LYS HE3 1 1 16 16922 1 1 16 LYS HG2 H -2.146 8.392 3.815 1.00 . A A . 16 LYS HG2 1 1 16 16923 1 1 16 LYS HG3 H -0.405 8.639 3.963 1.00 . A A . 16 LYS HG3 1 1 16 16924 1 1 16 LYS HZ1 H -0.275 11.129 0.434 1.00 . A A . 16 LYS HZ1 1 1 16 16925 1 1 16 LYS HZ2 H -0.321 9.678 -0.437 1.00 . A A . 16 LYS HZ2 1 1 16 16926 1 1 16 LYS HZ3 H 1.166 10.374 -0.029 1.00 . A A . 16 LYS HZ3 1 1 16 16927 1 1 16 LYS N N -1.984 6.341 5.174 1.00 . A A . 16 LYS N 1 1 16 16928 1 1 16 LYS NZ N 0.192 10.209 0.295 1.00 . A A . 16 LYS NZ 1 1 16 16929 1 1 16 LYS O O 1.069 7.135 4.882 1.00 . A A . 16 LYS O 1 1 16 16930 1 1 17 ARG C C 2.866 3.661 6.327 1.00 . A A . 17 ARG C 1 1 16 16931 1 1 17 ARG CA C 2.230 5.040 6.232 1.00 . A A . 17 ARG CA 1 1 16 16932 1 1 17 ARG CB C 2.067 5.631 7.634 1.00 . A A . 17 ARG CB 1 1 16 16933 1 1 17 ARG CD C 1.633 7.656 9.054 1.00 . A A . 17 ARG CD 1 1 16 16934 1 1 17 ARG CG C 1.698 7.105 7.639 1.00 . A A . 17 ARG CG 1 1 16 16935 1 1 17 ARG CZ C 1.389 9.833 10.172 1.00 . A A . 17 ARG CZ 1 1 16 16936 1 1 17 ARG H H 0.447 4.142 5.496 1.00 . A A . 17 ARG H 1 1 16 16937 1 1 17 ARG HA H 2.882 5.683 5.659 1.00 . A A . 17 ARG HA 1 1 16 16938 1 1 17 ARG HB2 H 1.291 5.087 8.152 1.00 . A A . 17 ARG HB2 1 1 16 16939 1 1 17 ARG HB3 H 2.997 5.512 8.171 1.00 . A A . 17 ARG HB3 1 1 16 16940 1 1 17 ARG HD2 H 0.861 7.130 9.596 1.00 . A A . 17 ARG HD2 1 1 16 16941 1 1 17 ARG HD3 H 2.586 7.489 9.535 1.00 . A A . 17 ARG HD3 1 1 16 16942 1 1 17 ARG HE H 1.086 9.509 8.227 1.00 . A A . 17 ARG HE 1 1 16 16943 1 1 17 ARG HG2 H 2.443 7.655 7.083 1.00 . A A . 17 ARG HG2 1 1 16 16944 1 1 17 ARG HG3 H 0.733 7.227 7.170 1.00 . A A . 17 ARG HG3 1 1 16 16945 1 1 17 ARG HH11 H 1.934 8.311 11.385 1.00 . A A . 17 ARG HH11 1 1 16 16946 1 1 17 ARG HH12 H 1.762 9.851 12.159 1.00 . A A . 17 ARG HH12 1 1 16 16947 1 1 17 ARG HH21 H 0.856 11.542 9.234 1.00 . A A . 17 ARG HH21 1 1 16 16948 1 1 17 ARG HH22 H 1.148 11.688 10.936 1.00 . A A . 17 ARG HH22 1 1 16 16949 1 1 17 ARG N N 0.938 4.994 5.547 1.00 . A A . 17 ARG N 1 1 16 16950 1 1 17 ARG NE N 1.336 9.086 9.075 1.00 . A A . 17 ARG NE 1 1 16 16951 1 1 17 ARG NH1 N 1.722 9.287 11.334 1.00 . A A . 17 ARG NH1 1 1 16 16952 1 1 17 ARG NH2 N 1.107 11.127 10.109 1.00 . A A . 17 ARG NH2 1 1 16 16953 1 1 17 ARG O O 2.620 2.933 7.289 1.00 . A A . 17 ARG O 1 1 16 16954 1 1 18 GLY C C 5.647 1.890 4.719 1.00 . A A . 18 GLY C 1 1 16 16955 1 1 18 GLY CA C 4.300 1.982 5.406 1.00 . A A . 18 GLY CA 1 1 16 16956 1 1 18 GLY H H 3.848 3.884 4.589 1.00 . A A . 18 GLY H 1 1 16 16957 1 1 18 GLY HA2 H 4.431 1.722 6.438 1.00 . A A . 18 GLY HA2 1 1 16 16958 1 1 18 GLY HA3 H 3.637 1.264 4.960 1.00 . A A . 18 GLY HA3 1 1 16 16959 1 1 18 GLY N N 3.678 3.287 5.345 1.00 . A A . 18 GLY N 1 1 16 16960 1 1 18 GLY O O 6.510 2.752 4.881 1.00 . A A . 18 GLY O 1 1 16 16961 1 1 19 LYS C C 6.870 0.782 1.739 1.00 . A A . 19 LYS C 1 1 16 16962 1 1 19 LYS CA C 7.045 0.536 3.239 1.00 . A A . 19 LYS CA 1 1 16 16963 1 1 19 LYS CB C 7.429 -0.915 3.516 1.00 . A A . 19 LYS CB 1 1 16 16964 1 1 19 LYS CD C 8.215 -2.630 5.141 1.00 . A A . 19 LYS CD 1 1 16 16965 1 1 19 LYS CE C 8.747 -2.902 6.539 1.00 . A A . 19 LYS CE 1 1 16 16966 1 1 19 LYS CG C 8.048 -1.146 4.880 1.00 . A A . 19 LYS CG 1 1 16 16967 1 1 19 LYS H H 5.066 0.185 3.868 1.00 . A A . 19 LYS H 1 1 16 16968 1 1 19 LYS HA H 7.810 1.173 3.608 1.00 . A A . 19 LYS HA 1 1 16 16969 1 1 19 LYS HB2 H 6.527 -1.509 3.455 1.00 . A A . 19 LYS HB2 1 1 16 16970 1 1 19 LYS HB3 H 8.121 -1.250 2.760 1.00 . A A . 19 LYS HB3 1 1 16 16971 1 1 19 LYS HD2 H 7.253 -3.108 5.032 1.00 . A A . 19 LYS HD2 1 1 16 16972 1 1 19 LYS HD3 H 8.904 -3.034 4.415 1.00 . A A . 19 LYS HD3 1 1 16 16973 1 1 19 LYS HE2 H 8.041 -2.518 7.260 1.00 . A A . 19 LYS HE2 1 1 16 16974 1 1 19 LYS HE3 H 8.848 -3.969 6.670 1.00 . A A . 19 LYS HE3 1 1 16 16975 1 1 19 LYS HG2 H 9.017 -0.669 4.915 1.00 . A A . 19 LYS HG2 1 1 16 16976 1 1 19 LYS HG3 H 7.404 -0.724 5.638 1.00 . A A . 19 LYS HG3 1 1 16 16977 1 1 19 LYS HZ1 H 9.994 -1.228 6.640 1.00 . A A . 19 LYS HZ1 1 1 16 16978 1 1 19 LYS HZ2 H 10.769 -2.629 6.093 1.00 . A A . 19 LYS HZ2 1 1 16 16979 1 1 19 LYS HZ3 H 10.401 -2.453 7.734 1.00 . A A . 19 LYS HZ3 1 1 16 16980 1 1 19 LYS N N 5.811 0.817 3.956 1.00 . A A . 19 LYS N 1 1 16 16981 1 1 19 LYS NZ N 10.070 -2.258 6.767 1.00 . A A . 19 LYS NZ 1 1 16 16982 1 1 19 LYS O O 7.098 1.885 1.242 1.00 . A A . 19 LYS O 1 1 16 16983 1 1 20 GLY C C 4.875 -0.814 -0.618 1.00 . A A . 20 GLY C 1 1 16 16984 1 1 20 GLY CA C 6.219 -0.204 -0.370 1.00 . A A . 20 GLY CA 1 1 16 16985 1 1 20 GLY H H 6.338 -1.102 1.498 1.00 . A A . 20 GLY H 1 1 16 16986 1 1 20 GLY HA2 H 6.230 0.819 -0.696 1.00 . A A . 20 GLY HA2 1 1 16 16987 1 1 20 GLY HA3 H 6.968 -0.772 -0.895 1.00 . A A . 20 GLY HA3 1 1 16 16988 1 1 20 GLY N N 6.473 -0.264 1.040 1.00 . A A . 20 GLY N 1 1 16 16989 1 1 20 GLY O O 4.061 -0.301 -1.376 1.00 . A A . 20 GLY O 1 1 16 16990 1 1 21 LYS C C 2.976 -3.059 1.424 1.00 . A A . 21 LYS C 1 1 16 16991 1 1 21 LYS CA C 3.424 -2.667 0.006 1.00 . A A . 21 LYS CA 1 1 16 16992 1 1 21 LYS CB C 3.552 -3.908 -0.878 1.00 . A A . 21 LYS CB 1 1 16 16993 1 1 21 LYS CD C 1.618 -3.892 -2.487 1.00 . A A . 21 LYS CD 1 1 16 16994 1 1 21 LYS CE C 0.812 -2.989 -1.568 1.00 . A A . 21 LYS CE 1 1 16 16995 1 1 21 LYS CG C 3.114 -3.675 -2.314 1.00 . A A . 21 LYS CG 1 1 16 16996 1 1 21 LYS H H 5.426 -2.313 0.553 1.00 . A A . 21 LYS H 1 1 16 16997 1 1 21 LYS HA H 2.684 -2.008 -0.418 1.00 . A A . 21 LYS HA 1 1 16 16998 1 1 21 LYS HB2 H 4.585 -4.221 -0.887 1.00 . A A . 21 LYS HB2 1 1 16 16999 1 1 21 LYS HB3 H 2.947 -4.699 -0.462 1.00 . A A . 21 LYS HB3 1 1 16 17000 1 1 21 LYS HD2 H 1.349 -3.678 -3.510 1.00 . A A . 21 LYS HD2 1 1 16 17001 1 1 21 LYS HD3 H 1.384 -4.921 -2.258 1.00 . A A . 21 LYS HD3 1 1 16 17002 1 1 21 LYS HE2 H 1.096 -3.192 -0.546 1.00 . A A . 21 LYS HE2 1 1 16 17003 1 1 21 LYS HE3 H 1.041 -1.960 -1.806 1.00 . A A . 21 LYS HE3 1 1 16 17004 1 1 21 LYS HG2 H 3.353 -2.659 -2.589 1.00 . A A . 21 LYS HG2 1 1 16 17005 1 1 21 LYS HG3 H 3.647 -4.358 -2.957 1.00 . A A . 21 LYS HG3 1 1 16 17006 1 1 21 LYS HZ1 H -0.879 -4.214 -1.589 1.00 . A A . 21 LYS HZ1 1 1 16 17007 1 1 21 LYS HZ2 H -0.967 -2.905 -2.660 1.00 . A A . 21 LYS HZ2 1 1 16 17008 1 1 21 LYS HZ3 H -1.167 -2.656 -0.998 1.00 . A A . 21 LYS HZ3 1 1 16 17009 1 1 21 LYS N N 4.677 -1.939 0.045 1.00 . A A . 21 LYS N 1 1 16 17010 1 1 21 LYS NZ N -0.653 -3.206 -1.715 1.00 . A A . 21 LYS NZ 1 1 16 17011 1 1 21 LYS O O 1.878 -3.578 1.605 1.00 . A A . 21 LYS O 1 1 16 17012 1 1 22 ASP C C 2.757 -1.967 4.487 1.00 . A A . 22 ASP C 1 1 16 17013 1 1 22 ASP CA C 3.506 -3.103 3.813 1.00 . A A . 22 ASP CA 1 1 16 17014 1 1 22 ASP CB C 4.782 -3.387 4.590 1.00 . A A . 22 ASP CB 1 1 16 17015 1 1 22 ASP CG C 4.510 -3.910 5.986 1.00 . A A . 22 ASP CG 1 1 16 17016 1 1 22 ASP H H 4.663 -2.358 2.247 1.00 . A A . 22 ASP H 1 1 16 17017 1 1 22 ASP HA H 2.897 -3.965 3.810 1.00 . A A . 22 ASP HA 1 1 16 17018 1 1 22 ASP HB2 H 5.370 -4.112 4.059 1.00 . A A . 22 ASP HB2 1 1 16 17019 1 1 22 ASP HB3 H 5.338 -2.475 4.670 1.00 . A A . 22 ASP HB3 1 1 16 17020 1 1 22 ASP N N 3.821 -2.784 2.432 1.00 . A A . 22 ASP N 1 1 16 17021 1 1 22 ASP O O 2.571 -1.958 5.702 1.00 . A A . 22 ASP O 1 1 16 17022 1 1 22 ASP OD1 O 4.371 -5.141 6.144 1.00 . A A . 22 ASP OD1 1 1 16 17023 1 1 22 ASP OD2 O 4.435 -3.088 6.924 1.00 . A A . 22 ASP OD2 1 1 16 17024 1 1 23 VAL C C 0.120 -0.123 4.176 1.00 . A A . 23 VAL C 1 1 16 17025 1 1 23 VAL CA C 1.616 0.136 4.169 1.00 . A A . 23 VAL CA 1 1 16 17026 1 1 23 VAL CB C 1.889 1.339 3.272 1.00 . A A . 23 VAL CB 1 1 16 17027 1 1 23 VAL CG1 C 1.412 1.052 1.858 1.00 . A A . 23 VAL CG1 1 1 16 17028 1 1 23 VAL CG2 C 1.224 2.576 3.835 1.00 . A A . 23 VAL CG2 1 1 16 17029 1 1 23 VAL H H 2.563 -1.055 2.746 1.00 . A A . 23 VAL H 1 1 16 17030 1 1 23 VAL HA H 1.948 0.367 5.167 1.00 . A A . 23 VAL HA 1 1 16 17031 1 1 23 VAL HB H 2.954 1.502 3.243 1.00 . A A . 23 VAL HB 1 1 16 17032 1 1 23 VAL HG11 H 2.254 0.750 1.252 1.00 . A A . 23 VAL HG11 1 1 16 17033 1 1 23 VAL HG12 H 0.966 1.940 1.442 1.00 . A A . 23 VAL HG12 1 1 16 17034 1 1 23 VAL HG13 H 0.681 0.258 1.874 1.00 . A A . 23 VAL HG13 1 1 16 17035 1 1 23 VAL HG21 H 0.193 2.608 3.514 1.00 . A A . 23 VAL HG21 1 1 16 17036 1 1 23 VAL HG22 H 1.739 3.456 3.481 1.00 . A A . 23 VAL HG22 1 1 16 17037 1 1 23 VAL HG23 H 1.265 2.539 4.911 1.00 . A A . 23 VAL HG23 1 1 16 17038 1 1 23 VAL N N 2.345 -1.008 3.687 1.00 . A A . 23 VAL N 1 1 16 17039 1 1 23 VAL O O -0.382 -0.963 3.431 1.00 . A A . 23 VAL O 1 1 16 17040 1 1 24 GLU C C -2.710 1.678 4.408 1.00 . A A . 24 GLU C 1 1 16 17041 1 1 24 GLU CA C -2.022 0.506 5.094 1.00 . A A . 24 GLU CA 1 1 16 17042 1 1 24 GLU CB C -2.450 0.436 6.559 1.00 . A A . 24 GLU CB 1 1 16 17043 1 1 24 GLU CD C -2.334 1.477 8.856 1.00 . A A . 24 GLU CD 1 1 16 17044 1 1 24 GLU CG C -1.951 1.602 7.395 1.00 . A A . 24 GLU CG 1 1 16 17045 1 1 24 GLU H H -0.121 1.324 5.509 1.00 . A A . 24 GLU H 1 1 16 17046 1 1 24 GLU HA H -2.305 -0.413 4.598 1.00 . A A . 24 GLU HA 1 1 16 17047 1 1 24 GLU HB2 H -3.529 0.425 6.603 1.00 . A A . 24 GLU HB2 1 1 16 17048 1 1 24 GLU HB3 H -2.072 -0.478 6.991 1.00 . A A . 24 GLU HB3 1 1 16 17049 1 1 24 GLU HG2 H -0.875 1.646 7.323 1.00 . A A . 24 GLU HG2 1 1 16 17050 1 1 24 GLU HG3 H -2.376 2.515 7.004 1.00 . A A . 24 GLU HG3 1 1 16 17051 1 1 24 GLU N N -0.582 0.640 4.986 1.00 . A A . 24 GLU N 1 1 16 17052 1 1 24 GLU O O -2.468 2.837 4.744 1.00 . A A . 24 GLU O 1 1 16 17053 1 1 24 GLU OE1 O -1.582 0.827 9.613 1.00 . A A . 24 GLU OE1 1 1 16 17054 1 1 24 GLU OE2 O -3.384 2.030 9.245 1.00 . A A . 24 GLU OE2 1 1 16 17055 1 1 25 TYR C C -5.779 2.062 2.711 1.00 . A A . 25 TYR C 1 1 16 17056 1 1 25 TYR CA C -4.291 2.376 2.705 1.00 . A A . 25 TYR CA 1 1 16 17057 1 1 25 TYR CB C -3.776 2.450 1.270 1.00 . A A . 25 TYR CB 1 1 16 17058 1 1 25 TYR CD1 C -1.365 3.145 1.607 1.00 . A A . 25 TYR CD1 1 1 16 17059 1 1 25 TYR CD2 C -2.786 4.581 0.343 1.00 . A A . 25 TYR CD2 1 1 16 17060 1 1 25 TYR CE1 C -0.309 4.019 1.410 1.00 . A A . 25 TYR CE1 1 1 16 17061 1 1 25 TYR CE2 C -1.735 5.452 0.138 1.00 . A A . 25 TYR CE2 1 1 16 17062 1 1 25 TYR CG C -2.622 3.412 1.078 1.00 . A A . 25 TYR CG 1 1 16 17063 1 1 25 TYR CZ C -0.500 5.166 0.673 1.00 . A A . 25 TYR CZ 1 1 16 17064 1 1 25 TYR H H -3.723 0.431 3.240 1.00 . A A . 25 TYR H 1 1 16 17065 1 1 25 TYR HA H -4.126 3.324 3.182 1.00 . A A . 25 TYR HA 1 1 16 17066 1 1 25 TYR HB2 H -3.442 1.468 0.968 1.00 . A A . 25 TYR HB2 1 1 16 17067 1 1 25 TYR HB3 H -4.581 2.764 0.623 1.00 . A A . 25 TYR HB3 1 1 16 17068 1 1 25 TYR HD1 H -1.218 2.244 2.185 1.00 . A A . 25 TYR HD1 1 1 16 17069 1 1 25 TYR HD2 H -3.752 4.803 -0.075 1.00 . A A . 25 TYR HD2 1 1 16 17070 1 1 25 TYR HE1 H 0.661 3.799 1.827 1.00 . A A . 25 TYR HE1 1 1 16 17071 1 1 25 TYR HE2 H -1.885 6.354 -0.436 1.00 . A A . 25 TYR HE2 1 1 16 17072 1 1 25 TYR HH H 0.223 6.930 0.445 1.00 . A A . 25 TYR HH 1 1 16 17073 1 1 25 TYR N N -3.565 1.368 3.447 1.00 . A A . 25 TYR N 1 1 16 17074 1 1 25 TYR O O -6.173 0.903 2.683 1.00 . A A . 25 TYR O 1 1 16 17075 1 1 25 TYR OH O 0.550 6.030 0.468 1.00 . A A . 25 TYR OH 1 1 16 17076 1 1 26 LEU C C -8.541 2.855 1.327 1.00 . A A . 26 LEU C 1 1 16 17077 1 1 26 LEU CA C -8.035 2.932 2.742 1.00 . A A . 26 LEU CA 1 1 16 17078 1 1 26 LEU CB C -8.698 4.110 3.464 1.00 . A A . 26 LEU CB 1 1 16 17079 1 1 26 LEU CD1 C -10.905 4.833 4.431 1.00 . A A . 26 LEU CD1 1 1 16 17080 1 1 26 LEU CD2 C -10.461 5.118 1.982 1.00 . A A . 26 LEU CD2 1 1 16 17081 1 1 26 LEU CG C -10.202 4.260 3.212 1.00 . A A . 26 LEU CG 1 1 16 17082 1 1 26 LEU H H -6.231 3.991 2.706 1.00 . A A . 26 LEU H 1 1 16 17083 1 1 26 LEU HA H -8.273 2.012 3.251 1.00 . A A . 26 LEU HA 1 1 16 17084 1 1 26 LEU HB2 H -8.538 3.993 4.524 1.00 . A A . 26 LEU HB2 1 1 16 17085 1 1 26 LEU HB3 H -8.211 5.018 3.144 1.00 . A A . 26 LEU HB3 1 1 16 17086 1 1 26 LEU HD11 H -10.262 5.551 4.914 1.00 . A A . 26 LEU HD11 1 1 16 17087 1 1 26 LEU HD12 H -11.136 4.034 5.121 1.00 . A A . 26 LEU HD12 1 1 16 17088 1 1 26 LEU HD13 H -11.820 5.317 4.124 1.00 . A A . 26 LEU HD13 1 1 16 17089 1 1 26 LEU HD21 H -10.273 4.534 1.092 1.00 . A A . 26 LEU HD21 1 1 16 17090 1 1 26 LEU HD22 H -9.811 5.976 1.995 1.00 . A A . 26 LEU HD22 1 1 16 17091 1 1 26 LEU HD23 H -11.490 5.446 1.984 1.00 . A A . 26 LEU HD23 1 1 16 17092 1 1 26 LEU HG H -10.610 3.290 3.019 1.00 . A A . 26 LEU HG 1 1 16 17093 1 1 26 LEU N N -6.597 3.097 2.728 1.00 . A A . 26 LEU N 1 1 16 17094 1 1 26 LEU O O -7.875 3.307 0.400 1.00 . A A . 26 LEU O 1 1 16 17095 1 1 27 VAL C C -11.748 2.358 -0.247 1.00 . A A . 27 VAL C 1 1 16 17096 1 1 27 VAL CA C -10.247 2.179 -0.181 1.00 . A A . 27 VAL CA 1 1 16 17097 1 1 27 VAL CB C -9.790 0.893 -0.924 1.00 . A A . 27 VAL CB 1 1 16 17098 1 1 27 VAL CG1 C -8.660 0.184 -0.191 1.00 . A A . 27 VAL CG1 1 1 16 17099 1 1 27 VAL CG2 C -10.925 -0.087 -1.228 1.00 . A A . 27 VAL CG2 1 1 16 17100 1 1 27 VAL H H -10.185 1.874 1.902 1.00 . A A . 27 VAL H 1 1 16 17101 1 1 27 VAL HA H -9.826 2.995 -0.732 1.00 . A A . 27 VAL HA 1 1 16 17102 1 1 27 VAL HB H -9.399 1.236 -1.854 1.00 . A A . 27 VAL HB 1 1 16 17103 1 1 27 VAL HG11 H -9.011 -0.154 0.773 1.00 . A A . 27 VAL HG11 1 1 16 17104 1 1 27 VAL HG12 H -7.835 0.869 -0.054 1.00 . A A . 27 VAL HG12 1 1 16 17105 1 1 27 VAL HG13 H -8.330 -0.664 -0.773 1.00 . A A . 27 VAL HG13 1 1 16 17106 1 1 27 VAL HG21 H -10.511 -1.021 -1.575 1.00 . A A . 27 VAL HG21 1 1 16 17107 1 1 27 VAL HG22 H -11.566 0.329 -1.991 1.00 . A A . 27 VAL HG22 1 1 16 17108 1 1 27 VAL HG23 H -11.500 -0.258 -0.334 1.00 . A A . 27 VAL HG23 1 1 16 17109 1 1 27 VAL N N -9.708 2.271 1.148 1.00 . A A . 27 VAL N 1 1 16 17110 1 1 27 VAL O O -12.523 1.552 0.268 1.00 . A A . 27 VAL O 1 1 16 17111 1 1 28 ARG C C -13.802 2.995 -2.424 1.00 . A A . 28 ARG C 1 1 16 17112 1 1 28 ARG CA C -13.525 3.711 -1.141 1.00 . A A . 28 ARG CA 1 1 16 17113 1 1 28 ARG CB C -13.798 5.201 -1.290 1.00 . A A . 28 ARG CB 1 1 16 17114 1 1 28 ARG CD C -13.651 7.497 -0.274 1.00 . A A . 28 ARG CD 1 1 16 17115 1 1 28 ARG CG C -13.202 6.047 -0.176 1.00 . A A . 28 ARG CG 1 1 16 17116 1 1 28 ARG CZ C -15.736 8.793 -0.138 1.00 . A A . 28 ARG CZ 1 1 16 17117 1 1 28 ARG H H -11.464 4.079 -1.191 1.00 . A A . 28 ARG H 1 1 16 17118 1 1 28 ARG HA H -14.127 3.282 -0.360 1.00 . A A . 28 ARG HA 1 1 16 17119 1 1 28 ARG HB2 H -13.380 5.526 -2.229 1.00 . A A . 28 ARG HB2 1 1 16 17120 1 1 28 ARG HB3 H -14.865 5.361 -1.305 1.00 . A A . 28 ARG HB3 1 1 16 17121 1 1 28 ARG HD2 H -13.219 8.049 0.547 1.00 . A A . 28 ARG HD2 1 1 16 17122 1 1 28 ARG HD3 H -13.296 7.906 -1.209 1.00 . A A . 28 ARG HD3 1 1 16 17123 1 1 28 ARG HE H -15.635 6.804 -0.247 1.00 . A A . 28 ARG HE 1 1 16 17124 1 1 28 ARG HG2 H -13.520 5.647 0.776 1.00 . A A . 28 ARG HG2 1 1 16 17125 1 1 28 ARG HG3 H -12.125 6.006 -0.243 1.00 . A A . 28 ARG HG3 1 1 16 17126 1 1 28 ARG HH11 H -14.043 9.897 -0.122 1.00 . A A . 28 ARG HH11 1 1 16 17127 1 1 28 ARG HH12 H -15.518 10.800 -0.033 1.00 . A A . 28 ARG HH12 1 1 16 17128 1 1 28 ARG HH21 H -17.587 7.981 -0.130 1.00 . A A . 28 ARG HH21 1 1 16 17129 1 1 28 ARG HH22 H -17.535 9.709 -0.035 1.00 . A A . 28 ARG HH22 1 1 16 17130 1 1 28 ARG N N -12.137 3.444 -0.882 1.00 . A A . 28 ARG N 1 1 16 17131 1 1 28 ARG NE N -15.103 7.626 -0.219 1.00 . A A . 28 ARG NE 1 1 16 17132 1 1 28 ARG NH1 N -15.042 9.923 -0.094 1.00 . A A . 28 ARG NH1 1 1 16 17133 1 1 28 ARG NH2 N -17.061 8.831 -0.099 1.00 . A A . 28 ARG NH2 1 1 16 17134 1 1 28 ARG O O -14.072 3.608 -3.457 1.00 . A A . 28 ARG O 1 1 16 17135 1 1 29 TRP C C -14.724 1.336 -4.532 1.00 . A A . 29 TRP C 1 1 16 17136 1 1 29 TRP CA C -13.862 0.757 -3.432 1.00 . A A . 29 TRP CA 1 1 16 17137 1 1 29 TRP CB C -14.468 -0.533 -2.922 1.00 . A A . 29 TRP CB 1 1 16 17138 1 1 29 TRP CD1 C -13.990 -1.679 -5.154 1.00 . A A . 29 TRP CD1 1 1 16 17139 1 1 29 TRP CD2 C -15.748 -2.523 -4.053 1.00 . A A . 29 TRP CD2 1 1 16 17140 1 1 29 TRP CE2 C -15.589 -3.233 -5.258 1.00 . A A . 29 TRP CE2 1 1 16 17141 1 1 29 TRP CE3 C -16.790 -2.880 -3.192 1.00 . A A . 29 TRP CE3 1 1 16 17142 1 1 29 TRP CG C -14.716 -1.533 -4.007 1.00 . A A . 29 TRP CG 1 1 16 17143 1 1 29 TRP CH2 C -17.447 -4.605 -4.764 1.00 . A A . 29 TRP CH2 1 1 16 17144 1 1 29 TRP CZ2 C -16.436 -4.276 -5.624 1.00 . A A . 29 TRP CZ2 1 1 16 17145 1 1 29 TRP CZ3 C -17.630 -3.917 -3.558 1.00 . A A . 29 TRP CZ3 1 1 16 17146 1 1 29 TRP H H -13.516 1.287 -1.446 1.00 . A A . 29 TRP H 1 1 16 17147 1 1 29 TRP HA H -12.885 0.545 -3.822 1.00 . A A . 29 TRP HA 1 1 16 17148 1 1 29 TRP HB2 H -13.797 -0.978 -2.200 1.00 . A A . 29 TRP HB2 1 1 16 17149 1 1 29 TRP HB3 H -15.403 -0.297 -2.444 1.00 . A A . 29 TRP HB3 1 1 16 17150 1 1 29 TRP HD1 H -13.133 -1.070 -5.414 1.00 . A A . 29 TRP HD1 1 1 16 17151 1 1 29 TRP HE1 H -14.165 -2.997 -6.781 1.00 . A A . 29 TRP HE1 1 1 16 17152 1 1 29 TRP HE3 H -16.947 -2.362 -2.258 1.00 . A A . 29 TRP HE3 1 1 16 17153 1 1 29 TRP HH2 H -18.127 -5.407 -5.010 1.00 . A A . 29 TRP HH2 1 1 16 17154 1 1 29 TRP HZ2 H -16.308 -4.817 -6.551 1.00 . A A . 29 TRP HZ2 1 1 16 17155 1 1 29 TRP HZ3 H -18.441 -4.206 -2.907 1.00 . A A . 29 TRP HZ3 1 1 16 17156 1 1 29 TRP N N -13.706 1.670 -2.322 1.00 . A A . 29 TRP N 1 1 16 17157 1 1 29 TRP NE1 N -14.511 -2.699 -5.914 1.00 . A A . 29 TRP NE1 1 1 16 17158 1 1 29 TRP O O -15.944 1.215 -4.514 1.00 . A A . 29 TRP O 1 1 16 17159 1 1 30 LYS C C -15.973 1.934 -7.046 1.00 . A A . 30 LYS C 1 1 16 17160 1 1 30 LYS CA C -14.694 2.661 -6.619 1.00 . A A . 30 LYS CA 1 1 16 17161 1 1 30 LYS CB C -13.734 2.713 -7.810 1.00 . A A . 30 LYS CB 1 1 16 17162 1 1 30 LYS CD C -13.267 3.584 -10.122 1.00 . A A . 30 LYS CD 1 1 16 17163 1 1 30 LYS CE C -13.802 4.398 -11.288 1.00 . A A . 30 LYS CE 1 1 16 17164 1 1 30 LYS CG C -14.290 3.473 -9.003 1.00 . A A . 30 LYS CG 1 1 16 17165 1 1 30 LYS H H -13.063 2.142 -5.312 1.00 . A A . 30 LYS H 1 1 16 17166 1 1 30 LYS HA H -14.949 3.671 -6.337 1.00 . A A . 30 LYS HA 1 1 16 17167 1 1 30 LYS HB2 H -12.820 3.188 -7.504 1.00 . A A . 30 LYS HB2 1 1 16 17168 1 1 30 LYS HB3 H -13.518 1.703 -8.125 1.00 . A A . 30 LYS HB3 1 1 16 17169 1 1 30 LYS HD2 H -12.378 4.064 -9.738 1.00 . A A . 30 LYS HD2 1 1 16 17170 1 1 30 LYS HD3 H -13.019 2.591 -10.469 1.00 . A A . 30 LYS HD3 1 1 16 17171 1 1 30 LYS HE2 H -14.676 3.905 -11.686 1.00 . A A . 30 LYS HE2 1 1 16 17172 1 1 30 LYS HE3 H -14.076 5.380 -10.929 1.00 . A A . 30 LYS HE3 1 1 16 17173 1 1 30 LYS HG2 H -15.160 2.953 -9.377 1.00 . A A . 30 LYS HG2 1 1 16 17174 1 1 30 LYS HG3 H -14.572 4.467 -8.685 1.00 . A A . 30 LYS HG3 1 1 16 17175 1 1 30 LYS HZ1 H -11.941 5.017 -12.009 1.00 . A A . 30 LYS HZ1 1 1 16 17176 1 1 30 LYS HZ2 H -13.186 5.111 -13.153 1.00 . A A . 30 LYS HZ2 1 1 16 17177 1 1 30 LYS HZ3 H -12.526 3.609 -12.741 1.00 . A A . 30 LYS HZ3 1 1 16 17178 1 1 30 LYS N N -14.044 2.022 -5.454 1.00 . A A . 30 LYS N 1 1 16 17179 1 1 30 LYS NZ N -12.793 4.544 -12.373 1.00 . A A . 30 LYS NZ 1 1 16 17180 1 1 30 LYS O O -16.945 2.564 -7.461 1.00 . A A . 30 LYS O 1 1 16 17181 1 1 31 ASP C C -17.724 -0.824 -6.041 1.00 . A A . 31 ASP C 1 1 16 17182 1 1 31 ASP CA C -17.120 -0.201 -7.295 1.00 . A A . 31 ASP CA 1 1 16 17183 1 1 31 ASP CB C -16.724 -1.297 -8.286 1.00 . A A . 31 ASP CB 1 1 16 17184 1 1 31 ASP CG C -16.134 -0.735 -9.564 1.00 . A A . 31 ASP CG 1 1 16 17185 1 1 31 ASP H H -15.147 0.165 -6.624 1.00 . A A . 31 ASP H 1 1 16 17186 1 1 31 ASP HA H -17.852 0.446 -7.755 1.00 . A A . 31 ASP HA 1 1 16 17187 1 1 31 ASP HB2 H -15.990 -1.941 -7.826 1.00 . A A . 31 ASP HB2 1 1 16 17188 1 1 31 ASP HB3 H -17.599 -1.878 -8.539 1.00 . A A . 31 ASP HB3 1 1 16 17189 1 1 31 ASP N N -15.960 0.610 -6.944 1.00 . A A . 31 ASP N 1 1 16 17190 1 1 31 ASP O O -17.883 -2.041 -5.952 1.00 . A A . 31 ASP O 1 1 16 17191 1 1 31 ASP OD1 O -16.911 -0.432 -10.493 1.00 . A A . 31 ASP OD1 1 1 16 17192 1 1 31 ASP OD2 O -14.895 -0.600 -9.636 1.00 . A A . 31 ASP OD2 1 1 16 17193 1 1 32 GLY C C -19.586 0.544 -3.201 1.00 . A A . 32 GLY C 1 1 16 17194 1 1 32 GLY CA C -18.626 -0.451 -3.824 1.00 . A A . 32 GLY CA 1 1 16 17195 1 1 32 GLY H H -17.921 0.985 -5.208 1.00 . A A . 32 GLY H 1 1 16 17196 1 1 32 GLY HA2 H -19.150 -1.378 -4.005 1.00 . A A . 32 GLY HA2 1 1 16 17197 1 1 32 GLY HA3 H -17.818 -0.633 -3.126 1.00 . A A . 32 GLY HA3 1 1 16 17198 1 1 32 GLY N N -18.060 0.024 -5.073 1.00 . A A . 32 GLY N 1 1 16 17199 1 1 32 GLY O O -20.126 1.413 -3.886 1.00 . A A . 32 GLY O 1 1 16 17200 1 1 33 GLY C C -20.267 1.537 0.246 1.00 . A A . 33 GLY C 1 1 16 17201 1 1 33 GLY CA C -20.692 1.311 -1.192 1.00 . A A . 33 GLY CA 1 1 16 17202 1 1 33 GLY H H -19.341 -0.303 -1.406 1.00 . A A . 33 GLY H 1 1 16 17203 1 1 33 GLY HA2 H -20.708 2.262 -1.705 1.00 . A A . 33 GLY HA2 1 1 16 17204 1 1 33 GLY HA3 H -21.688 0.894 -1.202 1.00 . A A . 33 GLY HA3 1 1 16 17205 1 1 33 GLY N N -19.798 0.412 -1.896 1.00 . A A . 33 GLY N 1 1 16 17206 1 1 33 GLY O O -21.076 1.930 1.086 1.00 . A A . 33 GLY O 1 1 16 17207 1 1 34 ASP C C -16.984 1.856 1.820 1.00 . A A . 34 ASP C 1 1 16 17208 1 1 34 ASP CA C -18.455 1.457 1.873 1.00 . A A . 34 ASP CA 1 1 16 17209 1 1 34 ASP CB C -18.617 0.168 2.679 1.00 . A A . 34 ASP CB 1 1 16 17210 1 1 34 ASP CG C -20.068 -0.251 2.816 1.00 . A A . 34 ASP CG 1 1 16 17211 1 1 34 ASP H H -18.397 0.972 -0.184 1.00 . A A . 34 ASP H 1 1 16 17212 1 1 34 ASP HA H -19.014 2.246 2.355 1.00 . A A . 34 ASP HA 1 1 16 17213 1 1 34 ASP HB2 H -18.078 -0.627 2.187 1.00 . A A . 34 ASP HB2 1 1 16 17214 1 1 34 ASP HB3 H -18.209 0.316 3.669 1.00 . A A . 34 ASP HB3 1 1 16 17215 1 1 34 ASP N N -18.993 1.283 0.529 1.00 . A A . 34 ASP N 1 1 16 17216 1 1 34 ASP O O -16.437 2.100 0.745 1.00 . A A . 34 ASP O 1 1 16 17217 1 1 34 ASP OD1 O -20.738 0.224 3.757 1.00 . A A . 34 ASP OD1 1 1 16 17218 1 1 34 ASP OD2 O -20.534 -1.054 1.980 1.00 . A A . 34 ASP OD2 1 1 16 17219 1 1 35 CYS C C -14.244 1.539 4.196 1.00 . A A . 35 CYS C 1 1 16 17220 1 1 35 CYS CA C -14.941 2.291 3.067 1.00 . A A . 35 CYS CA 1 1 16 17221 1 1 35 CYS CB C -14.803 3.798 3.281 1.00 . A A . 35 CYS CB 1 1 16 17222 1 1 35 CYS H H -16.839 1.714 3.809 1.00 . A A . 35 CYS H 1 1 16 17223 1 1 35 CYS HA H -14.474 2.025 2.130 1.00 . A A . 35 CYS HA 1 1 16 17224 1 1 35 CYS HB2 H -15.218 4.058 4.244 1.00 . A A . 35 CYS HB2 1 1 16 17225 1 1 35 CYS HB3 H -13.756 4.063 3.265 1.00 . A A . 35 CYS HB3 1 1 16 17226 1 1 35 CYS HG H -16.398 5.689 2.667 1.00 . A A . 35 CYS HG 1 1 16 17227 1 1 35 CYS N N -16.350 1.920 2.985 1.00 . A A . 35 CYS N 1 1 16 17228 1 1 35 CYS O O -14.780 1.416 5.297 1.00 . A A . 35 CYS O 1 1 16 17229 1 1 35 CYS SG S -15.644 4.802 2.035 1.00 . A A . 35 CYS SG 1 1 16 17230 1 1 36 GLU C C -10.773 0.478 4.665 1.00 . A A . 36 GLU C 1 1 16 17231 1 1 36 GLU CA C -12.269 0.302 4.906 1.00 . A A . 36 GLU CA 1 1 16 17232 1 1 36 GLU CB C -12.631 -1.183 4.870 1.00 . A A . 36 GLU CB 1 1 16 17233 1 1 36 GLU CD C -14.411 -2.944 5.206 1.00 . A A . 36 GLU CD 1 1 16 17234 1 1 36 GLU CG C -14.091 -1.462 5.190 1.00 . A A . 36 GLU CG 1 1 16 17235 1 1 36 GLU H H -12.671 1.169 3.018 1.00 . A A . 36 GLU H 1 1 16 17236 1 1 36 GLU HA H -12.514 0.700 5.880 1.00 . A A . 36 GLU HA 1 1 16 17237 1 1 36 GLU HB2 H -12.422 -1.569 3.884 1.00 . A A . 36 GLU HB2 1 1 16 17238 1 1 36 GLU HB3 H -12.021 -1.709 5.590 1.00 . A A . 36 GLU HB3 1 1 16 17239 1 1 36 GLU HG2 H -14.318 -1.051 6.163 1.00 . A A . 36 GLU HG2 1 1 16 17240 1 1 36 GLU HG3 H -14.707 -0.983 4.444 1.00 . A A . 36 GLU HG3 1 1 16 17241 1 1 36 GLU N N -13.044 1.040 3.915 1.00 . A A . 36 GLU N 1 1 16 17242 1 1 36 GLU O O -10.361 1.124 3.701 1.00 . A A . 36 GLU O 1 1 16 17243 1 1 36 GLU OE1 O -14.038 -3.622 6.186 1.00 . A A . 36 GLU OE1 1 1 16 17244 1 1 36 GLU OE2 O -15.032 -3.427 4.237 1.00 . A A . 36 GLU OE2 1 1 16 17245 1 1 37 TRP C C -7.927 -1.248 4.780 1.00 . A A . 37 TRP C 1 1 16 17246 1 1 37 TRP CA C -8.515 -0.004 5.436 1.00 . A A . 37 TRP CA 1 1 16 17247 1 1 37 TRP CB C -7.894 0.174 6.820 1.00 . A A . 37 TRP CB 1 1 16 17248 1 1 37 TRP CD1 C -8.842 2.545 7.010 1.00 . A A . 37 TRP CD1 1 1 16 17249 1 1 37 TRP CD2 C -8.558 1.512 8.976 1.00 . A A . 37 TRP CD2 1 1 16 17250 1 1 37 TRP CE2 C -9.080 2.797 9.216 1.00 . A A . 37 TRP CE2 1 1 16 17251 1 1 37 TRP CE3 C -8.296 0.677 10.065 1.00 . A A . 37 TRP CE3 1 1 16 17252 1 1 37 TRP CG C -8.414 1.371 7.557 1.00 . A A . 37 TRP CG 1 1 16 17253 1 1 37 TRP CH2 C -9.080 2.426 11.547 1.00 . A A . 37 TRP CH2 1 1 16 17254 1 1 37 TRP CZ2 C -9.345 3.265 10.500 1.00 . A A . 37 TRP CZ2 1 1 16 17255 1 1 37 TRP CZ3 C -8.560 1.143 11.339 1.00 . A A . 37 TRP CZ3 1 1 16 17256 1 1 37 TRP H H -10.351 -0.600 6.294 1.00 . A A . 37 TRP H 1 1 16 17257 1 1 37 TRP HA H -8.281 0.858 4.831 1.00 . A A . 37 TRP HA 1 1 16 17258 1 1 37 TRP HB2 H -8.102 -0.703 7.416 1.00 . A A . 37 TRP HB2 1 1 16 17259 1 1 37 TRP HB3 H -6.827 0.283 6.713 1.00 . A A . 37 TRP HB3 1 1 16 17260 1 1 37 TRP HD1 H -8.858 2.751 5.952 1.00 . A A . 37 TRP HD1 1 1 16 17261 1 1 37 TRP HE1 H -9.594 4.313 7.860 1.00 . A A . 37 TRP HE1 1 1 16 17262 1 1 37 TRP HE3 H -7.895 -0.316 9.923 1.00 . A A . 37 TRP HE3 1 1 16 17263 1 1 37 TRP HH2 H -9.271 2.749 12.561 1.00 . A A . 37 TRP HH2 1 1 16 17264 1 1 37 TRP HZ2 H -9.748 4.251 10.677 1.00 . A A . 37 TRP HZ2 1 1 16 17265 1 1 37 TRP HZ3 H -8.364 0.512 12.193 1.00 . A A . 37 TRP HZ3 1 1 16 17266 1 1 37 TRP N N -9.964 -0.099 5.548 1.00 . A A . 37 TRP N 1 1 16 17267 1 1 37 TRP NE1 N -9.245 3.408 8.001 1.00 . A A . 37 TRP NE1 1 1 16 17268 1 1 37 TRP O O -8.456 -2.349 4.929 1.00 . A A . 37 TRP O 1 1 16 17269 1 1 38 VAL C C -5.131 -2.783 4.344 1.00 . A A . 38 VAL C 1 1 16 17270 1 1 38 VAL CA C -6.157 -2.177 3.402 1.00 . A A . 38 VAL CA 1 1 16 17271 1 1 38 VAL CB C -5.452 -1.754 2.095 1.00 . A A . 38 VAL CB 1 1 16 17272 1 1 38 VAL CG1 C -4.686 -2.929 1.498 1.00 . A A . 38 VAL CG1 1 1 16 17273 1 1 38 VAL CG2 C -6.459 -1.218 1.093 1.00 . A A . 38 VAL CG2 1 1 16 17274 1 1 38 VAL H H -6.467 -0.155 3.953 1.00 . A A . 38 VAL H 1 1 16 17275 1 1 38 VAL HA H -6.902 -2.923 3.164 1.00 . A A . 38 VAL HA 1 1 16 17276 1 1 38 VAL HB H -4.747 -0.968 2.323 1.00 . A A . 38 VAL HB 1 1 16 17277 1 1 38 VAL HG11 H -4.383 -2.689 0.494 1.00 . A A . 38 VAL HG11 1 1 16 17278 1 1 38 VAL HG12 H -5.321 -3.801 1.482 1.00 . A A . 38 VAL HG12 1 1 16 17279 1 1 38 VAL HG13 H -3.812 -3.130 2.100 1.00 . A A . 38 VAL HG13 1 1 16 17280 1 1 38 VAL HG21 H -7.237 -0.683 1.616 1.00 . A A . 38 VAL HG21 1 1 16 17281 1 1 38 VAL HG22 H -6.893 -2.042 0.547 1.00 . A A . 38 VAL HG22 1 1 16 17282 1 1 38 VAL HG23 H -5.962 -0.551 0.404 1.00 . A A . 38 VAL HG23 1 1 16 17283 1 1 38 VAL N N -6.828 -1.063 4.055 1.00 . A A . 38 VAL N 1 1 16 17284 1 1 38 VAL O O -4.697 -2.142 5.303 1.00 . A A . 38 VAL O 1 1 16 17285 1 1 39 LYS C C -2.392 -4.100 4.795 1.00 . A A . 39 LYS C 1 1 16 17286 1 1 39 LYS CA C -3.781 -4.705 4.903 1.00 . A A . 39 LYS CA 1 1 16 17287 1 1 39 LYS CB C -3.741 -6.193 4.552 1.00 . A A . 39 LYS CB 1 1 16 17288 1 1 39 LYS CD C -2.834 -8.473 5.068 1.00 . A A . 39 LYS CD 1 1 16 17289 1 1 39 LYS CE C -1.821 -9.270 5.873 1.00 . A A . 39 LYS CE 1 1 16 17290 1 1 39 LYS CG C -2.755 -6.990 5.388 1.00 . A A . 39 LYS CG 1 1 16 17291 1 1 39 LYS H H -5.124 -4.479 3.293 1.00 . A A . 39 LYS H 1 1 16 17292 1 1 39 LYS HA H -4.110 -4.593 5.917 1.00 . A A . 39 LYS HA 1 1 16 17293 1 1 39 LYS HB2 H -4.725 -6.612 4.698 1.00 . A A . 39 LYS HB2 1 1 16 17294 1 1 39 LYS HB3 H -3.465 -6.298 3.512 1.00 . A A . 39 LYS HB3 1 1 16 17295 1 1 39 LYS HD2 H -3.825 -8.829 5.303 1.00 . A A . 39 LYS HD2 1 1 16 17296 1 1 39 LYS HD3 H -2.637 -8.615 4.016 1.00 . A A . 39 LYS HD3 1 1 16 17297 1 1 39 LYS HE2 H -0.828 -8.938 5.610 1.00 . A A . 39 LYS HE2 1 1 16 17298 1 1 39 LYS HE3 H -1.995 -9.091 6.924 1.00 . A A . 39 LYS HE3 1 1 16 17299 1 1 39 LYS HG2 H -1.755 -6.639 5.181 1.00 . A A . 39 LYS HG2 1 1 16 17300 1 1 39 LYS HG3 H -2.983 -6.842 6.433 1.00 . A A . 39 LYS HG3 1 1 16 17301 1 1 39 LYS HZ1 H -1.786 -10.920 4.593 1.00 . A A . 39 LYS HZ1 1 1 16 17302 1 1 39 LYS HZ2 H -2.870 -11.077 5.883 1.00 . A A . 39 LYS HZ2 1 1 16 17303 1 1 39 LYS HZ3 H -1.208 -11.248 6.148 1.00 . A A . 39 LYS HZ3 1 1 16 17304 1 1 39 LYS N N -4.744 -4.016 4.068 1.00 . A A . 39 LYS N 1 1 16 17305 1 1 39 LYS NZ N -1.928 -10.731 5.606 1.00 . A A . 39 LYS NZ 1 1 16 17306 1 1 39 LYS O O -1.679 -4.304 3.813 1.00 . A A . 39 LYS O 1 1 16 17307 1 1 40 GLY C C 0.326 -3.611 6.542 1.00 . A A . 40 GLY C 1 1 16 17308 1 1 40 GLY CA C -0.714 -2.733 5.874 1.00 . A A . 40 GLY CA 1 1 16 17309 1 1 40 GLY H H -2.654 -3.204 6.556 1.00 . A A . 40 GLY H 1 1 16 17310 1 1 40 GLY HA2 H -0.394 -2.532 4.867 1.00 . A A . 40 GLY HA2 1 1 16 17311 1 1 40 GLY HA3 H -0.785 -1.802 6.414 1.00 . A A . 40 GLY HA3 1 1 16 17312 1 1 40 GLY N N -2.021 -3.353 5.828 1.00 . A A . 40 GLY N 1 1 16 17313 1 1 40 GLY O O 1.177 -3.125 7.284 1.00 . A A . 40 GLY O 1 1 16 17314 1 1 41 VAL C C 1.992 -6.523 5.719 1.00 . A A . 41 VAL C 1 1 16 17315 1 1 41 VAL CA C 1.196 -5.862 6.841 1.00 . A A . 41 VAL CA 1 1 16 17316 1 1 41 VAL CB C 0.506 -6.967 7.659 1.00 . A A . 41 VAL CB 1 1 16 17317 1 1 41 VAL CG1 C 1.495 -7.620 8.612 1.00 . A A . 41 VAL CG1 1 1 16 17318 1 1 41 VAL CG2 C -0.693 -6.415 8.417 1.00 . A A . 41 VAL CG2 1 1 16 17319 1 1 41 VAL H H -0.480 -5.243 5.720 1.00 . A A . 41 VAL H 1 1 16 17320 1 1 41 VAL HA H 1.874 -5.326 7.488 1.00 . A A . 41 VAL HA 1 1 16 17321 1 1 41 VAL HB H 0.157 -7.724 6.972 1.00 . A A . 41 VAL HB 1 1 16 17322 1 1 41 VAL HG11 H 1.902 -6.872 9.277 1.00 . A A . 41 VAL HG11 1 1 16 17323 1 1 41 VAL HG12 H 2.295 -8.072 8.046 1.00 . A A . 41 VAL HG12 1 1 16 17324 1 1 41 VAL HG13 H 0.990 -8.379 9.191 1.00 . A A . 41 VAL HG13 1 1 16 17325 1 1 41 VAL HG21 H -1.168 -7.213 8.967 1.00 . A A . 41 VAL HG21 1 1 16 17326 1 1 41 VAL HG22 H -1.397 -5.991 7.717 1.00 . A A . 41 VAL HG22 1 1 16 17327 1 1 41 VAL HG23 H -0.363 -5.649 9.104 1.00 . A A . 41 VAL HG23 1 1 16 17328 1 1 41 VAL N N 0.242 -4.912 6.291 1.00 . A A . 41 VAL N 1 1 16 17329 1 1 41 VAL O O 2.804 -7.413 5.966 1.00 . A A . 41 VAL O 1 1 16 17330 1 1 42 HIS C C 3.896 -6.224 3.367 1.00 . A A . 42 HIS C 1 1 16 17331 1 1 42 HIS CA C 2.447 -6.635 3.336 1.00 . A A . 42 HIS CA 1 1 16 17332 1 1 42 HIS CB C 1.758 -6.199 2.042 1.00 . A A . 42 HIS CB 1 1 16 17333 1 1 42 HIS CD2 C 0.081 -8.154 1.748 1.00 . A A . 42 HIS CD2 1 1 16 17334 1 1 42 HIS CE1 C 0.596 -8.715 -0.307 1.00 . A A . 42 HIS CE1 1 1 16 17335 1 1 42 HIS CG C 1.066 -7.322 1.334 1.00 . A A . 42 HIS CG 1 1 16 17336 1 1 42 HIS H H 1.115 -5.364 4.340 1.00 . A A . 42 HIS H 1 1 16 17337 1 1 42 HIS HA H 2.413 -7.701 3.415 1.00 . A A . 42 HIS HA 1 1 16 17338 1 1 42 HIS HB2 H 1.010 -5.452 2.280 1.00 . A A . 42 HIS HB2 1 1 16 17339 1 1 42 HIS HB3 H 2.489 -5.774 1.370 1.00 . A A . 42 HIS HB3 1 1 16 17340 1 1 42 HIS HD1 H 2.042 -7.285 -0.533 1.00 . A A . 42 HIS HD1 1 1 16 17341 1 1 42 HIS HD2 H -0.398 -8.148 2.717 1.00 . A A . 42 HIS HD2 1 1 16 17342 1 1 42 HIS HE1 H 0.611 -9.221 -1.260 1.00 . A A . 42 HIS HE1 1 1 16 17343 1 1 42 HIS HE2 H -0.889 -9.696 0.705 1.00 . A A . 42 HIS HE2 1 1 16 17344 1 1 42 HIS N N 1.755 -6.083 4.483 1.00 . A A . 42 HIS N 1 1 16 17345 1 1 42 HIS ND1 N 1.366 -7.700 0.043 1.00 . A A . 42 HIS ND1 1 1 16 17346 1 1 42 HIS NE2 N -0.191 -9.009 0.710 1.00 . A A . 42 HIS NE2 1 1 16 17347 1 1 42 HIS O O 4.330 -5.340 2.632 1.00 . A A . 42 HIS O 1 1 16 17348 1 1 43 VAL C C 6.876 -6.769 3.173 1.00 . A A . 43 VAL C 1 1 16 17349 1 1 43 VAL CA C 6.048 -6.669 4.441 1.00 . A A . 43 VAL CA 1 1 16 17350 1 1 43 VAL CB C 6.632 -7.632 5.495 1.00 . A A . 43 VAL CB 1 1 16 17351 1 1 43 VAL CG1 C 8.098 -7.318 5.759 1.00 . A A . 43 VAL CG1 1 1 16 17352 1 1 43 VAL CG2 C 5.827 -7.567 6.783 1.00 . A A . 43 VAL CG2 1 1 16 17353 1 1 43 VAL H H 4.180 -7.612 4.756 1.00 . A A . 43 VAL H 1 1 16 17354 1 1 43 VAL HA H 6.146 -5.672 4.817 1.00 . A A . 43 VAL HA 1 1 16 17355 1 1 43 VAL HB H 6.568 -8.638 5.107 1.00 . A A . 43 VAL HB 1 1 16 17356 1 1 43 VAL HG11 H 8.662 -7.443 4.846 1.00 . A A . 43 VAL HG11 1 1 16 17357 1 1 43 VAL HG12 H 8.480 -7.990 6.512 1.00 . A A . 43 VAL HG12 1 1 16 17358 1 1 43 VAL HG13 H 8.191 -6.300 6.103 1.00 . A A . 43 VAL HG13 1 1 16 17359 1 1 43 VAL HG21 H 5.789 -6.546 7.133 1.00 . A A . 43 VAL HG21 1 1 16 17360 1 1 43 VAL HG22 H 6.296 -8.187 7.533 1.00 . A A . 43 VAL HG22 1 1 16 17361 1 1 43 VAL HG23 H 4.825 -7.922 6.599 1.00 . A A . 43 VAL HG23 1 1 16 17362 1 1 43 VAL N N 4.629 -6.919 4.225 1.00 . A A . 43 VAL N 1 1 16 17363 1 1 43 VAL O O 7.594 -7.744 2.955 1.00 . A A . 43 VAL O 1 1 16 17364 1 1 44 ALA C C 8.820 -4.911 1.420 1.00 . A A . 44 ALA C 1 1 16 17365 1 1 44 ALA CA C 7.538 -5.661 1.126 1.00 . A A . 44 ALA CA 1 1 16 17366 1 1 44 ALA CB C 6.742 -4.987 0.021 1.00 . A A . 44 ALA CB 1 1 16 17367 1 1 44 ALA H H 6.138 -5.024 2.554 1.00 . A A . 44 ALA H 1 1 16 17368 1 1 44 ALA HA H 7.789 -6.662 0.817 1.00 . A A . 44 ALA HA 1 1 16 17369 1 1 44 ALA HB1 H 5.800 -5.499 -0.105 1.00 . A A . 44 ALA HB1 1 1 16 17370 1 1 44 ALA HB2 H 7.301 -5.029 -0.901 1.00 . A A . 44 ALA HB2 1 1 16 17371 1 1 44 ALA HB3 H 6.560 -3.956 0.285 1.00 . A A . 44 ALA HB3 1 1 16 17372 1 1 44 ALA N N 6.764 -5.744 2.342 1.00 . A A . 44 ALA N 1 1 16 17373 1 1 44 ALA O O 9.154 -3.928 0.759 1.00 . A A . 44 ALA O 1 1 16 17374 1 1 45 GLU C C 11.702 -4.577 1.661 1.00 . A A . 45 GLU C 1 1 16 17375 1 1 45 GLU CA C 10.786 -4.792 2.855 1.00 . A A . 45 GLU CA 1 1 16 17376 1 1 45 GLU CB C 11.480 -5.671 3.897 1.00 . A A . 45 GLU CB 1 1 16 17377 1 1 45 GLU CD C 13.488 -6.006 5.392 1.00 . A A . 45 GLU CD 1 1 16 17378 1 1 45 GLU CG C 12.802 -5.104 4.385 1.00 . A A . 45 GLU CG 1 1 16 17379 1 1 45 GLU H H 9.208 -6.190 2.896 1.00 . A A . 45 GLU H 1 1 16 17380 1 1 45 GLU HA H 10.557 -3.832 3.297 1.00 . A A . 45 GLU HA 1 1 16 17381 1 1 45 GLU HB2 H 10.825 -5.786 4.748 1.00 . A A . 45 GLU HB2 1 1 16 17382 1 1 45 GLU HB3 H 11.668 -6.642 3.463 1.00 . A A . 45 GLU HB3 1 1 16 17383 1 1 45 GLU HG2 H 13.457 -4.972 3.538 1.00 . A A . 45 GLU HG2 1 1 16 17384 1 1 45 GLU HG3 H 12.619 -4.145 4.849 1.00 . A A . 45 GLU HG3 1 1 16 17385 1 1 45 GLU N N 9.532 -5.395 2.431 1.00 . A A . 45 GLU N 1 1 16 17386 1 1 45 GLU O O 12.617 -3.762 1.710 1.00 . A A . 45 GLU O 1 1 16 17387 1 1 45 GLU OE1 O 13.188 -5.885 6.598 1.00 . A A . 45 GLU OE1 1 1 16 17388 1 1 45 GLU OE2 O 14.328 -6.830 4.975 1.00 . A A . 45 GLU OE2 1 1 16 17389 1 1 46 ASP C C 11.947 -3.864 -1.288 1.00 . A A . 46 ASP C 1 1 16 17390 1 1 46 ASP CA C 12.257 -5.195 -0.614 1.00 . A A . 46 ASP CA 1 1 16 17391 1 1 46 ASP CB C 11.966 -6.345 -1.579 1.00 . A A . 46 ASP CB 1 1 16 17392 1 1 46 ASP CG C 12.302 -7.700 -0.985 1.00 . A A . 46 ASP CG 1 1 16 17393 1 1 46 ASP H H 10.761 -6.018 0.643 1.00 . A A . 46 ASP H 1 1 16 17394 1 1 46 ASP HA H 13.302 -5.213 -0.343 1.00 . A A . 46 ASP HA 1 1 16 17395 1 1 46 ASP HB2 H 10.918 -6.335 -1.834 1.00 . A A . 46 ASP HB2 1 1 16 17396 1 1 46 ASP HB3 H 12.553 -6.210 -2.475 1.00 . A A . 46 ASP HB3 1 1 16 17397 1 1 46 ASP N N 11.468 -5.336 0.600 1.00 . A A . 46 ASP N 1 1 16 17398 1 1 46 ASP O O 12.852 -3.091 -1.599 1.00 . A A . 46 ASP O 1 1 16 17399 1 1 46 ASP OD1 O 13.502 -8.038 -0.919 1.00 . A A . 46 ASP OD1 1 1 16 17400 1 1 46 ASP OD2 O 11.363 -8.423 -0.588 1.00 . A A . 46 ASP OD2 1 1 16 17401 1 1 47 VAL C C 10.729 -1.128 -1.371 1.00 . A A . 47 VAL C 1 1 16 17402 1 1 47 VAL CA C 10.218 -2.355 -2.122 1.00 . A A . 47 VAL CA 1 1 16 17403 1 1 47 VAL CB C 8.684 -2.285 -2.191 1.00 . A A . 47 VAL CB 1 1 16 17404 1 1 47 VAL CG1 C 8.240 -1.045 -2.949 1.00 . A A . 47 VAL CG1 1 1 16 17405 1 1 47 VAL CG2 C 8.109 -3.543 -2.831 1.00 . A A . 47 VAL CG2 1 1 16 17406 1 1 47 VAL H H 9.982 -4.232 -1.162 1.00 . A A . 47 VAL H 1 1 16 17407 1 1 47 VAL HA H 10.604 -2.341 -3.129 1.00 . A A . 47 VAL HA 1 1 16 17408 1 1 47 VAL HB H 8.310 -2.216 -1.180 1.00 . A A . 47 VAL HB 1 1 16 17409 1 1 47 VAL HG11 H 7.172 -1.081 -3.103 1.00 . A A . 47 VAL HG11 1 1 16 17410 1 1 47 VAL HG12 H 8.742 -1.009 -3.906 1.00 . A A . 47 VAL HG12 1 1 16 17411 1 1 47 VAL HG13 H 8.491 -0.168 -2.377 1.00 . A A . 47 VAL HG13 1 1 16 17412 1 1 47 VAL HG21 H 8.416 -3.593 -3.865 1.00 . A A . 47 VAL HG21 1 1 16 17413 1 1 47 VAL HG22 H 7.030 -3.513 -2.779 1.00 . A A . 47 VAL HG22 1 1 16 17414 1 1 47 VAL HG23 H 8.468 -4.415 -2.309 1.00 . A A . 47 VAL HG23 1 1 16 17415 1 1 47 VAL N N 10.658 -3.592 -1.479 1.00 . A A . 47 VAL N 1 1 16 17416 1 1 47 VAL O O 10.971 -0.090 -1.967 1.00 . A A . 47 VAL O 1 1 16 17417 1 1 48 ALA C C 12.881 -0.278 0.925 1.00 . A A . 48 ALA C 1 1 16 17418 1 1 48 ALA CA C 11.366 -0.270 0.868 1.00 . A A . 48 ALA CA 1 1 16 17419 1 1 48 ALA CB C 10.799 -0.531 2.255 1.00 . A A . 48 ALA CB 1 1 16 17420 1 1 48 ALA H H 10.723 -2.165 0.286 1.00 . A A . 48 ALA H 1 1 16 17421 1 1 48 ALA HA H 11.016 0.695 0.547 1.00 . A A . 48 ALA HA 1 1 16 17422 1 1 48 ALA HB1 H 11.280 0.119 2.969 1.00 . A A . 48 ALA HB1 1 1 16 17423 1 1 48 ALA HB2 H 10.977 -1.560 2.528 1.00 . A A . 48 ALA HB2 1 1 16 17424 1 1 48 ALA HB3 H 9.737 -0.338 2.251 1.00 . A A . 48 ALA HB3 1 1 16 17425 1 1 48 ALA N N 10.895 -1.298 -0.063 1.00 . A A . 48 ALA N 1 1 16 17426 1 1 48 ALA O O 13.537 0.725 0.647 1.00 . A A . 48 ALA O 1 1 16 17427 1 1 49 LYS C C 15.499 -1.217 0.046 1.00 . A A . 49 LYS C 1 1 16 17428 1 1 49 LYS CA C 14.870 -1.602 1.374 1.00 . A A . 49 LYS CA 1 1 16 17429 1 1 49 LYS CB C 15.226 -3.048 1.728 1.00 . A A . 49 LYS CB 1 1 16 17430 1 1 49 LYS CD C 17.028 -4.739 2.209 1.00 . A A . 49 LYS CD 1 1 16 17431 1 1 49 LYS CE C 16.447 -5.160 3.549 1.00 . A A . 49 LYS CE 1 1 16 17432 1 1 49 LYS CG C 16.720 -3.282 1.897 1.00 . A A . 49 LYS CG 1 1 16 17433 1 1 49 LYS H H 12.848 -2.192 1.500 1.00 . A A . 49 LYS H 1 1 16 17434 1 1 49 LYS HA H 15.235 -0.945 2.147 1.00 . A A . 49 LYS HA 1 1 16 17435 1 1 49 LYS HB2 H 14.735 -3.313 2.651 1.00 . A A . 49 LYS HB2 1 1 16 17436 1 1 49 LYS HB3 H 14.870 -3.697 0.940 1.00 . A A . 49 LYS HB3 1 1 16 17437 1 1 49 LYS HD2 H 16.606 -5.361 1.435 1.00 . A A . 49 LYS HD2 1 1 16 17438 1 1 49 LYS HD3 H 18.100 -4.872 2.235 1.00 . A A . 49 LYS HD3 1 1 16 17439 1 1 49 LYS HE2 H 15.395 -4.919 3.563 1.00 . A A . 49 LYS HE2 1 1 16 17440 1 1 49 LYS HE3 H 16.572 -6.226 3.663 1.00 . A A . 49 LYS HE3 1 1 16 17441 1 1 49 LYS HG2 H 17.223 -3.009 0.982 1.00 . A A . 49 LYS HG2 1 1 16 17442 1 1 49 LYS HG3 H 17.081 -2.665 2.707 1.00 . A A . 49 LYS HG3 1 1 16 17443 1 1 49 LYS HZ1 H 17.044 -3.437 4.571 1.00 . A A . 49 LYS HZ1 1 1 16 17444 1 1 49 LYS HZ2 H 18.119 -4.734 4.726 1.00 . A A . 49 LYS HZ2 1 1 16 17445 1 1 49 LYS HZ3 H 16.662 -4.737 5.584 1.00 . A A . 49 LYS HZ3 1 1 16 17446 1 1 49 LYS N N 13.430 -1.433 1.289 1.00 . A A . 49 LYS N 1 1 16 17447 1 1 49 LYS NZ N 17.114 -4.468 4.687 1.00 . A A . 49 LYS NZ 1 1 16 17448 1 1 49 LYS O O 16.634 -0.750 -0.015 1.00 . A A . 49 LYS O 1 1 16 17449 1 1 50 ASP C C 14.779 0.327 -2.693 1.00 . A A . 50 ASP C 1 1 16 17450 1 1 50 ASP CA C 15.220 -1.087 -2.348 1.00 . A A . 50 ASP CA 1 1 16 17451 1 1 50 ASP CB C 14.738 -2.105 -3.393 1.00 . A A . 50 ASP CB 1 1 16 17452 1 1 50 ASP CG C 13.328 -1.863 -3.923 1.00 . A A . 50 ASP CG 1 1 16 17453 1 1 50 ASP H H 13.866 -1.845 -0.921 1.00 . A A . 50 ASP H 1 1 16 17454 1 1 50 ASP HA H 16.302 -1.106 -2.320 1.00 . A A . 50 ASP HA 1 1 16 17455 1 1 50 ASP HB2 H 15.414 -2.087 -4.229 1.00 . A A . 50 ASP HB2 1 1 16 17456 1 1 50 ASP HB3 H 14.760 -3.088 -2.942 1.00 . A A . 50 ASP HB3 1 1 16 17457 1 1 50 ASP N N 14.751 -1.439 -1.026 1.00 . A A . 50 ASP N 1 1 16 17458 1 1 50 ASP O O 15.407 1.003 -3.509 1.00 . A A . 50 ASP O 1 1 16 17459 1 1 50 ASP OD1 O 13.020 -0.721 -4.325 1.00 . A A . 50 ASP OD1 1 1 16 17460 1 1 50 ASP OD2 O 12.542 -2.832 -3.965 1.00 . A A . 50 ASP OD2 1 1 16 17461 1 1 51 TYR C C 14.174 3.146 -1.812 1.00 . A A . 51 TYR C 1 1 16 17462 1 1 51 TYR CA C 13.194 2.115 -2.325 1.00 . A A . 51 TYR CA 1 1 16 17463 1 1 51 TYR CB C 11.862 2.384 -1.644 1.00 . A A . 51 TYR CB 1 1 16 17464 1 1 51 TYR CD1 C 10.851 3.117 -3.842 1.00 . A A . 51 TYR CD1 1 1 16 17465 1 1 51 TYR CD2 C 9.435 2.044 -2.254 1.00 . A A . 51 TYR CD2 1 1 16 17466 1 1 51 TYR CE1 C 9.788 3.233 -4.718 1.00 . A A . 51 TYR CE1 1 1 16 17467 1 1 51 TYR CE2 C 8.368 2.157 -3.123 1.00 . A A . 51 TYR CE2 1 1 16 17468 1 1 51 TYR CG C 10.694 2.523 -2.597 1.00 . A A . 51 TYR CG 1 1 16 17469 1 1 51 TYR CZ C 8.548 2.806 -4.344 1.00 . A A . 51 TYR CZ 1 1 16 17470 1 1 51 TYR H H 13.217 0.196 -1.438 1.00 . A A . 51 TYR H 1 1 16 17471 1 1 51 TYR HA H 13.064 2.200 -3.375 1.00 . A A . 51 TYR HA 1 1 16 17472 1 1 51 TYR HB2 H 11.668 1.589 -0.981 1.00 . A A . 51 TYR HB2 1 1 16 17473 1 1 51 TYR HB3 H 11.927 3.302 -1.075 1.00 . A A . 51 TYR HB3 1 1 16 17474 1 1 51 TYR HD1 H 11.823 3.495 -4.125 1.00 . A A . 51 TYR HD1 1 1 16 17475 1 1 51 TYR HD2 H 9.296 1.578 -1.290 1.00 . A A . 51 TYR HD2 1 1 16 17476 1 1 51 TYR HE1 H 9.931 3.697 -5.682 1.00 . A A . 51 TYR HE1 1 1 16 17477 1 1 51 TYR HE2 H 7.398 1.779 -2.836 1.00 . A A . 51 TYR HE2 1 1 16 17478 1 1 51 TYR HH H 6.702 3.124 -4.739 1.00 . A A . 51 TYR HH 1 1 16 17479 1 1 51 TYR N N 13.690 0.776 -2.070 1.00 . A A . 51 TYR N 1 1 16 17480 1 1 51 TYR O O 14.773 3.912 -2.566 1.00 . A A . 51 TYR O 1 1 16 17481 1 1 51 TYR OH O 7.488 2.862 -5.223 1.00 . A A . 51 TYR OH 1 1 16 17482 1 1 52 GLU C C 16.593 3.551 0.343 1.00 . A A . 52 GLU C 1 1 16 17483 1 1 52 GLU CA C 15.172 4.077 0.197 1.00 . A A . 52 GLU CA 1 1 16 17484 1 1 52 GLU CB C 14.593 4.415 1.574 1.00 . A A . 52 GLU CB 1 1 16 17485 1 1 52 GLU CD C 13.895 3.581 3.856 1.00 . A A . 52 GLU CD 1 1 16 17486 1 1 52 GLU CG C 14.553 3.236 2.535 1.00 . A A . 52 GLU CG 1 1 16 17487 1 1 52 GLU H H 13.848 2.446 0.027 1.00 . A A . 52 GLU H 1 1 16 17488 1 1 52 GLU HA H 15.185 4.967 -0.393 1.00 . A A . 52 GLU HA 1 1 16 17489 1 1 52 GLU HB2 H 15.191 5.194 2.021 1.00 . A A . 52 GLU HB2 1 1 16 17490 1 1 52 GLU HB3 H 13.584 4.779 1.446 1.00 . A A . 52 GLU HB3 1 1 16 17491 1 1 52 GLU HG2 H 14.003 2.430 2.075 1.00 . A A . 52 GLU HG2 1 1 16 17492 1 1 52 GLU HG3 H 15.565 2.914 2.729 1.00 . A A . 52 GLU HG3 1 1 16 17493 1 1 52 GLU N N 14.319 3.134 -0.492 1.00 . A A . 52 GLU N 1 1 16 17494 1 1 52 GLU O O 17.560 4.233 0.003 1.00 . A A . 52 GLU O 1 1 16 17495 1 1 52 GLU OE1 O 14.602 4.073 4.761 1.00 . A A . 52 GLU OE1 1 1 16 17496 1 1 52 GLU OE2 O 12.673 3.360 3.985 1.00 . A A . 52 GLU OE2 1 1 16 17497 1 1 53 ASP C C 18.577 1.166 -0.253 1.00 . A A . 53 ASP C 1 1 16 17498 1 1 53 ASP CA C 17.998 1.705 1.061 1.00 . A A . 53 ASP CA 1 1 16 17499 1 1 53 ASP CB C 17.843 0.596 2.109 1.00 . A A . 53 ASP CB 1 1 16 17500 1 1 53 ASP CG C 18.982 -0.410 2.113 1.00 . A A . 53 ASP CG 1 1 16 17501 1 1 53 ASP H H 15.893 1.838 1.084 1.00 . A A . 53 ASP H 1 1 16 17502 1 1 53 ASP HA H 18.668 2.457 1.449 1.00 . A A . 53 ASP HA 1 1 16 17503 1 1 53 ASP HB2 H 17.799 1.051 3.088 1.00 . A A . 53 ASP HB2 1 1 16 17504 1 1 53 ASP HB3 H 16.916 0.074 1.926 1.00 . A A . 53 ASP HB3 1 1 16 17505 1 1 53 ASP N N 16.705 2.334 0.850 1.00 . A A . 53 ASP N 1 1 16 17506 1 1 53 ASP O O 19.736 0.753 -0.301 1.00 . A A . 53 ASP O 1 1 16 17507 1 1 53 ASP OD1 O 18.935 -1.363 1.307 1.00 . A A . 53 ASP OD1 1 1 16 17508 1 1 53 ASP OD2 O 19.921 -0.242 2.921 1.00 . A A . 53 ASP OD2 1 1 16 17509 1 1 54 GLY C C 18.854 1.805 -3.428 1.00 . A A . 54 GLY C 1 1 16 17510 1 1 54 GLY CA C 18.245 0.692 -2.600 1.00 . A A . 54 GLY CA 1 1 16 17511 1 1 54 GLY H H 16.851 1.489 -1.224 1.00 . A A . 54 GLY H 1 1 16 17512 1 1 54 GLY HA2 H 18.992 -0.072 -2.437 1.00 . A A . 54 GLY HA2 1 1 16 17513 1 1 54 GLY HA3 H 17.418 0.262 -3.143 1.00 . A A . 54 GLY HA3 1 1 16 17514 1 1 54 GLY N N 17.772 1.167 -1.313 1.00 . A A . 54 GLY N 1 1 16 17515 1 1 54 GLY O O 19.844 1.597 -4.131 1.00 . A A . 54 GLY O 1 1 16 17516 1 1 55 LEU C C 19.858 4.850 -3.302 1.00 . A A . 55 LEU C 1 1 16 17517 1 1 55 LEU CA C 18.754 4.148 -4.085 1.00 . A A . 55 LEU CA 1 1 16 17518 1 1 55 LEU CB C 17.610 5.124 -4.374 1.00 . A A . 55 LEU CB 1 1 16 17519 1 1 55 LEU CD1 C 15.341 5.558 -5.351 1.00 . A A . 55 LEU CD1 1 1 16 17520 1 1 55 LEU CD2 C 17.015 4.214 -6.632 1.00 . A A . 55 LEU CD2 1 1 16 17521 1 1 55 LEU CG C 16.488 4.564 -5.249 1.00 . A A . 55 LEU CG 1 1 16 17522 1 1 55 LEU H H 17.471 3.092 -2.774 1.00 . A A . 55 LEU H 1 1 16 17523 1 1 55 LEU HA H 19.160 3.795 -5.021 1.00 . A A . 55 LEU HA 1 1 16 17524 1 1 55 LEU HB2 H 17.184 5.437 -3.431 1.00 . A A . 55 LEU HB2 1 1 16 17525 1 1 55 LEU HB3 H 18.022 5.991 -4.868 1.00 . A A . 55 LEU HB3 1 1 16 17526 1 1 55 LEU HD11 H 15.702 6.483 -5.778 1.00 . A A . 55 LEU HD11 1 1 16 17527 1 1 55 LEU HD12 H 14.941 5.749 -4.365 1.00 . A A . 55 LEU HD12 1 1 16 17528 1 1 55 LEU HD13 H 14.566 5.149 -5.981 1.00 . A A . 55 LEU HD13 1 1 16 17529 1 1 55 LEU HD21 H 17.396 5.105 -7.109 1.00 . A A . 55 LEU HD21 1 1 16 17530 1 1 55 LEU HD22 H 16.214 3.801 -7.228 1.00 . A A . 55 LEU HD22 1 1 16 17531 1 1 55 LEU HD23 H 17.808 3.487 -6.542 1.00 . A A . 55 LEU HD23 1 1 16 17532 1 1 55 LEU HG H 16.106 3.660 -4.797 1.00 . A A . 55 LEU HG 1 1 16 17533 1 1 55 LEU N N 18.260 2.992 -3.346 1.00 . A A . 55 LEU N 1 1 16 17534 1 1 55 LEU O O 21.005 4.906 -3.741 1.00 . A A . 55 LEU O 1 1 16 17535 1 1 56 GLU C C 21.112 5.098 -0.314 1.00 . A A . 56 GLU C 1 1 16 17536 1 1 56 GLU CA C 20.466 6.073 -1.288 1.00 . A A . 56 GLU CA 1 1 16 17537 1 1 56 GLU CB C 19.794 7.208 -0.519 1.00 . A A . 56 GLU CB 1 1 16 17538 1 1 56 GLU CD C 18.265 7.914 -2.400 1.00 . A A . 56 GLU CD 1 1 16 17539 1 1 56 GLU CG C 19.318 8.350 -1.402 1.00 . A A . 56 GLU CG 1 1 16 17540 1 1 56 GLU H H 18.568 5.319 -1.845 1.00 . A A . 56 GLU H 1 1 16 17541 1 1 56 GLU HA H 21.229 6.484 -1.922 1.00 . A A . 56 GLU HA 1 1 16 17542 1 1 56 GLU HB2 H 18.943 6.810 0.005 1.00 . A A . 56 GLU HB2 1 1 16 17543 1 1 56 GLU HB3 H 20.495 7.606 0.200 1.00 . A A . 56 GLU HB3 1 1 16 17544 1 1 56 GLU HG2 H 18.900 9.123 -0.776 1.00 . A A . 56 GLU HG2 1 1 16 17545 1 1 56 GLU HG3 H 20.166 8.746 -1.942 1.00 . A A . 56 GLU HG3 1 1 16 17546 1 1 56 GLU N N 19.501 5.387 -2.138 1.00 . A A . 56 GLU N 1 1 16 17547 1 1 56 GLU O O 21.031 5.269 0.903 1.00 . A A . 56 GLU O 1 1 16 17548 1 1 56 GLU OE1 O 17.076 7.859 -2.023 1.00 . A A . 56 GLU OE1 1 1 16 17549 1 1 56 GLU OE2 O 18.629 7.632 -3.561 1.00 . A A . 56 GLU OE2 1 1 16 17550 1 1 57 TYR C C 23.764 3.560 0.458 1.00 . A A . 57 TYR C 1 1 16 17551 1 1 57 TYR CA C 22.415 3.059 -0.047 1.00 . A A . 57 TYR CA 1 1 16 17552 1 1 57 TYR CB C 22.600 1.772 -0.851 1.00 . A A . 57 TYR CB 1 1 16 17553 1 1 57 TYR CD1 C 22.554 -0.184 0.745 1.00 . A A . 57 TYR CD1 1 1 16 17554 1 1 57 TYR CD2 C 24.657 0.476 -0.166 1.00 . A A . 57 TYR CD2 1 1 16 17555 1 1 57 TYR CE1 C 23.175 -1.194 1.456 1.00 . A A . 57 TYR CE1 1 1 16 17556 1 1 57 TYR CE2 C 25.285 -0.532 0.541 1.00 . A A . 57 TYR CE2 1 1 16 17557 1 1 57 TYR CG C 23.283 0.666 -0.077 1.00 . A A . 57 TYR CG 1 1 16 17558 1 1 57 TYR CZ C 24.541 -1.369 1.342 1.00 . A A . 57 TYR CZ 1 1 16 17559 1 1 57 TYR H H 21.788 4.001 -1.837 1.00 . A A . 57 TYR H 1 1 16 17560 1 1 57 TYR HA H 21.781 2.854 0.803 1.00 . A A . 57 TYR HA 1 1 16 17561 1 1 57 TYR HB2 H 21.632 1.408 -1.163 1.00 . A A . 57 TYR HB2 1 1 16 17562 1 1 57 TYR HB3 H 23.197 1.984 -1.726 1.00 . A A . 57 TYR HB3 1 1 16 17563 1 1 57 TYR HD1 H 21.487 -0.049 0.824 1.00 . A A . 57 TYR HD1 1 1 16 17564 1 1 57 TYR HD2 H 25.238 1.129 -0.800 1.00 . A A . 57 TYR HD2 1 1 16 17565 1 1 57 TYR HE1 H 22.592 -1.844 2.089 1.00 . A A . 57 TYR HE1 1 1 16 17566 1 1 57 TYR HE2 H 26.353 -0.665 0.460 1.00 . A A . 57 TYR HE2 1 1 16 17567 1 1 57 TYR HH H 24.669 -3.184 1.952 1.00 . A A . 57 TYR HH 1 1 16 17568 1 1 57 TYR N N 21.755 4.073 -0.861 1.00 . A A . 57 TYR N 1 1 16 17569 1 1 57 TYR O O 23.800 4.161 1.551 1.00 . A A . 57 TYR O 1 1 16 17570 1 1 57 TYR OXT O 24.774 3.347 -0.246 1.00 . A A . 57 TYR OXT 1 1 16 17571 1 1 57 TYR OH O 25.161 -2.367 2.057 1.00 . A A . 57 TYR OH 1 1 16 17572 2 2 1 ALA C C -14.732 -8.852 -1.549 1.00 . B B . 1 ALA C 1 1 16 17573 2 2 1 ALA CA C -15.340 -10.076 -2.236 1.00 . B B . 1 ALA CA 1 1 16 17574 2 2 1 ALA CB C -14.643 -11.349 -1.774 1.00 . B B . 1 ALA CB 1 1 16 17575 2 2 1 ALA H1 H -15.286 -8.962 -4.000 1.00 . B B . 1 ALA H1 1 1 16 17576 2 2 1 ALA H2 H -16.114 -10.429 -4.139 1.00 . B B . 1 ALA H2 1 1 16 17577 2 2 1 ALA H3 H -14.425 -10.418 -4.082 1.00 . B B . 1 ALA H3 1 1 16 17578 2 2 1 ALA HA H -16.379 -10.149 -1.948 1.00 . B B . 1 ALA HA 1 1 16 17579 2 2 1 ALA HB1 H -14.865 -11.521 -0.730 1.00 . B B . 1 ALA HB1 1 1 16 17580 2 2 1 ALA HB2 H -13.576 -11.246 -1.902 1.00 . B B . 1 ALA HB2 1 1 16 17581 2 2 1 ALA HB3 H -14.996 -12.185 -2.358 1.00 . B B . 1 ALA HB3 1 1 16 17582 2 2 1 ALA N N -15.284 -9.963 -3.717 1.00 . B B . 1 ALA N 1 1 16 17583 2 2 1 ALA O O -15.315 -8.320 -0.605 1.00 . B B . 1 ALA O 1 1 16 17584 2 2 2 PRO C C -13.830 -6.017 -1.298 1.00 . B B . 2 PRO C 1 1 16 17585 2 2 2 PRO CA C -12.893 -7.217 -1.412 1.00 . B B . 2 PRO CA 1 1 16 17586 2 2 2 PRO CB C -11.755 -6.913 -2.391 1.00 . B B . 2 PRO CB 1 1 16 17587 2 2 2 PRO CD C -12.782 -8.940 -3.134 1.00 . B B . 2 PRO CD 1 1 16 17588 2 2 2 PRO CG C -11.467 -8.215 -3.052 1.00 . B B . 2 PRO CG 1 1 16 17589 2 2 2 PRO HA H -12.484 -7.446 -0.440 1.00 . B B . 2 PRO HA 1 1 16 17590 2 2 2 PRO HB2 H -12.078 -6.168 -3.104 1.00 . B B . 2 PRO HB2 1 1 16 17591 2 2 2 PRO HB3 H -10.896 -6.549 -1.846 1.00 . B B . 2 PRO HB3 1 1 16 17592 2 2 2 PRO HD2 H -13.270 -8.730 -4.075 1.00 . B B . 2 PRO HD2 1 1 16 17593 2 2 2 PRO HD3 H -12.634 -10.001 -3.013 1.00 . B B . 2 PRO HD3 1 1 16 17594 2 2 2 PRO HG2 H -11.071 -8.045 -4.042 1.00 . B B . 2 PRO HG2 1 1 16 17595 2 2 2 PRO HG3 H -10.766 -8.781 -2.458 1.00 . B B . 2 PRO HG3 1 1 16 17596 2 2 2 PRO N N -13.554 -8.383 -2.007 1.00 . B B . 2 PRO N 1 1 16 17597 2 2 2 PRO O O -14.092 -5.329 -2.284 1.00 . B B . 2 PRO O 1 1 16 17598 2 2 3 PRO C C -14.536 -3.294 0.179 1.00 . B B . 3 PRO C 1 1 16 17599 2 2 3 PRO CA C -15.261 -4.636 0.159 1.00 . B B . 3 PRO CA 1 1 16 17600 2 2 3 PRO CB C -15.858 -4.939 1.544 1.00 . B B . 3 PRO CB 1 1 16 17601 2 2 3 PRO CD C -14.095 -6.514 1.140 1.00 . B B . 3 PRO CD 1 1 16 17602 2 2 3 PRO CG C -15.360 -6.300 1.918 1.00 . B B . 3 PRO CG 1 1 16 17603 2 2 3 PRO HA H -16.053 -4.603 -0.576 1.00 . B B . 3 PRO HA 1 1 16 17604 2 2 3 PRO HB2 H -15.522 -4.192 2.249 1.00 . B B . 3 PRO HB2 1 1 16 17605 2 2 3 PRO HB3 H -16.936 -4.918 1.483 1.00 . B B . 3 PRO HB3 1 1 16 17606 2 2 3 PRO HD2 H -13.247 -6.115 1.677 1.00 . B B . 3 PRO HD2 1 1 16 17607 2 2 3 PRO HD3 H -13.953 -7.562 0.924 1.00 . B B . 3 PRO HD3 1 1 16 17608 2 2 3 PRO HG2 H -15.159 -6.337 2.978 1.00 . B B . 3 PRO HG2 1 1 16 17609 2 2 3 PRO HG3 H -16.096 -7.043 1.649 1.00 . B B . 3 PRO HG3 1 1 16 17610 2 2 3 PRO N N -14.349 -5.752 -0.086 1.00 . B B . 3 PRO N 1 1 16 17611 2 2 3 PRO O O -14.929 -2.354 -0.511 1.00 . B B . 3 PRO O 1 1 16 17612 2 2 4 GLY C C -11.212 -2.225 1.002 1.00 . B B . 4 GLY C 1 1 16 17613 2 2 4 GLY CA C -12.708 -1.985 1.072 1.00 . B B . 4 GLY CA 1 1 16 17614 2 2 4 GLY H H -13.207 -3.997 1.502 1.00 . B B . 4 GLY H 1 1 16 17615 2 2 4 GLY HA2 H -12.997 -1.333 0.261 1.00 . B B . 4 GLY HA2 1 1 16 17616 2 2 4 GLY HA3 H -12.941 -1.501 2.008 1.00 . B B . 4 GLY HA3 1 1 16 17617 2 2 4 GLY N N -13.473 -3.215 0.975 1.00 . B B . 4 GLY N 1 1 16 17618 2 2 4 GLY O O -10.484 -1.929 1.950 1.00 . B B . 4 GLY O 1 1 16 17619 2 2 5 THR C C -8.947 -2.995 -1.796 1.00 . B B . 5 THR C 1 1 16 17620 2 2 5 THR CA C -9.337 -3.044 -0.320 1.00 . B B . 5 THR CA 1 1 16 17621 2 2 5 THR CB C -8.955 -4.420 0.256 1.00 . B B . 5 THR CB 1 1 16 17622 2 2 5 THR CG2 C -9.108 -4.435 1.769 1.00 . B B . 5 THR CG2 1 1 16 17623 2 2 5 THR H H -11.383 -2.947 -0.849 1.00 . B B . 5 THR H 1 1 16 17624 2 2 5 THR HA H -8.777 -2.287 0.208 1.00 . B B . 5 THR HA 1 1 16 17625 2 2 5 THR HB H -7.923 -4.622 0.011 1.00 . B B . 5 THR HB 1 1 16 17626 2 2 5 THR HG1 H -9.233 -6.175 -0.604 1.00 . B B . 5 THR HG1 1 1 16 17627 2 2 5 THR HG21 H -8.836 -5.409 2.148 1.00 . B B . 5 THR HG21 1 1 16 17628 2 2 5 THR HG22 H -10.133 -4.221 2.030 1.00 . B B . 5 THR HG22 1 1 16 17629 2 2 5 THR HG23 H -8.461 -3.686 2.204 1.00 . B B . 5 THR HG23 1 1 16 17630 2 2 5 THR N N -10.755 -2.760 -0.125 1.00 . B B . 5 THR N 1 1 16 17631 2 2 5 THR O O -9.802 -2.850 -2.670 1.00 . B B . 5 THR O 1 1 16 17632 2 2 5 THR OG1 O -9.781 -5.439 -0.322 1.00 . B B . 5 THR OG1 1 1 16 17633 2 2 6 ALA C C -5.651 -3.481 -3.457 1.00 . B B . 6 ALA C 1 1 16 17634 2 2 6 ALA CA C -7.132 -3.099 -3.429 1.00 . B B . 6 ALA CA 1 1 16 17635 2 2 6 ALA CB C -7.348 -1.728 -4.056 1.00 . B B . 6 ALA CB 1 1 16 17636 2 2 6 ALA H H -7.018 -3.222 -1.318 1.00 . B B . 6 ALA H 1 1 16 17637 2 2 6 ALA HA H -7.689 -3.825 -4.004 1.00 . B B . 6 ALA HA 1 1 16 17638 2 2 6 ALA HB1 H -7.897 -1.101 -3.369 1.00 . B B . 6 ALA HB1 1 1 16 17639 2 2 6 ALA HB2 H -7.909 -1.838 -4.971 1.00 . B B . 6 ALA HB2 1 1 16 17640 2 2 6 ALA HB3 H -6.393 -1.275 -4.272 1.00 . B B . 6 ALA HB3 1 1 16 17641 2 2 6 ALA N N -7.648 -3.117 -2.062 1.00 . B B . 6 ALA N 1 1 16 17642 2 2 6 ALA O O -5.153 -4.128 -2.535 1.00 . B B . 6 ALA O 1 1 16 17643 2 2 7 ARG C C -2.885 -2.491 -5.710 1.00 . B B . 7 ARG C 1 1 16 17644 2 2 7 ARG CA C -3.530 -3.393 -4.660 1.00 . B B . 7 ARG CA 1 1 16 17645 2 2 7 ARG CB C -3.329 -4.862 -5.041 1.00 . B B . 7 ARG CB 1 1 16 17646 2 2 7 ARG CD C -3.726 -6.704 -6.706 1.00 . B B . 7 ARG CD 1 1 16 17647 2 2 7 ARG CG C -3.953 -5.237 -6.375 1.00 . B B . 7 ARG CG 1 1 16 17648 2 2 7 ARG CZ C -4.234 -8.915 -5.754 1.00 . B B . 7 ARG CZ 1 1 16 17649 2 2 7 ARG H H -5.408 -2.605 -5.241 1.00 . B B . 7 ARG H 1 1 16 17650 2 2 7 ARG HA H -3.060 -3.209 -3.706 1.00 . B B . 7 ARG HA 1 1 16 17651 2 2 7 ARG HB2 H -2.269 -5.066 -5.093 1.00 . B B . 7 ARG HB2 1 1 16 17652 2 2 7 ARG HB3 H -3.769 -5.483 -4.274 1.00 . B B . 7 ARG HB3 1 1 16 17653 2 2 7 ARG HD2 H -4.164 -6.915 -7.670 1.00 . B B . 7 ARG HD2 1 1 16 17654 2 2 7 ARG HD3 H -2.662 -6.890 -6.745 1.00 . B B . 7 ARG HD3 1 1 16 17655 2 2 7 ARG HE H -4.820 -7.174 -4.973 1.00 . B B . 7 ARG HE 1 1 16 17656 2 2 7 ARG HG2 H -5.015 -5.049 -6.330 1.00 . B B . 7 ARG HG2 1 1 16 17657 2 2 7 ARG HG3 H -3.512 -4.630 -7.152 1.00 . B B . 7 ARG HG3 1 1 16 17658 2 2 7 ARG HH11 H -3.147 -8.953 -7.458 1.00 . B B . 7 ARG HH11 1 1 16 17659 2 2 7 ARG HH12 H -3.509 -10.502 -6.772 1.00 . B B . 7 ARG HH12 1 1 16 17660 2 2 7 ARG HH21 H -5.301 -9.209 -4.062 1.00 . B B . 7 ARG HH21 1 1 16 17661 2 2 7 ARG HH22 H -4.735 -10.648 -4.843 1.00 . B B . 7 ARG HH22 1 1 16 17662 2 2 7 ARG N N -4.954 -3.094 -4.524 1.00 . B B . 7 ARG N 1 1 16 17663 2 2 7 ARG NE N -4.325 -7.589 -5.711 1.00 . B B . 7 ARG NE 1 1 16 17664 2 2 7 ARG NH1 N -3.577 -9.505 -6.742 1.00 . B B . 7 ARG NH1 1 1 16 17665 2 2 7 ARG NH2 N -4.803 -9.651 -4.809 1.00 . B B . 7 ARG NH2 1 1 16 17666 2 2 7 ARG O O -3.338 -2.437 -6.854 1.00 . B B . 7 ARG O 1 1 16 17667 2 2 8 ARG C C -0.216 -1.649 -7.178 1.00 . B B . 8 ARG C 1 1 16 17668 2 2 8 ARG CA C -1.133 -0.880 -6.232 1.00 . B B . 8 ARG CA 1 1 16 17669 2 2 8 ARG CB C -0.326 0.158 -5.453 1.00 . B B . 8 ARG CB 1 1 16 17670 2 2 8 ARG CD C -0.436 1.779 -7.375 1.00 . B B . 8 ARG CD 1 1 16 17671 2 2 8 ARG CG C -0.608 1.591 -5.877 1.00 . B B . 8 ARG CG 1 1 16 17672 2 2 8 ARG CZ C 1.398 2.036 -8.992 1.00 . B B . 8 ARG CZ 1 1 16 17673 2 2 8 ARG H H -1.509 -1.863 -4.391 1.00 . B B . 8 ARG H 1 1 16 17674 2 2 8 ARG HA H -1.882 -0.370 -6.819 1.00 . B B . 8 ARG HA 1 1 16 17675 2 2 8 ARG HB2 H -0.558 0.064 -4.402 1.00 . B B . 8 ARG HB2 1 1 16 17676 2 2 8 ARG HB3 H 0.727 -0.037 -5.598 1.00 . B B . 8 ARG HB3 1 1 16 17677 2 2 8 ARG HD2 H -0.998 1.013 -7.888 1.00 . B B . 8 ARG HD2 1 1 16 17678 2 2 8 ARG HD3 H -0.820 2.749 -7.650 1.00 . B B . 8 ARG HD3 1 1 16 17679 2 2 8 ARG HE H 1.610 1.364 -7.126 1.00 . B B . 8 ARG HE 1 1 16 17680 2 2 8 ARG HG2 H -1.622 1.842 -5.609 1.00 . B B . 8 ARG HG2 1 1 16 17681 2 2 8 ARG HG3 H 0.076 2.248 -5.360 1.00 . B B . 8 ARG HG3 1 1 16 17682 2 2 8 ARG HH11 H -0.428 2.559 -9.685 1.00 . B B . 8 ARG HH11 1 1 16 17683 2 2 8 ARG HH12 H 0.874 2.739 -10.813 1.00 . B B . 8 ARG HH12 1 1 16 17684 2 2 8 ARG HH21 H 3.331 1.604 -8.601 1.00 . B B . 8 ARG HH21 1 1 16 17685 2 2 8 ARG HH22 H 3.012 2.193 -10.198 1.00 . B B . 8 ARG HH22 1 1 16 17686 2 2 8 ARG N N -1.827 -1.782 -5.316 1.00 . B B . 8 ARG N 1 1 16 17687 2 2 8 ARG NE N 0.963 1.692 -7.785 1.00 . B B . 8 ARG NE 1 1 16 17688 2 2 8 ARG NH1 N 0.544 2.481 -9.905 1.00 . B B . 8 ARG NH1 1 1 16 17689 2 2 8 ARG NH2 N 2.686 1.937 -9.288 1.00 . B B . 8 ARG NH2 1 1 16 17690 2 2 8 ARG O O -0.058 -1.275 -8.341 1.00 . B B . 8 ARG O 1 1 16 17691 2 2 9 LYS C C 1.075 -5.017 -7.225 1.00 . B B . 9 LYS C 1 1 16 17692 2 2 9 LYS CA C 1.289 -3.531 -7.496 1.00 . B B . 9 LYS CA 1 1 16 17693 2 2 9 LYS CB C 2.749 -3.164 -7.210 1.00 . B B . 9 LYS CB 1 1 16 17694 2 2 9 LYS CD C 4.511 -1.385 -7.050 1.00 . B B . 9 LYS CD 1 1 16 17695 2 2 9 LYS CE C 4.846 0.081 -7.265 1.00 . B B . 9 LYS CE 1 1 16 17696 2 2 9 LYS CG C 3.074 -1.698 -7.443 1.00 . B B . 9 LYS CG 1 1 16 17697 2 2 9 LYS H H 0.227 -2.984 -5.750 1.00 . B B . 9 LYS H 1 1 16 17698 2 2 9 LYS HA H 1.068 -3.324 -8.533 1.00 . B B . 9 LYS HA 1 1 16 17699 2 2 9 LYS HB2 H 2.974 -3.401 -6.180 1.00 . B B . 9 LYS HB2 1 1 16 17700 2 2 9 LYS HB3 H 3.388 -3.756 -7.850 1.00 . B B . 9 LYS HB3 1 1 16 17701 2 2 9 LYS HD2 H 4.647 -1.625 -6.007 1.00 . B B . 9 LYS HD2 1 1 16 17702 2 2 9 LYS HD3 H 5.175 -1.989 -7.649 1.00 . B B . 9 LYS HD3 1 1 16 17703 2 2 9 LYS HE2 H 4.739 0.311 -8.314 1.00 . B B . 9 LYS HE2 1 1 16 17704 2 2 9 LYS HE3 H 4.156 0.684 -6.691 1.00 . B B . 9 LYS HE3 1 1 16 17705 2 2 9 LYS HG2 H 2.940 -1.469 -8.490 1.00 . B B . 9 LYS HG2 1 1 16 17706 2 2 9 LYS HG3 H 2.406 -1.091 -6.850 1.00 . B B . 9 LYS HG3 1 1 16 17707 2 2 9 LYS HZ1 H 6.433 1.410 -6.986 1.00 . B B . 9 LYS HZ1 1 1 16 17708 2 2 9 LYS HZ2 H 6.916 -0.158 -7.399 1.00 . B B . 9 LYS HZ2 1 1 16 17709 2 2 9 LYS HZ3 H 6.365 0.174 -5.835 1.00 . B B . 9 LYS HZ3 1 1 16 17710 2 2 9 LYS N N 0.390 -2.725 -6.681 1.00 . B B . 9 LYS N 1 1 16 17711 2 2 9 LYS NZ N 6.238 0.399 -6.842 1.00 . B B . 9 LYS NZ 1 1 16 17712 2 2 9 LYS O O 0.127 -5.399 -6.537 1.00 . B B . 9 LYS O 1 1 16 17713 2 2 10 ARG C C 1.789 -7.612 -6.072 1.00 . B B . 10 ARG C 1 1 16 17714 2 2 10 ARG CA C 1.860 -7.291 -7.559 1.00 . B B . 10 ARG CA 1 1 16 17715 2 2 10 ARG CB C 3.076 -7.987 -8.161 1.00 . B B . 10 ARG CB 1 1 16 17716 2 2 10 ARG CD C 5.532 -8.440 -7.881 1.00 . B B . 10 ARG CD 1 1 16 17717 2 2 10 ARG CG C 4.389 -7.481 -7.590 1.00 . B B . 10 ARG CG 1 1 16 17718 2 2 10 ARG CZ C 7.959 -8.594 -7.511 1.00 . B B . 10 ARG CZ 1 1 16 17719 2 2 10 ARG H H 2.687 -5.499 -8.313 1.00 . B B . 10 ARG H 1 1 16 17720 2 2 10 ARG HA H 0.965 -7.647 -8.045 1.00 . B B . 10 ARG HA 1 1 16 17721 2 2 10 ARG HB2 H 3.004 -9.047 -7.965 1.00 . B B . 10 ARG HB2 1 1 16 17722 2 2 10 ARG HB3 H 3.083 -7.825 -9.229 1.00 . B B . 10 ARG HB3 1 1 16 17723 2 2 10 ARG HD2 H 5.303 -9.397 -7.437 1.00 . B B . 10 ARG HD2 1 1 16 17724 2 2 10 ARG HD3 H 5.626 -8.552 -8.951 1.00 . B B . 10 ARG HD3 1 1 16 17725 2 2 10 ARG HE H 6.791 -7.128 -6.823 1.00 . B B . 10 ARG HE 1 1 16 17726 2 2 10 ARG HG2 H 4.614 -6.522 -8.035 1.00 . B B . 10 ARG HG2 1 1 16 17727 2 2 10 ARG HG3 H 4.283 -7.366 -6.518 1.00 . B B . 10 ARG HG3 1 1 16 17728 2 2 10 ARG HH11 H 7.167 -10.095 -8.609 1.00 . B B . 10 ARG HH11 1 1 16 17729 2 2 10 ARG HH12 H 8.876 -10.195 -8.336 1.00 . B B . 10 ARG HH12 1 1 16 17730 2 2 10 ARG HH21 H 9.041 -7.250 -6.459 1.00 . B B . 10 ARG HH21 1 1 16 17731 2 2 10 ARG HH22 H 9.941 -8.576 -7.115 1.00 . B B . 10 ARG HH22 1 1 16 17732 2 2 10 ARG N N 1.955 -5.854 -7.766 1.00 . B B . 10 ARG N 1 1 16 17733 2 2 10 ARG NE N 6.802 -7.961 -7.340 1.00 . B B . 10 ARG NE 1 1 16 17734 2 2 10 ARG NH1 N 8.005 -9.720 -8.209 1.00 . B B . 10 ARG NH1 1 1 16 17735 2 2 10 ARG NH2 N 9.072 -8.099 -6.985 1.00 . B B . 10 ARG NH2 1 1 16 17736 2 2 10 ARG O O 1.265 -8.652 -5.673 1.00 . B B . 10 ARG O 1 1 16 17737 2 2 11 LYS C C 3.437 -7.871 -3.421 1.00 . B B . 11 LYS C 1 1 16 17738 2 2 11 LYS CA C 2.361 -6.873 -3.814 1.00 . B B . 11 LYS CA 1 1 16 17739 2 2 11 LYS CB C 1.000 -7.319 -3.278 1.00 . B B . 11 LYS CB 1 1 16 17740 2 2 11 LYS CD C -1.316 -6.503 -2.786 1.00 . B B . 11 LYS CD 1 1 16 17741 2 2 11 LYS CE C -1.916 -7.897 -2.702 1.00 . B B . 11 LYS CE 1 1 16 17742 2 2 11 LYS CG C -0.152 -6.456 -3.757 1.00 . B B . 11 LYS CG 1 1 16 17743 2 2 11 LYS H H 2.730 -5.900 -5.647 1.00 . B B . 11 LYS H 1 1 16 17744 2 2 11 LYS HA H 2.608 -5.918 -3.383 1.00 . B B . 11 LYS HA 1 1 16 17745 2 2 11 LYS HB2 H 0.815 -8.336 -3.583 1.00 . B B . 11 LYS HB2 1 1 16 17746 2 2 11 LYS HB3 H 1.025 -7.275 -2.200 1.00 . B B . 11 LYS HB3 1 1 16 17747 2 2 11 LYS HD2 H -0.960 -6.216 -1.808 1.00 . B B . 11 LYS HD2 1 1 16 17748 2 2 11 LYS HD3 H -2.076 -5.810 -3.114 1.00 . B B . 11 LYS HD3 1 1 16 17749 2 2 11 LYS HE2 H -2.199 -8.214 -3.694 1.00 . B B . 11 LYS HE2 1 1 16 17750 2 2 11 LYS HE3 H -1.171 -8.572 -2.308 1.00 . B B . 11 LYS HE3 1 1 16 17751 2 2 11 LYS HG2 H 0.189 -5.434 -3.848 1.00 . B B . 11 LYS HG2 1 1 16 17752 2 2 11 LYS HG3 H -0.481 -6.814 -4.721 1.00 . B B . 11 LYS HG3 1 1 16 17753 2 2 11 LYS HZ1 H -2.875 -7.592 -0.870 1.00 . B B . 11 LYS HZ1 1 1 16 17754 2 2 11 LYS HZ2 H -3.474 -8.909 -1.747 1.00 . B B . 11 LYS HZ2 1 1 16 17755 2 2 11 LYS HZ3 H -3.868 -7.332 -2.214 1.00 . B B . 11 LYS HZ3 1 1 16 17756 2 2 11 LYS N N 2.331 -6.706 -5.260 1.00 . B B . 11 LYS N 1 1 16 17757 2 2 11 LYS NZ N -3.117 -7.935 -1.821 1.00 . B B . 11 LYS NZ 1 1 16 17758 2 2 11 LYS O O 3.188 -9.074 -3.337 1.00 . B B . 11 LYS O 1 1 16 17759 2 2 12 ALA C C 5.851 -8.349 -1.298 1.00 . B B . 12 ALA C 1 1 16 17760 2 2 12 ALA CA C 5.763 -8.198 -2.809 1.00 . B B . 12 ALA CA 1 1 16 17761 2 2 12 ALA CB C 7.058 -7.615 -3.351 1.00 . B B . 12 ALA CB 1 1 16 17762 2 2 12 ALA H H 4.765 -6.388 -3.244 1.00 . B B . 12 ALA H 1 1 16 17763 2 2 12 ALA HA H 5.616 -9.170 -3.257 1.00 . B B . 12 ALA HA 1 1 16 17764 2 2 12 ALA HB1 H 6.880 -7.184 -4.326 1.00 . B B . 12 ALA HB1 1 1 16 17765 2 2 12 ALA HB2 H 7.800 -8.395 -3.431 1.00 . B B . 12 ALA HB2 1 1 16 17766 2 2 12 ALA HB3 H 7.414 -6.847 -2.678 1.00 . B B . 12 ALA HB3 1 1 16 17767 2 2 12 ALA N N 4.637 -7.358 -3.181 1.00 . B B . 12 ALA N 1 1 16 17768 2 2 12 ALA O O 6.590 -7.625 -0.644 1.00 . B B . 12 ALA O 1 1 16 17769 2 2 13 ASP C C 5.779 -10.838 1.023 1.00 . B B . 13 ASP C 1 1 16 17770 2 2 13 ASP CA C 5.102 -9.514 0.693 1.00 . B B . 13 ASP CA 1 1 16 17771 2 2 13 ASP CB C 3.675 -9.494 1.244 1.00 . B B . 13 ASP CB 1 1 16 17772 2 2 13 ASP CG C 2.796 -10.550 0.602 1.00 . B B . 13 ASP CG 1 1 16 17773 2 2 13 ASP H H 4.516 -9.837 -1.316 1.00 . B B . 13 ASP H 1 1 16 17774 2 2 13 ASP HA H 5.665 -8.714 1.150 1.00 . B B . 13 ASP HA 1 1 16 17775 2 2 13 ASP HB2 H 3.703 -9.673 2.308 1.00 . B B . 13 ASP HB2 1 1 16 17776 2 2 13 ASP HB3 H 3.239 -8.523 1.058 1.00 . B B . 13 ASP HB3 1 1 16 17777 2 2 13 ASP N N 5.093 -9.287 -0.745 1.00 . B B . 13 ASP N 1 1 16 17778 2 2 13 ASP O O 5.185 -11.907 0.881 1.00 . B B . 13 ASP O 1 1 16 17779 2 2 13 ASP OD1 O 2.577 -10.474 -0.626 1.00 . B B . 13 ASP OD1 1 1 16 17780 2 2 13 ASP OD2 O 2.331 -11.455 1.324 1.00 . B B . 13 ASP OD2 1 1 16 17781 2 2 14 SER C C 6.995 -12.907 2.670 1.00 . B B . 14 SER C 1 1 16 17782 2 2 14 SER CA C 7.809 -11.942 1.812 1.00 . B B . 14 SER CA 1 1 16 17783 2 2 14 SER CB C 9.088 -11.541 2.551 1.00 . B B . 14 SER CB 1 1 16 17784 2 2 14 SER H H 7.445 -9.872 1.560 1.00 . B B . 14 SER H 1 1 16 17785 2 2 14 SER HA H 8.079 -12.437 0.891 1.00 . B B . 14 SER HA 1 1 16 17786 2 2 14 SER HB2 H 9.682 -10.900 1.916 1.00 . B B . 14 SER HB2 1 1 16 17787 2 2 14 SER HB3 H 8.827 -11.009 3.454 1.00 . B B . 14 SER HB3 1 1 16 17788 2 2 14 SER HG H 9.775 -13.345 2.210 1.00 . B B . 14 SER HG 1 1 16 17789 2 2 14 SER N N 7.032 -10.756 1.465 1.00 . B B . 14 SER N 1 1 16 17790 2 2 14 SER O O 6.312 -13.779 2.091 1.00 . B B . 14 SER O 1 1 16 17791 2 2 14 SER OXT O 7.049 -12.785 3.911 1.00 . B B . 14 SER OXT 1 1 16 17792 2 2 14 SER OG O 9.858 -12.680 2.897 1.00 . B B . 14 SER OG 1 1 17 17793 1 1 1 GLY C C 11.649 5.194 -6.110 1.00 . A A . 1 GLY C 1 1 17 17794 1 1 1 GLY CA C 11.006 4.374 -7.216 1.00 . A A . 1 GLY CA 1 1 17 17795 1 1 1 GLY H1 H 9.039 4.742 -6.612 1.00 . A A . 1 GLY H1 1 1 17 17796 1 1 1 GLY H2 H 9.173 4.158 -8.195 1.00 . A A . 1 GLY H2 1 1 17 17797 1 1 1 GLY H3 H 9.580 5.763 -7.849 1.00 . A A . 1 GLY H3 1 1 17 17798 1 1 1 GLY HA2 H 11.022 3.328 -6.941 1.00 . A A . 1 GLY HA2 1 1 17 17799 1 1 1 GLY HA3 H 11.583 4.503 -8.122 1.00 . A A . 1 GLY HA3 1 1 17 17800 1 1 1 GLY N N 9.600 4.788 -7.487 1.00 . A A . 1 GLY N 1 1 17 17801 1 1 1 GLY O O 12.749 5.717 -6.286 1.00 . A A . 1 GLY O 1 1 17 17802 1 1 2 SER C C 10.472 6.319 -2.722 1.00 . A A . 2 SER C 1 1 17 17803 1 1 2 SER CA C 11.499 6.094 -3.835 1.00 . A A . 2 SER CA 1 1 17 17804 1 1 2 SER CB C 12.026 7.440 -4.322 1.00 . A A . 2 SER CB 1 1 17 17805 1 1 2 SER H H 10.112 4.845 -4.863 1.00 . A A . 2 SER H 1 1 17 17806 1 1 2 SER HA H 12.326 5.542 -3.418 1.00 . A A . 2 SER HA 1 1 17 17807 1 1 2 SER HB2 H 12.983 7.290 -4.798 1.00 . A A . 2 SER HB2 1 1 17 17808 1 1 2 SER HB3 H 11.331 7.861 -5.031 1.00 . A A . 2 SER HB3 1 1 17 17809 1 1 2 SER HG H 13.111 8.343 -2.964 1.00 . A A . 2 SER HG 1 1 17 17810 1 1 2 SER N N 10.969 5.310 -4.960 1.00 . A A . 2 SER N 1 1 17 17811 1 1 2 SER O O 10.831 6.785 -1.639 1.00 . A A . 2 SER O 1 1 17 17812 1 1 2 SER OG O 12.193 8.345 -3.245 1.00 . A A . 2 SER OG 1 1 17 17813 1 1 3 GLN C C 8.111 4.930 -1.078 1.00 . A A . 3 GLN C 1 1 17 17814 1 1 3 GLN CA C 8.183 6.169 -1.951 1.00 . A A . 3 GLN CA 1 1 17 17815 1 1 3 GLN CB C 6.831 6.448 -2.594 1.00 . A A . 3 GLN CB 1 1 17 17816 1 1 3 GLN CD C 5.447 7.994 -4.038 1.00 . A A . 3 GLN CD 1 1 17 17817 1 1 3 GLN CG C 6.765 7.783 -3.318 1.00 . A A . 3 GLN CG 1 1 17 17818 1 1 3 GLN H H 8.946 5.662 -3.842 1.00 . A A . 3 GLN H 1 1 17 17819 1 1 3 GLN HA H 8.460 7.005 -1.344 1.00 . A A . 3 GLN HA 1 1 17 17820 1 1 3 GLN HB2 H 6.628 5.670 -3.302 1.00 . A A . 3 GLN HB2 1 1 17 17821 1 1 3 GLN HB3 H 6.070 6.439 -1.828 1.00 . A A . 3 GLN HB3 1 1 17 17822 1 1 3 GLN HE21 H 6.195 7.188 -5.694 1.00 . A A . 3 GLN HE21 1 1 17 17823 1 1 3 GLN HE22 H 4.553 7.715 -5.791 1.00 . A A . 3 GLN HE22 1 1 17 17824 1 1 3 GLN HG2 H 6.895 8.576 -2.598 1.00 . A A . 3 GLN HG2 1 1 17 17825 1 1 3 GLN HG3 H 7.565 7.824 -4.043 1.00 . A A . 3 GLN HG3 1 1 17 17826 1 1 3 GLN N N 9.204 5.997 -2.967 1.00 . A A . 3 GLN N 1 1 17 17827 1 1 3 GLN NE2 N 5.393 7.592 -5.303 1.00 . A A . 3 GLN NE2 1 1 17 17828 1 1 3 GLN O O 8.186 3.803 -1.569 1.00 . A A . 3 GLN O 1 1 17 17829 1 1 3 GLN OE1 O 4.490 8.514 -3.465 1.00 . A A . 3 GLN OE1 1 1 17 17830 1 1 4 VAL C C 6.478 3.681 1.489 1.00 . A A . 4 VAL C 1 1 17 17831 1 1 4 VAL CA C 7.920 4.052 1.168 1.00 . A A . 4 VAL CA 1 1 17 17832 1 1 4 VAL CB C 8.684 4.424 2.460 1.00 . A A . 4 VAL CB 1 1 17 17833 1 1 4 VAL CG1 C 7.924 5.465 3.272 1.00 . A A . 4 VAL CG1 1 1 17 17834 1 1 4 VAL CG2 C 8.970 3.186 3.291 1.00 . A A . 4 VAL CG2 1 1 17 17835 1 1 4 VAL H H 7.860 6.060 0.549 1.00 . A A . 4 VAL H 1 1 17 17836 1 1 4 VAL HA H 8.409 3.202 0.715 1.00 . A A . 4 VAL HA 1 1 17 17837 1 1 4 VAL HB H 9.630 4.857 2.173 1.00 . A A . 4 VAL HB 1 1 17 17838 1 1 4 VAL HG11 H 7.511 6.209 2.606 1.00 . A A . 4 VAL HG11 1 1 17 17839 1 1 4 VAL HG12 H 8.598 5.941 3.966 1.00 . A A . 4 VAL HG12 1 1 17 17840 1 1 4 VAL HG13 H 7.124 4.987 3.817 1.00 . A A . 4 VAL HG13 1 1 17 17841 1 1 4 VAL HG21 H 8.084 2.585 3.347 1.00 . A A . 4 VAL HG21 1 1 17 17842 1 1 4 VAL HG22 H 9.273 3.481 4.284 1.00 . A A . 4 VAL HG22 1 1 17 17843 1 1 4 VAL HG23 H 9.762 2.617 2.827 1.00 . A A . 4 VAL HG23 1 1 17 17844 1 1 4 VAL N N 7.965 5.145 0.221 1.00 . A A . 4 VAL N 1 1 17 17845 1 1 4 VAL O O 6.123 3.453 2.644 1.00 . A A . 4 VAL O 1 1 17 17846 1 1 5 PHE C C 3.516 3.220 -0.724 1.00 . A A . 5 PHE C 1 1 17 17847 1 1 5 PHE CA C 4.243 3.280 0.623 1.00 . A A . 5 PHE CA 1 1 17 17848 1 1 5 PHE CB C 3.583 4.325 1.518 1.00 . A A . 5 PHE CB 1 1 17 17849 1 1 5 PHE CD1 C 4.897 6.504 0.468 1.00 . A A . 5 PHE CD1 1 1 17 17850 1 1 5 PHE CD2 C 4.453 5.182 2.403 1.00 . A A . 5 PHE CD2 1 1 17 17851 1 1 5 PHE CE1 C 6.184 6.732 0.916 1.00 . A A . 5 PHE CE1 1 1 17 17852 1 1 5 PHE CE2 C 5.738 5.407 2.857 1.00 . A A . 5 PHE CE2 1 1 17 17853 1 1 5 PHE CG C 4.018 5.727 1.205 1.00 . A A . 5 PHE CG 1 1 17 17854 1 1 5 PHE CZ C 4.839 8.316 0.620 1.00 . A A . 5 PHE CZ 1 1 17 17855 1 1 5 PHE H H 5.993 3.797 -0.449 1.00 . A A . 5 PHE H 1 1 17 17856 1 1 5 PHE HA H 4.188 2.309 1.109 1.00 . A A . 5 PHE HA 1 1 17 17857 1 1 5 PHE HB2 H 2.513 4.273 1.393 1.00 . A A . 5 PHE HB2 1 1 17 17858 1 1 5 PHE HB3 H 3.833 4.120 2.545 1.00 . A A . 5 PHE HB3 1 1 17 17859 1 1 5 PHE HD1 H 4.569 6.932 -0.466 1.00 . A A . 5 PHE HD1 1 1 17 17860 1 1 5 PHE HD2 H 3.776 4.575 2.985 1.00 . A A . 5 PHE HD2 1 1 17 17861 1 1 5 PHE HE1 H 6.859 7.340 0.333 1.00 . A A . 5 PHE HE1 1 1 17 17862 1 1 5 PHE HE2 H 6.064 4.979 3.793 1.00 . A A . 5 PHE HE2 1 1 17 17863 1 1 5 PHE HZ H 5.158 9.323 0.393 1.00 . A A . 5 PHE HZ 1 1 17 17864 1 1 5 PHE N N 5.650 3.616 0.450 1.00 . A A . 5 PHE N 1 1 17 17865 1 1 5 PHE O O 3.911 3.883 -1.685 1.00 . A A . 5 PHE O 1 1 17 17866 1 1 6 GLU C C 0.165 2.343 -1.683 1.00 . A A . 6 GLU C 1 1 17 17867 1 1 6 GLU CA C 1.652 2.275 -1.997 1.00 . A A . 6 GLU CA 1 1 17 17868 1 1 6 GLU CB C 1.960 0.948 -2.680 1.00 . A A . 6 GLU CB 1 1 17 17869 1 1 6 GLU CD C 4.281 1.740 -3.251 1.00 . A A . 6 GLU CD 1 1 17 17870 1 1 6 GLU CG C 3.021 1.066 -3.753 1.00 . A A . 6 GLU CG 1 1 17 17871 1 1 6 GLU H H 2.208 1.913 0.012 1.00 . A A . 6 GLU H 1 1 17 17872 1 1 6 GLU HA H 1.906 3.082 -2.665 1.00 . A A . 6 GLU HA 1 1 17 17873 1 1 6 GLU HB2 H 2.296 0.240 -1.936 1.00 . A A . 6 GLU HB2 1 1 17 17874 1 1 6 GLU HB3 H 1.055 0.573 -3.136 1.00 . A A . 6 GLU HB3 1 1 17 17875 1 1 6 GLU HG2 H 3.271 0.077 -4.104 1.00 . A A . 6 GLU HG2 1 1 17 17876 1 1 6 GLU HG3 H 2.617 1.647 -4.568 1.00 . A A . 6 GLU HG3 1 1 17 17877 1 1 6 GLU N N 2.454 2.423 -0.781 1.00 . A A . 6 GLU N 1 1 17 17878 1 1 6 GLU O O -0.282 1.845 -0.654 1.00 . A A . 6 GLU O 1 1 17 17879 1 1 6 GLU OE1 O 4.819 1.295 -2.215 1.00 . A A . 6 GLU OE1 1 1 17 17880 1 1 6 GLU OE2 O 4.730 2.714 -3.892 1.00 . A A . 6 GLU OE2 1 1 17 17881 1 1 7 TYR C C -2.795 1.855 -2.899 1.00 . A A . 7 TYR C 1 1 17 17882 1 1 7 TYR CA C -2.033 3.054 -2.353 1.00 . A A . 7 TYR CA 1 1 17 17883 1 1 7 TYR CB C -2.560 4.350 -2.961 1.00 . A A . 7 TYR CB 1 1 17 17884 1 1 7 TYR CD1 C -1.344 4.775 -5.131 1.00 . A A . 7 TYR CD1 1 1 17 17885 1 1 7 TYR CD2 C -3.611 4.047 -5.237 1.00 . A A . 7 TYR CD2 1 1 17 17886 1 1 7 TYR CE1 C -1.288 4.816 -6.512 1.00 . A A . 7 TYR CE1 1 1 17 17887 1 1 7 TYR CE2 C -3.563 4.085 -6.617 1.00 . A A . 7 TYR CE2 1 1 17 17888 1 1 7 TYR CG C -2.504 4.390 -4.471 1.00 . A A . 7 TYR CG 1 1 17 17889 1 1 7 TYR CZ C -2.400 4.469 -7.249 1.00 . A A . 7 TYR CZ 1 1 17 17890 1 1 7 TYR H H -0.227 3.315 -3.391 1.00 . A A . 7 TYR H 1 1 17 17891 1 1 7 TYR HA H -2.180 3.084 -1.296 1.00 . A A . 7 TYR HA 1 1 17 17892 1 1 7 TYR HB2 H -3.584 4.478 -2.665 1.00 . A A . 7 TYR HB2 1 1 17 17893 1 1 7 TYR HB3 H -1.976 5.177 -2.584 1.00 . A A . 7 TYR HB3 1 1 17 17894 1 1 7 TYR HD1 H -0.473 5.046 -4.551 1.00 . A A . 7 TYR HD1 1 1 17 17895 1 1 7 TYR HD2 H -4.520 3.745 -4.738 1.00 . A A . 7 TYR HD2 1 1 17 17896 1 1 7 TYR HE1 H -0.377 5.118 -7.007 1.00 . A A . 7 TYR HE1 1 1 17 17897 1 1 7 TYR HE2 H -4.434 3.813 -7.194 1.00 . A A . 7 TYR HE2 1 1 17 17898 1 1 7 TYR HH H -1.539 4.091 -8.926 1.00 . A A . 7 TYR HH 1 1 17 17899 1 1 7 TYR N N -0.613 2.937 -2.578 1.00 . A A . 7 TYR N 1 1 17 17900 1 1 7 TYR O O -2.973 1.710 -4.109 1.00 . A A . 7 TYR O 1 1 17 17901 1 1 7 TYR OH O -2.350 4.509 -8.625 1.00 . A A . 7 TYR OH 1 1 17 17902 1 1 8 ALA C C -5.488 0.167 -2.367 1.00 . A A . 8 ALA C 1 1 17 17903 1 1 8 ALA CA C -4.007 -0.187 -2.358 1.00 . A A . 8 ALA CA 1 1 17 17904 1 1 8 ALA CB C -3.730 -1.339 -1.392 1.00 . A A . 8 ALA CB 1 1 17 17905 1 1 8 ALA H H -3.050 1.168 -1.034 1.00 . A A . 8 ALA H 1 1 17 17906 1 1 8 ALA HA H -3.707 -0.488 -3.352 1.00 . A A . 8 ALA HA 1 1 17 17907 1 1 8 ALA HB1 H -2.942 -1.960 -1.791 1.00 . A A . 8 ALA HB1 1 1 17 17908 1 1 8 ALA HB2 H -4.624 -1.931 -1.270 1.00 . A A . 8 ALA HB2 1 1 17 17909 1 1 8 ALA HB3 H -3.428 -0.950 -0.429 1.00 . A A . 8 ALA HB3 1 1 17 17910 1 1 8 ALA N N -3.238 0.995 -1.986 1.00 . A A . 8 ALA N 1 1 17 17911 1 1 8 ALA O O -6.303 -0.497 -1.729 1.00 . A A . 8 ALA O 1 1 17 17912 1 1 9 GLU C C -7.796 1.554 -4.550 1.00 . A A . 9 GLU C 1 1 17 17913 1 1 9 GLU CA C -7.183 1.714 -3.178 1.00 . A A . 9 GLU CA 1 1 17 17914 1 1 9 GLU CB C -7.169 3.175 -2.710 1.00 . A A . 9 GLU CB 1 1 17 17915 1 1 9 GLU CD C -7.354 4.408 -4.916 1.00 . A A . 9 GLU CD 1 1 17 17916 1 1 9 GLU CG C -7.958 4.174 -3.542 1.00 . A A . 9 GLU CG 1 1 17 17917 1 1 9 GLU H H -5.136 1.696 -3.609 1.00 . A A . 9 GLU H 1 1 17 17918 1 1 9 GLU HA H -7.779 1.145 -2.501 1.00 . A A . 9 GLU HA 1 1 17 17919 1 1 9 GLU HB2 H -7.559 3.211 -1.708 1.00 . A A . 9 GLU HB2 1 1 17 17920 1 1 9 GLU HB3 H -6.140 3.506 -2.685 1.00 . A A . 9 GLU HB3 1 1 17 17921 1 1 9 GLU HG2 H -8.957 3.806 -3.657 1.00 . A A . 9 GLU HG2 1 1 17 17922 1 1 9 GLU HG3 H -7.982 5.112 -3.017 1.00 . A A . 9 GLU HG3 1 1 17 17923 1 1 9 GLU N N -5.825 1.222 -3.106 1.00 . A A . 9 GLU N 1 1 17 17924 1 1 9 GLU O O -7.108 1.426 -5.564 1.00 . A A . 9 GLU O 1 1 17 17925 1 1 9 GLU OE1 O -6.350 5.144 -5.003 1.00 . A A . 9 GLU OE1 1 1 17 17926 1 1 9 GLU OE2 O -7.886 3.858 -5.902 1.00 . A A . 9 GLU OE2 1 1 17 17927 1 1 10 VAL C C -10.312 2.808 -6.256 1.00 . A A . 10 VAL C 1 1 17 17928 1 1 10 VAL CA C -9.887 1.439 -5.750 1.00 . A A . 10 VAL CA 1 1 17 17929 1 1 10 VAL CB C -11.094 0.533 -5.527 1.00 . A A . 10 VAL CB 1 1 17 17930 1 1 10 VAL CG1 C -11.901 0.387 -6.809 1.00 . A A . 10 VAL CG1 1 1 17 17931 1 1 10 VAL CG2 C -10.627 -0.821 -5.007 1.00 . A A . 10 VAL CG2 1 1 17 17932 1 1 10 VAL H H -9.588 1.653 -3.691 1.00 . A A . 10 VAL H 1 1 17 17933 1 1 10 VAL HA H -9.268 0.986 -6.472 1.00 . A A . 10 VAL HA 1 1 17 17934 1 1 10 VAL HB H -11.708 0.984 -4.777 1.00 . A A . 10 VAL HB 1 1 17 17935 1 1 10 VAL HG11 H -11.661 -0.554 -7.280 1.00 . A A . 10 VAL HG11 1 1 17 17936 1 1 10 VAL HG12 H -11.657 1.196 -7.482 1.00 . A A . 10 VAL HG12 1 1 17 17937 1 1 10 VAL HG13 H -12.955 0.417 -6.582 1.00 . A A . 10 VAL HG13 1 1 17 17938 1 1 10 VAL HG21 H -10.239 -0.707 -4.005 1.00 . A A . 10 VAL HG21 1 1 17 17939 1 1 10 VAL HG22 H -9.850 -1.204 -5.652 1.00 . A A . 10 VAL HG22 1 1 17 17940 1 1 10 VAL HG23 H -11.455 -1.513 -4.994 1.00 . A A . 10 VAL HG23 1 1 17 17941 1 1 10 VAL N N -9.118 1.565 -4.545 1.00 . A A . 10 VAL N 1 1 17 17942 1 1 10 VAL O O -10.385 3.046 -7.461 1.00 . A A . 10 VAL O 1 1 17 17943 1 1 11 ASP C C -10.330 6.097 -4.725 1.00 . A A . 11 ASP C 1 1 17 17944 1 1 11 ASP CA C -10.972 5.071 -5.663 1.00 . A A . 11 ASP CA 1 1 17 17945 1 1 11 ASP CB C -12.489 5.237 -5.616 1.00 . A A . 11 ASP CB 1 1 17 17946 1 1 11 ASP CG C -12.938 6.592 -6.126 1.00 . A A . 11 ASP CG 1 1 17 17947 1 1 11 ASP H H -10.597 3.430 -4.385 1.00 . A A . 11 ASP H 1 1 17 17948 1 1 11 ASP HA H -10.632 5.263 -6.670 1.00 . A A . 11 ASP HA 1 1 17 17949 1 1 11 ASP HB2 H -12.948 4.475 -6.220 1.00 . A A . 11 ASP HB2 1 1 17 17950 1 1 11 ASP HB3 H -12.822 5.130 -4.594 1.00 . A A . 11 ASP HB3 1 1 17 17951 1 1 11 ASP N N -10.596 3.706 -5.320 1.00 . A A . 11 ASP N 1 1 17 17952 1 1 11 ASP O O -9.904 7.164 -5.167 1.00 . A A . 11 ASP O 1 1 17 17953 1 1 11 ASP OD1 O -13.042 6.756 -7.359 1.00 . A A . 11 ASP OD1 1 1 17 17954 1 1 11 ASP OD2 O -13.187 7.488 -5.293 1.00 . A A . 11 ASP OD2 1 1 17 17955 1 1 12 GLU C C -9.175 6.051 -1.200 1.00 . A A . 12 GLU C 1 1 17 17956 1 1 12 GLU CA C -9.718 6.732 -2.452 1.00 . A A . 12 GLU CA 1 1 17 17957 1 1 12 GLU CB C -10.802 7.730 -2.058 1.00 . A A . 12 GLU CB 1 1 17 17958 1 1 12 GLU CD C -12.242 9.688 -2.745 1.00 . A A . 12 GLU CD 1 1 17 17959 1 1 12 GLU CG C -11.166 8.705 -3.166 1.00 . A A . 12 GLU CG 1 1 17 17960 1 1 12 GLU H H -10.495 4.866 -3.146 1.00 . A A . 12 GLU H 1 1 17 17961 1 1 12 GLU HA H -8.908 7.266 -2.928 1.00 . A A . 12 GLU HA 1 1 17 17962 1 1 12 GLU HB2 H -11.693 7.180 -1.784 1.00 . A A . 12 GLU HB2 1 1 17 17963 1 1 12 GLU HB3 H -10.462 8.294 -1.205 1.00 . A A . 12 GLU HB3 1 1 17 17964 1 1 12 GLU HG2 H -10.283 9.261 -3.443 1.00 . A A . 12 GLU HG2 1 1 17 17965 1 1 12 GLU HG3 H -11.522 8.146 -4.019 1.00 . A A . 12 GLU HG3 1 1 17 17966 1 1 12 GLU N N -10.258 5.777 -3.431 1.00 . A A . 12 GLU N 1 1 17 17967 1 1 12 GLU O O -9.583 4.956 -0.861 1.00 . A A . 12 GLU O 1 1 17 17968 1 1 12 GLU OE1 O -11.890 10.755 -2.200 1.00 . A A . 12 GLU OE1 1 1 17 17969 1 1 12 GLU OE2 O -13.436 9.390 -2.960 1.00 . A A . 12 GLU OE2 1 1 17 17970 1 1 13 ILE C C -7.778 7.226 1.854 1.00 . A A . 13 ILE C 1 1 17 17971 1 1 13 ILE CA C -7.687 6.193 0.728 1.00 . A A . 13 ILE CA 1 1 17 17972 1 1 13 ILE CB C -6.200 5.791 0.512 1.00 . A A . 13 ILE CB 1 1 17 17973 1 1 13 ILE CD1 C -5.595 7.867 -0.823 1.00 . A A . 13 ILE CD1 1 1 17 17974 1 1 13 ILE CG1 C -5.306 7.033 0.406 1.00 . A A . 13 ILE CG1 1 1 17 17975 1 1 13 ILE CG2 C -6.070 4.973 -0.756 1.00 . A A . 13 ILE CG2 1 1 17 17976 1 1 13 ILE H H -8.013 7.627 -0.797 1.00 . A A . 13 ILE H 1 1 17 17977 1 1 13 ILE HA H -8.248 5.309 1.005 1.00 . A A . 13 ILE HA 1 1 17 17978 1 1 13 ILE HB H -5.871 5.171 1.346 1.00 . A A . 13 ILE HB 1 1 17 17979 1 1 13 ILE HD11 H -6.359 8.595 -0.592 1.00 . A A . 13 ILE HD11 1 1 17 17980 1 1 13 ILE HD12 H -5.940 7.223 -1.622 1.00 . A A . 13 ILE HD12 1 1 17 17981 1 1 13 ILE HD13 H -4.695 8.375 -1.134 1.00 . A A . 13 ILE HD13 1 1 17 17982 1 1 13 ILE HG12 H -5.460 7.656 1.275 1.00 . A A . 13 ILE HG12 1 1 17 17983 1 1 13 ILE HG13 H -4.273 6.729 0.366 1.00 . A A . 13 ILE HG13 1 1 17 17984 1 1 13 ILE HG21 H -5.174 5.268 -1.283 1.00 . A A . 13 ILE HG21 1 1 17 17985 1 1 13 ILE HG22 H -6.928 5.147 -1.382 1.00 . A A . 13 ILE HG22 1 1 17 17986 1 1 13 ILE HG23 H -6.007 3.925 -0.507 1.00 . A A . 13 ILE HG23 1 1 17 17987 1 1 13 ILE N N -8.278 6.734 -0.495 1.00 . A A . 13 ILE N 1 1 17 17988 1 1 13 ILE O O -8.455 8.245 1.721 1.00 . A A . 13 ILE O 1 1 17 17989 1 1 14 VAL C C -5.760 7.749 4.845 1.00 . A A . 14 VAL C 1 1 17 17990 1 1 14 VAL CA C -7.078 7.871 4.092 1.00 . A A . 14 VAL CA 1 1 17 17991 1 1 14 VAL CB C -8.259 7.616 5.053 1.00 . A A . 14 VAL CB 1 1 17 17992 1 1 14 VAL CG1 C -8.157 8.503 6.287 1.00 . A A . 14 VAL CG1 1 1 17 17993 1 1 14 VAL CG2 C -9.581 7.848 4.337 1.00 . A A . 14 VAL CG2 1 1 17 17994 1 1 14 VAL H H -6.585 6.121 3.011 1.00 . A A . 14 VAL H 1 1 17 17995 1 1 14 VAL HA H -7.165 8.875 3.705 1.00 . A A . 14 VAL HA 1 1 17 17996 1 1 14 VAL HB H -8.222 6.585 5.373 1.00 . A A . 14 VAL HB 1 1 17 17997 1 1 14 VAL HG11 H -7.226 8.304 6.797 1.00 . A A . 14 VAL HG11 1 1 17 17998 1 1 14 VAL HG12 H -8.984 8.294 6.950 1.00 . A A . 14 VAL HG12 1 1 17 17999 1 1 14 VAL HG13 H -8.189 9.541 5.988 1.00 . A A . 14 VAL HG13 1 1 17 18000 1 1 14 VAL HG21 H -9.620 8.863 3.973 1.00 . A A . 14 VAL HG21 1 1 17 18001 1 1 14 VAL HG22 H -10.397 7.679 5.024 1.00 . A A . 14 VAL HG22 1 1 17 18002 1 1 14 VAL HG23 H -9.664 7.164 3.505 1.00 . A A . 14 VAL HG23 1 1 17 18003 1 1 14 VAL N N -7.094 6.956 2.957 1.00 . A A . 14 VAL N 1 1 17 18004 1 1 14 VAL O O -5.103 8.746 5.139 1.00 . A A . 14 VAL O 1 1 17 18005 1 1 15 GLU C C -3.068 5.826 4.852 1.00 . A A . 15 GLU C 1 1 17 18006 1 1 15 GLU CA C -4.136 6.249 5.854 1.00 . A A . 15 GLU CA 1 1 17 18007 1 1 15 GLU CB C -4.333 5.156 6.906 1.00 . A A . 15 GLU CB 1 1 17 18008 1 1 15 GLU CD C -2.432 5.939 8.371 1.00 . A A . 15 GLU CD 1 1 17 18009 1 1 15 GLU CG C -3.054 4.771 7.630 1.00 . A A . 15 GLU CG 1 1 17 18010 1 1 15 GLU H H -5.969 5.765 4.908 1.00 . A A . 15 GLU H 1 1 17 18011 1 1 15 GLU HA H -3.821 7.159 6.340 1.00 . A A . 15 GLU HA 1 1 17 18012 1 1 15 GLU HB2 H -5.046 5.503 7.639 1.00 . A A . 15 GLU HB2 1 1 17 18013 1 1 15 GLU HB3 H -4.727 4.274 6.422 1.00 . A A . 15 GLU HB3 1 1 17 18014 1 1 15 GLU HG2 H -3.278 3.991 8.343 1.00 . A A . 15 GLU HG2 1 1 17 18015 1 1 15 GLU HG3 H -2.342 4.402 6.906 1.00 . A A . 15 GLU HG3 1 1 17 18016 1 1 15 GLU N N -5.387 6.516 5.155 1.00 . A A . 15 GLU N 1 1 17 18017 1 1 15 GLU O O -3.354 5.092 3.915 1.00 . A A . 15 GLU O 1 1 17 18018 1 1 15 GLU OE1 O -1.628 6.670 7.756 1.00 . A A . 15 GLU OE1 1 1 17 18019 1 1 15 GLU OE2 O -2.750 6.121 9.564 1.00 . A A . 15 GLU OE2 1 1 17 18020 1 1 16 LYS C C 0.604 5.995 4.783 1.00 . A A . 16 LYS C 1 1 17 18021 1 1 16 LYS CA C -0.771 5.958 4.104 1.00 . A A . 16 LYS CA 1 1 17 18022 1 1 16 LYS CB C -0.774 6.929 2.928 1.00 . A A . 16 LYS CB 1 1 17 18023 1 1 16 LYS CD C -0.709 9.321 2.158 1.00 . A A . 16 LYS CD 1 1 17 18024 1 1 16 LYS CE C 0.697 9.255 1.586 1.00 . A A . 16 LYS CE 1 1 17 18025 1 1 16 LYS CG C -0.868 8.388 3.347 1.00 . A A . 16 LYS CG 1 1 17 18026 1 1 16 LYS H H -1.669 6.916 5.769 1.00 . A A . 16 LYS H 1 1 17 18027 1 1 16 LYS HA H -0.972 4.955 3.735 1.00 . A A . 16 LYS HA 1 1 17 18028 1 1 16 LYS HB2 H 0.138 6.797 2.370 1.00 . A A . 16 LYS HB2 1 1 17 18029 1 1 16 LYS HB3 H -1.616 6.705 2.291 1.00 . A A . 16 LYS HB3 1 1 17 18030 1 1 16 LYS HD2 H -1.413 9.036 1.392 1.00 . A A . 16 LYS HD2 1 1 17 18031 1 1 16 LYS HD3 H -0.911 10.333 2.478 1.00 . A A . 16 LYS HD3 1 1 17 18032 1 1 16 LYS HE2 H 0.920 8.230 1.332 1.00 . A A . 16 LYS HE2 1 1 17 18033 1 1 16 LYS HE3 H 0.738 9.863 0.695 1.00 . A A . 16 LYS HE3 1 1 17 18034 1 1 16 LYS HG2 H -1.832 8.561 3.801 1.00 . A A . 16 LYS HG2 1 1 17 18035 1 1 16 LYS HG3 H -0.087 8.597 4.065 1.00 . A A . 16 LYS HG3 1 1 17 18036 1 1 16 LYS HZ1 H 1.519 10.732 2.812 1.00 . A A . 16 LYS HZ1 1 1 17 18037 1 1 16 LYS HZ2 H 2.665 9.690 2.133 1.00 . A A . 16 LYS HZ2 1 1 17 18038 1 1 16 LYS HZ3 H 1.698 9.163 3.416 1.00 . A A . 16 LYS HZ3 1 1 17 18039 1 1 16 LYS N N -1.848 6.309 5.025 1.00 . A A . 16 LYS N 1 1 17 18040 1 1 16 LYS NZ N 1.716 9.743 2.555 1.00 . A A . 16 LYS NZ 1 1 17 18041 1 1 16 LYS O O 1.280 7.023 4.753 1.00 . A A . 16 LYS O 1 1 17 18042 1 1 17 ARG C C 2.865 3.410 6.107 1.00 . A A . 17 ARG C 1 1 17 18043 1 1 17 ARG CA C 2.324 4.836 6.063 1.00 . A A . 17 ARG CA 1 1 17 18044 1 1 17 ARG CB C 2.207 5.391 7.484 1.00 . A A . 17 ARG CB 1 1 17 18045 1 1 17 ARG CD C 3.370 6.069 9.606 1.00 . A A . 17 ARG CD 1 1 17 18046 1 1 17 ARG CG C 3.534 5.462 8.222 1.00 . A A . 17 ARG CG 1 1 17 18047 1 1 17 ARG CZ C 4.775 6.722 11.516 1.00 . A A . 17 ARG CZ 1 1 17 18048 1 1 17 ARG H H 0.462 4.079 5.364 1.00 . A A . 17 ARG H 1 1 17 18049 1 1 17 ARG HA H 3.010 5.451 5.501 1.00 . A A . 17 ARG HA 1 1 17 18050 1 1 17 ARG HB2 H 1.792 6.387 7.436 1.00 . A A . 17 ARG HB2 1 1 17 18051 1 1 17 ARG HB3 H 1.538 4.760 8.050 1.00 . A A . 17 ARG HB3 1 1 17 18052 1 1 17 ARG HD2 H 2.918 7.045 9.506 1.00 . A A . 17 ARG HD2 1 1 17 18053 1 1 17 ARG HD3 H 2.724 5.431 10.190 1.00 . A A . 17 ARG HD3 1 1 17 18054 1 1 17 ARG HE H 5.454 5.904 9.828 1.00 . A A . 17 ARG HE 1 1 17 18055 1 1 17 ARG HG2 H 3.933 4.465 8.324 1.00 . A A . 17 ARG HG2 1 1 17 18056 1 1 17 ARG HG3 H 4.220 6.070 7.650 1.00 . A A . 17 ARG HG3 1 1 17 18057 1 1 17 ARG HH11 H 2.799 7.077 11.751 1.00 . A A . 17 ARG HH11 1 1 17 18058 1 1 17 ARG HH12 H 3.801 7.531 13.090 1.00 . A A . 17 ARG HH12 1 1 17 18059 1 1 17 ARG HH21 H 6.782 6.498 11.585 1.00 . A A . 17 ARG HH21 1 1 17 18060 1 1 17 ARG HH22 H 6.066 7.200 12.996 1.00 . A A . 17 ARG HH22 1 1 17 18061 1 1 17 ARG N N 1.021 4.886 5.391 1.00 . A A . 17 ARG N 1 1 17 18062 1 1 17 ARG NE N 4.649 6.209 10.296 1.00 . A A . 17 ARG NE 1 1 17 18063 1 1 17 ARG NH1 N 3.704 7.145 12.173 1.00 . A A . 17 ARG NH1 1 1 17 18064 1 1 17 ARG NH2 N 5.972 6.814 12.078 1.00 . A A . 17 ARG NH2 1 1 17 18065 1 1 17 ARG O O 2.561 2.664 7.038 1.00 . A A . 17 ARG O 1 1 17 18066 1 1 18 GLY C C 5.507 1.481 4.414 1.00 . A A . 18 GLY C 1 1 17 18067 1 1 18 GLY CA C 4.178 1.661 5.113 1.00 . A A . 18 GLY CA 1 1 17 18068 1 1 18 GLY H H 3.915 3.644 4.399 1.00 . A A . 18 GLY H 1 1 17 18069 1 1 18 GLY HA2 H 4.285 1.336 6.135 1.00 . A A . 18 GLY HA2 1 1 17 18070 1 1 18 GLY HA3 H 3.456 1.031 4.632 1.00 . A A . 18 GLY HA3 1 1 17 18071 1 1 18 GLY N N 3.666 3.017 5.113 1.00 . A A . 18 GLY N 1 1 17 18072 1 1 18 GLY O O 6.469 2.195 4.683 1.00 . A A . 18 GLY O 1 1 17 18073 1 1 19 LYS C C 6.391 0.143 1.257 1.00 . A A . 19 LYS C 1 1 17 18074 1 1 19 LYS CA C 6.716 0.122 2.759 1.00 . A A . 19 LYS CA 1 1 17 18075 1 1 19 LYS CB C 7.128 -1.260 3.233 1.00 . A A . 19 LYS CB 1 1 17 18076 1 1 19 LYS CD C 7.930 -2.685 5.110 1.00 . A A . 19 LYS CD 1 1 17 18077 1 1 19 LYS CE C 8.408 -2.720 6.553 1.00 . A A . 19 LYS CE 1 1 17 18078 1 1 19 LYS CG C 7.633 -1.274 4.661 1.00 . A A . 19 LYS CG 1 1 17 18079 1 1 19 LYS H H 4.733 -0.058 3.404 1.00 . A A . 19 LYS H 1 1 17 18080 1 1 19 LYS HA H 7.505 0.819 2.962 1.00 . A A . 19 LYS HA 1 1 17 18081 1 1 19 LYS HB2 H 6.254 -1.900 3.173 1.00 . A A . 19 LYS HB2 1 1 17 18082 1 1 19 LYS HB3 H 7.900 -1.651 2.591 1.00 . A A . 19 LYS HB3 1 1 17 18083 1 1 19 LYS HD2 H 7.030 -3.269 5.022 1.00 . A A . 19 LYS HD2 1 1 17 18084 1 1 19 LYS HD3 H 8.695 -3.097 4.472 1.00 . A A . 19 LYS HD3 1 1 17 18085 1 1 19 LYS HE2 H 7.644 -2.288 7.181 1.00 . A A . 19 LYS HE2 1 1 17 18086 1 1 19 LYS HE3 H 8.570 -3.748 6.840 1.00 . A A . 19 LYS HE3 1 1 17 18087 1 1 19 LYS HG2 H 8.538 -0.688 4.719 1.00 . A A . 19 LYS HG2 1 1 17 18088 1 1 19 LYS HG3 H 6.880 -0.848 5.307 1.00 . A A . 19 LYS HG3 1 1 17 18089 1 1 19 LYS HZ1 H 9.537 -0.965 6.461 1.00 . A A . 19 LYS HZ1 1 1 17 18090 1 1 19 LYS HZ2 H 10.427 -2.370 6.150 1.00 . A A . 19 LYS HZ2 1 1 17 18091 1 1 19 LYS HZ3 H 9.970 -1.992 7.733 1.00 . A A . 19 LYS HZ3 1 1 17 18092 1 1 19 LYS N N 5.539 0.484 3.529 1.00 . A A . 19 LYS N 1 1 17 18093 1 1 19 LYS NZ N 9.674 -1.959 6.736 1.00 . A A . 19 LYS NZ 1 1 17 18094 1 1 19 LYS O O 5.984 1.168 0.730 1.00 . A A . 19 LYS O 1 1 17 18095 1 1 20 GLY C C 4.819 -1.457 -0.962 1.00 . A A . 20 GLY C 1 1 17 18096 1 1 20 GLY CA C 6.247 -1.034 -0.832 1.00 . A A . 20 GLY CA 1 1 17 18097 1 1 20 GLY H H 6.885 -1.773 1.008 1.00 . A A . 20 GLY H 1 1 17 18098 1 1 20 GLY HA2 H 6.394 -0.067 -1.282 1.00 . A A . 20 GLY HA2 1 1 17 18099 1 1 20 GLY HA3 H 6.871 -1.765 -1.311 1.00 . A A . 20 GLY HA3 1 1 17 18100 1 1 20 GLY N N 6.571 -0.977 0.566 1.00 . A A . 20 GLY N 1 1 17 18101 1 1 20 GLY O O 4.069 -0.975 -1.807 1.00 . A A . 20 GLY O 1 1 17 18102 1 1 21 LYS C C 2.755 -3.241 1.446 1.00 . A A . 21 LYS C 1 1 17 18103 1 1 21 LYS CA C 3.129 -2.918 -0.013 1.00 . A A . 21 LYS CA 1 1 17 18104 1 1 21 LYS CB C 2.979 -4.151 -0.902 1.00 . A A . 21 LYS CB 1 1 17 18105 1 1 21 LYS CD C 4.538 -4.073 -2.872 1.00 . A A . 21 LYS CD 1 1 17 18106 1 1 21 LYS CE C 4.686 -3.731 -4.346 1.00 . A A . 21 LYS CE 1 1 17 18107 1 1 21 LYS CG C 3.118 -3.835 -2.383 1.00 . A A . 21 LYS CG 1 1 17 18108 1 1 21 LYS H H 5.177 -2.784 0.460 1.00 . A A . 21 LYS H 1 1 17 18109 1 1 21 LYS HA H 2.462 -2.147 -0.375 1.00 . A A . 21 LYS HA 1 1 17 18110 1 1 21 LYS HB2 H 3.743 -4.866 -0.634 1.00 . A A . 21 LYS HB2 1 1 17 18111 1 1 21 LYS HB3 H 2.008 -4.590 -0.735 1.00 . A A . 21 LYS HB3 1 1 17 18112 1 1 21 LYS HD2 H 5.213 -3.456 -2.301 1.00 . A A . 21 LYS HD2 1 1 17 18113 1 1 21 LYS HD3 H 4.788 -5.114 -2.727 1.00 . A A . 21 LYS HD3 1 1 17 18114 1 1 21 LYS HE2 H 5.716 -3.881 -4.636 1.00 . A A . 21 LYS HE2 1 1 17 18115 1 1 21 LYS HE3 H 4.052 -4.389 -4.921 1.00 . A A . 21 LYS HE3 1 1 17 18116 1 1 21 LYS HG2 H 2.442 -4.463 -2.943 1.00 . A A . 21 LYS HG2 1 1 17 18117 1 1 21 LYS HG3 H 2.862 -2.798 -2.543 1.00 . A A . 21 LYS HG3 1 1 17 18118 1 1 21 LYS HZ1 H 4.878 -1.671 -4.052 1.00 . A A . 21 LYS HZ1 1 1 17 18119 1 1 21 LYS HZ2 H 3.300 -2.169 -4.409 1.00 . A A . 21 LYS HZ2 1 1 17 18120 1 1 21 LYS HZ3 H 4.464 -2.101 -5.635 1.00 . A A . 21 LYS HZ3 1 1 17 18121 1 1 21 LYS N N 4.476 -2.398 -0.104 1.00 . A A . 21 LYS N 1 1 17 18122 1 1 21 LYS NZ N 4.306 -2.320 -4.630 1.00 . A A . 21 LYS NZ 1 1 17 18123 1 1 21 LYS O O 1.680 -3.777 1.699 1.00 . A A . 21 LYS O 1 1 17 18124 1 1 22 ASP C C 2.574 -1.978 4.430 1.00 . A A . 22 ASP C 1 1 17 18125 1 1 22 ASP CA C 3.363 -3.117 3.820 1.00 . A A . 22 ASP CA 1 1 17 18126 1 1 22 ASP CB C 4.661 -3.238 4.599 1.00 . A A . 22 ASP CB 1 1 17 18127 1 1 22 ASP CG C 4.445 -3.683 6.034 1.00 . A A . 22 ASP CG 1 1 17 18128 1 1 22 ASP H H 4.449 -2.436 2.168 1.00 . A A . 22 ASP H 1 1 17 18129 1 1 22 ASP HA H 2.813 -4.013 3.900 1.00 . A A . 22 ASP HA 1 1 17 18130 1 1 22 ASP HB2 H 5.317 -3.932 4.115 1.00 . A A . 22 ASP HB2 1 1 17 18131 1 1 22 ASP HB3 H 5.124 -2.273 4.615 1.00 . A A . 22 ASP HB3 1 1 17 18132 1 1 22 ASP N N 3.625 -2.875 2.407 1.00 . A A . 22 ASP N 1 1 17 18133 1 1 22 ASP O O 2.404 -1.902 5.644 1.00 . A A . 22 ASP O 1 1 17 18134 1 1 22 ASP OD1 O 4.270 -2.806 6.906 1.00 . A A . 22 ASP OD1 1 1 17 18135 1 1 22 ASP OD2 O 4.454 -4.904 6.287 1.00 . A A . 22 ASP OD2 1 1 17 18136 1 1 23 VAL C C -0.123 -0.263 4.094 1.00 . A A . 23 VAL C 1 1 17 18137 1 1 23 VAL CA C 1.357 0.047 4.013 1.00 . A A . 23 VAL CA 1 1 17 18138 1 1 23 VAL CB C 1.583 1.207 3.046 1.00 . A A . 23 VAL CB 1 1 17 18139 1 1 23 VAL CG1 C 0.931 0.927 1.700 1.00 . A A . 23 VAL CG1 1 1 17 18140 1 1 23 VAL CG2 C 1.068 2.497 3.646 1.00 . A A . 23 VAL CG2 1 1 17 18141 1 1 23 VAL H H 2.308 -1.191 2.642 1.00 . A A . 23 VAL H 1 1 17 18142 1 1 23 VAL HA H 1.711 0.344 4.986 1.00 . A A . 23 VAL HA 1 1 17 18143 1 1 23 VAL HB H 2.653 1.303 2.891 1.00 . A A . 23 VAL HB 1 1 17 18144 1 1 23 VAL HG11 H 0.774 1.855 1.191 1.00 . A A . 23 VAL HG11 1 1 17 18145 1 1 23 VAL HG12 H -0.016 0.432 1.837 1.00 . A A . 23 VAL HG12 1 1 17 18146 1 1 23 VAL HG13 H 1.582 0.301 1.108 1.00 . A A . 23 VAL HG13 1 1 17 18147 1 1 23 VAL HG21 H 1.149 2.440 4.718 1.00 . A A . 23 VAL HG21 1 1 17 18148 1 1 23 VAL HG22 H 0.034 2.636 3.373 1.00 . A A . 23 VAL HG22 1 1 17 18149 1 1 23 VAL HG23 H 1.655 3.327 3.282 1.00 . A A . 23 VAL HG23 1 1 17 18150 1 1 23 VAL N N 2.111 -1.093 3.583 1.00 . A A . 23 VAL N 1 1 17 18151 1 1 23 VAL O O -0.638 -1.109 3.363 1.00 . A A . 23 VAL O 1 1 17 18152 1 1 24 GLU C C -2.991 1.443 4.569 1.00 . A A . 24 GLU C 1 1 17 18153 1 1 24 GLU CA C -2.227 0.258 5.135 1.00 . A A . 24 GLU CA 1 1 17 18154 1 1 24 GLU CB C -2.575 0.069 6.606 1.00 . A A . 24 GLU CB 1 1 17 18155 1 1 24 GLU CD C -2.288 0.879 8.983 1.00 . A A . 24 GLU CD 1 1 17 18156 1 1 24 GLU CG C -1.902 1.073 7.529 1.00 . A A . 24 GLU CG 1 1 17 18157 1 1 24 GLU H H -0.343 1.156 5.459 1.00 . A A . 24 GLU H 1 1 17 18158 1 1 24 GLU HA H -2.499 -0.640 4.590 1.00 . A A . 24 GLU HA 1 1 17 18159 1 1 24 GLU HB2 H -3.644 0.169 6.719 1.00 . A A . 24 GLU HB2 1 1 17 18160 1 1 24 GLU HB3 H -2.282 -0.924 6.908 1.00 . A A . 24 GLU HB3 1 1 17 18161 1 1 24 GLU HG2 H -0.833 0.963 7.439 1.00 . A A . 24 GLU HG2 1 1 17 18162 1 1 24 GLU HG3 H -2.188 2.069 7.225 1.00 . A A . 24 GLU HG3 1 1 17 18163 1 1 24 GLU N N -0.805 0.455 4.957 1.00 . A A . 24 GLU N 1 1 17 18164 1 1 24 GLU O O -3.111 2.486 5.211 1.00 . A A . 24 GLU O 1 1 17 18165 1 1 24 GLU OE1 O -1.701 -0.007 9.639 1.00 . A A . 24 GLU OE1 1 1 17 18166 1 1 24 GLU OE2 O -3.177 1.613 9.463 1.00 . A A . 24 GLU OE2 1 1 17 18167 1 1 25 TYR C C -5.738 2.012 2.735 1.00 . A A . 25 TYR C 1 1 17 18168 1 1 25 TYR CA C -4.247 2.319 2.694 1.00 . A A . 25 TYR CA 1 1 17 18169 1 1 25 TYR CB C -3.791 2.442 1.242 1.00 . A A . 25 TYR CB 1 1 17 18170 1 1 25 TYR CD1 C -1.368 3.105 1.467 1.00 . A A . 25 TYR CD1 1 1 17 18171 1 1 25 TYR CD2 C -2.852 4.645 0.429 1.00 . A A . 25 TYR CD2 1 1 17 18172 1 1 25 TYR CE1 C -0.320 3.991 1.304 1.00 . A A . 25 TYR CE1 1 1 17 18173 1 1 25 TYR CE2 C -1.810 5.539 0.264 1.00 . A A . 25 TYR CE2 1 1 17 18174 1 1 25 TYR CG C -2.649 3.414 1.033 1.00 . A A . 25 TYR CG 1 1 17 18175 1 1 25 TYR CZ C -0.557 5.195 0.595 1.00 . A A . 25 TYR CZ 1 1 17 18176 1 1 25 TYR H H -3.396 0.413 2.922 1.00 . A A . 25 TYR H 1 1 17 18177 1 1 25 TYR HA H -4.050 3.249 3.202 1.00 . A A . 25 TYR HA 1 1 17 18178 1 1 25 TYR HB2 H -3.467 1.472 0.894 1.00 . A A . 25 TYR HB2 1 1 17 18179 1 1 25 TYR HB3 H -4.624 2.774 0.640 1.00 . A A . 25 TYR HB3 1 1 17 18180 1 1 25 TYR HD1 H -1.195 2.157 1.933 1.00 . A A . 25 TYR HD1 1 1 17 18181 1 1 25 TYR HD2 H -3.843 4.905 0.086 1.00 . A A . 25 TYR HD2 1 1 17 18182 1 1 25 TYR HE1 H 0.668 3.727 1.650 1.00 . A A . 25 TYR HE1 1 1 17 18183 1 1 25 TYR HE2 H -1.986 6.490 -0.210 1.00 . A A . 25 TYR HE2 1 1 17 18184 1 1 25 TYR HH H 0.187 6.984 0.767 1.00 . A A . 25 TYR HH 1 1 17 18185 1 1 25 TYR N N -3.503 1.273 3.364 1.00 . A A . 25 TYR N 1 1 17 18186 1 1 25 TYR O O -6.138 0.854 2.744 1.00 . A A . 25 TYR O 1 1 17 18187 1 1 25 TYR OH O 0.490 6.100 0.550 1.00 . A A . 25 TYR OH 1 1 17 18188 1 1 26 LEU C C -8.491 2.803 1.352 1.00 . A A . 26 LEU C 1 1 17 18189 1 1 26 LEU CA C -7.991 2.884 2.772 1.00 . A A . 26 LEU CA 1 1 17 18190 1 1 26 LEU CB C -8.653 4.058 3.493 1.00 . A A . 26 LEU CB 1 1 17 18191 1 1 26 LEU CD1 C -10.845 4.749 4.506 1.00 . A A . 26 LEU CD1 1 1 17 18192 1 1 26 LEU CD2 C -10.465 5.017 2.045 1.00 . A A . 26 LEU CD2 1 1 17 18193 1 1 26 LEU CG C -10.162 4.175 3.277 1.00 . A A . 26 LEU CG 1 1 17 18194 1 1 26 LEU H H -6.186 3.944 2.722 1.00 . A A . 26 LEU H 1 1 17 18195 1 1 26 LEU HA H -8.225 1.962 3.282 1.00 . A A . 26 LEU HA 1 1 17 18196 1 1 26 LEU HB2 H -8.463 3.961 4.551 1.00 . A A . 26 LEU HB2 1 1 17 18197 1 1 26 LEU HB3 H -8.191 4.970 3.147 1.00 . A A . 26 LEU HB3 1 1 17 18198 1 1 26 LEU HD11 H -10.895 3.990 5.273 1.00 . A A . 26 LEU HD11 1 1 17 18199 1 1 26 LEU HD12 H -11.843 5.069 4.248 1.00 . A A . 26 LEU HD12 1 1 17 18200 1 1 26 LEU HD13 H -10.279 5.590 4.872 1.00 . A A . 26 LEU HD13 1 1 17 18201 1 1 26 LEU HD21 H -11.501 5.319 2.061 1.00 . A A . 26 LEU HD21 1 1 17 18202 1 1 26 LEU HD22 H -10.274 4.431 1.155 1.00 . A A . 26 LEU HD22 1 1 17 18203 1 1 26 LEU HD23 H -9.833 5.892 2.042 1.00 . A A . 26 LEU HD23 1 1 17 18204 1 1 26 LEU HG H -10.562 3.193 3.104 1.00 . A A . 26 LEU HG 1 1 17 18205 1 1 26 LEU N N -6.554 3.048 2.748 1.00 . A A . 26 LEU N 1 1 17 18206 1 1 26 LEU O O -7.824 3.269 0.436 1.00 . A A . 26 LEU O 1 1 17 18207 1 1 27 VAL C C -11.663 2.274 -0.301 1.00 . A A . 27 VAL C 1 1 17 18208 1 1 27 VAL CA C -10.156 2.117 -0.199 1.00 . A A . 27 VAL CA 1 1 17 18209 1 1 27 VAL CB C -9.671 0.834 -0.925 1.00 . A A . 27 VAL CB 1 1 17 18210 1 1 27 VAL CG1 C -8.520 0.167 -0.190 1.00 . A A . 27 VAL CG1 1 1 17 18211 1 1 27 VAL CG2 C -10.782 -0.179 -1.210 1.00 . A A . 27 VAL CG2 1 1 17 18212 1 1 27 VAL H H -10.144 1.818 1.892 1.00 . A A . 27 VAL H 1 1 17 18213 1 1 27 VAL HA H -9.722 2.933 -0.743 1.00 . A A . 27 VAL HA 1 1 17 18214 1 1 27 VAL HB H -9.290 1.175 -1.861 1.00 . A A . 27 VAL HB 1 1 17 18215 1 1 27 VAL HG11 H -8.837 -0.108 0.805 1.00 . A A . 27 VAL HG11 1 1 17 18216 1 1 27 VAL HG12 H -7.687 0.851 -0.126 1.00 . A A . 27 VAL HG12 1 1 17 18217 1 1 27 VAL HG13 H -8.217 -0.718 -0.728 1.00 . A A . 27 VAL HG13 1 1 17 18218 1 1 27 VAL HG21 H -11.490 0.251 -1.904 1.00 . A A . 27 VAL HG21 1 1 17 18219 1 1 27 VAL HG22 H -11.285 -0.427 -0.290 1.00 . A A . 27 VAL HG22 1 1 17 18220 1 1 27 VAL HG23 H -10.353 -1.069 -1.641 1.00 . A A . 27 VAL HG23 1 1 17 18221 1 1 27 VAL N N -9.649 2.211 1.147 1.00 . A A . 27 VAL N 1 1 17 18222 1 1 27 VAL O O -12.430 1.417 0.138 1.00 . A A . 27 VAL O 1 1 17 18223 1 1 28 ARG C C -13.770 2.958 -2.430 1.00 . A A . 28 ARG C 1 1 17 18224 1 1 28 ARG CA C -13.468 3.635 -1.127 1.00 . A A . 28 ARG CA 1 1 17 18225 1 1 28 ARG CB C -13.771 5.120 -1.227 1.00 . A A . 28 ARG CB 1 1 17 18226 1 1 28 ARG CD C -13.639 7.385 -0.140 1.00 . A A . 28 ARG CD 1 1 17 18227 1 1 28 ARG CG C -13.125 5.954 -0.133 1.00 . A A . 28 ARG CG 1 1 17 18228 1 1 28 ARG CZ C -13.254 9.483 1.086 1.00 . A A . 28 ARG CZ 1 1 17 18229 1 1 28 ARG H H -11.411 4.073 -1.123 1.00 . A A . 28 ARG H 1 1 17 18230 1 1 28 ARG HA H -14.057 3.177 -0.353 1.00 . A A . 28 ARG HA 1 1 17 18231 1 1 28 ARG HB2 H -13.416 5.465 -2.183 1.00 . A A . 28 ARG HB2 1 1 17 18232 1 1 28 ARG HB3 H -14.841 5.263 -1.179 1.00 . A A . 28 ARG HB3 1 1 17 18233 1 1 28 ARG HD2 H -13.374 7.847 -1.078 1.00 . A A . 28 ARG HD2 1 1 17 18234 1 1 28 ARG HD3 H -14.715 7.367 -0.041 1.00 . A A . 28 ARG HD3 1 1 17 18235 1 1 28 ARG HE H -12.542 7.700 1.625 1.00 . A A . 28 ARG HE 1 1 17 18236 1 1 28 ARG HG2 H -13.347 5.508 0.825 1.00 . A A . 28 ARG HG2 1 1 17 18237 1 1 28 ARG HG3 H -12.055 5.965 -0.287 1.00 . A A . 28 ARG HG3 1 1 17 18238 1 1 28 ARG HH11 H -14.370 9.670 -0.588 1.00 . A A . 28 ARG HH11 1 1 17 18239 1 1 28 ARG HH12 H -14.097 11.138 0.290 1.00 . A A . 28 ARG HH12 1 1 17 18240 1 1 28 ARG HH21 H -12.179 9.625 2.791 1.00 . A A . 28 ARG HH21 1 1 17 18241 1 1 28 ARG HH22 H -12.853 11.112 2.213 1.00 . A A . 28 ARG HH22 1 1 17 18242 1 1 28 ARG N N -12.070 3.393 -0.871 1.00 . A A . 28 ARG N 1 1 17 18243 1 1 28 ARG NE N -13.076 8.173 0.954 1.00 . A A . 28 ARG NE 1 1 17 18244 1 1 28 ARG NH1 N -13.966 10.152 0.190 1.00 . A A . 28 ARG NH1 1 1 17 18245 1 1 28 ARG NH2 N -12.718 10.126 2.114 1.00 . A A . 28 ARG NH2 1 1 17 18246 1 1 28 ARG O O -13.890 3.601 -3.472 1.00 . A A . 28 ARG O 1 1 17 18247 1 1 29 TRP C C -14.856 1.464 -4.593 1.00 . A A . 29 TRP C 1 1 17 18248 1 1 29 TRP CA C -14.111 0.763 -3.478 1.00 . A A . 29 TRP CA 1 1 17 18249 1 1 29 TRP CB C -14.907 -0.441 -3.005 1.00 . A A . 29 TRP CB 1 1 17 18250 1 1 29 TRP CD1 C -13.875 -1.777 -4.931 1.00 . A A . 29 TRP CD1 1 1 17 18251 1 1 29 TRP CD2 C -15.338 -2.937 -3.693 1.00 . A A . 29 TRP CD2 1 1 17 18252 1 1 29 TRP CE2 C -14.846 -3.776 -4.710 1.00 . A A . 29 TRP CE2 1 1 17 18253 1 1 29 TRP CE3 C -16.275 -3.450 -2.792 1.00 . A A . 29 TRP CE3 1 1 17 18254 1 1 29 TRP CG C -14.702 -1.662 -3.851 1.00 . A A . 29 TRP CG 1 1 17 18255 1 1 29 TRP CH2 C -16.175 -5.575 -3.953 1.00 . A A . 29 TRP CH2 1 1 17 18256 1 1 29 TRP CZ2 C -15.257 -5.100 -4.850 1.00 . A A . 29 TRP CZ2 1 1 17 18257 1 1 29 TRP CZ3 C -16.683 -4.765 -2.932 1.00 . A A . 29 TRP CZ3 1 1 17 18258 1 1 29 TRP H H -13.769 1.230 -1.457 1.00 . A A . 29 TRP H 1 1 17 18259 1 1 29 TRP HA H -13.155 0.423 -3.850 1.00 . A A . 29 TRP HA 1 1 17 18260 1 1 29 TRP HB2 H -14.609 -0.666 -1.996 1.00 . A A . 29 TRP HB2 1 1 17 18261 1 1 29 TRP HB3 H -15.958 -0.195 -3.018 1.00 . A A . 29 TRP HB3 1 1 17 18262 1 1 29 TRP HD1 H -13.252 -0.979 -5.310 1.00 . A A . 29 TRP HD1 1 1 17 18263 1 1 29 TRP HE1 H -13.453 -3.375 -6.228 1.00 . A A . 29 TRP HE1 1 1 17 18264 1 1 29 TRP HE3 H -16.678 -2.841 -1.997 1.00 . A A . 29 TRP HE3 1 1 17 18265 1 1 29 TRP HH2 H -16.522 -6.596 -4.025 1.00 . A A . 29 TRP HH2 1 1 17 18266 1 1 29 TRP HZ2 H -14.875 -5.737 -5.632 1.00 . A A . 29 TRP HZ2 1 1 17 18267 1 1 29 TRP HZ3 H -17.405 -5.179 -2.245 1.00 . A A . 29 TRP HZ3 1 1 17 18268 1 1 29 TRP N N -13.870 1.638 -2.340 1.00 . A A . 29 TRP N 1 1 17 18269 1 1 29 TRP NE1 N -13.954 -3.046 -5.452 1.00 . A A . 29 TRP NE1 1 1 17 18270 1 1 29 TRP O O -16.081 1.506 -4.606 1.00 . A A . 29 TRP O 1 1 17 18271 1 1 30 LYS C C -15.944 2.193 -7.142 1.00 . A A . 30 LYS C 1 1 17 18272 1 1 30 LYS CA C -14.611 2.784 -6.666 1.00 . A A . 30 LYS CA 1 1 17 18273 1 1 30 LYS CB C -13.605 2.747 -7.819 1.00 . A A . 30 LYS CB 1 1 17 18274 1 1 30 LYS CD C -12.920 3.661 -10.062 1.00 . A A . 30 LYS CD 1 1 17 18275 1 1 30 LYS CE C -13.314 4.561 -11.221 1.00 . A A . 30 LYS CE 1 1 17 18276 1 1 30 LYS CG C -13.983 3.659 -8.976 1.00 . A A . 30 LYS CG 1 1 17 18277 1 1 30 LYS H H -13.092 2.090 -5.316 1.00 . A A . 30 LYS H 1 1 17 18278 1 1 30 LYS HA H -14.774 3.813 -6.380 1.00 . A A . 30 LYS HA 1 1 17 18279 1 1 30 LYS HB2 H -12.635 3.046 -7.451 1.00 . A A . 30 LYS HB2 1 1 17 18280 1 1 30 LYS HB3 H -13.542 1.736 -8.192 1.00 . A A . 30 LYS HB3 1 1 17 18281 1 1 30 LYS HD2 H -11.990 4.016 -9.643 1.00 . A A . 30 LYS HD2 1 1 17 18282 1 1 30 LYS HD3 H -12.791 2.652 -10.428 1.00 . A A . 30 LYS HD3 1 1 17 18283 1 1 30 LYS HE2 H -12.510 4.572 -11.942 1.00 . A A . 30 LYS HE2 1 1 17 18284 1 1 30 LYS HE3 H -14.206 4.162 -11.683 1.00 . A A . 30 LYS HE3 1 1 17 18285 1 1 30 LYS HG2 H -14.914 3.317 -9.401 1.00 . A A . 30 LYS HG2 1 1 17 18286 1 1 30 LYS HG3 H -14.105 4.665 -8.603 1.00 . A A . 30 LYS HG3 1 1 17 18287 1 1 30 LYS HZ1 H -12.740 6.349 -10.306 1.00 . A A . 30 LYS HZ1 1 1 17 18288 1 1 30 LYS HZ2 H -14.376 5.969 -10.103 1.00 . A A . 30 LYS HZ2 1 1 17 18289 1 1 30 LYS HZ3 H -13.823 6.554 -11.590 1.00 . A A . 30 LYS HZ3 1 1 17 18290 1 1 30 LYS N N -14.074 2.073 -5.489 1.00 . A A . 30 LYS N 1 1 17 18291 1 1 30 LYS NZ N -13.582 5.955 -10.774 1.00 . A A . 30 LYS NZ 1 1 17 18292 1 1 30 LYS O O -16.826 2.918 -7.600 1.00 . A A . 30 LYS O 1 1 17 18293 1 1 31 ASP C C -17.890 -0.542 -6.216 1.00 . A A . 31 ASP C 1 1 17 18294 1 1 31 ASP CA C -17.299 0.184 -7.423 1.00 . A A . 31 ASP CA 1 1 17 18295 1 1 31 ASP CB C -17.022 -0.811 -8.551 1.00 . A A . 31 ASP CB 1 1 17 18296 1 1 31 ASP CG C -18.283 -1.496 -9.040 1.00 . A A . 31 ASP CG 1 1 17 18297 1 1 31 ASP H H -15.319 0.347 -6.695 1.00 . A A . 31 ASP H 1 1 17 18298 1 1 31 ASP HA H -18.004 0.925 -7.767 1.00 . A A . 31 ASP HA 1 1 17 18299 1 1 31 ASP HB2 H -16.575 -0.287 -9.383 1.00 . A A . 31 ASP HB2 1 1 17 18300 1 1 31 ASP HB3 H -16.337 -1.567 -8.196 1.00 . A A . 31 ASP HB3 1 1 17 18301 1 1 31 ASP N N -16.072 0.873 -7.036 1.00 . A A . 31 ASP N 1 1 17 18302 1 1 31 ASP O O -18.125 -1.750 -6.256 1.00 . A A . 31 ASP O 1 1 17 18303 1 1 31 ASP OD1 O -18.935 -0.954 -9.958 1.00 . A A . 31 ASP OD1 1 1 17 18304 1 1 31 ASP OD2 O -18.621 -2.572 -8.504 1.00 . A A . 31 ASP OD2 1 1 17 18305 1 1 32 GLY C C -19.664 0.552 -3.239 1.00 . A A . 32 GLY C 1 1 17 18306 1 1 32 GLY CA C -18.669 -0.364 -3.926 1.00 . A A . 32 GLY CA 1 1 17 18307 1 1 32 GLY H H -17.934 1.170 -5.182 1.00 . A A . 32 GLY H 1 1 17 18308 1 1 32 GLY HA2 H -19.158 -1.298 -4.164 1.00 . A A . 32 GLY HA2 1 1 17 18309 1 1 32 GLY HA3 H -17.851 -0.557 -3.243 1.00 . A A . 32 GLY HA3 1 1 17 18310 1 1 32 GLY N N -18.129 0.211 -5.144 1.00 . A A . 32 GLY N 1 1 17 18311 1 1 32 GLY O O -20.473 1.209 -3.895 1.00 . A A . 32 GLY O 1 1 17 18312 1 1 33 GLY C C -19.879 1.914 0.152 1.00 . A A . 33 GLY C 1 1 17 18313 1 1 33 GLY CA C -20.500 1.435 -1.147 1.00 . A A . 33 GLY CA 1 1 17 18314 1 1 33 GLY H H -18.934 0.044 -1.446 1.00 . A A . 33 GLY H 1 1 17 18315 1 1 33 GLY HA2 H -20.766 2.295 -1.745 1.00 . A A . 33 GLY HA2 1 1 17 18316 1 1 33 GLY HA3 H -21.396 0.876 -0.922 1.00 . A A . 33 GLY HA3 1 1 17 18317 1 1 33 GLY N N -19.599 0.592 -1.911 1.00 . A A . 33 GLY N 1 1 17 18318 1 1 33 GLY O O -19.976 3.092 0.497 1.00 . A A . 33 GLY O 1 1 17 18319 1 1 34 ASP C C -17.122 1.645 1.942 1.00 . A A . 34 ASP C 1 1 17 18320 1 1 34 ASP CA C -18.602 1.331 2.143 1.00 . A A . 34 ASP CA 1 1 17 18321 1 1 34 ASP CB C -18.755 0.176 3.135 1.00 . A A . 34 ASP CB 1 1 17 18322 1 1 34 ASP CG C -20.207 -0.158 3.412 1.00 . A A . 34 ASP CG 1 1 17 18323 1 1 34 ASP H H -19.198 0.075 0.546 1.00 . A A . 34 ASP H 1 1 17 18324 1 1 34 ASP HA H -19.092 2.206 2.542 1.00 . A A . 34 ASP HA 1 1 17 18325 1 1 34 ASP HB2 H -18.273 -0.702 2.733 1.00 . A A . 34 ASP HB2 1 1 17 18326 1 1 34 ASP HB3 H -18.282 0.446 4.067 1.00 . A A . 34 ASP HB3 1 1 17 18327 1 1 34 ASP N N -19.240 0.998 0.875 1.00 . A A . 34 ASP N 1 1 17 18328 1 1 34 ASP O O -16.636 1.701 0.812 1.00 . A A . 34 ASP O 1 1 17 18329 1 1 34 ASP OD1 O -20.804 -0.917 2.619 1.00 . A A . 34 ASP OD1 1 1 17 18330 1 1 34 ASP OD2 O -20.749 0.339 4.421 1.00 . A A . 34 ASP OD2 1 1 17 18331 1 1 35 CYS C C -14.242 1.511 4.158 1.00 . A A . 35 CYS C 1 1 17 18332 1 1 35 CYS CA C -14.985 2.158 2.992 1.00 . A A . 35 CYS CA 1 1 17 18333 1 1 35 CYS CB C -14.772 3.673 3.016 1.00 . A A . 35 CYS CB 1 1 17 18334 1 1 35 CYS H H -16.853 1.792 3.917 1.00 . A A . 35 CYS H 1 1 17 18335 1 1 35 CYS HA H -14.595 1.762 2.066 1.00 . A A . 35 CYS HA 1 1 17 18336 1 1 35 CYS HB2 H -15.135 4.065 3.953 1.00 . A A . 35 CYS HB2 1 1 17 18337 1 1 35 CYS HB3 H -13.716 3.882 2.928 1.00 . A A . 35 CYS HB3 1 1 17 18338 1 1 35 CYS HG H -16.624 5.238 2.225 1.00 . A A . 35 CYS HG 1 1 17 18339 1 1 35 CYS N N -16.410 1.848 3.046 1.00 . A A . 35 CYS N 1 1 17 18340 1 1 35 CYS O O -14.610 1.696 5.318 1.00 . A A . 35 CYS O 1 1 17 18341 1 1 35 CYS SG S -15.622 4.557 1.687 1.00 . A A . 35 CYS SG 1 1 17 18342 1 1 36 GLU C C -10.909 0.308 4.633 1.00 . A A . 36 GLU C 1 1 17 18343 1 1 36 GLU CA C -12.401 0.082 4.868 1.00 . A A . 36 GLU CA 1 1 17 18344 1 1 36 GLU CB C -12.711 -1.416 4.890 1.00 . A A . 36 GLU CB 1 1 17 18345 1 1 36 GLU CD C -14.461 -3.215 5.173 1.00 . A A . 36 GLU CD 1 1 17 18346 1 1 36 GLU CG C -14.158 -1.731 5.232 1.00 . A A . 36 GLU CG 1 1 17 18347 1 1 36 GLU H H -12.954 0.639 2.899 1.00 . A A . 36 GLU H 1 1 17 18348 1 1 36 GLU HA H -12.670 0.509 5.822 1.00 . A A . 36 GLU HA 1 1 17 18349 1 1 36 GLU HB2 H -12.495 -1.833 3.920 1.00 . A A . 36 GLU HB2 1 1 17 18350 1 1 36 GLU HB3 H -12.080 -1.891 5.626 1.00 . A A . 36 GLU HB3 1 1 17 18351 1 1 36 GLU HG2 H -14.364 -1.377 6.231 1.00 . A A . 36 GLU HG2 1 1 17 18352 1 1 36 GLU HG3 H -14.800 -1.219 4.530 1.00 . A A . 36 GLU HG3 1 1 17 18353 1 1 36 GLU N N -13.197 0.752 3.843 1.00 . A A . 36 GLU N 1 1 17 18354 1 1 36 GLU O O -10.516 0.976 3.677 1.00 . A A . 36 GLU O 1 1 17 18355 1 1 36 GLU OE1 O -14.022 -3.948 6.084 1.00 . A A . 36 GLU OE1 1 1 17 18356 1 1 36 GLU OE2 O -15.136 -3.646 4.215 1.00 . A A . 36 GLU OE2 1 1 17 18357 1 1 37 TRP C C -7.978 -1.330 4.789 1.00 . A A . 37 TRP C 1 1 17 18358 1 1 37 TRP CA C -8.636 -0.102 5.414 1.00 . A A . 37 TRP CA 1 1 17 18359 1 1 37 TRP CB C -8.044 0.135 6.803 1.00 . A A . 37 TRP CB 1 1 17 18360 1 1 37 TRP CD1 C -9.046 2.489 6.902 1.00 . A A . 37 TRP CD1 1 1 17 18361 1 1 37 TRP CD2 C -8.782 1.519 8.901 1.00 . A A . 37 TRP CD2 1 1 17 18362 1 1 37 TRP CE2 C -9.335 2.799 9.094 1.00 . A A . 37 TRP CE2 1 1 17 18363 1 1 37 TRP CE3 C -8.526 0.721 10.021 1.00 . A A . 37 TRP CE3 1 1 17 18364 1 1 37 TRP CG C -8.605 1.340 7.491 1.00 . A A . 37 TRP CG 1 1 17 18365 1 1 37 TRP CH2 C -9.377 2.494 11.436 1.00 . A A . 37 TRP CH2 1 1 17 18366 1 1 37 TRP CZ2 C -9.637 3.297 10.359 1.00 . A A . 37 TRP CZ2 1 1 17 18367 1 1 37 TRP CZ3 C -8.826 1.218 11.275 1.00 . A A . 37 TRP CZ3 1 1 17 18368 1 1 37 TRP H H -10.456 -0.777 6.252 1.00 . A A . 37 TRP H 1 1 17 18369 1 1 37 TRP HA H -8.432 0.757 4.795 1.00 . A A . 37 TRP HA 1 1 17 18370 1 1 37 TRP HB2 H -8.243 -0.727 7.423 1.00 . A A . 37 TRP HB2 1 1 17 18371 1 1 37 TRP HB3 H -6.978 0.265 6.713 1.00 . A A . 37 TRP HB3 1 1 17 18372 1 1 37 TRP HD1 H -9.043 2.664 5.836 1.00 . A A . 37 TRP HD1 1 1 17 18373 1 1 37 TRP HE1 H -9.853 4.263 7.683 1.00 . A A . 37 TRP HE1 1 1 17 18374 1 1 37 TRP HE3 H -8.102 -0.267 9.917 1.00 . A A . 37 TRP HE3 1 1 17 18375 1 1 37 TRP HH2 H -9.595 2.842 12.436 1.00 . A A . 37 TRP HH2 1 1 17 18376 1 1 37 TRP HZ2 H -10.063 4.280 10.499 1.00 . A A . 37 TRP HZ2 1 1 17 18377 1 1 37 TRP HZ3 H -8.634 0.614 12.151 1.00 . A A . 37 TRP HZ3 1 1 17 18378 1 1 37 TRP N N -10.083 -0.253 5.513 1.00 . A A . 37 TRP N 1 1 17 18379 1 1 37 TRP NE1 N -9.488 3.370 7.858 1.00 . A A . 37 TRP NE1 1 1 17 18380 1 1 37 TRP O O -8.476 -2.448 4.913 1.00 . A A . 37 TRP O 1 1 17 18381 1 1 38 VAL C C -5.084 -2.744 4.480 1.00 . A A . 38 VAL C 1 1 17 18382 1 1 38 VAL CA C -6.095 -2.180 3.491 1.00 . A A . 38 VAL CA 1 1 17 18383 1 1 38 VAL CB C -5.367 -1.693 2.219 1.00 . A A . 38 VAL CB 1 1 17 18384 1 1 38 VAL CG1 C -4.425 -2.760 1.673 1.00 . A A . 38 VAL CG1 1 1 17 18385 1 1 38 VAL CG2 C -6.377 -1.286 1.161 1.00 . A A . 38 VAL CG2 1 1 17 18386 1 1 38 VAL H H -6.522 -0.180 4.038 1.00 . A A . 38 VAL H 1 1 17 18387 1 1 38 VAL HA H -6.789 -2.960 3.213 1.00 . A A . 38 VAL HA 1 1 17 18388 1 1 38 VAL HB H -4.781 -0.828 2.474 1.00 . A A . 38 VAL HB 1 1 17 18389 1 1 38 VAL HG11 H -3.630 -2.936 2.382 1.00 . A A . 38 VAL HG11 1 1 17 18390 1 1 38 VAL HG12 H -4.003 -2.423 0.741 1.00 . A A . 38 VAL HG12 1 1 17 18391 1 1 38 VAL HG13 H -4.972 -3.677 1.509 1.00 . A A . 38 VAL HG13 1 1 17 18392 1 1 38 VAL HG21 H -5.887 -0.691 0.405 1.00 . A A . 38 VAL HG21 1 1 17 18393 1 1 38 VAL HG22 H -7.163 -0.707 1.621 1.00 . A A . 38 VAL HG22 1 1 17 18394 1 1 38 VAL HG23 H -6.798 -2.170 0.707 1.00 . A A . 38 VAL HG23 1 1 17 18395 1 1 38 VAL N N -6.851 -1.102 4.119 1.00 . A A . 38 VAL N 1 1 17 18396 1 1 38 VAL O O -4.767 -2.107 5.485 1.00 . A A . 38 VAL O 1 1 17 18397 1 1 39 LYS C C -2.220 -4.008 4.941 1.00 . A A . 39 LYS C 1 1 17 18398 1 1 39 LYS CA C -3.623 -4.572 5.086 1.00 . A A . 39 LYS CA 1 1 17 18399 1 1 39 LYS CB C -3.617 -6.086 4.866 1.00 . A A . 39 LYS CB 1 1 17 18400 1 1 39 LYS CD C -2.815 -8.345 5.615 1.00 . A A . 39 LYS CD 1 1 17 18401 1 1 39 LYS CE C -1.981 -9.109 6.631 1.00 . A A . 39 LYS CE 1 1 17 18402 1 1 39 LYS CG C -2.739 -6.844 5.847 1.00 . A A . 39 LYS CG 1 1 17 18403 1 1 39 LYS H H -4.861 -4.401 3.382 1.00 . A A . 39 LYS H 1 1 17 18404 1 1 39 LYS HA H -3.949 -4.366 6.083 1.00 . A A . 39 LYS HA 1 1 17 18405 1 1 39 LYS HB2 H -4.627 -6.455 4.961 1.00 . A A . 39 LYS HB2 1 1 17 18406 1 1 39 LYS HB3 H -3.262 -6.290 3.867 1.00 . A A . 39 LYS HB3 1 1 17 18407 1 1 39 LYS HD2 H -3.844 -8.660 5.700 1.00 . A A . 39 LYS HD2 1 1 17 18408 1 1 39 LYS HD3 H -2.449 -8.565 4.623 1.00 . A A . 39 LYS HD3 1 1 17 18409 1 1 39 LYS HE2 H -0.952 -8.795 6.542 1.00 . A A . 39 LYS HE2 1 1 17 18410 1 1 39 LYS HE3 H -2.343 -8.878 7.622 1.00 . A A . 39 LYS HE3 1 1 17 18411 1 1 39 LYS HG2 H -1.715 -6.523 5.723 1.00 . A A . 39 LYS HG2 1 1 17 18412 1 1 39 LYS HG3 H -3.068 -6.627 6.853 1.00 . A A . 39 LYS HG3 1 1 17 18413 1 1 39 LYS HZ1 H -1.693 -10.826 5.475 1.00 . A A . 39 LYS HZ1 1 1 17 18414 1 1 39 LYS HZ2 H -3.043 -10.903 6.491 1.00 . A A . 39 LYS HZ2 1 1 17 18415 1 1 39 LYS HZ3 H -1.489 -11.076 7.135 1.00 . A A . 39 LYS HZ3 1 1 17 18416 1 1 39 LYS N N -4.578 -3.936 4.197 1.00 . A A . 39 LYS N 1 1 17 18417 1 1 39 LYS NZ N -2.057 -10.581 6.418 1.00 . A A . 39 LYS NZ 1 1 17 18418 1 1 39 LYS O O -1.508 -4.300 3.978 1.00 . A A . 39 LYS O 1 1 17 18419 1 1 40 GLY C C 0.488 -3.449 6.685 1.00 . A A . 40 GLY C 1 1 17 18420 1 1 40 GLY CA C -0.515 -2.608 5.928 1.00 . A A . 40 GLY CA 1 1 17 18421 1 1 40 GLY H H -2.467 -2.979 6.633 1.00 . A A . 40 GLY H 1 1 17 18422 1 1 40 GLY HA2 H -0.176 -2.516 4.911 1.00 . A A . 40 GLY HA2 1 1 17 18423 1 1 40 GLY HA3 H -0.562 -1.628 6.378 1.00 . A A . 40 GLY HA3 1 1 17 18424 1 1 40 GLY N N -1.836 -3.196 5.919 1.00 . A A . 40 GLY N 1 1 17 18425 1 1 40 GLY O O 1.261 -2.939 7.496 1.00 . A A . 40 GLY O 1 1 17 18426 1 1 41 VAL C C 2.233 -6.357 5.980 1.00 . A A . 41 VAL C 1 1 17 18427 1 1 41 VAL CA C 1.384 -5.676 7.050 1.00 . A A . 41 VAL CA 1 1 17 18428 1 1 41 VAL CB C 0.663 -6.771 7.858 1.00 . A A . 41 VAL CB 1 1 17 18429 1 1 41 VAL CG1 C 1.577 -7.327 8.938 1.00 . A A . 41 VAL CG1 1 1 17 18430 1 1 41 VAL CG2 C -0.632 -6.247 8.464 1.00 . A A . 41 VAL CG2 1 1 17 18431 1 1 41 VAL H H -0.215 -5.090 5.803 1.00 . A A . 41 VAL H 1 1 17 18432 1 1 41 VAL HA H 2.028 -5.121 7.716 1.00 . A A . 41 VAL HA 1 1 17 18433 1 1 41 VAL HB H 0.422 -7.577 7.181 1.00 . A A . 41 VAL HB 1 1 17 18434 1 1 41 VAL HG11 H 2.455 -7.758 8.480 1.00 . A A . 41 VAL HG11 1 1 17 18435 1 1 41 VAL HG12 H 1.053 -8.089 9.497 1.00 . A A . 41 VAL HG12 1 1 17 18436 1 1 41 VAL HG13 H 1.873 -6.531 9.605 1.00 . A A . 41 VAL HG13 1 1 17 18437 1 1 41 VAL HG21 H -1.119 -7.040 9.015 1.00 . A A . 41 VAL HG21 1 1 17 18438 1 1 41 VAL HG22 H -1.286 -5.904 7.676 1.00 . A A . 41 VAL HG22 1 1 17 18439 1 1 41 VAL HG23 H -0.412 -5.428 9.131 1.00 . A A . 41 VAL HG23 1 1 17 18440 1 1 41 VAL N N 0.455 -4.746 6.430 1.00 . A A . 41 VAL N 1 1 17 18441 1 1 41 VAL O O 3.080 -7.193 6.292 1.00 . A A . 41 VAL O 1 1 17 18442 1 1 42 HIS C C 4.155 -6.071 3.589 1.00 . A A . 42 HIS C 1 1 17 18443 1 1 42 HIS CA C 2.741 -6.587 3.615 1.00 . A A . 42 HIS CA 1 1 17 18444 1 1 42 HIS CB C 2.011 -6.344 2.298 1.00 . A A . 42 HIS CB 1 1 17 18445 1 1 42 HIS CD2 C 2.182 -8.596 1.016 1.00 . A A . 42 HIS CD2 1 1 17 18446 1 1 42 HIS CE1 C 0.050 -9.109 0.992 1.00 . A A . 42 HIS CE1 1 1 17 18447 1 1 42 HIS CG C 1.517 -7.602 1.652 1.00 . A A . 42 HIS CG 1 1 17 18448 1 1 42 HIS H H 1.328 -5.310 4.517 1.00 . A A . 42 HIS H 1 1 17 18449 1 1 42 HIS HA H 2.802 -7.633 3.794 1.00 . A A . 42 HIS HA 1 1 17 18450 1 1 42 HIS HB2 H 1.148 -5.716 2.490 1.00 . A A . 42 HIS HB2 1 1 17 18451 1 1 42 HIS HB3 H 2.672 -5.845 1.606 1.00 . A A . 42 HIS HB3 1 1 17 18452 1 1 42 HIS HD1 H -0.555 -7.433 1.996 1.00 . A A . 42 HIS HD1 1 1 17 18453 1 1 42 HIS HD2 H 3.248 -8.650 0.849 1.00 . A A . 42 HIS HD2 1 1 17 18454 1 1 42 HIS HE1 H -0.880 -9.628 0.815 1.00 . A A . 42 HIS HE1 1 1 17 18455 1 1 42 HIS HE2 H 1.427 -10.314 0.072 1.00 . A A . 42 HIS HE2 1 1 17 18456 1 1 42 HIS N N 2.001 -5.996 4.715 1.00 . A A . 42 HIS N 1 1 17 18457 1 1 42 HIS ND1 N 0.184 -7.953 1.618 1.00 . A A . 42 HIS ND1 1 1 17 18458 1 1 42 HIS NE2 N 1.247 -9.519 0.617 1.00 . A A . 42 HIS NE2 1 1 17 18459 1 1 42 HIS O O 4.532 -5.270 2.738 1.00 . A A . 42 HIS O 1 1 17 18460 1 1 43 VAL C C 7.169 -6.418 3.464 1.00 . A A . 43 VAL C 1 1 17 18461 1 1 43 VAL CA C 6.329 -6.257 4.713 1.00 . A A . 43 VAL CA 1 1 17 18462 1 1 43 VAL CB C 6.961 -7.087 5.849 1.00 . A A . 43 VAL CB 1 1 17 18463 1 1 43 VAL CG1 C 8.403 -6.665 6.089 1.00 . A A . 43 VAL CG1 1 1 17 18464 1 1 43 VAL CG2 C 6.142 -6.955 7.124 1.00 . A A . 43 VAL CG2 1 1 17 18465 1 1 43 VAL H H 4.531 -7.293 5.114 1.00 . A A . 43 VAL H 1 1 17 18466 1 1 43 VAL HA H 6.361 -5.228 5.002 1.00 . A A . 43 VAL HA 1 1 17 18467 1 1 43 VAL HB H 6.958 -8.125 5.552 1.00 . A A . 43 VAL HB 1 1 17 18468 1 1 43 VAL HG11 H 8.427 -5.636 6.416 1.00 . A A . 43 VAL HG11 1 1 17 18469 1 1 43 VAL HG12 H 8.964 -6.763 5.172 1.00 . A A . 43 VAL HG12 1 1 17 18470 1 1 43 VAL HG13 H 8.840 -7.295 6.849 1.00 . A A . 43 VAL HG13 1 1 17 18471 1 1 43 VAL HG21 H 6.062 -5.912 7.395 1.00 . A A . 43 VAL HG21 1 1 17 18472 1 1 43 VAL HG22 H 6.627 -7.497 7.921 1.00 . A A . 43 VAL HG22 1 1 17 18473 1 1 43 VAL HG23 H 5.155 -7.361 6.961 1.00 . A A . 43 VAL HG23 1 1 17 18474 1 1 43 VAL N N 4.932 -6.622 4.517 1.00 . A A . 43 VAL N 1 1 17 18475 1 1 43 VAL O O 7.943 -7.366 3.331 1.00 . A A . 43 VAL O 1 1 17 18476 1 1 44 ALA C C 9.043 -4.625 1.557 1.00 . A A . 44 ALA C 1 1 17 18477 1 1 44 ALA CA C 7.788 -5.447 1.334 1.00 . A A . 44 ALA CA 1 1 17 18478 1 1 44 ALA CB C 6.964 -4.885 0.188 1.00 . A A . 44 ALA CB 1 1 17 18479 1 1 44 ALA H H 6.360 -4.758 2.715 1.00 . A A . 44 ALA H 1 1 17 18480 1 1 44 ALA HA H 8.073 -6.460 1.099 1.00 . A A . 44 ALA HA 1 1 17 18481 1 1 44 ALA HB1 H 7.257 -5.361 -0.731 1.00 . A A . 44 ALA HB1 1 1 17 18482 1 1 44 ALA HB2 H 7.126 -3.820 0.115 1.00 . A A . 44 ALA HB2 1 1 17 18483 1 1 44 ALA HB3 H 5.917 -5.076 0.373 1.00 . A A . 44 ALA HB3 1 1 17 18484 1 1 44 ALA N N 7.017 -5.467 2.556 1.00 . A A . 44 ALA N 1 1 17 18485 1 1 44 ALA O O 9.375 -3.736 0.772 1.00 . A A . 44 ALA O 1 1 17 18486 1 1 45 GLU C C 11.879 -4.098 1.824 1.00 . A A . 45 GLU C 1 1 17 18487 1 1 45 GLU CA C 10.954 -4.230 3.018 1.00 . A A . 45 GLU CA 1 1 17 18488 1 1 45 GLU CB C 11.674 -4.953 4.159 1.00 . A A . 45 GLU CB 1 1 17 18489 1 1 45 GLU CD C 11.236 -7.300 3.321 1.00 . A A . 45 GLU CD 1 1 17 18490 1 1 45 GLU CG C 12.280 -6.287 3.752 1.00 . A A . 45 GLU CG 1 1 17 18491 1 1 45 GLU H H 9.431 -5.682 3.199 1.00 . A A . 45 GLU H 1 1 17 18492 1 1 45 GLU HA H 10.670 -3.242 3.345 1.00 . A A . 45 GLU HA 1 1 17 18493 1 1 45 GLU HB2 H 12.467 -4.319 4.528 1.00 . A A . 45 GLU HB2 1 1 17 18494 1 1 45 GLU HB3 H 10.969 -5.131 4.958 1.00 . A A . 45 GLU HB3 1 1 17 18495 1 1 45 GLU HG2 H 12.958 -6.122 2.928 1.00 . A A . 45 GLU HG2 1 1 17 18496 1 1 45 GLU HG3 H 12.827 -6.691 4.592 1.00 . A A . 45 GLU HG3 1 1 17 18497 1 1 45 GLU N N 9.737 -4.939 2.645 1.00 . A A . 45 GLU N 1 1 17 18498 1 1 45 GLU O O 12.662 -3.163 1.734 1.00 . A A . 45 GLU O 1 1 17 18499 1 1 45 GLU OE1 O 10.878 -7.310 2.126 1.00 . A A . 45 GLU OE1 1 1 17 18500 1 1 45 GLU OE2 O 10.776 -8.080 4.181 1.00 . A A . 45 GLU OE2 1 1 17 18501 1 1 46 ASP C C 12.017 -4.015 -1.274 1.00 . A A . 46 ASP C 1 1 17 18502 1 1 46 ASP CA C 12.589 -5.019 -0.298 1.00 . A A . 46 ASP CA 1 1 17 18503 1 1 46 ASP CB C 12.639 -6.403 -0.931 1.00 . A A . 46 ASP CB 1 1 17 18504 1 1 46 ASP CG C 13.603 -6.474 -2.099 1.00 . A A . 46 ASP CG 1 1 17 18505 1 1 46 ASP H H 11.121 -5.768 1.043 1.00 . A A . 46 ASP H 1 1 17 18506 1 1 46 ASP HA H 13.590 -4.705 -0.036 1.00 . A A . 46 ASP HA 1 1 17 18507 1 1 46 ASP HB2 H 12.950 -7.117 -0.186 1.00 . A A . 46 ASP HB2 1 1 17 18508 1 1 46 ASP HB3 H 11.652 -6.662 -1.284 1.00 . A A . 46 ASP HB3 1 1 17 18509 1 1 46 ASP N N 11.772 -5.042 0.908 1.00 . A A . 46 ASP N 1 1 17 18510 1 1 46 ASP O O 12.743 -3.230 -1.866 1.00 . A A . 46 ASP O 1 1 17 18511 1 1 46 ASP OD1 O 13.266 -5.945 -3.179 1.00 . A A . 46 ASP OD1 1 1 17 18512 1 1 46 ASP OD2 O 14.694 -7.059 -1.934 1.00 . A A . 46 ASP OD2 1 1 17 18513 1 1 47 VAL C C 10.205 -1.684 -1.832 1.00 . A A . 47 VAL C 1 1 17 18514 1 1 47 VAL CA C 10.046 -3.109 -2.321 1.00 . A A . 47 VAL CA 1 1 17 18515 1 1 47 VAL CB C 8.549 -3.409 -2.434 1.00 . A A . 47 VAL CB 1 1 17 18516 1 1 47 VAL CG1 C 7.885 -2.465 -3.427 1.00 . A A . 47 VAL CG1 1 1 17 18517 1 1 47 VAL CG2 C 8.324 -4.859 -2.830 1.00 . A A . 47 VAL CG2 1 1 17 18518 1 1 47 VAL H H 10.168 -4.678 -0.918 1.00 . A A . 47 VAL H 1 1 17 18519 1 1 47 VAL HA H 10.495 -3.198 -3.299 1.00 . A A . 47 VAL HA 1 1 17 18520 1 1 47 VAL HB H 8.107 -3.243 -1.459 1.00 . A A . 47 VAL HB 1 1 17 18521 1 1 47 VAL HG11 H 8.334 -2.594 -4.400 1.00 . A A . 47 VAL HG11 1 1 17 18522 1 1 47 VAL HG12 H 8.022 -1.444 -3.099 1.00 . A A . 47 VAL HG12 1 1 17 18523 1 1 47 VAL HG13 H 6.829 -2.687 -3.484 1.00 . A A . 47 VAL HG13 1 1 17 18524 1 1 47 VAL HG21 H 8.817 -5.507 -2.120 1.00 . A A . 47 VAL HG21 1 1 17 18525 1 1 47 VAL HG22 H 8.731 -5.030 -3.816 1.00 . A A . 47 VAL HG22 1 1 17 18526 1 1 47 VAL HG23 H 7.265 -5.071 -2.836 1.00 . A A . 47 VAL HG23 1 1 17 18527 1 1 47 VAL N N 10.706 -4.034 -1.425 1.00 . A A . 47 VAL N 1 1 17 18528 1 1 47 VAL O O 10.144 -0.770 -2.632 1.00 . A A . 47 VAL O 1 1 17 18529 1 1 48 ALA C C 11.994 0.122 0.383 1.00 . A A . 48 ALA C 1 1 17 18530 1 1 48 ALA CA C 10.523 -0.246 0.174 1.00 . A A . 48 ALA CA 1 1 17 18531 1 1 48 ALA CB C 9.805 -0.274 1.513 1.00 . A A . 48 ALA CB 1 1 17 18532 1 1 48 ALA H H 10.364 -2.338 0.035 1.00 . A A . 48 ALA H 1 1 17 18533 1 1 48 ALA HA H 10.059 0.524 -0.431 1.00 . A A . 48 ALA HA 1 1 17 18534 1 1 48 ALA HB1 H 8.749 -0.428 1.350 1.00 . A A . 48 ALA HB1 1 1 17 18535 1 1 48 ALA HB2 H 9.957 0.665 2.024 1.00 . A A . 48 ALA HB2 1 1 17 18536 1 1 48 ALA HB3 H 10.197 -1.080 2.116 1.00 . A A . 48 ALA HB3 1 1 17 18537 1 1 48 ALA N N 10.356 -1.538 -0.507 1.00 . A A . 48 ALA N 1 1 17 18538 1 1 48 ALA O O 12.446 1.174 -0.073 1.00 . A A . 48 ALA O 1 1 17 18539 1 1 49 LYS C C 14.899 -0.124 0.083 1.00 . A A . 49 LYS C 1 1 17 18540 1 1 49 LYS CA C 14.156 -0.476 1.360 1.00 . A A . 49 LYS CA 1 1 17 18541 1 1 49 LYS CB C 14.817 -1.681 2.031 1.00 . A A . 49 LYS CB 1 1 17 18542 1 1 49 LYS CD C 16.888 -2.690 3.036 1.00 . A A . 49 LYS CD 1 1 17 18543 1 1 49 LYS CE C 16.821 -3.916 2.140 1.00 . A A . 49 LYS CE 1 1 17 18544 1 1 49 LYS CG C 16.287 -1.469 2.355 1.00 . A A . 49 LYS CG 1 1 17 18545 1 1 49 LYS H H 12.342 -1.590 1.380 1.00 . A A . 49 LYS H 1 1 17 18546 1 1 49 LYS HA H 14.202 0.369 2.031 1.00 . A A . 49 LYS HA 1 1 17 18547 1 1 49 LYS HB2 H 14.296 -1.896 2.952 1.00 . A A . 49 LYS HB2 1 1 17 18548 1 1 49 LYS HB3 H 14.735 -2.534 1.375 1.00 . A A . 49 LYS HB3 1 1 17 18549 1 1 49 LYS HD2 H 17.921 -2.487 3.275 1.00 . A A . 49 LYS HD2 1 1 17 18550 1 1 49 LYS HD3 H 16.339 -2.889 3.945 1.00 . A A . 49 LYS HD3 1 1 17 18551 1 1 49 LYS HE2 H 15.785 -4.135 1.927 1.00 . A A . 49 LYS HE2 1 1 17 18552 1 1 49 LYS HE3 H 17.340 -3.702 1.218 1.00 . A A . 49 LYS HE3 1 1 17 18553 1 1 49 LYS HG2 H 16.826 -1.281 1.439 1.00 . A A . 49 LYS HG2 1 1 17 18554 1 1 49 LYS HG3 H 16.383 -0.619 3.013 1.00 . A A . 49 LYS HG3 1 1 17 18555 1 1 49 LYS HZ1 H 16.956 -5.331 3.672 1.00 . A A . 49 LYS HZ1 1 1 17 18556 1 1 49 LYS HZ2 H 18.446 -4.921 2.983 1.00 . A A . 49 LYS HZ2 1 1 17 18557 1 1 49 LYS HZ3 H 17.377 -5.930 2.148 1.00 . A A . 49 LYS HZ3 1 1 17 18558 1 1 49 LYS N N 12.742 -0.744 1.076 1.00 . A A . 49 LYS N 1 1 17 18559 1 1 49 LYS NZ N 17.444 -5.107 2.781 1.00 . A A . 49 LYS NZ 1 1 17 18560 1 1 49 LYS O O 15.676 0.827 0.040 1.00 . A A . 49 LYS O 1 1 17 18561 1 1 50 ASP C C 14.542 0.473 -2.957 1.00 . A A . 50 ASP C 1 1 17 18562 1 1 50 ASP CA C 15.278 -0.661 -2.243 1.00 . A A . 50 ASP CA 1 1 17 18563 1 1 50 ASP CB C 15.276 -1.950 -3.075 1.00 . A A . 50 ASP CB 1 1 17 18564 1 1 50 ASP CG C 15.584 -1.713 -4.543 1.00 . A A . 50 ASP CG 1 1 17 18565 1 1 50 ASP H H 14.007 -1.624 -0.864 1.00 . A A . 50 ASP H 1 1 17 18566 1 1 50 ASP HA H 16.299 -0.357 -2.061 1.00 . A A . 50 ASP HA 1 1 17 18567 1 1 50 ASP HB2 H 16.025 -2.621 -2.679 1.00 . A A . 50 ASP HB2 1 1 17 18568 1 1 50 ASP HB3 H 14.310 -2.419 -2.995 1.00 . A A . 50 ASP HB3 1 1 17 18569 1 1 50 ASP N N 14.652 -0.897 -0.956 1.00 . A A . 50 ASP N 1 1 17 18570 1 1 50 ASP O O 15.075 1.107 -3.867 1.00 . A A . 50 ASP O 1 1 17 18571 1 1 50 ASP OD1 O 14.652 -1.358 -5.295 1.00 . A A . 50 ASP OD1 1 1 17 18572 1 1 50 ASP OD2 O 16.757 -1.883 -4.939 1.00 . A A . 50 ASP OD2 1 1 17 18573 1 1 51 TYR C C 13.078 3.110 -2.767 1.00 . A A . 51 TYR C 1 1 17 18574 1 1 51 TYR CA C 12.477 1.759 -3.065 1.00 . A A . 51 TYR CA 1 1 17 18575 1 1 51 TYR CB C 11.116 1.683 -2.399 1.00 . A A . 51 TYR CB 1 1 17 18576 1 1 51 TYR CD1 C 10.070 2.321 -4.622 1.00 . A A . 51 TYR CD1 1 1 17 18577 1 1 51 TYR CD2 C 8.666 1.380 -2.940 1.00 . A A . 51 TYR CD2 1 1 17 18578 1 1 51 TYR CE1 C 8.985 2.415 -5.474 1.00 . A A . 51 TYR CE1 1 1 17 18579 1 1 51 TYR CE2 C 7.581 1.471 -3.787 1.00 . A A . 51 TYR CE2 1 1 17 18580 1 1 51 TYR CG C 9.930 1.802 -3.338 1.00 . A A . 51 TYR CG 1 1 17 18581 1 1 51 TYR CZ C 7.746 1.989 -5.053 1.00 . A A . 51 TYR CZ 1 1 17 18582 1 1 51 TYR H H 12.921 0.152 -1.834 1.00 . A A . 51 TYR H 1 1 17 18583 1 1 51 TYR HA H 12.372 1.604 -4.117 1.00 . A A . 51 TYR HA 1 1 17 18584 1 1 51 TYR HB2 H 11.061 0.744 -1.917 1.00 . A A . 51 TYR HB2 1 1 17 18585 1 1 51 TYR HB3 H 11.035 2.449 -1.647 1.00 . A A . 51 TYR HB3 1 1 17 18586 1 1 51 TYR HD1 H 11.039 2.658 -4.952 1.00 . A A . 51 TYR HD1 1 1 17 18587 1 1 51 TYR HD2 H 8.535 0.972 -1.948 1.00 . A A . 51 TYR HD2 1 1 17 18588 1 1 51 TYR HE1 H 9.114 2.815 -6.466 1.00 . A A . 51 TYR HE1 1 1 17 18589 1 1 51 TYR HE2 H 6.614 1.134 -3.457 1.00 . A A . 51 TYR HE2 1 1 17 18590 1 1 51 TYR HH H 5.915 2.448 -5.423 1.00 . A A . 51 TYR HH 1 1 17 18591 1 1 51 TYR N N 13.303 0.711 -2.527 1.00 . A A . 51 TYR N 1 1 17 18592 1 1 51 TYR O O 13.555 3.813 -3.657 1.00 . A A . 51 TYR O 1 1 17 18593 1 1 51 TYR OH O 6.665 2.081 -5.899 1.00 . A A . 51 TYR OH 1 1 17 18594 1 1 52 GLU C C 15.076 4.694 -0.792 1.00 . A A . 52 GLU C 1 1 17 18595 1 1 52 GLU CA C 13.569 4.715 -1.016 1.00 . A A . 52 GLU CA 1 1 17 18596 1 1 52 GLU CB C 12.854 5.124 0.275 1.00 . A A . 52 GLU CB 1 1 17 18597 1 1 52 GLU CD C 12.475 4.675 2.730 1.00 . A A . 52 GLU CD 1 1 17 18598 1 1 52 GLU CG C 13.241 4.284 1.482 1.00 . A A . 52 GLU CG 1 1 17 18599 1 1 52 GLU H H 12.763 2.778 -0.821 1.00 . A A . 52 GLU H 1 1 17 18600 1 1 52 GLU HA H 13.332 5.426 -1.778 1.00 . A A . 52 GLU HA 1 1 17 18601 1 1 52 GLU HB2 H 13.090 6.155 0.492 1.00 . A A . 52 GLU HB2 1 1 17 18602 1 1 52 GLU HB3 H 11.789 5.032 0.126 1.00 . A A . 52 GLU HB3 1 1 17 18603 1 1 52 GLU HG2 H 13.038 3.247 1.265 1.00 . A A . 52 GLU HG2 1 1 17 18604 1 1 52 GLU HG3 H 14.296 4.412 1.672 1.00 . A A . 52 GLU HG3 1 1 17 18605 1 1 52 GLU N N 13.080 3.436 -1.479 1.00 . A A . 52 GLU N 1 1 17 18606 1 1 52 GLU O O 15.796 5.582 -1.248 1.00 . A A . 52 GLU O 1 1 17 18607 1 1 52 GLU OE1 O 12.835 5.696 3.352 1.00 . A A . 52 GLU OE1 1 1 17 18608 1 1 52 GLU OE2 O 11.516 3.959 3.087 1.00 . A A . 52 GLU OE2 1 1 17 18609 1 1 53 ASP C C 17.739 3.009 -0.978 1.00 . A A . 53 ASP C 1 1 17 18610 1 1 53 ASP CA C 16.956 3.530 0.223 1.00 . A A . 53 ASP CA 1 1 17 18611 1 1 53 ASP CB C 17.126 2.590 1.415 1.00 . A A . 53 ASP CB 1 1 17 18612 1 1 53 ASP CG C 17.681 3.298 2.636 1.00 . A A . 53 ASP CG 1 1 17 18613 1 1 53 ASP H H 14.911 2.997 0.243 1.00 . A A . 53 ASP H 1 1 17 18614 1 1 53 ASP HA H 17.337 4.504 0.490 1.00 . A A . 53 ASP HA 1 1 17 18615 1 1 53 ASP HB2 H 16.161 2.175 1.670 1.00 . A A . 53 ASP HB2 1 1 17 18616 1 1 53 ASP HB3 H 17.800 1.791 1.144 1.00 . A A . 53 ASP HB3 1 1 17 18617 1 1 53 ASP N N 15.540 3.675 -0.084 1.00 . A A . 53 ASP N 1 1 17 18618 1 1 53 ASP O O 18.832 3.492 -1.272 1.00 . A A . 53 ASP O 1 1 17 18619 1 1 53 ASP OD1 O 18.920 3.343 2.785 1.00 . A A . 53 ASP OD1 1 1 17 18620 1 1 53 ASP OD2 O 16.875 3.807 3.444 1.00 . A A . 53 ASP OD2 1 1 17 18621 1 1 54 GLY C C 18.304 2.525 -3.805 1.00 . A A . 54 GLY C 1 1 17 18622 1 1 54 GLY CA C 17.846 1.460 -2.830 1.00 . A A . 54 GLY CA 1 1 17 18623 1 1 54 GLY H H 16.305 1.675 -1.391 1.00 . A A . 54 GLY H 1 1 17 18624 1 1 54 GLY HA2 H 18.706 0.897 -2.499 1.00 . A A . 54 GLY HA2 1 1 17 18625 1 1 54 GLY HA3 H 17.167 0.793 -3.337 1.00 . A A . 54 GLY HA3 1 1 17 18626 1 1 54 GLY N N 17.177 2.023 -1.669 1.00 . A A . 54 GLY N 1 1 17 18627 1 1 54 GLY O O 19.469 2.556 -4.201 1.00 . A A . 54 GLY O 1 1 17 18628 1 1 55 LEU C C 18.600 5.514 -4.476 1.00 . A A . 55 LEU C 1 1 17 18629 1 1 55 LEU CA C 17.697 4.473 -5.129 1.00 . A A . 55 LEU CA 1 1 17 18630 1 1 55 LEU CB C 16.413 5.137 -5.630 1.00 . A A . 55 LEU CB 1 1 17 18631 1 1 55 LEU CD1 C 17.394 5.790 -7.841 1.00 . A A . 55 LEU CD1 1 1 17 18632 1 1 55 LEU CD2 C 15.294 6.884 -7.038 1.00 . A A . 55 LEU CD2 1 1 17 18633 1 1 55 LEU CG C 16.628 6.281 -6.623 1.00 . A A . 55 LEU CG 1 1 17 18634 1 1 55 LEU H H 16.471 3.324 -3.843 1.00 . A A . 55 LEU H 1 1 17 18635 1 1 55 LEU HA H 18.218 4.038 -5.968 1.00 . A A . 55 LEU HA 1 1 17 18636 1 1 55 LEU HB2 H 15.805 4.382 -6.105 1.00 . A A . 55 LEU HB2 1 1 17 18637 1 1 55 LEU HB3 H 15.876 5.525 -4.777 1.00 . A A . 55 LEU HB3 1 1 17 18638 1 1 55 LEU HD11 H 17.559 6.615 -8.520 1.00 . A A . 55 LEU HD11 1 1 17 18639 1 1 55 LEU HD12 H 16.822 5.022 -8.342 1.00 . A A . 55 LEU HD12 1 1 17 18640 1 1 55 LEU HD13 H 18.345 5.384 -7.529 1.00 . A A . 55 LEU HD13 1 1 17 18641 1 1 55 LEU HD21 H 15.467 7.686 -7.741 1.00 . A A . 55 LEU HD21 1 1 17 18642 1 1 55 LEU HD22 H 14.788 7.273 -6.167 1.00 . A A . 55 LEU HD22 1 1 17 18643 1 1 55 LEU HD23 H 14.683 6.125 -7.501 1.00 . A A . 55 LEU HD23 1 1 17 18644 1 1 55 LEU HG H 17.214 7.055 -6.150 1.00 . A A . 55 LEU HG 1 1 17 18645 1 1 55 LEU N N 17.383 3.401 -4.194 1.00 . A A . 55 LEU N 1 1 17 18646 1 1 55 LEU O O 19.771 5.643 -4.831 1.00 . A A . 55 LEU O 1 1 17 18647 1 1 56 GLU C C 19.641 6.668 -1.700 1.00 . A A . 56 GLU C 1 1 17 18648 1 1 56 GLU CA C 18.804 7.279 -2.819 1.00 . A A . 56 GLU CA 1 1 17 18649 1 1 56 GLU CB C 17.863 8.339 -2.251 1.00 . A A . 56 GLU CB 1 1 17 18650 1 1 56 GLU CD C 16.070 10.058 -2.720 1.00 . A A . 56 GLU CD 1 1 17 18651 1 1 56 GLU CG C 16.984 8.998 -3.303 1.00 . A A . 56 GLU CG 1 1 17 18652 1 1 56 GLU H H 17.109 6.100 -3.280 1.00 . A A . 56 GLU H 1 1 17 18653 1 1 56 GLU HA H 19.463 7.746 -3.529 1.00 . A A . 56 GLU HA 1 1 17 18654 1 1 56 GLU HB2 H 17.226 7.874 -1.520 1.00 . A A . 56 GLU HB2 1 1 17 18655 1 1 56 GLU HB3 H 18.451 9.107 -1.770 1.00 . A A . 56 GLU HB3 1 1 17 18656 1 1 56 GLU HG2 H 17.619 9.460 -4.044 1.00 . A A . 56 GLU HG2 1 1 17 18657 1 1 56 GLU HG3 H 16.378 8.239 -3.773 1.00 . A A . 56 GLU HG3 1 1 17 18658 1 1 56 GLU N N 18.047 6.251 -3.520 1.00 . A A . 56 GLU N 1 1 17 18659 1 1 56 GLU O O 19.430 6.958 -0.522 1.00 . A A . 56 GLU O 1 1 17 18660 1 1 56 GLU OE1 O 15.011 9.691 -2.171 1.00 . A A . 56 GLU OE1 1 1 17 18661 1 1 56 GLU OE2 O 16.415 11.255 -2.814 1.00 . A A . 56 GLU OE2 1 1 17 18662 1 1 57 TYR C C 22.663 6.042 -0.777 1.00 . A A . 57 TYR C 1 1 17 18663 1 1 57 TYR CA C 21.461 5.163 -1.112 1.00 . A A . 57 TYR CA 1 1 17 18664 1 1 57 TYR CB C 21.937 3.815 -1.659 1.00 . A A . 57 TYR CB 1 1 17 18665 1 1 57 TYR CD1 C 22.286 2.346 0.364 1.00 . A A . 57 TYR CD1 1 1 17 18666 1 1 57 TYR CD2 C 24.205 3.034 -0.871 1.00 . A A . 57 TYR CD2 1 1 17 18667 1 1 57 TYR CE1 C 23.095 1.647 1.240 1.00 . A A . 57 TYR CE1 1 1 17 18668 1 1 57 TYR CE2 C 25.022 2.337 -0.001 1.00 . A A . 57 TYR CE2 1 1 17 18669 1 1 57 TYR CG C 22.826 3.050 -0.705 1.00 . A A . 57 TYR CG 1 1 17 18670 1 1 57 TYR CZ C 24.461 1.639 1.048 1.00 . A A . 57 TYR CZ 1 1 17 18671 1 1 57 TYR H H 20.708 5.629 -3.032 1.00 . A A . 57 TYR H 1 1 17 18672 1 1 57 TYR HA H 20.891 4.995 -0.211 1.00 . A A . 57 TYR HA 1 1 17 18673 1 1 57 TYR HB2 H 21.077 3.200 -1.875 1.00 . A A . 57 TYR HB2 1 1 17 18674 1 1 57 TYR HB3 H 22.492 3.981 -2.571 1.00 . A A . 57 TYR HB3 1 1 17 18675 1 1 57 TYR HD1 H 21.216 2.347 0.507 1.00 . A A . 57 TYR HD1 1 1 17 18676 1 1 57 TYR HD2 H 24.641 3.577 -1.697 1.00 . A A . 57 TYR HD2 1 1 17 18677 1 1 57 TYR HE1 H 22.656 1.105 2.064 1.00 . A A . 57 TYR HE1 1 1 17 18678 1 1 57 TYR HE2 H 26.092 2.337 -0.146 1.00 . A A . 57 TYR HE2 1 1 17 18679 1 1 57 TYR HH H 26.045 1.481 2.130 1.00 . A A . 57 TYR HH 1 1 17 18680 1 1 57 TYR N N 20.590 5.819 -2.079 1.00 . A A . 57 TYR N 1 1 17 18681 1 1 57 TYR O O 23.683 5.942 -1.489 1.00 . A A . 57 TYR O 1 1 17 18682 1 1 57 TYR OXT O 22.571 6.822 0.194 1.00 . A A . 57 TYR OXT 1 1 17 18683 1 1 57 TYR OH O 25.271 0.952 1.923 1.00 . A A . 57 TYR OH 1 1 17 18684 2 2 1 ALA C C -14.858 -9.342 0.596 1.00 . B B . 1 ALA C 1 1 17 18685 2 2 1 ALA CA C -16.074 -10.177 0.193 1.00 . B B . 1 ALA CA 1 1 17 18686 2 2 1 ALA CB C -17.333 -9.606 0.827 1.00 . B B . 1 ALA CB 1 1 17 18687 2 2 1 ALA H1 H -15.800 -11.662 1.631 1.00 . B B . 1 ALA H1 1 1 17 18688 2 2 1 ALA H2 H -15.046 -11.991 0.153 1.00 . B B . 1 ALA H2 1 1 17 18689 2 2 1 ALA H3 H -16.723 -12.156 0.301 1.00 . B B . 1 ALA H3 1 1 17 18690 2 2 1 ALA HA H -16.194 -10.143 -0.878 1.00 . B B . 1 ALA HA 1 1 17 18691 2 2 1 ALA HB1 H -17.246 -9.650 1.903 1.00 . B B . 1 ALA HB1 1 1 17 18692 2 2 1 ALA HB2 H -18.190 -10.183 0.511 1.00 . B B . 1 ALA HB2 1 1 17 18693 2 2 1 ALA HB3 H -17.458 -8.578 0.519 1.00 . B B . 1 ALA HB3 1 1 17 18694 2 2 1 ALA N N -15.898 -11.595 0.597 1.00 . B B . 1 ALA N 1 1 17 18695 2 2 1 ALA O O -14.493 -9.304 1.769 1.00 . B B . 1 ALA O 1 1 17 18696 2 2 2 PRO C C -13.389 -6.578 0.709 1.00 . B B . 2 PRO C 1 1 17 18697 2 2 2 PRO CA C -13.035 -7.830 -0.091 1.00 . B B . 2 PRO CA 1 1 17 18698 2 2 2 PRO CB C -12.531 -7.447 -1.484 1.00 . B B . 2 PRO CB 1 1 17 18699 2 2 2 PRO CD C -14.577 -8.638 -1.800 1.00 . B B . 2 PRO CD 1 1 17 18700 2 2 2 PRO CG C -13.734 -7.526 -2.358 1.00 . B B . 2 PRO CG 1 1 17 18701 2 2 2 PRO HA H -12.273 -8.390 0.427 1.00 . B B . 2 PRO HA 1 1 17 18702 2 2 2 PRO HB2 H -12.124 -6.446 -1.461 1.00 . B B . 2 PRO HB2 1 1 17 18703 2 2 2 PRO HB3 H -11.768 -8.144 -1.799 1.00 . B B . 2 PRO HB3 1 1 17 18704 2 2 2 PRO HD2 H -15.627 -8.416 -1.927 1.00 . B B . 2 PRO HD2 1 1 17 18705 2 2 2 PRO HD3 H -14.328 -9.577 -2.274 1.00 . B B . 2 PRO HD3 1 1 17 18706 2 2 2 PRO HG2 H -14.274 -6.592 -2.324 1.00 . B B . 2 PRO HG2 1 1 17 18707 2 2 2 PRO HG3 H -13.438 -7.754 -3.371 1.00 . B B . 2 PRO HG3 1 1 17 18708 2 2 2 PRO N N -14.213 -8.660 -0.370 1.00 . B B . 2 PRO N 1 1 17 18709 2 2 2 PRO O O -14.031 -5.665 0.190 1.00 . B B . 2 PRO O 1 1 17 18710 2 2 3 PRO C C -12.381 -4.164 2.526 1.00 . B B . 3 PRO C 1 1 17 18711 2 2 3 PRO CA C -13.257 -5.369 2.853 1.00 . B B . 3 PRO CA 1 1 17 18712 2 2 3 PRO CB C -12.937 -5.899 4.249 1.00 . B B . 3 PRO CB 1 1 17 18713 2 2 3 PRO CD C -12.197 -7.559 2.689 1.00 . B B . 3 PRO CD 1 1 17 18714 2 2 3 PRO CG C -11.896 -6.941 4.028 1.00 . B B . 3 PRO CG 1 1 17 18715 2 2 3 PRO HA H -14.296 -5.083 2.801 1.00 . B B . 3 PRO HA 1 1 17 18716 2 2 3 PRO HB2 H -12.567 -5.093 4.867 1.00 . B B . 3 PRO HB2 1 1 17 18717 2 2 3 PRO HB3 H -13.828 -6.319 4.691 1.00 . B B . 3 PRO HB3 1 1 17 18718 2 2 3 PRO HD2 H -11.280 -7.775 2.161 1.00 . B B . 3 PRO HD2 1 1 17 18719 2 2 3 PRO HD3 H -12.782 -8.457 2.813 1.00 . B B . 3 PRO HD3 1 1 17 18720 2 2 3 PRO HG2 H -10.917 -6.485 4.019 1.00 . B B . 3 PRO HG2 1 1 17 18721 2 2 3 PRO HG3 H -11.955 -7.688 4.806 1.00 . B B . 3 PRO HG3 1 1 17 18722 2 2 3 PRO N N -12.973 -6.517 1.988 1.00 . B B . 3 PRO N 1 1 17 18723 2 2 3 PRO O O -11.279 -4.023 3.057 1.00 . B B . 3 PRO O 1 1 17 18724 2 2 4 GLY C C -10.684 -2.423 0.922 1.00 . B B . 4 GLY C 1 1 17 18725 2 2 4 GLY CA C -12.129 -2.111 1.264 1.00 . B B . 4 GLY CA 1 1 17 18726 2 2 4 GLY H H -13.761 -3.462 1.257 1.00 . B B . 4 GLY H 1 1 17 18727 2 2 4 GLY HA2 H -12.602 -1.667 0.401 1.00 . B B . 4 GLY HA2 1 1 17 18728 2 2 4 GLY HA3 H -12.150 -1.403 2.077 1.00 . B B . 4 GLY HA3 1 1 17 18729 2 2 4 GLY N N -12.878 -3.297 1.648 1.00 . B B . 4 GLY N 1 1 17 18730 2 2 4 GLY O O -9.789 -2.238 1.746 1.00 . B B . 4 GLY O 1 1 17 18731 2 2 5 THR C C -8.980 -3.089 -2.264 1.00 . B B . 5 THR C 1 1 17 18732 2 2 5 THR CA C -9.120 -3.240 -0.752 1.00 . B B . 5 THR CA 1 1 17 18733 2 2 5 THR CB C -8.751 -4.681 -0.355 1.00 . B B . 5 THR CB 1 1 17 18734 2 2 5 THR CG2 C -8.932 -6.785 0.785 1.00 . B B . 5 THR CG2 1 1 17 18735 2 2 5 THR H H -11.216 -2.992 -0.913 1.00 . B B . 5 THR H 1 1 17 18736 2 2 5 THR HA H -8.426 -2.569 -0.271 1.00 . B B . 5 THR HA 1 1 17 18737 2 2 5 THR HB H -8.743 -4.751 0.723 1.00 . B B . 5 THR HB 1 1 17 18738 2 2 5 THR HG1 H -8.407 -4.680 1.914 1.00 . B B . 5 THR HG1 1 1 17 18739 2 2 5 THR HG21 H -8.999 -6.895 1.858 1.00 . B B . 5 THR HG21 1 1 17 18740 2 2 5 THR HG22 H -8.749 -7.749 0.336 1.00 . B B . 5 THR HG22 1 1 17 18741 2 2 5 THR HG23 H -9.858 -6.379 0.405 1.00 . B B . 5 THR HG23 1 1 17 18742 2 2 5 THR N N -10.462 -2.895 -0.298 1.00 . B B . 5 THR N 1 1 17 18743 2 2 5 THR O O -9.970 -3.080 -2.995 1.00 . B B . 5 THR O 1 1 17 18744 2 2 5 THR OG1 O -8.023 -4.562 1.042 1.00 . B B . 5 THR OG1 1 1 17 18745 2 2 6 ALA C C -6.118 -3.500 -4.487 1.00 . B B . 6 ALA C 1 1 17 18746 2 2 6 ALA CA C -7.447 -2.832 -4.146 1.00 . B B . 6 ALA CA 1 1 17 18747 2 2 6 ALA CB C -7.425 -1.364 -4.543 1.00 . B B . 6 ALA CB 1 1 17 18748 2 2 6 ALA H H -6.993 -2.974 -2.084 1.00 . B B . 6 ALA H 1 1 17 18749 2 2 6 ALA HA H -8.238 -3.321 -4.697 1.00 . B B . 6 ALA HA 1 1 17 18750 2 2 6 ALA HB1 H -8.211 -0.839 -4.020 1.00 . B B . 6 ALA HB1 1 1 17 18751 2 2 6 ALA HB2 H -7.579 -1.276 -5.607 1.00 . B B . 6 ALA HB2 1 1 17 18752 2 2 6 ALA HB3 H -6.471 -0.936 -4.282 1.00 . B B . 6 ALA HB3 1 1 17 18753 2 2 6 ALA N N -7.737 -2.971 -2.722 1.00 . B B . 6 ALA N 1 1 17 18754 2 2 6 ALA O O -6.017 -4.254 -5.455 1.00 . B B . 6 ALA O 1 1 17 18755 2 2 7 ARG C C -3.106 -3.268 -5.140 1.00 . B B . 7 ARG C 1 1 17 18756 2 2 7 ARG CA C -3.773 -3.790 -3.872 1.00 . B B . 7 ARG CA 1 1 17 18757 2 2 7 ARG CB C -3.870 -5.316 -3.927 1.00 . B B . 7 ARG CB 1 1 17 18758 2 2 7 ARG CD C -4.522 -7.442 -2.753 1.00 . B B . 7 ARG CD 1 1 17 18759 2 2 7 ARG CG C -4.561 -5.923 -2.716 1.00 . B B . 7 ARG CG 1 1 17 18760 2 2 7 ARG CZ C -5.260 -9.271 -4.221 1.00 . B B . 7 ARG CZ 1 1 17 18761 2 2 7 ARG H H -5.246 -2.589 -2.944 1.00 . B B . 7 ARG H 1 1 17 18762 2 2 7 ARG HA H -3.168 -3.511 -3.023 1.00 . B B . 7 ARG HA 1 1 17 18763 2 2 7 ARG HB2 H -4.422 -5.600 -4.811 1.00 . B B . 7 ARG HB2 1 1 17 18764 2 2 7 ARG HB3 H -2.873 -5.726 -3.987 1.00 . B B . 7 ARG HB3 1 1 17 18765 2 2 7 ARG HD2 H -3.494 -7.764 -2.678 1.00 . B B . 7 ARG HD2 1 1 17 18766 2 2 7 ARG HD3 H -5.080 -7.823 -1.911 1.00 . B B . 7 ARG HD3 1 1 17 18767 2 2 7 ARG HE H -5.374 -7.332 -4.671 1.00 . B B . 7 ARG HE 1 1 17 18768 2 2 7 ARG HG2 H -4.063 -5.582 -1.821 1.00 . B B . 7 ARG HG2 1 1 17 18769 2 2 7 ARG HG3 H -5.592 -5.597 -2.704 1.00 . B B . 7 ARG HG3 1 1 17 18770 2 2 7 ARG HH11 H -4.499 -9.862 -2.444 1.00 . B B . 7 ARG HH11 1 1 17 18771 2 2 7 ARG HH12 H -5.021 -11.140 -3.489 1.00 . B B . 7 ARG HH12 1 1 17 18772 2 2 7 ARG HH21 H -6.064 -9.006 -6.056 1.00 . B B . 7 ARG HH21 1 1 17 18773 2 2 7 ARG HH22 H -5.911 -10.653 -5.544 1.00 . B B . 7 ARG HH22 1 1 17 18774 2 2 7 ARG N N -5.101 -3.211 -3.683 1.00 . B B . 7 ARG N 1 1 17 18775 2 2 7 ARG NE N -5.097 -7.974 -3.985 1.00 . B B . 7 ARG NE 1 1 17 18776 2 2 7 ARG NH1 N -4.897 -10.164 -3.310 1.00 . B B . 7 ARG NH1 1 1 17 18777 2 2 7 ARG NH2 N -5.789 -9.677 -5.368 1.00 . B B . 7 ARG NH2 1 1 17 18778 2 2 7 ARG O O -3.606 -3.478 -6.247 1.00 . B B . 7 ARG O 1 1 17 18779 2 2 8 ARG C C -0.612 -3.174 -6.935 1.00 . B B . 8 ARG C 1 1 17 18780 2 2 8 ARG CA C -1.232 -2.050 -6.108 1.00 . B B . 8 ARG CA 1 1 17 18781 2 2 8 ARG CB C -0.144 -1.083 -5.633 1.00 . B B . 8 ARG CB 1 1 17 18782 2 2 8 ARG CD C -1.398 0.996 -6.293 1.00 . B B . 8 ARG CD 1 1 17 18783 2 2 8 ARG CG C -0.683 0.261 -5.169 1.00 . B B . 8 ARG CG 1 1 17 18784 2 2 8 ARG CZ C -0.959 1.576 -8.642 1.00 . B B . 8 ARG CZ 1 1 17 18785 2 2 8 ARG H H -1.627 -2.440 -4.063 1.00 . B B . 8 ARG H 1 1 17 18786 2 2 8 ARG HA H -1.931 -1.512 -6.729 1.00 . B B . 8 ARG HA 1 1 17 18787 2 2 8 ARG HB2 H 0.391 -1.536 -4.811 1.00 . B B . 8 ARG HB2 1 1 17 18788 2 2 8 ARG HB3 H 0.545 -0.909 -6.446 1.00 . B B . 8 ARG HB3 1 1 17 18789 2 2 8 ARG HD2 H -2.236 0.399 -6.621 1.00 . B B . 8 ARG HD2 1 1 17 18790 2 2 8 ARG HD3 H -1.758 1.941 -5.914 1.00 . B B . 8 ARG HD3 1 1 17 18791 2 2 8 ARG HE H 0.446 1.163 -7.287 1.00 . B B . 8 ARG HE 1 1 17 18792 2 2 8 ARG HG2 H -1.378 0.100 -4.359 1.00 . B B . 8 ARG HG2 1 1 17 18793 2 2 8 ARG HG3 H 0.141 0.868 -4.824 1.00 . B B . 8 ARG HG3 1 1 17 18794 2 2 8 ARG HH11 H -2.913 1.513 -8.135 1.00 . B B . 8 ARG HH11 1 1 17 18795 2 2 8 ARG HH12 H -2.588 1.933 -9.784 1.00 . B B . 8 ARG HH12 1 1 17 18796 2 2 8 ARG HH21 H 0.885 1.717 -9.458 1.00 . B B . 8 ARG HH21 1 1 17 18797 2 2 8 ARG HH22 H -0.430 2.050 -10.534 1.00 . B B . 8 ARG HH22 1 1 17 18798 2 2 8 ARG N N -1.971 -2.589 -4.971 1.00 . B B . 8 ARG N 1 1 17 18799 2 2 8 ARG NE N -0.519 1.244 -7.432 1.00 . B B . 8 ARG NE 1 1 17 18800 2 2 8 ARG NH1 N -2.260 1.683 -8.873 1.00 . B B . 8 ARG NH1 1 1 17 18801 2 2 8 ARG NH2 N -0.097 1.800 -9.625 1.00 . B B . 8 ARG NH2 1 1 17 18802 2 2 8 ARG O O -0.642 -3.137 -8.164 1.00 . B B . 8 ARG O 1 1 17 18803 2 2 9 LYS C C 0.419 -6.568 -6.108 1.00 . B B . 9 LYS C 1 1 17 18804 2 2 9 LYS CA C 0.567 -5.299 -6.939 1.00 . B B . 9 LYS CA 1 1 17 18805 2 2 9 LYS CB C 2.048 -5.019 -7.204 1.00 . B B . 9 LYS CB 1 1 17 18806 2 2 9 LYS CD C 3.779 -3.519 -8.234 1.00 . B B . 9 LYS CD 1 1 17 18807 2 2 9 LYS CE C 4.348 -4.642 -9.085 1.00 . B B . 9 LYS CE 1 1 17 18808 2 2 9 LYS CG C 2.298 -3.725 -7.960 1.00 . B B . 9 LYS CG 1 1 17 18809 2 2 9 LYS H H -0.034 -4.145 -5.278 1.00 . B B . 9 LYS H 1 1 17 18810 2 2 9 LYS HA H 0.058 -5.432 -7.881 1.00 . B B . 9 LYS HA 1 1 17 18811 2 2 9 LYS HB2 H 2.566 -4.963 -6.257 1.00 . B B . 9 LYS HB2 1 1 17 18812 2 2 9 LYS HB3 H 2.459 -5.833 -7.781 1.00 . B B . 9 LYS HB3 1 1 17 18813 2 2 9 LYS HD2 H 3.913 -2.583 -8.755 1.00 . B B . 9 LYS HD2 1 1 17 18814 2 2 9 LYS HD3 H 4.308 -3.488 -7.292 1.00 . B B . 9 LYS HD3 1 1 17 18815 2 2 9 LYS HE2 H 4.245 -5.572 -8.547 1.00 . B B . 9 LYS HE2 1 1 17 18816 2 2 9 LYS HE3 H 3.789 -4.696 -10.008 1.00 . B B . 9 LYS HE3 1 1 17 18817 2 2 9 LYS HG2 H 1.770 -3.762 -8.902 1.00 . B B . 9 LYS HG2 1 1 17 18818 2 2 9 LYS HG3 H 1.931 -2.897 -7.371 1.00 . B B . 9 LYS HG3 1 1 17 18819 2 2 9 LYS HZ1 H 5.908 -3.533 -9.925 1.00 . B B . 9 LYS HZ1 1 1 17 18820 2 2 9 LYS HZ2 H 6.148 -5.207 -9.982 1.00 . B B . 9 LYS HZ2 1 1 17 18821 2 2 9 LYS HZ3 H 6.344 -4.375 -8.523 1.00 . B B . 9 LYS HZ3 1 1 17 18822 2 2 9 LYS N N -0.046 -4.170 -6.256 1.00 . B B . 9 LYS N 1 1 17 18823 2 2 9 LYS NZ N 5.788 -4.424 -9.401 1.00 . B B . 9 LYS NZ 1 1 17 18824 2 2 9 LYS O O -0.330 -6.594 -5.131 1.00 . B B . 9 LYS O 1 1 17 18825 2 2 10 ARG C C 1.368 -8.665 -4.292 1.00 . B B . 10 ARG C 1 1 17 18826 2 2 10 ARG CA C 1.078 -8.881 -5.774 1.00 . B B . 10 ARG CA 1 1 17 18827 2 2 10 ARG CB C 2.108 -9.845 -6.350 1.00 . B B . 10 ARG CB 1 1 17 18828 2 2 10 ARG CD C 4.551 -10.404 -6.508 1.00 . B B . 10 ARG CD 1 1 17 18829 2 2 10 ARG CG C 3.525 -9.309 -6.264 1.00 . B B . 10 ARG CG 1 1 17 18830 2 2 10 ARG CZ C 4.997 -12.701 -5.752 1.00 . B B . 10 ARG CZ 1 1 17 18831 2 2 10 ARG H H 1.703 -7.546 -7.288 1.00 . B B . 10 ARG H 1 1 17 18832 2 2 10 ARG HA H 0.091 -9.301 -5.888 1.00 . B B . 10 ARG HA 1 1 17 18833 2 2 10 ARG HB2 H 2.059 -10.777 -5.807 1.00 . B B . 10 ARG HB2 1 1 17 18834 2 2 10 ARG HB3 H 1.875 -10.027 -7.389 1.00 . B B . 10 ARG HB3 1 1 17 18835 2 2 10 ARG HD2 H 4.469 -10.734 -7.532 1.00 . B B . 10 ARG HD2 1 1 17 18836 2 2 10 ARG HD3 H 5.538 -10.000 -6.337 1.00 . B B . 10 ARG HD3 1 1 17 18837 2 2 10 ARG HE H 3.693 -11.454 -4.901 1.00 . B B . 10 ARG HE 1 1 17 18838 2 2 10 ARG HG2 H 3.652 -8.540 -7.012 1.00 . B B . 10 ARG HG2 1 1 17 18839 2 2 10 ARG HG3 H 3.681 -8.886 -5.280 1.00 . B B . 10 ARG HG3 1 1 17 18840 2 2 10 ARG HH11 H 6.068 -12.110 -7.360 1.00 . B B . 10 ARG HH11 1 1 17 18841 2 2 10 ARG HH12 H 6.375 -13.727 -6.817 1.00 . B B . 10 ARG HH12 1 1 17 18842 2 2 10 ARG HH21 H 4.086 -13.583 -4.178 1.00 . B B . 10 ARG HH21 1 1 17 18843 2 2 10 ARG HH22 H 5.246 -14.564 -5.008 1.00 . B B . 10 ARG HH22 1 1 17 18844 2 2 10 ARG N N 1.128 -7.619 -6.497 1.00 . B B . 10 ARG N 1 1 17 18845 2 2 10 ARG NE N 4.347 -11.548 -5.625 1.00 . B B . 10 ARG NE 1 1 17 18846 2 2 10 ARG NH1 N 5.886 -12.859 -6.723 1.00 . B B . 10 ARG NH1 1 1 17 18847 2 2 10 ARG NH2 N 4.757 -13.698 -4.910 1.00 . B B . 10 ARG NH2 1 1 17 18848 2 2 10 ARG O O 0.952 -9.456 -3.446 1.00 . B B . 10 ARG O 1 1 17 18849 2 2 11 LYS C C 3.470 -8.259 -2.077 1.00 . B B . 11 LYS C 1 1 17 18850 2 2 11 LYS CA C 2.461 -7.257 -2.623 1.00 . B B . 11 LYS CA 1 1 17 18851 2 2 11 LYS CB C 1.235 -7.203 -1.710 1.00 . B B . 11 LYS CB 1 1 17 18852 2 2 11 LYS CD C -0.730 -5.855 -0.949 1.00 . B B . 11 LYS CD 1 1 17 18853 2 2 11 LYS CE C -1.688 -4.727 -1.288 1.00 . B B . 11 LYS CE 1 1 17 18854 2 2 11 LYS CG C 0.230 -6.133 -2.092 1.00 . B B . 11 LYS CG 1 1 17 18855 2 2 11 LYS H H 2.389 -7.000 -4.717 1.00 . B B . 11 LYS H 1 1 17 18856 2 2 11 LYS HA H 2.925 -6.284 -2.641 1.00 . B B . 11 LYS HA 1 1 17 18857 2 2 11 LYS HB2 H 0.737 -8.158 -1.732 1.00 . B B . 11 LYS HB2 1 1 17 18858 2 2 11 LYS HB3 H 1.566 -7.005 -0.703 1.00 . B B . 11 LYS HB3 1 1 17 18859 2 2 11 LYS HD2 H -1.298 -6.749 -0.744 1.00 . B B . 11 LYS HD2 1 1 17 18860 2 2 11 LYS HD3 H -0.159 -5.580 -0.074 1.00 . B B . 11 LYS HD3 1 1 17 18861 2 2 11 LYS HE2 H -1.119 -3.824 -1.449 1.00 . B B . 11 LYS HE2 1 1 17 18862 2 2 11 LYS HE3 H -2.216 -4.985 -2.192 1.00 . B B . 11 LYS HE3 1 1 17 18863 2 2 11 LYS HG2 H 0.759 -5.224 -2.337 1.00 . B B . 11 LYS HG2 1 1 17 18864 2 2 11 LYS HG3 H -0.332 -6.469 -2.950 1.00 . B B . 11 LYS HG3 1 1 17 18865 2 2 11 LYS HZ1 H -3.371 -3.777 -0.498 1.00 . B B . 11 LYS HZ1 1 1 17 18866 2 2 11 LYS HZ2 H -2.191 -4.149 0.655 1.00 . B B . 11 LYS HZ2 1 1 17 18867 2 2 11 LYS HZ3 H -3.177 -5.372 0.028 1.00 . B B . 11 LYS HZ3 1 1 17 18868 2 2 11 LYS N N 2.092 -7.589 -3.992 1.00 . B B . 11 LYS N 1 1 17 18869 2 2 11 LYS NZ N -2.675 -4.490 -0.199 1.00 . B B . 11 LYS NZ 1 1 17 18870 2 2 11 LYS O O 3.099 -9.302 -1.539 1.00 . B B . 11 LYS O 1 1 17 18871 2 2 12 ALA C C 6.063 -8.576 -0.255 1.00 . B B . 12 ALA C 1 1 17 18872 2 2 12 ALA CA C 5.818 -8.792 -1.743 1.00 . B B . 12 ALA CA 1 1 17 18873 2 2 12 ALA CB C 7.096 -8.532 -2.528 1.00 . B B . 12 ALA CB 1 1 17 18874 2 2 12 ALA H H 4.976 -7.081 -2.655 1.00 . B B . 12 ALA H 1 1 17 18875 2 2 12 ALA HA H 5.520 -9.817 -1.911 1.00 . B B . 12 ALA HA 1 1 17 18876 2 2 12 ALA HB1 H 6.859 -8.422 -3.576 1.00 . B B . 12 ALA HB1 1 1 17 18877 2 2 12 ALA HB2 H 7.774 -9.362 -2.397 1.00 . B B . 12 ALA HB2 1 1 17 18878 2 2 12 ALA HB3 H 7.563 -7.626 -2.165 1.00 . B B . 12 ALA HB3 1 1 17 18879 2 2 12 ALA N N 4.748 -7.929 -2.220 1.00 . B B . 12 ALA N 1 1 17 18880 2 2 12 ALA O O 6.366 -7.467 0.174 1.00 . B B . 12 ALA O 1 1 17 18881 2 2 13 ASP C C 7.165 -10.560 2.446 1.00 . B B . 13 ASP C 1 1 17 18882 2 2 13 ASP CA C 6.148 -9.530 1.971 1.00 . B B . 13 ASP CA 1 1 17 18883 2 2 13 ASP CB C 4.829 -9.693 2.730 1.00 . B B . 13 ASP CB 1 1 17 18884 2 2 13 ASP CG C 4.089 -10.959 2.344 1.00 . B B . 13 ASP CG 1 1 17 18885 2 2 13 ASP H H 5.686 -10.500 0.146 1.00 . B B . 13 ASP H 1 1 17 18886 2 2 13 ASP HA H 6.540 -8.545 2.168 1.00 . B B . 13 ASP HA 1 1 17 18887 2 2 13 ASP HB2 H 5.035 -9.729 3.789 1.00 . B B . 13 ASP HB2 1 1 17 18888 2 2 13 ASP HB3 H 4.194 -8.844 2.520 1.00 . B B . 13 ASP HB3 1 1 17 18889 2 2 13 ASP N N 5.931 -9.634 0.535 1.00 . B B . 13 ASP N 1 1 17 18890 2 2 13 ASP O O 6.901 -11.333 3.367 1.00 . B B . 13 ASP O 1 1 17 18891 2 2 13 ASP OD1 O 3.412 -10.955 1.294 1.00 . B B . 13 ASP OD1 1 1 17 18892 2 2 13 ASP OD2 O 4.186 -11.955 3.091 1.00 . B B . 13 ASP OD2 1 1 17 18893 2 2 14 SER C C 10.598 -11.310 1.235 1.00 . B B . 14 SER C 1 1 17 18894 2 2 14 SER CA C 9.396 -11.490 2.157 1.00 . B B . 14 SER CA 1 1 17 18895 2 2 14 SER CB C 8.896 -12.933 2.085 1.00 . B B . 14 SER CB 1 1 17 18896 2 2 14 SER H H 8.473 -9.925 1.075 1.00 . B B . 14 SER H 1 1 17 18897 2 2 14 SER HA H 9.699 -11.272 3.169 1.00 . B B . 14 SER HA 1 1 17 18898 2 2 14 SER HB2 H 8.103 -13.074 2.805 1.00 . B B . 14 SER HB2 1 1 17 18899 2 2 14 SER HB3 H 8.520 -13.133 1.092 1.00 . B B . 14 SER HB3 1 1 17 18900 2 2 14 SER HG H 9.989 -13.992 3.318 1.00 . B B . 14 SER HG 1 1 17 18901 2 2 14 SER N N 8.329 -10.563 1.805 1.00 . B B . 14 SER N 1 1 17 18902 2 2 14 SER O O 10.653 -12.000 0.195 1.00 . B B . 14 SER O 1 1 17 18903 2 2 14 SER OXT O 11.472 -10.478 1.559 1.00 . B B . 14 SER OXT 1 1 17 18904 2 2 14 SER OG O 9.939 -13.850 2.370 1.00 . B B . 14 SER OG 1 1 18 18905 1 1 1 GLY C C 11.555 5.732 -5.719 1.00 . A A . 1 GLY C 1 1 18 18906 1 1 1 GLY CA C 11.052 4.694 -6.707 1.00 . A A . 1 GLY CA 1 1 18 18907 1 1 1 GLY H1 H 9.276 4.022 -7.578 1.00 . A A . 1 GLY H1 1 1 18 18908 1 1 1 GLY H2 H 9.339 5.698 -7.359 1.00 . A A . 1 GLY H2 1 1 18 18909 1 1 1 GLY H3 H 9.073 4.681 -6.034 1.00 . A A . 1 GLY H3 1 1 18 18910 1 1 1 GLY HA2 H 11.295 3.708 -6.338 1.00 . A A . 1 GLY HA2 1 1 18 18911 1 1 1 GLY HA3 H 11.556 4.843 -7.652 1.00 . A A . 1 GLY HA3 1 1 18 18912 1 1 1 GLY N N 9.582 4.780 -6.935 1.00 . A A . 1 GLY N 1 1 18 18913 1 1 1 GLY O O 12.601 6.344 -5.939 1.00 . A A . 1 GLY O 1 1 18 18914 1 1 2 SER C C 10.231 6.980 -2.452 1.00 . A A . 2 SER C 1 1 18 18915 1 1 2 SER CA C 11.219 6.915 -3.616 1.00 . A A . 2 SER CA 1 1 18 18916 1 1 2 SER CB C 11.365 8.294 -4.254 1.00 . A A . 2 SER CB 1 1 18 18917 1 1 2 SER H H 10.001 5.413 -4.489 1.00 . A A . 2 SER H 1 1 18 18918 1 1 2 SER HA H 12.180 6.614 -3.231 1.00 . A A . 2 SER HA 1 1 18 18919 1 1 2 SER HB2 H 11.620 9.012 -3.491 1.00 . A A . 2 SER HB2 1 1 18 18920 1 1 2 SER HB3 H 12.149 8.259 -4.995 1.00 . A A . 2 SER HB3 1 1 18 18921 1 1 2 SER HG H 9.632 9.208 -4.260 1.00 . A A . 2 SER HG 1 1 18 18922 1 1 2 SER N N 10.820 5.933 -4.624 1.00 . A A . 2 SER N 1 1 18 18923 1 1 2 SER O O 10.617 7.291 -1.325 1.00 . A A . 2 SER O 1 1 18 18924 1 1 2 SER OG O 10.159 8.700 -4.880 1.00 . A A . 2 SER OG 1 1 18 18925 1 1 3 GLN C C 7.887 5.363 -0.970 1.00 . A A . 3 GLN C 1 1 18 18926 1 1 3 GLN CA C 7.946 6.713 -1.676 1.00 . A A . 3 GLN CA 1 1 18 18927 1 1 3 GLN CB C 6.591 7.061 -2.292 1.00 . A A . 3 GLN CB 1 1 18 18928 1 1 3 GLN CD C 4.512 6.220 -3.480 1.00 . A A . 3 GLN CD 1 1 18 18929 1 1 3 GLN CG C 5.926 5.904 -3.028 1.00 . A A . 3 GLN CG 1 1 18 18930 1 1 3 GLN H H 8.689 6.489 -3.634 1.00 . A A . 3 GLN H 1 1 18 18931 1 1 3 GLN HA H 8.218 7.474 -0.960 1.00 . A A . 3 GLN HA 1 1 18 18932 1 1 3 GLN HB2 H 5.924 7.397 -1.512 1.00 . A A . 3 GLN HB2 1 1 18 18933 1 1 3 GLN HB3 H 6.741 7.861 -2.998 1.00 . A A . 3 GLN HB3 1 1 18 18934 1 1 3 GLN HE21 H 4.980 8.136 -3.747 1.00 . A A . 3 GLN HE21 1 1 18 18935 1 1 3 GLN HE22 H 3.346 7.707 -4.101 1.00 . A A . 3 GLN HE22 1 1 18 18936 1 1 3 GLN HG2 H 6.518 5.663 -3.899 1.00 . A A . 3 GLN HG2 1 1 18 18937 1 1 3 GLN HG3 H 5.894 5.048 -2.370 1.00 . A A . 3 GLN HG3 1 1 18 18938 1 1 3 GLN N N 8.961 6.690 -2.717 1.00 . A A . 3 GLN N 1 1 18 18939 1 1 3 GLN NE2 N 4.254 7.482 -3.809 1.00 . A A . 3 GLN NE2 1 1 18 18940 1 1 3 GLN O O 7.816 4.321 -1.616 1.00 . A A . 3 GLN O 1 1 18 18941 1 1 3 GLN OE1 O 3.658 5.335 -3.540 1.00 . A A . 3 GLN OE1 1 1 18 18942 1 1 4 VAL C C 6.465 3.730 1.468 1.00 . A A . 4 VAL C 1 1 18 18943 1 1 4 VAL CA C 7.890 4.164 1.139 1.00 . A A . 4 VAL CA 1 1 18 18944 1 1 4 VAL CB C 8.709 4.315 2.441 1.00 . A A . 4 VAL CB 1 1 18 18945 1 1 4 VAL CG1 C 8.139 5.411 3.334 1.00 . A A . 4 VAL CG1 1 1 18 18946 1 1 4 VAL CG2 C 8.776 2.992 3.187 1.00 . A A . 4 VAL CG2 1 1 18 18947 1 1 4 VAL H H 7.938 6.252 0.817 1.00 . A A . 4 VAL H 1 1 18 18948 1 1 4 VAL HA H 8.354 3.391 0.544 1.00 . A A . 4 VAL HA 1 1 18 18949 1 1 4 VAL HB H 9.716 4.597 2.170 1.00 . A A . 4 VAL HB 1 1 18 18950 1 1 4 VAL HG11 H 7.898 6.277 2.738 1.00 . A A . 4 VAL HG11 1 1 18 18951 1 1 4 VAL HG12 H 8.874 5.683 4.077 1.00 . A A . 4 VAL HG12 1 1 18 18952 1 1 4 VAL HG13 H 7.250 5.053 3.828 1.00 . A A . 4 VAL HG13 1 1 18 18953 1 1 4 VAL HG21 H 9.355 3.118 4.090 1.00 . A A . 4 VAL HG21 1 1 18 18954 1 1 4 VAL HG22 H 9.246 2.248 2.560 1.00 . A A . 4 VAL HG22 1 1 18 18955 1 1 4 VAL HG23 H 7.780 2.672 3.440 1.00 . A A . 4 VAL HG23 1 1 18 18956 1 1 4 VAL N N 7.913 5.390 0.355 1.00 . A A . 4 VAL N 1 1 18 18957 1 1 4 VAL O O 6.058 3.719 2.626 1.00 . A A . 4 VAL O 1 1 18 18958 1 1 5 PHE C C 3.603 2.889 -0.748 1.00 . A A . 5 PHE C 1 1 18 18959 1 1 5 PHE CA C 4.332 2.909 0.593 1.00 . A A . 5 PHE CA 1 1 18 18960 1 1 5 PHE CB C 3.569 3.817 1.567 1.00 . A A . 5 PHE CB 1 1 18 18961 1 1 5 PHE CD1 C 3.127 5.873 0.197 1.00 . A A . 5 PHE CD1 1 1 18 18962 1 1 5 PHE CD2 C 4.541 6.067 2.108 1.00 . A A . 5 PHE CD2 1 1 18 18963 1 1 5 PHE CE1 C 3.291 7.219 -0.064 1.00 . A A . 5 PHE CE1 1 1 18 18964 1 1 5 PHE CE2 C 4.709 7.414 1.850 1.00 . A A . 5 PHE CE2 1 1 18 18965 1 1 5 PHE CG C 3.749 5.282 1.286 1.00 . A A . 5 PHE CG 1 1 18 18966 1 1 5 PHE CZ C 4.083 7.991 0.762 1.00 . A A . 5 PHE CZ 1 1 18 18967 1 1 5 PHE H H 6.100 3.391 -0.470 1.00 . A A . 5 PHE H 1 1 18 18968 1 1 5 PHE HA H 4.358 1.904 0.996 1.00 . A A . 5 PHE HA 1 1 18 18969 1 1 5 PHE HB2 H 2.517 3.595 1.497 1.00 . A A . 5 PHE HB2 1 1 18 18970 1 1 5 PHE HB3 H 3.905 3.624 2.574 1.00 . A A . 5 PHE HB3 1 1 18 18971 1 1 5 PHE HD1 H 2.507 5.270 -0.450 1.00 . A A . 5 PHE HD1 1 1 18 18972 1 1 5 PHE HD2 H 5.032 5.619 2.959 1.00 . A A . 5 PHE HD2 1 1 18 18973 1 1 5 PHE HE1 H 2.800 7.668 -0.916 1.00 . A A . 5 PHE HE1 1 1 18 18974 1 1 5 PHE HE2 H 5.329 8.016 2.499 1.00 . A A . 5 PHE HE2 1 1 18 18975 1 1 5 PHE HZ H 4.212 9.044 0.559 1.00 . A A . 5 PHE HZ 1 1 18 18976 1 1 5 PHE N N 5.714 3.361 0.430 1.00 . A A . 5 PHE N 1 1 18 18977 1 1 5 PHE O O 4.057 3.487 -1.724 1.00 . A A . 5 PHE O 1 1 18 18978 1 1 6 GLU C C 0.173 2.128 -1.634 1.00 . A A . 6 GLU C 1 1 18 18979 1 1 6 GLU CA C 1.654 2.101 -1.992 1.00 . A A . 6 GLU CA 1 1 18 18980 1 1 6 GLU CB C 1.976 0.821 -2.766 1.00 . A A . 6 GLU CB 1 1 18 18981 1 1 6 GLU CD C 1.412 1.786 -5.030 1.00 . A A . 6 GLU CD 1 1 18 18982 1 1 6 GLU CG C 1.168 0.661 -4.043 1.00 . A A . 6 GLU CG 1 1 18 18983 1 1 6 GLU H H 2.173 1.735 0.029 1.00 . A A . 6 GLU H 1 1 18 18984 1 1 6 GLU HA H 1.878 2.956 -2.614 1.00 . A A . 6 GLU HA 1 1 18 18985 1 1 6 GLU HB2 H 3.024 0.828 -3.029 1.00 . A A . 6 GLU HB2 1 1 18 18986 1 1 6 GLU HB3 H 1.779 -0.033 -2.129 1.00 . A A . 6 GLU HB3 1 1 18 18987 1 1 6 GLU HG2 H 1.439 -0.273 -4.512 1.00 . A A . 6 GLU HG2 1 1 18 18988 1 1 6 GLU HG3 H 0.118 0.645 -3.790 1.00 . A A . 6 GLU HG3 1 1 18 18989 1 1 6 GLU N N 2.469 2.197 -0.783 1.00 . A A . 6 GLU N 1 1 18 18990 1 1 6 GLU O O -0.229 1.602 -0.597 1.00 . A A . 6 GLU O 1 1 18 18991 1 1 6 GLU OE1 O 2.389 1.696 -5.803 1.00 . A A . 6 GLU OE1 1 1 18 18992 1 1 6 GLU OE2 O 0.628 2.760 -5.028 1.00 . A A . 6 GLU OE2 1 1 18 18993 1 1 7 TYR C C -2.815 1.647 -2.825 1.00 . A A . 7 TYR C 1 1 18 18994 1 1 7 TYR CA C -2.063 2.831 -2.242 1.00 . A A . 7 TYR CA 1 1 18 18995 1 1 7 TYR CB C -2.611 4.139 -2.810 1.00 . A A . 7 TYR CB 1 1 18 18996 1 1 7 TYR CD1 C -1.143 4.948 -4.695 1.00 . A A . 7 TYR CD1 1 1 18 18997 1 1 7 TYR CD2 C -3.222 3.924 -5.250 1.00 . A A . 7 TYR CD2 1 1 18 18998 1 1 7 TYR CE1 C -0.872 5.137 -6.037 1.00 . A A . 7 TYR CE1 1 1 18 18999 1 1 7 TYR CE2 C -2.960 4.110 -6.595 1.00 . A A . 7 TYR CE2 1 1 18 19000 1 1 7 TYR CG C -2.320 4.339 -4.280 1.00 . A A . 7 TYR CG 1 1 18 19001 1 1 7 TYR CZ C -1.784 4.717 -6.982 1.00 . A A . 7 TYR CZ 1 1 18 19002 1 1 7 TYR H H -0.275 3.150 -3.297 1.00 . A A . 7 TYR H 1 1 18 19003 1 1 7 TYR HA H -2.207 2.827 -1.181 1.00 . A A . 7 TYR HA 1 1 18 19004 1 1 7 TYR HB2 H -3.678 4.158 -2.679 1.00 . A A . 7 TYR HB2 1 1 18 19005 1 1 7 TYR HB3 H -2.175 4.967 -2.272 1.00 . A A . 7 TYR HB3 1 1 18 19006 1 1 7 TYR HD1 H -0.431 5.276 -3.952 1.00 . A A . 7 TYR HD1 1 1 18 19007 1 1 7 TYR HD2 H -4.143 3.448 -4.943 1.00 . A A . 7 TYR HD2 1 1 18 19008 1 1 7 TYR HE1 H 0.048 5.612 -6.340 1.00 . A A . 7 TYR HE1 1 1 18 19009 1 1 7 TYR HE2 H -3.674 3.780 -7.334 1.00 . A A . 7 TYR HE2 1 1 18 19010 1 1 7 TYR HH H -0.621 4.625 -8.511 1.00 . A A . 7 TYR HH 1 1 18 19011 1 1 7 TYR N N -0.639 2.741 -2.490 1.00 . A A . 7 TYR N 1 1 18 19012 1 1 7 TYR O O -3.006 1.550 -4.037 1.00 . A A . 7 TYR O 1 1 18 19013 1 1 7 TYR OH O -1.520 4.904 -8.320 1.00 . A A . 7 TYR OH 1 1 18 19014 1 1 8 ALA C C -5.479 -0.087 -2.356 1.00 . A A . 8 ALA C 1 1 18 19015 1 1 8 ALA CA C -3.997 -0.422 -2.372 1.00 . A A . 8 ALA CA 1 1 18 19016 1 1 8 ALA CB C -3.711 -1.614 -1.471 1.00 . A A . 8 ALA CB 1 1 18 19017 1 1 8 ALA H H -3.044 0.871 -0.989 1.00 . A A . 8 ALA H 1 1 18 19018 1 1 8 ALA HA H -3.699 -0.672 -3.378 1.00 . A A . 8 ALA HA 1 1 18 19019 1 1 8 ALA HB1 H -2.798 -1.445 -0.919 1.00 . A A . 8 ALA HB1 1 1 18 19020 1 1 8 ALA HB2 H -3.609 -2.504 -2.072 1.00 . A A . 8 ALA HB2 1 1 18 19021 1 1 8 ALA HB3 H -4.530 -1.742 -0.777 1.00 . A A . 8 ALA HB3 1 1 18 19022 1 1 8 ALA N N -3.240 0.744 -1.947 1.00 . A A . 8 ALA N 1 1 18 19023 1 1 8 ALA O O -6.276 -0.761 -1.705 1.00 . A A . 8 ALA O 1 1 18 19024 1 1 9 GLU C C -7.818 1.275 -4.493 1.00 . A A . 9 GLU C 1 1 18 19025 1 1 9 GLU CA C -7.200 1.442 -3.126 1.00 . A A . 9 GLU CA 1 1 18 19026 1 1 9 GLU CB C -7.213 2.902 -2.643 1.00 . A A . 9 GLU CB 1 1 18 19027 1 1 9 GLU CD C -7.308 4.123 -4.861 1.00 . A A . 9 GLU CD 1 1 18 19028 1 1 9 GLU CG C -7.967 3.899 -3.512 1.00 . A A . 9 GLU CG 1 1 18 19029 1 1 9 GLU H H -5.157 1.461 -3.580 1.00 . A A . 9 GLU H 1 1 18 19030 1 1 9 GLU HA H -7.780 0.851 -2.452 1.00 . A A . 9 GLU HA 1 1 18 19031 1 1 9 GLU HB2 H -7.650 2.930 -1.660 1.00 . A A . 9 GLU HB2 1 1 18 19032 1 1 9 GLU HB3 H -6.188 3.234 -2.572 1.00 . A A . 9 GLU HB3 1 1 18 19033 1 1 9 GLU HG2 H -8.961 3.530 -3.665 1.00 . A A . 9 GLU HG2 1 1 18 19034 1 1 9 GLU HG3 H -8.012 4.840 -2.995 1.00 . A A . 9 GLU HG3 1 1 18 19035 1 1 9 GLU N N -5.835 0.972 -3.077 1.00 . A A . 9 GLU N 1 1 18 19036 1 1 9 GLU O O -7.136 1.080 -5.500 1.00 . A A . 9 GLU O 1 1 18 19037 1 1 9 GLU OE1 O -6.297 4.854 -4.913 1.00 . A A . 9 GLU OE1 1 1 18 19038 1 1 9 GLU OE2 O -7.802 3.567 -5.864 1.00 . A A . 9 GLU OE2 1 1 18 19039 1 1 10 VAL C C -10.251 2.581 -6.272 1.00 . A A . 10 VAL C 1 1 18 19040 1 1 10 VAL CA C -9.907 1.216 -5.686 1.00 . A A . 10 VAL CA 1 1 18 19041 1 1 10 VAL CB C -11.156 0.383 -5.405 1.00 . A A . 10 VAL CB 1 1 18 19042 1 1 10 VAL CG1 C -11.983 0.190 -6.665 1.00 . A A . 10 VAL CG1 1 1 18 19043 1 1 10 VAL CG2 C -10.754 -0.958 -4.805 1.00 . A A . 10 VAL CG2 1 1 18 19044 1 1 10 VAL H H -9.598 1.521 -3.645 1.00 . A A . 10 VAL H 1 1 18 19045 1 1 10 VAL HA H -9.314 0.690 -6.381 1.00 . A A . 10 VAL HA 1 1 18 19046 1 1 10 VAL HB H -11.738 0.906 -4.676 1.00 . A A . 10 VAL HB 1 1 18 19047 1 1 10 VAL HG11 H -11.751 0.973 -7.370 1.00 . A A . 10 VAL HG11 1 1 18 19048 1 1 10 VAL HG12 H -13.033 0.226 -6.417 1.00 . A A . 10 VAL HG12 1 1 18 19049 1 1 10 VAL HG13 H -11.751 -0.769 -7.103 1.00 . A A . 10 VAL HG13 1 1 18 19050 1 1 10 VAL HG21 H -10.858 -0.918 -3.730 1.00 . A A . 10 VAL HG21 1 1 18 19051 1 1 10 VAL HG22 H -9.726 -1.171 -5.059 1.00 . A A . 10 VAL HG22 1 1 18 19052 1 1 10 VAL HG23 H -11.388 -1.737 -5.201 1.00 . A A . 10 VAL HG23 1 1 18 19053 1 1 10 VAL N N -9.134 1.358 -4.491 1.00 . A A . 10 VAL N 1 1 18 19054 1 1 10 VAL O O -10.269 2.761 -7.489 1.00 . A A . 10 VAL O 1 1 18 19055 1 1 11 ASP C C -10.226 5.953 -4.859 1.00 . A A . 11 ASP C 1 1 18 19056 1 1 11 ASP CA C -10.813 4.907 -5.822 1.00 . A A . 11 ASP CA 1 1 18 19057 1 1 11 ASP CB C -12.327 5.121 -5.974 1.00 . A A . 11 ASP CB 1 1 18 19058 1 1 11 ASP CG C -12.709 6.576 -6.189 1.00 . A A . 11 ASP CG 1 1 18 19059 1 1 11 ASP H H -10.592 3.310 -4.448 1.00 . A A . 11 ASP H 1 1 18 19060 1 1 11 ASP HA H -10.351 5.043 -6.788 1.00 . A A . 11 ASP HA 1 1 18 19061 1 1 11 ASP HB2 H -12.672 4.563 -6.822 1.00 . A A . 11 ASP HB2 1 1 18 19062 1 1 11 ASP HB3 H -12.829 4.763 -5.089 1.00 . A A . 11 ASP HB3 1 1 18 19063 1 1 11 ASP N N -10.528 3.540 -5.394 1.00 . A A . 11 ASP N 1 1 18 19064 1 1 11 ASP O O -9.801 7.021 -5.297 1.00 . A A . 11 ASP O 1 1 18 19065 1 1 11 ASP OD1 O -12.446 7.103 -7.291 1.00 . A A . 11 ASP OD1 1 1 18 19066 1 1 11 ASP OD2 O -13.281 7.183 -5.259 1.00 . A A . 11 ASP OD2 1 1 18 19067 1 1 12 GLU C C -9.195 6.008 -1.292 1.00 . A A . 12 GLU C 1 1 18 19068 1 1 12 GLU CA C -9.703 6.642 -2.583 1.00 . A A . 12 GLU CA 1 1 18 19069 1 1 12 GLU CB C -10.806 7.648 -2.255 1.00 . A A . 12 GLU CB 1 1 18 19070 1 1 12 GLU CD C -12.297 9.515 -3.075 1.00 . A A . 12 GLU CD 1 1 18 19071 1 1 12 GLU CG C -11.186 8.543 -3.423 1.00 . A A . 12 GLU CG 1 1 18 19072 1 1 12 GLU H H -10.437 4.751 -3.258 1.00 . A A . 12 GLU H 1 1 18 19073 1 1 12 GLU HA H -8.880 7.169 -3.044 1.00 . A A . 12 GLU HA 1 1 18 19074 1 1 12 GLU HB2 H -11.687 7.106 -1.944 1.00 . A A . 12 GLU HB2 1 1 18 19075 1 1 12 GLU HB3 H -10.473 8.272 -1.443 1.00 . A A . 12 GLU HB3 1 1 18 19076 1 1 12 GLU HG2 H -10.317 9.106 -3.726 1.00 . A A . 12 GLU HG2 1 1 18 19077 1 1 12 GLU HG3 H -11.513 7.922 -4.242 1.00 . A A . 12 GLU HG3 1 1 18 19078 1 1 12 GLU N N -10.199 5.658 -3.557 1.00 . A A . 12 GLU N 1 1 18 19079 1 1 12 GLU O O -9.686 4.972 -0.870 1.00 . A A . 12 GLU O 1 1 18 19080 1 1 12 GLU OE1 O -11.995 10.573 -2.484 1.00 . A A . 12 GLU OE1 1 1 18 19081 1 1 12 GLU OE2 O -13.468 9.217 -3.392 1.00 . A A . 12 GLU OE2 1 1 18 19082 1 1 13 ILE C C -7.750 7.241 1.697 1.00 . A A . 13 ILE C 1 1 18 19083 1 1 13 ILE CA C -7.666 6.171 0.605 1.00 . A A . 13 ILE CA 1 1 18 19084 1 1 13 ILE CB C -6.186 5.729 0.420 1.00 . A A . 13 ILE CB 1 1 18 19085 1 1 13 ILE CD1 C -5.483 7.743 -0.970 1.00 . A A . 13 ILE CD1 1 1 18 19086 1 1 13 ILE CG1 C -5.258 6.944 0.296 1.00 . A A . 13 ILE CG1 1 1 18 19087 1 1 13 ILE CG2 C -6.065 4.865 -0.818 1.00 . A A . 13 ILE CG2 1 1 18 19088 1 1 13 ILE H H -7.906 7.511 -1.020 1.00 . A A . 13 ILE H 1 1 18 19089 1 1 13 ILE HA H -8.245 5.310 0.912 1.00 . A A . 13 ILE HA 1 1 18 19090 1 1 13 ILE HB H -5.885 5.127 1.276 1.00 . A A . 13 ILE HB 1 1 18 19091 1 1 13 ILE HD11 H -5.786 7.079 -1.766 1.00 . A A . 13 ILE HD11 1 1 18 19092 1 1 13 ILE HD12 H -4.568 8.245 -1.246 1.00 . A A . 13 ILE HD12 1 1 18 19093 1 1 13 ILE HD13 H -6.255 8.476 -0.798 1.00 . A A . 13 ILE HD13 1 1 18 19094 1 1 13 ILE HG12 H -5.421 7.603 1.135 1.00 . A A . 13 ILE HG12 1 1 18 19095 1 1 13 ILE HG13 H -4.231 6.612 0.301 1.00 . A A . 13 ILE HG13 1 1 18 19096 1 1 13 ILE HG21 H -5.220 5.194 -1.404 1.00 . A A . 13 ILE HG21 1 1 18 19097 1 1 13 ILE HG22 H -6.963 4.952 -1.403 1.00 . A A . 13 ILE HG22 1 1 18 19098 1 1 13 ILE HG23 H -5.920 3.835 -0.528 1.00 . A A . 13 ILE HG23 1 1 18 19099 1 1 13 ILE N N -8.235 6.669 -0.647 1.00 . A A . 13 ILE N 1 1 18 19100 1 1 13 ILE O O -8.373 8.286 1.511 1.00 . A A . 13 ILE O 1 1 18 19101 1 1 14 VAL C C -5.775 7.800 4.702 1.00 . A A . 14 VAL C 1 1 18 19102 1 1 14 VAL CA C -7.096 7.909 3.948 1.00 . A A . 14 VAL CA 1 1 18 19103 1 1 14 VAL CB C -8.271 7.670 4.921 1.00 . A A . 14 VAL CB 1 1 18 19104 1 1 14 VAL CG1 C -8.173 8.593 6.129 1.00 . A A . 14 VAL CG1 1 1 18 19105 1 1 14 VAL CG2 C -9.599 7.871 4.206 1.00 . A A . 14 VAL CG2 1 1 18 19106 1 1 14 VAL H H -6.643 6.116 2.920 1.00 . A A . 14 VAL H 1 1 18 19107 1 1 14 VAL HA H -7.184 8.906 3.544 1.00 . A A . 14 VAL HA 1 1 18 19108 1 1 14 VAL HB H -8.225 6.649 5.269 1.00 . A A . 14 VAL HB 1 1 18 19109 1 1 14 VAL HG11 H -7.244 8.408 6.647 1.00 . A A . 14 VAL HG11 1 1 18 19110 1 1 14 VAL HG12 H -9.000 8.403 6.796 1.00 . A A . 14 VAL HG12 1 1 18 19111 1 1 14 VAL HG13 H -8.205 9.621 5.800 1.00 . A A . 14 VAL HG13 1 1 18 19112 1 1 14 VAL HG21 H -10.409 7.649 4.886 1.00 . A A . 14 VAL HG21 1 1 18 19113 1 1 14 VAL HG22 H -9.653 7.210 3.355 1.00 . A A . 14 VAL HG22 1 1 18 19114 1 1 14 VAL HG23 H -9.679 8.895 3.874 1.00 . A A . 14 VAL HG23 1 1 18 19115 1 1 14 VAL N N -7.114 6.970 2.831 1.00 . A A . 14 VAL N 1 1 18 19116 1 1 14 VAL O O -5.124 8.804 4.988 1.00 . A A . 14 VAL O 1 1 18 19117 1 1 15 GLU C C -3.057 5.929 4.716 1.00 . A A . 15 GLU C 1 1 18 19118 1 1 15 GLU CA C -4.137 6.317 5.718 1.00 . A A . 15 GLU CA 1 1 18 19119 1 1 15 GLU CB C -4.318 5.206 6.754 1.00 . A A . 15 GLU CB 1 1 18 19120 1 1 15 GLU CD C -5.535 4.407 8.818 1.00 . A A . 15 GLU CD 1 1 18 19121 1 1 15 GLU CG C -5.344 5.536 7.825 1.00 . A A . 15 GLU CG 1 1 18 19122 1 1 15 GLU H H -5.966 5.815 4.775 1.00 . A A . 15 GLU H 1 1 18 19123 1 1 15 GLU HA H -3.842 7.228 6.218 1.00 . A A . 15 GLU HA 1 1 18 19124 1 1 15 GLU HB2 H -4.635 4.305 6.248 1.00 . A A . 15 GLU HB2 1 1 18 19125 1 1 15 GLU HB3 H -3.370 5.023 7.238 1.00 . A A . 15 GLU HB3 1 1 18 19126 1 1 15 GLU HG2 H -5.016 6.415 8.361 1.00 . A A . 15 GLU HG2 1 1 18 19127 1 1 15 GLU HG3 H -6.291 5.740 7.347 1.00 . A A . 15 GLU HG3 1 1 18 19128 1 1 15 GLU N N -5.390 6.571 5.018 1.00 . A A . 15 GLU N 1 1 18 19129 1 1 15 GLU O O -3.333 5.245 3.736 1.00 . A A . 15 GLU O 1 1 18 19130 1 1 15 GLU OE1 O -4.760 4.338 9.795 1.00 . A A . 15 GLU OE1 1 1 18 19131 1 1 15 GLU OE2 O -6.459 3.591 8.619 1.00 . A A . 15 GLU OE2 1 1 18 19132 1 1 16 LYS C C 0.616 6.074 4.739 1.00 . A A . 16 LYS C 1 1 18 19133 1 1 16 LYS CA C -0.742 6.070 4.026 1.00 . A A . 16 LYS CA 1 1 18 19134 1 1 16 LYS CB C -0.713 7.076 2.878 1.00 . A A . 16 LYS CB 1 1 18 19135 1 1 16 LYS CD C -0.554 9.488 2.187 1.00 . A A . 16 LYS CD 1 1 18 19136 1 1 16 LYS CE C 0.892 9.410 1.722 1.00 . A A . 16 LYS CE 1 1 18 19137 1 1 16 LYS CG C -0.825 8.523 3.331 1.00 . A A . 16 LYS CG 1 1 18 19138 1 1 16 LYS H H -1.669 6.954 5.719 1.00 . A A . 16 LYS H 1 1 18 19139 1 1 16 LYS HA H -0.936 5.080 3.623 1.00 . A A . 16 LYS HA 1 1 18 19140 1 1 16 LYS HB2 H 0.216 6.962 2.343 1.00 . A A . 16 LYS HB2 1 1 18 19141 1 1 16 LYS HB3 H -1.534 6.865 2.208 1.00 . A A . 16 LYS HB3 1 1 18 19142 1 1 16 LYS HD2 H -1.201 9.242 1.359 1.00 . A A . 16 LYS HD2 1 1 18 19143 1 1 16 LYS HD3 H -0.761 10.493 2.522 1.00 . A A . 16 LYS HD3 1 1 18 19144 1 1 16 LYS HE2 H 1.537 9.650 2.555 1.00 . A A . 16 LYS HE2 1 1 18 19145 1 1 16 LYS HE3 H 1.097 8.405 1.387 1.00 . A A . 16 LYS HE3 1 1 18 19146 1 1 16 LYS HG2 H -1.823 8.696 3.705 1.00 . A A . 16 LYS HG2 1 1 18 19147 1 1 16 LYS HG3 H -0.107 8.700 4.118 1.00 . A A . 16 LYS HG3 1 1 18 19148 1 1 16 LYS HZ1 H 1.002 11.336 0.920 1.00 . A A . 16 LYS HZ1 1 1 18 19149 1 1 16 LYS HZ2 H 0.550 10.151 -0.201 1.00 . A A . 16 LYS HZ2 1 1 18 19150 1 1 16 LYS HZ3 H 2.159 10.269 0.302 1.00 . A A . 16 LYS HZ3 1 1 18 19151 1 1 16 LYS N N -1.836 6.391 4.937 1.00 . A A . 16 LYS N 1 1 18 19152 1 1 16 LYS NZ N 1.170 10.358 0.608 1.00 . A A . 16 LYS NZ 1 1 18 19153 1 1 16 LYS O O 1.320 7.084 4.720 1.00 . A A . 16 LYS O 1 1 18 19154 1 1 17 ARG C C 2.766 3.446 6.136 1.00 . A A . 17 ARG C 1 1 18 19155 1 1 17 ARG CA C 2.259 4.881 6.078 1.00 . A A . 17 ARG CA 1 1 18 19156 1 1 17 ARG CB C 2.092 5.423 7.492 1.00 . A A . 17 ARG CB 1 1 18 19157 1 1 17 ARG CD C 3.126 5.940 9.703 1.00 . A A . 17 ARG CD 1 1 18 19158 1 1 17 ARG CG C 3.388 5.508 8.274 1.00 . A A . 17 ARG CG 1 1 18 19159 1 1 17 ARG CZ C 2.302 4.972 11.806 1.00 . A A . 17 ARG CZ 1 1 18 19160 1 1 17 ARG H H 0.409 4.168 5.327 1.00 . A A . 17 ARG H 1 1 18 19161 1 1 17 ARG HA H 2.979 5.486 5.549 1.00 . A A . 17 ARG HA 1 1 18 19162 1 1 17 ARG HB2 H 1.666 6.414 7.436 1.00 . A A . 17 ARG HB2 1 1 18 19163 1 1 17 ARG HB3 H 1.412 4.781 8.032 1.00 . A A . 17 ARG HB3 1 1 18 19164 1 1 17 ARG HD2 H 4.033 6.358 10.111 1.00 . A A . 17 ARG HD2 1 1 18 19165 1 1 17 ARG HD3 H 2.352 6.694 9.692 1.00 . A A . 17 ARG HD3 1 1 18 19166 1 1 17 ARG HE H 2.690 3.933 10.147 1.00 . A A . 17 ARG HE 1 1 18 19167 1 1 17 ARG HG2 H 3.860 4.537 8.279 1.00 . A A . 17 ARG HG2 1 1 18 19168 1 1 17 ARG HG3 H 4.039 6.229 7.800 1.00 . A A . 17 ARG HG3 1 1 18 19169 1 1 17 ARG HH11 H 2.584 6.972 11.840 1.00 . A A . 17 ARG HH11 1 1 18 19170 1 1 17 ARG HH12 H 2.004 6.280 13.318 1.00 . A A . 17 ARG HH12 1 1 18 19171 1 1 17 ARG HH21 H 1.923 3.007 12.087 1.00 . A A . 17 ARG HH21 1 1 18 19172 1 1 17 ARG HH22 H 1.626 4.023 13.457 1.00 . A A . 17 ARG HH22 1 1 18 19173 1 1 17 ARG N N 0.986 4.959 5.364 1.00 . A A . 17 ARG N 1 1 18 19174 1 1 17 ARG NE N 2.691 4.829 10.543 1.00 . A A . 17 ARG NE 1 1 18 19175 1 1 17 ARG NH1 N 2.296 6.173 12.367 1.00 . A A . 17 ARG NH1 1 1 18 19176 1 1 17 ARG NH2 N 1.919 3.914 12.508 1.00 . A A . 17 ARG NH2 1 1 18 19177 1 1 17 ARG O O 2.344 2.678 7.002 1.00 . A A . 17 ARG O 1 1 18 19178 1 1 18 GLY C C 5.551 1.516 4.723 1.00 . A A . 18 GLY C 1 1 18 19179 1 1 18 GLY CA C 4.146 1.704 5.251 1.00 . A A . 18 GLY CA 1 1 18 19180 1 1 18 GLY H H 3.990 3.704 4.559 1.00 . A A . 18 GLY H 1 1 18 19181 1 1 18 GLY HA2 H 4.115 1.346 6.268 1.00 . A A . 18 GLY HA2 1 1 18 19182 1 1 18 GLY HA3 H 3.480 1.104 4.659 1.00 . A A . 18 GLY HA3 1 1 18 19183 1 1 18 GLY N N 3.663 3.067 5.230 1.00 . A A . 18 GLY N 1 1 18 19184 1 1 18 GLY O O 6.486 2.209 5.123 1.00 . A A . 18 GLY O 1 1 18 19185 1 1 19 LYS C C 6.910 0.426 1.708 1.00 . A A . 19 LYS C 1 1 18 19186 1 1 19 LYS CA C 6.944 0.180 3.209 1.00 . A A . 19 LYS CA 1 1 18 19187 1 1 19 LYS CB C 7.181 -1.299 3.483 1.00 . A A . 19 LYS CB 1 1 18 19188 1 1 19 LYS CD C 7.931 -3.062 5.076 1.00 . A A . 19 LYS CD 1 1 18 19189 1 1 19 LYS CE C 8.032 -3.426 6.548 1.00 . A A . 19 LYS CE 1 1 18 19190 1 1 19 LYS CG C 7.692 -1.581 4.881 1.00 . A A . 19 LYS CG 1 1 18 19191 1 1 19 LYS H H 4.868 0.055 3.551 1.00 . A A . 19 LYS H 1 1 18 19192 1 1 19 LYS HA H 7.724 0.748 3.651 1.00 . A A . 19 LYS HA 1 1 18 19193 1 1 19 LYS HB2 H 6.233 -1.817 3.358 1.00 . A A . 19 LYS HB2 1 1 18 19194 1 1 19 LYS HB3 H 7.891 -1.688 2.771 1.00 . A A . 19 LYS HB3 1 1 18 19195 1 1 19 LYS HD2 H 7.111 -3.601 4.634 1.00 . A A . 19 LYS HD2 1 1 18 19196 1 1 19 LYS HD3 H 8.852 -3.333 4.581 1.00 . A A . 19 LYS HD3 1 1 18 19197 1 1 19 LYS HE2 H 7.106 -3.158 7.034 1.00 . A A . 19 LYS HE2 1 1 18 19198 1 1 19 LYS HE3 H 8.186 -4.491 6.631 1.00 . A A . 19 LYS HE3 1 1 18 19199 1 1 19 LYS HG2 H 8.620 -1.050 5.032 1.00 . A A . 19 LYS HG2 1 1 18 19200 1 1 19 LYS HG3 H 6.958 -1.245 5.599 1.00 . A A . 19 LYS HG3 1 1 18 19201 1 1 19 LYS HZ1 H 9.220 -3.016 8.216 1.00 . A A . 19 LYS HZ1 1 1 18 19202 1 1 19 LYS HZ2 H 9.001 -1.690 7.188 1.00 . A A . 19 LYS HZ2 1 1 18 19203 1 1 19 LYS HZ3 H 10.054 -2.939 6.747 1.00 . A A . 19 LYS HZ3 1 1 18 19204 1 1 19 LYS N N 5.674 0.548 3.821 1.00 . A A . 19 LYS N 1 1 18 19205 1 1 19 LYS NZ N 9.155 -2.718 7.222 1.00 . A A . 19 LYS NZ 1 1 18 19206 1 1 19 LYS O O 7.551 1.330 1.175 1.00 . A A . 19 LYS O 1 1 18 19207 1 1 20 GLY C C 4.597 -1.007 -0.598 1.00 . A A . 20 GLY C 1 1 18 19208 1 1 20 GLY CA C 5.945 -0.400 -0.355 1.00 . A A . 20 GLY CA 1 1 18 19209 1 1 20 GLY H H 5.735 -1.131 1.573 1.00 . A A . 20 GLY H 1 1 18 19210 1 1 20 GLY HA2 H 5.969 0.619 -0.706 1.00 . A A . 20 GLY HA2 1 1 18 19211 1 1 20 GLY HA3 H 6.694 -0.985 -0.851 1.00 . A A . 20 GLY HA3 1 1 18 19212 1 1 20 GLY N N 6.167 -0.435 1.061 1.00 . A A . 20 GLY N 1 1 18 19213 1 1 20 GLY O O 3.763 -0.478 -1.323 1.00 . A A . 20 GLY O 1 1 18 19214 1 1 21 LYS C C 2.735 -3.197 1.472 1.00 . A A . 21 LYS C 1 1 18 19215 1 1 21 LYS CA C 3.173 -2.885 0.028 1.00 . A A . 21 LYS CA 1 1 18 19216 1 1 21 LYS CB C 3.307 -4.177 -0.783 1.00 . A A . 21 LYS CB 1 1 18 19217 1 1 21 LYS CD C 4.307 -3.349 -2.944 1.00 . A A . 21 LYS CD 1 1 18 19218 1 1 21 LYS CE C 3.894 -2.430 -4.083 1.00 . A A . 21 LYS CE 1 1 18 19219 1 1 21 LYS CG C 3.096 -3.980 -2.276 1.00 . A A . 21 LYS CG 1 1 18 19220 1 1 21 LYS H H 5.185 -2.531 0.525 1.00 . A A . 21 LYS H 1 1 18 19221 1 1 21 LYS HA H 2.425 -2.253 -0.435 1.00 . A A . 21 LYS HA 1 1 18 19222 1 1 21 LYS HB2 H 4.295 -4.583 -0.632 1.00 . A A . 21 LYS HB2 1 1 18 19223 1 1 21 LYS HB3 H 2.576 -4.889 -0.430 1.00 . A A . 21 LYS HB3 1 1 18 19224 1 1 21 LYS HD2 H 4.857 -2.779 -2.213 1.00 . A A . 21 LYS HD2 1 1 18 19225 1 1 21 LYS HD3 H 4.937 -4.133 -3.338 1.00 . A A . 21 LYS HD3 1 1 18 19226 1 1 21 LYS HE2 H 3.339 -3.005 -4.808 1.00 . A A . 21 LYS HE2 1 1 18 19227 1 1 21 LYS HE3 H 3.265 -1.646 -3.688 1.00 . A A . 21 LYS HE3 1 1 18 19228 1 1 21 LYS HG2 H 2.908 -4.940 -2.733 1.00 . A A . 21 LYS HG2 1 1 18 19229 1 1 21 LYS HG3 H 2.239 -3.338 -2.425 1.00 . A A . 21 LYS HG3 1 1 18 19230 1 1 21 LYS HZ1 H 5.604 -1.232 -4.080 1.00 . A A . 21 LYS HZ1 1 1 18 19231 1 1 21 LYS HZ2 H 4.754 -1.209 -5.542 1.00 . A A . 21 LYS HZ2 1 1 18 19232 1 1 21 LYS HZ3 H 5.696 -2.552 -5.132 1.00 . A A . 21 LYS HZ3 1 1 18 19233 1 1 21 LYS N N 4.421 -2.151 0.041 1.00 . A A . 21 LYS N 1 1 18 19234 1 1 21 LYS NZ N 5.069 -1.812 -4.757 1.00 . A A . 21 LYS NZ 1 1 18 19235 1 1 21 LYS O O 1.628 -3.683 1.696 1.00 . A A . 21 LYS O 1 1 18 19236 1 1 22 ASP C C 2.551 -1.946 4.467 1.00 . A A . 22 ASP C 1 1 18 19237 1 1 22 ASP CA C 3.311 -3.109 3.863 1.00 . A A . 22 ASP CA 1 1 18 19238 1 1 22 ASP CB C 4.602 -3.294 4.662 1.00 . A A . 22 ASP CB 1 1 18 19239 1 1 22 ASP CG C 4.359 -3.869 6.044 1.00 . A A . 22 ASP CG 1 1 18 19240 1 1 22 ASP H H 4.455 -2.495 2.234 1.00 . A A . 22 ASP H 1 1 18 19241 1 1 22 ASP HA H 2.717 -3.983 3.927 1.00 . A A . 22 ASP HA 1 1 18 19242 1 1 22 ASP HB2 H 5.266 -3.943 4.126 1.00 . A A . 22 ASP HB2 1 1 18 19243 1 1 22 ASP HB3 H 5.074 -2.331 4.781 1.00 . A A . 22 ASP HB3 1 1 18 19244 1 1 22 ASP N N 3.603 -2.876 2.456 1.00 . A A . 22 ASP N 1 1 18 19245 1 1 22 ASP O O 2.373 -1.865 5.680 1.00 . A A . 22 ASP O 1 1 18 19246 1 1 22 ASP OD1 O 4.023 -3.090 6.961 1.00 . A A . 22 ASP OD1 1 1 18 19247 1 1 22 ASP OD2 O 4.510 -5.095 6.215 1.00 . A A . 22 ASP OD2 1 1 18 19248 1 1 23 VAL C C -0.108 -0.207 4.150 1.00 . A A . 23 VAL C 1 1 18 19249 1 1 23 VAL CA C 1.374 0.101 4.063 1.00 . A A . 23 VAL CA 1 1 18 19250 1 1 23 VAL CB C 1.601 1.285 3.121 1.00 . A A . 23 VAL CB 1 1 18 19251 1 1 23 VAL CG1 C 0.854 1.106 1.804 1.00 . A A . 23 VAL CG1 1 1 18 19252 1 1 23 VAL CG2 C 1.196 2.574 3.793 1.00 . A A . 23 VAL CG2 1 1 18 19253 1 1 23 VAL H H 2.333 -1.138 2.680 1.00 . A A . 23 VAL H 1 1 18 19254 1 1 23 VAL HA H 1.736 0.376 5.039 1.00 . A A . 23 VAL HA 1 1 18 19255 1 1 23 VAL HB H 2.661 1.334 2.910 1.00 . A A . 23 VAL HB 1 1 18 19256 1 1 23 VAL HG11 H 0.814 2.049 1.287 1.00 . A A . 23 VAL HG11 1 1 18 19257 1 1 23 VAL HG12 H -0.152 0.763 1.992 1.00 . A A . 23 VAL HG12 1 1 18 19258 1 1 23 VAL HG13 H 1.371 0.383 1.191 1.00 . A A . 23 VAL HG13 1 1 18 19259 1 1 23 VAL HG21 H 1.978 3.308 3.671 1.00 . A A . 23 VAL HG21 1 1 18 19260 1 1 23 VAL HG22 H 1.035 2.391 4.843 1.00 . A A . 23 VAL HG22 1 1 18 19261 1 1 23 VAL HG23 H 0.284 2.939 3.352 1.00 . A A . 23 VAL HG23 1 1 18 19262 1 1 23 VAL N N 2.116 -1.048 3.619 1.00 . A A . 23 VAL N 1 1 18 19263 1 1 23 VAL O O -0.629 -1.043 3.411 1.00 . A A . 23 VAL O 1 1 18 19264 1 1 24 GLU C C -2.998 1.468 4.647 1.00 . A A . 24 GLU C 1 1 18 19265 1 1 24 GLU CA C -2.206 0.295 5.217 1.00 . A A . 24 GLU CA 1 1 18 19266 1 1 24 GLU CB C -2.535 0.104 6.696 1.00 . A A . 24 GLU CB 1 1 18 19267 1 1 24 GLU CD C -1.571 2.347 7.387 1.00 . A A . 24 GLU CD 1 1 18 19268 1 1 24 GLU CG C -1.609 0.854 7.648 1.00 . A A . 24 GLU CG 1 1 18 19269 1 1 24 GLU H H -0.320 1.188 5.537 1.00 . A A . 24 GLU H 1 1 18 19270 1 1 24 GLU HA H -2.470 -0.613 4.681 1.00 . A A . 24 GLU HA 1 1 18 19271 1 1 24 GLU HB2 H -3.545 0.443 6.869 1.00 . A A . 24 GLU HB2 1 1 18 19272 1 1 24 GLU HB3 H -2.474 -0.947 6.926 1.00 . A A . 24 GLU HB3 1 1 18 19273 1 1 24 GLU HG2 H -1.950 0.693 8.660 1.00 . A A . 24 GLU HG2 1 1 18 19274 1 1 24 GLU HG3 H -0.610 0.459 7.541 1.00 . A A . 24 GLU HG3 1 1 18 19275 1 1 24 GLU N N -0.784 0.497 5.027 1.00 . A A . 24 GLU N 1 1 18 19276 1 1 24 GLU O O -3.213 2.477 5.317 1.00 . A A . 24 GLU O 1 1 18 19277 1 1 24 GLU OE1 O -0.754 2.783 6.548 1.00 . A A . 24 GLU OE1 1 1 18 19278 1 1 24 GLU OE2 O -2.359 3.080 8.021 1.00 . A A . 24 GLU OE2 1 1 18 19279 1 1 25 TYR C C -5.689 2.062 2.788 1.00 . A A . 25 TYR C 1 1 18 19280 1 1 25 TYR CA C -4.196 2.373 2.746 1.00 . A A . 25 TYR CA 1 1 18 19281 1 1 25 TYR CB C -3.746 2.504 1.291 1.00 . A A . 25 TYR CB 1 1 18 19282 1 1 25 TYR CD1 C -1.354 3.280 1.593 1.00 . A A . 25 TYR CD1 1 1 18 19283 1 1 25 TYR CD2 C -2.820 4.629 0.295 1.00 . A A . 25 TYR CD2 1 1 18 19284 1 1 25 TYR CE1 C -0.325 4.177 1.360 1.00 . A A . 25 TYR CE1 1 1 18 19285 1 1 25 TYR CE2 C -1.798 5.524 0.053 1.00 . A A . 25 TYR CE2 1 1 18 19286 1 1 25 TYR CG C -2.619 3.492 1.065 1.00 . A A . 25 TYR CG 1 1 18 19287 1 1 25 TYR CZ C -0.553 5.294 0.588 1.00 . A A . 25 TYR CZ 1 1 18 19288 1 1 25 TYR H H -3.282 0.486 2.945 1.00 . A A . 25 TYR H 1 1 18 19289 1 1 25 TYR HA H -4.001 3.303 3.258 1.00 . A A . 25 TYR HA 1 1 18 19290 1 1 25 TYR HB2 H -3.412 1.540 0.940 1.00 . A A . 25 TYR HB2 1 1 18 19291 1 1 25 TYR HB3 H -4.589 2.822 0.693 1.00 . A A . 25 TYR HB3 1 1 18 19292 1 1 25 TYR HD1 H -1.177 2.403 2.197 1.00 . A A . 25 TYR HD1 1 1 18 19293 1 1 25 TYR HD2 H -3.791 4.806 -0.124 1.00 . A A . 25 TYR HD2 1 1 18 19294 1 1 25 TYR HE1 H 0.651 3.996 1.778 1.00 . A A . 25 TYR HE1 1 1 18 19295 1 1 25 TYR HE2 H -1.979 6.402 -0.549 1.00 . A A . 25 TYR HE2 1 1 18 19296 1 1 25 TYR HH H 0.125 7.076 0.360 1.00 . A A . 25 TYR HH 1 1 18 19297 1 1 25 TYR N N -3.442 1.325 3.412 1.00 . A A . 25 TYR N 1 1 18 19298 1 1 25 TYR O O -6.086 0.905 2.802 1.00 . A A . 25 TYR O 1 1 18 19299 1 1 25 TYR OH O 0.470 6.180 0.343 1.00 . A A . 25 TYR OH 1 1 18 19300 1 1 26 LEU C C -8.439 2.810 1.386 1.00 . A A . 26 LEU C 1 1 18 19301 1 1 26 LEU CA C -7.951 2.899 2.812 1.00 . A A . 26 LEU CA 1 1 18 19302 1 1 26 LEU CB C -8.647 4.056 3.537 1.00 . A A . 26 LEU CB 1 1 18 19303 1 1 26 LEU CD1 C -10.869 4.733 4.504 1.00 . A A . 26 LEU CD1 1 1 18 19304 1 1 26 LEU CD2 C -10.445 4.980 2.050 1.00 . A A . 26 LEU CD2 1 1 18 19305 1 1 26 LEU CG C -10.156 4.154 3.294 1.00 . A A . 26 LEU CG 1 1 18 19306 1 1 26 LEU H H -6.160 3.987 2.754 1.00 . A A . 26 LEU H 1 1 18 19307 1 1 26 LEU HA H -8.167 1.969 3.317 1.00 . A A . 26 LEU HA 1 1 18 19308 1 1 26 LEU HB2 H -8.476 3.944 4.598 1.00 . A A . 26 LEU HB2 1 1 18 19309 1 1 26 LEU HB3 H -8.191 4.980 3.215 1.00 . A A . 26 LEU HB3 1 1 18 19310 1 1 26 LEU HD11 H -10.811 4.032 5.324 1.00 . A A . 26 LEU HD11 1 1 18 19311 1 1 26 LEU HD12 H -11.904 4.913 4.257 1.00 . A A . 26 LEU HD12 1 1 18 19312 1 1 26 LEU HD13 H -10.399 5.659 4.791 1.00 . A A . 26 LEU HD13 1 1 18 19313 1 1 26 LEU HD21 H -10.311 4.366 1.171 1.00 . A A . 26 LEU HD21 1 1 18 19314 1 1 26 LEU HD22 H -9.771 5.821 2.009 1.00 . A A . 26 LEU HD22 1 1 18 19315 1 1 26 LEU HD23 H -11.464 5.337 2.085 1.00 . A A . 26 LEU HD23 1 1 18 19316 1 1 26 LEU HG H -10.544 3.165 3.127 1.00 . A A . 26 LEU HG 1 1 18 19317 1 1 26 LEU N N -6.516 3.089 2.792 1.00 . A A . 26 LEU N 1 1 18 19318 1 1 26 LEU O O -7.761 3.267 0.474 1.00 . A A . 26 LEU O 1 1 18 19319 1 1 27 VAL C C -11.593 2.294 -0.287 1.00 . A A . 27 VAL C 1 1 18 19320 1 1 27 VAL CA C -10.088 2.106 -0.179 1.00 . A A . 27 VAL CA 1 1 18 19321 1 1 27 VAL CB C -9.628 0.803 -0.884 1.00 . A A . 27 VAL CB 1 1 18 19322 1 1 27 VAL CG1 C -8.497 0.116 -0.131 1.00 . A A . 27 VAL CG1 1 1 18 19323 1 1 27 VAL CG2 C -10.757 -0.187 -1.170 1.00 . A A . 27 VAL CG2 1 1 18 19324 1 1 27 VAL H H -10.086 1.809 1.914 1.00 . A A . 27 VAL H 1 1 18 19325 1 1 27 VAL HA H -9.632 2.910 -0.732 1.00 . A A . 27 VAL HA 1 1 18 19326 1 1 27 VAL HB H -9.232 1.124 -1.818 1.00 . A A . 27 VAL HB 1 1 18 19327 1 1 27 VAL HG11 H -8.242 -0.808 -0.629 1.00 . A A . 27 VAL HG11 1 1 18 19328 1 1 27 VAL HG12 H -8.814 -0.096 0.880 1.00 . A A . 27 VAL HG12 1 1 18 19329 1 1 27 VAL HG13 H -7.633 0.764 -0.110 1.00 . A A . 27 VAL HG13 1 1 18 19330 1 1 27 VAL HG21 H -11.416 0.227 -1.919 1.00 . A A . 27 VAL HG21 1 1 18 19331 1 1 27 VAL HG22 H -11.309 -0.367 -0.267 1.00 . A A . 27 VAL HG22 1 1 18 19332 1 1 27 VAL HG23 H -10.341 -1.115 -1.530 1.00 . A A . 27 VAL HG23 1 1 18 19333 1 1 27 VAL N N -9.591 2.207 1.172 1.00 . A A . 27 VAL N 1 1 18 19334 1 1 27 VAL O O -12.379 1.464 0.170 1.00 . A A . 27 VAL O 1 1 18 19335 1 1 28 ARG C C -13.697 2.990 -2.431 1.00 . A A . 28 ARG C 1 1 18 19336 1 1 28 ARG CA C -13.370 3.674 -1.137 1.00 . A A . 28 ARG CA 1 1 18 19337 1 1 28 ARG CB C -13.642 5.171 -1.244 1.00 . A A . 28 ARG CB 1 1 18 19338 1 1 28 ARG CD C -13.699 5.815 1.188 1.00 . A A . 28 ARG CD 1 1 18 19339 1 1 28 ARG CG C -12.988 5.993 -0.144 1.00 . A A . 28 ARG CG 1 1 18 19340 1 1 28 ARG CZ C -15.736 6.695 2.251 1.00 . A A . 28 ARG CZ 1 1 18 19341 1 1 28 ARG H H -11.303 4.063 -1.155 1.00 . A A . 28 ARG H 1 1 18 19342 1 1 28 ARG HA H -13.965 3.234 -0.356 1.00 . A A . 28 ARG HA 1 1 18 19343 1 1 28 ARG HB2 H -13.272 5.516 -2.196 1.00 . A A . 28 ARG HB2 1 1 18 19344 1 1 28 ARG HB3 H -14.709 5.335 -1.201 1.00 . A A . 28 ARG HB3 1 1 18 19345 1 1 28 ARG HD2 H -13.746 4.760 1.419 1.00 . A A . 28 ARG HD2 1 1 18 19346 1 1 28 ARG HD3 H -13.134 6.324 1.955 1.00 . A A . 28 ARG HD3 1 1 18 19347 1 1 28 ARG HE H -15.481 6.471 0.285 1.00 . A A . 28 ARG HE 1 1 18 19348 1 1 28 ARG HG2 H -11.961 5.678 -0.036 1.00 . A A . 28 ARG HG2 1 1 18 19349 1 1 28 ARG HG3 H -13.018 7.037 -0.423 1.00 . A A . 28 ARG HG3 1 1 18 19350 1 1 28 ARG HH11 H -14.265 6.176 3.536 1.00 . A A . 28 ARG HH11 1 1 18 19351 1 1 28 ARG HH12 H -15.704 6.801 4.269 1.00 . A A . 28 ARG HH12 1 1 18 19352 1 1 28 ARG HH21 H -17.380 7.298 1.243 1.00 . A A . 28 ARG HH21 1 1 18 19353 1 1 28 ARG HH22 H -17.473 7.439 2.967 1.00 . A A . 28 ARG HH22 1 1 18 19354 1 1 28 ARG N N -11.977 3.406 -0.883 1.00 . A A . 28 ARG N 1 1 18 19355 1 1 28 ARG NE N -15.056 6.354 1.160 1.00 . A A . 28 ARG NE 1 1 18 19356 1 1 28 ARG NH1 N -15.190 6.545 3.450 1.00 . A A . 28 ARG NH1 1 1 18 19357 1 1 28 ARG NH2 N -16.964 7.184 2.145 1.00 . A A . 28 ARG NH2 1 1 18 19358 1 1 28 ARG O O -13.742 3.621 -3.486 1.00 . A A . 28 ARG O 1 1 18 19359 1 1 29 TRP C C -14.863 1.569 -4.595 1.00 . A A . 29 TRP C 1 1 18 19360 1 1 29 TRP CA C -14.194 0.813 -3.465 1.00 . A A . 29 TRP CA 1 1 18 19361 1 1 29 TRP CB C -15.088 -0.331 -3.014 1.00 . A A . 29 TRP CB 1 1 18 19362 1 1 29 TRP CD1 C -13.676 -1.957 -4.395 1.00 . A A . 29 TRP CD1 1 1 18 19363 1 1 29 TRP CD2 C -14.924 -2.935 -2.815 1.00 . A A . 29 TRP CD2 1 1 18 19364 1 1 29 TRP CE2 C -14.203 -3.933 -3.496 1.00 . A A . 29 TRP CE2 1 1 18 19365 1 1 29 TRP CE3 C -15.780 -3.312 -1.775 1.00 . A A . 29 TRP CE3 1 1 18 19366 1 1 29 TRP CG C -14.571 -1.679 -3.404 1.00 . A A . 29 TRP CG 1 1 18 19367 1 1 29 TRP CH2 C -15.156 -5.623 -2.151 1.00 . A A . 29 TRP CH2 1 1 18 19368 1 1 29 TRP CZ2 C -14.311 -5.283 -3.171 1.00 . A A . 29 TRP CZ2 1 1 18 19369 1 1 29 TRP CZ3 C -15.886 -4.653 -1.455 1.00 . A A . 29 TRP CZ3 1 1 18 19370 1 1 29 TRP H H -13.863 1.271 -1.436 1.00 . A A . 29 TRP H 1 1 18 19371 1 1 29 TRP HA H -13.259 0.405 -3.821 1.00 . A A . 29 TRP HA 1 1 18 19372 1 1 29 TRP HB2 H -15.174 -0.298 -1.938 1.00 . A A . 29 TRP HB2 1 1 18 19373 1 1 29 TRP HB3 H -16.066 -0.207 -3.452 1.00 . A A . 29 TRP HB3 1 1 18 19374 1 1 29 TRP HD1 H -13.221 -1.210 -5.030 1.00 . A A . 29 TRP HD1 1 1 18 19375 1 1 29 TRP HE1 H -12.843 -3.758 -5.085 1.00 . A A . 29 TRP HE1 1 1 18 19376 1 1 29 TRP HE3 H -16.350 -2.577 -1.228 1.00 . A A . 29 TRP HE3 1 1 18 19377 1 1 29 TRP HH2 H -15.272 -6.659 -1.867 1.00 . A A . 29 TRP HH2 1 1 18 19378 1 1 29 TRP HZ2 H -13.755 -6.043 -3.699 1.00 . A A . 29 TRP HZ2 1 1 18 19379 1 1 29 TRP HZ3 H -16.543 -4.962 -0.655 1.00 . A A . 29 TRP HZ3 1 1 18 19380 1 1 29 TRP N N -13.906 1.677 -2.326 1.00 . A A . 29 TRP N 1 1 18 19381 1 1 29 TRP NE1 N -13.448 -3.311 -4.457 1.00 . A A . 29 TRP NE1 1 1 18 19382 1 1 29 TRP O O -16.078 1.745 -4.609 1.00 . A A . 29 TRP O 1 1 18 19383 1 1 30 LYS C C -15.866 2.395 -7.148 1.00 . A A . 30 LYS C 1 1 18 19384 1 1 30 LYS CA C -14.464 2.814 -6.696 1.00 . A A . 30 LYS CA 1 1 18 19385 1 1 30 LYS CB C -13.491 2.587 -7.856 1.00 . A A . 30 LYS CB 1 1 18 19386 1 1 30 LYS CD C -12.757 3.239 -10.171 1.00 . A A . 30 LYS CD 1 1 18 19387 1 1 30 LYS CE C -12.869 1.821 -10.709 1.00 . A A . 30 LYS CE 1 1 18 19388 1 1 30 LYS CG C -13.751 3.492 -9.050 1.00 . A A . 30 LYS CG 1 1 18 19389 1 1 30 LYS H H -13.040 1.990 -5.317 1.00 . A A . 30 LYS H 1 1 18 19390 1 1 30 LYS HA H -14.473 3.865 -6.447 1.00 . A A . 30 LYS HA 1 1 18 19391 1 1 30 LYS HB2 H -12.484 2.766 -7.509 1.00 . A A . 30 LYS HB2 1 1 18 19392 1 1 30 LYS HB3 H -13.572 1.562 -8.185 1.00 . A A . 30 LYS HB3 1 1 18 19393 1 1 30 LYS HD2 H -12.949 3.934 -10.974 1.00 . A A . 30 LYS HD2 1 1 18 19394 1 1 30 LYS HD3 H -11.756 3.392 -9.793 1.00 . A A . 30 LYS HD3 1 1 18 19395 1 1 30 LYS HE2 H -12.639 1.128 -9.912 1.00 . A A . 30 LYS HE2 1 1 18 19396 1 1 30 LYS HE3 H -13.883 1.658 -11.046 1.00 . A A . 30 LYS HE3 1 1 18 19397 1 1 30 LYS HG2 H -14.749 3.305 -9.420 1.00 . A A . 30 LYS HG2 1 1 18 19398 1 1 30 LYS HG3 H -13.669 4.522 -8.733 1.00 . A A . 30 LYS HG3 1 1 18 19399 1 1 30 LYS HZ1 H -10.952 1.722 -11.533 1.00 . A A . 30 LYS HZ1 1 1 18 19400 1 1 30 LYS HZ2 H -12.140 2.245 -12.620 1.00 . A A . 30 LYS HZ2 1 1 18 19401 1 1 30 LYS HZ3 H -12.041 0.610 -12.196 1.00 . A A . 30 LYS HZ3 1 1 18 19402 1 1 30 LYS N N -14.015 2.069 -5.501 1.00 . A A . 30 LYS N 1 1 18 19403 1 1 30 LYS NZ N -11.935 1.583 -11.844 1.00 . A A . 30 LYS NZ 1 1 18 19404 1 1 30 LYS O O -16.655 3.222 -7.605 1.00 . A A . 30 LYS O 1 1 18 19405 1 1 31 ASP C C -18.080 -0.158 -6.193 1.00 . A A . 31 ASP C 1 1 18 19406 1 1 31 ASP CA C -17.464 0.571 -7.385 1.00 . A A . 31 ASP CA 1 1 18 19407 1 1 31 ASP CB C -17.339 -0.381 -8.575 1.00 . A A . 31 ASP CB 1 1 18 19408 1 1 31 ASP CG C -16.712 0.285 -9.783 1.00 . A A . 31 ASP CG 1 1 18 19409 1 1 31 ASP H H -15.473 0.493 -6.682 1.00 . A A . 31 ASP H 1 1 18 19410 1 1 31 ASP HA H -18.102 1.400 -7.659 1.00 . A A . 31 ASP HA 1 1 18 19411 1 1 31 ASP HB2 H -16.724 -1.223 -8.292 1.00 . A A . 31 ASP HB2 1 1 18 19412 1 1 31 ASP HB3 H -18.321 -0.735 -8.850 1.00 . A A . 31 ASP HB3 1 1 18 19413 1 1 31 ASP N N -16.158 1.105 -7.022 1.00 . A A . 31 ASP N 1 1 18 19414 1 1 31 ASP O O -18.413 -1.340 -6.278 1.00 . A A . 31 ASP O 1 1 18 19415 1 1 31 ASP OD1 O -15.466 0.359 -9.841 1.00 . A A . 31 ASP OD1 1 1 18 19416 1 1 31 ASP OD2 O -17.466 0.733 -10.673 1.00 . A A . 31 ASP OD2 1 1 18 19417 1 1 32 GLY C C -19.701 0.907 -3.124 1.00 . A A . 32 GLY C 1 1 18 19418 1 1 32 GLY CA C -18.780 -0.034 -3.876 1.00 . A A . 32 GLY CA 1 1 18 19419 1 1 32 GLY H H -17.950 1.499 -5.076 1.00 . A A . 32 GLY H 1 1 18 19420 1 1 32 GLY HA2 H -19.332 -0.922 -4.145 1.00 . A A . 32 GLY HA2 1 1 18 19421 1 1 32 GLY HA3 H -17.965 -0.312 -3.220 1.00 . A A . 32 GLY HA3 1 1 18 19422 1 1 32 GLY N N -18.224 0.558 -5.080 1.00 . A A . 32 GLY N 1 1 18 19423 1 1 32 GLY O O -20.216 1.872 -3.689 1.00 . A A . 32 GLY O 1 1 18 19424 1 1 33 GLY C C -20.300 1.494 0.428 1.00 . A A . 33 GLY C 1 1 18 19425 1 1 33 GLY CA C -20.764 1.445 -1.015 1.00 . A A . 33 GLY CA 1 1 18 19426 1 1 33 GLY H H -19.473 -0.171 -1.455 1.00 . A A . 33 GLY H 1 1 18 19427 1 1 33 GLY HA2 H -20.772 2.448 -1.415 1.00 . A A . 33 GLY HA2 1 1 18 19428 1 1 33 GLY HA3 H -21.768 1.048 -1.045 1.00 . A A . 33 GLY HA3 1 1 18 19429 1 1 33 GLY N N -19.907 0.617 -1.843 1.00 . A A . 33 GLY N 1 1 18 19430 1 1 33 GLY O O -21.073 1.831 1.325 1.00 . A A . 33 GLY O 1 1 18 19431 1 1 34 ASP C C -17.038 1.713 1.973 1.00 . A A . 34 ASP C 1 1 18 19432 1 1 34 ASP CA C -18.460 1.161 1.995 1.00 . A A . 34 ASP CA 1 1 18 19433 1 1 34 ASP CB C -18.461 -0.254 2.576 1.00 . A A . 34 ASP CB 1 1 18 19434 1 1 34 ASP CG C -19.854 -0.850 2.646 1.00 . A A . 34 ASP CG 1 1 18 19435 1 1 34 ASP H H -18.464 0.900 -0.104 1.00 . A A . 34 ASP H 1 1 18 19436 1 1 34 ASP HA H -19.072 1.798 2.615 1.00 . A A . 34 ASP HA 1 1 18 19437 1 1 34 ASP HB2 H -17.849 -0.892 1.956 1.00 . A A . 34 ASP HB2 1 1 18 19438 1 1 34 ASP HB3 H -18.050 -0.227 3.574 1.00 . A A . 34 ASP HB3 1 1 18 19439 1 1 34 ASP N N -19.031 1.157 0.652 1.00 . A A . 34 ASP N 1 1 18 19440 1 1 34 ASP O O -16.544 2.139 0.928 1.00 . A A . 34 ASP O 1 1 18 19441 1 1 34 ASP OD1 O -20.565 -0.583 3.638 1.00 . A A . 34 ASP OD1 1 1 18 19442 1 1 34 ASP OD2 O -20.234 -1.584 1.710 1.00 . A A . 34 ASP OD2 1 1 18 19443 1 1 35 CYS C C -14.239 1.482 4.325 1.00 . A A . 35 CYS C 1 1 18 19444 1 1 35 CYS CA C -15.015 2.207 3.230 1.00 . A A . 35 CYS CA 1 1 18 19445 1 1 35 CYS CB C -15.026 3.710 3.512 1.00 . A A . 35 CYS CB 1 1 18 19446 1 1 35 CYS H H -16.823 1.352 3.929 1.00 . A A . 35 CYS H 1 1 18 19447 1 1 35 CYS HA H -14.527 2.032 2.284 1.00 . A A . 35 CYS HA 1 1 18 19448 1 1 35 CYS HB2 H -14.009 4.070 3.544 1.00 . A A . 35 CYS HB2 1 1 18 19449 1 1 35 CYS HB3 H -15.557 4.213 2.718 1.00 . A A . 35 CYS HB3 1 1 18 19450 1 1 35 CYS HG H -14.871 4.582 5.903 1.00 . A A . 35 CYS HG 1 1 18 19451 1 1 35 CYS N N -16.381 1.703 3.128 1.00 . A A . 35 CYS N 1 1 18 19452 1 1 35 CYS O O -14.520 1.646 5.513 1.00 . A A . 35 CYS O 1 1 18 19453 1 1 35 CYS SG S -15.816 4.160 5.075 1.00 . A A . 35 CYS SG 1 1 18 19454 1 1 36 GLU C C -10.953 0.251 4.657 1.00 . A A . 36 GLU C 1 1 18 19455 1 1 36 GLU CA C -12.433 -0.064 4.859 1.00 . A A . 36 GLU CA 1 1 18 19456 1 1 36 GLU CB C -12.678 -1.565 4.707 1.00 . A A . 36 GLU CB 1 1 18 19457 1 1 36 GLU CD C -13.601 -1.889 7.035 1.00 . A A . 36 GLU CD 1 1 18 19458 1 1 36 GLU CG C -13.832 -2.081 5.550 1.00 . A A . 36 GLU CG 1 1 18 19459 1 1 36 GLU H H -13.085 0.592 2.956 1.00 . A A . 36 GLU H 1 1 18 19460 1 1 36 GLU HA H -12.718 0.239 5.855 1.00 . A A . 36 GLU HA 1 1 18 19461 1 1 36 GLU HB2 H -12.895 -1.779 3.673 1.00 . A A . 36 GLU HB2 1 1 18 19462 1 1 36 GLU HB3 H -11.784 -2.093 4.995 1.00 . A A . 36 GLU HB3 1 1 18 19463 1 1 36 GLU HG2 H -14.731 -1.552 5.270 1.00 . A A . 36 GLU HG2 1 1 18 19464 1 1 36 GLU HG3 H -13.961 -3.136 5.353 1.00 . A A . 36 GLU HG3 1 1 18 19465 1 1 36 GLU N N -13.258 0.683 3.916 1.00 . A A . 36 GLU N 1 1 18 19466 1 1 36 GLU O O -10.593 1.086 3.827 1.00 . A A . 36 GLU O 1 1 18 19467 1 1 36 GLU OE1 O -13.902 -0.790 7.547 1.00 . A A . 36 GLU OE1 1 1 18 19468 1 1 36 GLU OE2 O -13.121 -2.840 7.688 1.00 . A A . 36 GLU OE2 1 1 18 19469 1 1 37 TRP C C -7.950 -1.392 4.689 1.00 . A A . 37 TRP C 1 1 18 19470 1 1 37 TRP CA C -8.661 -0.209 5.339 1.00 . A A . 37 TRP CA 1 1 18 19471 1 1 37 TRP CB C -8.098 0.012 6.741 1.00 . A A . 37 TRP CB 1 1 18 19472 1 1 37 TRP CD1 C -8.890 2.421 7.090 1.00 . A A . 37 TRP CD1 1 1 18 19473 1 1 37 TRP CD2 C -9.424 1.030 8.759 1.00 . A A . 37 TRP CD2 1 1 18 19474 1 1 37 TRP CE2 C -9.914 2.313 9.071 1.00 . A A . 37 TRP CE2 1 1 18 19475 1 1 37 TRP CE3 C -9.644 -0.013 9.665 1.00 . A A . 37 TRP CE3 1 1 18 19476 1 1 37 TRP CG C -8.774 1.121 7.486 1.00 . A A . 37 TRP CG 1 1 18 19477 1 1 37 TRP CH2 C -10.807 1.541 11.117 1.00 . A A . 37 TRP CH2 1 1 18 19478 1 1 37 TRP CZ2 C -10.605 2.580 10.249 1.00 . A A . 37 TRP CZ2 1 1 18 19479 1 1 37 TRP CZ3 C -10.331 0.254 10.835 1.00 . A A . 37 TRP CZ3 1 1 18 19480 1 1 37 TRP H H -10.442 -1.077 6.062 1.00 . A A . 37 TRP H 1 1 18 19481 1 1 37 TRP HA H -8.486 0.675 4.746 1.00 . A A . 37 TRP HA 1 1 18 19482 1 1 37 TRP HB2 H -8.214 -0.895 7.315 1.00 . A A . 37 TRP HB2 1 1 18 19483 1 1 37 TRP HB3 H -7.051 0.248 6.663 1.00 . A A . 37 TRP HB3 1 1 18 19484 1 1 37 TRP HD1 H -8.496 2.810 6.164 1.00 . A A . 37 TRP HD1 1 1 18 19485 1 1 37 TRP HE1 H -9.785 4.100 7.980 1.00 . A A . 37 TRP HE1 1 1 18 19486 1 1 37 TRP HE3 H -9.285 -1.012 9.464 1.00 . A A . 37 TRP HE3 1 1 18 19487 1 1 37 TRP HH2 H -11.338 1.703 12.043 1.00 . A A . 37 TRP HH2 1 1 18 19488 1 1 37 TRP HZ2 H -10.979 3.567 10.482 1.00 . A A . 37 TRP HZ2 1 1 18 19489 1 1 37 TRP HZ3 H -10.509 -0.539 11.546 1.00 . A A . 37 TRP HZ3 1 1 18 19490 1 1 37 TRP N N -10.099 -0.424 5.421 1.00 . A A . 37 TRP N 1 1 18 19491 1 1 37 TRP NE1 N -9.574 3.145 8.036 1.00 . A A . 37 TRP NE1 1 1 18 19492 1 1 37 TRP O O -8.416 -2.527 4.755 1.00 . A A . 37 TRP O 1 1 18 19493 1 1 38 VAL C C -5.040 -2.744 4.432 1.00 . A A . 38 VAL C 1 1 18 19494 1 1 38 VAL CA C -6.002 -2.139 3.425 1.00 . A A . 38 VAL CA 1 1 18 19495 1 1 38 VAL CB C -5.205 -1.563 2.227 1.00 . A A . 38 VAL CB 1 1 18 19496 1 1 38 VAL CG1 C -4.158 -2.544 1.718 1.00 . A A . 38 VAL CG1 1 1 18 19497 1 1 38 VAL CG2 C -6.153 -1.164 1.110 1.00 . A A . 38 VAL CG2 1 1 18 19498 1 1 38 VAL H H -6.493 -0.178 4.051 1.00 . A A . 38 VAL H 1 1 18 19499 1 1 38 VAL HA H -6.667 -2.909 3.060 1.00 . A A . 38 VAL HA 1 1 18 19500 1 1 38 VAL HB H -4.690 -0.681 2.559 1.00 . A A . 38 VAL HB 1 1 18 19501 1 1 38 VAL HG11 H -3.449 -2.756 2.504 1.00 . A A . 38 VAL HG11 1 1 18 19502 1 1 38 VAL HG12 H -3.637 -2.111 0.883 1.00 . A A . 38 VAL HG12 1 1 18 19503 1 1 38 VAL HG13 H -4.639 -3.460 1.410 1.00 . A A . 38 VAL HG13 1 1 18 19504 1 1 38 VAL HG21 H -7.136 -0.999 1.521 1.00 . A A . 38 VAL HG21 1 1 18 19505 1 1 38 VAL HG22 H -6.197 -1.957 0.379 1.00 . A A . 38 VAL HG22 1 1 18 19506 1 1 38 VAL HG23 H -5.798 -0.258 0.641 1.00 . A A . 38 VAL HG23 1 1 18 19507 1 1 38 VAL N N -6.804 -1.110 4.075 1.00 . A A . 38 VAL N 1 1 18 19508 1 1 38 VAL O O -4.777 -2.160 5.482 1.00 . A A . 38 VAL O 1 1 18 19509 1 1 39 LYS C C -2.186 -4.029 4.891 1.00 . A A . 39 LYS C 1 1 18 19510 1 1 39 LYS CA C -3.593 -4.584 5.000 1.00 . A A . 39 LYS CA 1 1 18 19511 1 1 39 LYS CB C -3.597 -6.092 4.742 1.00 . A A . 39 LYS CB 1 1 18 19512 1 1 39 LYS CD C -2.786 -8.371 5.412 1.00 . A A . 39 LYS CD 1 1 18 19513 1 1 39 LYS CE C -1.978 -9.172 6.418 1.00 . A A . 39 LYS CE 1 1 18 19514 1 1 39 LYS CG C -2.729 -6.880 5.709 1.00 . A A . 39 LYS CG 1 1 18 19515 1 1 39 LYS H H -4.752 -4.332 3.254 1.00 . A A . 39 LYS H 1 1 18 19516 1 1 39 LYS HA H -3.937 -4.396 5.993 1.00 . A A . 39 LYS HA 1 1 18 19517 1 1 39 LYS HB2 H -4.610 -6.456 4.824 1.00 . A A . 39 LYS HB2 1 1 18 19518 1 1 39 LYS HB3 H -3.239 -6.275 3.739 1.00 . A A . 39 LYS HB3 1 1 18 19519 1 1 39 LYS HD2 H -3.815 -8.697 5.451 1.00 . A A . 39 LYS HD2 1 1 18 19520 1 1 39 LYS HD3 H -2.388 -8.546 4.423 1.00 . A A . 39 LYS HD3 1 1 18 19521 1 1 39 LYS HE2 H -0.942 -8.874 6.350 1.00 . A A . 39 LYS HE2 1 1 18 19522 1 1 39 LYS HE3 H -2.347 -8.958 7.411 1.00 . A A . 39 LYS HE3 1 1 18 19523 1 1 39 LYS HG2 H -1.708 -6.544 5.619 1.00 . A A . 39 LYS HG2 1 1 18 19524 1 1 39 LYS HG3 H -3.081 -6.709 6.715 1.00 . A A . 39 LYS HG3 1 1 18 19525 1 1 39 LYS HZ1 H -3.072 -10.937 6.190 1.00 . A A . 39 LYS HZ1 1 1 18 19526 1 1 39 LYS HZ2 H -1.552 -11.160 6.901 1.00 . A A . 39 LYS HZ2 1 1 18 19527 1 1 39 LYS HZ3 H -1.675 -10.869 5.239 1.00 . A A . 39 LYS HZ3 1 1 18 19528 1 1 39 LYS N N -4.513 -3.913 4.107 1.00 . A A . 39 LYS N 1 1 18 19529 1 1 39 LYS NZ N -2.076 -10.637 6.170 1.00 . A A . 39 LYS NZ 1 1 18 19530 1 1 39 LYS O O -1.456 -4.311 3.941 1.00 . A A . 39 LYS O 1 1 18 19531 1 1 40 GLY C C 0.505 -3.522 6.639 1.00 . A A . 40 GLY C 1 1 18 19532 1 1 40 GLY CA C -0.499 -2.642 5.927 1.00 . A A . 40 GLY CA 1 1 18 19533 1 1 40 GLY H H -2.468 -3.015 6.584 1.00 . A A . 40 GLY H 1 1 18 19534 1 1 40 GLY HA2 H -0.159 -2.490 4.918 1.00 . A A . 40 GLY HA2 1 1 18 19535 1 1 40 GLY HA3 H -0.551 -1.688 6.430 1.00 . A A . 40 GLY HA3 1 1 18 19536 1 1 40 GLY N N -1.820 -3.227 5.884 1.00 . A A . 40 GLY N 1 1 18 19537 1 1 40 GLY O O 1.280 -3.051 7.472 1.00 . A A . 40 GLY O 1 1 18 19538 1 1 41 VAL C C 2.232 -6.421 5.792 1.00 . A A . 41 VAL C 1 1 18 19539 1 1 41 VAL CA C 1.408 -5.763 6.894 1.00 . A A . 41 VAL CA 1 1 18 19540 1 1 41 VAL CB C 0.694 -6.867 7.694 1.00 . A A . 41 VAL CB 1 1 18 19541 1 1 41 VAL CG1 C 1.635 -7.465 8.729 1.00 . A A . 41 VAL CG1 1 1 18 19542 1 1 41 VAL CG2 C -0.571 -6.336 8.355 1.00 . A A . 41 VAL CG2 1 1 18 19543 1 1 41 VAL H H -0.185 -5.123 5.673 1.00 . A A . 41 VAL H 1 1 18 19544 1 1 41 VAL HA H 2.072 -5.229 7.561 1.00 . A A . 41 VAL HA 1 1 18 19545 1 1 41 VAL HB H 0.419 -7.650 7.004 1.00 . A A . 41 VAL HB 1 1 18 19546 1 1 41 VAL HG11 H 1.977 -6.687 9.396 1.00 . A A . 41 VAL HG11 1 1 18 19547 1 1 41 VAL HG12 H 2.482 -7.911 8.230 1.00 . A A . 41 VAL HG12 1 1 18 19548 1 1 41 VAL HG13 H 1.112 -8.221 9.296 1.00 . A A . 41 VAL HG13 1 1 18 19549 1 1 41 VAL HG21 H -0.317 -5.527 9.023 1.00 . A A . 41 VAL HG21 1 1 18 19550 1 1 41 VAL HG22 H -1.045 -7.128 8.914 1.00 . A A . 41 VAL HG22 1 1 18 19551 1 1 41 VAL HG23 H -1.250 -5.976 7.596 1.00 . A A . 41 VAL HG23 1 1 18 19552 1 1 41 VAL N N 0.478 -4.807 6.318 1.00 . A A . 41 VAL N 1 1 18 19553 1 1 41 VAL O O 3.070 -7.279 6.064 1.00 . A A . 41 VAL O 1 1 18 19554 1 1 42 HIS C C 4.130 -6.068 3.422 1.00 . A A . 42 HIS C 1 1 18 19555 1 1 42 HIS CA C 2.716 -6.581 3.416 1.00 . A A . 42 HIS CA 1 1 18 19556 1 1 42 HIS CB C 2.004 -6.271 2.099 1.00 . A A . 42 HIS CB 1 1 18 19557 1 1 42 HIS CD2 C 2.242 -8.722 1.278 1.00 . A A . 42 HIS CD2 1 1 18 19558 1 1 42 HIS CE1 C 0.619 -8.723 -0.195 1.00 . A A . 42 HIS CE1 1 1 18 19559 1 1 42 HIS CG C 1.681 -7.489 1.290 1.00 . A A . 42 HIS CG 1 1 18 19560 1 1 42 HIS H H 1.313 -5.328 4.373 1.00 . A A . 42 HIS H 1 1 18 19561 1 1 42 HIS HA H 2.769 -7.633 3.551 1.00 . A A . 42 HIS HA 1 1 18 19562 1 1 42 HIS HB2 H 1.071 -5.762 2.315 1.00 . A A . 42 HIS HB2 1 1 18 19563 1 1 42 HIS HB3 H 2.629 -5.627 1.498 1.00 . A A . 42 HIS HB3 1 1 18 19564 1 1 42 HIS HD1 H 0.074 -6.778 0.128 1.00 . A A . 42 HIS HD1 1 1 18 19565 1 1 42 HIS HD2 H 3.069 -9.058 1.890 1.00 . A A . 42 HIS HD2 1 1 18 19566 1 1 42 HIS HE1 H -0.076 -9.041 -0.958 1.00 . A A . 42 HIS HE1 1 1 18 19567 1 1 42 HIS HE2 H 1.740 -10.407 0.128 1.00 . A A . 42 HIS HE2 1 1 18 19568 1 1 42 HIS N N 1.986 -6.023 4.541 1.00 . A A . 42 HIS N 1 1 18 19569 1 1 42 HIS ND1 N 0.668 -7.523 0.354 1.00 . A A . 42 HIS ND1 1 1 18 19570 1 1 42 HIS NE2 N 1.563 -9.469 0.347 1.00 . A A . 42 HIS NE2 1 1 18 19571 1 1 42 HIS O O 4.503 -5.210 2.629 1.00 . A A . 42 HIS O 1 1 18 19572 1 1 43 VAL C C 7.162 -6.378 3.279 1.00 . A A . 43 VAL C 1 1 18 19573 1 1 43 VAL CA C 6.306 -6.318 4.533 1.00 . A A . 43 VAL CA 1 1 18 19574 1 1 43 VAL CB C 6.947 -7.221 5.609 1.00 . A A . 43 VAL CB 1 1 18 19575 1 1 43 VAL CG1 C 8.386 -6.802 5.879 1.00 . A A . 43 VAL CG1 1 1 18 19576 1 1 43 VAL CG2 C 6.134 -7.192 6.893 1.00 . A A . 43 VAL CG2 1 1 18 19577 1 1 43 VAL H H 4.503 -7.379 4.865 1.00 . A A . 43 VAL H 1 1 18 19578 1 1 43 VAL HA H 6.328 -5.315 4.897 1.00 . A A . 43 VAL HA 1 1 18 19579 1 1 43 VAL HB H 6.957 -8.236 5.239 1.00 . A A . 43 VAL HB 1 1 18 19580 1 1 43 VAL HG11 H 8.683 -6.051 5.164 1.00 . A A . 43 VAL HG11 1 1 18 19581 1 1 43 VAL HG12 H 9.034 -7.661 5.789 1.00 . A A . 43 VAL HG12 1 1 18 19582 1 1 43 VAL HG13 H 8.461 -6.398 6.879 1.00 . A A . 43 VAL HG13 1 1 18 19583 1 1 43 VAL HG21 H 5.136 -7.552 6.697 1.00 . A A . 43 VAL HG21 1 1 18 19584 1 1 43 VAL HG22 H 6.086 -6.179 7.266 1.00 . A A . 43 VAL HG22 1 1 18 19585 1 1 43 VAL HG23 H 6.606 -7.824 7.632 1.00 . A A . 43 VAL HG23 1 1 18 19586 1 1 43 VAL N N 4.908 -6.676 4.310 1.00 . A A . 43 VAL N 1 1 18 19587 1 1 43 VAL O O 8.002 -7.261 3.128 1.00 . A A . 43 VAL O 1 1 18 19588 1 1 44 ALA C C 8.928 -4.397 1.427 1.00 . A A . 44 ALA C 1 1 18 19589 1 1 44 ALA CA C 7.732 -5.299 1.177 1.00 . A A . 44 ALA CA 1 1 18 19590 1 1 44 ALA CB C 6.882 -4.778 0.031 1.00 . A A . 44 ALA CB 1 1 18 19591 1 1 44 ALA H H 6.243 -4.756 2.565 1.00 . A A . 44 ALA H 1 1 18 19592 1 1 44 ALA HA H 8.089 -6.278 0.923 1.00 . A A . 44 ALA HA 1 1 18 19593 1 1 44 ALA HB1 H 7.422 -4.894 -0.897 1.00 . A A . 44 ALA HB1 1 1 18 19594 1 1 44 ALA HB2 H 6.663 -3.734 0.191 1.00 . A A . 44 ALA HB2 1 1 18 19595 1 1 44 ALA HB3 H 5.961 -5.338 -0.017 1.00 . A A . 44 ALA HB3 1 1 18 19596 1 1 44 ALA N N 6.951 -5.410 2.394 1.00 . A A . 44 ALA N 1 1 18 19597 1 1 44 ALA O O 9.200 -3.471 0.663 1.00 . A A . 44 ALA O 1 1 18 19598 1 1 45 GLU C C 11.709 -3.645 1.706 1.00 . A A . 45 GLU C 1 1 18 19599 1 1 45 GLU CA C 10.815 -3.910 2.907 1.00 . A A . 45 GLU CA 1 1 18 19600 1 1 45 GLU CB C 11.603 -4.634 4.012 1.00 . A A . 45 GLU CB 1 1 18 19601 1 1 45 GLU CD C 13.247 -6.449 4.644 1.00 . A A . 45 GLU CD 1 1 18 19602 1 1 45 GLU CG C 12.519 -5.749 3.514 1.00 . A A . 45 GLU CG 1 1 18 19603 1 1 45 GLU H H 9.367 -5.451 3.057 1.00 . A A . 45 GLU H 1 1 18 19604 1 1 45 GLU HA H 10.465 -2.964 3.289 1.00 . A A . 45 GLU HA 1 1 18 19605 1 1 45 GLU HB2 H 12.211 -3.909 4.531 1.00 . A A . 45 GLU HB2 1 1 18 19606 1 1 45 GLU HB3 H 10.900 -5.063 4.712 1.00 . A A . 45 GLU HB3 1 1 18 19607 1 1 45 GLU HG2 H 11.930 -6.479 2.982 1.00 . A A . 45 GLU HG2 1 1 18 19608 1 1 45 GLU HG3 H 13.251 -5.323 2.845 1.00 . A A . 45 GLU HG3 1 1 18 19609 1 1 45 GLU N N 9.640 -4.688 2.512 1.00 . A A . 45 GLU N 1 1 18 19610 1 1 45 GLU O O 12.421 -2.644 1.651 1.00 . A A . 45 GLU O 1 1 18 19611 1 1 45 GLU OE1 O 12.658 -7.368 5.251 1.00 . A A . 45 GLU OE1 1 1 18 19612 1 1 45 GLU OE2 O 14.407 -6.078 4.922 1.00 . A A . 45 GLU OE2 1 1 18 19613 1 1 46 ASP C C 11.958 -3.238 -1.279 1.00 . A A . 46 ASP C 1 1 18 19614 1 1 46 ASP CA C 12.454 -4.423 -0.469 1.00 . A A . 46 ASP CA 1 1 18 19615 1 1 46 ASP CB C 12.375 -5.699 -1.305 1.00 . A A . 46 ASP CB 1 1 18 19616 1 1 46 ASP CG C 12.822 -6.927 -0.534 1.00 . A A . 46 ASP CG 1 1 18 19617 1 1 46 ASP H H 11.074 -5.341 0.862 1.00 . A A . 46 ASP H 1 1 18 19618 1 1 46 ASP HA H 13.482 -4.242 -0.191 1.00 . A A . 46 ASP HA 1 1 18 19619 1 1 46 ASP HB2 H 11.355 -5.850 -1.625 1.00 . A A . 46 ASP HB2 1 1 18 19620 1 1 46 ASP HB3 H 13.008 -5.590 -2.173 1.00 . A A . 46 ASP HB3 1 1 18 19621 1 1 46 ASP N N 11.662 -4.558 0.748 1.00 . A A . 46 ASP N 1 1 18 19622 1 1 46 ASP O O 12.736 -2.379 -1.672 1.00 . A A . 46 ASP O 1 1 18 19623 1 1 46 ASP OD1 O 11.982 -7.519 0.175 1.00 . A A . 46 ASP OD1 1 1 18 19624 1 1 46 ASP OD2 O 14.010 -7.296 -0.641 1.00 . A A . 46 ASP OD2 1 1 18 19625 1 1 47 VAL C C 10.367 -0.756 -1.620 1.00 . A A . 47 VAL C 1 1 18 19626 1 1 47 VAL CA C 10.055 -2.105 -2.263 1.00 . A A . 47 VAL CA 1 1 18 19627 1 1 47 VAL CB C 8.533 -2.280 -2.365 1.00 . A A . 47 VAL CB 1 1 18 19628 1 1 47 VAL CG1 C 7.933 -1.206 -3.253 1.00 . A A . 47 VAL CG1 1 1 18 19629 1 1 47 VAL CG2 C 8.185 -3.661 -2.892 1.00 . A A . 47 VAL CG2 1 1 18 19630 1 1 47 VAL H H 10.080 -3.882 -1.119 1.00 . A A . 47 VAL H 1 1 18 19631 1 1 47 VAL HA H 10.470 -2.125 -3.261 1.00 . A A . 47 VAL HA 1 1 18 19632 1 1 47 VAL HB H 8.115 -2.177 -1.375 1.00 . A A . 47 VAL HB 1 1 18 19633 1 1 47 VAL HG11 H 8.632 -0.390 -3.351 1.00 . A A . 47 VAL HG11 1 1 18 19634 1 1 47 VAL HG12 H 7.017 -0.844 -2.809 1.00 . A A . 47 VAL HG12 1 1 18 19635 1 1 47 VAL HG13 H 7.723 -1.621 -4.228 1.00 . A A . 47 VAL HG13 1 1 18 19636 1 1 47 VAL HG21 H 8.674 -4.409 -2.289 1.00 . A A . 47 VAL HG21 1 1 18 19637 1 1 47 VAL HG22 H 8.520 -3.752 -3.915 1.00 . A A . 47 VAL HG22 1 1 18 19638 1 1 47 VAL HG23 H 7.116 -3.806 -2.848 1.00 . A A . 47 VAL HG23 1 1 18 19639 1 1 47 VAL N N 10.654 -3.187 -1.498 1.00 . A A . 47 VAL N 1 1 18 19640 1 1 47 VAL O O 10.475 0.246 -2.303 1.00 . A A . 47 VAL O 1 1 18 19641 1 1 48 ALA C C 12.306 0.693 0.456 1.00 . A A . 48 ALA C 1 1 18 19642 1 1 48 ALA CA C 10.823 0.387 0.532 1.00 . A A . 48 ALA CA 1 1 18 19643 1 1 48 ALA CB C 10.416 0.124 1.974 1.00 . A A . 48 ALA CB 1 1 18 19644 1 1 48 ALA H H 10.419 -1.623 0.135 1.00 . A A . 48 ALA H 1 1 18 19645 1 1 48 ALA HA H 10.266 1.236 0.177 1.00 . A A . 48 ALA HA 1 1 18 19646 1 1 48 ALA HB1 H 9.346 -0.007 2.028 1.00 . A A . 48 ALA HB1 1 1 18 19647 1 1 48 ALA HB2 H 10.708 0.962 2.589 1.00 . A A . 48 ALA HB2 1 1 18 19648 1 1 48 ALA HB3 H 10.905 -0.771 2.329 1.00 . A A . 48 ALA HB3 1 1 18 19649 1 1 48 ALA N N 10.510 -0.781 -0.297 1.00 . A A . 48 ALA N 1 1 18 19650 1 1 48 ALA O O 12.706 1.778 0.036 1.00 . A A . 48 ALA O 1 1 18 19651 1 1 49 LYS C C 14.960 0.201 -0.638 1.00 . A A . 49 LYS C 1 1 18 19652 1 1 49 LYS CA C 14.564 -0.105 0.803 1.00 . A A . 49 LYS CA 1 1 18 19653 1 1 49 LYS CB C 15.278 -1.369 1.288 1.00 . A A . 49 LYS CB 1 1 18 19654 1 1 49 LYS CD C 17.461 -2.538 1.712 1.00 . A A . 49 LYS CD 1 1 18 19655 1 1 49 LYS CE C 17.339 -3.526 0.563 1.00 . A A . 49 LYS CE 1 1 18 19656 1 1 49 LYS CG C 16.787 -1.216 1.383 1.00 . A A . 49 LYS CG 1 1 18 19657 1 1 49 LYS H H 12.748 -1.110 1.208 1.00 . A A . 49 LYS H 1 1 18 19658 1 1 49 LYS HA H 14.835 0.728 1.434 1.00 . A A . 49 LYS HA 1 1 18 19659 1 1 49 LYS HB2 H 14.901 -1.627 2.268 1.00 . A A . 49 LYS HB2 1 1 18 19660 1 1 49 LYS HB3 H 15.060 -2.177 0.605 1.00 . A A . 49 LYS HB3 1 1 18 19661 1 1 49 LYS HD2 H 18.508 -2.359 1.910 1.00 . A A . 49 LYS HD2 1 1 18 19662 1 1 49 LYS HD3 H 16.994 -2.961 2.590 1.00 . A A . 49 LYS HD3 1 1 18 19663 1 1 49 LYS HE2 H 16.292 -3.700 0.363 1.00 . A A . 49 LYS HE2 1 1 18 19664 1 1 49 LYS HE3 H 17.807 -3.100 -0.313 1.00 . A A . 49 LYS HE3 1 1 18 19665 1 1 49 LYS HG2 H 17.163 -0.859 0.436 1.00 . A A . 49 LYS HG2 1 1 18 19666 1 1 49 LYS HG3 H 17.020 -0.501 2.158 1.00 . A A . 49 LYS HG3 1 1 18 19667 1 1 49 LYS HZ1 H 17.949 -5.458 0.051 1.00 . A A . 49 LYS HZ1 1 1 18 19668 1 1 49 LYS HZ2 H 17.512 -5.286 1.677 1.00 . A A . 49 LYS HZ2 1 1 18 19669 1 1 49 LYS HZ3 H 18.990 -4.675 1.129 1.00 . A A . 49 LYS HZ3 1 1 18 19670 1 1 49 LYS N N 13.123 -0.271 0.866 1.00 . A A . 49 LYS N 1 1 18 19671 1 1 49 LYS NZ N 17.993 -4.828 0.877 1.00 . A A . 49 LYS NZ 1 1 18 19672 1 1 49 LYS O O 15.970 0.851 -0.903 1.00 . A A . 49 LYS O 1 1 18 19673 1 1 50 ASP C C 13.618 1.172 -3.445 1.00 . A A . 50 ASP C 1 1 18 19674 1 1 50 ASP CA C 14.364 -0.076 -2.982 1.00 . A A . 50 ASP CA 1 1 18 19675 1 1 50 ASP CB C 13.912 -1.301 -3.781 1.00 . A A . 50 ASP CB 1 1 18 19676 1 1 50 ASP CG C 14.514 -1.341 -5.172 1.00 . A A . 50 ASP CG 1 1 18 19677 1 1 50 ASP H H 13.362 -0.809 -1.287 1.00 . A A . 50 ASP H 1 1 18 19678 1 1 50 ASP HA H 15.423 0.074 -3.134 1.00 . A A . 50 ASP HA 1 1 18 19679 1 1 50 ASP HB2 H 14.206 -2.199 -3.249 1.00 . A A . 50 ASP HB2 1 1 18 19680 1 1 50 ASP HB3 H 12.835 -1.281 -3.875 1.00 . A A . 50 ASP HB3 1 1 18 19681 1 1 50 ASP N N 14.143 -0.292 -1.566 1.00 . A A . 50 ASP N 1 1 18 19682 1 1 50 ASP O O 13.964 1.769 -4.463 1.00 . A A . 50 ASP O 1 1 18 19683 1 1 50 ASP OD1 O 15.730 -1.604 -5.284 1.00 . A A . 50 ASP OD1 1 1 18 19684 1 1 50 ASP OD2 O 13.772 -1.107 -6.148 1.00 . A A . 50 ASP OD2 1 1 18 19685 1 1 51 TYR C C 12.615 3.989 -2.730 1.00 . A A . 51 TYR C 1 1 18 19686 1 1 51 TYR CA C 11.816 2.745 -3.048 1.00 . A A . 51 TYR CA 1 1 18 19687 1 1 51 TYR CB C 10.491 2.849 -2.293 1.00 . A A . 51 TYR CB 1 1 18 19688 1 1 51 TYR CD1 C 9.190 2.839 -4.461 1.00 . A A . 51 TYR CD1 1 1 18 19689 1 1 51 TYR CD2 C 8.177 1.855 -2.542 1.00 . A A . 51 TYR CD2 1 1 18 19690 1 1 51 TYR CE1 C 8.067 2.541 -5.211 1.00 . A A . 51 TYR CE1 1 1 18 19691 1 1 51 TYR CE2 C 7.052 1.551 -3.287 1.00 . A A . 51 TYR CE2 1 1 18 19692 1 1 51 TYR CG C 9.266 2.502 -3.116 1.00 . A A . 51 TYR CG 1 1 18 19693 1 1 51 TYR CZ C 7.003 1.897 -4.620 1.00 . A A . 51 TYR CZ 1 1 18 19694 1 1 51 TYR H H 12.325 1.044 -1.915 1.00 . A A . 51 TYR H 1 1 18 19695 1 1 51 TYR HA H 11.613 2.681 -4.088 1.00 . A A . 51 TYR HA 1 1 18 19696 1 1 51 TYR HB2 H 10.527 2.197 -1.457 1.00 . A A . 51 TYR HB2 1 1 18 19697 1 1 51 TYR HB3 H 10.364 3.862 -1.936 1.00 . A A . 51 TYR HB3 1 1 18 19698 1 1 51 TYR HD1 H 10.021 3.346 -4.923 1.00 . A A . 51 TYR HD1 1 1 18 19699 1 1 51 TYR HD2 H 8.216 1.585 -1.496 1.00 . A A . 51 TYR HD2 1 1 18 19700 1 1 51 TYR HE1 H 8.029 2.813 -6.256 1.00 . A A . 51 TYR HE1 1 1 18 19701 1 1 51 TYR HE2 H 6.218 1.047 -2.823 1.00 . A A . 51 TYR HE2 1 1 18 19702 1 1 51 TYR HH H 5.097 1.804 -4.858 1.00 . A A . 51 TYR HH 1 1 18 19703 1 1 51 TYR N N 12.578 1.560 -2.698 1.00 . A A . 51 TYR N 1 1 18 19704 1 1 51 TYR O O 13.106 4.689 -3.615 1.00 . A A . 51 TYR O 1 1 18 19705 1 1 51 TYR OH O 5.885 1.597 -5.365 1.00 . A A . 51 TYR OH 1 1 18 19706 1 1 52 GLU C C 14.955 5.205 -0.917 1.00 . A A . 52 GLU C 1 1 18 19707 1 1 52 GLU CA C 13.443 5.404 -0.932 1.00 . A A . 52 GLU CA 1 1 18 19708 1 1 52 GLU CB C 12.950 5.767 0.471 1.00 . A A . 52 GLU CB 1 1 18 19709 1 1 52 GLU CD C 12.757 5.101 2.901 1.00 . A A . 52 GLU CD 1 1 18 19710 1 1 52 GLU CG C 13.165 4.672 1.505 1.00 . A A . 52 GLU CG 1 1 18 19711 1 1 52 GLU H H 12.369 3.594 -0.785 1.00 . A A . 52 GLU H 1 1 18 19712 1 1 52 GLU HA H 13.202 6.207 -1.596 1.00 . A A . 52 GLU HA 1 1 18 19713 1 1 52 GLU HB2 H 13.474 6.651 0.805 1.00 . A A . 52 GLU HB2 1 1 18 19714 1 1 52 GLU HB3 H 11.894 5.984 0.423 1.00 . A A . 52 GLU HB3 1 1 18 19715 1 1 52 GLU HG2 H 12.579 3.810 1.225 1.00 . A A . 52 GLU HG2 1 1 18 19716 1 1 52 GLU HG3 H 14.210 4.407 1.519 1.00 . A A . 52 GLU HG3 1 1 18 19717 1 1 52 GLU N N 12.746 4.234 -1.428 1.00 . A A . 52 GLU N 1 1 18 19718 1 1 52 GLU O O 15.709 6.065 -1.369 1.00 . A A . 52 GLU O 1 1 18 19719 1 1 52 GLU OE1 O 11.573 4.915 3.256 1.00 . A A . 52 GLU OE1 1 1 18 19720 1 1 52 GLU OE2 O 13.616 5.625 3.639 1.00 . A A . 52 GLU OE2 1 1 18 19721 1 1 53 ASP C C 17.362 3.236 -1.622 1.00 . A A . 53 ASP C 1 1 18 19722 1 1 53 ASP CA C 16.807 3.755 -0.298 1.00 . A A . 53 ASP CA 1 1 18 19723 1 1 53 ASP CB C 17.031 2.730 0.810 1.00 . A A . 53 ASP CB 1 1 18 19724 1 1 53 ASP CG C 17.216 3.378 2.169 1.00 . A A . 53 ASP CG 1 1 18 19725 1 1 53 ASP H H 14.734 3.414 -0.064 1.00 . A A . 53 ASP H 1 1 18 19726 1 1 53 ASP HA H 17.325 4.666 -0.040 1.00 . A A . 53 ASP HA 1 1 18 19727 1 1 53 ASP HB2 H 16.170 2.080 0.861 1.00 . A A . 53 ASP HB2 1 1 18 19728 1 1 53 ASP HB3 H 17.911 2.145 0.584 1.00 . A A . 53 ASP HB3 1 1 18 19729 1 1 53 ASP N N 15.387 4.066 -0.394 1.00 . A A . 53 ASP N 1 1 18 19730 1 1 53 ASP O O 18.574 3.246 -1.839 1.00 . A A . 53 ASP O 1 1 18 19731 1 1 53 ASP OD1 O 18.371 3.689 2.526 1.00 . A A . 53 ASP OD1 1 1 18 19732 1 1 53 ASP OD2 O 16.204 3.575 2.874 1.00 . A A . 53 ASP OD2 1 1 18 19733 1 1 54 GLY C C 17.325 3.381 -4.742 1.00 . A A . 54 GLY C 1 1 18 19734 1 1 54 GLY CA C 16.919 2.273 -3.791 1.00 . A A . 54 GLY CA 1 1 18 19735 1 1 54 GLY H H 15.523 2.794 -2.283 1.00 . A A . 54 GLY H 1 1 18 19736 1 1 54 GLY HA2 H 17.765 1.620 -3.635 1.00 . A A . 54 GLY HA2 1 1 18 19737 1 1 54 GLY HA3 H 16.117 1.706 -4.237 1.00 . A A . 54 GLY HA3 1 1 18 19738 1 1 54 GLY N N 16.478 2.782 -2.505 1.00 . A A . 54 GLY N 1 1 18 19739 1 1 54 GLY O O 18.341 3.276 -5.428 1.00 . A A . 54 GLY O 1 1 18 19740 1 1 55 LEU C C 17.943 6.428 -5.070 1.00 . A A . 55 LEU C 1 1 18 19741 1 1 55 LEU CA C 16.818 5.580 -5.653 1.00 . A A . 55 LEU CA 1 1 18 19742 1 1 55 LEU CB C 15.565 6.435 -5.852 1.00 . A A . 55 LEU CB 1 1 18 19743 1 1 55 LEU CD1 C 16.332 7.255 -8.094 1.00 . A A . 55 LEU CD1 1 1 18 19744 1 1 55 LEU CD2 C 14.433 8.394 -6.931 1.00 . A A . 55 LEU CD2 1 1 18 19745 1 1 55 LEU CG C 15.754 7.661 -6.746 1.00 . A A . 55 LEU CG 1 1 18 19746 1 1 55 LEU H H 15.731 4.469 -4.216 1.00 . A A . 55 LEU H 1 1 18 19747 1 1 55 LEU HA H 17.136 5.192 -6.609 1.00 . A A . 55 LEU HA 1 1 18 19748 1 1 55 LEU HB2 H 14.796 5.811 -6.285 1.00 . A A . 55 LEU HB2 1 1 18 19749 1 1 55 LEU HB3 H 15.228 6.772 -4.883 1.00 . A A . 55 LEU HB3 1 1 18 19750 1 1 55 LEU HD11 H 15.656 6.570 -8.584 1.00 . A A . 55 LEU HD11 1 1 18 19751 1 1 55 LEU HD12 H 17.287 6.774 -7.945 1.00 . A A . 55 LEU HD12 1 1 18 19752 1 1 55 LEU HD13 H 16.463 8.133 -8.709 1.00 . A A . 55 LEU HD13 1 1 18 19753 1 1 55 LEU HD21 H 14.593 9.279 -7.529 1.00 . A A . 55 LEU HD21 1 1 18 19754 1 1 55 LEU HD22 H 14.041 8.678 -5.965 1.00 . A A . 55 LEU HD22 1 1 18 19755 1 1 55 LEU HD23 H 13.727 7.745 -7.430 1.00 . A A . 55 LEU HD23 1 1 18 19756 1 1 55 LEU HG H 16.451 8.339 -6.275 1.00 . A A . 55 LEU HG 1 1 18 19757 1 1 55 LEU N N 16.530 4.445 -4.784 1.00 . A A . 55 LEU N 1 1 18 19758 1 1 55 LEU O O 19.014 6.549 -5.663 1.00 . A A . 55 LEU O 1 1 18 19759 1 1 56 GLU C C 19.583 6.984 -2.348 1.00 . A A . 56 GLU C 1 1 18 19760 1 1 56 GLU CA C 18.688 7.839 -3.236 1.00 . A A . 56 GLU CA 1 1 18 19761 1 1 56 GLU CB C 18.012 8.926 -2.405 1.00 . A A . 56 GLU CB 1 1 18 19762 1 1 56 GLU CD C 18.052 10.616 -4.283 1.00 . A A . 56 GLU CD 1 1 18 19763 1 1 56 GLU CG C 17.211 9.919 -3.231 1.00 . A A . 56 GLU CG 1 1 18 19764 1 1 56 GLU H H 16.816 6.882 -3.481 1.00 . A A . 56 GLU H 1 1 18 19765 1 1 56 GLU HA H 19.293 8.303 -3.993 1.00 . A A . 56 GLU HA 1 1 18 19766 1 1 56 GLU HB2 H 17.346 8.456 -1.703 1.00 . A A . 56 GLU HB2 1 1 18 19767 1 1 56 GLU HB3 H 18.769 9.471 -1.860 1.00 . A A . 56 GLU HB3 1 1 18 19768 1 1 56 GLU HG2 H 16.409 9.393 -3.725 1.00 . A A . 56 GLU HG2 1 1 18 19769 1 1 56 GLU HG3 H 16.797 10.667 -2.570 1.00 . A A . 56 GLU HG3 1 1 18 19770 1 1 56 GLU N N 17.692 7.012 -3.903 1.00 . A A . 56 GLU N 1 1 18 19771 1 1 56 GLU O O 19.655 7.186 -1.136 1.00 . A A . 56 GLU O 1 1 18 19772 1 1 56 GLU OE1 O 18.810 11.539 -3.921 1.00 . A A . 56 GLU OE1 1 1 18 19773 1 1 56 GLU OE2 O 17.954 10.237 -5.470 1.00 . A A . 56 GLU OE2 1 1 18 19774 1 1 57 TYR C C 22.513 5.782 -2.007 1.00 . A A . 57 TYR C 1 1 18 19775 1 1 57 TYR CA C 21.157 5.127 -2.244 1.00 . A A . 57 TYR CA 1 1 18 19776 1 1 57 TYR CB C 21.333 3.823 -3.026 1.00 . A A . 57 TYR CB 1 1 18 19777 1 1 57 TYR CD1 C 23.551 2.773 -2.430 1.00 . A A . 57 TYR CD1 1 1 18 19778 1 1 57 TYR CD2 C 21.571 1.826 -1.499 1.00 . A A . 57 TYR CD2 1 1 18 19779 1 1 57 TYR CE1 C 24.318 1.832 -1.771 1.00 . A A . 57 TYR CE1 1 1 18 19780 1 1 57 TYR CE2 C 22.331 0.881 -0.836 1.00 . A A . 57 TYR CE2 1 1 18 19781 1 1 57 TYR CG C 22.167 2.787 -2.306 1.00 . A A . 57 TYR CG 1 1 18 19782 1 1 57 TYR CZ C 23.700 0.875 -0.990 1.00 . A A . 57 TYR CZ 1 1 18 19783 1 1 57 TYR H H 20.165 5.923 -3.937 1.00 . A A . 57 TYR H 1 1 18 19784 1 1 57 TYR HA H 20.703 4.906 -1.290 1.00 . A A . 57 TYR HA 1 1 18 19785 1 1 57 TYR HB2 H 20.361 3.392 -3.214 1.00 . A A . 57 TYR HB2 1 1 18 19786 1 1 57 TYR HB3 H 21.812 4.041 -3.969 1.00 . A A . 57 TYR HB3 1 1 18 19787 1 1 57 TYR HD1 H 24.029 3.515 -3.054 1.00 . A A . 57 TYR HD1 1 1 18 19788 1 1 57 TYR HD2 H 20.498 1.822 -1.393 1.00 . A A . 57 TYR HD2 1 1 18 19789 1 1 57 TYR HE1 H 25.393 1.838 -1.880 1.00 . A A . 57 TYR HE1 1 1 18 19790 1 1 57 TYR HE2 H 21.850 0.141 -0.214 1.00 . A A . 57 TYR HE2 1 1 18 19791 1 1 57 TYR HH H 24.044 -0.911 -0.386 1.00 . A A . 57 TYR HH 1 1 18 19792 1 1 57 TYR N N 20.263 6.026 -2.967 1.00 . A A . 57 TYR N 1 1 18 19793 1 1 57 TYR O O 23.397 5.645 -2.878 1.00 . A A . 57 TYR O 1 1 18 19794 1 1 57 TYR OXT O 22.680 6.429 -0.951 1.00 . A A . 57 TYR OXT 1 1 18 19795 1 1 57 TYR OH O 24.463 -0.051 -0.315 1.00 . A A . 57 TYR OH 1 1 18 19796 2 2 1 ALA C C -14.006 -8.800 3.639 1.00 . B B . 1 ALA C 1 1 18 19797 2 2 1 ALA CA C -13.936 -10.304 3.356 1.00 . B B . 1 ALA CA 1 1 18 19798 2 2 1 ALA CB C -13.686 -11.077 4.643 1.00 . B B . 1 ALA CB 1 1 18 19799 2 2 1 ALA H1 H -13.195 -11.441 1.772 1.00 . B B . 1 ALA H1 1 1 18 19800 2 2 1 ALA H2 H -12.000 -10.870 2.819 1.00 . B B . 1 ALA H2 1 1 18 19801 2 2 1 ALA H3 H -12.735 -9.812 1.720 1.00 . B B . 1 ALA H3 1 1 18 19802 2 2 1 ALA HA H -14.890 -10.621 2.962 1.00 . B B . 1 ALA HA 1 1 18 19803 2 2 1 ALA HB1 H -13.687 -12.137 4.433 1.00 . B B . 1 ALA HB1 1 1 18 19804 2 2 1 ALA HB2 H -14.467 -10.852 5.355 1.00 . B B . 1 ALA HB2 1 1 18 19805 2 2 1 ALA HB3 H -12.731 -10.794 5.057 1.00 . B B . 1 ALA HB3 1 1 18 19806 2 2 1 ALA N N -12.894 -10.628 2.346 1.00 . B B . 1 ALA N 1 1 18 19807 2 2 1 ALA O O -15.097 -8.231 3.693 1.00 . B B . 1 ALA O 1 1 18 19808 2 2 2 PRO C C -13.700 -5.897 3.138 1.00 . B B . 2 PRO C 1 1 18 19809 2 2 2 PRO CA C -12.816 -6.692 4.099 1.00 . B B . 2 PRO CA 1 1 18 19810 2 2 2 PRO CB C -11.345 -6.331 3.891 1.00 . B B . 2 PRO CB 1 1 18 19811 2 2 2 PRO CD C -11.497 -8.718 3.779 1.00 . B B . 2 PRO CD 1 1 18 19812 2 2 2 PRO CG C -10.602 -7.583 4.199 1.00 . B B . 2 PRO CG 1 1 18 19813 2 2 2 PRO HA H -13.103 -6.476 5.118 1.00 . B B . 2 PRO HA 1 1 18 19814 2 2 2 PRO HB2 H -11.189 -6.016 2.870 1.00 . B B . 2 PRO HB2 1 1 18 19815 2 2 2 PRO HB3 H -11.069 -5.533 4.566 1.00 . B B . 2 PRO HB3 1 1 18 19816 2 2 2 PRO HD2 H -11.251 -9.040 2.777 1.00 . B B . 2 PRO HD2 1 1 18 19817 2 2 2 PRO HD3 H -11.409 -9.540 4.471 1.00 . B B . 2 PRO HD3 1 1 18 19818 2 2 2 PRO HG2 H -9.678 -7.607 3.639 1.00 . B B . 2 PRO HG2 1 1 18 19819 2 2 2 PRO HG3 H -10.400 -7.639 5.259 1.00 . B B . 2 PRO HG3 1 1 18 19820 2 2 2 PRO N N -12.851 -8.132 3.825 1.00 . B B . 2 PRO N 1 1 18 19821 2 2 2 PRO O O -13.362 -5.737 1.965 1.00 . B B . 2 PRO O 1 1 18 19822 2 2 3 PRO C C -15.247 -3.213 2.494 1.00 . B B . 3 PRO C 1 1 18 19823 2 2 3 PRO CA C -15.775 -4.610 2.799 1.00 . B B . 3 PRO CA 1 1 18 19824 2 2 3 PRO CB C -17.032 -4.530 3.665 1.00 . B B . 3 PRO CB 1 1 18 19825 2 2 3 PRO CD C -15.327 -5.534 5.011 1.00 . B B . 3 PRO CD 1 1 18 19826 2 2 3 PRO CG C -16.529 -4.628 5.063 1.00 . B B . 3 PRO CG 1 1 18 19827 2 2 3 PRO HA H -16.003 -5.119 1.873 1.00 . B B . 3 PRO HA 1 1 18 19828 2 2 3 PRO HB2 H -17.534 -3.589 3.489 1.00 . B B . 3 PRO HB2 1 1 18 19829 2 2 3 PRO HB3 H -17.693 -5.349 3.425 1.00 . B B . 3 PRO HB3 1 1 18 19830 2 2 3 PRO HD2 H -14.578 -5.203 5.715 1.00 . B B . 3 PRO HD2 1 1 18 19831 2 2 3 PRO HD3 H -15.615 -6.554 5.214 1.00 . B B . 3 PRO HD3 1 1 18 19832 2 2 3 PRO HG2 H -16.246 -3.649 5.422 1.00 . B B . 3 PRO HG2 1 1 18 19833 2 2 3 PRO HG3 H -17.292 -5.055 5.698 1.00 . B B . 3 PRO HG3 1 1 18 19834 2 2 3 PRO N N -14.847 -5.389 3.624 1.00 . B B . 3 PRO N 1 1 18 19835 2 2 3 PRO O O -15.794 -2.216 2.963 1.00 . B B . 3 PRO O 1 1 18 19836 2 2 4 GLY C C -12.081 -1.891 1.387 1.00 . B B . 4 GLY C 1 1 18 19837 2 2 4 GLY CA C -13.597 -1.870 1.347 1.00 . B B . 4 GLY CA 1 1 18 19838 2 2 4 GLY H H -13.786 -3.979 1.359 1.00 . B B . 4 GLY H 1 1 18 19839 2 2 4 GLY HA2 H -13.916 -1.606 0.349 1.00 . B B . 4 GLY HA2 1 1 18 19840 2 2 4 GLY HA3 H -13.954 -1.120 2.036 1.00 . B B . 4 GLY HA3 1 1 18 19841 2 2 4 GLY N N -14.180 -3.150 1.703 1.00 . B B . 4 GLY N 1 1 18 19842 2 2 4 GLY O O -11.464 -1.150 2.152 1.00 . B B . 4 GLY O 1 1 18 19843 2 2 5 THR C C -9.542 -3.309 -0.867 1.00 . B B . 5 THR C 1 1 18 19844 2 2 5 THR CA C -10.026 -2.853 0.507 1.00 . B B . 5 THR CA 1 1 18 19845 2 2 5 THR CB C -9.510 -3.837 1.571 1.00 . B B . 5 THR CB 1 1 18 19846 2 2 5 THR CG2 C -10.097 -3.508 2.934 1.00 . B B . 5 THR CG2 1 1 18 19847 2 2 5 THR H H -12.023 -3.282 -0.041 1.00 . B B . 5 THR H 1 1 18 19848 2 2 5 THR HA H -9.607 -1.878 0.714 1.00 . B B . 5 THR HA 1 1 18 19849 2 2 5 THR HB H -8.435 -3.756 1.628 1.00 . B B . 5 THR HB 1 1 18 19850 2 2 5 THR HG1 H -9.127 -5.591 0.753 1.00 . B B . 5 THR HG1 1 1 18 19851 2 2 5 THR HG21 H -11.162 -3.688 2.921 1.00 . B B . 5 THR HG21 1 1 18 19852 2 2 5 THR HG22 H -9.910 -2.468 3.163 1.00 . B B . 5 THR HG22 1 1 18 19853 2 2 5 THR HG23 H -9.635 -4.131 3.684 1.00 . B B . 5 THR HG23 1 1 18 19854 2 2 5 THR N N -11.480 -2.737 0.558 1.00 . B B . 5 THR N 1 1 18 19855 2 2 5 THR O O -10.339 -3.632 -1.746 1.00 . B B . 5 THR O 1 1 18 19856 2 2 5 THR OG1 O -9.863 -5.179 1.210 1.00 . B B . 5 THR OG1 1 1 18 19857 2 2 6 ALA C C -6.095 -3.891 -2.126 1.00 . B B . 6 ALA C 1 1 18 19858 2 2 6 ALA CA C -7.606 -3.746 -2.291 1.00 . B B . 6 ALA CA 1 1 18 19859 2 2 6 ALA CB C -7.934 -2.761 -3.403 1.00 . B B . 6 ALA CB 1 1 18 19860 2 2 6 ALA H H -7.646 -3.051 -0.295 1.00 . B B . 6 ALA H 1 1 18 19861 2 2 6 ALA HA H -8.021 -4.708 -2.559 1.00 . B B . 6 ALA HA 1 1 18 19862 2 2 6 ALA HB1 H -9.004 -2.627 -3.461 1.00 . B B . 6 ALA HB1 1 1 18 19863 2 2 6 ALA HB2 H -7.568 -3.145 -4.344 1.00 . B B . 6 ALA HB2 1 1 18 19864 2 2 6 ALA HB3 H -7.464 -1.813 -3.194 1.00 . B B . 6 ALA HB3 1 1 18 19865 2 2 6 ALA N N -8.222 -3.326 -1.037 1.00 . B B . 6 ALA N 1 1 18 19866 2 2 6 ALA O O -5.322 -3.485 -2.994 1.00 . B B . 6 ALA O 1 1 18 19867 2 2 7 ARG C C -3.482 -5.145 -1.909 1.00 . B B . 7 ARG C 1 1 18 19868 2 2 7 ARG CA C -4.272 -4.684 -0.691 1.00 . B B . 7 ARG CA 1 1 18 19869 2 2 7 ARG CB C -4.130 -5.716 0.429 1.00 . B B . 7 ARG CB 1 1 18 19870 2 2 7 ARG CD C -4.357 -8.116 1.145 1.00 . B B . 7 ARG CD 1 1 18 19871 2 2 7 ARG CG C -4.604 -7.106 0.036 1.00 . B B . 7 ARG CG 1 1 18 19872 2 2 7 ARG CZ C -2.414 -9.288 2.100 1.00 . B B . 7 ARG CZ 1 1 18 19873 2 2 7 ARG H H -6.362 -4.788 -0.362 1.00 . B B . 7 ARG H 1 1 18 19874 2 2 7 ARG HA H -3.868 -3.746 -0.352 1.00 . B B . 7 ARG HA 1 1 18 19875 2 2 7 ARG HB2 H -3.091 -5.780 0.714 1.00 . B B . 7 ARG HB2 1 1 18 19876 2 2 7 ARG HB3 H -4.709 -5.390 1.280 1.00 . B B . 7 ARG HB3 1 1 18 19877 2 2 7 ARG HD2 H -4.884 -7.793 2.031 1.00 . B B . 7 ARG HD2 1 1 18 19878 2 2 7 ARG HD3 H -4.737 -9.076 0.831 1.00 . B B . 7 ARG HD3 1 1 18 19879 2 2 7 ARG HE H -2.342 -7.519 1.182 1.00 . B B . 7 ARG HE 1 1 18 19880 2 2 7 ARG HG2 H -5.663 -7.069 -0.174 1.00 . B B . 7 ARG HG2 1 1 18 19881 2 2 7 ARG HG3 H -4.072 -7.420 -0.850 1.00 . B B . 7 ARG HG3 1 1 18 19882 2 2 7 ARG HH11 H -4.171 -10.268 2.288 1.00 . B B . 7 ARG HH11 1 1 18 19883 2 2 7 ARG HH12 H -2.796 -11.076 2.963 1.00 . B B . 7 ARG HH12 1 1 18 19884 2 2 7 ARG HH21 H -0.524 -8.573 2.068 1.00 . B B . 7 ARG HH21 1 1 18 19885 2 2 7 ARG HH22 H -0.722 -10.111 2.840 1.00 . B B . 7 ARG HH22 1 1 18 19886 2 2 7 ARG N N -5.688 -4.479 -1.003 1.00 . B B . 7 ARG N 1 1 18 19887 2 2 7 ARG NE N -2.936 -8.246 1.460 1.00 . B B . 7 ARG NE 1 1 18 19888 2 2 7 ARG NH1 N -3.191 -10.293 2.482 1.00 . B B . 7 ARG NH1 1 1 18 19889 2 2 7 ARG NH2 N -1.114 -9.327 2.356 1.00 . B B . 7 ARG NH2 1 1 18 19890 2 2 7 ARG O O -3.923 -6.027 -2.648 1.00 . B B . 7 ARG O 1 1 18 19891 2 2 8 ARG C C -1.186 -6.418 -3.183 1.00 . B B . 8 ARG C 1 1 18 19892 2 2 8 ARG CA C -1.463 -4.921 -3.237 1.00 . B B . 8 ARG CA 1 1 18 19893 2 2 8 ARG CB C -0.151 -4.134 -3.204 1.00 . B B . 8 ARG CB 1 1 18 19894 2 2 8 ARG CD C -0.133 -3.622 -5.661 1.00 . B B . 8 ARG CD 1 1 18 19895 2 2 8 ARG CG C 0.641 -4.219 -4.497 1.00 . B B . 8 ARG CG 1 1 18 19896 2 2 8 ARG CZ C 0.162 -3.223 -8.069 1.00 . B B . 8 ARG CZ 1 1 18 19897 2 2 8 ARG H H -2.012 -3.833 -1.510 1.00 . B B . 8 ARG H 1 1 18 19898 2 2 8 ARG HA H -1.993 -4.694 -4.150 1.00 . B B . 8 ARG HA 1 1 18 19899 2 2 8 ARG HB2 H -0.373 -3.095 -3.011 1.00 . B B . 8 ARG HB2 1 1 18 19900 2 2 8 ARG HB3 H 0.465 -4.517 -2.403 1.00 . B B . 8 ARG HB3 1 1 18 19901 2 2 8 ARG HD2 H -1.023 -4.211 -5.825 1.00 . B B . 8 ARG HD2 1 1 18 19902 2 2 8 ARG HD3 H -0.415 -2.610 -5.407 1.00 . B B . 8 ARG HD3 1 1 18 19903 2 2 8 ARG HE H 1.590 -3.875 -6.838 1.00 . B B . 8 ARG HE 1 1 18 19904 2 2 8 ARG HG2 H 1.568 -3.678 -4.378 1.00 . B B . 8 ARG HG2 1 1 18 19905 2 2 8 ARG HG3 H 0.852 -5.257 -4.711 1.00 . B B . 8 ARG HG3 1 1 18 19906 2 2 8 ARG HH11 H -1.696 -2.852 -7.364 1.00 . B B . 8 ARG HH11 1 1 18 19907 2 2 8 ARG HH12 H -1.474 -2.568 -9.058 1.00 . B B . 8 ARG HH12 1 1 18 19908 2 2 8 ARG HH21 H 1.895 -3.501 -9.071 1.00 . B B . 8 ARG HH21 1 1 18 19909 2 2 8 ARG HH22 H 0.566 -2.937 -10.028 1.00 . B B . 8 ARG HH22 1 1 18 19910 2 2 8 ARG N N -2.310 -4.544 -2.118 1.00 . B B . 8 ARG N 1 1 18 19911 2 2 8 ARG NE N 0.652 -3.599 -6.892 1.00 . B B . 8 ARG NE 1 1 18 19912 2 2 8 ARG NH1 N -1.106 -2.851 -8.172 1.00 . B B . 8 ARG NH1 1 1 18 19913 2 2 8 ARG NH2 N 0.938 -3.222 -9.145 1.00 . B B . 8 ARG NH2 1 1 18 19914 2 2 8 ARG O O -0.856 -6.957 -2.126 1.00 . B B . 8 ARG O 1 1 18 19915 2 2 9 LYS C C 0.143 -8.904 -5.174 1.00 . B B . 9 LYS C 1 1 18 19916 2 2 9 LYS CA C -1.104 -8.535 -4.370 1.00 . B B . 9 LYS CA 1 1 18 19917 2 2 9 LYS CB C -2.349 -9.266 -4.920 1.00 . B B . 9 LYS CB 1 1 18 19918 2 2 9 LYS CD C -3.804 -9.590 -6.950 1.00 . B B . 9 LYS CD 1 1 18 19919 2 2 9 LYS CE C -4.511 -10.773 -6.309 1.00 . B B . 9 LYS CE 1 1 18 19920 2 2 9 LYS CG C -2.382 -9.441 -6.439 1.00 . B B . 9 LYS CG 1 1 18 19921 2 2 9 LYS H H -1.555 -6.592 -5.133 1.00 . B B . 9 LYS H 1 1 18 19922 2 2 9 LYS HA H -0.948 -8.862 -3.352 1.00 . B B . 9 LYS HA 1 1 18 19923 2 2 9 LYS HB2 H -2.388 -10.249 -4.475 1.00 . B B . 9 LYS HB2 1 1 18 19924 2 2 9 LYS HB3 H -3.234 -8.721 -4.622 1.00 . B B . 9 LYS HB3 1 1 18 19925 2 2 9 LYS HD2 H -4.353 -8.689 -6.721 1.00 . B B . 9 LYS HD2 1 1 18 19926 2 2 9 LYS HD3 H -3.777 -9.733 -8.021 1.00 . B B . 9 LYS HD3 1 1 18 19927 2 2 9 LYS HE2 H -4.602 -10.592 -5.249 1.00 . B B . 9 LYS HE2 1 1 18 19928 2 2 9 LYS HE3 H -5.495 -10.867 -6.743 1.00 . B B . 9 LYS HE3 1 1 18 19929 2 2 9 LYS HG2 H -1.929 -8.585 -6.910 1.00 . B B . 9 LYS HG2 1 1 18 19930 2 2 9 LYS HG3 H -1.825 -10.330 -6.698 1.00 . B B . 9 LYS HG3 1 1 18 19931 2 2 9 LYS HZ1 H -4.260 -12.830 -6.048 1.00 . B B . 9 LYS HZ1 1 1 18 19932 2 2 9 LYS HZ2 H -2.807 -11.967 -6.126 1.00 . B B . 9 LYS HZ2 1 1 18 19933 2 2 9 LYS HZ3 H -3.696 -12.256 -7.536 1.00 . B B . 9 LYS HZ3 1 1 18 19934 2 2 9 LYS N N -1.321 -7.086 -4.319 1.00 . B B . 9 LYS N 1 1 18 19935 2 2 9 LYS NZ N -3.766 -12.045 -6.520 1.00 . B B . 9 LYS NZ 1 1 18 19936 2 2 9 LYS O O 0.177 -9.936 -5.843 1.00 . B B . 9 LYS O 1 1 18 19937 2 2 10 ARG C C 3.438 -8.952 -4.866 1.00 . B B . 10 ARG C 1 1 18 19938 2 2 10 ARG CA C 2.413 -8.322 -5.809 1.00 . B B . 10 ARG CA 1 1 18 19939 2 2 10 ARG CB C 2.976 -7.033 -6.414 1.00 . B B . 10 ARG CB 1 1 18 19940 2 2 10 ARG CD C 4.236 -4.892 -6.063 1.00 . B B . 10 ARG CD 1 1 18 19941 2 2 10 ARG CG C 3.592 -6.094 -5.391 1.00 . B B . 10 ARG CG 1 1 18 19942 2 2 10 ARG CZ C 5.573 -4.477 -8.084 1.00 . B B . 10 ARG CZ 1 1 18 19943 2 2 10 ARG H H 1.080 -7.247 -4.563 1.00 . B B . 10 ARG H 1 1 18 19944 2 2 10 ARG HA H 2.201 -9.019 -6.604 1.00 . B B . 10 ARG HA 1 1 18 19945 2 2 10 ARG HB2 H 3.735 -7.291 -7.136 1.00 . B B . 10 ARG HB2 1 1 18 19946 2 2 10 ARG HB3 H 2.177 -6.508 -6.917 1.00 . B B . 10 ARG HB3 1 1 18 19947 2 2 10 ARG HD2 H 3.461 -4.280 -6.499 1.00 . B B . 10 ARG HD2 1 1 18 19948 2 2 10 ARG HD3 H 4.768 -4.322 -5.316 1.00 . B B . 10 ARG HD3 1 1 18 19949 2 2 10 ARG HE H 5.521 -6.203 -7.085 1.00 . B B . 10 ARG HE 1 1 18 19950 2 2 10 ARG HG2 H 2.819 -5.750 -4.722 1.00 . B B . 10 ARG HG2 1 1 18 19951 2 2 10 ARG HG3 H 4.344 -6.629 -4.831 1.00 . B B . 10 ARG HG3 1 1 18 19952 2 2 10 ARG HH11 H 4.477 -2.901 -7.451 1.00 . B B . 10 ARG HH11 1 1 18 19953 2 2 10 ARG HH12 H 5.421 -2.624 -8.877 1.00 . B B . 10 ARG HH12 1 1 18 19954 2 2 10 ARG HH21 H 6.771 -5.849 -8.959 1.00 . B B . 10 ARG HH21 1 1 18 19955 2 2 10 ARG HH22 H 6.728 -4.300 -9.732 1.00 . B B . 10 ARG HH22 1 1 18 19956 2 2 10 ARG N N 1.165 -8.060 -5.102 1.00 . B B . 10 ARG N 1 1 18 19957 2 2 10 ARG NE N 5.173 -5.287 -7.110 1.00 . B B . 10 ARG NE 1 1 18 19958 2 2 10 ARG NH1 N 5.120 -3.233 -8.142 1.00 . B B . 10 ARG NH1 1 1 18 19959 2 2 10 ARG NH2 N 6.428 -4.911 -9.001 1.00 . B B . 10 ARG NH2 1 1 18 19960 2 2 10 ARG O O 4.394 -9.588 -5.312 1.00 . B B . 10 ARG O 1 1 18 19961 2 2 11 LYS C C 5.579 -9.294 -2.947 1.00 . B B . 11 LYS C 1 1 18 19962 2 2 11 LYS CA C 4.114 -9.303 -2.525 1.00 . B B . 11 LYS CA 1 1 18 19963 2 2 11 LYS CB C 3.689 -10.723 -2.135 1.00 . B B . 11 LYS CB 1 1 18 19964 2 2 11 LYS CD C 1.854 -11.422 -3.709 1.00 . B B . 11 LYS CD 1 1 18 19965 2 2 11 LYS CE C 1.479 -12.308 -4.886 1.00 . B B . 11 LYS CE 1 1 18 19966 2 2 11 LYS CG C 3.310 -11.609 -3.312 1.00 . B B . 11 LYS CG 1 1 18 19967 2 2 11 LYS H H 2.463 -8.221 -3.276 1.00 . B B . 11 LYS H 1 1 18 19968 2 2 11 LYS HA H 4.014 -8.669 -1.656 1.00 . B B . 11 LYS HA 1 1 18 19969 2 2 11 LYS HB2 H 4.504 -11.194 -1.609 1.00 . B B . 11 LYS HB2 1 1 18 19970 2 2 11 LYS HB3 H 2.837 -10.658 -1.472 1.00 . B B . 11 LYS HB3 1 1 18 19971 2 2 11 LYS HD2 H 1.226 -11.676 -2.868 1.00 . B B . 11 LYS HD2 1 1 18 19972 2 2 11 LYS HD3 H 1.693 -10.390 -3.981 1.00 . B B . 11 LYS HD3 1 1 18 19973 2 2 11 LYS HE2 H 1.668 -13.337 -4.620 1.00 . B B . 11 LYS HE2 1 1 18 19974 2 2 11 LYS HE3 H 0.427 -12.179 -5.096 1.00 . B B . 11 LYS HE3 1 1 18 19975 2 2 11 LYS HG2 H 3.937 -11.364 -4.154 1.00 . B B . 11 LYS HG2 1 1 18 19976 2 2 11 LYS HG3 H 3.467 -12.642 -3.035 1.00 . B B . 11 LYS HG3 1 1 18 19977 2 2 11 LYS HZ1 H 2.081 -10.986 -6.387 1.00 . B B . 11 LYS HZ1 1 1 18 19978 2 2 11 LYS HZ2 H 1.989 -12.599 -6.890 1.00 . B B . 11 LYS HZ2 1 1 18 19979 2 2 11 LYS HZ3 H 3.279 -12.088 -5.923 1.00 . B B . 11 LYS HZ3 1 1 18 19980 2 2 11 LYS N N 3.231 -8.758 -3.558 1.00 . B B . 11 LYS N 1 1 18 19981 2 2 11 LYS NZ N 2.262 -11.972 -6.107 1.00 . B B . 11 LYS NZ 1 1 18 19982 2 2 11 LYS O O 6.204 -10.347 -3.079 1.00 . B B . 11 LYS O 1 1 18 19983 2 2 12 ALA C C 8.413 -8.700 -2.570 1.00 . B B . 12 ALA C 1 1 18 19984 2 2 12 ALA CA C 7.514 -7.954 -3.546 1.00 . B B . 12 ALA CA 1 1 18 19985 2 2 12 ALA CB C 7.893 -6.485 -3.577 1.00 . B B . 12 ALA CB 1 1 18 19986 2 2 12 ALA H H 5.565 -7.299 -3.052 1.00 . B B . 12 ALA H 1 1 18 19987 2 2 12 ALA HA H 7.642 -8.363 -4.538 1.00 . B B . 12 ALA HA 1 1 18 19988 2 2 12 ALA HB1 H 7.250 -5.960 -4.270 1.00 . B B . 12 ALA HB1 1 1 18 19989 2 2 12 ALA HB2 H 8.921 -6.383 -3.890 1.00 . B B . 12 ALA HB2 1 1 18 19990 2 2 12 ALA HB3 H 7.774 -6.068 -2.587 1.00 . B B . 12 ALA HB3 1 1 18 19991 2 2 12 ALA N N 6.119 -8.101 -3.160 1.00 . B B . 12 ALA N 1 1 18 19992 2 2 12 ALA O O 9.499 -9.158 -2.927 1.00 . B B . 12 ALA O 1 1 18 19993 2 2 13 ASP C C 7.998 -10.818 0.065 1.00 . B B . 13 ASP C 1 1 18 19994 2 2 13 ASP CA C 8.680 -9.499 -0.288 1.00 . B B . 13 ASP CA 1 1 18 19995 2 2 13 ASP CB C 8.778 -8.592 0.942 1.00 . B B . 13 ASP CB 1 1 18 19996 2 2 13 ASP CG C 9.494 -9.251 2.106 1.00 . B B . 13 ASP CG 1 1 18 19997 2 2 13 ASP H H 7.070 -8.421 -1.121 1.00 . B B . 13 ASP H 1 1 18 19998 2 2 13 ASP HA H 9.673 -9.703 -0.658 1.00 . B B . 13 ASP HA 1 1 18 19999 2 2 13 ASP HB2 H 9.322 -7.698 0.675 1.00 . B B . 13 ASP HB2 1 1 18 20000 2 2 13 ASP HB3 H 7.779 -8.315 1.259 1.00 . B B . 13 ASP HB3 1 1 18 20001 2 2 13 ASP N N 7.942 -8.814 -1.335 1.00 . B B . 13 ASP N 1 1 18 20002 2 2 13 ASP O O 7.938 -11.214 1.229 1.00 . B B . 13 ASP O 1 1 18 20003 2 2 13 ASP OD1 O 10.742 -9.226 2.125 1.00 . B B . 13 ASP OD1 1 1 18 20004 2 2 13 ASP OD2 O 8.806 -9.790 2.998 1.00 . B B . 13 ASP OD2 1 1 18 20005 2 2 14 SER C C 7.723 -13.784 -0.096 1.00 . B B . 14 SER C 1 1 18 20006 2 2 14 SER CA C 6.801 -12.768 -0.763 1.00 . B B . 14 SER CA 1 1 18 20007 2 2 14 SER CB C 6.305 -13.315 -2.103 1.00 . B B . 14 SER CB 1 1 18 20008 2 2 14 SER H H 7.557 -11.126 -1.861 1.00 . B B . 14 SER H 1 1 18 20009 2 2 14 SER HA H 5.951 -12.593 -0.121 1.00 . B B . 14 SER HA 1 1 18 20010 2 2 14 SER HB2 H 5.826 -14.270 -1.945 1.00 . B B . 14 SER HB2 1 1 18 20011 2 2 14 SER HB3 H 5.595 -12.622 -2.532 1.00 . B B . 14 SER HB3 1 1 18 20012 2 2 14 SER HG H 7.190 -14.233 -3.591 1.00 . B B . 14 SER HG 1 1 18 20013 2 2 14 SER N N 7.480 -11.495 -0.956 1.00 . B B . 14 SER N 1 1 18 20014 2 2 14 SER O O 8.440 -14.500 -0.826 1.00 . B B . 14 SER O 1 1 18 20015 2 2 14 SER OXT O 7.722 -13.854 1.152 1.00 . B B . 14 SER OXT 1 1 18 20016 2 2 14 SER OG O 7.378 -13.490 -3.011 1.00 . B B . 14 SER OG 1 1 19 20017 1 1 1 GLY C C 11.109 5.877 -5.838 1.00 . A A . 1 GLY C 1 1 19 20018 1 1 1 GLY CA C 10.518 4.833 -6.770 1.00 . A A . 1 GLY CA 1 1 19 20019 1 1 1 GLY H1 H 8.790 5.873 -7.316 1.00 . A A . 1 GLY H1 1 1 19 20020 1 1 1 GLY H2 H 8.588 4.869 -5.971 1.00 . A A . 1 GLY H2 1 1 19 20021 1 1 1 GLY H3 H 8.675 4.197 -7.519 1.00 . A A . 1 GLY H3 1 1 19 20022 1 1 1 GLY HA2 H 10.762 3.849 -6.395 1.00 . A A . 1 GLY HA2 1 1 19 20023 1 1 1 GLY HA3 H 10.964 4.950 -7.748 1.00 . A A . 1 GLY HA3 1 1 19 20024 1 1 1 GLY N N 9.040 4.951 -6.902 1.00 . A A . 1 GLY N 1 1 19 20025 1 1 1 GLY O O 12.160 6.447 -6.130 1.00 . A A . 1 GLY O 1 1 19 20026 1 1 2 SER C C 9.980 7.244 -2.542 1.00 . A A . 2 SER C 1 1 19 20027 1 1 2 SER CA C 10.913 7.120 -3.746 1.00 . A A . 2 SER CA 1 1 19 20028 1 1 2 SER CB C 11.077 8.476 -4.419 1.00 . A A . 2 SER CB 1 1 19 20029 1 1 2 SER H H 9.618 5.629 -4.521 1.00 . A A . 2 SER H 1 1 19 20030 1 1 2 SER HA H 11.879 6.796 -3.391 1.00 . A A . 2 SER HA 1 1 19 20031 1 1 2 SER HB2 H 11.445 9.187 -3.696 1.00 . A A . 2 SER HB2 1 1 19 20032 1 1 2 SER HB3 H 11.786 8.387 -5.227 1.00 . A A . 2 SER HB3 1 1 19 20033 1 1 2 SER HG H 9.931 9.870 -5.182 1.00 . A A . 2 SER HG 1 1 19 20034 1 1 2 SER N N 10.438 6.128 -4.710 1.00 . A A . 2 SER N 1 1 19 20035 1 1 2 SER O O 10.420 7.603 -1.452 1.00 . A A . 2 SER O 1 1 19 20036 1 1 2 SER OG O 9.845 8.946 -4.938 1.00 . A A . 2 SER OG 1 1 19 20037 1 1 3 GLN C C 7.674 5.688 -0.932 1.00 . A A . 3 GLN C 1 1 19 20038 1 1 3 GLN CA C 7.738 7.031 -1.642 1.00 . A A . 3 GLN CA 1 1 19 20039 1 1 3 GLN CB C 6.360 7.420 -2.159 1.00 . A A . 3 GLN CB 1 1 19 20040 1 1 3 GLN CD C 4.880 9.265 -3.066 1.00 . A A . 3 GLN CD 1 1 19 20041 1 1 3 GLN CG C 6.293 8.834 -2.712 1.00 . A A . 3 GLN CG 1 1 19 20042 1 1 3 GLN H H 8.382 6.724 -3.628 1.00 . A A . 3 GLN H 1 1 19 20043 1 1 3 GLN HA H 8.076 7.776 -0.950 1.00 . A A . 3 GLN HA 1 1 19 20044 1 1 3 GLN HB2 H 6.091 6.738 -2.940 1.00 . A A . 3 GLN HB2 1 1 19 20045 1 1 3 GLN HB3 H 5.646 7.336 -1.353 1.00 . A A . 3 GLN HB3 1 1 19 20046 1 1 3 GLN HE21 H 4.390 7.402 -3.569 1.00 . A A . 3 GLN HE21 1 1 19 20047 1 1 3 GLN HE22 H 3.136 8.577 -3.729 1.00 . A A . 3 GLN HE22 1 1 19 20048 1 1 3 GLN HG2 H 6.685 9.515 -1.972 1.00 . A A . 3 GLN HG2 1 1 19 20049 1 1 3 GLN HG3 H 6.902 8.885 -3.604 1.00 . A A . 3 GLN HG3 1 1 19 20050 1 1 3 GLN N N 8.695 6.965 -2.736 1.00 . A A . 3 GLN N 1 1 19 20051 1 1 3 GLN NE2 N 4.052 8.318 -3.499 1.00 . A A . 3 GLN NE2 1 1 19 20052 1 1 3 GLN O O 7.664 4.643 -1.575 1.00 . A A . 3 GLN O 1 1 19 20053 1 1 3 GLN OE1 O 4.537 10.443 -2.957 1.00 . A A . 3 GLN OE1 1 1 19 20054 1 1 4 VAL C C 6.166 4.013 1.425 1.00 . A A . 4 VAL C 1 1 19 20055 1 1 4 VAL CA C 7.591 4.495 1.178 1.00 . A A . 4 VAL CA 1 1 19 20056 1 1 4 VAL CB C 8.311 4.679 2.530 1.00 . A A . 4 VAL CB 1 1 19 20057 1 1 4 VAL CG1 C 7.614 5.730 3.386 1.00 . A A . 4 VAL CG1 1 1 19 20058 1 1 4 VAL CG2 C 8.406 3.352 3.265 1.00 . A A . 4 VAL CG2 1 1 19 20059 1 1 4 VAL H H 7.608 6.584 0.850 1.00 . A A . 4 VAL H 1 1 19 20060 1 1 4 VAL HA H 8.120 3.735 0.621 1.00 . A A . 4 VAL HA 1 1 19 20061 1 1 4 VAL HB H 9.314 5.024 2.331 1.00 . A A . 4 VAL HB 1 1 19 20062 1 1 4 VAL HG11 H 6.809 5.272 3.940 1.00 . A A . 4 VAL HG11 1 1 19 20063 1 1 4 VAL HG12 H 7.217 6.508 2.752 1.00 . A A . 4 VAL HG12 1 1 19 20064 1 1 4 VAL HG13 H 8.326 6.158 4.077 1.00 . A A . 4 VAL HG13 1 1 19 20065 1 1 4 VAL HG21 H 8.692 3.526 4.291 1.00 . A A . 4 VAL HG21 1 1 19 20066 1 1 4 VAL HG22 H 9.146 2.728 2.784 1.00 . A A . 4 VAL HG22 1 1 19 20067 1 1 4 VAL HG23 H 7.448 2.857 3.236 1.00 . A A . 4 VAL HG23 1 1 19 20068 1 1 4 VAL N N 7.625 5.719 0.393 1.00 . A A . 4 VAL N 1 1 19 20069 1 1 4 VAL O O 5.657 4.098 2.540 1.00 . A A . 4 VAL O 1 1 19 20070 1 1 5 PHE C C 3.512 2.818 -0.901 1.00 . A A . 5 PHE C 1 1 19 20071 1 1 5 PHE CA C 4.159 2.977 0.476 1.00 . A A . 5 PHE CA 1 1 19 20072 1 1 5 PHE CB C 3.290 3.906 1.323 1.00 . A A . 5 PHE CB 1 1 19 20073 1 1 5 PHE CD1 C 4.356 5.686 -0.018 1.00 . A A . 5 PHE CD1 1 1 19 20074 1 1 5 PHE CD2 C 4.015 4.977 2.233 1.00 . A A . 5 PHE CD2 1 1 19 20075 1 1 5 PHE CE1 C 5.724 5.628 0.168 1.00 . A A . 5 PHE CE1 1 1 19 20076 1 1 5 PHE CE2 C 5.383 4.915 2.425 1.00 . A A . 5 PHE CE2 1 1 19 20077 1 1 5 PHE CG C 3.487 5.363 1.012 1.00 . A A . 5 PHE CG 1 1 19 20078 1 1 5 PHE CZ C 3.852 8.058 0.437 1.00 . A A . 5 PHE CZ 1 1 19 20079 1 1 5 PHE H H 5.988 3.451 -0.491 1.00 . A A . 5 PHE H 1 1 19 20080 1 1 5 PHE HA H 4.210 2.004 0.958 1.00 . A A . 5 PHE HA 1 1 19 20081 1 1 5 PHE HB2 H 2.257 3.668 1.142 1.00 . A A . 5 PHE HB2 1 1 19 20082 1 1 5 PHE HB3 H 3.513 3.751 2.367 1.00 . A A . 5 PHE HB3 1 1 19 20083 1 1 5 PHE HD1 H 3.955 5.989 -0.974 1.00 . A A . 5 PHE HD1 1 1 19 20084 1 1 5 PHE HD2 H 3.347 4.721 3.042 1.00 . A A . 5 PHE HD2 1 1 19 20085 1 1 5 PHE HE1 H 6.390 5.882 -0.643 1.00 . A A . 5 PHE HE1 1 1 19 20086 1 1 5 PHE HE2 H 5.782 4.614 3.381 1.00 . A A . 5 PHE HE2 1 1 19 20087 1 1 5 PHE HZ H 3.994 9.105 0.214 1.00 . A A . 5 PHE HZ 1 1 19 20088 1 1 5 PHE N N 5.527 3.491 0.373 1.00 . A A . 5 PHE N 1 1 19 20089 1 1 5 PHE O O 4.110 3.148 -1.925 1.00 . A A . 5 PHE O 1 1 19 20090 1 1 6 GLU C C 0.032 2.172 -1.846 1.00 . A A . 6 GLU C 1 1 19 20091 1 1 6 GLU CA C 1.525 2.102 -2.140 1.00 . A A . 6 GLU CA 1 1 19 20092 1 1 6 GLU CB C 1.874 0.752 -2.770 1.00 . A A . 6 GLU CB 1 1 19 20093 1 1 6 GLU CD C 1.470 1.436 -5.168 1.00 . A A . 6 GLU CD 1 1 19 20094 1 1 6 GLU CG C 1.118 0.466 -4.057 1.00 . A A . 6 GLU CG 1 1 19 20095 1 1 6 GLU H H 1.851 2.085 -0.056 1.00 . A A . 6 GLU H 1 1 19 20096 1 1 6 GLU HA H 1.784 2.894 -2.827 1.00 . A A . 6 GLU HA 1 1 19 20097 1 1 6 GLU HB2 H 2.930 0.736 -2.989 1.00 . A A . 6 GLU HB2 1 1 19 20098 1 1 6 GLU HB3 H 1.649 -0.033 -2.061 1.00 . A A . 6 GLU HB3 1 1 19 20099 1 1 6 GLU HG2 H 1.357 -0.535 -4.385 1.00 . A A . 6 GLU HG2 1 1 19 20100 1 1 6 GLU HG3 H 0.058 0.536 -3.860 1.00 . A A . 6 GLU HG3 1 1 19 20101 1 1 6 GLU N N 2.279 2.308 -0.909 1.00 . A A . 6 GLU N 1 1 19 20102 1 1 6 GLU O O -0.409 1.771 -0.767 1.00 . A A . 6 GLU O 1 1 19 20103 1 1 6 GLU OE1 O 0.846 2.517 -5.232 1.00 . A A . 6 GLU OE1 1 1 19 20104 1 1 6 GLU OE2 O 2.369 1.115 -5.973 1.00 . A A . 6 GLU OE2 1 1 19 20105 1 1 7 TYR C C -2.886 1.516 -3.059 1.00 . A A . 7 TYR C 1 1 19 20106 1 1 7 TYR CA C -2.184 2.776 -2.597 1.00 . A A . 7 TYR CA 1 1 19 20107 1 1 7 TYR CB C -2.770 3.988 -3.326 1.00 . A A . 7 TYR CB 1 1 19 20108 1 1 7 TYR CD1 C -0.693 5.415 -3.029 1.00 . A A . 7 TYR CD1 1 1 19 20109 1 1 7 TYR CD2 C -1.875 5.558 -5.093 1.00 . A A . 7 TYR CD2 1 1 19 20110 1 1 7 TYR CE1 C 0.221 6.347 -3.483 1.00 . A A . 7 TYR CE1 1 1 19 20111 1 1 7 TYR CE2 C -0.963 6.489 -5.555 1.00 . A A . 7 TYR CE2 1 1 19 20112 1 1 7 TYR CG C -1.755 5.003 -3.825 1.00 . A A . 7 TYR CG 1 1 19 20113 1 1 7 TYR CZ C 0.082 6.880 -4.745 1.00 . A A . 7 TYR CZ 1 1 19 20114 1 1 7 TYR H H -0.358 2.994 -3.628 1.00 . A A . 7 TYR H 1 1 19 20115 1 1 7 TYR HA H -2.364 2.887 -1.541 1.00 . A A . 7 TYR HA 1 1 19 20116 1 1 7 TYR HB2 H -3.335 3.643 -4.179 1.00 . A A . 7 TYR HB2 1 1 19 20117 1 1 7 TYR HB3 H -3.434 4.491 -2.647 1.00 . A A . 7 TYR HB3 1 1 19 20118 1 1 7 TYR HD1 H -0.581 4.993 -2.043 1.00 . A A . 7 TYR HD1 1 1 19 20119 1 1 7 TYR HD2 H -2.695 5.251 -5.725 1.00 . A A . 7 TYR HD2 1 1 19 20120 1 1 7 TYR HE1 H 1.040 6.653 -2.849 1.00 . A A . 7 TYR HE1 1 1 19 20121 1 1 7 TYR HE2 H -1.073 6.907 -6.544 1.00 . A A . 7 TYR HE2 1 1 19 20122 1 1 7 TYR HH H 1.874 7.551 -4.928 1.00 . A A . 7 TYR HH 1 1 19 20123 1 1 7 TYR N N -0.750 2.673 -2.793 1.00 . A A . 7 TYR N 1 1 19 20124 1 1 7 TYR O O -2.978 1.239 -4.254 1.00 . A A . 7 TYR O 1 1 19 20125 1 1 7 TYR OH O 0.990 7.808 -5.200 1.00 . A A . 7 TYR OH 1 1 19 20126 1 1 8 ALA C C -5.589 -0.235 -2.465 1.00 . A A . 8 ALA C 1 1 19 20127 1 1 8 ALA CA C -4.089 -0.478 -2.394 1.00 . A A . 8 ALA CA 1 1 19 20128 1 1 8 ALA CB C -3.781 -1.528 -1.340 1.00 . A A . 8 ALA CB 1 1 19 20129 1 1 8 ALA H H -3.271 1.032 -1.158 1.00 . A A . 8 ALA H 1 1 19 20130 1 1 8 ALA HA H -3.742 -0.843 -3.349 1.00 . A A . 8 ALA HA 1 1 19 20131 1 1 8 ALA HB1 H -2.807 -1.957 -1.528 1.00 . A A . 8 ALA HB1 1 1 19 20132 1 1 8 ALA HB2 H -4.529 -2.304 -1.386 1.00 . A A . 8 ALA HB2 1 1 19 20133 1 1 8 ALA HB3 H -3.792 -1.077 -0.356 1.00 . A A . 8 ALA HB3 1 1 19 20134 1 1 8 ALA N N -3.383 0.755 -2.096 1.00 . A A . 8 ALA N 1 1 19 20135 1 1 8 ALA O O -6.380 -1.107 -2.110 1.00 . A A . 8 ALA O 1 1 19 20136 1 1 9 GLU C C -7.923 1.194 -4.413 1.00 . A A . 9 GLU C 1 1 19 20137 1 1 9 GLU CA C -7.391 1.287 -3.017 1.00 . A A . 9 GLU CA 1 1 19 20138 1 1 9 GLU CB C -7.645 2.673 -2.442 1.00 . A A . 9 GLU CB 1 1 19 20139 1 1 9 GLU CD C -7.846 -1.838 0.383 1.00 . A A . 9 GLU CD 1 1 19 20140 1 1 9 GLU CG C -7.387 3.826 -3.400 1.00 . A A . 9 GLU CG 1 1 19 20141 1 1 9 GLU H H -5.310 1.613 -3.203 1.00 . A A . 9 GLU H 1 1 19 20142 1 1 9 GLU HA H -7.937 0.576 -2.440 1.00 . A A . 9 GLU HA 1 1 19 20143 1 1 9 GLU HB2 H -8.670 2.734 -2.134 1.00 . A A . 9 GLU HB2 1 1 19 20144 1 1 9 GLU HB3 H -7.013 2.791 -1.584 1.00 . A A . 9 GLU HB3 1 1 19 20145 1 1 9 GLU HG2 H -8.056 3.728 -4.243 1.00 . A A . 9 GLU HG2 1 1 19 20146 1 1 9 GLU HG3 H -7.595 4.752 -2.887 1.00 . A A . 9 GLU HG3 1 1 19 20147 1 1 9 GLU N N -5.980 0.950 -2.928 1.00 . A A . 9 GLU N 1 1 19 20148 1 1 9 GLU O O -7.194 0.952 -5.375 1.00 . A A . 9 GLU O 1 1 19 20149 1 1 9 GLU OE1 O -8.946 -2.271 0.782 1.00 . A A . 9 GLU OE1 1 1 19 20150 1 1 9 GLU OE2 O -7.203 -2.358 -0.552 1.00 . A A . 9 GLU OE2 1 1 19 20151 1 1 10 VAL C C -10.368 2.670 -6.249 1.00 . A A . 10 VAL C 1 1 19 20152 1 1 10 VAL CA C -9.900 1.311 -5.751 1.00 . A A . 10 VAL CA 1 1 19 20153 1 1 10 VAL CB C -11.060 0.322 -5.655 1.00 . A A . 10 VAL CB 1 1 19 20154 1 1 10 VAL CG1 C -11.669 0.061 -7.023 1.00 . A A . 10 VAL CG1 1 1 19 20155 1 1 10 VAL CG2 C -10.580 -0.970 -5.006 1.00 . A A . 10 VAL CG2 1 1 19 20156 1 1 10 VAL H H -9.732 1.604 -3.688 1.00 . A A . 10 VAL H 1 1 19 20157 1 1 10 VAL HA H -9.208 0.929 -6.438 1.00 . A A . 10 VAL HA 1 1 19 20158 1 1 10 VAL HB H -11.808 0.751 -5.023 1.00 . A A . 10 VAL HB 1 1 19 20159 1 1 10 VAL HG11 H -10.955 -0.463 -7.640 1.00 . A A . 10 VAL HG11 1 1 19 20160 1 1 10 VAL HG12 H -11.924 1.002 -7.486 1.00 . A A . 10 VAL HG12 1 1 19 20161 1 1 10 VAL HG13 H -12.559 -0.539 -6.913 1.00 . A A . 10 VAL HG13 1 1 19 20162 1 1 10 VAL HG21 H -11.258 -1.774 -5.246 1.00 . A A . 10 VAL HG21 1 1 19 20163 1 1 10 VAL HG22 H -10.540 -0.839 -3.931 1.00 . A A . 10 VAL HG22 1 1 19 20164 1 1 10 VAL HG23 H -9.594 -1.210 -5.372 1.00 . A A . 10 VAL HG23 1 1 19 20165 1 1 10 VAL N N -9.221 1.395 -4.499 1.00 . A A . 10 VAL N 1 1 19 20166 1 1 10 VAL O O -10.649 2.839 -7.434 1.00 . A A . 10 VAL O 1 1 19 20167 1 1 11 ASP C C -10.180 6.042 -4.838 1.00 . A A . 11 ASP C 1 1 19 20168 1 1 11 ASP CA C -10.847 4.986 -5.715 1.00 . A A . 11 ASP CA 1 1 19 20169 1 1 11 ASP CB C -12.367 5.112 -5.595 1.00 . A A . 11 ASP CB 1 1 19 20170 1 1 11 ASP CG C -12.879 6.436 -6.125 1.00 . A A . 11 ASP CG 1 1 19 20171 1 1 11 ASP H H -10.169 3.453 -4.424 1.00 . A A . 11 ASP H 1 1 19 20172 1 1 11 ASP HA H -10.562 5.155 -6.741 1.00 . A A . 11 ASP HA 1 1 19 20173 1 1 11 ASP HB2 H -12.835 4.318 -6.152 1.00 . A A . 11 ASP HB2 1 1 19 20174 1 1 11 ASP HB3 H -12.647 5.030 -4.555 1.00 . A A . 11 ASP HB3 1 1 19 20175 1 1 11 ASP N N -10.421 3.643 -5.349 1.00 . A A . 11 ASP N 1 1 19 20176 1 1 11 ASP O O -9.730 7.076 -5.329 1.00 . A A . 11 ASP O 1 1 19 20177 1 1 11 ASP OD1 O -13.120 6.533 -7.347 1.00 . A A . 11 ASP OD1 1 1 19 20178 1 1 11 ASP OD2 O -13.042 7.376 -5.319 1.00 . A A . 11 ASP OD2 1 1 19 20179 1 1 12 GLU C C -8.989 6.012 -1.359 1.00 . A A . 12 GLU C 1 1 19 20180 1 1 12 GLU CA C -9.541 6.720 -2.589 1.00 . A A . 12 GLU CA 1 1 19 20181 1 1 12 GLU CB C -10.599 7.738 -2.165 1.00 . A A . 12 GLU CB 1 1 19 20182 1 1 12 GLU CD C -11.988 9.747 -2.806 1.00 . A A . 12 GLU CD 1 1 19 20183 1 1 12 GLU CG C -10.980 8.713 -3.267 1.00 . A A . 12 GLU CG 1 1 19 20184 1 1 12 GLU H H -10.433 4.893 -3.222 1.00 . A A . 12 GLU H 1 1 19 20185 1 1 12 GLU HA H -8.735 7.238 -3.085 1.00 . A A . 12 GLU HA 1 1 19 20186 1 1 12 GLU HB2 H -11.489 7.204 -1.859 1.00 . A A . 12 GLU HB2 1 1 19 20187 1 1 12 GLU HB3 H -10.222 8.303 -1.325 1.00 . A A . 12 GLU HB3 1 1 19 20188 1 1 12 GLU HG2 H -10.090 9.225 -3.602 1.00 . A A . 12 GLU HG2 1 1 19 20189 1 1 12 GLU HG3 H -11.407 8.157 -4.089 1.00 . A A . 12 GLU HG3 1 1 19 20190 1 1 12 GLU N N -10.122 5.771 -3.540 1.00 . A A . 12 GLU N 1 1 19 20191 1 1 12 GLU O O -9.250 4.838 -1.154 1.00 . A A . 12 GLU O 1 1 19 20192 1 1 12 GLU OE1 O -11.565 10.782 -2.249 1.00 . A A . 12 GLU OE1 1 1 19 20193 1 1 12 GLU OE2 O -13.201 9.521 -3.000 1.00 . A A . 12 GLU OE2 1 1 19 20194 1 1 13 ILE C C -7.706 7.222 1.802 1.00 . A A . 13 ILE C 1 1 19 20195 1 1 13 ILE CA C -7.660 6.175 0.685 1.00 . A A . 13 ILE CA 1 1 19 20196 1 1 13 ILE CB C -6.193 5.706 0.479 1.00 . A A . 13 ILE CB 1 1 19 20197 1 1 13 ILE CD1 C -5.553 7.696 -0.955 1.00 . A A . 13 ILE CD1 1 1 19 20198 1 1 13 ILE CG1 C -5.260 6.904 0.301 1.00 . A A . 13 ILE CG1 1 1 19 20199 1 1 13 ILE CG2 C -6.112 4.819 -0.740 1.00 . A A . 13 ILE CG2 1 1 19 20200 1 1 13 ILE H H -8.050 7.673 -0.764 1.00 . A A . 13 ILE H 1 1 19 20201 1 1 13 ILE HA H -8.260 5.316 0.968 1.00 . A A . 13 ILE HA 1 1 19 20202 1 1 13 ILE HB H -5.877 5.119 1.341 1.00 . A A . 13 ILE HB 1 1 19 20203 1 1 13 ILE HD11 H -5.951 7.033 -1.713 1.00 . A A . 13 ILE HD11 1 1 19 20204 1 1 13 ILE HD12 H -4.644 8.152 -1.315 1.00 . A A . 13 ILE HD12 1 1 19 20205 1 1 13 ILE HD13 H -6.278 8.464 -0.733 1.00 . A A . 13 ILE HD13 1 1 19 20206 1 1 13 ILE HG12 H -5.367 7.567 1.146 1.00 . A A . 13 ILE HG12 1 1 19 20207 1 1 13 ILE HG13 H -4.240 6.554 0.245 1.00 . A A . 13 ILE HG13 1 1 19 20208 1 1 13 ILE HG21 H -5.615 5.345 -1.541 1.00 . A A . 13 ILE HG21 1 1 19 20209 1 1 13 ILE HG22 H -7.104 4.558 -1.044 1.00 . A A . 13 ILE HG22 1 1 19 20210 1 1 13 ILE HG23 H -5.560 3.923 -0.501 1.00 . A A . 13 ILE HG23 1 1 19 20211 1 1 13 ILE N N -8.231 6.736 -0.541 1.00 . A A . 13 ILE N 1 1 19 20212 1 1 13 ILE O O -8.343 8.265 1.655 1.00 . A A . 13 ILE O 1 1 19 20213 1 1 14 VAL C C -5.671 7.721 4.784 1.00 . A A . 14 VAL C 1 1 19 20214 1 1 14 VAL CA C -6.985 7.874 4.033 1.00 . A A . 14 VAL CA 1 1 19 20215 1 1 14 VAL CB C -8.171 7.674 5.003 1.00 . A A . 14 VAL CB 1 1 19 20216 1 1 14 VAL CG1 C -8.036 8.578 6.221 1.00 . A A . 14 VAL CG1 1 1 19 20217 1 1 14 VAL CG2 C -9.490 7.942 4.291 1.00 . A A . 14 VAL CG2 1 1 19 20218 1 1 14 VAL H H -6.552 6.091 2.977 1.00 . A A . 14 VAL H 1 1 19 20219 1 1 14 VAL HA H -7.039 8.875 3.633 1.00 . A A . 14 VAL HA 1 1 19 20220 1 1 14 VAL HB H -8.170 6.648 5.339 1.00 . A A . 14 VAL HB 1 1 19 20221 1 1 14 VAL HG11 H -8.025 9.610 5.903 1.00 . A A . 14 VAL HG11 1 1 19 20222 1 1 14 VAL HG12 H -7.114 8.350 6.736 1.00 . A A . 14 VAL HG12 1 1 19 20223 1 1 14 VAL HG13 H -8.870 8.414 6.886 1.00 . A A . 14 VAL HG13 1 1 19 20224 1 1 14 VAL HG21 H -9.560 8.991 4.046 1.00 . A A . 14 VAL HG21 1 1 19 20225 1 1 14 VAL HG22 H -10.310 7.668 4.938 1.00 . A A . 14 VAL HG22 1 1 19 20226 1 1 14 VAL HG23 H -9.535 7.358 3.386 1.00 . A A . 14 VAL HG23 1 1 19 20227 1 1 14 VAL N N -7.032 6.943 2.910 1.00 . A A . 14 VAL N 1 1 19 20228 1 1 14 VAL O O -4.910 8.677 4.932 1.00 . A A . 14 VAL O 1 1 19 20229 1 1 15 GLU C C -3.119 5.746 4.984 1.00 . A A . 15 GLU C 1 1 19 20230 1 1 15 GLU CA C -4.175 6.221 5.972 1.00 . A A . 15 GLU CA 1 1 19 20231 1 1 15 GLU CB C -4.413 5.159 7.047 1.00 . A A . 15 GLU CB 1 1 19 20232 1 1 15 GLU CD C -4.856 6.817 8.899 1.00 . A A . 15 GLU CD 1 1 19 20233 1 1 15 GLU CG C -5.366 5.606 8.143 1.00 . A A . 15 GLU CG 1 1 19 20234 1 1 15 GLU H H -6.069 5.796 5.121 1.00 . A A . 15 GLU H 1 1 19 20235 1 1 15 GLU HA H -3.837 7.134 6.439 1.00 . A A . 15 GLU HA 1 1 19 20236 1 1 15 GLU HB2 H -4.823 4.276 6.580 1.00 . A A . 15 GLU HB2 1 1 19 20237 1 1 15 GLU HB3 H -3.466 4.907 7.503 1.00 . A A . 15 GLU HB3 1 1 19 20238 1 1 15 GLU HG2 H -6.318 5.853 7.696 1.00 . A A . 15 GLU HG2 1 1 19 20239 1 1 15 GLU HG3 H -5.498 4.793 8.841 1.00 . A A . 15 GLU HG3 1 1 19 20240 1 1 15 GLU N N -5.412 6.511 5.258 1.00 . A A . 15 GLU N 1 1 19 20241 1 1 15 GLU O O -3.401 4.927 4.124 1.00 . A A . 15 GLU O 1 1 19 20242 1 1 15 GLU OE1 O -4.063 6.635 9.846 1.00 . A A . 15 GLU OE1 1 1 19 20243 1 1 15 GLU OE2 O -5.251 7.947 8.543 1.00 . A A . 15 GLU OE2 1 1 19 20244 1 1 16 LYS C C 0.532 6.005 4.828 1.00 . A A . 16 LYS C 1 1 19 20245 1 1 16 LYS CA C -0.844 5.884 4.170 1.00 . A A . 16 LYS CA 1 1 19 20246 1 1 16 LYS CB C -0.895 6.775 2.932 1.00 . A A . 16 LYS CB 1 1 19 20247 1 1 16 LYS CD C -1.231 9.084 1.999 1.00 . A A . 16 LYS CD 1 1 19 20248 1 1 16 LYS CE C -1.355 10.565 2.324 1.00 . A A . 16 LYS CE 1 1 19 20249 1 1 16 LYS CG C -1.038 8.253 3.256 1.00 . A A . 16 LYS CG 1 1 19 20250 1 1 16 LYS H H -1.732 6.934 5.788 1.00 . A A . 16 LYS H 1 1 19 20251 1 1 16 LYS HA H -1.021 4.854 3.874 1.00 . A A . 16 LYS HA 1 1 19 20252 1 1 16 LYS HB2 H 0.017 6.641 2.373 1.00 . A A . 16 LYS HB2 1 1 19 20253 1 1 16 LYS HB3 H -1.732 6.478 2.318 1.00 . A A . 16 LYS HB3 1 1 19 20254 1 1 16 LYS HD2 H -0.380 8.940 1.349 1.00 . A A . 16 LYS HD2 1 1 19 20255 1 1 16 LYS HD3 H -2.129 8.758 1.497 1.00 . A A . 16 LYS HD3 1 1 19 20256 1 1 16 LYS HE2 H -0.427 10.905 2.759 1.00 . A A . 16 LYS HE2 1 1 19 20257 1 1 16 LYS HE3 H -1.541 11.106 1.408 1.00 . A A . 16 LYS HE3 1 1 19 20258 1 1 16 LYS HG2 H -1.895 8.389 3.900 1.00 . A A . 16 LYS HG2 1 1 19 20259 1 1 16 LYS HG3 H -0.146 8.588 3.766 1.00 . A A . 16 LYS HG3 1 1 19 20260 1 1 16 LYS HZ1 H -3.367 10.504 2.878 1.00 . A A . 16 LYS HZ1 1 1 19 20261 1 1 16 LYS HZ2 H -2.533 11.851 3.473 1.00 . A A . 16 LYS HZ2 1 1 19 20262 1 1 16 LYS HZ3 H -2.296 10.330 4.174 1.00 . A A . 16 LYS HZ3 1 1 19 20263 1 1 16 LYS N N -1.912 6.274 5.089 1.00 . A A . 16 LYS N 1 1 19 20264 1 1 16 LYS NZ N -2.465 10.832 3.279 1.00 . A A . 16 LYS NZ 1 1 19 20265 1 1 16 LYS O O 1.192 7.036 4.699 1.00 . A A . 16 LYS O 1 1 19 20266 1 1 17 ARG C C 2.855 3.588 6.367 1.00 . A A . 17 ARG C 1 1 19 20267 1 1 17 ARG CA C 2.266 4.987 6.207 1.00 . A A . 17 ARG CA 1 1 19 20268 1 1 17 ARG CB C 2.130 5.639 7.590 1.00 . A A . 17 ARG CB 1 1 19 20269 1 1 17 ARG CD C 0.271 7.334 7.698 1.00 . A A . 17 ARG CD 1 1 19 20270 1 1 17 ARG CG C 1.770 7.116 7.549 1.00 . A A . 17 ARG CG 1 1 19 20271 1 1 17 ARG CZ C -1.354 9.172 7.518 1.00 . A A . 17 ARG CZ 1 1 19 20272 1 1 17 ARG H H 0.441 4.128 5.525 1.00 . A A . 17 ARG H 1 1 19 20273 1 1 17 ARG HA H 2.941 5.580 5.609 1.00 . A A . 17 ARG HA 1 1 19 20274 1 1 17 ARG HB2 H 1.361 5.120 8.144 1.00 . A A . 17 ARG HB2 1 1 19 20275 1 1 17 ARG HB3 H 3.068 5.535 8.115 1.00 . A A . 17 ARG HB3 1 1 19 20276 1 1 17 ARG HD2 H -0.246 6.675 7.020 1.00 . A A . 17 ARG HD2 1 1 19 20277 1 1 17 ARG HD3 H -0.013 7.100 8.713 1.00 . A A . 17 ARG HD3 1 1 19 20278 1 1 17 ARG HE H 0.593 9.327 7.109 1.00 . A A . 17 ARG HE 1 1 19 20279 1 1 17 ARG HG2 H 2.276 7.620 8.358 1.00 . A A . 17 ARG HG2 1 1 19 20280 1 1 17 ARG HG3 H 2.095 7.530 6.607 1.00 . A A . 17 ARG HG3 1 1 19 20281 1 1 17 ARG HH11 H -2.126 7.410 8.139 1.00 . A A . 17 ARG HH11 1 1 19 20282 1 1 17 ARG HH12 H -3.261 8.712 8.004 1.00 . A A . 17 ARG HH12 1 1 19 20283 1 1 17 ARG HH21 H -0.893 11.049 6.928 1.00 . A A . 17 ARG HH21 1 1 19 20284 1 1 17 ARG HH22 H -2.559 10.781 7.315 1.00 . A A . 17 ARG HH22 1 1 19 20285 1 1 17 ARG N N 0.970 4.956 5.520 1.00 . A A . 17 ARG N 1 1 19 20286 1 1 17 ARG NE N -0.111 8.713 7.405 1.00 . A A . 17 ARG NE 1 1 19 20287 1 1 17 ARG NH1 N -2.327 8.365 7.919 1.00 . A A . 17 ARG NH1 1 1 19 20288 1 1 17 ARG NH2 N -1.624 10.438 7.231 1.00 . A A . 17 ARG NH2 1 1 19 20289 1 1 17 ARG O O 2.530 2.886 7.324 1.00 . A A . 17 ARG O 1 1 19 20290 1 1 18 GLY C C 5.675 1.732 4.917 1.00 . A A . 18 GLY C 1 1 19 20291 1 1 18 GLY CA C 4.305 1.855 5.554 1.00 . A A . 18 GLY CA 1 1 19 20292 1 1 18 GLY H H 3.951 3.759 4.690 1.00 . A A . 18 GLY H 1 1 19 20293 1 1 18 GLY HA2 H 4.392 1.606 6.601 1.00 . A A . 18 GLY HA2 1 1 19 20294 1 1 18 GLY HA3 H 3.646 1.145 5.088 1.00 . A A . 18 GLY HA3 1 1 19 20295 1 1 18 GLY N N 3.717 3.175 5.441 1.00 . A A . 18 GLY N 1 1 19 20296 1 1 18 GLY O O 6.580 2.517 5.196 1.00 . A A . 18 GLY O 1 1 19 20297 1 1 19 LYS C C 6.918 0.755 1.883 1.00 . A A . 19 LYS C 1 1 19 20298 1 1 19 LYS CA C 7.053 0.434 3.361 1.00 . A A . 19 LYS CA 1 1 19 20299 1 1 19 LYS CB C 7.383 -1.037 3.547 1.00 . A A . 19 LYS CB 1 1 19 20300 1 1 19 LYS CD C 8.202 -2.822 5.084 1.00 . A A . 19 LYS CD 1 1 19 20301 1 1 19 LYS CE C 8.796 -3.129 6.447 1.00 . A A . 19 LYS CE 1 1 19 20302 1 1 19 LYS CG C 8.066 -1.333 4.865 1.00 . A A . 19 LYS CG 1 1 19 20303 1 1 19 LYS H H 5.039 0.137 3.904 1.00 . A A . 19 LYS H 1 1 19 20304 1 1 19 LYS HA H 7.829 1.017 3.783 1.00 . A A . 19 LYS HA 1 1 19 20305 1 1 19 LYS HB2 H 6.459 -1.597 3.510 1.00 . A A . 19 LYS HB2 1 1 19 20306 1 1 19 LYS HB3 H 8.025 -1.366 2.745 1.00 . A A . 19 LYS HB3 1 1 19 20307 1 1 19 LYS HD2 H 7.226 -3.271 5.014 1.00 . A A . 19 LYS HD2 1 1 19 20308 1 1 19 LYS HD3 H 8.843 -3.229 4.318 1.00 . A A . 19 LYS HD3 1 1 19 20309 1 1 19 LYS HE2 H 9.786 -2.701 6.498 1.00 . A A . 19 LYS HE2 1 1 19 20310 1 1 19 LYS HE3 H 8.170 -2.680 7.204 1.00 . A A . 19 LYS HE3 1 1 19 20311 1 1 19 LYS HG2 H 9.049 -0.887 4.861 1.00 . A A . 19 LYS HG2 1 1 19 20312 1 1 19 LYS HG3 H 7.478 -0.912 5.669 1.00 . A A . 19 LYS HG3 1 1 19 20313 1 1 19 LYS HZ1 H 9.305 -4.770 7.630 1.00 . A A . 19 LYS HZ1 1 1 19 20314 1 1 19 LYS HZ2 H 9.481 -5.042 5.970 1.00 . A A . 19 LYS HZ2 1 1 19 20315 1 1 19 LYS HZ3 H 7.939 -5.019 6.665 1.00 . A A . 19 LYS HZ3 1 1 19 20316 1 1 19 LYS N N 5.810 0.721 4.065 1.00 . A A . 19 LYS N 1 1 19 20317 1 1 19 LYS NZ N 8.887 -4.592 6.695 1.00 . A A . 19 LYS NZ 1 1 19 20318 1 1 19 LYS O O 7.480 1.720 1.370 1.00 . A A . 19 LYS O 1 1 19 20319 1 1 20 GLY C C 4.598 -0.675 -0.416 1.00 . A A . 20 GLY C 1 1 19 20320 1 1 20 GLY CA C 5.907 0.010 -0.178 1.00 . A A . 20 GLY CA 1 1 19 20321 1 1 20 GLY H H 5.848 -0.876 1.702 1.00 . A A . 20 GLY H 1 1 19 20322 1 1 20 GLY HA2 H 5.838 1.053 -0.446 1.00 . A A . 20 GLY HA2 1 1 19 20323 1 1 20 GLY HA3 H 6.671 -0.472 -0.749 1.00 . A A . 20 GLY HA3 1 1 19 20324 1 1 20 GLY N N 6.201 -0.113 1.220 1.00 . A A . 20 GLY N 1 1 19 20325 1 1 20 GLY O O 3.692 -0.152 -1.059 1.00 . A A . 20 GLY O 1 1 19 20326 1 1 21 LYS C C 2.938 -3.080 1.534 1.00 . A A . 21 LYS C 1 1 19 20327 1 1 21 LYS CA C 3.340 -2.690 0.104 1.00 . A A . 21 LYS CA 1 1 19 20328 1 1 21 LYS CB C 3.557 -3.936 -0.749 1.00 . A A . 21 LYS CB 1 1 19 20329 1 1 21 LYS CD C 2.499 -5.472 -2.425 1.00 . A A . 21 LYS CD 1 1 19 20330 1 1 21 LYS CE C 1.777 -6.384 -1.447 1.00 . A A . 21 LYS CE 1 1 19 20331 1 1 21 LYS CG C 2.579 -4.051 -1.898 1.00 . A A . 21 LYS CG 1 1 19 20332 1 1 21 LYS H H 5.342 -2.231 0.562 1.00 . A A . 21 LYS H 1 1 19 20333 1 1 21 LYS HA H 2.546 -2.097 -0.332 1.00 . A A . 21 LYS HA 1 1 19 20334 1 1 21 LYS HB2 H 4.556 -3.909 -1.157 1.00 . A A . 21 LYS HB2 1 1 19 20335 1 1 21 LYS HB3 H 3.454 -4.811 -0.125 1.00 . A A . 21 LYS HB3 1 1 19 20336 1 1 21 LYS HD2 H 1.964 -5.470 -3.363 1.00 . A A . 21 LYS HD2 1 1 19 20337 1 1 21 LYS HD3 H 3.501 -5.846 -2.580 1.00 . A A . 21 LYS HD3 1 1 19 20338 1 1 21 LYS HE2 H 2.276 -6.333 -0.492 1.00 . A A . 21 LYS HE2 1 1 19 20339 1 1 21 LYS HE3 H 0.758 -6.041 -1.339 1.00 . A A . 21 LYS HE3 1 1 19 20340 1 1 21 LYS HG2 H 1.603 -3.750 -1.551 1.00 . A A . 21 LYS HG2 1 1 19 20341 1 1 21 LYS HG3 H 2.897 -3.396 -2.697 1.00 . A A . 21 LYS HG3 1 1 19 20342 1 1 21 LYS HZ1 H 1.365 -7.856 -2.869 1.00 . A A . 21 LYS HZ1 1 1 19 20343 1 1 21 LYS HZ2 H 1.191 -8.381 -1.269 1.00 . A A . 21 LYS HZ2 1 1 19 20344 1 1 21 LYS HZ3 H 2.733 -8.174 -1.930 1.00 . A A . 21 LYS HZ3 1 1 19 20345 1 1 21 LYS N N 4.533 -1.873 0.136 1.00 . A A . 21 LYS N 1 1 19 20346 1 1 21 LYS NZ N 1.765 -7.798 -1.911 1.00 . A A . 21 LYS NZ 1 1 19 20347 1 1 21 LYS O O 1.850 -3.606 1.753 1.00 . A A . 21 LYS O 1 1 19 20348 1 1 22 ASP C C 2.777 -1.973 4.579 1.00 . A A . 22 ASP C 1 1 19 20349 1 1 22 ASP CA C 3.544 -3.098 3.912 1.00 . A A . 22 ASP CA 1 1 19 20350 1 1 22 ASP CB C 4.846 -3.312 4.676 1.00 . A A . 22 ASP CB 1 1 19 20351 1 1 22 ASP CG C 4.629 -3.982 6.020 1.00 . A A . 22 ASP CG 1 1 19 20352 1 1 22 ASP H H 4.678 -2.413 2.293 1.00 . A A . 22 ASP H 1 1 19 20353 1 1 22 ASP HA H 2.960 -3.983 3.939 1.00 . A A . 22 ASP HA 1 1 19 20354 1 1 22 ASP HB2 H 5.513 -3.913 4.083 1.00 . A A . 22 ASP HB2 1 1 19 20355 1 1 22 ASP HB3 H 5.305 -2.351 4.851 1.00 . A A . 22 ASP HB3 1 1 19 20356 1 1 22 ASP N N 3.819 -2.797 2.514 1.00 . A A . 22 ASP N 1 1 19 20357 1 1 22 ASP O O 2.583 -1.966 5.792 1.00 . A A . 22 ASP O 1 1 19 20358 1 1 22 ASP OD1 O 4.576 -5.229 6.056 1.00 . A A . 22 ASP OD1 1 1 19 20359 1 1 22 ASP OD2 O 4.513 -3.267 7.035 1.00 . A A . 22 ASP OD2 1 1 19 20360 1 1 23 VAL C C 0.121 -0.194 4.225 1.00 . A A . 23 VAL C 1 1 19 20361 1 1 23 VAL CA C 1.609 0.106 4.250 1.00 . A A . 23 VAL CA 1 1 19 20362 1 1 23 VAL CB C 1.879 1.312 3.364 1.00 . A A . 23 VAL CB 1 1 19 20363 1 1 23 VAL CG1 C 1.438 1.011 1.947 1.00 . A A . 23 VAL CG1 1 1 19 20364 1 1 23 VAL CG2 C 1.177 2.531 3.911 1.00 . A A . 23 VAL CG2 1 1 19 20365 1 1 23 VAL H H 2.586 -1.068 2.837 1.00 . A A . 23 VAL H 1 1 19 20366 1 1 23 VAL HA H 1.916 0.336 5.256 1.00 . A A . 23 VAL HA 1 1 19 20367 1 1 23 VAL HB H 2.942 1.500 3.355 1.00 . A A . 23 VAL HB 1 1 19 20368 1 1 23 VAL HG11 H 0.872 1.844 1.562 1.00 . A A . 23 VAL HG11 1 1 19 20369 1 1 23 VAL HG12 H 0.823 0.124 1.938 1.00 . A A . 23 VAL HG12 1 1 19 20370 1 1 23 VAL HG13 H 2.308 0.850 1.329 1.00 . A A . 23 VAL HG13 1 1 19 20371 1 1 23 VAL HG21 H 0.155 2.547 3.559 1.00 . A A . 23 VAL HG21 1 1 19 20372 1 1 23 VAL HG22 H 1.687 3.423 3.580 1.00 . A A . 23 VAL HG22 1 1 19 20373 1 1 23 VAL HG23 H 1.186 2.485 4.989 1.00 . A A . 23 VAL HG23 1 1 19 20374 1 1 23 VAL N N 2.361 -1.023 3.777 1.00 . A A . 23 VAL N 1 1 19 20375 1 1 23 VAL O O -0.341 -1.041 3.461 1.00 . A A . 23 VAL O 1 1 19 20376 1 1 24 GLU C C -2.798 1.522 4.486 1.00 . A A . 24 GLU C 1 1 19 20377 1 1 24 GLU CA C -2.061 0.340 5.096 1.00 . A A . 24 GLU CA 1 1 19 20378 1 1 24 GLU CB C -2.516 0.137 6.535 1.00 . A A . 24 GLU CB 1 1 19 20379 1 1 24 GLU CD C -2.469 0.973 8.919 1.00 . A A . 24 GLU CD 1 1 19 20380 1 1 24 GLU CG C -1.999 1.197 7.495 1.00 . A A . 24 GLU CG 1 1 19 20381 1 1 24 GLU H H -0.203 1.235 5.565 1.00 . A A . 24 GLU H 1 1 19 20382 1 1 24 GLU HA H -2.294 -0.553 4.527 1.00 . A A . 24 GLU HA 1 1 19 20383 1 1 24 GLU HB2 H -3.595 0.156 6.559 1.00 . A A . 24 GLU HB2 1 1 19 20384 1 1 24 GLU HB3 H -2.175 -0.827 6.876 1.00 . A A . 24 GLU HB3 1 1 19 20385 1 1 24 GLU HG2 H -0.919 1.178 7.481 1.00 . A A . 24 GLU HG2 1 1 19 20386 1 1 24 GLU HG3 H -2.346 2.164 7.163 1.00 . A A . 24 GLU HG3 1 1 19 20387 1 1 24 GLU N N -0.625 0.535 5.027 1.00 . A A . 24 GLU N 1 1 19 20388 1 1 24 GLU O O -2.724 2.645 4.986 1.00 . A A . 24 GLU O 1 1 19 20389 1 1 24 GLU OE1 O -3.555 1.481 9.272 1.00 . A A . 24 GLU OE1 1 1 19 20390 1 1 24 GLU OE2 O -1.755 0.289 9.680 1.00 . A A . 24 GLU OE2 1 1 19 20391 1 1 25 TYR C C -5.755 1.958 2.786 1.00 . A A . 25 TYR C 1 1 19 20392 1 1 25 TYR CA C -4.270 2.273 2.712 1.00 . A A . 25 TYR CA 1 1 19 20393 1 1 25 TYR CB C -3.830 2.360 1.256 1.00 . A A . 25 TYR CB 1 1 19 20394 1 1 25 TYR CD1 C -1.437 3.068 1.620 1.00 . A A . 25 TYR CD1 1 1 19 20395 1 1 25 TYR CD2 C -2.819 4.432 0.243 1.00 . A A . 25 TYR CD2 1 1 19 20396 1 1 25 TYR CE1 C -0.379 3.931 1.426 1.00 . A A . 25 TYR CE1 1 1 19 20397 1 1 25 TYR CE2 C -1.766 5.301 0.045 1.00 . A A . 25 TYR CE2 1 1 19 20398 1 1 25 TYR CG C -2.675 3.304 1.036 1.00 . A A . 25 TYR CG 1 1 19 20399 1 1 25 TYR CZ C -0.544 5.039 0.625 1.00 . A A . 25 TYR CZ 1 1 19 20400 1 1 25 TYR H H -3.528 0.348 3.066 1.00 . A A . 25 TYR H 1 1 19 20401 1 1 25 TYR HA H -4.079 3.215 3.190 1.00 . A A . 25 TYR HA 1 1 19 20402 1 1 25 TYR HB2 H -3.529 1.378 0.918 1.00 . A A . 25 TYR HB2 1 1 19 20403 1 1 25 TYR HB3 H -4.660 2.701 0.657 1.00 . A A . 25 TYR HB3 1 1 19 20404 1 1 25 TYR HD1 H -1.308 2.194 2.235 1.00 . A A . 25 TYR HD1 1 1 19 20405 1 1 25 TYR HD2 H -3.775 4.631 -0.218 1.00 . A A . 25 TYR HD2 1 1 19 20406 1 1 25 TYR HE1 H 0.574 3.730 1.891 1.00 . A A . 25 TYR HE1 1 1 19 20407 1 1 25 TYR HE2 H -1.898 6.165 -0.579 1.00 . A A . 25 TYR HE2 1 1 19 20408 1 1 25 TYR HH H 1.312 5.419 0.327 1.00 . A A . 25 TYR HH 1 1 19 20409 1 1 25 TYR N N -3.510 1.255 3.404 1.00 . A A . 25 TYR N 1 1 19 20410 1 1 25 TYR O O -6.149 0.797 2.812 1.00 . A A . 25 TYR O 1 1 19 20411 1 1 25 TYR OH O 0.501 5.917 0.450 1.00 . A A . 25 TYR OH 1 1 19 20412 1 1 26 LEU C C -8.524 2.768 1.454 1.00 . A A . 26 LEU C 1 1 19 20413 1 1 26 LEU CA C -8.008 2.822 2.867 1.00 . A A . 26 LEU CA 1 1 19 20414 1 1 26 LEU CB C -8.663 3.969 3.640 1.00 . A A . 26 LEU CB 1 1 19 20415 1 1 26 LEU CD1 C -10.597 2.860 4.778 1.00 . A A . 26 LEU CD1 1 1 19 20416 1 1 26 LEU CD2 C -10.786 5.241 4.059 1.00 . A A . 26 LEU CD2 1 1 19 20417 1 1 26 LEU CG C -10.184 3.883 3.740 1.00 . A A . 26 LEU CG 1 1 19 20418 1 1 26 LEU H H -6.211 3.889 2.735 1.00 . A A . 26 LEU H 1 1 19 20419 1 1 26 LEU HA H -8.221 1.881 3.353 1.00 . A A . 26 LEU HA 1 1 19 20420 1 1 26 LEU HB2 H -8.253 3.980 4.641 1.00 . A A . 26 LEU HB2 1 1 19 20421 1 1 26 LEU HB3 H -8.406 4.898 3.154 1.00 . A A . 26 LEU HB3 1 1 19 20422 1 1 26 LEU HD11 H -9.834 2.102 4.853 1.00 . A A . 26 LEU HD11 1 1 19 20423 1 1 26 LEU HD12 H -11.529 2.400 4.481 1.00 . A A . 26 LEU HD12 1 1 19 20424 1 1 26 LEU HD13 H -10.721 3.343 5.736 1.00 . A A . 26 LEU HD13 1 1 19 20425 1 1 26 LEU HD21 H -10.737 5.870 3.184 1.00 . A A . 26 LEU HD21 1 1 19 20426 1 1 26 LEU HD22 H -10.233 5.698 4.866 1.00 . A A . 26 LEU HD22 1 1 19 20427 1 1 26 LEU HD23 H -11.817 5.116 4.355 1.00 . A A . 26 LEU HD23 1 1 19 20428 1 1 26 LEU HG H -10.574 3.560 2.793 1.00 . A A . 26 LEU HG 1 1 19 20429 1 1 26 LEU N N -6.574 2.994 2.807 1.00 . A A . 26 LEU N 1 1 19 20430 1 1 26 LEU O O -7.849 3.229 0.533 1.00 . A A . 26 LEU O 1 1 19 20431 1 1 27 VAL C C -11.695 2.300 -0.229 1.00 . A A . 27 VAL C 1 1 19 20432 1 1 27 VAL CA C -10.194 2.114 -0.097 1.00 . A A . 27 VAL CA 1 1 19 20433 1 1 27 VAL CB C -9.725 0.809 -0.782 1.00 . A A . 27 VAL CB 1 1 19 20434 1 1 27 VAL CG1 C -8.463 0.261 -0.123 1.00 . A A . 27 VAL CG1 1 1 19 20435 1 1 27 VAL CG2 C -10.799 -0.276 -0.837 1.00 . A A . 27 VAL CG2 1 1 19 20436 1 1 27 VAL H H -10.215 1.851 2.002 1.00 . A A . 27 VAL H 1 1 19 20437 1 1 27 VAL HA H -9.739 2.911 -0.648 1.00 . A A . 27 VAL HA 1 1 19 20438 1 1 27 VAL HB H -9.472 1.085 -1.782 1.00 . A A . 27 VAL HB 1 1 19 20439 1 1 27 VAL HG11 H -8.641 0.129 0.932 1.00 . A A . 27 VAL HG11 1 1 19 20440 1 1 27 VAL HG12 H -7.649 0.957 -0.268 1.00 . A A . 27 VAL HG12 1 1 19 20441 1 1 27 VAL HG13 H -8.208 -0.690 -0.567 1.00 . A A . 27 VAL HG13 1 1 19 20442 1 1 27 VAL HG21 H -11.656 0.093 -1.381 1.00 . A A . 27 VAL HG21 1 1 19 20443 1 1 27 VAL HG22 H -11.096 -0.539 0.168 1.00 . A A . 27 VAL HG22 1 1 19 20444 1 1 27 VAL HG23 H -10.404 -1.149 -1.335 1.00 . A A . 27 VAL HG23 1 1 19 20445 1 1 27 VAL N N -9.698 2.208 1.252 1.00 . A A . 27 VAL N 1 1 19 20446 1 1 27 VAL O O -12.490 1.478 0.225 1.00 . A A . 27 VAL O 1 1 19 20447 1 1 28 ARG C C -13.755 2.955 -2.408 1.00 . A A . 28 ARG C 1 1 19 20448 1 1 28 ARG CA C -13.450 3.679 -1.133 1.00 . A A . 28 ARG CA 1 1 19 20449 1 1 28 ARG CB C -13.720 5.164 -1.299 1.00 . A A . 28 ARG CB 1 1 19 20450 1 1 28 ARG CD C -13.548 7.473 -0.332 1.00 . A A . 28 ARG CD 1 1 19 20451 1 1 28 ARG CG C -13.085 6.030 -0.224 1.00 . A A . 28 ARG CG 1 1 19 20452 1 1 28 ARG CZ C -13.337 9.584 0.909 1.00 . A A . 28 ARG CZ 1 1 19 20453 1 1 28 ARG H H -11.384 4.065 -1.109 1.00 . A A . 28 ARG H 1 1 19 20454 1 1 28 ARG HA H -14.061 3.269 -0.348 1.00 . A A . 28 ARG HA 1 1 19 20455 1 1 28 ARG HB2 H -13.335 5.465 -2.257 1.00 . A A . 28 ARG HB2 1 1 19 20456 1 1 28 ARG HB3 H -14.787 5.330 -1.281 1.00 . A A . 28 ARG HB3 1 1 19 20457 1 1 28 ARG HD2 H -13.221 7.873 -1.281 1.00 . A A . 28 ARG HD2 1 1 19 20458 1 1 28 ARG HD3 H -14.628 7.494 -0.288 1.00 . A A . 28 ARG HD3 1 1 19 20459 1 1 28 ARG HE H -12.387 7.891 1.369 1.00 . A A . 28 ARG HE 1 1 19 20460 1 1 28 ARG HG2 H -13.361 5.644 0.745 1.00 . A A . 28 ARG HG2 1 1 19 20461 1 1 28 ARG HG3 H -12.011 5.996 -0.335 1.00 . A A . 28 ARG HG3 1 1 19 20462 1 1 28 ARG HH11 H -14.571 9.654 -0.690 1.00 . A A . 28 ARG HH11 1 1 19 20463 1 1 28 ARG HH12 H -14.422 11.133 0.198 1.00 . A A . 28 ARG HH12 1 1 19 20464 1 1 28 ARG HH21 H -12.182 9.835 2.549 1.00 . A A . 28 ARG HH21 1 1 19 20465 1 1 28 ARG HH22 H -13.063 11.237 2.039 1.00 . A A . 28 ARG HH22 1 1 19 20466 1 1 28 ARG N N -12.065 3.411 -0.844 1.00 . A A . 28 ARG N 1 1 19 20467 1 1 28 ARG NE N -13.014 8.306 0.742 1.00 . A A . 28 ARG NE 1 1 19 20468 1 1 28 ARG NH1 N -14.179 10.172 0.070 1.00 . A A . 28 ARG NH1 1 1 19 20469 1 1 28 ARG NH2 N -12.818 10.275 1.915 1.00 . A A . 28 ARG NH2 1 1 19 20470 1 1 28 ARG O O -13.941 3.565 -3.462 1.00 . A A . 28 ARG O 1 1 19 20471 1 1 29 TRP C C -14.834 1.349 -4.485 1.00 . A A . 29 TRP C 1 1 19 20472 1 1 29 TRP CA C -14.015 0.714 -3.382 1.00 . A A . 29 TRP CA 1 1 19 20473 1 1 29 TRP CB C -14.741 -0.505 -2.842 1.00 . A A . 29 TRP CB 1 1 19 20474 1 1 29 TRP CD1 C -13.614 -1.899 -4.668 1.00 . A A . 29 TRP CD1 1 1 19 20475 1 1 29 TRP CD2 C -14.993 -3.064 -3.344 1.00 . A A . 29 TRP CD2 1 1 19 20476 1 1 29 TRP CE2 C -14.441 -3.941 -4.296 1.00 . A A . 29 TRP CE2 1 1 19 20477 1 1 29 TRP CE3 C -15.894 -3.572 -2.404 1.00 . A A . 29 TRP CE3 1 1 19 20478 1 1 29 TRP CG C -14.449 -1.764 -3.598 1.00 . A A . 29 TRP CG 1 1 19 20479 1 1 29 TRP CH2 C -15.641 -5.767 -3.400 1.00 . A A . 29 TRP CH2 1 1 19 20480 1 1 29 TRP CZ2 C -14.757 -5.297 -4.333 1.00 . A A . 29 TRP CZ2 1 1 19 20481 1 1 29 TRP CZ3 C -16.208 -4.919 -2.441 1.00 . A A . 29 TRP CZ3 1 1 19 20482 1 1 29 TRP H H -13.602 1.257 -1.398 1.00 . A A . 29 TRP H 1 1 19 20483 1 1 29 TRP HA H -13.058 0.408 -3.779 1.00 . A A . 29 TRP HA 1 1 19 20484 1 1 29 TRP HB2 H -14.447 -0.645 -1.816 1.00 . A A . 29 TRP HB2 1 1 19 20485 1 1 29 TRP HB3 H -15.806 -0.327 -2.885 1.00 . A A . 29 TRP HB3 1 1 19 20486 1 1 29 TRP HD1 H -13.050 -1.088 -5.107 1.00 . A A . 29 TRP HD1 1 1 19 20487 1 1 29 TRP HE1 H -13.077 -3.556 -5.844 1.00 . A A . 29 TRP HE1 1 1 19 20488 1 1 29 TRP HE3 H -16.341 -2.932 -1.657 1.00 . A A . 29 TRP HE3 1 1 19 20489 1 1 29 TRP HH2 H -15.916 -6.812 -3.392 1.00 . A A . 29 TRP HH2 1 1 19 20490 1 1 29 TRP HZ2 H -14.328 -5.965 -5.064 1.00 . A A . 29 TRP HZ2 1 1 19 20491 1 1 29 TRP HZ3 H -16.902 -5.329 -1.722 1.00 . A A . 29 TRP HZ3 1 1 19 20492 1 1 29 TRP N N -13.776 1.634 -2.281 1.00 . A A . 29 TRP N 1 1 19 20493 1 1 29 TRP NE1 N -13.601 -3.207 -5.093 1.00 . A A . 29 TRP NE1 1 1 19 20494 1 1 29 TRP O O -16.060 1.332 -4.455 1.00 . A A . 29 TRP O 1 1 19 20495 1 1 30 LYS C C -16.053 1.998 -7.002 1.00 . A A . 30 LYS C 1 1 19 20496 1 1 30 LYS CA C -14.718 2.632 -6.592 1.00 . A A . 30 LYS CA 1 1 19 20497 1 1 30 LYS CB C -13.758 2.579 -7.780 1.00 . A A . 30 LYS CB 1 1 19 20498 1 1 30 LYS CD C -13.158 3.418 -10.068 1.00 . A A . 30 LYS CD 1 1 19 20499 1 1 30 LYS CE C -13.568 4.310 -11.228 1.00 . A A . 30 LYS CE 1 1 19 20500 1 1 30 LYS CG C -14.203 3.419 -8.964 1.00 . A A . 30 LYS CG 1 1 19 20501 1 1 30 LYS H H -13.127 2.016 -5.284 1.00 . A A . 30 LYS H 1 1 19 20502 1 1 30 LYS HA H -14.891 3.665 -6.329 1.00 . A A . 30 LYS HA 1 1 19 20503 1 1 30 LYS HB2 H -12.792 2.928 -7.464 1.00 . A A . 30 LYS HB2 1 1 19 20504 1 1 30 LYS HB3 H -13.671 1.554 -8.109 1.00 . A A . 30 LYS HB3 1 1 19 20505 1 1 30 LYS HD2 H -12.222 3.777 -9.664 1.00 . A A . 30 LYS HD2 1 1 19 20506 1 1 30 LYS HD3 H -13.032 2.408 -10.429 1.00 . A A . 30 LYS HD3 1 1 19 20507 1 1 30 LYS HE2 H -13.684 5.321 -10.865 1.00 . A A . 30 LYS HE2 1 1 19 20508 1 1 30 LYS HE3 H -12.790 4.284 -11.977 1.00 . A A . 30 LYS HE3 1 1 19 20509 1 1 30 LYS HG2 H -15.126 3.016 -9.355 1.00 . A A . 30 LYS HG2 1 1 19 20510 1 1 30 LYS HG3 H -14.364 4.435 -8.633 1.00 . A A . 30 LYS HG3 1 1 19 20511 1 1 30 LYS HZ1 H -15.104 4.500 -12.630 1.00 . A A . 30 LYS HZ1 1 1 19 20512 1 1 30 LYS HZ2 H -15.611 3.885 -11.137 1.00 . A A . 30 LYS HZ2 1 1 19 20513 1 1 30 LYS HZ3 H -14.753 2.899 -12.210 1.00 . A A . 30 LYS HZ3 1 1 19 20514 1 1 30 LYS N N -14.113 1.964 -5.420 1.00 . A A . 30 LYS N 1 1 19 20515 1 1 30 LYS NZ N -14.849 3.867 -11.845 1.00 . A A . 30 LYS NZ 1 1 19 20516 1 1 30 LYS O O -16.975 2.693 -7.427 1.00 . A A . 30 LYS O 1 1 19 20517 1 1 31 ASP C C -17.997 -0.618 -5.946 1.00 . A A . 31 ASP C 1 1 19 20518 1 1 31 ASP CA C -17.361 -0.049 -7.211 1.00 . A A . 31 ASP CA 1 1 19 20519 1 1 31 ASP CB C -17.056 -1.178 -8.196 1.00 . A A . 31 ASP CB 1 1 19 20520 1 1 31 ASP CG C -16.512 -0.664 -9.514 1.00 . A A . 31 ASP CG 1 1 19 20521 1 1 31 ASP H H -15.363 0.177 -6.550 1.00 . A A . 31 ASP H 1 1 19 20522 1 1 31 ASP HA H -18.049 0.646 -7.668 1.00 . A A . 31 ASP HA 1 1 19 20523 1 1 31 ASP HB2 H -16.323 -1.841 -7.760 1.00 . A A . 31 ASP HB2 1 1 19 20524 1 1 31 ASP HB3 H -17.964 -1.731 -8.393 1.00 . A A . 31 ASP HB3 1 1 19 20525 1 1 31 ASP N N -16.140 0.677 -6.875 1.00 . A A . 31 ASP N 1 1 19 20526 1 1 31 ASP O O -18.259 -1.816 -5.851 1.00 . A A . 31 ASP O 1 1 19 20527 1 1 31 ASP OD1 O -15.295 -0.390 -9.586 1.00 . A A . 31 ASP OD1 1 1 19 20528 1 1 31 ASP OD2 O -17.301 -0.538 -10.473 1.00 . A A . 31 ASP OD2 1 1 19 20529 1 1 32 GLY C C -19.661 0.920 -3.067 1.00 . A A . 32 GLY C 1 1 19 20530 1 1 32 GLY CA C -18.824 -0.164 -3.716 1.00 . A A . 32 GLY CA 1 1 19 20531 1 1 32 GLY H H -18.021 1.202 -5.116 1.00 . A A . 32 GLY H 1 1 19 20532 1 1 32 GLY HA2 H -19.443 -1.032 -3.888 1.00 . A A . 32 GLY HA2 1 1 19 20533 1 1 32 GLY HA3 H -18.022 -0.432 -3.038 1.00 . A A . 32 GLY HA3 1 1 19 20534 1 1 32 GLY N N -18.240 0.257 -4.975 1.00 . A A . 32 GLY N 1 1 19 20535 1 1 32 GLY O O -20.075 1.875 -3.726 1.00 . A A . 32 GLY O 1 1 19 20536 1 1 33 GLY C C -19.927 2.342 0.127 1.00 . A A . 33 GLY C 1 1 19 20537 1 1 33 GLY CA C -20.693 1.750 -1.041 1.00 . A A . 33 GLY CA 1 1 19 20538 1 1 33 GLY H H -19.562 -0.020 -1.307 1.00 . A A . 33 GLY H 1 1 19 20539 1 1 33 GLY HA2 H -20.970 2.546 -1.716 1.00 . A A . 33 GLY HA2 1 1 19 20540 1 1 33 GLY HA3 H -21.590 1.277 -0.669 1.00 . A A . 33 GLY HA3 1 1 19 20541 1 1 33 GLY N N -19.910 0.769 -1.771 1.00 . A A . 33 GLY N 1 1 19 20542 1 1 33 GLY O O -20.030 3.537 0.405 1.00 . A A . 33 GLY O 1 1 19 20543 1 1 34 ASP C C -16.875 1.822 1.656 1.00 . A A . 34 ASP C 1 1 19 20544 1 1 34 ASP CA C -18.367 1.940 1.958 1.00 . A A . 34 ASP CA 1 1 19 20545 1 1 34 ASP CB C -18.721 1.110 3.193 1.00 . A A . 34 ASP CB 1 1 19 20546 1 1 34 ASP CG C -20.182 1.237 3.573 1.00 . A A . 34 ASP CG 1 1 19 20547 1 1 34 ASP H H -19.127 0.558 0.550 1.00 . A A . 34 ASP H 1 1 19 20548 1 1 34 ASP HA H -18.605 2.976 2.148 1.00 . A A . 34 ASP HA 1 1 19 20549 1 1 34 ASP HB2 H -18.509 0.071 2.995 1.00 . A A . 34 ASP HB2 1 1 19 20550 1 1 34 ASP HB3 H -18.119 1.443 4.028 1.00 . A A . 34 ASP HB3 1 1 19 20551 1 1 34 ASP N N -19.159 1.500 0.815 1.00 . A A . 34 ASP N 1 1 19 20552 1 1 34 ASP O O -16.485 1.335 0.594 1.00 . A A . 34 ASP O 1 1 19 20553 1 1 34 ASP OD1 O -20.526 2.199 4.292 1.00 . A A . 34 ASP OD1 1 1 19 20554 1 1 34 ASP OD2 O -20.983 0.377 3.153 1.00 . A A . 34 ASP OD2 1 1 19 20555 1 1 35 CYS C C -13.933 1.508 3.604 1.00 . A A . 35 CYS C 1 1 19 20556 1 1 35 CYS CA C -14.595 2.213 2.423 1.00 . A A . 35 CYS CA 1 1 19 20557 1 1 35 CYS CB C -14.027 3.625 2.275 1.00 . A A . 35 CYS CB 1 1 19 20558 1 1 35 CYS H H -16.415 2.642 3.420 1.00 . A A . 35 CYS H 1 1 19 20559 1 1 35 CYS HA H -14.388 1.654 1.522 1.00 . A A . 35 CYS HA 1 1 19 20560 1 1 35 CYS HB2 H -12.956 3.564 2.150 1.00 . A A . 35 CYS HB2 1 1 19 20561 1 1 35 CYS HB3 H -14.459 4.089 1.400 1.00 . A A . 35 CYS HB3 1 1 19 20562 1 1 35 CYS HG H -15.072 5.731 3.262 1.00 . A A . 35 CYS HG 1 1 19 20563 1 1 35 CYS N N -16.045 2.267 2.594 1.00 . A A . 35 CYS N 1 1 19 20564 1 1 35 CYS O O -14.206 1.829 4.760 1.00 . A A . 35 CYS O 1 1 19 20565 1 1 35 CYS SG S -14.353 4.703 3.689 1.00 . A A . 35 CYS SG 1 1 19 20566 1 1 36 GLU C C -10.858 0.020 4.275 1.00 . A A . 36 GLU C 1 1 19 20567 1 1 36 GLU CA C -12.366 -0.198 4.343 1.00 . A A . 36 GLU CA 1 1 19 20568 1 1 36 GLU CB C -12.668 -1.683 4.215 1.00 . A A . 36 GLU CB 1 1 19 20569 1 1 36 GLU CD C -14.212 -1.722 6.212 1.00 . A A . 36 GLU CD 1 1 19 20570 1 1 36 GLU CG C -14.034 -2.077 4.750 1.00 . A A . 36 GLU CG 1 1 19 20571 1 1 36 GLU H H -12.888 0.330 2.368 1.00 . A A . 36 GLU H 1 1 19 20572 1 1 36 GLU HA H -12.725 0.151 5.299 1.00 . A A . 36 GLU HA 1 1 19 20573 1 1 36 GLU HB2 H -12.618 -1.962 3.172 1.00 . A A . 36 GLU HB2 1 1 19 20574 1 1 36 GLU HB3 H -11.916 -2.227 4.760 1.00 . A A . 36 GLU HB3 1 1 19 20575 1 1 36 GLU HG2 H -14.793 -1.565 4.176 1.00 . A A . 36 GLU HG2 1 1 19 20576 1 1 36 GLU HG3 H -14.158 -3.144 4.635 1.00 . A A . 36 GLU HG3 1 1 19 20577 1 1 36 GLU N N -13.062 0.547 3.305 1.00 . A A . 36 GLU N 1 1 19 20578 1 1 36 GLU O O -10.333 0.520 3.281 1.00 . A A . 36 GLU O 1 1 19 20579 1 1 36 GLU OE1 O -13.680 -2.457 7.071 1.00 . A A . 36 GLU OE1 1 1 19 20580 1 1 36 GLU OE2 O -14.882 -0.708 6.501 1.00 . A A . 36 GLU OE2 1 1 19 20581 1 1 37 TRP C C -8.011 -1.431 4.850 1.00 . A A . 37 TRP C 1 1 19 20582 1 1 37 TRP CA C -8.722 -0.223 5.436 1.00 . A A . 37 TRP CA 1 1 19 20583 1 1 37 TRP CB C -8.291 -0.076 6.899 1.00 . A A . 37 TRP CB 1 1 19 20584 1 1 37 TRP CD1 C -8.869 2.405 7.071 1.00 . A A . 37 TRP CD1 1 1 19 20585 1 1 37 TRP CD2 C -9.407 1.214 8.886 1.00 . A A . 37 TRP CD2 1 1 19 20586 1 1 37 TRP CE2 C -9.776 2.555 9.105 1.00 . A A . 37 TRP CE2 1 1 19 20587 1 1 37 TRP CE3 C -9.648 0.275 9.893 1.00 . A A . 37 TRP CE3 1 1 19 20588 1 1 37 TRP CG C -8.835 1.142 7.575 1.00 . A A . 37 TRP CG 1 1 19 20589 1 1 37 TRP CH2 C -10.594 2.037 11.259 1.00 . A A . 37 TRP CH2 1 1 19 20590 1 1 37 TRP CZ2 C -10.371 2.978 10.291 1.00 . A A . 37 TRP CZ2 1 1 19 20591 1 1 37 TRP CZ3 C -10.238 0.697 11.069 1.00 . A A . 37 TRP CZ3 1 1 19 20592 1 1 37 TRP H H -10.656 -0.751 6.100 1.00 . A A . 37 TRP H 1 1 19 20593 1 1 37 TRP HA H -8.434 0.661 4.890 1.00 . A A . 37 TRP HA 1 1 19 20594 1 1 37 TRP HB2 H -8.630 -0.939 7.452 1.00 . A A . 37 TRP HB2 1 1 19 20595 1 1 37 TRP HB3 H -7.212 -0.032 6.942 1.00 . A A . 37 TRP HB3 1 1 19 20596 1 1 37 TRP HD1 H -8.506 2.675 6.092 1.00 . A A . 37 TRP HD1 1 1 19 20597 1 1 37 TRP HE1 H -9.578 4.223 7.848 1.00 . A A . 37 TRP HE1 1 1 19 20598 1 1 37 TRP HE3 H -9.380 -0.763 9.764 1.00 . A A . 37 TRP HE3 1 1 19 20599 1 1 37 TRP HH2 H -11.052 2.322 12.195 1.00 . A A . 37 TRP HH2 1 1 19 20600 1 1 37 TRP HZ2 H -10.652 4.008 10.453 1.00 . A A . 37 TRP HZ2 1 1 19 20601 1 1 37 TRP HZ3 H -10.431 -0.014 11.859 1.00 . A A . 37 TRP HZ3 1 1 19 20602 1 1 37 TRP N N -10.172 -0.370 5.345 1.00 . A A . 37 TRP N 1 1 19 20603 1 1 37 TRP NE1 N -9.438 3.262 7.981 1.00 . A A . 37 TRP NE1 1 1 19 20604 1 1 37 TRP O O -8.430 -2.569 5.052 1.00 . A A . 37 TRP O 1 1 19 20605 1 1 38 VAL C C -5.104 -2.768 4.543 1.00 . A A . 38 VAL C 1 1 19 20606 1 1 38 VAL CA C -6.135 -2.254 3.544 1.00 . A A . 38 VAL CA 1 1 19 20607 1 1 38 VAL CB C -5.413 -1.799 2.262 1.00 . A A . 38 VAL CB 1 1 19 20608 1 1 38 VAL CG1 C -4.551 -2.922 1.704 1.00 . A A . 38 VAL CG1 1 1 19 20609 1 1 38 VAL CG2 C -6.415 -1.332 1.223 1.00 . A A . 38 VAL CG2 1 1 19 20610 1 1 38 VAL H H -6.646 -0.240 3.994 1.00 . A A . 38 VAL H 1 1 19 20611 1 1 38 VAL HA H -6.811 -3.057 3.290 1.00 . A A . 38 VAL HA 1 1 19 20612 1 1 38 VAL HB H -4.770 -0.972 2.508 1.00 . A A . 38 VAL HB 1 1 19 20613 1 1 38 VAL HG11 H -4.155 -2.630 0.751 1.00 . A A . 38 VAL HG11 1 1 19 20614 1 1 38 VAL HG12 H -5.149 -3.814 1.589 1.00 . A A . 38 VAL HG12 1 1 19 20615 1 1 38 VAL HG13 H -3.736 -3.122 2.384 1.00 . A A . 38 VAL HG13 1 1 19 20616 1 1 38 VAL HG21 H -6.639 -2.143 0.550 1.00 . A A . 38 VAL HG21 1 1 19 20617 1 1 38 VAL HG22 H -5.997 -0.506 0.664 1.00 . A A . 38 VAL HG22 1 1 19 20618 1 1 38 VAL HG23 H -7.319 -1.013 1.717 1.00 . A A . 38 VAL HG23 1 1 19 20619 1 1 38 VAL N N -6.918 -1.177 4.140 1.00 . A A . 38 VAL N 1 1 19 20620 1 1 38 VAL O O -4.764 -2.082 5.507 1.00 . A A . 38 VAL O 1 1 19 20621 1 1 39 LYS C C -2.236 -4.035 5.025 1.00 . A A . 39 LYS C 1 1 19 20622 1 1 39 LYS CA C -3.642 -4.590 5.198 1.00 . A A . 39 LYS CA 1 1 19 20623 1 1 39 LYS CB C -3.636 -6.109 5.014 1.00 . A A . 39 LYS CB 1 1 19 20624 1 1 39 LYS CD C -2.722 -8.333 5.732 1.00 . A A . 39 LYS CD 1 1 19 20625 1 1 39 LYS CE C -4.036 -8.881 6.264 1.00 . A A . 39 LYS CE 1 1 19 20626 1 1 39 LYS CG C -2.638 -6.826 5.905 1.00 . A A . 39 LYS CG 1 1 19 20627 1 1 39 LYS H H -4.915 -4.474 3.517 1.00 . A A . 39 LYS H 1 1 19 20628 1 1 39 LYS HA H -3.954 -4.367 6.196 1.00 . A A . 39 LYS HA 1 1 19 20629 1 1 39 LYS HB2 H -4.622 -6.490 5.234 1.00 . A A . 39 LYS HB2 1 1 19 20630 1 1 39 LYS HB3 H -3.394 -6.333 3.985 1.00 . A A . 39 LYS HB3 1 1 19 20631 1 1 39 LYS HD2 H -2.644 -8.569 4.681 1.00 . A A . 39 LYS HD2 1 1 19 20632 1 1 39 LYS HD3 H -1.906 -8.794 6.268 1.00 . A A . 39 LYS HD3 1 1 19 20633 1 1 39 LYS HE2 H -4.120 -8.628 7.310 1.00 . A A . 39 LYS HE2 1 1 19 20634 1 1 39 LYS HE3 H -4.850 -8.427 5.716 1.00 . A A . 39 LYS HE3 1 1 19 20635 1 1 39 LYS HG2 H -1.642 -6.499 5.651 1.00 . A A . 39 LYS HG2 1 1 19 20636 1 1 39 LYS HG3 H -2.850 -6.578 6.936 1.00 . A A . 39 LYS HG3 1 1 19 20637 1 1 39 LYS HZ1 H -3.322 -10.815 6.603 1.00 . A A . 39 LYS HZ1 1 1 19 20638 1 1 39 LYS HZ2 H -4.094 -10.623 5.110 1.00 . A A . 39 LYS HZ2 1 1 19 20639 1 1 39 LYS HZ3 H -5.008 -10.712 6.530 1.00 . A A . 39 LYS HZ3 1 1 19 20640 1 1 39 LYS N N -4.612 -3.977 4.304 1.00 . A A . 39 LYS N 1 1 19 20641 1 1 39 LYS NZ N -4.121 -10.361 6.116 1.00 . A A . 39 LYS NZ 1 1 19 20642 1 1 39 LYS O O -1.559 -4.303 4.033 1.00 . A A . 39 LYS O 1 1 19 20643 1 1 40 GLY C C 0.537 -3.586 6.684 1.00 . A A . 40 GLY C 1 1 19 20644 1 1 40 GLY CA C -0.484 -2.684 6.018 1.00 . A A . 40 GLY CA 1 1 19 20645 1 1 40 GLY H H -2.430 -3.051 6.747 1.00 . A A . 40 GLY H 1 1 19 20646 1 1 40 GLY HA2 H -0.181 -2.516 4.999 1.00 . A A . 40 GLY HA2 1 1 19 20647 1 1 40 GLY HA3 H -0.508 -1.738 6.538 1.00 . A A . 40 GLY HA3 1 1 19 20648 1 1 40 GLY N N -1.814 -3.258 6.018 1.00 . A A . 40 GLY N 1 1 19 20649 1 1 40 GLY O O 1.349 -3.132 7.491 1.00 . A A . 40 GLY O 1 1 19 20650 1 1 41 VAL C C 2.230 -6.475 5.766 1.00 . A A . 41 VAL C 1 1 19 20651 1 1 41 VAL CA C 1.416 -5.849 6.896 1.00 . A A . 41 VAL CA 1 1 19 20652 1 1 41 VAL CB C 0.702 -6.980 7.652 1.00 . A A . 41 VAL CB 1 1 19 20653 1 1 41 VAL CG1 C 1.667 -7.686 8.592 1.00 . A A . 41 VAL CG1 1 1 19 20654 1 1 41 VAL CG2 C -0.507 -6.451 8.409 1.00 . A A . 41 VAL CG2 1 1 19 20655 1 1 41 VAL H H -0.218 -5.172 5.743 1.00 . A A . 41 VAL H 1 1 19 20656 1 1 41 VAL HA H 2.084 -5.343 7.578 1.00 . A A . 41 VAL HA 1 1 19 20657 1 1 41 VAL HB H 0.361 -7.702 6.924 1.00 . A A . 41 VAL HB 1 1 19 20658 1 1 41 VAL HG11 H 2.060 -6.975 9.304 1.00 . A A . 41 VAL HG11 1 1 19 20659 1 1 41 VAL HG12 H 2.480 -8.111 8.021 1.00 . A A . 41 VAL HG12 1 1 19 20660 1 1 41 VAL HG13 H 1.147 -8.473 9.118 1.00 . A A . 41 VAL HG13 1 1 19 20661 1 1 41 VAL HG21 H -1.018 -7.273 8.890 1.00 . A A . 41 VAL HG21 1 1 19 20662 1 1 41 VAL HG22 H -1.179 -5.964 7.719 1.00 . A A . 41 VAL HG22 1 1 19 20663 1 1 41 VAL HG23 H -0.182 -5.743 9.157 1.00 . A A . 41 VAL HG23 1 1 19 20664 1 1 41 VAL N N 0.478 -4.871 6.360 1.00 . A A . 41 VAL N 1 1 19 20665 1 1 41 VAL O O 3.143 -7.262 6.009 1.00 . A A . 41 VAL O 1 1 19 20666 1 1 42 HIS C C 3.992 -6.151 3.333 1.00 . A A . 42 HIS C 1 1 19 20667 1 1 42 HIS CA C 2.565 -6.641 3.361 1.00 . A A . 42 HIS CA 1 1 19 20668 1 1 42 HIS CB C 1.793 -6.255 2.099 1.00 . A A . 42 HIS CB 1 1 19 20669 1 1 42 HIS CD2 C 1.456 -8.696 1.288 1.00 . A A . 42 HIS CD2 1 1 19 20670 1 1 42 HIS CE1 C -0.565 -8.482 0.465 1.00 . A A . 42 HIS CE1 1 1 19 20671 1 1 42 HIS CG C 1.078 -7.408 1.467 1.00 . A A . 42 HIS CG 1 1 19 20672 1 1 42 HIS H H 1.166 -5.485 4.393 1.00 . A A . 42 HIS H 1 1 19 20673 1 1 42 HIS HA H 2.594 -7.705 3.447 1.00 . A A . 42 HIS HA 1 1 19 20674 1 1 42 HIS HB2 H 1.044 -5.515 2.364 1.00 . A A . 42 HIS HB2 1 1 19 20675 1 1 42 HIS HB3 H 2.474 -5.838 1.373 1.00 . A A . 42 HIS HB3 1 1 19 20676 1 1 42 HIS HD1 H -0.740 -6.495 0.917 1.00 . A A . 42 HIS HD1 1 1 19 20677 1 1 42 HIS HD2 H 2.399 -9.135 1.583 1.00 . A A . 42 HIS HD2 1 1 19 20678 1 1 42 HIS HE1 H -1.512 -8.703 -0.006 1.00 . A A . 42 HIS HE1 1 1 19 20679 1 1 42 HIS HE2 H 0.375 -10.302 0.474 1.00 . A A . 42 HIS HE2 1 1 19 20680 1 1 42 HIS N N 1.885 -6.121 4.526 1.00 . A A . 42 HIS N 1 1 19 20681 1 1 42 HIS ND1 N -0.193 -7.307 0.939 1.00 . A A . 42 HIS ND1 1 1 19 20682 1 1 42 HIS NE2 N 0.417 -9.341 0.664 1.00 . A A . 42 HIS NE2 1 1 19 20683 1 1 42 HIS O O 4.350 -5.243 2.593 1.00 . A A . 42 HIS O 1 1 19 20684 1 1 43 VAL C C 7.005 -6.519 3.027 1.00 . A A . 43 VAL C 1 1 19 20685 1 1 43 VAL CA C 6.208 -6.507 4.323 1.00 . A A . 43 VAL CA 1 1 19 20686 1 1 43 VAL CB C 6.855 -7.472 5.337 1.00 . A A . 43 VAL CB 1 1 19 20687 1 1 43 VAL CG1 C 6.638 -8.917 4.919 1.00 . A A . 43 VAL CG1 1 1 19 20688 1 1 43 VAL CG2 C 8.340 -7.176 5.512 1.00 . A A . 43 VAL CG2 1 1 19 20689 1 1 43 VAL H H 4.392 -7.538 4.687 1.00 . A A . 43 VAL H 1 1 19 20690 1 1 43 VAL HA H 6.271 -5.520 4.729 1.00 . A A . 43 VAL HA 1 1 19 20691 1 1 43 VAL HB H 6.370 -7.324 6.289 1.00 . A A . 43 VAL HB 1 1 19 20692 1 1 43 VAL HG11 H 7.031 -9.574 5.680 1.00 . A A . 43 VAL HG11 1 1 19 20693 1 1 43 VAL HG12 H 7.147 -9.105 3.985 1.00 . A A . 43 VAL HG12 1 1 19 20694 1 1 43 VAL HG13 H 5.581 -9.102 4.796 1.00 . A A . 43 VAL HG13 1 1 19 20695 1 1 43 VAL HG21 H 8.528 -6.864 6.530 1.00 . A A . 43 VAL HG21 1 1 19 20696 1 1 43 VAL HG22 H 8.634 -6.391 4.833 1.00 . A A . 43 VAL HG22 1 1 19 20697 1 1 43 VAL HG23 H 8.911 -8.068 5.301 1.00 . A A . 43 VAL HG23 1 1 19 20698 1 1 43 VAL N N 4.791 -6.821 4.146 1.00 . A A . 43 VAL N 1 1 19 20699 1 1 43 VAL O O 7.799 -7.421 2.769 1.00 . A A . 43 VAL O 1 1 19 20700 1 1 44 ALA C C 8.685 -4.408 1.208 1.00 . A A . 44 ALA C 1 1 19 20701 1 1 44 ALA CA C 7.481 -5.307 0.974 1.00 . A A . 44 ALA CA 1 1 19 20702 1 1 44 ALA CB C 6.565 -4.729 -0.086 1.00 . A A . 44 ALA CB 1 1 19 20703 1 1 44 ALA H H 6.076 -4.852 2.469 1.00 . A A . 44 ALA H 1 1 19 20704 1 1 44 ALA HA H 7.826 -6.268 0.643 1.00 . A A . 44 ALA HA 1 1 19 20705 1 1 44 ALA HB1 H 6.753 -5.218 -1.031 1.00 . A A . 44 ALA HB1 1 1 19 20706 1 1 44 ALA HB2 H 6.747 -3.670 -0.182 1.00 . A A . 44 ALA HB2 1 1 19 20707 1 1 44 ALA HB3 H 5.542 -4.895 0.206 1.00 . A A . 44 ALA HB3 1 1 19 20708 1 1 44 ALA N N 6.767 -5.497 2.219 1.00 . A A . 44 ALA N 1 1 19 20709 1 1 44 ALA O O 8.912 -3.439 0.483 1.00 . A A . 44 ALA O 1 1 19 20710 1 1 45 GLU C C 11.490 -3.644 1.401 1.00 . A A . 45 GLU C 1 1 19 20711 1 1 45 GLU CA C 10.645 -3.991 2.617 1.00 . A A . 45 GLU CA 1 1 19 20712 1 1 45 GLU CB C 11.480 -4.791 3.618 1.00 . A A . 45 GLU CB 1 1 19 20713 1 1 45 GLU CD C 13.600 -4.933 4.983 1.00 . A A . 45 GLU CD 1 1 19 20714 1 1 45 GLU CG C 12.782 -4.110 4.007 1.00 . A A . 45 GLU CG 1 1 19 20715 1 1 45 GLU H H 9.209 -5.543 2.753 1.00 . A A . 45 GLU H 1 1 19 20716 1 1 45 GLU HA H 10.320 -3.075 3.085 1.00 . A A . 45 GLU HA 1 1 19 20717 1 1 45 GLU HB2 H 10.898 -4.947 4.513 1.00 . A A . 45 GLU HB2 1 1 19 20718 1 1 45 GLU HB3 H 11.718 -5.751 3.182 1.00 . A A . 45 GLU HB3 1 1 19 20719 1 1 45 GLU HG2 H 13.371 -3.948 3.117 1.00 . A A . 45 GLU HG2 1 1 19 20720 1 1 45 GLU HG3 H 12.553 -3.159 4.465 1.00 . A A . 45 GLU HG3 1 1 19 20721 1 1 45 GLU N N 9.452 -4.749 2.237 1.00 . A A . 45 GLU N 1 1 19 20722 1 1 45 GLU O O 12.223 -2.656 1.401 1.00 . A A . 45 GLU O 1 1 19 20723 1 1 45 GLU OE1 O 14.425 -5.752 4.525 1.00 . A A . 45 GLU OE1 1 1 19 20724 1 1 45 GLU OE2 O 13.416 -4.761 6.206 1.00 . A A . 45 GLU OE2 1 1 19 20725 1 1 46 ASP C C 11.578 -3.034 -1.598 1.00 . A A . 46 ASP C 1 1 19 20726 1 1 46 ASP CA C 12.130 -4.243 -0.865 1.00 . A A . 46 ASP CA 1 1 19 20727 1 1 46 ASP CB C 12.058 -5.478 -1.762 1.00 . A A . 46 ASP CB 1 1 19 20728 1 1 46 ASP CG C 12.824 -5.295 -3.057 1.00 . A A . 46 ASP CG 1 1 19 20729 1 1 46 ASP H H 10.776 -5.232 0.435 1.00 . A A . 46 ASP H 1 1 19 20730 1 1 46 ASP HA H 13.162 -4.051 -0.609 1.00 . A A . 46 ASP HA 1 1 19 20731 1 1 46 ASP HB2 H 12.475 -6.322 -1.234 1.00 . A A . 46 ASP HB2 1 1 19 20732 1 1 46 ASP HB3 H 11.026 -5.681 -2.000 1.00 . A A . 46 ASP HB3 1 1 19 20733 1 1 46 ASP N N 11.382 -4.465 0.369 1.00 . A A . 46 ASP N 1 1 19 20734 1 1 46 ASP O O 12.330 -2.166 -2.034 1.00 . A A . 46 ASP O 1 1 19 20735 1 1 46 ASP OD1 O 12.223 -4.816 -4.040 1.00 . A A . 46 ASP OD1 1 1 19 20736 1 1 46 ASP OD2 O 14.028 -5.631 -3.088 1.00 . A A . 46 ASP OD2 1 1 19 20737 1 1 47 VAL C C 10.020 -0.555 -1.731 1.00 . A A . 47 VAL C 1 1 19 20738 1 1 47 VAL CA C 9.608 -1.869 -2.387 1.00 . A A . 47 VAL CA 1 1 19 20739 1 1 47 VAL CB C 8.082 -2.022 -2.340 1.00 . A A . 47 VAL CB 1 1 19 20740 1 1 47 VAL CG1 C 7.413 -0.950 -3.180 1.00 . A A . 47 VAL CG1 1 1 19 20741 1 1 47 VAL CG2 C 7.673 -3.405 -2.814 1.00 . A A . 47 VAL CG2 1 1 19 20742 1 1 47 VAL H H 9.709 -3.694 -1.336 1.00 . A A . 47 VAL H 1 1 19 20743 1 1 47 VAL HA H 9.919 -1.862 -3.417 1.00 . A A . 47 VAL HA 1 1 19 20744 1 1 47 VAL HB H 7.764 -1.912 -1.317 1.00 . A A . 47 VAL HB 1 1 19 20745 1 1 47 VAL HG11 H 7.160 -1.357 -4.148 1.00 . A A . 47 VAL HG11 1 1 19 20746 1 1 47 VAL HG12 H 8.095 -0.121 -3.308 1.00 . A A . 47 VAL HG12 1 1 19 20747 1 1 47 VAL HG13 H 6.517 -0.607 -2.685 1.00 . A A . 47 VAL HG13 1 1 19 20748 1 1 47 VAL HG21 H 8.175 -3.631 -3.744 1.00 . A A . 47 VAL HG21 1 1 19 20749 1 1 47 VAL HG22 H 6.605 -3.435 -2.963 1.00 . A A . 47 VAL HG22 1 1 19 20750 1 1 47 VAL HG23 H 7.953 -4.134 -2.069 1.00 . A A . 47 VAL HG23 1 1 19 20751 1 1 47 VAL N N 10.258 -2.978 -1.719 1.00 . A A . 47 VAL N 1 1 19 20752 1 1 47 VAL O O 10.199 0.447 -2.400 1.00 . A A . 47 VAL O 1 1 19 20753 1 1 48 ALA C C 12.092 0.747 0.307 1.00 . A A . 48 ALA C 1 1 19 20754 1 1 48 ALA CA C 10.602 0.507 0.432 1.00 . A A . 48 ALA CA 1 1 19 20755 1 1 48 ALA CB C 10.251 0.212 1.883 1.00 . A A . 48 ALA CB 1 1 19 20756 1 1 48 ALA H H 10.060 -1.465 0.002 1.00 . A A . 48 ALA H 1 1 19 20757 1 1 48 ALA HA H 10.070 1.394 0.136 1.00 . A A . 48 ALA HA 1 1 19 20758 1 1 48 ALA HB1 H 9.208 -0.050 1.954 1.00 . A A . 48 ALA HB1 1 1 19 20759 1 1 48 ALA HB2 H 10.445 1.088 2.484 1.00 . A A . 48 ALA HB2 1 1 19 20760 1 1 48 ALA HB3 H 10.855 -0.609 2.239 1.00 . A A . 48 ALA HB3 1 1 19 20761 1 1 48 ALA N N 10.194 -0.619 -0.415 1.00 . A A . 48 ALA N 1 1 19 20762 1 1 48 ALA O O 12.529 1.821 -0.108 1.00 . A A . 48 ALA O 1 1 19 20763 1 1 49 LYS C C 14.711 0.222 -0.835 1.00 . A A . 49 LYS C 1 1 19 20764 1 1 49 LYS CA C 14.321 -0.167 0.582 1.00 . A A . 49 LYS CA 1 1 19 20765 1 1 49 LYS CB C 14.979 -1.494 0.970 1.00 . A A . 49 LYS CB 1 1 19 20766 1 1 49 LYS CD C 17.105 -2.792 1.312 1.00 . A A . 49 LYS CD 1 1 19 20767 1 1 49 LYS CE C 16.612 -3.953 0.462 1.00 . A A . 49 LYS CE 1 1 19 20768 1 1 49 LYS CG C 16.495 -1.473 0.863 1.00 . A A . 49 LYS CG 1 1 19 20769 1 1 49 LYS H H 12.468 -1.095 0.998 1.00 . A A . 49 LYS H 1 1 19 20770 1 1 49 LYS HA H 14.649 0.606 1.262 1.00 . A A . 49 LYS HA 1 1 19 20771 1 1 49 LYS HB2 H 14.715 -1.729 1.990 1.00 . A A . 49 LYS HB2 1 1 19 20772 1 1 49 LYS HB3 H 14.605 -2.272 0.321 1.00 . A A . 49 LYS HB3 1 1 19 20773 1 1 49 LYS HD2 H 18.179 -2.729 1.227 1.00 . A A . 49 LYS HD2 1 1 19 20774 1 1 49 LYS HD3 H 16.833 -2.971 2.343 1.00 . A A . 49 LYS HD3 1 1 19 20775 1 1 49 LYS HE2 H 17.054 -4.866 0.832 1.00 . A A . 49 LYS HE2 1 1 19 20776 1 1 49 LYS HE3 H 15.537 -4.014 0.548 1.00 . A A . 49 LYS HE3 1 1 19 20777 1 1 49 LYS HG2 H 16.772 -1.293 -0.165 1.00 . A A . 49 LYS HG2 1 1 19 20778 1 1 49 LYS HG3 H 16.879 -0.678 1.485 1.00 . A A . 49 LYS HG3 1 1 19 20779 1 1 49 LYS HZ1 H 18.009 -3.705 -1.072 1.00 . A A . 49 LYS HZ1 1 1 19 20780 1 1 49 LYS HZ2 H 16.534 -2.925 -1.355 1.00 . A A . 49 LYS HZ2 1 1 19 20781 1 1 49 LYS HZ3 H 16.649 -4.604 -1.523 1.00 . A A . 49 LYS HZ3 1 1 19 20782 1 1 49 LYS N N 12.875 -0.264 0.671 1.00 . A A . 49 LYS N 1 1 19 20783 1 1 49 LYS NZ N 16.976 -3.785 -0.972 1.00 . A A . 49 LYS NZ 1 1 19 20784 1 1 49 LYS O O 15.731 0.866 -1.061 1.00 . A A . 49 LYS O 1 1 19 20785 1 1 50 ASP C C 13.392 1.396 -3.581 1.00 . A A . 50 ASP C 1 1 19 20786 1 1 50 ASP CA C 14.139 0.127 -3.182 1.00 . A A . 50 ASP CA 1 1 19 20787 1 1 50 ASP CB C 13.788 -1.060 -4.088 1.00 . A A . 50 ASP CB 1 1 19 20788 1 1 50 ASP CG C 12.326 -1.150 -4.497 1.00 . A A . 50 ASP CG 1 1 19 20789 1 1 50 ASP H H 13.113 -0.741 -1.554 1.00 . A A . 50 ASP H 1 1 19 20790 1 1 50 ASP HA H 15.197 0.323 -3.277 1.00 . A A . 50 ASP HA 1 1 19 20791 1 1 50 ASP HB2 H 14.381 -0.999 -4.983 1.00 . A A . 50 ASP HB2 1 1 19 20792 1 1 50 ASP HB3 H 14.040 -1.969 -3.557 1.00 . A A . 50 ASP HB3 1 1 19 20793 1 1 50 ASP N N 13.895 -0.200 -1.792 1.00 . A A . 50 ASP N 1 1 19 20794 1 1 50 ASP O O 13.763 2.065 -4.545 1.00 . A A . 50 ASP O 1 1 19 20795 1 1 50 ASP OD1 O 11.775 -0.111 -4.911 1.00 . A A . 50 ASP OD1 1 1 19 20796 1 1 50 ASP OD2 O 11.726 -2.240 -4.381 1.00 . A A . 50 ASP OD2 1 1 19 20797 1 1 51 TYR C C 12.425 4.130 -2.856 1.00 . A A . 51 TYR C 1 1 19 20798 1 1 51 TYR CA C 11.568 2.923 -3.136 1.00 . A A . 51 TYR CA 1 1 19 20799 1 1 51 TYR CB C 10.321 3.044 -2.268 1.00 . A A . 51 TYR CB 1 1 19 20800 1 1 51 TYR CD1 C 8.837 3.104 -4.313 1.00 . A A . 51 TYR CD1 1 1 19 20801 1 1 51 TYR CD2 C 7.975 2.105 -2.329 1.00 . A A . 51 TYR CD2 1 1 19 20802 1 1 51 TYR CE1 C 7.656 2.820 -4.973 1.00 . A A . 51 TYR CE1 1 1 19 20803 1 1 51 TYR CE2 C 6.790 1.821 -2.982 1.00 . A A . 51 TYR CE2 1 1 19 20804 1 1 51 TYR CG C 9.016 2.751 -2.980 1.00 . A A . 51 TYR CG 1 1 19 20805 1 1 51 TYR CZ C 6.604 2.244 -4.272 1.00 . A A . 51 TYR CZ 1 1 19 20806 1 1 51 TYR H H 12.069 1.163 -2.091 1.00 . A A . 51 TYR H 1 1 19 20807 1 1 51 TYR HA H 11.281 2.878 -4.161 1.00 . A A . 51 TYR HA 1 1 19 20808 1 1 51 TYR HB2 H 10.422 2.364 -1.461 1.00 . A A . 51 TYR HB2 1 1 19 20809 1 1 51 TYR HB3 H 10.258 4.048 -1.871 1.00 . A A . 51 TYR HB3 1 1 19 20810 1 1 51 TYR HD1 H 9.637 3.607 -4.835 1.00 . A A . 51 TYR HD1 1 1 19 20811 1 1 51 TYR HD2 H 8.096 1.822 -1.294 1.00 . A A . 51 TYR HD2 1 1 19 20812 1 1 51 TYR HE1 H 7.536 3.103 -6.009 1.00 . A A . 51 TYR HE1 1 1 19 20813 1 1 51 TYR HE2 H 5.989 1.321 -2.456 1.00 . A A . 51 TYR HE2 1 1 19 20814 1 1 51 TYR HH H 4.716 2.172 -4.416 1.00 . A A . 51 TYR HH 1 1 19 20815 1 1 51 TYR N N 12.330 1.724 -2.843 1.00 . A A . 51 TYR N 1 1 19 20816 1 1 51 TYR O O 12.814 4.881 -3.750 1.00 . A A . 51 TYR O 1 1 19 20817 1 1 51 TYR OH O 5.459 1.898 -4.960 1.00 . A A . 51 TYR OH 1 1 19 20818 1 1 52 GLU C C 14.991 5.132 -1.278 1.00 . A A . 52 GLU C 1 1 19 20819 1 1 52 GLU CA C 13.505 5.383 -1.075 1.00 . A A . 52 GLU CA 1 1 19 20820 1 1 52 GLU CB C 13.231 5.615 0.413 1.00 . A A . 52 GLU CB 1 1 19 20821 1 1 52 GLU CD C 11.527 6.004 2.231 1.00 . A A . 52 GLU CD 1 1 19 20822 1 1 52 GLU CG C 11.759 5.747 0.756 1.00 . A A . 52 GLU CG 1 1 19 20823 1 1 52 GLU H H 12.417 3.586 -0.940 1.00 . A A . 52 GLU H 1 1 19 20824 1 1 52 GLU HA H 13.206 6.250 -1.624 1.00 . A A . 52 GLU HA 1 1 19 20825 1 1 52 GLU HB2 H 13.634 4.787 0.976 1.00 . A A . 52 GLU HB2 1 1 19 20826 1 1 52 GLU HB3 H 13.731 6.522 0.719 1.00 . A A . 52 GLU HB3 1 1 19 20827 1 1 52 GLU HG2 H 11.345 6.569 0.195 1.00 . A A . 52 GLU HG2 1 1 19 20828 1 1 52 GLU HG3 H 11.253 4.833 0.480 1.00 . A A . 52 GLU HG3 1 1 19 20829 1 1 52 GLU N N 12.722 4.273 -1.570 1.00 . A A . 52 GLU N 1 1 19 20830 1 1 52 GLU O O 15.652 5.800 -2.074 1.00 . A A . 52 GLU O 1 1 19 20831 1 1 52 GLU OE1 O 11.493 5.025 3.006 1.00 . A A . 52 GLU OE1 1 1 19 20832 1 1 52 GLU OE2 O 11.379 7.185 2.612 1.00 . A A . 52 GLU OE2 1 1 19 20833 1 1 53 ASP C C 17.309 3.404 -2.027 1.00 . A A . 53 ASP C 1 1 19 20834 1 1 53 ASP CA C 16.902 3.781 -0.606 1.00 . A A . 53 ASP CA 1 1 19 20835 1 1 53 ASP CB C 17.157 2.617 0.348 1.00 . A A . 53 ASP CB 1 1 19 20836 1 1 53 ASP CG C 17.827 3.059 1.635 1.00 . A A . 53 ASP CG 1 1 19 20837 1 1 53 ASP H H 14.908 3.661 0.063 1.00 . A A . 53 ASP H 1 1 19 20838 1 1 53 ASP HA H 17.487 4.631 -0.288 1.00 . A A . 53 ASP HA 1 1 19 20839 1 1 53 ASP HB2 H 16.207 2.160 0.597 1.00 . A A . 53 ASP HB2 1 1 19 20840 1 1 53 ASP HB3 H 17.789 1.889 -0.139 1.00 . A A . 53 ASP HB3 1 1 19 20841 1 1 53 ASP N N 15.500 4.153 -0.543 1.00 . A A . 53 ASP N 1 1 19 20842 1 1 53 ASP O O 18.373 3.802 -2.502 1.00 . A A . 53 ASP O 1 1 19 20843 1 1 53 ASP OD1 O 17.133 3.636 2.497 1.00 . A A . 53 ASP OD1 1 1 19 20844 1 1 53 ASP OD2 O 19.046 2.828 1.779 1.00 . A A . 53 ASP OD2 1 1 19 20845 1 1 54 GLY C C 17.094 3.405 -4.952 1.00 . A A . 54 GLY C 1 1 19 20846 1 1 54 GLY CA C 16.758 2.228 -4.061 1.00 . A A . 54 GLY CA 1 1 19 20847 1 1 54 GLY H H 15.624 2.351 -2.276 1.00 . A A . 54 GLY H 1 1 19 20848 1 1 54 GLY HA2 H 17.599 1.551 -4.043 1.00 . A A . 54 GLY HA2 1 1 19 20849 1 1 54 GLY HA3 H 15.903 1.712 -4.469 1.00 . A A . 54 GLY HA3 1 1 19 20850 1 1 54 GLY N N 16.460 2.638 -2.702 1.00 . A A . 54 GLY N 1 1 19 20851 1 1 54 GLY O O 17.989 3.322 -5.793 1.00 . A A . 54 GLY O 1 1 19 20852 1 1 55 LEU C C 17.730 6.536 -4.936 1.00 . A A . 55 LEU C 1 1 19 20853 1 1 55 LEU CA C 16.606 5.713 -5.553 1.00 . A A . 55 LEU CA 1 1 19 20854 1 1 55 LEU CB C 15.328 6.549 -5.638 1.00 . A A . 55 LEU CB 1 1 19 20855 1 1 55 LEU CD1 C 15.876 7.662 -7.818 1.00 . A A . 55 LEU CD1 1 1 19 20856 1 1 55 LEU CD2 C 14.184 8.683 -6.285 1.00 . A A . 55 LEU CD2 1 1 19 20857 1 1 55 LEU CG C 15.477 7.886 -6.367 1.00 . A A . 55 LEU CG 1 1 19 20858 1 1 55 LEU H H 15.669 4.508 -4.086 1.00 . A A . 55 LEU H 1 1 19 20859 1 1 55 LEU HA H 16.897 5.411 -6.548 1.00 . A A . 55 LEU HA 1 1 19 20860 1 1 55 LEU HB2 H 14.573 5.966 -6.147 1.00 . A A . 55 LEU HB2 1 1 19 20861 1 1 55 LEU HB3 H 14.986 6.750 -4.634 1.00 . A A . 55 LEU HB3 1 1 19 20862 1 1 55 LEU HD11 H 15.096 7.115 -8.326 1.00 . A A . 55 LEU HD11 1 1 19 20863 1 1 55 LEU HD12 H 16.795 7.096 -7.855 1.00 . A A . 55 LEU HD12 1 1 19 20864 1 1 55 LEU HD13 H 16.021 8.616 -8.302 1.00 . A A . 55 LEU HD13 1 1 19 20865 1 1 55 LEU HD21 H 13.921 8.837 -5.250 1.00 . A A . 55 LEU HD21 1 1 19 20866 1 1 55 LEU HD22 H 13.393 8.138 -6.780 1.00 . A A . 55 LEU HD22 1 1 19 20867 1 1 55 LEU HD23 H 14.319 9.639 -6.768 1.00 . A A . 55 LEU HD23 1 1 19 20868 1 1 55 LEU HG H 16.257 8.463 -5.892 1.00 . A A . 55 LEU HG 1 1 19 20869 1 1 55 LEU N N 16.373 4.507 -4.768 1.00 . A A . 55 LEU N 1 1 19 20870 1 1 55 LEU O O 18.746 6.796 -5.579 1.00 . A A . 55 LEU O 1 1 19 20871 1 1 56 GLU C C 19.515 6.812 -2.239 1.00 . A A . 56 GLU C 1 1 19 20872 1 1 56 GLU CA C 18.543 7.726 -2.977 1.00 . A A . 56 GLU CA 1 1 19 20873 1 1 56 GLU CB C 17.877 8.685 -1.995 1.00 . A A . 56 GLU CB 1 1 19 20874 1 1 56 GLU CD C 16.293 10.624 -1.662 1.00 . A A . 56 GLU CD 1 1 19 20875 1 1 56 GLU CG C 16.944 9.685 -2.658 1.00 . A A . 56 GLU CG 1 1 19 20876 1 1 56 GLU H H 16.705 6.708 -3.228 1.00 . A A . 56 GLU H 1 1 19 20877 1 1 56 GLU HA H 19.091 8.295 -3.705 1.00 . A A . 56 GLU HA 1 1 19 20878 1 1 56 GLU HB2 H 17.307 8.110 -1.287 1.00 . A A . 56 GLU HB2 1 1 19 20879 1 1 56 GLU HB3 H 18.643 9.234 -1.468 1.00 . A A . 56 GLU HB3 1 1 19 20880 1 1 56 GLU HG2 H 17.512 10.272 -3.366 1.00 . A A . 56 GLU HG2 1 1 19 20881 1 1 56 GLU HG3 H 16.169 9.144 -3.181 1.00 . A A . 56 GLU HG3 1 1 19 20882 1 1 56 GLU N N 17.540 6.941 -3.685 1.00 . A A . 56 GLU N 1 1 19 20883 1 1 56 GLU O O 19.641 6.875 -1.016 1.00 . A A . 56 GLU O 1 1 19 20884 1 1 56 GLU OE1 O 16.882 11.688 -1.377 1.00 . A A . 56 GLU OE1 1 1 19 20885 1 1 56 GLU OE2 O 15.195 10.297 -1.168 1.00 . A A . 56 GLU OE2 1 1 19 20886 1 1 57 TYR C C 22.507 5.702 -2.199 1.00 . A A . 57 TYR C 1 1 19 20887 1 1 57 TYR CA C 21.159 5.026 -2.429 1.00 . A A . 57 TYR CA 1 1 19 20888 1 1 57 TYR CB C 21.331 3.821 -3.356 1.00 . A A . 57 TYR CB 1 1 19 20889 1 1 57 TYR CD1 C 21.966 1.776 -2.018 1.00 . A A . 57 TYR CD1 1 1 19 20890 1 1 57 TYR CD2 C 23.677 2.895 -3.243 1.00 . A A . 57 TYR CD2 1 1 19 20891 1 1 57 TYR CE1 C 22.888 0.852 -1.565 1.00 . A A . 57 TYR CE1 1 1 19 20892 1 1 57 TYR CE2 C 24.605 1.975 -2.795 1.00 . A A . 57 TYR CE2 1 1 19 20893 1 1 57 TYR CG C 22.344 2.812 -2.862 1.00 . A A . 57 TYR CG 1 1 19 20894 1 1 57 TYR CZ C 24.205 0.955 -1.956 1.00 . A A . 57 TYR CZ 1 1 19 20895 1 1 57 TYR H H 20.050 5.967 -3.966 1.00 . A A . 57 TYR H 1 1 19 20896 1 1 57 TYR HA H 20.773 4.686 -1.480 1.00 . A A . 57 TYR HA 1 1 19 20897 1 1 57 TYR HB2 H 20.383 3.315 -3.457 1.00 . A A . 57 TYR HB2 1 1 19 20898 1 1 57 TYR HB3 H 21.654 4.168 -4.327 1.00 . A A . 57 TYR HB3 1 1 19 20899 1 1 57 TYR HD1 H 20.932 1.697 -1.712 1.00 . A A . 57 TYR HD1 1 1 19 20900 1 1 57 TYR HD2 H 23.987 3.696 -3.898 1.00 . A A . 57 TYR HD2 1 1 19 20901 1 1 57 TYR HE1 H 22.574 0.053 -0.909 1.00 . A A . 57 TYR HE1 1 1 19 20902 1 1 57 TYR HE2 H 25.638 2.055 -3.101 1.00 . A A . 57 TYR HE2 1 1 19 20903 1 1 57 TYR HH H 24.765 -0.850 -1.600 1.00 . A A . 57 TYR HH 1 1 19 20904 1 1 57 TYR N N 20.197 5.962 -2.997 1.00 . A A . 57 TYR N 1 1 19 20905 1 1 57 TYR O O 22.709 6.257 -1.099 1.00 . A A . 57 TYR O 1 1 19 20906 1 1 57 TYR OXT O 23.349 5.669 -3.120 1.00 . A A . 57 TYR OXT 1 1 19 20907 1 1 57 TYR OH O 25.126 0.036 -1.509 1.00 . A A . 57 TYR OH 1 1 19 20908 2 2 1 ALA C C -10.577 -6.887 4.094 1.00 . B B . 1 ALA C 1 1 19 20909 2 2 1 ALA CA C -10.535 -6.692 5.608 1.00 . B B . 1 ALA CA 1 1 19 20910 2 2 1 ALA CB C -11.225 -5.391 5.990 1.00 . B B . 1 ALA CB 1 1 19 20911 2 2 1 ALA H1 H -8.591 -5.936 5.658 1.00 . B B . 1 ALA H1 1 1 19 20912 2 2 1 ALA H2 H -8.682 -7.610 5.890 1.00 . B B . 1 ALA H2 1 1 19 20913 2 2 1 ALA H3 H -9.125 -6.557 7.139 1.00 . B B . 1 ALA H3 1 1 19 20914 2 2 1 ALA HA H -11.069 -7.505 6.079 1.00 . B B . 1 ALA HA 1 1 19 20915 2 2 1 ALA HB1 H -10.709 -4.562 5.527 1.00 . B B . 1 ALA HB1 1 1 19 20916 2 2 1 ALA HB2 H -11.205 -5.275 7.063 1.00 . B B . 1 ALA HB2 1 1 19 20917 2 2 1 ALA HB3 H -12.249 -5.414 5.648 1.00 . B B . 1 ALA HB3 1 1 19 20918 2 2 1 ALA N N -9.136 -6.699 6.109 1.00 . B B . 1 ALA N 1 1 19 20919 2 2 1 ALA O O -10.889 -5.959 3.349 1.00 . B B . 1 ALA O 1 1 19 20920 2 2 2 PRO C C -11.480 -7.864 1.470 1.00 . B B . 2 PRO C 1 1 19 20921 2 2 2 PRO CA C -10.264 -8.433 2.198 1.00 . B B . 2 PRO CA 1 1 19 20922 2 2 2 PRO CB C -10.285 -9.971 2.166 1.00 . B B . 2 PRO CB 1 1 19 20923 2 2 2 PRO CD C -9.866 -9.262 4.432 1.00 . B B . 2 PRO CD 1 1 19 20924 2 2 2 PRO CG C -10.318 -10.424 3.595 1.00 . B B . 2 PRO CG 1 1 19 20925 2 2 2 PRO HA H -9.365 -8.078 1.715 1.00 . B B . 2 PRO HA 1 1 19 20926 2 2 2 PRO HB2 H -11.160 -10.306 1.631 1.00 . B B . 2 PRO HB2 1 1 19 20927 2 2 2 PRO HB3 H -9.398 -10.329 1.665 1.00 . B B . 2 PRO HB3 1 1 19 20928 2 2 2 PRO HD2 H -10.375 -9.259 5.385 1.00 . B B . 2 PRO HD2 1 1 19 20929 2 2 2 PRO HD3 H -8.795 -9.289 4.573 1.00 . B B . 2 PRO HD3 1 1 19 20930 2 2 2 PRO HG2 H -11.324 -10.708 3.865 1.00 . B B . 2 PRO HG2 1 1 19 20931 2 2 2 PRO HG3 H -9.648 -11.260 3.727 1.00 . B B . 2 PRO HG3 1 1 19 20932 2 2 2 PRO N N -10.259 -8.106 3.622 1.00 . B B . 2 PRO N 1 1 19 20933 2 2 2 PRO O O -11.334 -7.103 0.515 1.00 . B B . 2 PRO O 1 1 19 20934 2 2 3 PRO C C -14.081 -6.227 1.394 1.00 . B B . 3 PRO C 1 1 19 20935 2 2 3 PRO CA C -13.934 -7.740 1.278 1.00 . B B . 3 PRO CA 1 1 19 20936 2 2 3 PRO CB C -15.049 -8.447 2.058 1.00 . B B . 3 PRO CB 1 1 19 20937 2 2 3 PRO CD C -12.978 -9.136 3.031 1.00 . B B . 3 PRO CD 1 1 19 20938 2 2 3 PRO CG C -14.421 -8.860 3.345 1.00 . B B . 3 PRO CG 1 1 19 20939 2 2 3 PRO HA H -13.985 -8.024 0.237 1.00 . B B . 3 PRO HA 1 1 19 20940 2 2 3 PRO HB2 H -15.867 -7.761 2.222 1.00 . B B . 3 PRO HB2 1 1 19 20941 2 2 3 PRO HB3 H -15.396 -9.302 1.498 1.00 . B B . 3 PRO HB3 1 1 19 20942 2 2 3 PRO HD2 H -12.359 -8.901 3.883 1.00 . B B . 3 PRO HD2 1 1 19 20943 2 2 3 PRO HD3 H -12.845 -10.166 2.737 1.00 . B B . 3 PRO HD3 1 1 19 20944 2 2 3 PRO HG2 H -14.502 -8.061 4.066 1.00 . B B . 3 PRO HG2 1 1 19 20945 2 2 3 PRO HG3 H -14.899 -9.753 3.717 1.00 . B B . 3 PRO HG3 1 1 19 20946 2 2 3 PRO N N -12.701 -8.227 1.905 1.00 . B B . 3 PRO N 1 1 19 20947 2 2 3 PRO O O -14.611 -5.717 2.382 1.00 . B B . 3 PRO O 1 1 19 20948 2 2 4 GLY C C -12.373 -3.409 0.023 1.00 . B B . 4 GLY C 1 1 19 20949 2 2 4 GLY CA C -13.690 -4.066 0.385 1.00 . B B . 4 GLY CA 1 1 19 20950 2 2 4 GLY H H -13.198 -5.976 -0.384 1.00 . B B . 4 GLY H 1 1 19 20951 2 2 4 GLY HA2 H -14.442 -3.755 -0.327 1.00 . B B . 4 GLY HA2 1 1 19 20952 2 2 4 GLY HA3 H -13.985 -3.737 1.371 1.00 . B B . 4 GLY HA3 1 1 19 20953 2 2 4 GLY N N -13.607 -5.514 0.378 1.00 . B B . 4 GLY N 1 1 19 20954 2 2 4 GLY O O -12.343 -2.439 -0.731 1.00 . B B . 4 GLY O 1 1 19 20955 2 2 5 THR C C -9.325 -4.046 -0.943 1.00 . B B . 5 THR C 1 1 19 20956 2 2 5 THR CA C -9.947 -3.415 0.300 1.00 . B B . 5 THR CA 1 1 19 20957 2 2 5 THR CB C -9.016 -3.670 1.499 1.00 . B B . 5 THR CB 1 1 19 20958 2 2 5 THR CG2 C -7.542 -6.010 0.747 1.00 . B B . 5 THR CG2 1 1 19 20959 2 2 5 THR H H -11.377 -4.713 1.160 1.00 . B B . 5 THR H 1 1 19 20960 2 2 5 THR HA H -10.030 -2.349 0.154 1.00 . B B . 5 THR HA 1 1 19 20961 2 2 5 THR HB H -8.118 -3.085 1.372 1.00 . B B . 5 THR HB 1 1 19 20962 2 2 5 THR HG1 H -8.947 -3.655 1.810 1.00 . B B . 5 THR HG1 1 1 19 20963 2 2 5 THR HG21 H -6.508 -5.970 0.440 1.00 . B B . 5 THR HG21 1 1 19 20964 2 2 5 THR HG22 H -8.167 -5.604 -0.034 1.00 . B B . 5 THR HG22 1 1 19 20965 2 2 5 THR HG23 H -7.822 -7.036 0.935 1.00 . B B . 5 THR HG23 1 1 19 20966 2 2 5 THR N N -11.281 -3.948 0.558 1.00 . B B . 5 THR N 1 1 19 20967 2 2 5 THR O O -9.876 -4.986 -1.515 1.00 . B B . 5 THR O 1 1 19 20968 2 2 5 THR OG1 O -9.027 -4.590 2.014 1.00 . B B . 5 THR OG1 1 1 19 20969 2 2 6 ALA C C -5.964 -4.033 -2.344 1.00 . B B . 6 ALA C 1 1 19 20970 2 2 6 ALA CA C -7.482 -4.027 -2.536 1.00 . B B . 6 ALA CA 1 1 19 20971 2 2 6 ALA CB C -7.856 -3.204 -3.760 1.00 . B B . 6 ALA CB 1 1 19 20972 2 2 6 ALA H H -7.790 -2.766 -0.865 1.00 . B B . 6 ALA H 1 1 19 20973 2 2 6 ALA HA H -7.815 -5.042 -2.702 1.00 . B B . 6 ALA HA 1 1 19 20974 2 2 6 ALA HB1 H -8.929 -3.212 -3.885 1.00 . B B . 6 ALA HB1 1 1 19 20975 2 2 6 ALA HB2 H -7.388 -3.628 -4.636 1.00 . B B . 6 ALA HB2 1 1 19 20976 2 2 6 ALA HB3 H -7.518 -2.188 -3.628 1.00 . B B . 6 ALA HB3 1 1 19 20977 2 2 6 ALA N N -8.176 -3.517 -1.359 1.00 . B B . 6 ALA N 1 1 19 20978 2 2 6 ALA O O -5.230 -3.430 -3.126 1.00 . B B . 6 ALA O 1 1 19 20979 2 2 7 ARG C C -3.295 -5.204 -2.268 1.00 . B B . 7 ARG C 1 1 19 20980 2 2 7 ARG CA C -4.069 -4.816 -1.014 1.00 . B B . 7 ARG CA 1 1 19 20981 2 2 7 ARG CB C -3.831 -5.857 0.081 1.00 . B B . 7 ARG CB 1 1 19 20982 2 2 7 ARG CD C -4.183 -8.217 0.876 1.00 . B B . 7 ARG CD 1 1 19 20983 2 2 7 ARG CG C -4.368 -7.234 -0.269 1.00 . B B . 7 ARG CG 1 1 19 20984 2 2 7 ARG CZ C -4.632 -10.585 1.363 1.00 . B B . 7 ARG CZ 1 1 19 20985 2 2 7 ARG H H -6.137 -5.174 -0.710 1.00 . B B . 7 ARG H 1 1 19 20986 2 2 7 ARG HA H -3.724 -3.858 -0.669 1.00 . B B . 7 ARG HA 1 1 19 20987 2 2 7 ARG HB2 H -2.770 -5.940 0.259 1.00 . B B . 7 ARG HB2 1 1 19 20988 2 2 7 ARG HB3 H -4.315 -5.525 0.988 1.00 . B B . 7 ARG HB3 1 1 19 20989 2 2 7 ARG HD2 H -3.131 -8.284 1.110 1.00 . B B . 7 ARG HD2 1 1 19 20990 2 2 7 ARG HD3 H -4.721 -7.851 1.738 1.00 . B B . 7 ARG HD3 1 1 19 20991 2 2 7 ARG HE H -5.067 -9.671 -0.356 1.00 . B B . 7 ARG HE 1 1 19 20992 2 2 7 ARG HG2 H -5.421 -7.153 -0.491 1.00 . B B . 7 ARG HG2 1 1 19 20993 2 2 7 ARG HG3 H -3.842 -7.604 -1.138 1.00 . B B . 7 ARG HG3 1 1 19 20994 2 2 7 ARG HH11 H -3.754 -9.560 2.868 1.00 . B B . 7 ARG HH11 1 1 19 20995 2 2 7 ARG HH12 H -4.079 -11.230 3.196 1.00 . B B . 7 ARG HH12 1 1 19 20996 2 2 7 ARG HH21 H -5.498 -11.867 0.065 1.00 . B B . 7 ARG HH21 1 1 19 20997 2 2 7 ARG HH22 H -5.069 -12.543 1.600 1.00 . B B . 7 ARG HH22 1 1 19 20998 2 2 7 ARG N N -5.501 -4.719 -1.301 1.00 . B B . 7 ARG N 1 1 19 20999 2 2 7 ARG NE N -4.679 -9.546 0.536 1.00 . B B . 7 ARG NE 1 1 19 21000 2 2 7 ARG NH1 N -4.112 -10.446 2.575 1.00 . B B . 7 ARG NH1 1 1 19 21001 2 2 7 ARG NH2 N -5.105 -11.761 0.978 1.00 . B B . 7 ARG NH2 1 1 19 21002 2 2 7 ARG O O -3.643 -6.177 -2.937 1.00 . B B . 7 ARG O 1 1 19 21003 2 2 8 ARG C C -1.041 -6.228 -3.764 1.00 . B B . 8 ARG C 1 1 19 21004 2 2 8 ARG CA C -1.442 -4.756 -3.776 1.00 . B B . 8 ARG CA 1 1 19 21005 2 2 8 ARG CB C -0.203 -3.864 -3.824 1.00 . B B . 8 ARG CB 1 1 19 21006 2 2 8 ARG CD C -0.316 -3.624 -6.323 1.00 . B B . 8 ARG CD 1 1 19 21007 2 2 8 ARG CG C 0.569 -3.950 -5.130 1.00 . B B . 8 ARG CG 1 1 19 21008 2 2 8 ARG CZ C -0.145 -3.510 -8.774 1.00 . B B . 8 ARG CZ 1 1 19 21009 2 2 8 ARG H H -1.992 -3.679 -2.038 1.00 . B B . 8 ARG H 1 1 19 21010 2 2 8 ARG HA H -2.050 -4.565 -4.648 1.00 . B B . 8 ARG HA 1 1 19 21011 2 2 8 ARG HB2 H -0.504 -2.838 -3.675 1.00 . B B . 8 ARG HB2 1 1 19 21012 2 2 8 ARG HB3 H 0.455 -4.155 -3.025 1.00 . B B . 8 ARG HB3 1 1 19 21013 2 2 8 ARG HD2 H -1.135 -4.327 -6.351 1.00 . B B . 8 ARG HD2 1 1 19 21014 2 2 8 ARG HD3 H -0.705 -2.623 -6.202 1.00 . B B . 8 ARG HD3 1 1 19 21015 2 2 8 ARG HE H 1.374 -3.904 -7.541 1.00 . B B . 8 ARG HE 1 1 19 21016 2 2 8 ARG HG2 H 1.387 -3.246 -5.099 1.00 . B B . 8 ARG HG2 1 1 19 21017 2 2 8 ARG HG3 H 0.958 -4.950 -5.243 1.00 . B B . 8 ARG HG3 1 1 19 21018 2 2 8 ARG HH11 H -1.991 -3.151 -8.031 1.00 . B B . 8 ARG HH11 1 1 19 21019 2 2 8 ARG HH12 H -1.858 -3.082 -9.757 1.00 . B B . 8 ARG HH12 1 1 19 21020 2 2 8 ARG HH21 H 1.560 -3.818 -9.815 1.00 . B B . 8 ARG HH21 1 1 19 21021 2 2 8 ARG HH22 H 0.160 -3.462 -10.771 1.00 . B B . 8 ARG HH22 1 1 19 21022 2 2 8 ARG N N -2.240 -4.449 -2.596 1.00 . B B . 8 ARG N 1 1 19 21023 2 2 8 ARG NE N 0.417 -3.699 -7.584 1.00 . B B . 8 ARG NE 1 1 19 21024 2 2 8 ARG NH1 N -1.437 -3.225 -8.862 1.00 . B B . 8 ARG NH1 1 1 19 21025 2 2 8 ARG NH2 N 0.585 -3.604 -9.877 1.00 . B B . 8 ARG NH2 1 1 19 21026 2 2 8 ARG O O -1.144 -6.896 -2.736 1.00 . B B . 8 ARG O 1 1 19 21027 2 2 9 LYS C C 1.115 -8.347 -5.745 1.00 . B B . 9 LYS C 1 1 19 21028 2 2 9 LYS CA C -0.201 -8.141 -4.994 1.00 . B B . 9 LYS CA 1 1 19 21029 2 2 9 LYS CB C -1.315 -8.967 -5.651 1.00 . B B . 9 LYS CB 1 1 19 21030 2 2 9 LYS CD C -0.203 -4.238 -12.129 1.00 . B B . 9 LYS CD 1 1 19 21031 2 2 9 LYS CE C 0.622 -5.383 -11.562 1.00 . B B . 9 LYS CE 1 1 19 21032 2 2 9 LYS CG C -1.506 -8.715 -7.142 1.00 . B B . 9 LYS CG 1 1 19 21033 2 2 9 LYS H H -0.497 -6.142 -5.676 1.00 . B B . 9 LYS H 1 1 19 21034 2 2 9 LYS HA H -0.071 -8.501 -3.985 1.00 . B B . 9 LYS HA 1 1 19 21035 2 2 9 LYS HB2 H -1.091 -10.014 -5.516 1.00 . B B . 9 LYS HB2 1 1 19 21036 2 2 9 LYS HB3 H -2.247 -8.744 -5.151 1.00 . B B . 9 LYS HB3 1 1 19 21037 2 2 9 LYS HD2 H -0.220 -4.318 -13.205 1.00 . B B . 9 LYS HD2 1 1 19 21038 2 2 9 LYS HD3 H 0.252 -3.301 -11.843 1.00 . B B . 9 LYS HD3 1 1 19 21039 2 2 9 LYS HE2 H 1.640 -5.281 -11.907 1.00 . B B . 9 LYS HE2 1 1 19 21040 2 2 9 LYS HE3 H 0.601 -5.325 -10.484 1.00 . B B . 9 LYS HE3 1 1 19 21041 2 2 9 LYS HG2 H -0.553 -8.480 -7.591 1.00 . B B . 9 LYS HG2 1 1 19 21042 2 2 9 LYS HG3 H -2.186 -7.887 -7.278 1.00 . B B . 9 LYS HG3 1 1 19 21043 2 2 9 LYS HZ1 H -0.496 -8.626 -9.613 1.00 . B B . 9 LYS HZ1 1 1 19 21044 2 2 9 LYS HZ2 H -1.112 -9.324 -11.027 1.00 . B B . 9 LYS HZ2 1 1 19 21045 2 2 9 LYS HZ3 H -0.336 -10.291 -9.876 1.00 . B B . 9 LYS HZ3 1 1 19 21046 2 2 9 LYS N N -0.586 -6.730 -4.901 1.00 . B B . 9 LYS N 1 1 19 21047 2 2 9 LYS NZ N -0.961 -9.470 -10.008 1.00 . B B . 9 LYS NZ 1 1 19 21048 2 2 9 LYS O O 1.217 -9.227 -6.600 1.00 . B B . 9 LYS O 1 1 19 21049 2 2 10 ARG C C 4.383 -8.463 -5.155 1.00 . B B . 10 ARG C 1 1 19 21050 2 2 10 ARG CA C 3.432 -7.685 -6.059 1.00 . B B . 10 ARG CA 1 1 19 21051 2 2 10 ARG CB C 4.018 -6.307 -6.392 1.00 . B B . 10 ARG CB 1 1 19 21052 2 2 10 ARG CD C 5.175 -4.223 -5.592 1.00 . B B . 10 ARG CD 1 1 19 21053 2 2 10 ARG CG C 4.613 -5.579 -5.195 1.00 . B B . 10 ARG CG 1 1 19 21054 2 2 10 ARG CZ C 4.385 -2.107 -6.567 1.00 . B B . 10 ARG CZ 1 1 19 21055 2 2 10 ARG H H 2.000 -6.862 -4.733 1.00 . B B . 10 ARG H 1 1 19 21056 2 2 10 ARG HA H 3.292 -8.240 -6.975 1.00 . B B . 10 ARG HA 1 1 19 21057 2 2 10 ARG HB2 H 4.797 -6.432 -7.130 1.00 . B B . 10 ARG HB2 1 1 19 21058 2 2 10 ARG HB3 H 3.236 -5.690 -6.809 1.00 . B B . 10 ARG HB3 1 1 19 21059 2 2 10 ARG HD2 H 5.661 -3.783 -4.733 1.00 . B B . 10 ARG HD2 1 1 19 21060 2 2 10 ARG HD3 H 5.901 -4.365 -6.380 1.00 . B B . 10 ARG HD3 1 1 19 21061 2 2 10 ARG HE H 3.205 -3.613 -6.001 1.00 . B B . 10 ARG HE 1 1 19 21062 2 2 10 ARG HG2 H 3.841 -5.435 -4.456 1.00 . B B . 10 ARG HG2 1 1 19 21063 2 2 10 ARG HG3 H 5.408 -6.182 -4.778 1.00 . B B . 10 ARG HG3 1 1 19 21064 2 2 10 ARG HH11 H 6.391 -2.259 -6.373 1.00 . B B . 10 ARG HH11 1 1 19 21065 2 2 10 ARG HH12 H 5.821 -0.770 -7.050 1.00 . B B . 10 ARG HH12 1 1 19 21066 2 2 10 ARG HH21 H 2.442 -1.655 -6.891 1.00 . B B . 10 ARG HH21 1 1 19 21067 2 2 10 ARG HH22 H 3.576 -0.427 -7.344 1.00 . B B . 10 ARG HH22 1 1 19 21068 2 2 10 ARG N N 2.129 -7.550 -5.417 1.00 . B B . 10 ARG N 1 1 19 21069 2 2 10 ARG NE N 4.135 -3.313 -6.065 1.00 . B B . 10 ARG NE 1 1 19 21070 2 2 10 ARG NH1 N 5.634 -1.676 -6.672 1.00 . B B . 10 ARG NH1 1 1 19 21071 2 2 10 ARG NH2 N 3.386 -1.332 -6.967 1.00 . B B . 10 ARG NH2 1 1 19 21072 2 2 10 ARG O O 5.200 -9.254 -5.623 1.00 . B B . 10 ARG O 1 1 19 21073 2 2 11 LYS C C 6.571 -8.818 -3.247 1.00 . B B . 11 LYS C 1 1 19 21074 2 2 11 LYS CA C 5.101 -8.900 -2.865 1.00 . B B . 11 LYS CA 1 1 19 21075 2 2 11 LYS CB C 4.695 -10.367 -2.724 1.00 . B B . 11 LYS CB 1 1 19 21076 2 2 11 LYS CD C 3.074 -10.329 -0.802 1.00 . B B . 11 LYS CD 1 1 19 21077 2 2 11 LYS CE C 3.843 -11.342 0.029 1.00 . B B . 11 LYS CE 1 1 19 21078 2 2 11 LYS CG C 3.253 -10.573 -2.292 1.00 . B B . 11 LYS CG 1 1 19 21079 2 2 11 LYS H H 3.599 -7.575 -3.546 1.00 . B B . 11 LYS H 1 1 19 21080 2 2 11 LYS HA H 4.959 -8.405 -1.916 1.00 . B B . 11 LYS HA 1 1 19 21081 2 2 11 LYS HB2 H 4.838 -10.860 -3.674 1.00 . B B . 11 LYS HB2 1 1 19 21082 2 2 11 LYS HB3 H 5.336 -10.830 -1.990 1.00 . B B . 11 LYS HB3 1 1 19 21083 2 2 11 LYS HD2 H 3.432 -9.340 -0.562 1.00 . B B . 11 LYS HD2 1 1 19 21084 2 2 11 LYS HD3 H 2.024 -10.403 -0.561 1.00 . B B . 11 LYS HD3 1 1 19 21085 2 2 11 LYS HE2 H 4.900 -11.204 -0.142 1.00 . B B . 11 LYS HE2 1 1 19 21086 2 2 11 LYS HE3 H 3.625 -11.172 1.073 1.00 . B B . 11 LYS HE3 1 1 19 21087 2 2 11 LYS HG2 H 2.623 -9.887 -2.838 1.00 . B B . 11 LYS HG2 1 1 19 21088 2 2 11 LYS HG3 H 2.962 -11.588 -2.519 1.00 . B B . 11 LYS HG3 1 1 19 21089 2 2 11 LYS HZ1 H 3.710 -12.937 -1.314 1.00 . B B . 11 LYS HZ1 1 1 19 21090 2 2 11 LYS HZ2 H 2.457 -12.892 -0.177 1.00 . B B . 11 LYS HZ2 1 1 19 21091 2 2 11 LYS HZ3 H 4.000 -13.410 0.283 1.00 . B B . 11 LYS HZ3 1 1 19 21092 2 2 11 LYS N N 4.263 -8.226 -3.851 1.00 . B B . 11 LYS N 1 1 19 21093 2 2 11 LYS NZ N 3.476 -12.744 -0.320 1.00 . B B . 11 LYS NZ 1 1 19 21094 2 2 11 LYS O O 7.110 -9.730 -3.874 1.00 . B B . 11 LYS O 1 1 19 21095 2 2 12 ALA C C 9.492 -8.138 -2.064 1.00 . B B . 12 ALA C 1 1 19 21096 2 2 12 ALA CA C 8.628 -7.538 -3.167 1.00 . B B . 12 ALA CA 1 1 19 21097 2 2 12 ALA CB C 8.945 -6.064 -3.346 1.00 . B B . 12 ALA CB 1 1 19 21098 2 2 12 ALA H H 6.735 -7.025 -2.378 1.00 . B B . 12 ALA H 1 1 19 21099 2 2 12 ALA HA H 8.838 -8.044 -4.098 1.00 . B B . 12 ALA HA 1 1 19 21100 2 2 12 ALA HB1 H 8.112 -5.572 -3.825 1.00 . B B . 12 ALA HB1 1 1 19 21101 2 2 12 ALA HB2 H 9.827 -5.958 -3.959 1.00 . B B . 12 ALA HB2 1 1 19 21102 2 2 12 ALA HB3 H 9.123 -5.617 -2.381 1.00 . B B . 12 ALA HB3 1 1 19 21103 2 2 12 ALA N N 7.217 -7.724 -2.868 1.00 . B B . 12 ALA N 1 1 19 21104 2 2 12 ALA O O 10.626 -8.554 -2.302 1.00 . B B . 12 ALA O 1 1 19 21105 2 2 13 ASP C C 8.737 -9.630 1.118 1.00 . B B . 13 ASP C 1 1 19 21106 2 2 13 ASP CA C 9.651 -8.728 0.296 1.00 . B B . 13 ASP CA 1 1 19 21107 2 2 13 ASP CB C 10.206 -7.598 1.172 1.00 . B B . 13 ASP CB 1 1 19 21108 2 2 13 ASP CG C 10.811 -8.105 2.468 1.00 . B B . 13 ASP CG 1 1 19 21109 2 2 13 ASP H H 8.035 -7.828 -0.730 1.00 . B B . 13 ASP H 1 1 19 21110 2 2 13 ASP HA H 10.476 -9.317 -0.076 1.00 . B B . 13 ASP HA 1 1 19 21111 2 2 13 ASP HB2 H 10.974 -7.081 0.623 1.00 . B B . 13 ASP HB2 1 1 19 21112 2 2 13 ASP HB3 H 9.409 -6.903 1.412 1.00 . B B . 13 ASP HB3 1 1 19 21113 2 2 13 ASP N N 8.942 -8.178 -0.852 1.00 . B B . 13 ASP N 1 1 19 21114 2 2 13 ASP O O 7.512 -9.541 1.027 1.00 . B B . 13 ASP O 1 1 19 21115 2 2 13 ASP OD1 O 10.057 -8.271 3.450 1.00 . B B . 13 ASP OD1 1 1 19 21116 2 2 13 ASP OD2 O 12.038 -8.335 2.500 1.00 . B B . 13 ASP OD2 1 1 19 21117 2 2 14 SER C C 9.504 -12.143 3.738 1.00 . B B . 14 SER C 1 1 19 21118 2 2 14 SER CA C 8.585 -11.418 2.761 1.00 . B B . 14 SER CA 1 1 19 21119 2 2 14 SER CB C 7.837 -12.434 1.896 1.00 . B B . 14 SER CB 1 1 19 21120 2 2 14 SER H H 10.321 -10.521 1.949 1.00 . B B . 14 SER H 1 1 19 21121 2 2 14 SER HA H 7.868 -10.837 3.320 1.00 . B B . 14 SER HA 1 1 19 21122 2 2 14 SER HB2 H 7.139 -11.914 1.256 1.00 . B B . 14 SER HB2 1 1 19 21123 2 2 14 SER HB3 H 8.545 -12.979 1.290 1.00 . B B . 14 SER HB3 1 1 19 21124 2 2 14 SER HG H 7.695 -14.081 2.946 1.00 . B B . 14 SER HG 1 1 19 21125 2 2 14 SER N N 9.342 -10.499 1.921 1.00 . B B . 14 SER N 1 1 19 21126 2 2 14 SER O O 9.981 -13.245 3.395 1.00 . B B . 14 SER O 1 1 19 21127 2 2 14 SER OXT O 9.741 -11.602 4.839 1.00 . B B . 14 SER OXT 1 1 19 21128 2 2 14 SER OG O 7.118 -13.355 2.698 1.00 . B B . 14 SER OG 1 1 20 21129 1 1 1 GLY C C 13.882 7.111 -2.342 1.00 . A A . 1 GLY C 1 1 20 21130 1 1 1 GLY CA C 13.622 7.944 -3.582 1.00 . A A . 1 GLY CA 1 1 20 21131 1 1 1 GLY H1 H 11.583 7.498 -3.671 1.00 . A A . 1 GLY H1 1 1 20 21132 1 1 1 GLY H2 H 12.039 8.812 -4.633 1.00 . A A . 1 GLY H2 1 1 20 21133 1 1 1 GLY H3 H 11.927 8.993 -2.956 1.00 . A A . 1 GLY H3 1 1 20 21134 1 1 1 GLY HA2 H 13.910 7.372 -4.452 1.00 . A A . 1 GLY HA2 1 1 20 21135 1 1 1 GLY HA3 H 14.227 8.838 -3.536 1.00 . A A . 1 GLY HA3 1 1 20 21136 1 1 1 GLY N N 12.193 8.340 -3.719 1.00 . A A . 1 GLY N 1 1 20 21137 1 1 1 GLY O O 14.905 6.434 -2.247 1.00 . A A . 1 GLY O 1 1 20 21138 1 1 2 SER C C 11.729 6.095 0.444 1.00 . A A . 2 SER C 1 1 20 21139 1 1 2 SER CA C 13.097 6.405 -0.150 1.00 . A A . 2 SER CA 1 1 20 21140 1 1 2 SER CB C 13.940 7.191 0.853 1.00 . A A . 2 SER CB 1 1 20 21141 1 1 2 SER H H 12.165 7.724 -1.514 1.00 . A A . 2 SER H 1 1 20 21142 1 1 2 SER HA H 13.596 5.476 -0.383 1.00 . A A . 2 SER HA 1 1 20 21143 1 1 2 SER HB2 H 13.973 6.657 1.789 1.00 . A A . 2 SER HB2 1 1 20 21144 1 1 2 SER HB3 H 14.942 7.304 0.467 1.00 . A A . 2 SER HB3 1 1 20 21145 1 1 2 SER HG H 13.317 8.948 0.248 1.00 . A A . 2 SER HG 1 1 20 21146 1 1 2 SER N N 12.958 7.162 -1.387 1.00 . A A . 2 SER N 1 1 20 21147 1 1 2 SER O O 11.384 4.934 0.668 1.00 . A A . 2 SER O 1 1 20 21148 1 1 2 SER OG O 13.391 8.478 1.083 1.00 . A A . 2 SER OG 1 1 20 21149 1 1 3 GLN C C 8.572 7.099 0.153 1.00 . A A . 3 GLN C 1 1 20 21150 1 1 3 GLN CA C 9.616 6.989 1.256 1.00 . A A . 3 GLN CA 1 1 20 21151 1 1 3 GLN CB C 9.361 8.040 2.329 1.00 . A A . 3 GLN CB 1 1 20 21152 1 1 3 GLN CD C 11.488 7.526 3.598 1.00 . A A . 3 GLN CD 1 1 20 21153 1 1 3 GLN CG C 9.984 7.708 3.676 1.00 . A A . 3 GLN CG 1 1 20 21154 1 1 3 GLN H H 11.289 8.042 0.498 1.00 . A A . 3 GLN H 1 1 20 21155 1 1 3 GLN HA H 9.554 6.016 1.702 1.00 . A A . 3 GLN HA 1 1 20 21156 1 1 3 GLN HB2 H 9.767 8.973 1.992 1.00 . A A . 3 GLN HB2 1 1 20 21157 1 1 3 GLN HB3 H 8.295 8.148 2.466 1.00 . A A . 3 GLN HB3 1 1 20 21158 1 1 3 GLN HE21 H 11.262 5.581 3.256 1.00 . A A . 3 GLN HE21 1 1 20 21159 1 1 3 GLN HE22 H 12.892 6.147 3.317 1.00 . A A . 3 GLN HE22 1 1 20 21160 1 1 3 GLN HG2 H 9.771 8.511 4.365 1.00 . A A . 3 GLN HG2 1 1 20 21161 1 1 3 GLN HG3 H 9.545 6.793 4.045 1.00 . A A . 3 GLN HG3 1 1 20 21162 1 1 3 GLN N N 10.954 7.143 0.698 1.00 . A A . 3 GLN N 1 1 20 21163 1 1 3 GLN NE2 N 11.924 6.293 3.365 1.00 . A A . 3 GLN NE2 1 1 20 21164 1 1 3 GLN O O 8.463 8.130 -0.509 1.00 . A A . 3 GLN O 1 1 20 21165 1 1 3 GLN OE1 O 12.249 8.483 3.748 1.00 . A A . 3 GLN OE1 1 1 20 21166 1 1 4 VAL C C 5.562 5.205 -0.680 1.00 . A A . 4 VAL C 1 1 20 21167 1 1 4 VAL CA C 6.785 6.020 -1.084 1.00 . A A . 4 VAL CA 1 1 20 21168 1 1 4 VAL CB C 7.357 5.452 -2.399 1.00 . A A . 4 VAL CB 1 1 20 21169 1 1 4 VAL CG1 C 6.295 5.431 -3.488 1.00 . A A . 4 VAL CG1 1 1 20 21170 1 1 4 VAL CG2 C 8.569 6.256 -2.843 1.00 . A A . 4 VAL CG2 1 1 20 21171 1 1 4 VAL H H 7.921 5.243 0.525 1.00 . A A . 4 VAL H 1 1 20 21172 1 1 4 VAL HA H 6.479 7.037 -1.262 1.00 . A A . 4 VAL HA 1 1 20 21173 1 1 4 VAL HB H 7.674 4.434 -2.218 1.00 . A A . 4 VAL HB 1 1 20 21174 1 1 4 VAL HG11 H 6.727 5.058 -4.405 1.00 . A A . 4 VAL HG11 1 1 20 21175 1 1 4 VAL HG12 H 5.920 6.432 -3.647 1.00 . A A . 4 VAL HG12 1 1 20 21176 1 1 4 VAL HG13 H 5.482 4.786 -3.186 1.00 . A A . 4 VAL HG13 1 1 20 21177 1 1 4 VAL HG21 H 8.958 5.842 -3.761 1.00 . A A . 4 VAL HG21 1 1 20 21178 1 1 4 VAL HG22 H 9.330 6.212 -2.078 1.00 . A A . 4 VAL HG22 1 1 20 21179 1 1 4 VAL HG23 H 8.280 7.283 -3.005 1.00 . A A . 4 VAL HG23 1 1 20 21180 1 1 4 VAL N N 7.802 6.033 -0.042 1.00 . A A . 4 VAL N 1 1 20 21181 1 1 4 VAL O O 4.436 5.701 -0.711 1.00 . A A . 4 VAL O 1 1 20 21182 1 1 5 PHE C C 3.781 2.852 -1.131 1.00 . A A . 5 PHE C 1 1 20 21183 1 1 5 PHE CA C 4.689 3.070 0.080 1.00 . A A . 5 PHE CA 1 1 20 21184 1 1 5 PHE CB C 3.891 3.648 1.262 1.00 . A A . 5 PHE CB 1 1 20 21185 1 1 5 PHE CD1 C 5.813 4.285 2.747 1.00 . A A . 5 PHE CD1 1 1 20 21186 1 1 5 PHE CD2 C 4.196 5.953 2.211 1.00 . A A . 5 PHE CD2 1 1 20 21187 1 1 5 PHE CE1 C 6.510 5.202 3.511 1.00 . A A . 5 PHE CE1 1 1 20 21188 1 1 5 PHE CE2 C 4.890 6.875 2.973 1.00 . A A . 5 PHE CE2 1 1 20 21189 1 1 5 PHE CG C 4.649 4.649 2.091 1.00 . A A . 5 PHE CG 1 1 20 21190 1 1 5 PHE CZ C 6.048 6.499 3.623 1.00 . A A . 5 PHE CZ 1 1 20 21191 1 1 5 PHE H H 6.706 3.620 -0.280 1.00 . A A . 5 PHE H 1 1 20 21192 1 1 5 PHE HA H 5.115 2.118 0.372 1.00 . A A . 5 PHE HA 1 1 20 21193 1 1 5 PHE HB2 H 3.006 4.133 0.892 1.00 . A A . 5 PHE HB2 1 1 20 21194 1 1 5 PHE HB3 H 3.601 2.838 1.910 1.00 . A A . 5 PHE HB3 1 1 20 21195 1 1 5 PHE HD1 H 6.175 3.272 2.662 1.00 . A A . 5 PHE HD1 1 1 20 21196 1 1 5 PHE HD2 H 3.289 6.248 1.704 1.00 . A A . 5 PHE HD2 1 1 20 21197 1 1 5 PHE HE1 H 7.416 4.905 4.018 1.00 . A A . 5 PHE HE1 1 1 20 21198 1 1 5 PHE HE2 H 4.527 7.889 3.058 1.00 . A A . 5 PHE HE2 1 1 20 21199 1 1 5 PHE HZ H 6.592 7.218 4.218 1.00 . A A . 5 PHE HZ 1 1 20 21200 1 1 5 PHE N N 5.785 3.954 -0.303 1.00 . A A . 5 PHE N 1 1 20 21201 1 1 5 PHE O O 4.184 3.126 -2.262 1.00 . A A . 5 PHE O 1 1 20 21202 1 1 6 GLU C C 0.191 2.253 -1.599 1.00 . A A . 6 GLU C 1 1 20 21203 1 1 6 GLU CA C 1.648 2.117 -2.024 1.00 . A A . 6 GLU CA 1 1 20 21204 1 1 6 GLU CB C 1.898 0.720 -2.600 1.00 . A A . 6 GLU CB 1 1 20 21205 1 1 6 GLU CD C -0.227 -0.579 -3.002 1.00 . A A . 6 GLU CD 1 1 20 21206 1 1 6 GLU CG C 0.861 0.277 -3.619 1.00 . A A . 6 GLU CG 1 1 20 21207 1 1 6 GLU H H 2.271 2.183 0.005 1.00 . A A . 6 GLU H 1 1 20 21208 1 1 6 GLU HA H 1.856 2.850 -2.788 1.00 . A A . 6 GLU HA 1 1 20 21209 1 1 6 GLU HB2 H 2.866 0.709 -3.078 1.00 . A A . 6 GLU HB2 1 1 20 21210 1 1 6 GLU HB3 H 1.901 0.006 -1.790 1.00 . A A . 6 GLU HB3 1 1 20 21211 1 1 6 GLU HG2 H 0.406 1.153 -4.055 1.00 . A A . 6 GLU HG2 1 1 20 21212 1 1 6 GLU HG3 H 1.355 -0.295 -4.391 1.00 . A A . 6 GLU HG3 1 1 20 21213 1 1 6 GLU N N 2.563 2.365 -0.912 1.00 . A A . 6 GLU N 1 1 20 21214 1 1 6 GLU O O -0.192 1.816 -0.514 1.00 . A A . 6 GLU O 1 1 20 21215 1 1 6 GLU OE1 O -1.030 -0.042 -2.213 1.00 . A A . 6 GLU OE1 1 1 20 21216 1 1 6 GLU OE2 O -0.276 -1.789 -3.309 1.00 . A A . 6 GLU OE2 1 1 20 21217 1 1 7 TYR C C -2.837 1.857 -2.719 1.00 . A A . 7 TYR C 1 1 20 21218 1 1 7 TYR CA C -2.031 3.026 -2.177 1.00 . A A . 7 TYR CA 1 1 20 21219 1 1 7 TYR CB C -2.547 4.349 -2.740 1.00 . A A . 7 TYR CB 1 1 20 21220 1 1 7 TYR CD1 C -3.257 4.085 -5.148 1.00 . A A . 7 TYR CD1 1 1 20 21221 1 1 7 TYR CD2 C -1.204 5.212 -4.700 1.00 . A A . 7 TYR CD2 1 1 20 21222 1 1 7 TYR CE1 C -3.074 4.281 -6.504 1.00 . A A . 7 TYR CE1 1 1 20 21223 1 1 7 TYR CE2 C -1.013 5.410 -6.054 1.00 . A A . 7 TYR CE2 1 1 20 21224 1 1 7 TYR CG C -2.327 4.545 -4.224 1.00 . A A . 7 TYR CG 1 1 20 21225 1 1 7 TYR CZ C -1.950 4.943 -6.951 1.00 . A A . 7 TYR CZ 1 1 20 21226 1 1 7 TYR H H -0.270 3.212 -3.300 1.00 . A A . 7 TYR H 1 1 20 21227 1 1 7 TYR HA H -2.146 3.038 -1.111 1.00 . A A . 7 TYR HA 1 1 20 21228 1 1 7 TYR HB2 H -3.602 4.407 -2.563 1.00 . A A . 7 TYR HB2 1 1 20 21229 1 1 7 TYR HB3 H -2.059 5.163 -2.224 1.00 . A A . 7 TYR HB3 1 1 20 21230 1 1 7 TYR HD1 H -4.134 3.564 -4.794 1.00 . A A . 7 TYR HD1 1 1 20 21231 1 1 7 TYR HD2 H -0.472 5.576 -3.994 1.00 . A A . 7 TYR HD2 1 1 20 21232 1 1 7 TYR HE1 H -3.809 3.916 -7.205 1.00 . A A . 7 TYR HE1 1 1 20 21233 1 1 7 TYR HE2 H -0.133 5.928 -6.404 1.00 . A A . 7 TYR HE2 1 1 20 21234 1 1 7 TYR HH H -2.601 5.398 -8.701 1.00 . A A . 7 TYR HH 1 1 20 21235 1 1 7 TYR N N -0.624 2.859 -2.462 1.00 . A A . 7 TYR N 1 1 20 21236 1 1 7 TYR O O -3.035 1.725 -3.927 1.00 . A A . 7 TYR O 1 1 20 21237 1 1 7 TYR OH O -1.767 5.142 -8.300 1.00 . A A . 7 TYR OH 1 1 20 21238 1 1 8 ALA C C -5.552 0.243 -2.209 1.00 . A A . 8 ALA C 1 1 20 21239 1 1 8 ALA CA C -4.087 -0.153 -2.183 1.00 . A A . 8 ALA CA 1 1 20 21240 1 1 8 ALA CB C -3.853 -1.289 -1.202 1.00 . A A . 8 ALA CB 1 1 20 21241 1 1 8 ALA H H -3.084 1.158 -0.860 1.00 . A A . 8 ALA H 1 1 20 21242 1 1 8 ALA HA H -3.781 -0.472 -3.168 1.00 . A A . 8 ALA HA 1 1 20 21243 1 1 8 ALA HB1 H -4.483 -2.127 -1.460 1.00 . A A . 8 ALA HB1 1 1 20 21244 1 1 8 ALA HB2 H -4.092 -0.956 -0.201 1.00 . A A . 8 ALA HB2 1 1 20 21245 1 1 8 ALA HB3 H -2.817 -1.592 -1.240 1.00 . A A . 8 ALA HB3 1 1 20 21246 1 1 8 ALA N N -3.292 1.004 -1.809 1.00 . A A . 8 ALA N 1 1 20 21247 1 1 8 ALA O O -6.377 -0.306 -1.478 1.00 . A A . 8 ALA O 1 1 20 21248 1 1 9 GLU C C -7.830 1.458 -4.518 1.00 . A A . 9 GLU C 1 1 20 21249 1 1 9 GLU CA C -7.194 1.741 -3.187 1.00 . A A . 9 GLU CA 1 1 20 21250 1 1 9 GLU CB C -7.120 3.235 -2.876 1.00 . A A . 9 GLU CB 1 1 20 21251 1 1 9 GLU CD C -7.293 4.247 -5.184 1.00 . A A . 9 GLU CD 1 1 20 21252 1 1 9 GLU CG C -7.896 4.152 -3.794 1.00 . A A . 9 GLU CG 1 1 20 21253 1 1 9 GLU H H -5.159 1.572 -3.641 1.00 . A A . 9 GLU H 1 1 20 21254 1 1 9 GLU HA H -7.813 1.280 -2.458 1.00 . A A . 9 GLU HA 1 1 20 21255 1 1 9 GLU HB2 H -7.494 3.388 -1.876 1.00 . A A . 9 GLU HB2 1 1 20 21256 1 1 9 GLU HB3 H -6.083 3.536 -2.902 1.00 . A A . 9 GLU HB3 1 1 20 21257 1 1 9 GLU HG2 H -8.896 3.773 -3.874 1.00 . A A . 9 GLU HG2 1 1 20 21258 1 1 9 GLU HG3 H -7.915 5.135 -3.357 1.00 . A A . 9 GLU HG3 1 1 20 21259 1 1 9 GLU N N -5.859 1.203 -3.069 1.00 . A A . 9 GLU N 1 1 20 21260 1 1 9 GLU O O -7.171 1.333 -5.549 1.00 . A A . 9 GLU O 1 1 20 21261 1 1 9 GLU OE1 O -6.285 4.965 -5.344 1.00 . A A . 9 GLU OE1 1 1 20 21262 1 1 9 GLU OE2 O -7.831 3.604 -6.110 1.00 . A A . 9 GLU OE2 1 1 20 21263 1 1 10 VAL C C -10.314 2.435 -6.261 1.00 . A A . 10 VAL C 1 1 20 21264 1 1 10 VAL CA C -9.930 1.108 -5.618 1.00 . A A . 10 VAL CA 1 1 20 21265 1 1 10 VAL CB C -11.167 0.281 -5.270 1.00 . A A . 10 VAL CB 1 1 20 21266 1 1 10 VAL CG1 C -11.991 0.006 -6.513 1.00 . A A . 10 VAL CG1 1 1 20 21267 1 1 10 VAL CG2 C -10.756 -1.023 -4.608 1.00 . A A . 10 VAL CG2 1 1 20 21268 1 1 10 VAL H H -9.589 1.467 -3.590 1.00 . A A . 10 VAL H 1 1 20 21269 1 1 10 VAL HA H -9.327 0.547 -6.283 1.00 . A A . 10 VAL HA 1 1 20 21270 1 1 10 VAL HB H -11.757 0.842 -4.571 1.00 . A A . 10 VAL HB 1 1 20 21271 1 1 10 VAL HG11 H -11.626 -0.888 -6.998 1.00 . A A . 10 VAL HG11 1 1 20 21272 1 1 10 VAL HG12 H -11.903 0.840 -7.191 1.00 . A A . 10 VAL HG12 1 1 20 21273 1 1 10 VAL HG13 H -13.026 -0.128 -6.240 1.00 . A A . 10 VAL HG13 1 1 20 21274 1 1 10 VAL HG21 H -11.491 -1.299 -3.866 1.00 . A A . 10 VAL HG21 1 1 20 21275 1 1 10 VAL HG22 H -9.796 -0.894 -4.131 1.00 . A A . 10 VAL HG22 1 1 20 21276 1 1 10 VAL HG23 H -10.686 -1.801 -5.354 1.00 . A A . 10 VAL HG23 1 1 20 21277 1 1 10 VAL N N -9.141 1.360 -4.457 1.00 . A A . 10 VAL N 1 1 20 21278 1 1 10 VAL O O -10.381 2.561 -7.484 1.00 . A A . 10 VAL O 1 1 20 21279 1 1 11 ASP C C -10.326 5.837 -4.887 1.00 . A A . 11 ASP C 1 1 20 21280 1 1 11 ASP CA C -10.902 4.780 -5.842 1.00 . A A . 11 ASP CA 1 1 20 21281 1 1 11 ASP CB C -12.419 4.963 -5.973 1.00 . A A . 11 ASP CB 1 1 20 21282 1 1 11 ASP CG C -9.978 6.998 -10.197 1.00 . A A . 11 ASP CG 1 1 20 21283 1 1 11 ASP H H -10.584 3.214 -4.452 1.00 . A A . 11 ASP H 1 1 20 21284 1 1 11 ASP HA H -10.454 4.920 -6.815 1.00 . A A . 11 ASP HA 1 1 20 21285 1 1 11 ASP HB2 H -12.767 4.366 -6.792 1.00 . A A . 11 ASP HB2 1 1 20 21286 1 1 11 ASP HB3 H -12.899 4.635 -5.066 1.00 . A A . 11 ASP HB3 1 1 20 21287 1 1 11 ASP N N -10.574 3.421 -5.404 1.00 . A A . 11 ASP N 1 1 20 21288 1 1 11 ASP O O -9.940 6.921 -5.324 1.00 . A A . 11 ASP O 1 1 20 21289 1 1 11 ASP OD1 O -10.837 7.455 -9.412 1.00 . A A . 11 ASP OD1 1 1 20 21290 1 1 11 ASP OD2 O -10.080 7.070 -11.440 1.00 . A A . 11 ASP OD2 1 1 20 21291 1 1 12 GLU C C -9.149 5.781 -1.384 1.00 . A A . 12 GLU C 1 1 20 21292 1 1 12 GLU CA C -9.748 6.481 -2.604 1.00 . A A . 12 GLU CA 1 1 20 21293 1 1 12 GLU CB C -10.858 7.432 -2.160 1.00 . A A . 12 GLU CB 1 1 20 21294 1 1 12 GLU CD C -12.314 9.413 -2.739 1.00 . A A . 12 GLU CD 1 1 20 21295 1 1 12 GLU CG C -11.273 8.427 -3.231 1.00 . A A . 12 GLU CG 1 1 20 21296 1 1 12 GLU H H -10.520 4.626 -3.296 1.00 . A A . 12 GLU H 1 1 20 21297 1 1 12 GLU HA H -8.970 7.056 -3.085 1.00 . A A . 12 GLU HA 1 1 20 21298 1 1 12 GLU HB2 H -11.726 6.849 -1.883 1.00 . A A . 12 GLU HB2 1 1 20 21299 1 1 12 GLU HB3 H -10.518 7.985 -1.297 1.00 . A A . 12 GLU HB3 1 1 20 21300 1 1 12 GLU HG2 H -10.400 8.978 -3.549 1.00 . A A . 12 GLU HG2 1 1 20 21301 1 1 12 GLU HG3 H -11.680 7.883 -4.071 1.00 . A A . 12 GLU HG3 1 1 20 21302 1 1 12 GLU N N -10.264 5.527 -3.590 1.00 . A A . 12 GLU N 1 1 20 21303 1 1 12 GLU O O -9.450 4.622 -1.111 1.00 . A A . 12 GLU O 1 1 20 21304 1 1 12 GLU OE1 O -11.923 10.474 -2.209 1.00 . A A . 12 GLU OE1 1 1 20 21305 1 1 12 GLU OE2 O -13.520 9.124 -2.882 1.00 . A A . 12 GLU OE2 1 1 20 21306 1 1 13 ILE C C -7.862 6.981 1.699 1.00 . A A . 13 ILE C 1 1 20 21307 1 1 13 ILE CA C -7.662 5.978 0.557 1.00 . A A . 13 ILE CA 1 1 20 21308 1 1 13 ILE CB C -6.138 5.703 0.371 1.00 . A A . 13 ILE CB 1 1 20 21309 1 1 13 ILE CD1 C -5.701 7.826 -0.927 1.00 . A A . 13 ILE CD1 1 1 20 21310 1 1 13 ILE CG1 C -5.352 7.011 0.299 1.00 . A A . 13 ILE CG1 1 1 20 21311 1 1 13 ILE CG2 C -5.896 4.919 -0.900 1.00 . A A . 13 ILE CG2 1 1 20 21312 1 1 13 ILE H H -8.082 7.413 -0.947 1.00 . A A . 13 ILE H 1 1 20 21313 1 1 13 ILE HA H -8.155 5.047 0.808 1.00 . A A . 13 ILE HA 1 1 20 21314 1 1 13 ILE HB H -5.781 5.104 1.210 1.00 . A A . 13 ILE HB 1 1 20 21315 1 1 13 ILE HD11 H -6.068 7.165 -1.704 1.00 . A A . 13 ILE HD11 1 1 20 21316 1 1 13 ILE HD12 H -4.823 8.345 -1.279 1.00 . A A . 13 ILE HD12 1 1 20 21317 1 1 13 ILE HD13 H -6.468 8.541 -0.675 1.00 . A A . 13 ILE HD13 1 1 20 21318 1 1 13 ILE HG12 H -5.570 7.609 1.172 1.00 . A A . 13 ILE HG12 1 1 20 21319 1 1 13 ILE HG13 H -4.296 6.794 0.266 1.00 . A A . 13 ILE HG13 1 1 20 21320 1 1 13 ILE HG21 H -4.917 5.156 -1.288 1.00 . A A . 13 ILE HG21 1 1 20 21321 1 1 13 ILE HG22 H -6.643 5.195 -1.627 1.00 . A A . 13 ILE HG22 1 1 20 21322 1 1 13 ILE HG23 H -5.955 3.863 -0.699 1.00 . A A . 13 ILE HG23 1 1 20 21323 1 1 13 ILE N N -8.292 6.501 -0.659 1.00 . A A . 13 ILE N 1 1 20 21324 1 1 13 ILE O O -8.648 7.922 1.579 1.00 . A A . 13 ILE O 1 1 20 21325 1 1 14 VAL C C -5.919 7.648 4.709 1.00 . A A . 14 VAL C 1 1 20 21326 1 1 14 VAL CA C -7.237 7.658 3.955 1.00 . A A . 14 VAL CA 1 1 20 21327 1 1 14 VAL CB C -8.375 7.240 4.908 1.00 . A A . 14 VAL CB 1 1 20 21328 1 1 14 VAL CG1 C -8.413 8.143 6.133 1.00 . A A . 14 VAL CG1 1 1 20 21329 1 1 14 VAL CG2 C -9.710 7.265 4.180 1.00 . A A . 14 VAL CG2 1 1 20 21330 1 1 14 VAL H H -6.546 6.004 2.834 1.00 . A A . 14 VAL H 1 1 20 21331 1 1 14 VAL HA H -7.434 8.658 3.601 1.00 . A A . 14 VAL HA 1 1 20 21332 1 1 14 VAL HB H -8.188 6.230 5.239 1.00 . A A . 14 VAL HB 1 1 20 21333 1 1 14 VAL HG11 H -8.579 9.164 5.824 1.00 . A A . 14 VAL HG11 1 1 20 21334 1 1 14 VAL HG12 H -7.473 8.075 6.660 1.00 . A A . 14 VAL HG12 1 1 20 21335 1 1 14 VAL HG13 H -9.214 7.829 6.786 1.00 . A A . 14 VAL HG13 1 1 20 21336 1 1 14 VAL HG21 H -9.673 6.592 3.336 1.00 . A A . 14 VAL HG21 1 1 20 21337 1 1 14 VAL HG22 H -9.913 8.267 3.832 1.00 . A A . 14 VAL HG22 1 1 20 21338 1 1 14 VAL HG23 H -10.493 6.952 4.856 1.00 . A A . 14 VAL HG23 1 1 20 21339 1 1 14 VAL N N -7.149 6.776 2.798 1.00 . A A . 14 VAL N 1 1 20 21340 1 1 14 VAL O O -5.262 8.678 4.859 1.00 . A A . 14 VAL O 1 1 20 21341 1 1 15 GLU C C -3.191 5.896 4.935 1.00 . A A . 15 GLU C 1 1 20 21342 1 1 15 GLU CA C -4.294 6.299 5.905 1.00 . A A . 15 GLU CA 1 1 20 21343 1 1 15 GLU CB C -4.445 5.241 7.000 1.00 . A A . 15 GLU CB 1 1 20 21344 1 1 15 GLU CD C -4.950 6.928 8.810 1.00 . A A . 15 GLU CD 1 1 20 21345 1 1 15 GLU CG C -5.389 5.653 8.118 1.00 . A A . 15 GLU CG 1 1 20 21346 1 1 15 GLU H H -6.131 5.692 5.040 1.00 . A A . 15 GLU H 1 1 20 21347 1 1 15 GLU HA H -4.037 7.245 6.358 1.00 . A A . 15 GLU HA 1 1 20 21348 1 1 15 GLU HB2 H -4.822 4.332 6.556 1.00 . A A . 15 GLU HB2 1 1 20 21349 1 1 15 GLU HB3 H -3.474 5.045 7.431 1.00 . A A . 15 GLU HB3 1 1 20 21350 1 1 15 GLU HG2 H -6.374 5.807 7.703 1.00 . A A . 15 GLU HG2 1 1 20 21351 1 1 15 GLU HG3 H -5.428 4.858 8.849 1.00 . A A . 15 GLU HG3 1 1 20 21352 1 1 15 GLU N N -5.546 6.470 5.182 1.00 . A A . 15 GLU N 1 1 20 21353 1 1 15 GLU O O -3.439 5.190 3.970 1.00 . A A . 15 GLU O 1 1 20 21354 1 1 15 GLU OE1 O -4.107 6.845 9.729 1.00 . A A . 15 GLU OE1 1 1 20 21355 1 1 15 GLU OE2 O -5.448 8.010 8.434 1.00 . A A . 15 GLU OE2 1 1 20 21356 1 1 16 LYS C C 0.468 6.124 5.052 1.00 . A A . 16 LYS C 1 1 20 21357 1 1 16 LYS CA C -0.859 6.048 4.295 1.00 . A A . 16 LYS CA 1 1 20 21358 1 1 16 LYS CB C -0.826 7.001 3.101 1.00 . A A . 16 LYS CB 1 1 20 21359 1 1 16 LYS CD C -0.901 9.368 2.267 1.00 . A A . 16 LYS CD 1 1 20 21360 1 1 16 LYS CE C -1.255 10.802 2.624 1.00 . A A . 16 LYS CE 1 1 20 21361 1 1 16 LYS CG C -0.935 8.466 3.489 1.00 . A A . 16 LYS CG 1 1 20 21362 1 1 16 LYS H H -1.850 6.980 5.926 1.00 . A A . 16 LYS H 1 1 20 21363 1 1 16 LYS HA H -1.012 5.034 3.936 1.00 . A A . 16 LYS HA 1 1 20 21364 1 1 16 LYS HB2 H 0.100 6.859 2.568 1.00 . A A . 16 LYS HB2 1 1 20 21365 1 1 16 LYS HB3 H -1.651 6.765 2.447 1.00 . A A . 16 LYS HB3 1 1 20 21366 1 1 16 LYS HD2 H 0.092 9.348 1.842 1.00 . A A . 16 LYS HD2 1 1 20 21367 1 1 16 LYS HD3 H -1.613 9.001 1.541 1.00 . A A . 16 LYS HD3 1 1 20 21368 1 1 16 LYS HE2 H -0.561 11.155 3.372 1.00 . A A . 16 LYS HE2 1 1 20 21369 1 1 16 LYS HE3 H -1.169 11.412 1.737 1.00 . A A . 16 LYS HE3 1 1 20 21370 1 1 16 LYS HG2 H -1.865 8.623 4.014 1.00 . A A . 16 LYS HG2 1 1 20 21371 1 1 16 LYS HG3 H -0.107 8.721 4.134 1.00 . A A . 16 LYS HG3 1 1 20 21372 1 1 16 LYS HZ1 H -3.323 10.546 2.465 1.00 . A A . 16 LYS HZ1 1 1 20 21373 1 1 16 LYS HZ2 H -2.867 11.911 3.355 1.00 . A A . 16 LYS HZ2 1 1 20 21374 1 1 16 LYS HZ3 H -2.731 10.370 4.039 1.00 . A A . 16 LYS HZ3 1 1 20 21375 1 1 16 LYS N N -1.986 6.383 5.164 1.00 . A A . 16 LYS N 1 1 20 21376 1 1 16 LYS NZ N -2.641 10.916 3.158 1.00 . A A . 16 LYS NZ 1 1 20 21377 1 1 16 LYS O O 1.071 7.194 5.140 1.00 . A A . 16 LYS O 1 1 20 21378 1 1 17 ARG C C 2.828 3.629 6.361 1.00 . A A . 17 ARG C 1 1 20 21379 1 1 17 ARG CA C 2.183 5.007 6.355 1.00 . A A . 17 ARG CA 1 1 20 21380 1 1 17 ARG CB C 1.929 5.469 7.790 1.00 . A A . 17 ARG CB 1 1 20 21381 1 1 17 ARG CD C 4.210 4.844 8.660 1.00 . A A . 17 ARG CD 1 1 20 21382 1 1 17 ARG CG C 3.179 5.953 8.510 1.00 . A A . 17 ARG CG 1 1 20 21383 1 1 17 ARG CZ C 6.341 4.445 9.817 1.00 . A A . 17 ARG CZ 1 1 20 21384 1 1 17 ARG H H 0.457 4.152 5.446 1.00 . A A . 17 ARG H 1 1 20 21385 1 1 17 ARG HA H 2.855 5.703 5.878 1.00 . A A . 17 ARG HA 1 1 20 21386 1 1 17 ARG HB2 H 1.213 6.278 7.774 1.00 . A A . 17 ARG HB2 1 1 20 21387 1 1 17 ARG HB3 H 1.513 4.645 8.352 1.00 . A A . 17 ARG HB3 1 1 20 21388 1 1 17 ARG HD2 H 3.728 3.976 9.085 1.00 . A A . 17 ARG HD2 1 1 20 21389 1 1 17 ARG HD3 H 4.600 4.598 7.684 1.00 . A A . 17 ARG HD3 1 1 20 21390 1 1 17 ARG HE H 5.300 6.145 9.900 1.00 . A A . 17 ARG HE 1 1 20 21391 1 1 17 ARG HG2 H 3.617 6.760 7.943 1.00 . A A . 17 ARG HG2 1 1 20 21392 1 1 17 ARG HG3 H 2.902 6.310 9.491 1.00 . A A . 17 ARG HG3 1 1 20 21393 1 1 17 ARG HH11 H 5.659 2.886 8.726 1.00 . A A . 17 ARG HH11 1 1 20 21394 1 1 17 ARG HH12 H 7.163 2.618 9.544 1.00 . A A . 17 ARG HH12 1 1 20 21395 1 1 17 ARG HH21 H 7.283 5.805 10.978 1.00 . A A . 17 ARG HH21 1 1 20 21396 1 1 17 ARG HH22 H 8.086 4.278 10.824 1.00 . A A . 17 ARG HH22 1 1 20 21397 1 1 17 ARG N N 0.931 5.002 5.598 1.00 . A A . 17 ARG N 1 1 20 21398 1 1 17 ARG NE N 5.319 5.240 9.522 1.00 . A A . 17 ARG NE 1 1 20 21399 1 1 17 ARG NH1 N 6.392 3.215 9.322 1.00 . A A . 17 ARG NH1 1 1 20 21400 1 1 17 ARG NH2 N 7.317 4.877 10.604 1.00 . A A . 17 ARG NH2 1 1 20 21401 1 1 17 ARG O O 2.577 2.835 7.268 1.00 . A A . 17 ARG O 1 1 20 21402 1 1 18 GLY C C 5.637 1.966 4.684 1.00 . A A . 18 GLY C 1 1 20 21403 1 1 18 GLY CA C 4.279 2.025 5.346 1.00 . A A . 18 GLY CA 1 1 20 21404 1 1 18 GLY H H 3.843 3.984 4.664 1.00 . A A . 18 GLY H 1 1 20 21405 1 1 18 GLY HA2 H 4.385 1.688 6.359 1.00 . A A . 18 GLY HA2 1 1 20 21406 1 1 18 GLY HA3 H 3.623 1.349 4.835 1.00 . A A . 18 GLY HA3 1 1 20 21407 1 1 18 GLY N N 3.660 3.331 5.369 1.00 . A A . 18 GLY N 1 1 20 21408 1 1 18 GLY O O 6.490 2.831 4.882 1.00 . A A . 18 GLY O 1 1 20 21409 1 1 19 LYS C C 6.889 0.880 1.694 1.00 . A A . 19 LYS C 1 1 20 21410 1 1 19 LYS CA C 7.059 0.644 3.194 1.00 . A A . 19 LYS CA 1 1 20 21411 1 1 19 LYS CB C 7.460 -0.800 3.483 1.00 . A A . 19 LYS CB 1 1 20 21412 1 1 19 LYS CD C 8.193 -2.490 5.179 1.00 . A A . 19 LYS CD 1 1 20 21413 1 1 19 LYS CE C 8.812 -2.713 6.551 1.00 . A A . 19 LYS CE 1 1 20 21414 1 1 19 LYS CG C 8.061 -1.011 4.861 1.00 . A A . 19 LYS CG 1 1 20 21415 1 1 19 LYS H H 5.074 0.279 3.789 1.00 . A A . 19 LYS H 1 1 20 21416 1 1 19 LYS HA H 7.813 1.293 3.568 1.00 . A A . 19 LYS HA 1 1 20 21417 1 1 19 LYS HB2 H 6.565 -1.408 3.410 1.00 . A A . 19 LYS HB2 1 1 20 21418 1 1 19 LYS HB3 H 8.172 -1.128 2.741 1.00 . A A . 19 LYS HB3 1 1 20 21419 1 1 19 LYS HD2 H 7.211 -2.941 5.160 1.00 . A A . 19 LYS HD2 1 1 20 21420 1 1 19 LYS HD3 H 8.817 -2.954 4.430 1.00 . A A . 19 LYS HD3 1 1 20 21421 1 1 19 LYS HE2 H 9.801 -2.283 6.560 1.00 . A A . 19 LYS HE2 1 1 20 21422 1 1 19 LYS HE3 H 8.198 -2.222 7.291 1.00 . A A . 19 LYS HE3 1 1 20 21423 1 1 19 LYS HG2 H 9.041 -0.557 4.890 1.00 . A A . 19 LYS HG2 1 1 20 21424 1 1 19 LYS HG3 H 7.423 -0.547 5.598 1.00 . A A . 19 LYS HG3 1 1 20 21425 1 1 19 LYS HZ1 H 9.402 -4.284 7.796 1.00 . A A . 19 LYS HZ1 1 1 20 21426 1 1 19 LYS HZ2 H 9.440 -4.664 6.147 1.00 . A A . 19 LYS HZ2 1 1 20 21427 1 1 19 LYS HZ3 H 7.960 -4.576 6.961 1.00 . A A . 19 LYS HZ3 1 1 20 21428 1 1 19 LYS N N 5.818 0.909 3.901 1.00 . A A . 19 LYS N 1 1 20 21429 1 1 19 LYS NZ N 8.910 -4.160 6.887 1.00 . A A . 19 LYS NZ 1 1 20 21430 1 1 19 LYS O O 7.131 1.975 1.187 1.00 . A A . 19 LYS O 1 1 20 21431 1 1 20 GLY C C 4.890 -0.762 -0.653 1.00 . A A . 20 GLY C 1 1 20 21432 1 1 20 GLY CA C 6.221 -0.121 -0.407 1.00 . A A . 20 GLY CA 1 1 20 21433 1 1 20 GLY H H 6.342 -1.003 1.469 1.00 . A A . 20 GLY H 1 1 20 21434 1 1 20 GLY HA2 H 6.210 0.901 -0.738 1.00 . A A . 20 GLY HA2 1 1 20 21435 1 1 20 GLY HA3 H 6.981 -0.675 -0.930 1.00 . A A . 20 GLY HA3 1 1 20 21436 1 1 20 GLY N N 6.480 -0.168 1.004 1.00 . A A . 20 GLY N 1 1 20 21437 1 1 20 GLY O O 4.054 -0.267 -1.402 1.00 . A A . 20 GLY O 1 1 20 21438 1 1 21 LYS C C 3.048 -3.033 1.398 1.00 . A A . 21 LYS C 1 1 20 21439 1 1 21 LYS CA C 3.494 -2.655 -0.025 1.00 . A A . 21 LYS CA 1 1 20 21440 1 1 21 LYS CB C 3.667 -3.907 -0.885 1.00 . A A . 21 LYS CB 1 1 20 21441 1 1 21 LYS CD C 1.746 -3.289 -2.399 1.00 . A A . 21 LYS CD 1 1 20 21442 1 1 21 LYS CE C 0.843 -4.171 -1.547 1.00 . A A . 21 LYS CE 1 1 20 21443 1 1 21 LYS CG C 3.202 -3.728 -2.323 1.00 . A A . 21 LYS CG 1 1 20 21444 1 1 21 LYS H H 5.485 -2.245 0.518 1.00 . A A . 21 LYS H 1 1 20 21445 1 1 21 LYS HA H 2.735 -2.029 -0.468 1.00 . A A . 21 LYS HA 1 1 20 21446 1 1 21 LYS HB2 H 4.716 -4.173 -0.899 1.00 . A A . 21 LYS HB2 1 1 20 21447 1 1 21 LYS HB3 H 3.106 -4.716 -0.443 1.00 . A A . 21 LYS HB3 1 1 20 21448 1 1 21 LYS HD2 H 1.666 -2.271 -2.052 1.00 . A A . 21 LYS HD2 1 1 20 21449 1 1 21 LYS HD3 H 1.418 -3.346 -3.428 1.00 . A A . 21 LYS HD3 1 1 20 21450 1 1 21 LYS HE2 H 0.831 -5.166 -1.967 1.00 . A A . 21 LYS HE2 1 1 20 21451 1 1 21 LYS HE3 H 1.242 -4.209 -0.545 1.00 . A A . 21 LYS HE3 1 1 20 21452 1 1 21 LYS HG2 H 3.816 -2.977 -2.797 1.00 . A A . 21 LYS HG2 1 1 20 21453 1 1 21 LYS HG3 H 3.314 -4.664 -2.846 1.00 . A A . 21 LYS HG3 1 1 20 21454 1 1 21 LYS HZ1 H -0.933 -3.552 -2.455 1.00 . A A . 21 LYS HZ1 1 1 20 21455 1 1 21 LYS HZ2 H -0.568 -2.722 -1.027 1.00 . A A . 21 LYS HZ2 1 1 20 21456 1 1 21 LYS HZ3 H -1.157 -4.305 -0.959 1.00 . A A . 21 LYS HZ3 1 1 20 21457 1 1 21 LYS N N 4.725 -1.893 0.010 1.00 . A A . 21 LYS N 1 1 20 21458 1 1 21 LYS NZ N -0.551 -3.652 -1.493 1.00 . A A . 21 LYS NZ 1 1 20 21459 1 1 21 LYS O O 1.951 -3.554 1.583 1.00 . A A . 21 LYS O 1 1 20 21460 1 1 22 ASP C C 2.821 -1.915 4.457 1.00 . A A . 22 ASP C 1 1 20 21461 1 1 22 ASP CA C 3.577 -3.050 3.791 1.00 . A A . 22 ASP CA 1 1 20 21462 1 1 22 ASP CB C 4.849 -3.327 4.579 1.00 . A A . 22 ASP CB 1 1 20 21463 1 1 22 ASP CG C 4.567 -3.793 5.993 1.00 . A A . 22 ASP CG 1 1 20 21464 1 1 22 ASP H H 4.718 -2.287 2.219 1.00 . A A . 22 ASP H 1 1 20 21465 1 1 22 ASP HA H 2.971 -3.914 3.790 1.00 . A A . 22 ASP HA 1 1 20 21466 1 1 22 ASP HB2 H 5.424 -4.083 4.078 1.00 . A A . 22 ASP HB2 1 1 20 21467 1 1 22 ASP HB3 H 5.421 -2.422 4.626 1.00 . A A . 22 ASP HB3 1 1 20 21468 1 1 22 ASP N N 3.889 -2.737 2.405 1.00 . A A . 22 ASP N 1 1 20 21469 1 1 22 ASP O O 2.664 -1.885 5.677 1.00 . A A . 22 ASP O 1 1 20 21470 1 1 22 ASP OD1 O 4.384 -5.013 6.192 1.00 . A A . 22 ASP OD1 1 1 20 21471 1 1 22 ASP OD2 O 4.529 -2.938 6.904 1.00 . A A . 22 ASP OD2 1 1 20 21472 1 1 23 VAL C C 0.140 -0.133 4.212 1.00 . A A . 23 VAL C 1 1 20 21473 1 1 23 VAL CA C 1.627 0.154 4.126 1.00 . A A . 23 VAL CA 1 1 20 21474 1 1 23 VAL CB C 1.845 1.339 3.187 1.00 . A A . 23 VAL CB 1 1 20 21475 1 1 23 VAL CG1 C 1.276 1.033 1.807 1.00 . A A . 23 VAL CG1 1 1 20 21476 1 1 23 VAL CG2 C 1.235 2.596 3.771 1.00 . A A . 23 VAL CG2 1 1 20 21477 1 1 23 VAL H H 2.568 -1.043 2.704 1.00 . A A . 23 VAL H 1 1 20 21478 1 1 23 VAL HA H 1.996 0.420 5.102 1.00 . A A . 23 VAL HA 1 1 20 21479 1 1 23 VAL HB H 2.908 1.491 3.085 1.00 . A A . 23 VAL HB 1 1 20 21480 1 1 23 VAL HG11 H 2.049 0.598 1.191 1.00 . A A . 23 VAL HG11 1 1 20 21481 1 1 23 VAL HG12 H 0.926 1.943 1.355 1.00 . A A . 23 VAL HG12 1 1 20 21482 1 1 23 VAL HG13 H 0.456 0.338 1.894 1.00 . A A . 23 VAL HG13 1 1 20 21483 1 1 23 VAL HG21 H 1.302 2.552 4.844 1.00 . A A . 23 VAL HG21 1 1 20 21484 1 1 23 VAL HG22 H 0.200 2.664 3.480 1.00 . A A . 23 VAL HG22 1 1 20 21485 1 1 23 VAL HG23 H 1.771 3.460 3.409 1.00 . A A . 23 VAL HG23 1 1 20 21486 1 1 23 VAL N N 2.367 -0.986 3.648 1.00 . A A . 23 VAL N 1 1 20 21487 1 1 23 VAL O O -0.385 -0.999 3.512 1.00 . A A . 23 VAL O 1 1 20 21488 1 1 24 GLU C C -2.713 1.644 4.618 1.00 . A A . 24 GLU C 1 1 20 21489 1 1 24 GLU CA C -1.964 0.474 5.240 1.00 . A A . 24 GLU CA 1 1 20 21490 1 1 24 GLU CB C -2.301 0.370 6.725 1.00 . A A . 24 GLU CB 1 1 20 21491 1 1 24 GLU CD C -2.104 1.397 9.025 1.00 . A A . 24 GLU CD 1 1 20 21492 1 1 24 GLU CG C -1.683 1.473 7.570 1.00 . A A . 24 GLU CG 1 1 20 21493 1 1 24 GLU H H -0.058 1.340 5.526 1.00 . A A . 24 GLU H 1 1 20 21494 1 1 24 GLU HA H -2.261 -0.442 4.745 1.00 . A A . 24 GLU HA 1 1 20 21495 1 1 24 GLU HB2 H -3.374 0.419 6.837 1.00 . A A . 24 GLU HB2 1 1 20 21496 1 1 24 GLU HB3 H -1.951 -0.580 7.095 1.00 . A A . 24 GLU HB3 1 1 20 21497 1 1 24 GLU HG2 H -0.607 1.388 7.518 1.00 . A A . 24 GLU HG2 1 1 20 21498 1 1 24 GLU HG3 H -1.988 2.429 7.171 1.00 . A A . 24 GLU HG3 1 1 20 21499 1 1 24 GLU N N -0.534 0.633 5.047 1.00 . A A . 24 GLU N 1 1 20 21500 1 1 24 GLU O O -2.659 2.768 5.117 1.00 . A A . 24 GLU O 1 1 20 21501 1 1 24 GLU OE1 O -1.507 0.595 9.774 1.00 . A A . 24 GLU OE1 1 1 20 21502 1 1 24 GLU OE2 O -3.031 2.138 9.414 1.00 . A A . 24 GLU OE2 1 1 20 21503 1 1 25 TYR C C -5.639 2.037 2.811 1.00 . A A . 25 TYR C 1 1 20 21504 1 1 25 TYR CA C -4.165 2.385 2.825 1.00 . A A . 25 TYR CA 1 1 20 21505 1 1 25 TYR CB C -3.675 2.497 1.386 1.00 . A A . 25 TYR CB 1 1 20 21506 1 1 25 TYR CD1 C -1.260 3.176 1.632 1.00 . A A . 25 TYR CD1 1 1 20 21507 1 1 25 TYR CD2 C -2.746 4.705 0.578 1.00 . A A . 25 TYR CD2 1 1 20 21508 1 1 25 TYR CE1 C -0.217 4.067 1.477 1.00 . A A . 25 TYR CE1 1 1 20 21509 1 1 25 TYR CE2 C -1.706 5.606 0.420 1.00 . A A . 25 TYR CE2 1 1 20 21510 1 1 25 TYR CG C -2.540 3.477 1.186 1.00 . A A . 25 TYR CG 1 1 20 21511 1 1 25 TYR CZ C -0.460 5.277 0.767 1.00 . A A . 25 TYR CZ 1 1 20 21512 1 1 25 TYR H H -3.424 0.459 3.190 1.00 . A A . 25 TYR H 1 1 20 21513 1 1 25 TYR HA H -4.020 3.322 3.325 1.00 . A A . 25 TYR HA 1 1 20 21514 1 1 25 TYR HB2 H -3.339 1.524 1.059 1.00 . A A . 25 TYR HB2 1 1 20 21515 1 1 25 TYR HB3 H -4.499 2.813 0.761 1.00 . A A . 25 TYR HB3 1 1 20 21516 1 1 25 TYR HD1 H -1.085 2.224 2.103 1.00 . A A . 25 TYR HD1 1 1 20 21517 1 1 25 TYR HD2 H -3.736 4.957 0.228 1.00 . A A . 25 TYR HD2 1 1 20 21518 1 1 25 TYR HE1 H 0.770 3.810 1.831 1.00 . A A . 25 TYR HE1 1 1 20 21519 1 1 25 TYR HE2 H -1.885 6.558 -0.055 1.00 . A A . 25 TYR HE2 1 1 20 21520 1 1 25 TYR HH H 1.403 5.699 0.541 1.00 . A A . 25 TYR HH 1 1 20 21521 1 1 25 TYR N N -3.409 1.371 3.528 1.00 . A A . 25 TYR N 1 1 20 21522 1 1 25 TYR O O -6.002 0.868 2.860 1.00 . A A . 25 TYR O 1 1 20 21523 1 1 25 TYR OH O 0.590 6.176 0.721 1.00 . A A . 25 TYR OH 1 1 20 21524 1 1 26 LEU C C -8.321 2.609 1.228 1.00 . A A . 26 LEU C 1 1 20 21525 1 1 26 LEU CA C -7.914 2.813 2.670 1.00 . A A . 26 LEU CA 1 1 20 21526 1 1 26 LEU CB C -8.686 3.990 3.265 1.00 . A A . 26 LEU CB 1 1 20 21527 1 1 26 LEU CD1 C -10.975 4.634 4.084 1.00 . A A . 26 LEU CD1 1 1 20 21528 1 1 26 LEU CD2 C -10.468 4.700 1.637 1.00 . A A . 26 LEU CD2 1 1 20 21529 1 1 26 LEU CG C -10.187 3.994 2.956 1.00 . A A . 26 LEU CG 1 1 20 21530 1 1 26 LEU H H -6.149 3.961 2.703 1.00 . A A . 26 LEU H 1 1 20 21531 1 1 26 LEU HA H -8.132 1.920 3.229 1.00 . A A . 26 LEU HA 1 1 20 21532 1 1 26 LEU HB2 H -8.552 3.980 4.337 1.00 . A A . 26 LEU HB2 1 1 20 21533 1 1 26 LEU HB3 H -8.263 4.894 2.878 1.00 . A A . 26 LEU HB3 1 1 20 21534 1 1 26 LEU HD11 H -11.768 3.967 4.388 1.00 . A A . 26 LEU HD11 1 1 20 21535 1 1 26 LEU HD12 H -11.399 5.566 3.743 1.00 . A A . 26 LEU HD12 1 1 20 21536 1 1 26 LEU HD13 H -10.320 4.819 4.922 1.00 . A A . 26 LEU HD13 1 1 20 21537 1 1 26 LEU HD21 H -11.509 4.981 1.596 1.00 . A A . 26 LEU HD21 1 1 20 21538 1 1 26 LEU HD22 H -10.245 4.033 0.816 1.00 . A A . 26 LEU HD22 1 1 20 21539 1 1 26 LEU HD23 H -9.854 5.583 1.561 1.00 . A A . 26 LEU HD23 1 1 20 21540 1 1 26 LEU HG H -10.517 2.981 2.855 1.00 . A A . 26 LEU HG 1 1 20 21541 1 1 26 LEU N N -6.486 3.046 2.724 1.00 . A A . 26 LEU N 1 1 20 21542 1 1 26 LEU O O -7.622 3.026 0.313 1.00 . A A . 26 LEU O 1 1 20 21543 1 1 27 VAL C C -11.402 1.868 -0.464 1.00 . A A . 27 VAL C 1 1 20 21544 1 1 27 VAL CA C -9.892 1.709 -0.334 1.00 . A A . 27 VAL CA 1 1 20 21545 1 1 27 VAL CB C -9.405 0.320 -0.856 1.00 . A A . 27 VAL CB 1 1 20 21546 1 1 27 VAL CG1 C -9.031 -0.599 0.298 1.00 . A A . 27 VAL CG1 1 1 20 21547 1 1 27 VAL CG2 C -10.410 -0.373 -1.778 1.00 . A A . 27 VAL CG2 1 1 20 21548 1 1 27 VAL H H -9.939 1.587 1.772 1.00 . A A . 27 VAL H 1 1 20 21549 1 1 27 VAL HA H -9.428 2.465 -0.953 1.00 . A A . 27 VAL HA 1 1 20 21550 1 1 27 VAL HB H -8.514 0.499 -1.427 1.00 . A A . 27 VAL HB 1 1 20 21551 1 1 27 VAL HG11 H -9.915 -0.846 0.864 1.00 . A A . 27 VAL HG11 1 1 20 21552 1 1 27 VAL HG12 H -8.321 -0.098 0.940 1.00 . A A . 27 VAL HG12 1 1 20 21553 1 1 27 VAL HG13 H -8.588 -1.500 -0.089 1.00 . A A . 27 VAL HG13 1 1 20 21554 1 1 27 VAL HG21 H -10.745 0.322 -2.534 1.00 . A A . 27 VAL HG21 1 1 20 21555 1 1 27 VAL HG22 H -11.256 -0.710 -1.200 1.00 . A A . 27 VAL HG22 1 1 20 21556 1 1 27 VAL HG23 H -9.938 -1.220 -2.250 1.00 . A A . 27 VAL HG23 1 1 20 21557 1 1 27 VAL N N -9.435 1.946 1.016 1.00 . A A . 27 VAL N 1 1 20 21558 1 1 27 VAL O O -12.169 0.959 -0.146 1.00 . A A . 27 VAL O 1 1 20 21559 1 1 28 ARG C C -13.599 2.667 -2.459 1.00 . A A . 28 ARG C 1 1 20 21560 1 1 28 ARG CA C -13.219 3.304 -1.150 1.00 . A A . 28 ARG CA 1 1 20 21561 1 1 28 ARG CB C -13.502 4.800 -1.192 1.00 . A A . 28 ARG CB 1 1 20 21562 1 1 28 ARG CD C -15.118 6.678 -0.774 1.00 . A A . 28 ARG CD 1 1 20 21563 1 1 28 ARG CG C -14.922 5.170 -0.791 1.00 . A A . 28 ARG CG 1 1 20 21564 1 1 28 ARG CZ C -16.936 8.303 -0.452 1.00 . A A . 28 ARG CZ 1 1 20 21565 1 1 28 ARG H H -11.158 3.741 -1.113 1.00 . A A . 28 ARG H 1 1 20 21566 1 1 28 ARG HA H -13.790 2.840 -0.365 1.00 . A A . 28 ARG HA 1 1 20 21567 1 1 28 ARG HB2 H -12.817 5.308 -0.529 1.00 . A A . 28 ARG HB2 1 1 20 21568 1 1 28 ARG HB3 H -13.338 5.142 -2.200 1.00 . A A . 28 ARG HB3 1 1 20 21569 1 1 28 ARG HD2 H -14.426 7.111 -0.067 1.00 . A A . 28 ARG HD2 1 1 20 21570 1 1 28 ARG HD3 H -14.910 7.066 -1.762 1.00 . A A . 28 ARG HD3 1 1 20 21571 1 1 28 ARG HE H -17.076 6.347 -0.079 1.00 . A A . 28 ARG HE 1 1 20 21572 1 1 28 ARG HG2 H -15.612 4.736 -1.499 1.00 . A A . 28 ARG HG2 1 1 20 21573 1 1 28 ARG HG3 H -15.122 4.779 0.196 1.00 . A A . 28 ARG HG3 1 1 20 21574 1 1 28 ARG HH11 H -15.209 9.084 -1.154 1.00 . A A . 28 ARG HH11 1 1 20 21575 1 1 28 ARG HH12 H -16.497 10.219 -0.921 1.00 . A A . 28 ARG HH12 1 1 20 21576 1 1 28 ARG HH21 H -18.781 7.838 0.230 1.00 . A A . 28 ARG HH21 1 1 20 21577 1 1 28 ARG HH22 H -18.525 9.512 -0.134 1.00 . A A . 28 ARG HH22 1 1 20 21578 1 1 28 ARG N N -11.815 3.039 -0.922 1.00 . A A . 28 ARG N 1 1 20 21579 1 1 28 ARG NE N -16.477 7.056 -0.395 1.00 . A A . 28 ARG NE 1 1 20 21580 1 1 28 ARG NH1 N -16.149 9.282 -0.878 1.00 . A A . 28 ARG NH1 1 1 20 21581 1 1 28 ARG NH2 N -18.183 8.573 -0.089 1.00 . A A . 28 ARG NH2 1 1 20 21582 1 1 28 ARG O O -13.625 3.326 -3.496 1.00 . A A . 28 ARG O 1 1 20 21583 1 1 29 TRP C C -14.933 1.374 -4.622 1.00 . A A . 29 TRP C 1 1 20 21584 1 1 29 TRP CA C -14.241 0.556 -3.545 1.00 . A A . 29 TRP CA 1 1 20 21585 1 1 29 TRP CB C -15.157 -0.572 -3.088 1.00 . A A . 29 TRP CB 1 1 20 21586 1 1 29 TRP CD1 C -13.968 -2.163 -4.715 1.00 . A A . 29 TRP CD1 1 1 20 21587 1 1 29 TRP CD2 C -15.908 -2.942 -3.913 1.00 . A A . 29 TRP CD2 1 1 20 21588 1 1 29 TRP CE2 C -15.364 -3.905 -4.785 1.00 . A A . 29 TRP CE2 1 1 20 21589 1 1 29 TRP CE3 C -17.128 -3.214 -3.288 1.00 . A A . 29 TRP CE3 1 1 20 21590 1 1 29 TRP CG C -15.000 -1.836 -3.882 1.00 . A A . 29 TRP CG 1 1 20 21591 1 1 29 TRP CH2 C -17.191 -5.355 -4.420 1.00 . A A . 29 TRP CH2 1 1 20 21592 1 1 29 TRP CZ2 C -15.997 -5.116 -5.045 1.00 . A A . 29 TRP CZ2 1 1 20 21593 1 1 29 TRP CZ3 C -17.757 -4.417 -3.548 1.00 . A A . 29 TRP CZ3 1 1 20 21594 1 1 29 TRP H H -13.827 0.935 -1.513 1.00 . A A . 29 TRP H 1 1 20 21595 1 1 29 TRP HA H -13.339 0.129 -3.953 1.00 . A A . 29 TRP HA 1 1 20 21596 1 1 29 TRP HB2 H -14.942 -0.791 -2.055 1.00 . A A . 29 TRP HB2 1 1 20 21597 1 1 29 TRP HB3 H -16.184 -0.248 -3.176 1.00 . A A . 29 TRP HB3 1 1 20 21598 1 1 29 TRP HD1 H -13.115 -1.530 -4.909 1.00 . A A . 29 TRP HD1 1 1 20 21599 1 1 29 TRP HE1 H -13.580 -3.860 -5.890 1.00 . A A . 29 TRP HE1 1 1 20 21600 1 1 29 TRP HE3 H -17.580 -2.503 -2.612 1.00 . A A . 29 TRP HE3 1 1 20 21601 1 1 29 TRP HH2 H -17.718 -6.282 -4.594 1.00 . A A . 29 TRP HH2 1 1 20 21602 1 1 29 TRP HZ2 H -15.574 -5.851 -5.715 1.00 . A A . 29 TRP HZ2 1 1 20 21603 1 1 29 TRP HZ3 H -18.701 -4.643 -3.075 1.00 . A A . 29 TRP HZ3 1 1 20 21604 1 1 29 TRP N N -13.875 1.369 -2.388 1.00 . A A . 29 TRP N 1 1 20 21605 1 1 29 TRP NE1 N -14.180 -3.406 -5.262 1.00 . A A . 29 TRP NE1 1 1 20 21606 1 1 29 TRP O O -16.145 1.570 -4.585 1.00 . A A . 29 TRP O 1 1 20 21607 1 1 30 LYS C C -16.026 2.337 -7.098 1.00 . A A . 30 LYS C 1 1 20 21608 1 1 30 LYS CA C -14.591 2.695 -6.690 1.00 . A A . 30 LYS CA 1 1 20 21609 1 1 30 LYS CB C -13.669 2.501 -7.905 1.00 . A A . 30 LYS CB 1 1 20 21610 1 1 30 LYS CD C -12.724 0.903 -9.609 1.00 . A A . 30 LYS CD 1 1 20 21611 1 1 30 LYS CE C -12.774 -0.519 -10.146 1.00 . A A . 30 LYS CE 1 1 20 21612 1 1 30 LYS CG C -13.860 1.175 -8.633 1.00 . A A . 30 LYS CG 1 1 20 21613 1 1 30 LYS H H -13.128 1.802 -5.390 1.00 . A A . 30 LYS H 1 1 20 21614 1 1 30 LYS HA H -14.564 3.734 -6.397 1.00 . A A . 30 LYS HA 1 1 20 21615 1 1 30 LYS HB2 H -13.857 3.297 -8.610 1.00 . A A . 30 LYS HB2 1 1 20 21616 1 1 30 LYS HB3 H -12.644 2.563 -7.575 1.00 . A A . 30 LYS HB3 1 1 20 21617 1 1 30 LYS HD2 H -12.802 1.591 -10.437 1.00 . A A . 30 LYS HD2 1 1 20 21618 1 1 30 LYS HD3 H -11.781 1.054 -9.103 1.00 . A A . 30 LYS HD3 1 1 20 21619 1 1 30 LYS HE2 H -11.918 -0.679 -10.785 1.00 . A A . 30 LYS HE2 1 1 20 21620 1 1 30 LYS HE3 H -12.733 -1.207 -9.314 1.00 . A A . 30 LYS HE3 1 1 20 21621 1 1 30 LYS HG2 H -13.906 0.377 -7.911 1.00 . A A . 30 LYS HG2 1 1 20 21622 1 1 30 LYS HG3 H -14.788 1.215 -9.182 1.00 . A A . 30 LYS HG3 1 1 20 21623 1 1 30 LYS HZ1 H -14.026 -1.762 -11.265 1.00 . A A . 30 LYS HZ1 1 1 20 21624 1 1 30 LYS HZ2 H -14.060 -0.140 -11.747 1.00 . A A . 30 LYS HZ2 1 1 20 21625 1 1 30 LYS HZ3 H -14.853 -0.619 -10.332 1.00 . A A . 30 LYS HZ3 1 1 20 21626 1 1 30 LYS N N -14.110 1.893 -5.541 1.00 . A A . 30 LYS N 1 1 20 21627 1 1 30 LYS NZ N -14.015 -0.778 -10.928 1.00 . A A . 30 LYS NZ 1 1 20 21628 1 1 30 LYS O O -16.803 3.207 -7.489 1.00 . A A . 30 LYS O 1 1 20 21629 1 1 31 ASP C C -18.332 -0.105 -6.151 1.00 . A A . 31 ASP C 1 1 20 21630 1 1 31 ASP CA C -17.700 0.586 -7.356 1.00 . A A . 31 ASP CA 1 1 20 21631 1 1 31 ASP CB C -17.659 -0.369 -8.550 1.00 . A A . 31 ASP CB 1 1 20 21632 1 1 31 ASP CG C -17.409 0.353 -9.861 1.00 . A A . 31 ASP CG 1 1 20 21633 1 1 31 ASP H H -15.687 0.401 -6.729 1.00 . A A . 31 ASP H 1 1 20 21634 1 1 31 ASP HA H -18.295 1.449 -7.613 1.00 . A A . 31 ASP HA 1 1 20 21635 1 1 31 ASP HB2 H -16.867 -1.089 -8.401 1.00 . A A . 31 ASP HB2 1 1 20 21636 1 1 31 ASP HB3 H -18.602 -0.889 -8.621 1.00 . A A . 31 ASP HB3 1 1 20 21637 1 1 31 ASP N N -16.359 1.052 -7.020 1.00 . A A . 31 ASP N 1 1 20 21638 1 1 31 ASP O O -18.729 -1.268 -6.222 1.00 . A A . 31 ASP O 1 1 20 21639 1 1 31 ASP OD1 O -18.333 1.038 -10.346 1.00 . A A . 31 ASP OD1 1 1 20 21640 1 1 31 ASP OD2 O -16.290 0.233 -10.402 1.00 . A A . 31 ASP OD2 1 1 20 21641 1 1 32 GLY C C -19.872 1.075 -3.101 1.00 . A A . 32 GLY C 1 1 20 21642 1 1 32 GLY CA C -18.988 0.080 -3.826 1.00 . A A . 32 GLY CA 1 1 20 21643 1 1 32 GLY H H -18.093 1.550 -5.054 1.00 . A A . 32 GLY H 1 1 20 21644 1 1 32 GLY HA2 H -19.572 -0.794 -4.072 1.00 . A A . 32 GLY HA2 1 1 20 21645 1 1 32 GLY HA3 H -18.180 -0.211 -3.166 1.00 . A A . 32 GLY HA3 1 1 20 21646 1 1 32 GLY N N -18.419 0.626 -5.043 1.00 . A A . 32 GLY N 1 1 20 21647 1 1 32 GLY O O -20.580 1.862 -3.729 1.00 . A A . 32 GLY O 1 1 20 21648 1 1 33 GLY C C -19.941 2.355 0.310 1.00 . A A . 33 GLY C 1 1 20 21649 1 1 33 GLY CA C -20.633 1.950 -0.977 1.00 . A A . 33 GLY CA 1 1 20 21650 1 1 33 GLY H H -19.246 0.390 -1.328 1.00 . A A . 33 GLY H 1 1 20 21651 1 1 33 GLY HA2 H -20.837 2.836 -1.559 1.00 . A A . 33 GLY HA2 1 1 20 21652 1 1 33 GLY HA3 H -21.569 1.468 -0.734 1.00 . A A . 33 GLY HA3 1 1 20 21653 1 1 33 GLY N N -19.829 1.040 -1.772 1.00 . A A . 33 GLY N 1 1 20 21654 1 1 33 GLY O O -19.870 3.539 0.638 1.00 . A A . 33 GLY O 1 1 20 21655 1 1 34 ASP C C -17.236 1.768 2.065 1.00 . A A . 34 ASP C 1 1 20 21656 1 1 34 ASP CA C -18.737 1.624 2.295 1.00 . A A . 34 ASP CA 1 1 20 21657 1 1 34 ASP CB C -19.006 0.493 3.290 1.00 . A A . 34 ASP CB 1 1 20 21658 1 1 34 ASP CG C -20.478 0.361 3.629 1.00 . A A . 34 ASP CG 1 1 20 21659 1 1 34 ASP H H -19.523 0.446 0.723 1.00 . A A . 34 ASP H 1 1 20 21660 1 1 34 ASP HA H -19.118 2.548 2.703 1.00 . A A . 34 ASP HA 1 1 20 21661 1 1 34 ASP HB2 H -18.670 -0.441 2.864 1.00 . A A . 34 ASP HB2 1 1 20 21662 1 1 34 ASP HB3 H -18.461 0.685 4.202 1.00 . A A . 34 ASP HB3 1 1 20 21663 1 1 34 ASP N N -19.431 1.368 1.039 1.00 . A A . 34 ASP N 1 1 20 21664 1 1 34 ASP O O -16.760 1.663 0.935 1.00 . A A . 34 ASP O 1 1 20 21665 1 1 34 ASP OD1 O -20.962 1.138 4.480 1.00 . A A . 34 ASP OD1 1 1 20 21666 1 1 34 ASP OD2 O -21.147 -0.517 3.045 1.00 . A A . 34 ASP OD2 1 1 20 21667 1 1 35 CYS C C -14.329 1.221 4.002 1.00 . A A . 35 CYS C 1 1 20 21668 1 1 35 CYS CA C -15.048 2.172 3.049 1.00 . A A . 35 CYS CA 1 1 20 21669 1 1 35 CYS CB C -14.656 3.616 3.360 1.00 . A A . 35 CYS CB 1 1 20 21670 1 1 35 CYS H H -16.930 2.082 4.016 1.00 . A A . 35 CYS H 1 1 20 21671 1 1 35 CYS HA H -14.753 1.938 2.037 1.00 . A A . 35 CYS HA 1 1 20 21672 1 1 35 CYS HB2 H -13.583 3.714 3.287 1.00 . A A . 35 CYS HB2 1 1 20 21673 1 1 35 CYS HB3 H -15.121 4.272 2.639 1.00 . A A . 35 CYS HB3 1 1 20 21674 1 1 35 CYS HG H -16.257 3.533 5.341 1.00 . A A . 35 CYS HG 1 1 20 21675 1 1 35 CYS N N -16.494 2.011 3.142 1.00 . A A . 35 CYS N 1 1 20 21676 1 1 35 CYS O O -14.745 1.038 5.145 1.00 . A A . 35 CYS O 1 1 20 21677 1 1 35 CYS SG S -15.145 4.174 5.009 1.00 . A A . 35 CYS SG 1 1 20 21678 1 1 36 GLU C C -10.973 -0.004 4.208 1.00 . A A . 36 GLU C 1 1 20 21679 1 1 36 GLU CA C -12.463 -0.311 4.327 1.00 . A A . 36 GLU CA 1 1 20 21680 1 1 36 GLU CB C -12.735 -1.751 3.890 1.00 . A A . 36 GLU CB 1 1 20 21681 1 1 36 GLU CD C -12.567 -2.769 6.195 1.00 . A A . 36 GLU CD 1 1 20 21682 1 1 36 GLU CG C -12.057 -2.792 4.767 1.00 . A A . 36 GLU CG 1 1 20 21683 1 1 36 GLU H H -12.964 0.808 2.601 1.00 . A A . 36 GLU H 1 1 20 21684 1 1 36 GLU HA H -12.764 -0.192 5.357 1.00 . A A . 36 GLU HA 1 1 20 21685 1 1 36 GLU HB2 H -13.800 -1.929 3.916 1.00 . A A . 36 GLU HB2 1 1 20 21686 1 1 36 GLU HB3 H -12.382 -1.881 2.878 1.00 . A A . 36 GLU HB3 1 1 20 21687 1 1 36 GLU HG2 H -12.241 -3.771 4.351 1.00 . A A . 36 GLU HG2 1 1 20 21688 1 1 36 GLU HG3 H -10.995 -2.598 4.777 1.00 . A A . 36 GLU HG3 1 1 20 21689 1 1 36 GLU N N -13.245 0.620 3.521 1.00 . A A . 36 GLU N 1 1 20 21690 1 1 36 GLU O O -10.536 0.633 3.250 1.00 . A A . 36 GLU O 1 1 20 21691 1 1 36 GLU OE1 O -11.993 -2.025 7.018 1.00 . A A . 36 GLU OE1 1 1 20 21692 1 1 36 GLU OE2 O -13.537 -3.497 6.490 1.00 . A A . 36 GLU OE2 1 1 20 21693 1 1 37 TRP C C -8.002 -1.427 4.636 1.00 . A A . 37 TRP C 1 1 20 21694 1 1 37 TRP CA C -8.761 -0.229 5.195 1.00 . A A . 37 TRP CA 1 1 20 21695 1 1 37 TRP CB C -8.282 0.063 6.617 1.00 . A A . 37 TRP CB 1 1 20 21696 1 1 37 TRP CD1 C -9.258 2.426 6.489 1.00 . A A . 37 TRP CD1 1 1 20 21697 1 1 37 TRP CD2 C -9.059 1.627 8.571 1.00 . A A . 37 TRP CD2 1 1 20 21698 1 1 37 TRP CE2 C -9.605 2.923 8.639 1.00 . A A . 37 TRP CE2 1 1 20 21699 1 1 37 TRP CE3 C -8.843 0.926 9.762 1.00 . A A . 37 TRP CE3 1 1 20 21700 1 1 37 TRP CG C -8.846 1.328 7.187 1.00 . A A . 37 TRP CG 1 1 20 21701 1 1 37 TRP CH2 C -9.714 2.821 10.996 1.00 . A A . 37 TRP CH2 1 1 20 21702 1 1 37 TRP CZ2 C -9.936 3.530 9.847 1.00 . A A . 37 TRP CZ2 1 1 20 21703 1 1 37 TRP CZ3 C -9.173 1.530 10.961 1.00 . A A . 37 TRP CZ3 1 1 20 21704 1 1 37 TRP H H -10.603 -0.964 5.923 1.00 . A A . 37 TRP H 1 1 20 21705 1 1 37 TRP HA H -8.562 0.630 4.576 1.00 . A A . 37 TRP HA 1 1 20 21706 1 1 37 TRP HB2 H -8.573 -0.753 7.262 1.00 . A A . 37 TRP HB2 1 1 20 21707 1 1 37 TRP HB3 H -7.206 0.146 6.615 1.00 . A A . 37 TRP HB3 1 1 20 21708 1 1 37 TRP HD1 H -9.224 2.512 5.413 1.00 . A A . 37 TRP HD1 1 1 20 21709 1 1 37 TRP HE1 H -10.068 4.268 7.096 1.00 . A A . 37 TRP HE1 1 1 20 21710 1 1 37 TRP HE3 H -8.426 -0.071 9.755 1.00 . A A . 37 TRP HE3 1 1 20 21711 1 1 37 TRP HH2 H -9.956 3.254 11.955 1.00 . A A . 37 TRP HH2 1 1 20 21712 1 1 37 TRP HZ2 H -10.355 4.525 9.891 1.00 . A A . 37 TRP HZ2 1 1 20 21713 1 1 37 TRP HZ3 H -9.012 1.004 11.890 1.00 . A A . 37 TRP HZ3 1 1 20 21714 1 1 37 TRP N N -10.199 -0.461 5.187 1.00 . A A . 37 TRP N 1 1 20 21715 1 1 37 TRP NE1 N -9.718 3.390 7.355 1.00 . A A . 37 TRP NE1 1 1 20 21716 1 1 37 TRP O O -8.443 -2.569 4.767 1.00 . A A . 37 TRP O 1 1 20 21717 1 1 38 VAL C C -5.054 -2.726 4.509 1.00 . A A . 38 VAL C 1 1 20 21718 1 1 38 VAL CA C -6.031 -2.218 3.456 1.00 . A A . 38 VAL CA 1 1 20 21719 1 1 38 VAL CB C -5.247 -1.758 2.207 1.00 . A A . 38 VAL CB 1 1 20 21720 1 1 38 VAL CG1 C -4.289 -2.852 1.741 1.00 . A A . 38 VAL CG1 1 1 20 21721 1 1 38 VAL CG2 C -6.206 -1.378 1.090 1.00 . A A . 38 VAL CG2 1 1 20 21722 1 1 38 VAL H H -6.566 -0.224 3.926 1.00 . A A . 38 VAL H 1 1 20 21723 1 1 38 VAL HA H -6.682 -3.025 3.165 1.00 . A A . 38 VAL HA 1 1 20 21724 1 1 38 VAL HB H -4.666 -0.885 2.468 1.00 . A A . 38 VAL HB 1 1 20 21725 1 1 38 VAL HG11 H -4.840 -3.768 1.584 1.00 . A A . 38 VAL HG11 1 1 20 21726 1 1 38 VAL HG12 H -3.533 -3.011 2.494 1.00 . A A . 38 VAL HG12 1 1 20 21727 1 1 38 VAL HG13 H -3.816 -2.556 0.823 1.00 . A A . 38 VAL HG13 1 1 20 21728 1 1 38 VAL HG21 H -5.829 -1.747 0.148 1.00 . A A . 38 VAL HG21 1 1 20 21729 1 1 38 VAL HG22 H -6.303 -0.304 1.045 1.00 . A A . 38 VAL HG22 1 1 20 21730 1 1 38 VAL HG23 H -7.174 -1.817 1.285 1.00 . A A . 38 VAL HG23 1 1 20 21731 1 1 38 VAL N N -6.858 -1.158 4.014 1.00 . A A . 38 VAL N 1 1 20 21732 1 1 38 VAL O O -4.764 -2.034 5.485 1.00 . A A . 38 VAL O 1 1 20 21733 1 1 39 LYS C C -2.212 -3.989 5.086 1.00 . A A . 39 LYS C 1 1 20 21734 1 1 39 LYS CA C -3.623 -4.530 5.247 1.00 . A A . 39 LYS CA 1 1 20 21735 1 1 39 LYS CB C -3.623 -6.054 5.106 1.00 . A A . 39 LYS CB 1 1 20 21736 1 1 39 LYS CD C -3.481 -6.549 7.566 1.00 . A A . 39 LYS CD 1 1 20 21737 1 1 39 LYS CE C -4.858 -7.188 7.652 1.00 . A A . 39 LYS CE 1 1 20 21738 1 1 39 LYS CG C -2.846 -6.765 6.202 1.00 . A A . 39 LYS CG 1 1 20 21739 1 1 39 LYS H H -4.810 -4.435 3.503 1.00 . A A . 39 LYS H 1 1 20 21740 1 1 39 LYS HA H -3.964 -4.271 6.229 1.00 . A A . 39 LYS HA 1 1 20 21741 1 1 39 LYS HB2 H -4.644 -6.407 5.129 1.00 . A A . 39 LYS HB2 1 1 20 21742 1 1 39 LYS HB3 H -3.182 -6.315 4.155 1.00 . A A . 39 LYS HB3 1 1 20 21743 1 1 39 LYS HD2 H -2.846 -6.987 8.320 1.00 . A A . 39 LYS HD2 1 1 20 21744 1 1 39 LYS HD3 H -3.575 -5.487 7.744 1.00 . A A . 39 LYS HD3 1 1 20 21745 1 1 39 LYS HE2 H -5.481 -6.779 6.869 1.00 . A A . 39 LYS HE2 1 1 20 21746 1 1 39 LYS HE3 H -4.755 -8.254 7.508 1.00 . A A . 39 LYS HE3 1 1 20 21747 1 1 39 LYS HG2 H -2.830 -7.823 5.989 1.00 . A A . 39 LYS HG2 1 1 20 21748 1 1 39 LYS HG3 H -1.837 -6.384 6.220 1.00 . A A . 39 LYS HG3 1 1 20 21749 1 1 39 LYS HZ1 H -4.899 -7.278 9.738 1.00 . A A . 39 LYS HZ1 1 1 20 21750 1 1 39 LYS HZ2 H -6.422 -7.428 9.017 1.00 . A A . 39 LYS HZ2 1 1 20 21751 1 1 39 LYS HZ3 H -5.669 -5.916 9.096 1.00 . A A . 39 LYS HZ3 1 1 20 21752 1 1 39 LYS N N -4.549 -3.933 4.303 1.00 . A A . 39 LYS N 1 1 20 21753 1 1 39 LYS NZ N -5.508 -6.936 8.968 1.00 . A A . 39 LYS NZ 1 1 20 21754 1 1 39 LYS O O -1.535 -4.256 4.094 1.00 . A A . 39 LYS O 1 1 20 21755 1 1 40 GLY C C 0.588 -3.587 6.698 1.00 . A A . 40 GLY C 1 1 20 21756 1 1 40 GLY CA C -0.446 -2.661 6.082 1.00 . A A . 40 GLY CA 1 1 20 21757 1 1 40 GLY H H -2.391 -3.022 6.819 1.00 . A A . 40 GLY H 1 1 20 21758 1 1 40 GLY HA2 H -0.159 -2.457 5.065 1.00 . A A . 40 GLY HA2 1 1 20 21759 1 1 40 GLY HA3 H -0.456 -1.735 6.636 1.00 . A A . 40 GLY HA3 1 1 20 21760 1 1 40 GLY N N -1.781 -3.225 6.084 1.00 . A A . 40 GLY N 1 1 20 21761 1 1 40 GLY O O 1.504 -3.138 7.385 1.00 . A A . 40 GLY O 1 1 20 21762 1 1 41 VAL C C 2.136 -6.517 5.817 1.00 . A A . 41 VAL C 1 1 20 21763 1 1 41 VAL CA C 1.371 -5.874 6.969 1.00 . A A . 41 VAL CA 1 1 20 21764 1 1 41 VAL CB C 0.663 -6.987 7.757 1.00 . A A . 41 VAL CB 1 1 20 21765 1 1 41 VAL CG1 C 1.656 -7.740 8.630 1.00 . A A . 41 VAL CG1 1 1 20 21766 1 1 41 VAL CG2 C -0.472 -6.417 8.594 1.00 . A A . 41 VAL CG2 1 1 20 21767 1 1 41 VAL H H -0.330 -5.188 5.933 1.00 . A A . 41 VAL H 1 1 20 21768 1 1 41 VAL HA H 2.069 -5.375 7.625 1.00 . A A . 41 VAL HA 1 1 20 21769 1 1 41 VAL HB H 0.247 -7.685 7.047 1.00 . A A . 41 VAL HB 1 1 20 21770 1 1 41 VAL HG11 H 2.129 -7.051 9.315 1.00 . A A . 41 VAL HG11 1 1 20 21771 1 1 41 VAL HG12 H 2.407 -8.199 8.004 1.00 . A A . 41 VAL HG12 1 1 20 21772 1 1 41 VAL HG13 H 1.136 -8.504 9.189 1.00 . A A . 41 VAL HG13 1 1 20 21773 1 1 41 VAL HG21 H -1.035 -7.226 9.036 1.00 . A A . 41 VAL HG21 1 1 20 21774 1 1 41 VAL HG22 H -1.123 -5.828 7.964 1.00 . A A . 41 VAL HG22 1 1 20 21775 1 1 41 VAL HG23 H -0.066 -5.792 9.375 1.00 . A A . 41 VAL HG23 1 1 20 21776 1 1 41 VAL N N 0.432 -4.886 6.463 1.00 . A A . 41 VAL N 1 1 20 21777 1 1 41 VAL O O 2.976 -7.390 6.033 1.00 . A A . 41 VAL O 1 1 20 21778 1 1 42 HIS C C 3.946 -6.210 3.419 1.00 . A A . 42 HIS C 1 1 20 21779 1 1 42 HIS CA C 2.494 -6.615 3.409 1.00 . A A . 42 HIS CA 1 1 20 21780 1 1 42 HIS CB C 1.778 -6.125 2.152 1.00 . A A . 42 HIS CB 1 1 20 21781 1 1 42 HIS CD2 C 0.086 -8.059 1.798 1.00 . A A . 42 HIS CD2 1 1 20 21782 1 1 42 HIS CE1 C 0.513 -8.476 -0.312 1.00 . A A . 42 HIS CE1 1 1 20 21783 1 1 42 HIS CG C 1.060 -7.205 1.403 1.00 . A A . 42 HIS CG 1 1 20 21784 1 1 42 HIS H H 1.161 -5.389 4.473 1.00 . A A . 42 HIS H 1 1 20 21785 1 1 42 HIS HA H 2.451 -7.682 3.455 1.00 . A A . 42 HIS HA 1 1 20 21786 1 1 42 HIS HB2 H 1.042 -5.382 2.439 1.00 . A A . 42 HIS HB2 1 1 20 21787 1 1 42 HIS HB3 H 2.498 -5.675 1.485 1.00 . A A . 42 HIS HB3 1 1 20 21788 1 1 42 HIS HD1 H 1.961 -7.043 -0.496 1.00 . A A . 42 HIS HD1 1 1 20 21789 1 1 42 HIS HD2 H -0.355 -8.117 2.782 1.00 . A A . 42 HIS HD2 1 1 20 21790 1 1 42 HIS HE1 H 0.482 -8.910 -1.300 1.00 . A A . 42 HIS HE1 1 1 20 21791 1 1 42 HIS HE2 H -0.865 -9.588 0.718 1.00 . A A . 42 HIS HE2 1 1 20 21792 1 1 42 HIS N N 1.833 -6.087 4.588 1.00 . A A . 42 HIS N 1 1 20 21793 1 1 42 HIS ND1 N 1.306 -7.493 0.076 1.00 . A A . 42 HIS ND1 1 1 20 21794 1 1 42 HIS NE2 N -0.235 -8.837 0.714 1.00 . A A . 42 HIS NE2 1 1 20 21795 1 1 42 HIS O O 4.376 -5.331 2.676 1.00 . A A . 42 HIS O 1 1 20 21796 1 1 43 VAL C C 6.939 -6.742 3.205 1.00 . A A . 43 VAL C 1 1 20 21797 1 1 43 VAL CA C 6.104 -6.657 4.470 1.00 . A A . 43 VAL CA 1 1 20 21798 1 1 43 VAL CB C 6.682 -7.615 5.527 1.00 . A A . 43 VAL CB 1 1 20 21799 1 1 43 VAL CG1 C 6.481 -9.065 5.110 1.00 . A A . 43 VAL CG1 1 1 20 21800 1 1 43 VAL CG2 C 8.155 -7.324 5.783 1.00 . A A . 43 VAL CG2 1 1 20 21801 1 1 43 VAL H H 4.248 -7.613 4.788 1.00 . A A . 43 VAL H 1 1 20 21802 1 1 43 VAL HA H 6.194 -5.661 4.853 1.00 . A A . 43 VAL HA 1 1 20 21803 1 1 43 VAL HB H 6.143 -7.456 6.449 1.00 . A A . 43 VAL HB 1 1 20 21804 1 1 43 VAL HG11 H 5.483 -9.192 4.717 1.00 . A A . 43 VAL HG11 1 1 20 21805 1 1 43 VAL HG12 H 6.613 -9.707 5.967 1.00 . A A . 43 VAL HG12 1 1 20 21806 1 1 43 VAL HG13 H 7.203 -9.326 4.350 1.00 . A A . 43 VAL HG13 1 1 20 21807 1 1 43 VAL HG21 H 8.266 -6.307 6.128 1.00 . A A . 43 VAL HG21 1 1 20 21808 1 1 43 VAL HG22 H 8.713 -7.457 4.869 1.00 . A A . 43 VAL HG22 1 1 20 21809 1 1 43 VAL HG23 H 8.530 -8.001 6.535 1.00 . A A . 43 VAL HG23 1 1 20 21810 1 1 43 VAL N N 4.687 -6.909 4.261 1.00 . A A . 43 VAL N 1 1 20 21811 1 1 43 VAL O O 7.667 -7.707 2.981 1.00 . A A . 43 VAL O 1 1 20 21812 1 1 44 ALA C C 8.902 -4.851 1.504 1.00 . A A . 44 ALA C 1 1 20 21813 1 1 44 ALA CA C 7.622 -5.600 1.179 1.00 . A A . 44 ALA CA 1 1 20 21814 1 1 44 ALA CB C 6.843 -4.896 0.079 1.00 . A A . 44 ALA CB 1 1 20 21815 1 1 44 ALA H H 6.189 -5.002 2.598 1.00 . A A . 44 ALA H 1 1 20 21816 1 1 44 ALA HA H 7.874 -6.594 0.850 1.00 . A A . 44 ALA HA 1 1 20 21817 1 1 44 ALA HB1 H 7.498 -4.703 -0.757 1.00 . A A . 44 ALA HB1 1 1 20 21818 1 1 44 ALA HB2 H 6.454 -3.963 0.455 1.00 . A A . 44 ALA HB2 1 1 20 21819 1 1 44 ALA HB3 H 6.026 -5.525 -0.242 1.00 . A A . 44 ALA HB3 1 1 20 21820 1 1 44 ALA N N 6.831 -5.707 2.386 1.00 . A A . 44 ALA N 1 1 20 21821 1 1 44 ALA O O 9.271 -3.888 0.832 1.00 . A A . 44 ALA O 1 1 20 21822 1 1 45 GLU C C 11.777 -4.511 1.867 1.00 . A A . 45 GLU C 1 1 20 21823 1 1 45 GLU CA C 10.813 -4.708 3.021 1.00 . A A . 45 GLU CA 1 1 20 21824 1 1 45 GLU CB C 11.461 -5.570 4.107 1.00 . A A . 45 GLU CB 1 1 20 21825 1 1 45 GLU CD C 10.976 -7.783 2.983 1.00 . A A . 45 GLU CD 1 1 20 21826 1 1 45 GLU CG C 12.033 -6.882 3.592 1.00 . A A . 45 GLU CG 1 1 20 21827 1 1 45 GLU H H 9.232 -6.103 3.014 1.00 . A A . 45 GLU H 1 1 20 21828 1 1 45 GLU HA H 10.568 -3.741 3.438 1.00 . A A . 45 GLU HA 1 1 20 21829 1 1 45 GLU HB2 H 12.262 -5.009 4.564 1.00 . A A . 45 GLU HB2 1 1 20 21830 1 1 45 GLU HB3 H 10.719 -5.798 4.859 1.00 . A A . 45 GLU HB3 1 1 20 21831 1 1 45 GLU HG2 H 12.775 -6.665 2.839 1.00 . A A . 45 GLU HG2 1 1 20 21832 1 1 45 GLU HG3 H 12.498 -7.405 4.415 1.00 . A A . 45 GLU HG3 1 1 20 21833 1 1 45 GLU N N 9.574 -5.316 2.554 1.00 . A A . 45 GLU N 1 1 20 21834 1 1 45 GLU O O 12.669 -3.670 1.928 1.00 . A A . 45 GLU O 1 1 20 21835 1 1 45 GLU OE1 O 10.339 -8.547 3.738 1.00 . A A . 45 GLU OE1 1 1 20 21836 1 1 45 GLU OE2 O 10.786 -7.725 1.750 1.00 . A A . 45 GLU OE2 1 1 20 21837 1 1 46 ASP C C 12.204 -3.860 -1.045 1.00 . A A . 46 ASP C 1 1 20 21838 1 1 46 ASP CA C 12.451 -5.195 -0.357 1.00 . A A . 46 ASP CA 1 1 20 21839 1 1 46 ASP CB C 12.171 -6.343 -1.322 1.00 . A A . 46 ASP CB 1 1 20 21840 1 1 46 ASP CG C 13.117 -6.350 -2.506 1.00 . A A . 46 ASP CG 1 1 20 21841 1 1 46 ASP H H 10.905 -5.995 0.853 1.00 . A A . 46 ASP H 1 1 20 21842 1 1 46 ASP HA H 13.484 -5.239 -0.041 1.00 . A A . 46 ASP HA 1 1 20 21843 1 1 46 ASP HB2 H 12.275 -7.279 -0.795 1.00 . A A . 46 ASP HB2 1 1 20 21844 1 1 46 ASP HB3 H 11.161 -6.251 -1.690 1.00 . A A . 46 ASP HB3 1 1 20 21845 1 1 46 ASP N N 11.607 -5.308 0.823 1.00 . A A . 46 ASP N 1 1 20 21846 1 1 46 ASP O O 13.138 -3.126 -1.342 1.00 . A A . 46 ASP O 1 1 20 21847 1 1 46 ASP OD1 O 12.825 -5.655 -3.503 1.00 . A A . 46 ASP OD1 1 1 20 21848 1 1 46 ASP OD2 O 14.151 -7.047 -2.438 1.00 . A A . 46 ASP OD2 1 1 20 21849 1 1 47 VAL C C 11.163 -1.103 -1.173 1.00 . A A . 47 VAL C 1 1 20 21850 1 1 47 VAL CA C 10.568 -2.291 -1.926 1.00 . A A . 47 VAL CA 1 1 20 21851 1 1 47 VAL CB C 9.039 -2.132 -2.000 1.00 . A A . 47 VAL CB 1 1 20 21852 1 1 47 VAL CG1 C 8.665 -0.826 -2.682 1.00 . A A . 47 VAL CG1 1 1 20 21853 1 1 47 VAL CG2 C 8.416 -3.314 -2.724 1.00 . A A . 47 VAL CG2 1 1 20 21854 1 1 47 VAL H H 10.228 -4.168 -0.998 1.00 . A A . 47 VAL H 1 1 20 21855 1 1 47 VAL HA H 10.962 -2.303 -2.932 1.00 . A A . 47 VAL HA 1 1 20 21856 1 1 47 VAL HB H 8.651 -2.107 -0.992 1.00 . A A . 47 VAL HB 1 1 20 21857 1 1 47 VAL HG11 H 7.751 -0.962 -3.243 1.00 . A A . 47 VAL HG11 1 1 20 21858 1 1 47 VAL HG12 H 9.458 -0.527 -3.350 1.00 . A A . 47 VAL HG12 1 1 20 21859 1 1 47 VAL HG13 H 8.516 -0.064 -1.934 1.00 . A A . 47 VAL HG13 1 1 20 21860 1 1 47 VAL HG21 H 7.341 -3.209 -2.727 1.00 . A A . 47 VAL HG21 1 1 20 21861 1 1 47 VAL HG22 H 8.686 -4.229 -2.217 1.00 . A A . 47 VAL HG22 1 1 20 21862 1 1 47 VAL HG23 H 8.779 -3.345 -3.741 1.00 . A A . 47 VAL HG23 1 1 20 21863 1 1 47 VAL N N 10.936 -3.545 -1.277 1.00 . A A . 47 VAL N 1 1 20 21864 1 1 47 VAL O O 11.618 -0.147 -1.776 1.00 . A A . 47 VAL O 1 1 20 21865 1 1 48 ALA C C 13.184 -0.264 1.143 1.00 . A A . 48 ALA C 1 1 20 21866 1 1 48 ALA CA C 11.667 -0.227 1.096 1.00 . A A . 48 ALA CA 1 1 20 21867 1 1 48 ALA CB C 11.103 -0.500 2.483 1.00 . A A . 48 ALA CB 1 1 20 21868 1 1 48 ALA H H 10.800 -2.031 0.507 1.00 . A A . 48 ALA H 1 1 20 21869 1 1 48 ALA HA H 11.340 0.753 0.796 1.00 . A A . 48 ALA HA 1 1 20 21870 1 1 48 ALA HB1 H 11.514 0.212 3.184 1.00 . A A . 48 ALA HB1 1 1 20 21871 1 1 48 ALA HB2 H 11.369 -1.500 2.788 1.00 . A A . 48 ALA HB2 1 1 20 21872 1 1 48 ALA HB3 H 10.028 -0.403 2.459 1.00 . A A . 48 ALA HB3 1 1 20 21873 1 1 48 ALA N N 11.154 -1.225 0.152 1.00 . A A . 48 ALA N 1 1 20 21874 1 1 48 ALA O O 13.852 0.727 0.850 1.00 . A A . 48 ALA O 1 1 20 21875 1 1 49 LYS C C 15.771 -1.273 0.228 1.00 . A A . 49 LYS C 1 1 20 21876 1 1 49 LYS CA C 15.164 -1.594 1.585 1.00 . A A . 49 LYS CA 1 1 20 21877 1 1 49 LYS CB C 15.512 -3.023 2.011 1.00 . A A . 49 LYS CB 1 1 20 21878 1 1 49 LYS CD C 17.755 -3.653 1.058 1.00 . A A . 49 LYS CD 1 1 20 21879 1 1 49 LYS CE C 17.285 -5.004 0.545 1.00 . A A . 49 LYS CE 1 1 20 21880 1 1 49 LYS CG C 16.989 -3.232 2.303 1.00 . A A . 49 LYS CG 1 1 20 21881 1 1 49 LYS H H 13.137 -2.173 1.736 1.00 . A A . 49 LYS H 1 1 20 21882 1 1 49 LYS HA H 15.548 -0.900 2.317 1.00 . A A . 49 LYS HA 1 1 20 21883 1 1 49 LYS HB2 H 14.954 -3.265 2.904 1.00 . A A . 49 LYS HB2 1 1 20 21884 1 1 49 LYS HB3 H 15.222 -3.701 1.223 1.00 . A A . 49 LYS HB3 1 1 20 21885 1 1 49 LYS HD2 H 17.606 -2.915 0.287 1.00 . A A . 49 LYS HD2 1 1 20 21886 1 1 49 LYS HD3 H 18.806 -3.716 1.300 1.00 . A A . 49 LYS HD3 1 1 20 21887 1 1 49 LYS HE2 H 16.293 -4.894 0.134 1.00 . A A . 49 LYS HE2 1 1 20 21888 1 1 49 LYS HE3 H 17.960 -5.336 -0.229 1.00 . A A . 49 LYS HE3 1 1 20 21889 1 1 49 LYS HG2 H 17.407 -2.308 2.672 1.00 . A A . 49 LYS HG2 1 1 20 21890 1 1 49 LYS HG3 H 17.091 -4.001 3.054 1.00 . A A . 49 LYS HG3 1 1 20 21891 1 1 49 LYS HZ1 H 16.568 -5.745 2.362 1.00 . A A . 49 LYS HZ1 1 1 20 21892 1 1 49 LYS HZ2 H 18.192 -6.117 2.061 1.00 . A A . 49 LYS HZ2 1 1 20 21893 1 1 49 LYS HZ3 H 16.968 -6.947 1.241 1.00 . A A . 49 LYS HZ3 1 1 20 21894 1 1 49 LYS N N 13.723 -1.420 1.516 1.00 . A A . 49 LYS N 1 1 20 21895 1 1 49 LYS NZ N 17.251 -6.025 1.628 1.00 . A A . 49 LYS NZ 1 1 20 21896 1 1 49 LYS O O 16.921 -0.851 0.125 1.00 . A A . 49 LYS O 1 1 20 21897 1 1 50 ASP C C 15.005 0.229 -2.535 1.00 . A A . 50 ASP C 1 1 20 21898 1 1 50 ASP CA C 15.412 -1.194 -2.170 1.00 . A A . 50 ASP CA 1 1 20 21899 1 1 50 ASP CB C 14.807 -2.189 -3.161 1.00 . A A . 50 ASP CB 1 1 20 21900 1 1 50 ASP CG C 15.517 -2.178 -4.501 1.00 . A A . 50 ASP CG 1 1 20 21901 1 1 50 ASP H H 14.083 -1.846 -0.673 1.00 . A A . 50 ASP H 1 1 20 21902 1 1 50 ASP HA H 16.490 -1.270 -2.201 1.00 . A A . 50 ASP HA 1 1 20 21903 1 1 50 ASP HB2 H 14.871 -3.186 -2.745 1.00 . A A . 50 ASP HB2 1 1 20 21904 1 1 50 ASP HB3 H 13.768 -1.938 -3.322 1.00 . A A . 50 ASP HB3 1 1 20 21905 1 1 50 ASP N N 14.982 -1.487 -0.818 1.00 . A A . 50 ASP N 1 1 20 21906 1 1 50 ASP O O 15.607 0.853 -3.409 1.00 . A A . 50 ASP O 1 1 20 21907 1 1 50 ASP OD1 O 15.111 -1.392 -5.382 1.00 . A A . 50 ASP OD1 1 1 20 21908 1 1 50 ASP OD2 O 16.479 -2.956 -4.668 1.00 . A A . 50 ASP OD2 1 1 20 21909 1 1 51 TYR C C 14.520 3.105 -1.631 1.00 . A A . 51 TYR C 1 1 20 21910 1 1 51 TYR CA C 13.509 2.093 -2.130 1.00 . A A . 51 TYR CA 1 1 20 21911 1 1 51 TYR CB C 12.174 2.410 -1.466 1.00 . A A . 51 TYR CB 1 1 20 21912 1 1 51 TYR CD1 C 11.168 3.152 -3.664 1.00 . A A . 51 TYR CD1 1 1 20 21913 1 1 51 TYR CD2 C 9.780 1.978 -2.123 1.00 . A A . 51 TYR CD2 1 1 20 21914 1 1 51 TYR CE1 C 10.112 3.242 -4.551 1.00 . A A . 51 TYR CE1 1 1 20 21915 1 1 51 TYR CE2 C 8.720 2.064 -3.004 1.00 . A A . 51 TYR CE2 1 1 20 21916 1 1 51 TYR CG C 11.020 2.519 -2.436 1.00 . A A . 51 TYR CG 1 1 20 21917 1 1 51 TYR CZ C 8.903 2.742 -4.226 1.00 . A A . 51 TYR CZ 1 1 20 21918 1 1 51 TYR H H 13.503 0.196 -1.200 1.00 . A A . 51 TYR H 1 1 20 21919 1 1 51 TYR HA H 13.386 2.172 -3.181 1.00 . A A . 51 TYR HA 1 1 20 21920 1 1 51 TYR HB2 H 11.954 1.649 -0.767 1.00 . A A . 51 TYR HB2 1 1 20 21921 1 1 51 TYR HB3 H 12.248 3.354 -0.942 1.00 . A A . 51 TYR HB3 1 1 20 21922 1 1 51 TYR HD1 H 12.125 3.580 -3.923 1.00 . A A . 51 TYR HD1 1 1 20 21923 1 1 51 TYR HD2 H 9.648 1.482 -1.172 1.00 . A A . 51 TYR HD2 1 1 20 21924 1 1 51 TYR HE1 H 10.247 3.737 -5.501 1.00 . A A . 51 TYR HE1 1 1 20 21925 1 1 51 TYR HE2 H 7.765 1.635 -2.740 1.00 . A A . 51 TYR HE2 1 1 20 21926 1 1 51 TYR HH H 8.132 2.537 -5.975 1.00 . A A . 51 TYR HH 1 1 20 21927 1 1 51 TYR N N 13.967 0.741 -1.866 1.00 . A A . 51 TYR N 1 1 20 21928 1 1 51 TYR O O 15.198 3.781 -2.405 1.00 . A A . 51 TYR O 1 1 20 21929 1 1 51 TYR OH O 7.837 2.784 -5.096 1.00 . A A . 51 TYR OH 1 1 20 21930 1 1 52 GLU C C 16.911 3.589 0.442 1.00 . A A . 52 GLU C 1 1 20 21931 1 1 52 GLU CA C 15.486 4.123 0.355 1.00 . A A . 52 GLU CA 1 1 20 21932 1 1 52 GLU CB C 14.963 4.438 1.758 1.00 . A A . 52 GLU CB 1 1 20 21933 1 1 52 GLU CD C 14.471 3.589 4.086 1.00 . A A . 52 GLU CD 1 1 20 21934 1 1 52 GLU CG C 15.062 3.270 2.727 1.00 . A A . 52 GLU CG 1 1 20 21935 1 1 52 GLU H H 14.050 2.586 0.238 1.00 . A A . 52 GLU H 1 1 20 21936 1 1 52 GLU HA H 15.480 5.022 -0.224 1.00 . A A . 52 GLU HA 1 1 20 21937 1 1 52 GLU HB2 H 15.527 5.264 2.164 1.00 . A A . 52 GLU HB2 1 1 20 21938 1 1 52 GLU HB3 H 13.924 4.725 1.684 1.00 . A A . 52 GLU HB3 1 1 20 21939 1 1 52 GLU HG2 H 14.532 2.426 2.310 1.00 . A A . 52 GLU HG2 1 1 20 21940 1 1 52 GLU HG3 H 16.103 3.013 2.854 1.00 . A A . 52 GLU HG3 1 1 20 21941 1 1 52 GLU N N 14.602 3.186 -0.308 1.00 . A A . 52 GLU N 1 1 20 21942 1 1 52 GLU O O 17.871 4.287 0.117 1.00 . A A . 52 GLU O 1 1 20 21943 1 1 52 GLU OE1 O 15.183 4.196 4.914 1.00 . A A . 52 GLU OE1 1 1 20 21944 1 1 52 GLU OE2 O 13.298 3.233 4.322 1.00 . A A . 52 GLU OE2 1 1 20 21945 1 1 53 ASP C C 18.890 1.231 -0.303 1.00 . A A . 53 ASP C 1 1 20 21946 1 1 53 ASP CA C 18.337 1.707 1.037 1.00 . A A . 53 ASP CA 1 1 20 21947 1 1 53 ASP CB C 18.217 0.533 2.006 1.00 . A A . 53 ASP CB 1 1 20 21948 1 1 53 ASP CG C 18.577 0.916 3.428 1.00 . A A . 53 ASP CG 1 1 20 21949 1 1 53 ASP H H 16.229 1.840 1.116 1.00 . A A . 53 ASP H 1 1 20 21950 1 1 53 ASP HA H 19.016 2.435 1.452 1.00 . A A . 53 ASP HA 1 1 20 21951 1 1 53 ASP HB2 H 17.194 0.182 1.999 1.00 . A A . 53 ASP HB2 1 1 20 21952 1 1 53 ASP HB3 H 18.873 -0.263 1.685 1.00 . A A . 53 ASP HB3 1 1 20 21953 1 1 53 ASP N N 17.036 2.346 0.884 1.00 . A A . 53 ASP N 1 1 20 21954 1 1 53 ASP O O 20.103 1.106 -0.472 1.00 . A A . 53 ASP O 1 1 20 21955 1 1 53 ASP OD1 O 17.669 1.332 4.178 1.00 . A A . 53 ASP OD1 1 1 20 21956 1 1 53 ASP OD2 O 19.766 0.797 3.792 1.00 . A A . 53 ASP OD2 1 1 20 21957 1 1 54 GLY C C 18.976 1.639 -3.412 1.00 . A A . 54 GLY C 1 1 20 21958 1 1 54 GLY CA C 18.432 0.511 -2.561 1.00 . A A . 54 GLY CA 1 1 20 21959 1 1 54 GLY H H 17.045 1.082 -1.066 1.00 . A A . 54 GLY H 1 1 20 21960 1 1 54 GLY HA2 H 19.205 -0.232 -2.433 1.00 . A A . 54 GLY HA2 1 1 20 21961 1 1 54 GLY HA3 H 17.597 0.060 -3.071 1.00 . A A . 54 GLY HA3 1 1 20 21962 1 1 54 GLY N N 17.999 0.967 -1.253 1.00 . A A . 54 GLY N 1 1 20 21963 1 1 54 GLY O O 20.108 1.574 -3.892 1.00 . A A . 54 GLY O 1 1 20 21964 1 1 55 LEU C C 19.751 4.545 -3.735 1.00 . A A . 55 LEU C 1 1 20 21965 1 1 55 LEU CA C 18.580 3.827 -4.396 1.00 . A A . 55 LEU CA 1 1 20 21966 1 1 55 LEU CB C 17.408 4.792 -4.584 1.00 . A A . 55 LEU CB 1 1 20 21967 1 1 55 LEU CD1 C 15.108 5.257 -5.461 1.00 . A A . 55 LEU CD1 1 1 20 21968 1 1 55 LEU CD2 C 16.592 3.631 -6.649 1.00 . A A . 55 LEU CD2 1 1 20 21969 1 1 55 LEU CG C 16.191 4.203 -5.297 1.00 . A A . 55 LEU CG 1 1 20 21970 1 1 55 LEU H H 17.276 2.672 -3.193 1.00 . A A . 55 LEU H 1 1 20 21971 1 1 55 LEU HA H 18.895 3.464 -5.362 1.00 . A A . 55 LEU HA 1 1 20 21972 1 1 55 LEU HB2 H 17.096 5.139 -3.609 1.00 . A A . 55 LEU HB2 1 1 20 21973 1 1 55 LEU HB3 H 17.755 5.641 -5.154 1.00 . A A . 55 LEU HB3 1 1 20 21974 1 1 55 LEU HD11 H 14.246 4.816 -5.942 1.00 . A A . 55 LEU HD11 1 1 20 21975 1 1 55 LEU HD12 H 15.484 6.066 -6.069 1.00 . A A . 55 LEU HD12 1 1 20 21976 1 1 55 LEU HD13 H 14.825 5.636 -4.491 1.00 . A A . 55 LEU HD13 1 1 20 21977 1 1 55 LEU HD21 H 17.015 4.414 -7.260 1.00 . A A . 55 LEU HD21 1 1 20 21978 1 1 55 LEU HD22 H 15.719 3.224 -7.140 1.00 . A A . 55 LEU HD22 1 1 20 21979 1 1 55 LEU HD23 H 17.323 2.848 -6.508 1.00 . A A . 55 LEU HD23 1 1 20 21980 1 1 55 LEU HG H 15.787 3.398 -4.700 1.00 . A A . 55 LEU HG 1 1 20 21981 1 1 55 LEU N N 18.169 2.678 -3.600 1.00 . A A . 55 LEU N 1 1 20 21982 1 1 55 LEU O O 20.860 4.568 -4.269 1.00 . A A . 55 LEU O 1 1 20 21983 1 1 56 GLU C C 21.300 4.889 -0.922 1.00 . A A . 56 GLU C 1 1 20 21984 1 1 56 GLU CA C 20.537 5.842 -1.832 1.00 . A A . 56 GLU CA 1 1 20 21985 1 1 56 GLU CB C 19.928 6.974 -1.012 1.00 . A A . 56 GLU CB 1 1 20 21986 1 1 56 GLU CD C 19.737 8.546 -2.982 1.00 . A A . 56 GLU CD 1 1 20 21987 1 1 56 GLU CG C 19.020 7.890 -1.817 1.00 . A A . 56 GLU CG 1 1 20 21988 1 1 56 GLU H H 18.596 5.078 -2.191 1.00 . A A . 56 GLU H 1 1 20 21989 1 1 56 GLU HA H 21.222 6.258 -2.549 1.00 . A A . 56 GLU HA 1 1 20 21990 1 1 56 GLU HB2 H 19.352 6.546 -0.212 1.00 . A A . 56 GLU HB2 1 1 20 21991 1 1 56 GLU HB3 H 20.725 7.570 -0.593 1.00 . A A . 56 GLU HB3 1 1 20 21992 1 1 56 GLU HG2 H 18.196 7.310 -2.203 1.00 . A A . 56 GLU HG2 1 1 20 21993 1 1 56 GLU HG3 H 18.641 8.664 -1.165 1.00 . A A . 56 GLU HG3 1 1 20 21994 1 1 56 GLU N N 19.500 5.129 -2.566 1.00 . A A . 56 GLU N 1 1 20 21995 1 1 56 GLU O O 21.352 5.076 0.294 1.00 . A A . 56 GLU O 1 1 20 21996 1 1 56 GLU OE1 O 19.764 7.945 -4.077 1.00 . A A . 56 GLU OE1 1 1 20 21997 1 1 56 GLU OE2 O 20.270 9.661 -2.799 1.00 . A A . 56 GLU OE2 1 1 20 21998 1 1 57 TYR C C 23.993 3.441 -0.325 1.00 . A A . 57 TYR C 1 1 20 21999 1 1 57 TYR CA C 22.655 2.871 -0.784 1.00 . A A . 57 TYR CA 1 1 20 22000 1 1 57 TYR CB C 22.880 1.631 -1.652 1.00 . A A . 57 TYR CB 1 1 20 22001 1 1 57 TYR CD1 C 22.843 -0.450 -0.218 1.00 . A A . 57 TYR CD1 1 1 20 22002 1 1 57 TYR CD2 C 24.955 0.370 -0.962 1.00 . A A . 57 TYR CD2 1 1 20 22003 1 1 57 TYR CE1 C 23.474 -1.485 0.445 1.00 . A A . 57 TYR CE1 1 1 20 22004 1 1 57 TYR CE2 C 25.593 -0.664 -0.302 1.00 . A A . 57 TYR CE2 1 1 20 22005 1 1 57 TYR CG C 23.572 0.495 -0.932 1.00 . A A . 57 TYR CG 1 1 20 22006 1 1 57 TYR CZ C 24.838 -1.603 0.385 1.00 . A A . 57 TYR CZ 1 1 20 22007 1 1 57 TYR H H 21.812 3.780 -2.497 1.00 . A A . 57 TYR H 1 1 20 22008 1 1 57 TYR HA H 22.080 2.591 0.085 1.00 . A A . 57 TYR HA 1 1 20 22009 1 1 57 TYR HB2 H 21.926 1.266 -2.001 1.00 . A A . 57 TYR HB2 1 1 20 22010 1 1 57 TYR HB3 H 23.488 1.903 -2.503 1.00 . A A . 57 TYR HB3 1 1 20 22011 1 1 57 TYR HD1 H 21.767 -0.366 -0.184 1.00 . A A . 57 TYR HD1 1 1 20 22012 1 1 57 TYR HD2 H 25.535 1.095 -1.513 1.00 . A A . 57 TYR HD2 1 1 20 22013 1 1 57 TYR HE1 H 22.891 -2.209 0.995 1.00 . A A . 57 TYR HE1 1 1 20 22014 1 1 57 TYR HE2 H 26.669 -0.744 -0.339 1.00 . A A . 57 TYR HE2 1 1 20 22015 1 1 57 TYR HH H 26.207 -2.265 1.578 1.00 . A A . 57 TYR HH 1 1 20 22016 1 1 57 TYR N N 21.891 3.867 -1.526 1.00 . A A . 57 TYR N 1 1 20 22017 1 1 57 TYR O O 24.976 3.328 -1.087 1.00 . A A . 57 TYR O 1 1 20 22018 1 1 57 TYR OXT O 24.047 3.998 0.791 1.00 . A A . 57 TYR OXT 1 1 20 22019 1 1 57 TYR OH O 25.480 -2.617 1.060 1.00 . A A . 57 TYR OH 1 1 20 22020 2 2 1 ALA C C -13.606 -9.512 2.565 1.00 . B B . 1 ALA C 1 1 20 22021 2 2 1 ALA CA C -13.718 -10.940 2.038 1.00 . B B . 1 ALA CA 1 1 20 22022 2 2 1 ALA CB C -14.517 -10.960 0.745 1.00 . B B . 1 ALA CB 1 1 20 22023 2 2 1 ALA H1 H -14.420 -12.799 2.670 1.00 . B B . 1 ALA H1 1 1 20 22024 2 2 1 ALA H2 H -15.299 -11.492 3.281 1.00 . B B . 1 ALA H2 1 1 20 22025 2 2 1 ALA H3 H -13.773 -11.852 3.913 1.00 . B B . 1 ALA H3 1 1 20 22026 2 2 1 ALA HA H -12.726 -11.314 1.825 1.00 . B B . 1 ALA HA 1 1 20 22027 2 2 1 ALA HB1 H -14.040 -10.319 0.018 1.00 . B B . 1 ALA HB1 1 1 20 22028 2 2 1 ALA HB2 H -15.519 -10.605 0.936 1.00 . B B . 1 ALA HB2 1 1 20 22029 2 2 1 ALA HB3 H -14.559 -11.969 0.363 1.00 . B B . 1 ALA HB3 1 1 20 22030 2 2 1 ALA N N -14.346 -11.832 3.045 1.00 . B B . 1 ALA N 1 1 20 22031 2 2 1 ALA O O -14.514 -9.016 3.232 1.00 . B B . 1 ALA O 1 1 20 22032 2 2 2 PRO C C -12.996 -6.432 1.850 1.00 . B B . 2 PRO C 1 1 20 22033 2 2 2 PRO CA C -12.257 -7.454 2.715 1.00 . B B . 2 PRO CA 1 1 20 22034 2 2 2 PRO CB C -10.747 -7.293 2.560 1.00 . B B . 2 PRO CB 1 1 20 22035 2 2 2 PRO CD C -11.351 -9.347 1.477 1.00 . B B . 2 PRO CD 1 1 20 22036 2 2 2 PRO CG C -10.392 -8.185 1.420 1.00 . B B . 2 PRO CG 1 1 20 22037 2 2 2 PRO HA H -12.531 -7.322 3.751 1.00 . B B . 2 PRO HA 1 1 20 22038 2 2 2 PRO HB2 H -10.513 -6.261 2.345 1.00 . B B . 2 PRO HB2 1 1 20 22039 2 2 2 PRO HB3 H -10.254 -7.600 3.470 1.00 . B B . 2 PRO HB3 1 1 20 22040 2 2 2 PRO HD2 H -11.671 -9.620 0.482 1.00 . B B . 2 PRO HD2 1 1 20 22041 2 2 2 PRO HD3 H -10.893 -10.191 1.971 1.00 . B B . 2 PRO HD3 1 1 20 22042 2 2 2 PRO HG2 H -10.506 -7.652 0.488 1.00 . B B . 2 PRO HG2 1 1 20 22043 2 2 2 PRO HG3 H -9.376 -8.535 1.532 1.00 . B B . 2 PRO HG3 1 1 20 22044 2 2 2 PRO N N -12.485 -8.829 2.269 1.00 . B B . 2 PRO N 1 1 20 22045 2 2 2 PRO O O -12.656 -6.240 0.683 1.00 . B B . 2 PRO O 1 1 20 22046 2 2 3 PRO C C -13.982 -3.512 1.351 1.00 . B B . 3 PRO C 1 1 20 22047 2 2 3 PRO CA C -14.800 -4.757 1.681 1.00 . B B . 3 PRO CA 1 1 20 22048 2 2 3 PRO CB C -15.937 -4.410 2.645 1.00 . B B . 3 PRO CB 1 1 20 22049 2 2 3 PRO CD C -14.489 -5.922 3.800 1.00 . B B . 3 PRO CD 1 1 20 22050 2 2 3 PRO CG C -15.410 -4.751 3.995 1.00 . B B . 3 PRO CG 1 1 20 22051 2 2 3 PRO HA H -15.210 -5.166 0.769 1.00 . B B . 3 PRO HA 1 1 20 22052 2 2 3 PRO HB2 H -16.171 -3.358 2.566 1.00 . B B . 3 PRO HB2 1 1 20 22053 2 2 3 PRO HB3 H -16.810 -4.998 2.402 1.00 . B B . 3 PRO HB3 1 1 20 22054 2 2 3 PRO HD2 H -13.665 -5.874 4.495 1.00 . B B . 3 PRO HD2 1 1 20 22055 2 2 3 PRO HD3 H -15.030 -6.850 3.915 1.00 . B B . 3 PRO HD3 1 1 20 22056 2 2 3 PRO HG2 H -14.867 -3.910 4.401 1.00 . B B . 3 PRO HG2 1 1 20 22057 2 2 3 PRO HG3 H -16.227 -5.021 4.650 1.00 . B B . 3 PRO HG3 1 1 20 22058 2 2 3 PRO N N -14.017 -5.759 2.412 1.00 . B B . 3 PRO N 1 1 20 22059 2 2 3 PRO O O -14.296 -2.412 1.807 1.00 . B B . 3 PRO O 1 1 20 22060 2 2 4 GLY C C -10.645 -2.983 -0.044 1.00 . B B . 4 GLY C 1 1 20 22061 2 2 4 GLY CA C -12.088 -2.573 0.178 1.00 . B B . 4 GLY CA 1 1 20 22062 2 2 4 GLY H H -12.726 -4.592 0.229 1.00 . B B . 4 GLY H 1 1 20 22063 2 2 4 GLY HA2 H -12.472 -2.143 -0.735 1.00 . B B . 4 GLY HA2 1 1 20 22064 2 2 4 GLY HA3 H -12.123 -1.827 0.957 1.00 . B B . 4 GLY HA3 1 1 20 22065 2 2 4 GLY N N -12.932 -3.692 0.557 1.00 . B B . 4 GLY N 1 1 20 22066 2 2 4 GLY O O -9.862 -3.062 0.903 1.00 . B B . 4 GLY O 1 1 20 22067 2 2 5 THR C C -8.602 -3.325 -3.095 1.00 . B B . 5 THR C 1 1 20 22068 2 2 5 THR CA C -8.938 -3.663 -1.646 1.00 . B B . 5 THR CA 1 1 20 22069 2 2 5 THR CB C -8.723 -5.171 -1.415 1.00 . B B . 5 THR CB 1 1 20 22070 2 2 5 THR CG2 C -8.846 -5.516 0.062 1.00 . B B . 5 THR CG2 1 1 20 22071 2 2 5 THR H H -10.961 -3.142 -2.005 1.00 . B B . 5 THR H 1 1 20 22072 2 2 5 THR HA H -8.256 -3.122 -1.007 1.00 . B B . 5 THR HA 1 1 20 22073 2 2 5 THR HB H -7.730 -5.433 -1.749 1.00 . B B . 5 THR HB 1 1 20 22074 2 2 5 THR HG1 H -9.261 -6.704 -2.532 1.00 . B B . 5 THR HG1 1 1 20 22075 2 2 5 THR HG21 H -8.116 -4.955 0.625 1.00 . B B . 5 THR HG21 1 1 20 22076 2 2 5 THR HG22 H -8.671 -6.574 0.200 1.00 . B B . 5 THR HG22 1 1 20 22077 2 2 5 THR HG23 H -9.838 -5.268 0.409 1.00 . B B . 5 THR HG23 1 1 20 22078 2 2 5 THR N N -10.298 -3.255 -1.296 1.00 . B B . 5 THR N 1 1 20 22079 2 2 5 THR O O -9.483 -3.280 -3.952 1.00 . B B . 5 THR O 1 1 20 22080 2 2 5 THR OG1 O -9.682 -5.924 -2.166 1.00 . B B . 5 THR OG1 1 1 20 22081 2 2 6 ALA C C -5.440 -3.255 -4.969 1.00 . B B . 6 ALA C 1 1 20 22082 2 2 6 ALA CA C -6.868 -2.774 -4.715 1.00 . B B . 6 ALA CA 1 1 20 22083 2 2 6 ALA CB C -6.966 -1.280 -4.963 1.00 . B B . 6 ALA CB 1 1 20 22084 2 2 6 ALA H H -6.663 -3.128 -2.635 1.00 . B B . 6 ALA H 1 1 20 22085 2 2 6 ALA HA H -7.530 -3.271 -5.409 1.00 . B B . 6 ALA HA 1 1 20 22086 2 2 6 ALA HB1 H -7.983 -0.954 -4.807 1.00 . B B . 6 ALA HB1 1 1 20 22087 2 2 6 ALA HB2 H -6.671 -1.062 -5.978 1.00 . B B . 6 ALA HB2 1 1 20 22088 2 2 6 ALA HB3 H -6.314 -0.757 -4.280 1.00 . B B . 6 ALA HB3 1 1 20 22089 2 2 6 ALA N N -7.317 -3.095 -3.363 1.00 . B B . 6 ALA N 1 1 20 22090 2 2 6 ALA O O -5.205 -4.088 -5.844 1.00 . B B . 6 ALA O 1 1 20 22091 2 2 7 ARG C C -2.594 -2.688 -5.747 1.00 . B B . 7 ARG C 1 1 20 22092 2 2 7 ARG CA C -3.082 -3.096 -4.362 1.00 . B B . 7 ARG CA 1 1 20 22093 2 2 7 ARG CB C -2.892 -4.602 -4.159 1.00 . B B . 7 ARG CB 1 1 20 22094 2 2 7 ARG CD C -1.314 -5.490 -5.916 1.00 . B B . 7 ARG CD 1 1 20 22095 2 2 7 ARG CG C -1.480 -5.089 -4.457 1.00 . B B . 7 ARG CG 1 1 20 22096 2 2 7 ARG CZ C -2.512 -6.804 -7.613 1.00 . B B . 7 ARG CZ 1 1 20 22097 2 2 7 ARG H H -4.741 -2.093 -3.502 1.00 . B B . 7 ARG H 1 1 20 22098 2 2 7 ARG HA H -2.510 -2.562 -3.617 1.00 . B B . 7 ARG HA 1 1 20 22099 2 2 7 ARG HB2 H -3.125 -4.847 -3.134 1.00 . B B . 7 ARG HB2 1 1 20 22100 2 2 7 ARG HB3 H -3.574 -5.129 -4.809 1.00 . B B . 7 ARG HB3 1 1 20 22101 2 2 7 ARG HD2 H -1.363 -4.607 -6.531 1.00 . B B . 7 ARG HD2 1 1 20 22102 2 2 7 ARG HD3 H -0.347 -5.956 -6.037 1.00 . B B . 7 ARG HD3 1 1 20 22103 2 2 7 ARG HE H -2.942 -6.796 -5.664 1.00 . B B . 7 ARG HE 1 1 20 22104 2 2 7 ARG HG2 H -0.783 -4.296 -4.234 1.00 . B B . 7 ARG HG2 1 1 20 22105 2 2 7 ARG HG3 H -1.266 -5.943 -3.831 1.00 . B B . 7 ARG HG3 1 1 20 22106 2 2 7 ARG HH11 H -0.999 -5.670 -8.329 1.00 . B B . 7 ARG HH11 1 1 20 22107 2 2 7 ARG HH12 H -1.850 -6.604 -9.513 1.00 . B B . 7 ARG HH12 1 1 20 22108 2 2 7 ARG HH21 H -4.071 -8.028 -7.219 1.00 . B B . 7 ARG HH21 1 1 20 22109 2 2 7 ARG HH22 H -3.595 -7.944 -8.882 1.00 . B B . 7 ARG HH22 1 1 20 22110 2 2 7 ARG N N -4.490 -2.731 -4.199 1.00 . B B . 7 ARG N 1 1 20 22111 2 2 7 ARG NE N -2.345 -6.428 -6.349 1.00 . B B . 7 ARG NE 1 1 20 22112 2 2 7 ARG NH1 N -1.723 -6.320 -8.563 1.00 . B B . 7 ARG NH1 1 1 20 22113 2 2 7 ARG NH2 N -3.472 -7.663 -7.931 1.00 . B B . 7 ARG NH2 1 1 20 22114 2 2 7 ARG O O -3.231 -3.008 -6.751 1.00 . B B . 7 ARG O 1 1 20 22115 2 2 8 ARG C C 0.556 -1.835 -7.259 1.00 . B B . 8 ARG C 1 1 20 22116 2 2 8 ARG CA C -0.937 -1.547 -7.102 1.00 . B B . 8 ARG CA 1 1 20 22117 2 2 8 ARG CB C -1.181 -0.052 -7.292 1.00 . B B . 8 ARG CB 1 1 20 22118 2 2 8 ARG CD C -0.103 2.182 -6.924 1.00 . B B . 8 ARG CD 1 1 20 22119 2 2 8 ARG CG C -0.387 0.814 -6.331 1.00 . B B . 8 ARG CG 1 1 20 22120 2 2 8 ARG CZ C 1.504 3.997 -6.502 1.00 . B B . 8 ARG CZ 1 1 20 22121 2 2 8 ARG H H -0.984 -1.749 -4.985 1.00 . B B . 8 ARG H 1 1 20 22122 2 2 8 ARG HA H -1.471 -2.083 -7.870 1.00 . B B . 8 ARG HA 1 1 20 22123 2 2 8 ARG HB2 H -0.907 0.221 -8.300 1.00 . B B . 8 ARG HB2 1 1 20 22124 2 2 8 ARG HB3 H -2.231 0.152 -7.144 1.00 . B B . 8 ARG HB3 1 1 20 22125 2 2 8 ARG HD2 H 0.376 2.051 -7.882 1.00 . B B . 8 ARG HD2 1 1 20 22126 2 2 8 ARG HD3 H -1.039 2.700 -7.059 1.00 . B B . 8 ARG HD3 1 1 20 22127 2 2 8 ARG HE H 0.804 2.746 -5.114 1.00 . B B . 8 ARG HE 1 1 20 22128 2 2 8 ARG HG2 H -0.956 0.939 -5.421 1.00 . B B . 8 ARG HG2 1 1 20 22129 2 2 8 ARG HG3 H 0.550 0.326 -6.108 1.00 . B B . 8 ARG HG3 1 1 20 22130 2 2 8 ARG HH11 H 0.876 3.849 -8.418 1.00 . B B . 8 ARG HH11 1 1 20 22131 2 2 8 ARG HH12 H 2.020 5.111 -8.108 1.00 . B B . 8 ARG HH12 1 1 20 22132 2 2 8 ARG HH21 H 2.309 4.407 -4.694 1.00 . B B . 8 ARG HH21 1 1 20 22133 2 2 8 ARG HH22 H 2.835 5.429 -5.991 1.00 . B B . 8 ARG HH22 1 1 20 22134 2 2 8 ARG N N -1.462 -1.985 -5.812 1.00 . B B . 8 ARG N 1 1 20 22135 2 2 8 ARG NE N 0.766 2.982 -6.064 1.00 . B B . 8 ARG NE 1 1 20 22136 2 2 8 ARG NH1 N 1.463 4.348 -7.780 1.00 . B B . 8 ARG NH1 1 1 20 22137 2 2 8 ARG NH2 N 2.279 4.667 -5.660 1.00 . B B . 8 ARG NH2 1 1 20 22138 2 2 8 ARG O O 1.310 -0.967 -7.700 1.00 . B B . 8 ARG O 1 1 20 22139 2 2 9 LYS C C 2.543 -4.915 -7.199 1.00 . B B . 9 LYS C 1 1 20 22140 2 2 9 LYS CA C 2.386 -3.404 -7.048 1.00 . B B . 9 LYS CA 1 1 20 22141 2 2 9 LYS CB C 3.203 -2.897 -5.854 1.00 . B B . 9 LYS CB 1 1 20 22142 2 2 9 LYS CD C 4.424 -0.978 -4.782 1.00 . B B . 9 LYS CD 1 1 20 22143 2 2 9 LYS CE C 5.104 0.355 -5.056 1.00 . B B . 9 LYS CE 1 1 20 22144 2 2 9 LYS CG C 3.588 -1.431 -5.968 1.00 . B B . 9 LYS CG 1 1 20 22145 2 2 9 LYS H H 0.362 -3.702 -6.549 1.00 . B B . 9 LYS H 1 1 20 22146 2 2 9 LYS HA H 2.746 -2.924 -7.944 1.00 . B B . 9 LYS HA 1 1 20 22147 2 2 9 LYS HB2 H 2.622 -3.027 -4.953 1.00 . B B . 9 LYS HB2 1 1 20 22148 2 2 9 LYS HB3 H 4.108 -3.481 -5.779 1.00 . B B . 9 LYS HB3 1 1 20 22149 2 2 9 LYS HD2 H 3.782 -0.873 -3.920 1.00 . B B . 9 LYS HD2 1 1 20 22150 2 2 9 LYS HD3 H 5.180 -1.723 -4.582 1.00 . B B . 9 LYS HD3 1 1 20 22151 2 2 9 LYS HE2 H 5.614 0.674 -4.159 1.00 . B B . 9 LYS HE2 1 1 20 22152 2 2 9 LYS HE3 H 5.824 0.219 -5.849 1.00 . B B . 9 LYS HE3 1 1 20 22153 2 2 9 LYS HG2 H 4.160 -1.288 -6.873 1.00 . B B . 9 LYS HG2 1 1 20 22154 2 2 9 LYS HG3 H 2.689 -0.834 -6.010 1.00 . B B . 9 LYS HG3 1 1 20 22155 2 2 9 LYS HZ1 H 3.573 1.088 -6.276 1.00 . B B . 9 LYS HZ1 1 1 20 22156 2 2 9 LYS HZ2 H 4.635 2.281 -5.717 1.00 . B B . 9 LYS HZ2 1 1 20 22157 2 2 9 LYS HZ3 H 3.483 1.618 -4.673 1.00 . B B . 9 LYS HZ3 1 1 20 22158 2 2 9 LYS N N 0.988 -3.043 -6.908 1.00 . B B . 9 LYS N 1 1 20 22159 2 2 9 LYS NZ N 4.130 1.408 -5.458 1.00 . B B . 9 LYS NZ 1 1 20 22160 2 2 9 LYS O O 1.559 -5.655 -7.149 1.00 . B B . 9 LYS O 1 1 20 22161 2 2 10 ARG C C 3.793 -7.534 -6.236 1.00 . B B . 10 ARG C 1 1 20 22162 2 2 10 ARG CA C 4.051 -6.792 -7.540 1.00 . B B . 10 ARG CA 1 1 20 22163 2 2 10 ARG CB C 5.504 -6.980 -7.936 1.00 . B B . 10 ARG CB 1 1 20 22164 2 2 10 ARG CD C 7.729 -6.944 -6.774 1.00 . B B . 10 ARG CD 1 1 20 22165 2 2 10 ARG CG C 6.435 -6.194 -7.039 1.00 . B B . 10 ARG CG 1 1 20 22166 2 2 10 ARG CZ C 9.862 -6.602 -5.603 1.00 . B B . 10 ARG CZ 1 1 20 22167 2 2 10 ARG H H 4.528 -4.743 -7.401 1.00 . B B . 10 ARG H 1 1 20 22168 2 2 10 ARG HA H 3.414 -7.184 -8.313 1.00 . B B . 10 ARG HA 1 1 20 22169 2 2 10 ARG HB2 H 5.758 -8.028 -7.867 1.00 . B B . 10 ARG HB2 1 1 20 22170 2 2 10 ARG HB3 H 5.642 -6.644 -8.952 1.00 . B B . 10 ARG HB3 1 1 20 22171 2 2 10 ARG HD2 H 7.496 -7.868 -6.265 1.00 . B B . 10 ARG HD2 1 1 20 22172 2 2 10 ARG HD3 H 8.202 -7.164 -7.719 1.00 . B B . 10 ARG HD3 1 1 20 22173 2 2 10 ARG HE H 8.360 -5.289 -5.642 1.00 . B B . 10 ARG HE 1 1 20 22174 2 2 10 ARG HG2 H 6.663 -5.255 -7.517 1.00 . B B . 10 ARG HG2 1 1 20 22175 2 2 10 ARG HG3 H 5.929 -6.004 -6.099 1.00 . B B . 10 ARG HG3 1 1 20 22176 2 2 10 ARG HH11 H 9.694 -8.369 -6.568 1.00 . B B . 10 ARG HH11 1 1 20 22177 2 2 10 ARG HH12 H 11.195 -8.114 -5.742 1.00 . B B . 10 ARG HH12 1 1 20 22178 2 2 10 ARG HH21 H 10.335 -4.943 -4.551 1.00 . B B . 10 ARG HH21 1 1 20 22179 2 2 10 ARG HH22 H 11.560 -6.167 -4.596 1.00 . B B . 10 ARG HH22 1 1 20 22180 2 2 10 ARG N N 3.776 -5.372 -7.383 1.00 . B B . 10 ARG N 1 1 20 22181 2 2 10 ARG NE N 8.653 -6.171 -5.949 1.00 . B B . 10 ARG NE 1 1 20 22182 2 2 10 ARG NH1 N 10.285 -7.793 -6.003 1.00 . B B . 10 ARG NH1 1 1 20 22183 2 2 10 ARG NH2 N 10.651 -5.842 -4.854 1.00 . B B . 10 ARG NH2 1 1 20 22184 2 2 10 ARG O O 3.486 -8.725 -6.231 1.00 . B B . 10 ARG O 1 1 20 22185 2 2 11 LYS C C 4.959 -8.185 -3.398 1.00 . B B . 11 LYS C 1 1 20 22186 2 2 11 LYS CA C 3.741 -7.366 -3.799 1.00 . B B . 11 LYS CA 1 1 20 22187 2 2 11 LYS CB C 2.479 -8.226 -3.730 1.00 . B B . 11 LYS CB 1 1 20 22188 2 2 11 LYS CD C -0.998 -7.206 0.670 1.00 . B B . 11 LYS CD 1 1 20 22189 2 2 11 LYS CE C 0.523 -7.241 0.646 1.00 . B B . 11 LYS CE 1 1 20 22190 2 2 11 LYS CG C -1.593 -8.147 -0.361 1.00 . B B . 11 LYS CG 1 1 20 22191 2 2 11 LYS H H 4.186 -5.865 -5.213 1.00 . B B . 11 LYS H 1 1 20 22192 2 2 11 LYS HA H 3.641 -6.538 -3.117 1.00 . B B . 11 LYS HA 1 1 20 22193 2 2 11 LYS HB2 H 2.275 -8.456 -2.694 1.00 . B B . 11 LYS HB2 1 1 20 22194 2 2 11 LYS HB3 H 2.651 -9.146 -4.267 1.00 . B B . 11 LYS HB3 1 1 20 22195 2 2 11 LYS HD2 H -1.328 -6.201 0.460 1.00 . B B . 11 LYS HD2 1 1 20 22196 2 2 11 LYS HD3 H -1.340 -7.503 1.649 1.00 . B B . 11 LYS HD3 1 1 20 22197 2 2 11 LYS HE2 H 0.859 -6.969 -0.344 1.00 . B B . 11 LYS HE2 1 1 20 22198 2 2 11 LYS HE3 H 0.851 -8.244 0.873 1.00 . B B . 11 LYS HE3 1 1 20 22199 2 2 11 LYS HG2 H -2.670 -8.072 -0.324 1.00 . B B . 11 LYS HG2 1 1 20 22200 2 2 11 LYS HG3 H -1.242 -7.862 -1.341 1.00 . B B . 11 LYS HG3 1 1 20 22201 2 2 11 LYS HZ1 H -1.369 -10.106 -6.213 1.00 . B B . 11 LYS HZ1 1 1 20 22202 2 2 11 LYS HZ2 H -0.839 -11.494 -5.406 1.00 . B B . 11 LYS HZ2 1 1 20 22203 2 2 11 LYS HZ3 H 0.125 -10.797 -6.608 1.00 . B B . 11 LYS HZ3 1 1 20 22204 2 2 11 LYS N N 3.934 -6.808 -5.131 1.00 . B B . 11 LYS N 1 1 20 22205 2 2 11 LYS NZ N -0.535 -10.596 -5.829 1.00 . B B . 11 LYS NZ 1 1 20 22206 2 2 11 LYS O O 4.891 -9.408 -3.270 1.00 . B B . 11 LYS O 1 1 20 22207 2 2 12 ALA C C 7.140 -9.250 -1.807 1.00 . B B . 12 ALA C 1 1 20 22208 2 2 12 ALA CA C 7.338 -8.123 -2.822 1.00 . B B . 12 ALA CA 1 1 20 22209 2 2 12 ALA CB C 8.296 -7.079 -2.266 1.00 . B B . 12 ALA CB 1 1 20 22210 2 2 12 ALA H H 6.048 -6.520 -3.320 1.00 . B B . 12 ALA H 1 1 20 22211 2 2 12 ALA HA H 7.779 -8.535 -3.717 1.00 . B B . 12 ALA HA 1 1 20 22212 2 2 12 ALA HB1 H 8.486 -6.329 -3.019 1.00 . B B . 12 ALA HB1 1 1 20 22213 2 2 12 ALA HB2 H 9.225 -7.555 -1.990 1.00 . B B . 12 ALA HB2 1 1 20 22214 2 2 12 ALA HB3 H 7.857 -6.614 -1.397 1.00 . B B . 12 ALA HB3 1 1 20 22215 2 2 12 ALA N N 6.075 -7.492 -3.201 1.00 . B B . 12 ALA N 1 1 20 22216 2 2 12 ALA O O 7.922 -10.200 -1.766 1.00 . B B . 12 ALA O 1 1 20 22217 2 2 13 ASP C C 4.573 -10.965 -0.357 1.00 . B B . 13 ASP C 1 1 20 22218 2 2 13 ASP CA C 5.813 -10.159 0.015 1.00 . B B . 13 ASP CA 1 1 20 22219 2 2 13 ASP CB C 5.620 -9.508 1.385 1.00 . B B . 13 ASP CB 1 1 20 22220 2 2 13 ASP CG C 5.366 -10.526 2.480 1.00 . B B . 13 ASP CG 1 1 20 22221 2 2 13 ASP H H 5.513 -8.359 -1.057 1.00 . B B . 13 ASP H 1 1 20 22222 2 2 13 ASP HA H 6.660 -10.827 0.060 1.00 . B B . 13 ASP HA 1 1 20 22223 2 2 13 ASP HB2 H 6.506 -8.950 1.637 1.00 . B B . 13 ASP HB2 1 1 20 22224 2 2 13 ASP HB3 H 4.776 -8.835 1.341 1.00 . B B . 13 ASP HB3 1 1 20 22225 2 2 13 ASP N N 6.096 -9.142 -0.990 1.00 . B B . 13 ASP N 1 1 20 22226 2 2 13 ASP O O 4.445 -12.132 0.014 1.00 . B B . 13 ASP O 1 1 20 22227 2 2 13 ASP OD1 O 6.350 -11.058 3.035 1.00 . B B . 13 ASP OD1 1 1 20 22228 2 2 13 ASP OD2 O 4.184 -10.788 2.784 1.00 . B B . 13 ASP OD2 1 1 20 22229 2 2 14 SER C C 1.751 -11.698 -0.343 1.00 . B B . 14 SER C 1 1 20 22230 2 2 14 SER CA C 2.431 -10.998 -1.516 1.00 . B B . 14 SER CA 1 1 20 22231 2 2 14 SER CB C 2.731 -12.010 -2.623 1.00 . B B . 14 SER CB 1 1 20 22232 2 2 14 SER H H 3.819 -9.406 -1.356 1.00 . B B . 14 SER H 1 1 20 22233 2 2 14 SER HA H 1.765 -10.243 -1.904 1.00 . B B . 14 SER HA 1 1 20 22234 2 2 14 SER HB2 H 3.165 -11.497 -3.468 1.00 . B B . 14 SER HB2 1 1 20 22235 2 2 14 SER HB3 H 3.427 -12.749 -2.254 1.00 . B B . 14 SER HB3 1 1 20 22236 2 2 14 SER HG H 1.780 -13.484 -3.494 1.00 . B B . 14 SER HG 1 1 20 22237 2 2 14 SER N N 3.660 -10.336 -1.092 1.00 . B B . 14 SER N 1 1 20 22238 2 2 14 SER O O 0.927 -11.048 0.335 1.00 . B B . 14 SER O 1 1 20 22239 2 2 14 SER OXT O 2.045 -12.890 -0.113 1.00 . B B . 14 SER OXT 1 1 20 22240 2 2 14 SER OG O 1.550 -12.667 -3.047 1.00 . B B . 14 SER OG 1 1 stop_ save_
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