NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
564829 | 2lwb | 18618 | cing | 4-filtered-FRED | STAR | entry | full | 398 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lwb # This FRED archive file contains, for PDB entry <2lwb>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2lwb _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lwb _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 2663.83 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 $Adhesin_WI_1 A . 1 1 stop_ save_ save_Adhesin_WI_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Adhesin WI 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code NCDWDKSHEKYDWELWDKWC _Entity.Number_of_monomers 20 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 ASN . 1 1 2 CYS . 1 1 3 ASP . 1 1 4 TRP . 1 1 5 ASP . 1 1 6 LYS . 1 1 7 SER . 1 1 8 HIS . 1 1 9 GLU . 1 1 10 LYS . 1 1 11 TYR . 1 1 12 ASP . 1 1 13 TRP . 1 1 14 GLU . 1 1 15 LEU . 1 1 16 TRP . 1 1 17 ASP . 1 1 18 LYS . 1 1 19 TRP . 1 1 20 CYS . 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 ASN 1 1 1 1 CYS 2 2 1 1 ASP 3 3 1 1 TRP 4 4 1 1 ASP 5 5 1 1 LYS 6 6 1 1 SER 7 7 1 1 HIS 8 8 1 1 GLU 9 9 1 1 LYS 10 10 1 1 TYR 11 11 1 1 ASP 12 12 1 1 TRP 13 13 1 1 GLU 14 14 1 1 LEU 15 15 1 1 TRP 16 16 1 1 ASP 17 17 1 1 LYS 18 18 1 1 TRP 19 19 1 1 CYS 20 20 1 1 stop_ save_ save_DYANA/DIANA_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 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 ASN HA . 18 ASN HA 1 1 1 1 2 1 1 2 CYS HA . 19 CYSS HA 1 1 2 1 1 1 1 1 ASN HA . 18 ASN HA 1 1 2 1 2 1 1 3 ASP H . 20 ASP H 1 1 3 1 1 1 1 1 ASN HA . 18 ASN HA 1 1 3 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 4 1 1 1 1 1 ASN HA . 18 ASN HA 1 1 4 1 2 1 1 4 TRP HH2 . 21 TRP HH2 1 1 5 1 1 1 1 1 ASN HA . 18 ASN HA 1 1 5 1 2 1 1 4 TRP HZ2 . 21 TRP HZ2 1 1 6 1 1 1 1 1 ASN QB . 18 ASN QB 1 1 6 1 2 1 1 4 TRP H . 21 TRP H 1 1 7 1 1 1 1 1 ASN QB . 18 ASN QB 1 1 7 1 2 1 1 4 TRP HD1 . 21 TRP HD1 1 1 8 1 1 1 1 1 ASN QB . 18 ASN QB 1 1 8 1 2 1 1 4 TRP HZ2 . 21 TRP HZ2 1 1 9 1 1 1 1 1 ASN QB . 18 ASN QB 1 1 9 1 2 1 1 19 TRP HE3 . 36 TRP HE3 1 1 10 1 1 1 1 1 ASN HB2 . 18 ASN HB2 1 1 10 1 2 1 1 2 CYS H . 19 CYSS H 1 1 11 1 1 1 1 1 ASN HB2 . 18 ASN HB2 1 1 11 1 2 1 1 3 ASP H . 20 ASP H 1 1 12 1 1 1 1 1 ASN HB2 . 18 ASN HB2 1 1 12 1 2 1 1 4 TRP H . 21 TRP H 1 1 13 1 1 1 1 1 ASN HB2 . 18 ASN HB2 1 1 13 1 2 1 1 4 TRP HD1 . 21 TRP HD1 1 1 14 1 1 1 1 1 ASN HB2 . 18 ASN HB2 1 1 14 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 15 1 1 1 1 1 ASN HB3 . 18 ASN HB3 1 1 15 1 2 1 1 2 CYS H . 19 CYSS H 1 1 16 1 1 1 1 1 ASN HB3 . 18 ASN HB3 1 1 16 1 2 1 1 3 ASP H . 20 ASP H 1 1 17 1 1 1 1 1 ASN HB3 . 18 ASN HB3 1 1 17 1 2 1 1 4 TRP H . 21 TRP H 1 1 18 1 1 1 1 1 ASN HB3 . 18 ASN HB3 1 1 18 1 2 1 1 4 TRP HD1 . 21 TRP HD1 1 1 19 1 1 1 1 1 ASN HB3 . 18 ASN HB3 1 1 19 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 20 1 1 1 1 1 ASN QD . 18 ASN QD2 1 1 20 1 2 1 1 3 ASP QB . 20 ASP QB 1 1 21 1 1 1 1 1 ASN QD . 18 ASN QD2 1 1 21 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 22 1 1 1 1 1 ASN QD . 18 ASN QD2 1 1 22 1 2 1 1 4 TRP HZ2 . 21 TRP HZ2 1 1 23 1 1 1 1 1 ASN HD21 . 18 ASN HD21 1 1 23 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 24 1 1 1 1 1 ASN HD21 . 18 ASN HD21 1 1 24 1 2 1 1 4 TRP HZ2 . 21 TRP HZ2 1 1 25 1 1 1 1 1 ASN HD22 . 18 ASN HD22 1 1 25 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 26 1 1 1 1 1 ASN HD22 . 18 ASN HD22 1 1 26 1 2 1 1 4 TRP HZ2 . 21 TRP HZ2 1 1 27 1 1 1 1 2 CYS H . 19 CYSS H 1 1 27 1 2 1 1 3 ASP H . 20 ASP H 1 1 28 1 1 1 1 2 CYS H . 19 CYSS H 1 1 28 1 2 1 1 4 TRP H . 21 TRP H 1 1 29 1 1 1 1 2 CYS H . 19 CYSS H 1 1 29 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 30 1 1 1 1 3 ASP H . 20 ASP H 1 1 30 1 2 1 1 3 ASP HB2 . 20 ASP HB2 1 1 31 1 1 1 1 3 ASP H . 20 ASP H 1 1 31 1 2 1 1 3 ASP QB . 20 ASP QB 1 1 32 1 1 1 1 3 ASP H . 20 ASP H 1 1 32 1 2 1 1 3 ASP HB3 . 20 ASP HB3 1 1 33 1 1 1 1 3 ASP H . 20 ASP H 1 1 33 1 2 1 1 4 TRP H . 21 TRP H 1 1 34 1 1 1 1 3 ASP H . 20 ASP H 1 1 34 1 2 1 1 4 TRP HD1 . 21 TRP HD1 1 1 35 1 1 1 1 3 ASP H . 20 ASP H 1 1 35 1 2 1 1 4 TRP HZ2 . 21 TRP HZ2 1 1 36 1 1 1 1 4 TRP H . 21 TRP H 1 1 36 1 2 1 1 4 TRP HD1 . 21 TRP HD1 1 1 37 1 1 1 1 4 TRP H . 21 TRP H 1 1 37 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 38 1 1 1 1 4 TRP H . 21 TRP H 1 1 38 1 2 1 1 5 ASP H . 22 ASP H 1 1 39 1 1 1 1 4 TRP HA . 21 TRP HA 1 1 39 1 2 1 1 5 ASP H . 22 ASP H 1 1 40 1 1 1 1 4 TRP HA . 21 TRP HA 1 1 40 1 2 1 1 8 HIS QB . 25 HIS QB 1 1 41 1 1 1 1 4 TRP QB . 21 TRP QB 1 1 41 1 2 1 1 4 TRP HE1 . 21 TRP HE1 1 1 42 1 1 1 1 4 TRP QB . 21 TRP QB 1 1 42 1 2 1 1 8 HIS H . 25 HIS H 1 1 43 1 1 1 1 4 TRP QB . 21 TRP QB 1 1 43 1 2 1 1 8 HIS HA . 25 HIS HA 1 1 44 1 1 1 1 4 TRP QB . 21 TRP QB 1 1 44 1 2 1 1 8 HIS QB . 25 HIS QB 1 1 45 1 1 1 1 4 TRP HB2 . 21 TRP HB2 1 1 45 1 2 1 1 5 ASP H . 22 ASP H 1 1 46 1 1 1 1 4 TRP HB3 . 21 TRP HB3 1 1 46 1 2 1 1 5 ASP H . 22 ASP H 1 1 47 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 47 1 2 1 1 5 ASP H . 22 ASP H 1 1 48 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 48 1 2 1 1 5 ASP HA . 22 ASP HA 1 1 49 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 49 1 2 1 1 5 ASP QB . 22 ASP QB 1 1 50 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 50 1 2 1 1 8 HIS HA . 25 HIS HA 1 1 51 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 51 1 2 1 1 8 HIS HB2 . 25 HIS HB2 1 1 52 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 52 1 2 1 1 8 HIS QB . 25 HIS QB 1 1 53 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 53 1 2 1 1 8 HIS HB3 . 25 HIS HB3 1 1 54 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 54 1 2 1 1 8 HIS HD2 . 25 HIS HD2 1 1 55 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 55 1 2 1 1 11 TYR HA . 28 TYR HA 1 1 56 1 1 1 1 4 TRP HD1 . 21 TRP HD1 1 1 56 1 2 1 1 11 TYR QB . 28 TYR QB 1 1 57 1 1 1 1 4 TRP HE1 . 21 TRP HE1 1 1 57 1 2 1 1 8 HIS HD2 . 25 HIS HD2 1 1 58 1 1 1 1 4 TRP HE1 . 21 TRP HE1 1 1 58 1 2 1 1 10 LYS QB . 27 LYS QB 1 1 59 1 1 1 1 4 TRP HE1 . 21 TRP HE1 1 1 59 1 2 1 1 19 TRP HE3 . 36 TRP HE3 1 1 60 1 1 1 1 4 TRP HH2 . 21 TRP HH2 1 1 60 1 2 1 1 8 HIS HE1 . 25 HIS HE1 1 1 61 1 1 1 1 4 TRP HH2 . 21 TRP HH2 1 1 61 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 62 1 1 1 1 4 TRP HZ2 . 21 TRP HZ2 1 1 62 1 2 1 1 8 HIS HE1 . 25 HIS HE1 1 1 63 1 1 1 1 4 TRP HZ2 . 21 TRP HZ2 1 1 63 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 64 1 1 1 1 5 ASP H . 22 ASP H 1 1 64 1 2 1 1 6 LYS H . 23 LYS H 1 1 65 1 1 1 1 5 ASP H . 22 ASP H 1 1 65 1 2 1 1 7 SER H . 24 SER H 1 1 66 1 1 1 1 5 ASP H . 22 ASP H 1 1 66 1 2 1 1 8 HIS H . 25 HIS H 1 1 67 1 1 1 1 5 ASP H . 22 ASP H 1 1 67 1 2 1 1 8 HIS HB2 . 25 HIS HB2 1 1 68 1 1 1 1 5 ASP H . 22 ASP H 1 1 68 1 2 1 1 8 HIS QB . 25 HIS QB 1 1 69 1 1 1 1 5 ASP H . 22 ASP H 1 1 69 1 2 1 1 8 HIS HB3 . 25 HIS HB3 1 1 70 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 70 1 2 1 1 6 LYS H . 23 LYS H 1 1 71 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 71 1 2 1 1 6 LYS HA . 23 LYS HA 1 1 72 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 72 1 2 1 1 6 LYS QB . 23 LYS QB 1 1 73 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 73 1 2 1 1 6 LYS HG2 . 23 LYS HG2 1 1 74 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 74 1 2 1 1 6 LYS HG3 . 23 LYS HG3 1 1 75 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 75 1 2 1 1 7 SER H . 24 SER H 1 1 76 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 76 1 2 1 1 8 HIS H . 25 HIS H 1 1 77 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 77 1 2 1 1 8 HIS HB2 . 25 HIS HB2 1 1 78 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 78 1 2 1 1 8 HIS QB . 25 HIS QB 1 1 79 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 79 1 2 1 1 8 HIS HB3 . 25 HIS HB3 1 1 80 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 80 1 2 1 1 11 TYR QB . 28 TYR QB 1 1 81 1 1 1 1 5 ASP HA . 22 ASP HA 1 1 81 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 82 1 1 1 1 5 ASP QB . 22 ASP QB 1 1 82 1 2 1 1 6 LYS H . 23 LYS H 1 1 83 1 1 1 1 5 ASP QB . 22 ASP QB 1 1 83 1 2 1 1 6 LYS QB . 23 LYS QB 1 1 84 1 1 1 1 5 ASP QB . 22 ASP QB 1 1 84 1 2 1 1 6 LYS QG . 23 LYS QG 1 1 85 1 1 1 1 5 ASP QB . 22 ASP QB 1 1 85 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 86 1 1 1 1 5 ASP QB . 22 ASP QB 1 1 86 1 2 1 1 11 TYR QE . 28 TYR QE 1 1 87 1 1 1 1 5 ASP HB2 . 22 ASP HB2 1 1 87 1 2 1 1 6 LYS H . 23 LYS H 1 1 88 1 1 1 1 5 ASP HB2 . 22 ASP HB2 1 1 88 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 89 1 1 1 1 5 ASP HB3 . 22 ASP HB3 1 1 89 1 2 1 1 6 LYS H . 23 LYS H 1 1 90 1 1 1 1 5 ASP HB3 . 22 ASP HB3 1 1 90 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 91 1 1 1 1 6 LYS H . 23 LYS H 1 1 91 1 2 1 1 6 LYS HB2 . 23 LYS HB2 1 1 92 1 1 1 1 6 LYS H . 23 LYS H 1 1 92 1 2 1 1 6 LYS HB3 . 23 LYS HB3 1 1 93 1 1 1 1 6 LYS H . 23 LYS H 1 1 93 1 2 1 1 6 LYS HG2 . 23 LYS HG2 1 1 94 1 1 1 1 6 LYS H . 23 LYS H 1 1 94 1 2 1 1 6 LYS HG3 . 23 LYS HG3 1 1 95 1 1 1 1 6 LYS H . 23 LYS H 1 1 95 1 2 1 1 7 SER H . 24 SER H 1 1 96 1 1 1 1 6 LYS H . 23 LYS H 1 1 96 1 2 1 1 7 SER QB . 24 SER QB 1 1 97 1 1 1 1 6 LYS H . 23 LYS H 1 1 97 1 2 1 1 8 HIS H . 25 HIS H 1 1 98 1 1 1 1 6 LYS H . 23 LYS H 1 1 98 1 2 1 1 8 HIS QB . 25 HIS QB 1 1 99 1 1 1 1 6 LYS H . 23 LYS H 1 1 99 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 100 1 1 1 1 6 LYS H . 23 LYS H 1 1 100 1 2 1 1 11 TYR QE . 28 TYR QE 1 1 101 1 1 1 1 6 LYS HA . 23 LYS HA 1 1 101 1 2 1 1 7 SER HA . 24 SER HA 1 1 102 1 1 1 1 6 LYS HA . 23 LYS HA 1 1 102 1 2 1 1 8 HIS H . 25 HIS H 1 1 103 1 1 1 1 6 LYS HA . 23 LYS HA 1 1 103 1 2 1 1 11 TYR HB2 . 28 TYR HB2 1 1 104 1 1 1 1 6 LYS HA . 23 LYS HA 1 1 104 1 2 1 1 11 TYR HB3 . 28 TYR HB3 1 1 105 1 1 1 1 6 LYS HA . 23 LYS HA 1 1 105 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 106 1 1 1 1 6 LYS HA . 23 LYS HA 1 1 106 1 2 1 1 11 TYR QE . 28 TYR QE 1 1 107 1 1 1 1 6 LYS QB . 23 LYS QB 1 1 107 1 2 1 1 6 LYS QE . 23 LYS QE 1 1 108 1 1 1 1 6 LYS QB . 23 LYS QB 1 1 108 1 2 1 1 7 SER H . 24 SER H 1 1 109 1 1 1 1 6 LYS QB . 23 LYS QB 1 1 109 1 2 1 1 7 SER QB . 24 SER QB 1 1 110 1 1 1 1 6 LYS QB . 23 LYS QB 1 1 110 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 111 1 1 1 1 6 LYS QB . 23 LYS QB 1 1 111 1 2 1 1 11 TYR QE . 28 TYR QE 1 1 112 1 1 1 1 6 LYS HB2 . 23 LYS HB2 1 1 112 1 2 1 1 6 LYS QE . 23 LYS QE 1 1 113 1 1 1 1 6 LYS HB2 . 23 LYS HB2 1 1 113 1 2 1 1 7 SER HA . 24 SER HA 1 1 114 1 1 1 1 6 LYS HB3 . 23 LYS HB3 1 1 114 1 2 1 1 6 LYS QE . 23 LYS QE 1 1 115 1 1 1 1 6 LYS HB3 . 23 LYS HB3 1 1 115 1 2 1 1 7 SER HA . 24 SER HA 1 1 116 1 1 1 1 6 LYS QD . 23 LYS QD 1 1 116 1 2 1 1 13 TRP HD1 . 30 TRP HD1 1 1 117 1 1 1 1 6 LYS QD . 23 LYS QD 1 1 117 1 2 1 1 13 TRP HE1 . 30 TRP HE1 1 1 118 1 1 1 1 6 LYS QD . 23 LYS QD 1 1 118 1 2 1 1 13 TRP HE3 . 30 TRP HE3 1 1 119 1 1 1 1 6 LYS QD . 23 LYS QD 1 1 119 1 2 1 1 13 TRP HZ2 . 30 TRP HZ2 1 1 120 1 1 1 1 6 LYS QD . 23 LYS QD 1 1 120 1 2 1 1 13 TRP HZ3 . 30 TRP HZ3 1 1 121 1 1 1 1 6 LYS QE . 23 LYS QE 1 1 121 1 2 1 1 6 LYS HG2 . 23 LYS HG2 1 1 122 1 1 1 1 6 LYS QE . 23 LYS QE 1 1 122 1 2 1 1 6 LYS HG3 . 23 LYS HG3 1 1 123 1 1 1 1 6 LYS QE . 23 LYS QE 1 1 123 1 2 1 1 13 TRP HD1 . 30 TRP HD1 1 1 124 1 1 1 1 6 LYS QE . 23 LYS QE 1 1 124 1 2 1 1 13 TRP HE3 . 30 TRP HE3 1 1 125 1 1 1 1 6 LYS QE . 23 LYS QE 1 1 125 1 2 1 1 13 TRP HH2 . 30 TRP HH2 1 1 126 1 1 1 1 6 LYS QE . 23 LYS QE 1 1 126 1 2 1 1 13 TRP HZ2 . 30 TRP HZ2 1 1 127 1 1 1 1 6 LYS QE . 23 LYS QE 1 1 127 1 2 1 1 13 TRP HZ3 . 30 TRP HZ3 1 1 128 1 1 1 1 6 LYS QG . 23 LYS QG 1 1 128 1 2 1 1 7 SER H . 24 SER H 1 1 129 1 1 1 1 6 LYS QG . 23 LYS QG 1 1 129 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 130 1 1 1 1 6 LYS QG . 23 LYS QG 1 1 130 1 2 1 1 11 TYR QE . 28 TYR QE 1 1 131 1 1 1 1 7 SER H . 24 SER H 1 1 131 1 2 1 1 7 SER HB2 . 24 SER HB2 1 1 132 1 1 1 1 7 SER H . 24 SER H 1 1 132 1 2 1 1 7 SER QB . 24 SER QB 1 1 133 1 1 1 1 7 SER H . 24 SER H 1 1 133 1 2 1 1 7 SER HB3 . 24 SER HB3 1 1 134 1 1 1 1 7 SER H . 24 SER H 1 1 134 1 2 1 1 8 HIS H . 25 HIS H 1 1 135 1 1 1 1 7 SER H . 24 SER H 1 1 135 1 2 1 1 8 HIS HA . 25 HIS HA 1 1 136 1 1 1 1 7 SER H . 24 SER H 1 1 136 1 2 1 1 8 HIS QB . 25 HIS QB 1 1 137 1 1 1 1 7 SER H . 24 SER H 1 1 137 1 2 1 1 11 TYR H . 28 TYR H 1 1 138 1 1 1 1 7 SER H . 24 SER H 1 1 138 1 2 1 1 11 TYR QB . 28 TYR QB 1 1 139 1 1 1 1 7 SER H . 24 SER H 1 1 139 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 140 1 1 1 1 7 SER H . 24 SER H 1 1 140 1 2 1 1 11 TYR QE . 28 TYR QE 1 1 141 1 1 1 1 7 SER HA . 24 SER HA 1 1 141 1 2 1 1 7 SER HB2 . 24 SER HB2 1 1 142 1 1 1 1 7 SER HA . 24 SER HA 1 1 142 1 2 1 1 7 SER HB3 . 24 SER HB3 1 1 143 1 1 1 1 7 SER HA . 24 SER HA 1 1 143 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 144 1 1 1 1 7 SER QB . 24 SER QB 1 1 144 1 2 1 1 8 HIS HA . 25 HIS HA 1 1 145 1 1 1 1 7 SER HB2 . 24 SER HB2 1 1 145 1 2 1 1 8 HIS H . 25 HIS H 1 1 146 1 1 1 1 7 SER HB3 . 24 SER HB3 1 1 146 1 2 1 1 8 HIS H . 25 HIS H 1 1 147 1 1 1 1 8 HIS H . 25 HIS H 1 1 147 1 2 1 1 8 HIS HB2 . 25 HIS HB2 1 1 148 1 1 1 1 8 HIS H . 25 HIS H 1 1 148 1 2 1 1 8 HIS HB3 . 25 HIS HB3 1 1 149 1 1 1 1 8 HIS H . 25 HIS H 1 1 149 1 2 1 1 10 LYS H . 27 LYS H 1 1 150 1 1 1 1 8 HIS H . 25 HIS H 1 1 150 1 2 1 1 11 TYR H . 28 TYR H 1 1 151 1 1 1 1 8 HIS H . 25 HIS H 1 1 151 1 2 1 1 11 TYR QB . 28 TYR QB 1 1 152 1 1 1 1 8 HIS H . 25 HIS H 1 1 152 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 153 1 1 1 1 8 HIS HA . 25 HIS HA 1 1 153 1 2 1 1 8 HIS HE1 . 25 HIS HE1 1 1 154 1 1 1 1 8 HIS HA . 25 HIS HA 1 1 154 1 2 1 1 9 GLU H . 26 GLU H 1 1 155 1 1 1 1 8 HIS HA . 25 HIS HA 1 1 155 1 2 1 1 10 LYS H . 27 LYS H 1 1 156 1 1 1 1 8 HIS HA . 25 HIS HA 1 1 156 1 2 1 1 11 TYR H . 28 TYR H 1 1 157 1 1 1 1 8 HIS HA . 25 HIS HA 1 1 157 1 2 1 1 11 TYR QB . 28 TYR QB 1 1 158 1 1 1 1 8 HIS QB . 25 HIS QB 1 1 158 1 2 1 1 8 HIS HD2 . 25 HIS HD2 1 1 159 1 1 1 1 8 HIS QB . 25 HIS QB 1 1 159 1 2 1 1 9 GLU H . 26 GLU H 1 1 160 1 1 1 1 8 HIS QB . 25 HIS QB 1 1 160 1 2 1 1 11 TYR HA . 28 TYR HA 1 1 161 1 1 1 1 8 HIS QB . 25 HIS QB 1 1 161 1 2 1 1 11 TYR QB . 28 TYR QB 1 1 162 1 1 1 1 8 HIS HB2 . 25 HIS HB2 1 1 162 1 2 1 1 8 HIS HD2 . 25 HIS HD2 1 1 163 1 1 1 1 8 HIS HB2 . 25 HIS HB2 1 1 163 1 2 1 1 8 HIS HE1 . 25 HIS HE1 1 1 164 1 1 1 1 8 HIS HB2 . 25 HIS HB2 1 1 164 1 2 1 1 10 LYS H . 27 LYS H 1 1 165 1 1 1 1 8 HIS HB2 . 25 HIS HB2 1 1 165 1 2 1 1 11 TYR H . 28 TYR H 1 1 166 1 1 1 1 8 HIS HB3 . 25 HIS HB3 1 1 166 1 2 1 1 8 HIS HD2 . 25 HIS HD2 1 1 167 1 1 1 1 8 HIS HB3 . 25 HIS HB3 1 1 167 1 2 1 1 8 HIS HE1 . 25 HIS HE1 1 1 168 1 1 1 1 8 HIS HB3 . 25 HIS HB3 1 1 168 1 2 1 1 10 LYS H . 27 LYS H 1 1 169 1 1 1 1 8 HIS HB3 . 25 HIS HB3 1 1 169 1 2 1 1 11 TYR H . 28 TYR H 1 1 170 1 1 1 1 8 HIS HD2 . 25 HIS HD2 1 1 170 1 2 1 1 9 GLU H . 26 GLU H 1 1 171 1 1 1 1 8 HIS HD2 . 25 HIS HD2 1 1 171 1 2 1 1 9 GLU QG . 26 GLU QG 1 1 172 1 1 1 1 8 HIS HD2 . 25 HIS HD2 1 1 172 1 2 1 1 10 LYS H . 27 LYS H 1 1 173 1 1 1 1 8 HIS HD2 . 25 HIS HD2 1 1 173 1 2 1 1 10 LYS HB2 . 27 LYS HB2 1 1 174 1 1 1 1 8 HIS HD2 . 25 HIS HD2 1 1 174 1 2 1 1 10 LYS HB3 . 27 LYS HB3 1 1 175 1 1 1 1 8 HIS HD2 . 25 HIS HD2 1 1 175 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 176 1 1 1 1 8 HIS HD2 . 25 HIS HD2 1 1 176 1 2 1 1 11 TYR H . 28 TYR H 1 1 177 1 1 1 1 8 HIS HD2 . 25 HIS HD2 1 1 177 1 2 1 1 11 TYR HA . 28 TYR HA 1 1 178 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 178 1 2 1 1 9 GLU H . 26 GLU H 1 1 179 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 179 1 2 1 1 9 GLU QB . 26 GLU QB 1 1 180 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 180 1 2 1 1 9 GLU HG2 . 26 GLU HG2 1 1 181 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 181 1 2 1 1 9 GLU QG . 26 GLU QG 1 1 182 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 182 1 2 1 1 9 GLU HG3 . 26 GLU HG3 1 1 183 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 183 1 2 1 1 10 LYS H . 27 LYS H 1 1 184 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 184 1 2 1 1 10 LYS QB . 27 LYS QB 1 1 185 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 185 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 186 1 1 1 1 8 HIS HE1 . 25 HIS HE1 1 1 186 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 187 1 1 1 1 9 GLU H . 26 GLU H 1 1 187 1 2 1 1 9 GLU QB . 26 GLU QB 1 1 188 1 1 1 1 9 GLU H . 26 GLU H 1 1 188 1 2 1 1 9 GLU QG . 26 GLU QG 1 1 189 1 1 1 1 9 GLU H . 26 GLU H 1 1 189 1 2 1 1 10 LYS H . 27 LYS H 1 1 190 1 1 1 1 9 GLU H . 26 GLU H 1 1 190 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 191 1 1 1 1 9 GLU H . 26 GLU H 1 1 191 1 2 1 1 11 TYR H . 28 TYR H 1 1 192 1 1 1 1 9 GLU H . 26 GLU H 1 1 192 1 2 1 1 11 TYR QB . 28 TYR QB 1 1 193 1 1 1 1 9 GLU HA . 26 GLU HA 1 1 193 1 2 1 1 9 GLU HB2 . 26 GLU HB2 1 1 194 1 1 1 1 9 GLU HA . 26 GLU HA 1 1 194 1 2 1 1 9 GLU HB3 . 26 GLU HB3 1 1 195 1 1 1 1 9 GLU HA . 26 GLU HA 1 1 195 1 2 1 1 9 GLU QG . 26 GLU QG 1 1 196 1 1 1 1 9 GLU HA . 26 GLU HA 1 1 196 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 197 1 1 1 1 9 GLU HA . 26 GLU HA 1 1 197 1 2 1 1 11 TYR H . 28 TYR H 1 1 198 1 1 1 1 9 GLU HA . 26 GLU HA 1 1 198 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 199 1 1 1 1 9 GLU QB . 26 GLU QB 1 1 199 1 2 1 1 10 LYS HA . 27 LYS HA 1 1 200 1 1 1 1 9 GLU QB . 26 GLU QB 1 1 200 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 201 1 1 1 1 9 GLU HB2 . 26 GLU HB2 1 1 201 1 2 1 1 10 LYS H . 27 LYS H 1 1 202 1 1 1 1 9 GLU HB2 . 26 GLU HB2 1 1 202 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 203 1 1 1 1 9 GLU HB3 . 26 GLU HB3 1 1 203 1 2 1 1 10 LYS H . 27 LYS H 1 1 204 1 1 1 1 9 GLU HB3 . 26 GLU HB3 1 1 204 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 205 1 1 1 1 9 GLU QG . 26 GLU QG 1 1 205 1 2 1 1 10 LYS H . 27 LYS H 1 1 206 1 1 1 1 9 GLU QG . 26 GLU QG 1 1 206 1 2 1 1 10 LYS QB . 27 LYS QB 1 1 207 1 1 1 1 9 GLU QG . 26 GLU QG 1 1 207 1 2 1 1 10 LYS QD . 27 LYS QD 1 1 208 1 1 1 1 9 GLU QG . 26 GLU QG 1 1 208 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 209 1 1 1 1 9 GLU QG . 26 GLU QG 1 1 209 1 2 1 1 11 TYR H . 28 TYR H 1 1 210 1 1 1 1 9 GLU HG2 . 26 GLU HG2 1 1 210 1 2 1 1 10 LYS H . 27 LYS H 1 1 211 1 1 1 1 9 GLU HG2 . 26 GLU HG2 1 1 211 1 2 1 1 10 LYS HA . 27 LYS HA 1 1 212 1 1 1 1 9 GLU HG2 . 26 GLU HG2 1 1 212 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 213 1 1 1 1 9 GLU HG2 . 26 GLU HG2 1 1 213 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 214 1 1 1 1 9 GLU HG3 . 26 GLU HG3 1 1 214 1 2 1 1 10 LYS H . 27 LYS H 1 1 215 1 1 1 1 9 GLU HG3 . 26 GLU HG3 1 1 215 1 2 1 1 10 LYS HA . 27 LYS HA 1 1 216 1 1 1 1 9 GLU HG3 . 26 GLU HG3 1 1 216 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 217 1 1 1 1 9 GLU HG3 . 26 GLU HG3 1 1 217 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 218 1 1 1 1 10 LYS H . 27 LYS H 1 1 218 1 2 1 1 10 LYS QD . 27 LYS QD 1 1 219 1 1 1 1 10 LYS H . 27 LYS H 1 1 219 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 220 1 1 1 1 10 LYS H . 27 LYS H 1 1 220 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 221 1 1 1 1 10 LYS H . 27 LYS H 1 1 221 1 2 1 1 11 TYR H . 28 TYR H 1 1 222 1 1 1 1 10 LYS H . 27 LYS H 1 1 222 1 2 1 1 11 TYR HA . 28 TYR HA 1 1 223 1 1 1 1 10 LYS H . 27 LYS H 1 1 223 1 2 1 1 11 TYR HB2 . 28 TYR HB2 1 1 224 1 1 1 1 10 LYS H . 27 LYS H 1 1 224 1 2 1 1 11 TYR HB3 . 28 TYR HB3 1 1 225 1 1 1 1 10 LYS H . 27 LYS H 1 1 225 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 226 1 1 1 1 10 LYS HA . 27 LYS HA 1 1 226 1 2 1 1 10 LYS QD . 27 LYS QD 1 1 227 1 1 1 1 10 LYS HA . 27 LYS HA 1 1 227 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 228 1 1 1 1 10 LYS HA . 27 LYS HA 1 1 228 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 229 1 1 1 1 10 LYS HA . 27 LYS HA 1 1 229 1 2 1 1 11 TYR HA . 28 TYR HA 1 1 230 1 1 1 1 10 LYS HA . 27 LYS HA 1 1 230 1 2 1 1 11 TYR QB . 28 TYR QB 1 1 231 1 1 1 1 10 LYS QB . 27 LYS QB 1 1 231 1 2 1 1 10 LYS QE . 27 LYS QE 1 1 232 1 1 1 1 10 LYS QB . 27 LYS QB 1 1 232 1 2 1 1 11 TYR H . 28 TYR H 1 1 233 1 1 1 1 10 LYS QB . 27 LYS QB 1 1 233 1 2 1 1 19 TRP HE3 . 36 TRP HE3 1 1 234 1 1 1 1 10 LYS QB . 27 LYS QB 1 1 234 1 2 1 1 19 TRP HH2 . 36 TRP HH2 1 1 235 1 1 1 1 10 LYS QB . 27 LYS QB 1 1 235 1 2 1 1 19 TRP HZ2 . 36 TRP HZ2 1 1 236 1 1 1 1 10 LYS QB . 27 LYS QB 1 1 236 1 2 1 1 19 TRP HZ3 . 36 TRP HZ3 1 1 237 1 1 1 1 10 LYS HB2 . 27 LYS HB2 1 1 237 1 2 1 1 11 TYR H . 28 TYR H 1 1 238 1 1 1 1 10 LYS HB2 . 27 LYS HB2 1 1 238 1 2 1 1 19 TRP HE3 . 36 TRP HE3 1 1 239 1 1 1 1 10 LYS HB2 . 27 LYS HB2 1 1 239 1 2 1 1 19 TRP HH2 . 36 TRP HH2 1 1 240 1 1 1 1 10 LYS HB2 . 27 LYS HB2 1 1 240 1 2 1 1 19 TRP HZ3 . 36 TRP HZ3 1 1 241 1 1 1 1 10 LYS HB3 . 27 LYS HB3 1 1 241 1 2 1 1 11 TYR H . 28 TYR H 1 1 242 1 1 1 1 10 LYS HB3 . 27 LYS HB3 1 1 242 1 2 1 1 19 TRP HE3 . 36 TRP HE3 1 1 243 1 1 1 1 10 LYS HB3 . 27 LYS HB3 1 1 243 1 2 1 1 19 TRP HH2 . 36 TRP HH2 1 1 244 1 1 1 1 10 LYS HB3 . 27 LYS HB3 1 1 244 1 2 1 1 19 TRP HZ3 . 36 TRP HZ3 1 1 245 1 1 1 1 10 LYS QD . 27 LYS QD 1 1 245 1 2 1 1 19 TRP HH2 . 36 TRP HH2 1 1 246 1 1 1 1 10 LYS QD . 27 LYS QD 1 1 246 1 2 1 1 19 TRP HZ2 . 36 TRP HZ2 1 1 247 1 1 1 1 10 LYS QE . 27 LYS QE 1 1 247 1 2 1 1 10 LYS QG . 27 LYS QG 1 1 248 1 1 1 1 10 LYS QE . 27 LYS QE 1 1 248 1 2 1 1 19 TRP HH2 . 36 TRP HH2 1 1 249 1 1 1 1 10 LYS QE . 27 LYS QE 1 1 249 1 2 1 1 19 TRP HZ3 . 36 TRP HZ3 1 1 250 1 1 1 1 10 LYS QG . 27 LYS QG 1 1 250 1 2 1 1 11 TYR H . 28 TYR H 1 1 251 1 1 1 1 10 LYS QG . 27 LYS QG 1 1 251 1 2 1 1 19 TRP HH2 . 36 TRP HH2 1 1 252 1 1 1 1 10 LYS QG . 27 LYS QG 1 1 252 1 2 1 1 19 TRP HZ2 . 36 TRP HZ2 1 1 253 1 1 1 1 10 LYS QG . 27 LYS QG 1 1 253 1 2 1 1 19 TRP HZ3 . 36 TRP HZ3 1 1 254 1 1 1 1 11 TYR H . 28 TYR H 1 1 254 1 2 1 1 11 TYR HB2 . 28 TYR HB2 1 1 255 1 1 1 1 11 TYR H . 28 TYR H 1 1 255 1 2 1 1 11 TYR HB3 . 28 TYR HB3 1 1 256 1 1 1 1 11 TYR H . 28 TYR H 1 1 256 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 257 1 1 1 1 11 TYR HA . 28 TYR HA 1 1 257 1 2 1 1 11 TYR QD . 28 TYR QD 1 1 258 1 1 1 1 11 TYR HA . 28 TYR HA 1 1 258 1 2 1 1 12 ASP H . 29 ASP H 1 1 259 1 1 1 1 11 TYR HA . 28 TYR HA 1 1 259 1 2 1 1 12 ASP QB . 29 ASP QB 1 1 260 1 1 1 1 11 TYR HA . 28 TYR HA 1 1 260 1 2 1 1 19 TRP HZ3 . 36 TRP HZ3 1 1 261 1 1 1 1 11 TYR QD . 28 TYR QD 1 1 261 1 2 1 1 12 ASP H . 29 ASP H 1 1 262 1 1 1 1 11 TYR QD . 28 TYR QD 1 1 262 1 2 1 1 12 ASP HA . 29 ASP HA 1 1 263 1 1 1 1 11 TYR QD . 28 TYR QD 1 1 263 1 2 1 1 13 TRP H . 30 TRP H 1 1 264 1 1 1 1 11 TYR QD . 28 TYR QD 1 1 264 1 2 1 1 13 TRP HA . 30 TRP HA 1 1 265 1 1 1 1 11 TYR QD . 28 TYR QD 1 1 265 1 2 1 1 16 TRP H . 33 TRP H 1 1 266 1 1 1 1 11 TYR QD . 28 TYR QD 1 1 266 1 2 1 1 16 TRP QB . 33 TRP QB 1 1 267 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 267 1 2 1 1 12 ASP H . 29 ASP H 1 1 268 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 268 1 2 1 1 12 ASP HA . 29 ASP HA 1 1 269 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 269 1 2 1 1 13 TRP H . 30 TRP H 1 1 270 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 270 1 2 1 1 13 TRP HA . 30 TRP HA 1 1 271 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 271 1 2 1 1 13 TRP HB2 . 30 TRP HB2 1 1 272 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 272 1 2 1 1 13 TRP HB3 . 30 TRP HB3 1 1 273 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 273 1 2 1 1 13 TRP HD1 . 30 TRP HD1 1 1 274 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 274 1 2 1 1 13 TRP HE1 . 30 TRP HE1 1 1 275 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 275 1 2 1 1 13 TRP HE3 . 30 TRP HE3 1 1 276 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 276 1 2 1 1 16 TRP H . 33 TRP H 1 1 277 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 277 1 2 1 1 16 TRP QB . 33 TRP QB 1 1 278 1 1 1 1 11 TYR QE . 28 TYR QE 1 1 278 1 2 1 1 16 TRP HD1 . 33 TRP HD1 1 1 279 1 1 1 1 12 ASP H . 29 ASP H 1 1 279 1 2 1 1 13 TRP HA . 30 TRP HA 1 1 280 1 1 1 1 12 ASP H . 29 ASP H 1 1 280 1 2 1 1 15 LEU HB2 . 32 LEU HB2 1 1 281 1 1 1 1 12 ASP H . 29 ASP H 1 1 281 1 2 1 1 15 LEU QB . 32 LEU QB 1 1 282 1 1 1 1 12 ASP H . 29 ASP H 1 1 282 1 2 1 1 15 LEU HB3 . 32 LEU HB3 1 1 283 1 1 1 1 12 ASP H . 29 ASP H 1 1 283 1 2 1 1 16 TRP H . 33 TRP H 1 1 284 1 1 1 1 12 ASP HA . 29 ASP HA 1 1 284 1 2 1 1 13 TRP HA . 30 TRP HA 1 1 285 1 1 1 1 12 ASP HA . 29 ASP HA 1 1 285 1 2 1 1 13 TRP HB2 . 30 TRP HB2 1 1 286 1 1 1 1 12 ASP HA . 29 ASP HA 1 1 286 1 2 1 1 13 TRP HB3 . 30 TRP HB3 1 1 287 1 1 1 1 12 ASP HA . 29 ASP HA 1 1 287 1 2 1 1 14 GLU H . 31 GLU H 1 1 288 1 1 1 1 12 ASP HA . 29 ASP HA 1 1 288 1 2 1 1 15 LEU QB . 32 LEU QB 1 1 289 1 1 1 1 12 ASP QB . 29 ASP QB 1 1 289 1 2 1 1 14 GLU H . 31 GLU H 1 1 290 1 1 1 1 12 ASP QB . 29 ASP QB 1 1 290 1 2 1 1 15 LEU H . 32 LEU H 1 1 291 1 1 1 1 12 ASP QB . 29 ASP QB 1 1 291 1 2 1 1 15 LEU QB . 32 LEU QB 1 1 292 1 1 1 1 12 ASP QB . 29 ASP QB 1 1 292 1 2 1 1 15 LEU QD . 32 LEU QQD 1 1 293 1 1 1 1 12 ASP QB . 29 ASP QB 1 1 293 1 2 1 1 18 LYS QG . 35 LYS QG 1 1 294 1 1 1 1 12 ASP HB2 . 29 ASP HB2 1 1 294 1 2 1 1 15 LEU H . 32 LEU H 1 1 295 1 1 1 1 12 ASP HB3 . 29 ASP HB3 1 1 295 1 2 1 1 15 LEU H . 32 LEU H 1 1 296 1 1 1 1 13 TRP H . 30 TRP H 1 1 296 1 2 1 1 13 TRP HD1 . 30 TRP HD1 1 1 297 1 1 1 1 13 TRP H . 30 TRP H 1 1 297 1 2 1 1 13 TRP HE3 . 30 TRP HE3 1 1 298 1 1 1 1 13 TRP H . 30 TRP H 1 1 298 1 2 1 1 14 GLU H . 31 GLU H 1 1 299 1 1 1 1 13 TRP HA . 30 TRP HA 1 1 299 1 2 1 1 13 TRP HD1 . 30 TRP HD1 1 1 300 1 1 1 1 13 TRP HA . 30 TRP HA 1 1 300 1 2 1 1 13 TRP HE3 . 30 TRP HE3 1 1 301 1 1 1 1 13 TRP HA . 30 TRP HA 1 1 301 1 2 1 1 14 GLU QG . 31 GLU QG 1 1 302 1 1 1 1 13 TRP HA . 30 TRP HA 1 1 302 1 2 1 1 15 LEU H . 32 LEU H 1 1 303 1 1 1 1 13 TRP HA . 30 TRP HA 1 1 303 1 2 1 1 16 TRP H . 33 TRP H 1 1 304 1 1 1 1 13 TRP HA . 30 TRP HA 1 1 304 1 2 1 1 16 TRP QB . 33 TRP QB 1 1 305 1 1 1 1 13 TRP HB2 . 30 TRP HB2 1 1 305 1 2 1 1 13 TRP HD1 . 30 TRP HD1 1 1 306 1 1 1 1 13 TRP HB3 . 30 TRP HB3 1 1 306 1 2 1 1 13 TRP HD1 . 30 TRP HD1 1 1 307 1 1 1 1 13 TRP HB3 . 30 TRP HB3 1 1 307 1 2 1 1 13 TRP HE3 . 30 TRP HE3 1 1 308 1 1 1 1 13 TRP HB3 . 30 TRP HB3 1 1 308 1 2 1 1 13 TRP HZ3 . 30 TRP HZ3 1 1 309 1 1 1 1 13 TRP HB3 . 30 TRP HB3 1 1 309 1 2 1 1 14 GLU H . 31 GLU H 1 1 310 1 1 1 1 13 TRP HE3 . 30 TRP HE3 1 1 310 1 2 1 1 14 GLU HA . 31 GLU HA 1 1 311 1 1 1 1 13 TRP HE3 . 30 TRP HE3 1 1 311 1 2 1 1 14 GLU QG . 31 GLU QG 1 1 312 1 1 1 1 13 TRP HE3 . 30 TRP HE3 1 1 312 1 2 1 1 16 TRP H . 33 TRP H 1 1 313 1 1 1 1 13 TRP HZ3 . 30 TRP HZ3 1 1 313 1 2 1 1 14 GLU H . 31 GLU H 1 1 314 1 1 1 1 13 TRP HZ3 . 30 TRP HZ3 1 1 314 1 2 1 1 14 GLU HA . 31 GLU HA 1 1 315 1 1 1 1 13 TRP HZ3 . 30 TRP HZ3 1 1 315 1 2 1 1 14 GLU QG . 31 GLU QG 1 1 316 1 1 1 1 14 GLU H . 31 GLU H 1 1 316 1 2 1 1 14 GLU QG . 31 GLU QG 1 1 317 1 1 1 1 14 GLU H . 31 GLU H 1 1 317 1 2 1 1 15 LEU H . 32 LEU H 1 1 318 1 1 1 1 14 GLU H . 31 GLU H 1 1 318 1 2 1 1 15 LEU HA . 32 LEU HA 1 1 319 1 1 1 1 14 GLU H . 31 GLU H 1 1 319 1 2 1 1 15 LEU QB . 32 LEU QB 1 1 320 1 1 1 1 14 GLU H . 31 GLU H 1 1 320 1 2 1 1 16 TRP H . 33 TRP H 1 1 321 1 1 1 1 14 GLU HA . 31 GLU HA 1 1 321 1 2 1 1 16 TRP H . 33 TRP H 1 1 322 1 1 1 1 14 GLU QB . 31 GLU QB 1 1 322 1 2 1 1 15 LEU H . 32 LEU H 1 1 323 1 1 1 1 14 GLU QB . 31 GLU QB 1 1 323 1 2 1 1 16 TRP H . 33 TRP H 1 1 324 1 1 1 1 15 LEU H . 32 LEU H 1 1 324 1 2 1 1 15 LEU QD . 32 LEU QQD 1 1 325 1 1 1 1 15 LEU H . 32 LEU H 1 1 325 1 2 1 1 16 TRP H . 33 TRP H 1 1 326 1 1 1 1 15 LEU H . 32 LEU H 1 1 326 1 2 1 1 16 TRP QB . 33 TRP QB 1 1 327 1 1 1 1 15 LEU HA . 32 LEU HA 1 1 327 1 2 1 1 15 LEU QD . 32 LEU QQD 1 1 328 1 1 1 1 15 LEU QB . 32 LEU QB 1 1 328 1 2 1 1 16 TRP H . 33 TRP H 1 1 329 1 1 1 1 15 LEU QB . 32 LEU QB 1 1 329 1 2 1 1 16 TRP QB . 33 TRP QB 1 1 330 1 1 1 1 15 LEU QB . 32 LEU QB 1 1 330 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 331 1 1 1 1 15 LEU HB2 . 32 LEU HB2 1 1 331 1 2 1 1 16 TRP H . 33 TRP H 1 1 332 1 1 1 1 15 LEU HB3 . 32 LEU HB3 1 1 332 1 2 1 1 16 TRP H . 33 TRP H 1 1 333 1 1 1 1 15 LEU QD . 32 LEU QQD 1 1 333 1 2 1 1 18 LYS H . 35 LYS H 1 1 334 1 1 1 1 15 LEU QD . 32 LEU QQD 1 1 334 1 2 1 1 18 LYS QD . 35 LYS QD 1 1 335 1 1 1 1 15 LEU QD . 32 LEU QQD 1 1 335 1 2 1 1 18 LYS QE . 35 LYS QE 1 1 336 1 1 1 1 15 LEU QD . 32 LEU QQD 1 1 336 1 2 1 1 18 LYS QG . 35 LYS QG 1 1 337 1 1 1 1 15 LEU QD . 32 LEU QQD 1 1 337 1 2 1 1 19 TRP H . 36 TRP H 1 1 338 1 1 1 1 15 LEU QD . 32 LEU QQD 1 1 338 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 339 1 1 1 1 15 LEU QD . 32 LEU QQD 1 1 339 1 2 1 1 19 TRP HE1 . 36 TRP HE1 1 1 340 1 1 1 1 15 LEU QD . 32 LEU QQD 1 1 340 1 2 1 1 19 TRP HZ2 . 36 TRP HZ2 1 1 341 1 1 1 1 15 LEU MD1 . 32 LEU QD1 1 1 341 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 342 1 1 1 1 15 LEU MD2 . 32 LEU QD2 1 1 342 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 343 1 1 1 1 15 LEU HG . 32 LEU HG 1 1 343 1 2 1 1 16 TRP HA . 33 TRP HA 1 1 344 1 1 1 1 15 LEU HG . 32 LEU HG 1 1 344 1 2 1 1 18 LYS HG2 . 35 LYS HG2 1 1 345 1 1 1 1 15 LEU HG . 32 LEU HG 1 1 345 1 2 1 1 18 LYS HG3 . 35 LYS HG3 1 1 346 1 1 1 1 15 LEU HG . 32 LEU HG 1 1 346 1 2 1 1 19 TRP H . 36 TRP H 1 1 347 1 1 1 1 15 LEU HG . 32 LEU HG 1 1 347 1 2 1 1 19 TRP HE1 . 36 TRP HE1 1 1 348 1 1 1 1 16 TRP H . 33 TRP H 1 1 348 1 2 1 1 16 TRP HB2 . 33 TRP HB2 1 1 349 1 1 1 1 16 TRP H . 33 TRP H 1 1 349 1 2 1 1 16 TRP HB3 . 33 TRP HB3 1 1 350 1 1 1 1 16 TRP H . 33 TRP H 1 1 350 1 2 1 1 16 TRP HE3 . 33 TRP HE3 1 1 351 1 1 1 1 16 TRP H . 33 TRP H 1 1 351 1 2 1 1 19 TRP H . 36 TRP H 1 1 352 1 1 1 1 16 TRP HA . 33 TRP HA 1 1 352 1 2 1 1 16 TRP HD1 . 33 TRP HD1 1 1 353 1 1 1 1 16 TRP HA . 33 TRP HA 1 1 353 1 2 1 1 16 TRP HE3 . 33 TRP HE3 1 1 354 1 1 1 1 16 TRP HA . 33 TRP HA 1 1 354 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 355 1 1 1 1 16 TRP QB . 33 TRP QB 1 1 355 1 2 1 1 17 ASP H . 34 ASP H 1 1 356 1 1 1 1 16 TRP HE1 . 33 TRP HE1 1 1 356 1 2 1 1 20 CYS HB2 . 37 CYSS HB2 1 1 357 1 1 1 1 16 TRP HE1 . 33 TRP HE1 1 1 357 1 2 1 1 20 CYS HB3 . 37 CYSS HB3 1 1 358 1 1 1 1 16 TRP HE3 . 33 TRP HE3 1 1 358 1 2 1 1 17 ASP H . 34 ASP H 1 1 359 1 1 1 1 16 TRP HE3 . 33 TRP HE3 1 1 359 1 2 1 1 17 ASP HA . 34 ASP HA 1 1 360 1 1 1 1 16 TRP HH2 . 33 TRP HH2 1 1 360 1 2 1 1 17 ASP HA . 34 ASP HA 1 1 361 1 1 1 1 16 TRP HZ2 . 33 TRP HZ2 1 1 361 1 2 1 1 17 ASP HA . 34 ASP HA 1 1 362 1 1 1 1 17 ASP H . 34 ASP H 1 1 362 1 2 1 1 19 TRP H . 36 TRP H 1 1 363 1 1 1 1 17 ASP H . 34 ASP H 1 1 363 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 364 1 1 1 1 17 ASP H . 34 ASP H 1 1 364 1 2 1 1 20 CYS H . 37 CYSS H 1 1 365 1 1 1 1 17 ASP HA . 34 ASP HA 1 1 365 1 2 1 1 19 TRP H . 36 TRP H 1 1 366 1 1 1 1 17 ASP QB . 34 ASP QB 1 1 366 1 2 1 1 18 LYS H . 35 LYS H 1 1 367 1 1 1 1 17 ASP QB . 34 ASP QB 1 1 367 1 2 1 1 18 LYS HA . 35 LYS HA 1 1 368 1 1 1 1 17 ASP QB . 34 ASP QB 1 1 368 1 2 1 1 18 LYS QB . 35 LYS QB 1 1 369 1 1 1 1 17 ASP QB . 34 ASP QB 1 1 369 1 2 1 1 18 LYS HG2 . 35 LYS HG2 1 1 370 1 1 1 1 17 ASP QB . 34 ASP QB 1 1 370 1 2 1 1 18 LYS QG . 35 LYS QG 1 1 371 1 1 1 1 17 ASP QB . 34 ASP QB 1 1 371 1 2 1 1 18 LYS HG3 . 35 LYS HG3 1 1 372 1 1 1 1 18 LYS H . 35 LYS H 1 1 372 1 2 1 1 18 LYS HB2 . 35 LYS HB2 1 1 373 1 1 1 1 18 LYS H . 35 LYS H 1 1 373 1 2 1 1 18 LYS HB3 . 35 LYS HB3 1 1 374 1 1 1 1 18 LYS H . 35 LYS H 1 1 374 1 2 1 1 18 LYS HG2 . 35 LYS HG2 1 1 375 1 1 1 1 18 LYS H . 35 LYS H 1 1 375 1 2 1 1 18 LYS QG . 35 LYS QG 1 1 376 1 1 1 1 18 LYS H . 35 LYS H 1 1 376 1 2 1 1 18 LYS HG3 . 35 LYS HG3 1 1 377 1 1 1 1 18 LYS H . 35 LYS H 1 1 377 1 2 1 1 19 TRP H . 36 TRP H 1 1 378 1 1 1 1 18 LYS H . 35 LYS H 1 1 378 1 2 1 1 19 TRP HA . 36 TRP HA 1 1 379 1 1 1 1 18 LYS H . 35 LYS H 1 1 379 1 2 1 1 20 CYS H . 37 CYSS H 1 1 380 1 1 1 1 18 LYS QB . 35 LYS QB 1 1 380 1 2 1 1 18 LYS QD . 35 LYS QD 1 1 381 1 1 1 1 18 LYS QB . 35 LYS QB 1 1 381 1 2 1 1 19 TRP H . 36 TRP H 1 1 382 1 1 1 1 18 LYS QB . 35 LYS QB 1 1 382 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 383 1 1 1 1 18 LYS HB2 . 35 LYS HB2 1 1 383 1 2 1 1 19 TRP H . 36 TRP H 1 1 384 1 1 1 1 18 LYS HB3 . 35 LYS HB3 1 1 384 1 2 1 1 19 TRP H . 36 TRP H 1 1 385 1 1 1 1 18 LYS QD . 35 LYS QD 1 1 385 1 2 1 1 19 TRP HE1 . 36 TRP HE1 1 1 386 1 1 1 1 18 LYS HD2 . 35 LYS HD2 1 1 386 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 387 1 1 1 1 18 LYS HD3 . 35 LYS HD3 1 1 387 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 388 1 1 1 1 18 LYS QE . 35 LYS QE 1 1 388 1 2 1 1 19 TRP H . 36 TRP H 1 1 389 1 1 1 1 18 LYS QE . 35 LYS QE 1 1 389 1 2 1 1 19 TRP HD1 . 36 TRP HD1 1 1 390 1 1 1 1 18 LYS QE . 35 LYS QE 1 1 390 1 2 1 1 19 TRP HZ2 . 36 TRP HZ2 1 1 391 1 1 1 1 18 LYS QE . 35 LYS QE 1 1 391 1 2 1 1 20 CYS H . 37 CYSS H 1 1 392 1 1 1 1 18 LYS QG . 35 LYS QG 1 1 392 1 2 1 1 19 TRP HE1 . 36 TRP HE1 1 1 393 1 1 1 1 18 LYS QG . 35 LYS QG 1 1 393 1 2 1 1 20 CYS H . 37 CYSS H 1 1 394 1 1 1 1 18 LYS HG2 . 35 LYS HG2 1 1 394 1 2 1 1 19 TRP H . 36 TRP H 1 1 395 1 1 1 1 18 LYS HG3 . 35 LYS HG3 1 1 395 1 2 1 1 19 TRP H . 36 TRP H 1 1 396 1 1 1 1 19 TRP H . 36 TRP H 1 1 396 1 2 1 1 20 CYS H . 37 CYSS H 1 1 397 1 1 1 1 19 TRP HA . 36 TRP HA 1 1 397 1 2 1 1 19 TRP HE3 . 36 TRP HE3 1 1 398 1 1 1 1 19 TRP QB . 36 TRP QB 1 1 398 1 2 1 1 20 CYS H . 37 CYSS H 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 . . . . . . . 5.41 1 1 2 1 . . . . . . . 4.86 1 1 3 1 . . . . . . . 5.28 1 1 4 1 . . . . . . . 5.39 1 1 5 1 . . . . . . . 4.95 1 1 6 1 . . . . . . . 4.77 1 1 7 1 . . . . . . . 4.77 1 1 8 1 . . . . . . . 4.24 1 1 9 1 . . . . . . . 4.92 1 1 10 1 . . . . . . . 5.5 1 1 11 1 . . . . . . . 5.37 1 1 12 1 . . . . . . . 5.5 1 1 13 1 . . . . . . . 5.47 1 1 14 1 . . . . . . . 4.24 1 1 15 1 . . . . . . . 5.5 1 1 16 1 . . . . . . . 5.37 1 1 17 1 . . . . . . . 5.5 1 1 18 1 . . . . . . . 5.47 1 1 19 1 . . . . . . . 4.24 1 1 20 1 . . . . . . . 5.17 1 1 21 1 . . . . . . . 3.28 1 1 22 1 . . . . . . . 3.82 1 1 23 1 . . . . . . . 3.78 1 1 24 1 . . . . . . . 4.68 1 1 25 1 . . . . . . . 3.78 1 1 26 1 . . . . . . . 4.68 1 1 27 1 . . . . . . . 4.83 1 1 28 1 . . . . . . . 5.13 1 1 29 1 . . . . . . . 4.97 1 1 30 1 . . . . . . . 4.15 1 1 31 1 . . . . . . . 3.61 1 1 32 1 . . . . . . . 4.15 1 1 33 1 . . . . . . . 3.86 1 1 34 1 . . . . . . . 5.5 1 1 35 1 . . . . . . . 5.5 1 1 36 1 . . . . . . . 4.27 1 1 37 1 . . . . . . . 5.5 1 1 38 1 . . . . . . . 4.71 1 1 39 1 . . . . . . . 3.56 1 1 40 1 . . . . . . . 4.79 1 1 41 1 . . . . . . . 4.46 1 1 42 1 . . . . . . . 3.55 1 1 43 1 . . . . . . . 4.29 1 1 44 1 . . . . . . . 3.59 1 1 45 1 . . . . . . . 5.5 1 1 46 1 . . . . . . . 5.5 1 1 47 1 . . . . . . . 4.16 1 1 48 1 . . . . . . . 4.3 1 1 49 1 . . . . . . . 5.17 1 1 50 1 . . . . . . . 5.5 1 1 51 1 . . . . . . . 5.5 1 1 52 1 . . . . . . . 4.74 1 1 53 1 . . . . . . . 5.5 1 1 54 1 . . . . . . . 3.95 1 1 55 1 . . . . . . . 4.71 1 1 56 1 . . . . . . . 4.92 1 1 57 1 . . . . . . . 4.65 1 1 58 1 . . . . . . . 4.86 1 1 59 1 . . . . . . . 5.5 1 1 60 1 . . . . . . . 4.4 1 1 61 1 . . . . . . . 5.5 1 1 62 1 . . . . . . . 4.65 1 1 63 1 . . . . . . . 4.21 1 1 64 1 . . . . . . . 4.67 1 1 65 1 . . . . . . . 4.89 1 1 66 1 . . . . . . . 4.18 1 1 67 1 . . . . . . . 5.48 1 1 68 1 . . . . . . . 4.69 1 1 69 1 . . . . . . . 5.48 1 1 70 1 . . . . . . . 3.16 1 1 71 1 . . . . . . . 4.44 1 1 72 1 . . . . . . . 4.95 1 1 73 1 . . . . . . . 5.12 1 1 74 1 . . . . . . . 5.12 1 1 75 1 . . . . . . . 4.13 1 1 76 1 . . . . . . . 4.02 1 1 77 1 . . . . . . . 4.91 1 1 78 1 . . . . . . . 4.32 1 1 79 1 . . . . . . . 4.91 1 1 80 1 . . . . . . . 4.15 1 1 81 1 . . . . . . . 4.09 1 1 82 1 . . . . . . . 3.06 1 1 83 1 . . . . . . . 4.46 1 1 84 1 . . . . . . . 4.15 1 1 85 1 . . . . . . . 4.42 1 1 86 1 . . . . . . . 5.34 1 1 87 1 . . . . . . . 3.6 1 1 88 1 . . . . . . . 5.11 1 1 89 1 . . . . . . . 3.6 1 1 90 1 . . . . . . . 5.11 1 1 91 1 . . . . . . . 4.09 1 1 92 1 . . . . . . . 4.09 1 1 93 1 . . . . . . . 4.36 1 1 94 1 . . . . . . . 4.36 1 1 95 1 . . . . . . . 3.55 1 1 96 1 . . . . . . . 5.34 1 1 97 1 . . . . . . . 4.72 1 1 98 1 . . . . . . . 5.17 1 1 99 1 . . . . . . . 4.64 1 1 100 1 . . . . . . . 3.98 1 1 101 1 . . . . . . . 5.16 1 1 102 1 . . . . . . . 5.27 1 1 103 1 . . . . . . . 4.67 1 1 104 1 . . . . . . . 4.67 1 1 105 1 . . . . . . . 3.64 1 1 106 1 . . . . . . . 4.33 1 1 107 1 . . . . . . . 4.27 1 1 108 1 . . . . . . . 3.76 1 1 109 1 . . . . . . . 5.18 1 1 110 1 . . . . . . . 4.65 1 1 111 1 . . . . . . . 4.18 1 1 112 1 . . . . . . . 4.86 1 1 113 1 . . . . . . . 5.49 1 1 114 1 . . . . . . . 4.86 1 1 115 1 . . . . . . . 5.49 1 1 116 1 . . . . . . . 5.17 1 1 117 1 . . . . . . . 5.32 1 1 118 1 . . . . . . . 5.34 1 1 119 1 . . . . . . . 4.65 1 1 120 1 . . . . . . . 5.42 1 1 121 1 . . . . . . . 3.91 1 1 122 1 . . . . . . . 3.91 1 1 123 1 . . . . . . . 5.15 1 1 124 1 . . . . . . . 5.5 1 1 125 1 . . . . . . . 5.42 1 1 126 1 . . . . . . . 5.38 1 1 127 1 . . . . . . . 5.5 1 1 128 1 . . . . . . . 4.59 1 1 129 1 . . . . . . . 4.16 1 1 130 1 . . . . . . . 4.02 1 1 131 1 . . . . . . . 4.01 1 1 132 1 . . . . . . . 3.22 1 1 133 1 . . . . . . . 4.01 1 1 134 1 . . . . . . . 3.02 1 1 135 1 . . . . . . . 5.05 1 1 136 1 . . . . . . . 3.92 1 1 137 1 . . . . . . . 5.21 1 1 138 1 . . . . . . . 4.65 1 1 139 1 . . . . . . . 4.72 1 1 140 1 . . . . . . . 5.23 1 1 141 1 . . . . . . . 2.92 1 1 142 1 . . . . . . . 2.92 1 1 143 1 . . . . . . . 4.8 1 1 144 1 . . . . . . . 4.52 1 1 145 1 . . . . . . . 4.96 1 1 146 1 . . . . . . . 4.96 1 1 147 1 . . . . . . . 2.93 1 1 148 1 . . . . . . . 2.93 1 1 149 1 . . . . . . . 5.5 1 1 150 1 . . . . . . . 4.0 1 1 151 1 . . . . . . . 5.34 1 1 152 1 . . . . . . . 3.7 1 1 153 1 . . . . . . . 4.96 1 1 154 1 . . . . . . . 2.64 1 1 155 1 . . . . . . . 4.39 1 1 156 1 . . . . . . . 4.72 1 1 157 1 . . . . . . . 4.22 1 1 158 1 . . . . . . . 3.25 1 1 159 1 . . . . . . . 3.9 1 1 160 1 . . . . . . . 4.67 1 1 161 1 . . . . . . . 3.67 1 1 162 1 . . . . . . . 3.82 1 1 163 1 . . . . . . . 5.31 1 1 164 1 . . . . . . . 5.5 1 1 165 1 . . . . . . . 5.09 1 1 166 1 . . . . . . . 3.82 1 1 167 1 . . . . . . . 5.31 1 1 168 1 . . . . . . . 5.5 1 1 169 1 . . . . . . . 5.09 1 1 170 1 . . . . . . . 4.89 1 1 171 1 . . . . . . . 5.34 1 1 172 1 . . . . . . . 5.38 1 1 173 1 . . . . . . . 5.5 1 1 174 1 . . . . . . . 5.5 1 1 175 1 . . . . . . . 5.5 1 1 176 1 . . . . . . . 3.38 1 1 177 1 . . . . . . . 3.63 1 1 178 1 . . . . . . . 4.8 1 1 179 1 . . . . . . . 4.41 1 1 180 1 . . . . . . . 4.51 1 1 181 1 . . . . . . . 3.91 1 1 182 1 . . . . . . . 4.51 1 1 183 1 . . . . . . . 3.89 1 1 184 1 . . . . . . . 4.88 1 1 185 1 . . . . . . . 4.26 1 1 186 1 . . . . . . . 3.98 1 1 187 1 . . . . . . . 3.06 1 1 188 1 . . . . . . . 3.22 1 1 189 1 . . . . . . . 3.68 1 1 190 1 . . . . . . . 4.54 1 1 191 1 . . . . . . . 4.32 1 1 192 1 . . . . . . . 4.9 1 1 193 1 . . . . . . . 2.99 1 1 194 1 . . . . . . . 2.99 1 1 195 1 . . . . . . . 3.4 1 1 196 1 . . . . . . . 4.8 1 1 197 1 . . . . . . . 4.72 1 1 198 1 . . . . . . . 4.23 1 1 199 1 . . . . . . . 4.83 1 1 200 1 . . . . . . . 4.0 1 1 201 1 . . . . . . . 5.06 1 1 202 1 . . . . . . . 4.61 1 1 203 1 . . . . . . . 5.06 1 1 204 1 . . . . . . . 4.61 1 1 205 1 . . . . . . . 4.14 1 1 206 1 . . . . . . . 4.02 1 1 207 1 . . . . . . . 4.77 1 1 208 1 . . . . . . . 4.15 1 1 209 1 . . . . . . . 4.61 1 1 210 1 . . . . . . . 4.71 1 1 211 1 . . . . . . . 4.62 1 1 212 1 . . . . . . . 4.87 1 1 213 1 . . . . . . . 3.78 1 1 214 1 . . . . . . . 4.71 1 1 215 1 . . . . . . . 4.62 1 1 216 1 . . . . . . . 4.87 1 1 217 1 . . . . . . . 3.78 1 1 218 1 . . . . . . . 5.3 1 1 219 1 . . . . . . . 5.21 1 1 220 1 . . . . . . . 4.43 1 1 221 1 . . . . . . . 3.16 1 1 222 1 . . . . . . . 5.5 1 1 223 1 . . . . . . . 5.5 1 1 224 1 . . . . . . . 5.5 1 1 225 1 . . . . . . . 5.5 1 1 226 1 . . . . . . . 4.11 1 1 227 1 . . . . . . . 4.63 1 1 228 1 . . . . . . . 3.31 1 1 229 1 . . . . . . . 5.32 1 1 230 1 . . . . . . . 5.34 1 1 231 1 . . . . . . . 4.03 1 1 232 1 . . . . . . . 3.64 1 1 233 1 . . . . . . . 4.03 1 1 234 1 . . . . . . . 4.62 1 1 235 1 . . . . . . . 4.57 1 1 236 1 . . . . . . . 4.51 1 1 237 1 . . . . . . . 4.17 1 1 238 1 . . . . . . . 4.68 1 1 239 1 . . . . . . . 5.38 1 1 240 1 . . . . . . . 5.15 1 1 241 1 . . . . . . . 4.17 1 1 242 1 . . . . . . . 4.68 1 1 243 1 . . . . . . . 5.38 1 1 244 1 . . . . . . . 5.15 1 1 245 1 . . . . . . . 3.93 1 1 246 1 . . . . . . . 4.36 1 1 247 1 . . . . . . . 3.3 1 1 248 1 . . . . . . . 4.05 1 1 249 1 . . . . . . . 4.45 1 1 250 1 . . . . . . . 4.47 1 1 251 1 . . . . . . . 4.56 1 1 252 1 . . . . . . . 5.5 1 1 253 1 . . . . . . . 4.93 1 1 254 1 . . . . . . . 3.35 1 1 255 1 . . . . . . . 3.35 1 1 256 1 . . . . . . . 3.38 1 1 257 1 . . . . . . . 3.16 1 1 258 1 . . . . . . . 3.45 1 1 259 1 . . . . . . . 4.96 1 1 260 1 . . . . . . . 4.29 1 1 261 1 . . . . . . . 3.57 1 1 262 1 . . . . . . . 4.7 1 1 263 1 . . . . . . . 4.41 1 1 264 1 . . . . . . . 4.06 1 1 265 1 . . . . . . . 4.89 1 1 266 1 . . . . . . . 4.45 1 1 267 1 . . . . . . . 5.15 1 1 268 1 . . . . . . . 4.67 1 1 269 1 . . . . . . . 4.48 1 1 270 1 . . . . . . . 3.63 1 1 271 1 . . . . . . . 3.8 1 1 272 1 . . . . . . . 4.74 1 1 273 1 . . . . . . . 4.21 1 1 274 1 . . . . . . . 5.45 1 1 275 1 . . . . . . . 5.36 1 1 276 1 . . . . . . . 5.24 1 1 277 1 . . . . . . . 4.94 1 1 278 1 . . . . . . . 4.25 1 1 279 1 . . . . . . . 5.46 1 1 280 1 . . . . . . . 5.5 1 1 281 1 . . . . . . . 4.64 1 1 282 1 . . . . . . . 5.5 1 1 283 1 . . . . . . . 5.5 1 1 284 1 . . . . . . . 4.59 1 1 285 1 . . . . . . . 4.54 1 1 286 1 . . . . . . . 5.21 1 1 287 1 . . . . . . . 5.5 1 1 288 1 . . . . . . . 4.88 1 1 289 1 . . . . . . . 5.34 1 1 290 1 . . . . . . . 4.63 1 1 291 1 . . . . . . . 4.02 1 1 292 1 . . . . . . . 4.32 1 1 293 1 . . . . . . . 4.74 1 1 294 1 . . . . . . . 5.28 1 1 295 1 . . . . . . . 5.28 1 1 296 1 . . . . . . . 5.06 1 1 297 1 . . . . . . . 5.1 1 1 298 1 . . . . . . . 4.69 1 1 299 1 . . . . . . . 3.85 1 1 300 1 . . . . . . . 3.99 1 1 301 1 . . . . . . . 5.5 1 1 302 1 . . . . . . . 5.5 1 1 303 1 . . . . . . . 4.23 1 1 304 1 . . . . . . . 3.86 1 1 305 1 . . . . . . . 3.46 1 1 306 1 . . . . . . . 3.56 1 1 307 1 . . . . . . . 3.52 1 1 308 1 . . . . . . . 5.4 1 1 309 1 . . . . . . . 4.08 1 1 310 1 . . . . . . . 3.5 1 1 311 1 . . . . . . . 4.04 1 1 312 1 . . . . . . . 4.93 1 1 313 1 . . . . . . . 5.5 1 1 314 1 . . . . . . . 4.56 1 1 315 1 . . . . . . . 4.55 1 1 316 1 . . . . . . . 4.02 1 1 317 1 . . . . . . . 4.16 1 1 318 1 . . . . . . . 5.5 1 1 319 1 . . . . . . . 5.34 1 1 320 1 . . . . . . . 4.66 1 1 321 1 . . . . . . . 4.96 1 1 322 1 . . . . . . . 4.67 1 1 323 1 . . . . . . . 5.5 1 1 324 1 . . . . . . . 5.17 1 1 325 1 . . . . . . . 3.94 1 1 326 1 . . . . . . . 5.29 1 1 327 1 . . . . . . . 3.83 1 1 328 1 . . . . . . . 3.84 1 1 329 1 . . . . . . . 5.18 1 1 330 1 . . . . . . . 5.09 1 1 331 1 . . . . . . . 4.49 1 1 332 1 . . . . . . . 4.49 1 1 333 1 . . . . . . . 5.31 1 1 334 1 . . . . . . . 4.04 1 1 335 1 . . . . . . . 4.86 1 1 336 1 . . . . . . . 3.86 1 1 337 1 . . . . . . . 5.44 1 1 338 1 . . . . . . . 4.1 1 1 339 1 . . . . . . . 4.29 1 1 340 1 . . . . . . . 5.17 1 1 341 1 . . . . . . . 4.97 1 1 342 1 . . . . . . . 4.97 1 1 343 1 . . . . . . . 5.5 1 1 344 1 . . . . . . . 5.5 1 1 345 1 . . . . . . . 5.5 1 1 346 1 . . . . . . . 4.86 1 1 347 1 . . . . . . . 5.03 1 1 348 1 . . . . . . . 3.55 1 1 349 1 . . . . . . . 3.55 1 1 350 1 . . . . . . . 5.3 1 1 351 1 . . . . . . . 5.5 1 1 352 1 . . . . . . . 4.66 1 1 353 1 . . . . . . . 4.37 1 1 354 1 . . . . . . . 5.01 1 1 355 1 . . . . . . . 4.1 1 1 356 1 . . . . . . . 5.02 1 1 357 1 . . . . . . . 5.02 1 1 358 1 . . . . . . . 5.3 1 1 359 1 . . . . . . . 4.58 1 1 360 1 . . . . . . . 5.24 1 1 361 1 . . . . . . . 5.5 1 1 362 1 . . . . . . . 5.5 1 1 363 1 . . . . . . . 5.38 1 1 364 1 . . . . . . . 5.5 1 1 365 1 . . . . . . . 5.5 1 1 366 1 . . . . . . . 4.6 1 1 367 1 . . . . . . . 5.27 1 1 368 1 . . . . . . . 4.66 1 1 369 1 . . . . . . . 5.5 1 1 370 1 . . . . . . . 4.7 1 1 371 1 . . . . . . . 5.5 1 1 372 1 . . . . . . . 3.92 1 1 373 1 . . . . . . . 3.92 1 1 374 1 . . . . . . . 5.39 1 1 375 1 . . . . . . . 4.67 1 1 376 1 . . . . . . . 5.39 1 1 377 1 . . . . . . . 4.27 1 1 378 1 . . . . . . . 5.5 1 1 379 1 . . . . . . . 5.19 1 1 380 1 . . . . . . . 3.12 1 1 381 1 . . . . . . . 4.21 1 1 382 1 . . . . . . . 4.61 1 1 383 1 . . . . . . . 4.86 1 1 384 1 . . . . . . . 4.86 1 1 385 1 . . . . . . . 4.45 1 1 386 1 . . . . . . . 5.23 1 1 387 1 . . . . . . . 5.23 1 1 388 1 . . . . . . . 5.34 1 1 389 1 . . . . . . . 5.09 1 1 390 1 . . . . . . . 4.86 1 1 391 1 . . . . . . . 5.34 1 1 392 1 . . . . . . . 5.34 1 1 393 1 . . . . . . . 5.34 1 1 394 1 . . . . . . . 5.5 1 1 395 1 . . . . . . . 5.5 1 1 396 1 . . . . . . . 4.03 1 1 397 1 . . . . . . . 4.57 1 1 398 1 . . . . . . . 4.82 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ASN C C 3.228 1.017 -1.184 1.00 . A A . 18 ASN C 1 1 1 2 1 1 1 ASN CA C 2.093 -0.001 -1.242 1.00 . A A . 18 ASN CA 1 1 1 3 1 1 1 ASN CB C 1.178 0.306 -2.429 1.00 . A A . 18 ASN CB 1 1 1 4 1 1 1 ASN CG C -0.002 1.175 -2.039 1.00 . A A . 18 ASN CG 1 1 1 5 1 1 1 ASN H1 H 1.808 0.001 0.855 1.00 . A A . 18 ASN H1 1 1 1 6 1 1 1 ASN HA H 2.515 -0.987 -1.370 1.00 . A A . 18 ASN HA 1 1 1 7 1 1 1 ASN HB2 H 1.745 0.824 -3.189 1.00 . A A . 18 ASN HB2 1 1 1 8 1 1 1 ASN HB3 H 0.801 -0.620 -2.835 1.00 . A A . 18 ASN HB3 1 1 1 9 1 1 1 ASN HD21 H 0.778 2.719 -3.020 1.00 . A A . 18 ASN HD21 1 1 1 10 1 1 1 ASN HD22 H -0.735 3.012 -2.239 1.00 . A A . 18 ASN HD22 1 1 1 11 1 1 1 ASN N N 1.329 0.000 0.000 1.00 . A A . 18 ASN N 1 1 1 12 1 1 1 ASN ND2 N 0.015 2.429 -2.477 1.00 . A A . 18 ASN ND2 1 1 1 13 1 1 1 ASN O O 4.399 0.652 -1.067 1.00 . A A . 18 ASN O 1 1 1 14 1 1 1 ASN OD1 O -0.919 0.724 -1.352 1.00 . A A . 18 ASN OD1 1 1 1 15 1 1 2 CYS C C 4.974 3.124 -2.237 1.00 . A A . 19 CYS C 1 1 1 16 1 1 2 CYS CA C 3.861 3.367 -1.221 1.00 . A A . 19 CYS CA 1 1 1 17 1 1 2 CYS CB C 4.455 3.485 0.184 1.00 . A A . 19 CYS CB 1 1 1 18 1 1 2 CYS H H 1.924 2.523 -1.357 1.00 . A A . 19 CYS H 1 1 1 19 1 1 2 CYS HA H 3.360 4.290 -1.469 1.00 . A A . 19 CYS HA 1 1 1 20 1 1 2 CYS HB2 H 3.662 3.380 0.911 1.00 . A A . 19 CYS HB2 1 1 1 21 1 1 2 CYS HB3 H 5.176 2.694 0.329 1.00 . A A . 19 CYS HB3 1 1 1 22 1 1 2 CYS N N 2.874 2.295 -1.265 1.00 . A A . 19 CYS N 1 1 1 23 1 1 2 CYS O O 6.110 3.555 -2.043 1.00 . A A . 19 CYS O 1 1 1 24 1 1 2 CYS SG S 5.294 5.069 0.506 1.00 . A A . 19 CYS SG 1 1 1 25 1 1 3 ASP C C 5.211 2.795 -5.680 1.00 . A A . 20 ASP C 1 1 1 26 1 1 3 ASP CA C 5.608 2.130 -4.366 1.00 . A A . 20 ASP CA 1 1 1 27 1 1 3 ASP CB C 5.728 0.618 -4.561 1.00 . A A . 20 ASP CB 1 1 1 28 1 1 3 ASP CG C 7.168 0.165 -4.701 1.00 . A A . 20 ASP CG 1 1 1 29 1 1 3 ASP H H 3.716 2.113 -3.416 1.00 . A A . 20 ASP H 1 1 1 30 1 1 3 ASP HA H 6.564 2.521 -4.054 1.00 . A A . 20 ASP HA 1 1 1 31 1 1 3 ASP HB2 H 5.294 0.115 -3.708 1.00 . A A . 20 ASP HB2 1 1 1 32 1 1 3 ASP HB3 H 5.191 0.332 -5.453 1.00 . A A . 20 ASP HB3 1 1 1 33 1 1 3 ASP N N 4.638 2.430 -3.319 1.00 . A A . 20 ASP N 1 1 1 34 1 1 3 ASP O O 5.866 2.605 -6.705 1.00 . A A . 20 ASP O 1 1 1 35 1 1 3 ASP OD1 O 7.872 0.691 -5.588 1.00 . A A . 20 ASP OD1 1 1 1 36 1 1 3 ASP OD2 O 7.591 -0.715 -3.923 1.00 . A A . 20 ASP OD2 1 1 1 37 1 1 4 TRP C C 2.894 5.533 -6.453 1.00 . A A . 21 TRP C 1 1 1 38 1 1 4 TRP CA C 3.651 4.264 -6.832 1.00 . A A . 21 TRP CA 1 1 1 39 1 1 4 TRP CB C 2.747 3.342 -7.651 1.00 . A A . 21 TRP CB 1 1 1 40 1 1 4 TRP CD1 C 0.913 3.000 -5.893 1.00 . A A . 21 TRP CD1 1 1 1 41 1 1 4 TRP CD2 C 1.676 1.104 -6.808 1.00 . A A . 21 TRP CD2 1 1 1 42 1 1 4 TRP CE2 C 0.680 0.780 -5.866 1.00 . A A . 21 TRP CE2 1 1 1 43 1 1 4 TRP CE3 C 2.300 0.070 -7.512 1.00 . A A . 21 TRP CE3 1 1 1 44 1 1 4 TRP CG C 1.809 2.529 -6.810 1.00 . A A . 21 TRP CG 1 1 1 45 1 1 4 TRP CH2 C 0.924 -1.527 -6.315 1.00 . A A . 21 TRP CH2 1 1 1 46 1 1 4 TRP CZ2 C 0.297 -0.534 -5.611 1.00 . A A . 21 TRP CZ2 1 1 1 47 1 1 4 TRP CZ3 C 1.918 -1.233 -7.258 1.00 . A A . 21 TRP CZ3 1 1 1 48 1 1 4 TRP H H 3.655 3.684 -4.795 1.00 . A A . 21 TRP H 1 1 1 49 1 1 4 TRP HA H 4.509 4.536 -7.429 1.00 . A A . 21 TRP HA 1 1 1 50 1 1 4 TRP HB2 H 2.155 3.938 -8.330 1.00 . A A . 21 TRP HB2 1 1 1 51 1 1 4 TRP HB3 H 3.362 2.660 -8.220 1.00 . A A . 21 TRP HB3 1 1 1 52 1 1 4 TRP HD1 H 0.774 4.045 -5.661 1.00 . A A . 21 TRP HD1 1 1 1 53 1 1 4 TRP HE1 H -0.465 2.035 -4.636 1.00 . A A . 21 TRP HE1 1 1 1 54 1 1 4 TRP HE3 H 3.068 0.276 -8.243 1.00 . A A . 21 TRP HE3 1 1 1 55 1 1 4 TRP HH2 H 0.659 -2.559 -6.148 1.00 . A A . 21 TRP HH2 1 1 1 56 1 1 4 TRP HZ2 H -0.468 -0.777 -4.888 1.00 . A A . 21 TRP HZ2 1 1 1 57 1 1 4 TRP HZ3 H 2.390 -2.046 -7.791 1.00 . A A . 21 TRP HZ3 1 1 1 58 1 1 4 TRP N N 4.135 3.572 -5.643 1.00 . A A . 21 TRP N 1 1 1 59 1 1 4 TRP NE1 N 0.231 1.953 -5.322 1.00 . A A . 21 TRP NE1 1 1 1 60 1 1 4 TRP O O 2.329 5.627 -5.363 1.00 . A A . 21 TRP O 1 1 1 61 1 1 5 ASP C C 1.829 8.443 -8.436 1.00 . A A . 22 ASP C 1 1 1 62 1 1 5 ASP CA C 2.198 7.768 -7.119 1.00 . A A . 22 ASP CA 1 1 1 63 1 1 5 ASP CB C 3.074 8.700 -6.280 1.00 . A A . 22 ASP CB 1 1 1 64 1 1 5 ASP CG C 4.551 8.391 -6.424 1.00 . A A . 22 ASP CG 1 1 1 65 1 1 5 ASP H H 3.356 6.370 -8.208 1.00 . A A . 22 ASP H 1 1 1 66 1 1 5 ASP HA H 1.292 7.553 -6.573 1.00 . A A . 22 ASP HA 1 1 1 67 1 1 5 ASP HB2 H 2.906 9.720 -6.595 1.00 . A A . 22 ASP HB2 1 1 1 68 1 1 5 ASP HB3 H 2.802 8.599 -5.240 1.00 . A A . 22 ASP HB3 1 1 1 69 1 1 5 ASP N N 2.887 6.505 -7.358 1.00 . A A . 22 ASP N 1 1 1 70 1 1 5 ASP O O 2.587 8.396 -9.404 1.00 . A A . 22 ASP O 1 1 1 71 1 1 5 ASP OD1 O 5.162 8.857 -7.409 1.00 . A A . 22 ASP OD1 1 1 1 72 1 1 5 ASP OD2 O 5.097 7.685 -5.551 1.00 . A A . 22 ASP OD2 1 1 1 73 1 1 6 LYS C C 0.366 8.882 -10.897 1.00 . A A . 23 LYS C 1 1 1 74 1 1 6 LYS CA C 0.187 9.758 -9.662 1.00 . A A . 23 LYS CA 1 1 1 75 1 1 6 LYS CB C 0.939 11.078 -9.847 1.00 . A A . 23 LYS CB 1 1 1 76 1 1 6 LYS CD C 0.035 13.167 -8.783 1.00 . A A . 23 LYS CD 1 1 1 77 1 1 6 LYS CE C 0.816 14.382 -9.257 1.00 . A A . 23 LYS CE 1 1 1 78 1 1 6 LYS CG C 0.939 11.957 -8.608 1.00 . A A . 23 LYS CG 1 1 1 79 1 1 6 LYS H H 0.098 9.075 -7.660 1.00 . A A . 23 LYS H 1 1 1 80 1 1 6 LYS HA H -0.864 9.967 -9.532 1.00 . A A . 23 LYS HA 1 1 1 81 1 1 6 LYS HB2 H 1.964 10.861 -10.109 1.00 . A A . 23 LYS HB2 1 1 1 82 1 1 6 LYS HB3 H 0.480 11.630 -10.654 1.00 . A A . 23 LYS HB3 1 1 1 83 1 1 6 LYS HD2 H -0.726 12.934 -9.513 1.00 . A A . 23 LYS HD2 1 1 1 84 1 1 6 LYS HD3 H -0.431 13.396 -7.835 1.00 . A A . 23 LYS HD3 1 1 1 85 1 1 6 LYS HE2 H 0.326 15.273 -8.895 1.00 . A A . 23 LYS HE2 1 1 1 86 1 1 6 LYS HE3 H 1.816 14.332 -8.852 1.00 . A A . 23 LYS HE3 1 1 1 87 1 1 6 LYS HG2 H 0.588 11.378 -7.767 1.00 . A A . 23 LYS HG2 1 1 1 88 1 1 6 LYS HG3 H 1.947 12.297 -8.419 1.00 . A A . 23 LYS HG3 1 1 1 89 1 1 6 LYS HZ1 H 1.057 15.425 -11.051 1.00 . A A . 23 LYS HZ1 1 1 1 90 1 1 6 LYS HZ2 H 0.012 14.100 -11.164 1.00 . A A . 23 LYS HZ2 1 1 1 91 1 1 6 LYS HZ3 H 1.683 13.853 -11.083 1.00 . A A . 23 LYS HZ3 1 1 1 92 1 1 6 LYS N N 0.659 9.072 -8.464 1.00 . A A . 23 LYS N 1 1 1 93 1 1 6 LYS NZ N 0.898 14.444 -10.743 1.00 . A A . 23 LYS NZ 1 1 1 94 1 1 6 LYS O O 1.021 9.278 -11.861 1.00 . A A . 23 LYS O 1 1 1 95 1 1 7 SER C C -0.899 5.475 -11.683 1.00 . A A . 24 SER C 1 1 1 96 1 1 7 SER CA C -0.125 6.756 -11.978 1.00 . A A . 24 SER CA 1 1 1 97 1 1 7 SER CB C 1.340 6.425 -12.268 1.00 . A A . 24 SER CB 1 1 1 98 1 1 7 SER H H -0.730 7.431 -10.064 1.00 . A A . 24 SER H 1 1 1 99 1 1 7 SER HA H -0.556 7.232 -12.846 1.00 . A A . 24 SER HA 1 1 1 100 1 1 7 SER HB2 H 1.955 6.787 -11.458 1.00 . A A . 24 SER HB2 1 1 1 101 1 1 7 SER HB3 H 1.453 5.354 -12.355 1.00 . A A . 24 SER HB3 1 1 1 102 1 1 7 SER HG H 2.172 7.880 -13.281 1.00 . A A . 24 SER HG 1 1 1 103 1 1 7 SER N N -0.222 7.690 -10.861 1.00 . A A . 24 SER N 1 1 1 104 1 1 7 SER O O -1.467 4.858 -12.585 1.00 . A A . 24 SER O 1 1 1 105 1 1 7 SER OG O 1.771 7.030 -13.474 1.00 . A A . 24 SER OG 1 1 1 106 1 1 8 HIS C C -3.128 4.028 -10.195 1.00 . A A . 25 HIS C 1 1 1 107 1 1 8 HIS CA C -1.623 3.874 -9.998 1.00 . A A . 25 HIS CA 1 1 1 108 1 1 8 HIS CB C -1.318 3.558 -8.533 1.00 . A A . 25 HIS CB 1 1 1 109 1 1 8 HIS CD2 C -2.368 1.853 -6.885 1.00 . A A . 25 HIS CD2 1 1 1 110 1 1 8 HIS CE1 C -2.444 0.118 -8.224 1.00 . A A . 25 HIS CE1 1 1 1 111 1 1 8 HIS CG C -1.861 2.238 -8.080 1.00 . A A . 25 HIS CG 1 1 1 112 1 1 8 HIS H H -0.447 5.615 -9.741 1.00 . A A . 25 HIS H 1 1 1 113 1 1 8 HIS HA H -1.274 3.058 -10.613 1.00 . A A . 25 HIS HA 1 1 1 114 1 1 8 HIS HB2 H -0.248 3.543 -8.390 1.00 . A A . 25 HIS HB2 1 1 1 115 1 1 8 HIS HB3 H -1.749 4.327 -7.909 1.00 . A A . 25 HIS HB3 1 1 1 116 1 1 8 HIS HD1 H -1.627 1.088 -9.829 1.00 . A A . 25 HIS HD1 1 1 1 117 1 1 8 HIS HD2 H -2.474 2.470 -6.004 1.00 . A A . 25 HIS HD2 1 1 1 118 1 1 8 HIS HE1 H -2.613 -0.876 -8.608 1.00 . A A . 25 HIS HE1 1 1 1 119 1 1 8 HIS N N -0.918 5.081 -10.414 1.00 . A A . 25 HIS N 1 1 1 120 1 1 8 HIS ND1 N -1.921 1.128 -8.896 1.00 . A A . 25 HIS ND1 1 1 1 121 1 1 8 HIS NE2 N -2.723 0.531 -7.001 1.00 . A A . 25 HIS NE2 1 1 1 122 1 1 8 HIS O O -3.668 5.128 -10.080 1.00 . A A . 25 HIS O 1 1 1 123 1 1 9 GLU C C -5.977 3.308 -9.425 1.00 . A A . 26 GLU C 1 1 1 124 1 1 9 GLU CA C -5.240 2.933 -10.707 1.00 . A A . 26 GLU CA 1 1 1 125 1 1 9 GLU CB C -5.718 1.567 -11.203 1.00 . A A . 26 GLU CB 1 1 1 126 1 1 9 GLU CD C -5.687 -0.897 -10.645 1.00 . A A . 26 GLU CD 1 1 1 127 1 1 9 GLU CG C -5.800 0.517 -10.107 1.00 . A A . 26 GLU CG 1 1 1 128 1 1 9 GLU H H -3.311 2.072 -10.570 1.00 . A A . 26 GLU H 1 1 1 129 1 1 9 GLU HA H -5.456 3.675 -11.461 1.00 . A A . 26 GLU HA 1 1 1 130 1 1 9 GLU HB2 H -6.699 1.679 -11.641 1.00 . A A . 26 GLU HB2 1 1 1 131 1 1 9 GLU HB3 H -5.034 1.213 -11.960 1.00 . A A . 26 GLU HB3 1 1 1 132 1 1 9 GLU HG2 H -4.997 0.684 -9.405 1.00 . A A . 26 GLU HG2 1 1 1 133 1 1 9 GLU HG3 H -6.748 0.619 -9.599 1.00 . A A . 26 GLU HG3 1 1 1 134 1 1 9 GLU N N -3.798 2.919 -10.493 1.00 . A A . 26 GLU N 1 1 1 135 1 1 9 GLU O O -7.087 3.838 -9.465 1.00 . A A . 26 GLU O 1 1 1 136 1 1 9 GLU OE1 O -6.366 -1.206 -11.647 1.00 . A A . 26 GLU OE1 1 1 1 137 1 1 9 GLU OE2 O -4.922 -1.693 -10.063 1.00 . A A . 26 GLU OE2 1 1 1 138 1 1 10 LYS C C -5.308 4.578 -6.380 1.00 . A A . 27 LYS C 1 1 1 139 1 1 10 LYS CA C -5.946 3.334 -6.991 1.00 . A A . 27 LYS CA 1 1 1 140 1 1 10 LYS CB C -5.785 2.146 -6.039 1.00 . A A . 27 LYS CB 1 1 1 141 1 1 10 LYS CD C -6.342 -0.245 -5.509 1.00 . A A . 27 LYS CD 1 1 1 142 1 1 10 LYS CE C -5.164 -1.106 -5.938 1.00 . A A . 27 LYS CE 1 1 1 143 1 1 10 LYS CG C -6.563 0.914 -6.467 1.00 . A A . 27 LYS CG 1 1 1 144 1 1 10 LYS H H -4.468 2.603 -8.319 1.00 . A A . 27 LYS H 1 1 1 145 1 1 10 LYS HA H -6.998 3.521 -7.144 1.00 . A A . 27 LYS HA 1 1 1 146 1 1 10 LYS HB2 H -4.738 1.884 -5.983 1.00 . A A . 27 LYS HB2 1 1 1 147 1 1 10 LYS HB3 H -6.127 2.438 -5.056 1.00 . A A . 27 LYS HB3 1 1 1 148 1 1 10 LYS HD2 H -6.147 0.146 -4.522 1.00 . A A . 27 LYS HD2 1 1 1 149 1 1 10 LYS HD3 H -7.234 -0.856 -5.487 1.00 . A A . 27 LYS HD3 1 1 1 150 1 1 10 LYS HE2 H -4.860 -0.809 -6.930 1.00 . A A . 27 LYS HE2 1 1 1 151 1 1 10 LYS HE3 H -4.348 -0.945 -5.249 1.00 . A A . 27 LYS HE3 1 1 1 152 1 1 10 LYS HG2 H -7.615 1.153 -6.489 1.00 . A A . 27 LYS HG2 1 1 1 153 1 1 10 LYS HG3 H -6.238 0.619 -7.455 1.00 . A A . 27 LYS HG3 1 1 1 154 1 1 10 LYS HZ1 H -4.851 -3.083 -5.342 1.00 . A A . 27 LYS HZ1 1 1 1 155 1 1 10 LYS HZ2 H -5.447 -2.929 -6.917 1.00 . A A . 27 LYS HZ2 1 1 1 156 1 1 10 LYS HZ3 H -6.478 -2.694 -5.596 1.00 . A A . 27 LYS HZ3 1 1 1 157 1 1 10 LYS N N -5.352 3.027 -8.286 1.00 . A A . 27 LYS N 1 1 1 158 1 1 10 LYS NZ N -5.510 -2.554 -5.949 1.00 . A A . 27 LYS NZ 1 1 1 159 1 1 10 LYS O O -5.724 5.043 -5.319 1.00 . A A . 27 LYS O 1 1 1 160 1 1 11 TYR C C -4.587 7.433 -6.303 1.00 . A A . 28 TYR C 1 1 1 161 1 1 11 TYR CA C -3.602 6.301 -6.582 1.00 . A A . 28 TYR CA 1 1 1 162 1 1 11 TYR CB C -2.564 6.756 -7.608 1.00 . A A . 28 TYR CB 1 1 1 163 1 1 11 TYR CD1 C -2.528 9.277 -7.470 1.00 . A A . 28 TYR CD1 1 1 1 164 1 1 11 TYR CD2 C -3.412 8.270 -9.442 1.00 . A A . 28 TYR CD2 1 1 1 165 1 1 11 TYR CE1 C -2.780 10.531 -7.992 1.00 . A A . 28 TYR CE1 1 1 1 166 1 1 11 TYR CE2 C -3.666 9.521 -9.972 1.00 . A A . 28 TYR CE2 1 1 1 167 1 1 11 TYR CG C -2.840 8.126 -8.184 1.00 . A A . 28 TYR CG 1 1 1 168 1 1 11 TYR CZ C -3.348 10.648 -9.243 1.00 . A A . 28 TYR CZ 1 1 1 169 1 1 11 TYR H H -4.012 4.695 -7.898 1.00 . A A . 28 TYR H 1 1 1 170 1 1 11 TYR HA H -3.097 6.044 -5.662 1.00 . A A . 28 TYR HA 1 1 1 171 1 1 11 TYR HB2 H -1.592 6.783 -7.140 1.00 . A A . 28 TYR HB2 1 1 1 172 1 1 11 TYR HB3 H -2.543 6.050 -8.426 1.00 . A A . 28 TYR HB3 1 1 1 173 1 1 11 TYR HD1 H -2.083 9.182 -6.491 1.00 . A A . 28 TYR HD1 1 1 1 174 1 1 11 TYR HD2 H -3.659 7.386 -10.011 1.00 . A A . 28 TYR HD2 1 1 1 175 1 1 11 TYR HE1 H -2.531 11.414 -7.422 1.00 . A A . 28 TYR HE1 1 1 1 176 1 1 11 TYR HE2 H -4.111 9.613 -10.952 1.00 . A A . 28 TYR HE2 1 1 1 177 1 1 11 TYR HH H -4.235 11.820 -10.483 1.00 . A A . 28 TYR HH 1 1 1 178 1 1 11 TYR N N -4.298 5.112 -7.058 1.00 . A A . 28 TYR N 1 1 1 179 1 1 11 TYR O O -5.609 7.562 -6.978 1.00 . A A . 28 TYR O 1 1 1 180 1 1 11 TYR OH O -3.599 11.895 -9.767 1.00 . A A . 28 TYR OH 1 1 1 181 1 1 12 ASP C C -4.326 10.671 -4.886 1.00 . A A . 29 ASP C 1 1 1 182 1 1 12 ASP CA C -5.126 9.373 -4.936 1.00 . A A . 29 ASP CA 1 1 1 183 1 1 12 ASP CB C -5.787 9.115 -3.582 1.00 . A A . 29 ASP CB 1 1 1 184 1 1 12 ASP CG C -7.194 8.568 -3.719 1.00 . A A . 29 ASP CG 1 1 1 185 1 1 12 ASP H H -3.442 8.096 -4.804 1.00 . A A . 29 ASP H 1 1 1 186 1 1 12 ASP HA H -5.893 9.467 -5.689 1.00 . A A . 29 ASP HA 1 1 1 187 1 1 12 ASP HB2 H -5.195 8.399 -3.030 1.00 . A A . 29 ASP HB2 1 1 1 188 1 1 12 ASP HB3 H -5.832 10.041 -3.028 1.00 . A A . 29 ASP HB3 1 1 1 189 1 1 12 ASP N N -4.271 8.250 -5.305 1.00 . A A . 29 ASP N 1 1 1 190 1 1 12 ASP O O -3.221 10.711 -4.345 1.00 . A A . 29 ASP O 1 1 1 191 1 1 12 ASP OD1 O -7.337 7.349 -3.944 1.00 . A A . 29 ASP OD1 1 1 1 192 1 1 12 ASP OD2 O -8.153 9.361 -3.603 1.00 . A A . 29 ASP OD2 1 1 1 193 1 1 13 TRP C C -3.921 13.507 -4.062 1.00 . A A . 30 TRP C 1 1 1 194 1 1 13 TRP CA C -4.230 13.030 -5.477 1.00 . A A . 30 TRP CA 1 1 1 195 1 1 13 TRP CB C -5.105 14.058 -6.195 1.00 . A A . 30 TRP CB 1 1 1 196 1 1 13 TRP CD1 C -4.355 15.233 -8.346 1.00 . A A . 30 TRP CD1 1 1 1 197 1 1 13 TRP CD2 C -3.376 16.006 -6.485 1.00 . A A . 30 TRP CD2 1 1 1 198 1 1 13 TRP CE2 C -2.881 16.730 -7.587 1.00 . A A . 30 TRP CE2 1 1 1 199 1 1 13 TRP CE3 C -2.904 16.318 -5.208 1.00 . A A . 30 TRP CE3 1 1 1 200 1 1 13 TRP CG C -4.318 15.054 -6.992 1.00 . A A . 30 TRP CG 1 1 1 201 1 1 13 TRP CH2 C -1.493 18.029 -6.186 1.00 . A A . 30 TRP CH2 1 1 1 202 1 1 13 TRP CZ2 C -1.937 17.744 -7.448 1.00 . A A . 30 TRP CZ2 1 1 1 203 1 1 13 TRP CZ3 C -1.968 17.325 -5.071 1.00 . A A . 30 TRP CZ3 1 1 1 204 1 1 13 TRP H H -5.774 11.636 -5.871 1.00 . A A . 30 TRP H 1 1 1 205 1 1 13 TRP HA H -3.301 12.920 -6.018 1.00 . A A . 30 TRP HA 1 1 1 206 1 1 13 TRP HB2 H -5.773 13.545 -6.870 1.00 . A A . 30 TRP HB2 1 1 1 207 1 1 13 TRP HB3 H -5.685 14.601 -5.463 1.00 . A A . 30 TRP HB3 1 1 1 208 1 1 13 TRP HD1 H -4.974 14.660 -9.018 1.00 . A A . 30 TRP HD1 1 1 1 209 1 1 13 TRP HE1 H -3.342 16.555 -9.626 1.00 . A A . 30 TRP HE1 1 1 1 210 1 1 13 TRP HE3 H -3.258 15.787 -4.336 1.00 . A A . 30 TRP HE3 1 1 1 211 1 1 13 TRP HH2 H -0.761 18.807 -6.032 1.00 . A A . 30 TRP HH2 1 1 1 212 1 1 13 TRP HZ2 H -1.562 18.296 -8.297 1.00 . A A . 30 TRP HZ2 1 1 1 213 1 1 13 TRP HZ3 H -1.591 17.580 -4.091 1.00 . A A . 30 TRP HZ3 1 1 1 214 1 1 13 TRP N N -4.891 11.730 -5.455 1.00 . A A . 30 TRP N 1 1 1 215 1 1 13 TRP NE1 N -3.492 16.239 -8.711 1.00 . A A . 30 TRP NE1 1 1 1 216 1 1 13 TRP O O -2.758 13.629 -3.679 1.00 . A A . 30 TRP O 1 1 1 217 1 1 14 GLU C C -4.259 13.127 -1.028 1.00 . A A . 31 GLU C 1 1 1 218 1 1 14 GLU CA C -4.808 14.239 -1.917 1.00 . A A . 31 GLU CA 1 1 1 219 1 1 14 GLU CB C -6.144 14.738 -1.363 1.00 . A A . 31 GLU CB 1 1 1 220 1 1 14 GLU CD C -7.579 16.782 -0.986 1.00 . A A . 31 GLU CD 1 1 1 221 1 1 14 GLU CG C -6.532 16.120 -1.861 1.00 . A A . 31 GLU CG 1 1 1 222 1 1 14 GLU H H -5.873 13.658 -3.652 1.00 . A A . 31 GLU H 1 1 1 223 1 1 14 GLU HA H -4.104 15.058 -1.925 1.00 . A A . 31 GLU HA 1 1 1 224 1 1 14 GLU HB2 H -6.920 14.043 -1.649 1.00 . A A . 31 GLU HB2 1 1 1 225 1 1 14 GLU HB3 H -6.083 14.771 -0.285 1.00 . A A . 31 GLU HB3 1 1 1 226 1 1 14 GLU HG2 H -5.651 16.743 -1.876 1.00 . A A . 31 GLU HG2 1 1 1 227 1 1 14 GLU HG3 H -6.926 16.030 -2.863 1.00 . A A . 31 GLU HG3 1 1 1 228 1 1 14 GLU N N -4.970 13.775 -3.290 1.00 . A A . 31 GLU N 1 1 1 229 1 1 14 GLU O O -3.296 13.328 -0.287 1.00 . A A . 31 GLU O 1 1 1 230 1 1 14 GLU OE1 O -7.987 16.167 0.021 1.00 . A A . 31 GLU OE1 1 1 1 231 1 1 14 GLU OE2 O -7.990 17.917 -1.310 1.00 . A A . 31 GLU OE2 1 1 1 232 1 1 15 LEU C C -3.010 10.431 -0.626 1.00 . A A . 32 LEU C 1 1 1 233 1 1 15 LEU CA C -4.453 10.810 -0.309 1.00 . A A . 32 LEU CA 1 1 1 234 1 1 15 LEU CB C -5.374 9.615 -0.564 1.00 . A A . 32 LEU CB 1 1 1 235 1 1 15 LEU CD1 C -6.583 9.807 1.624 1.00 . A A . 32 LEU CD1 1 1 1 236 1 1 15 LEU CD2 C -6.761 7.705 0.280 1.00 . A A . 32 LEU CD2 1 1 1 237 1 1 15 LEU CG C -5.858 8.864 0.677 1.00 . A A . 32 LEU CG 1 1 1 238 1 1 15 LEU H H -5.640 11.856 -1.715 1.00 . A A . 32 LEU H 1 1 1 239 1 1 15 LEU HA H -4.519 11.089 0.732 1.00 . A A . 32 LEU HA 1 1 1 240 1 1 15 LEU HB2 H -6.244 9.975 -1.092 1.00 . A A . 32 LEU HB2 1 1 1 241 1 1 15 LEU HB3 H -4.840 8.915 -1.190 1.00 . A A . 32 LEU HB3 1 1 1 242 1 1 15 LEU HD11 H -5.861 10.336 2.227 1.00 . A A . 32 LEU HD11 1 1 1 243 1 1 15 LEU HD12 H -7.240 9.238 2.265 1.00 . A A . 32 LEU HD12 1 1 1 244 1 1 15 LEU HD13 H -7.164 10.515 1.051 1.00 . A A . 32 LEU HD13 1 1 1 245 1 1 15 LEU HD21 H -7.785 8.045 0.238 1.00 . A A . 32 LEU HD21 1 1 1 246 1 1 15 LEU HD22 H -6.674 6.914 1.011 1.00 . A A . 32 LEU HD22 1 1 1 247 1 1 15 LEU HD23 H -6.465 7.334 -0.690 1.00 . A A . 32 LEU HD23 1 1 1 248 1 1 15 LEU HG H -5.003 8.458 1.200 1.00 . A A . 32 LEU HG 1 1 1 249 1 1 15 LEU N N -4.879 11.955 -1.106 1.00 . A A . 32 LEU N 1 1 1 250 1 1 15 LEU O O -2.378 9.681 0.117 1.00 . A A . 32 LEU O 1 1 1 251 1 1 16 TRP C C -0.179 10.704 -0.951 1.00 . A A . 33 TRP C 1 1 1 252 1 1 16 TRP CA C -1.126 10.675 -2.146 1.00 . A A . 33 TRP CA 1 1 1 253 1 1 16 TRP CB C -0.671 11.687 -3.198 1.00 . A A . 33 TRP CB 1 1 1 254 1 1 16 TRP CD1 C 1.487 11.035 -4.417 1.00 . A A . 33 TRP CD1 1 1 1 255 1 1 16 TRP CD2 C 1.798 12.360 -2.639 1.00 . A A . 33 TRP CD2 1 1 1 256 1 1 16 TRP CE2 C 3.053 12.078 -3.215 1.00 . A A . 33 TRP CE2 1 1 1 257 1 1 16 TRP CE3 C 1.746 13.179 -1.508 1.00 . A A . 33 TRP CE3 1 1 1 258 1 1 16 TRP CG C 0.810 11.684 -3.424 1.00 . A A . 33 TRP CG 1 1 1 259 1 1 16 TRP CH2 C 4.160 13.383 -1.586 1.00 . A A . 33 TRP CH2 1 1 1 260 1 1 16 TRP CZ2 C 4.241 12.584 -2.695 1.00 . A A . 33 TRP CZ2 1 1 1 261 1 1 16 TRP CZ3 C 2.926 13.680 -0.993 1.00 . A A . 33 TRP CZ3 1 1 1 262 1 1 16 TRP H H -3.050 11.548 -2.283 1.00 . A A . 33 TRP H 1 1 1 263 1 1 16 TRP HA H -1.109 9.686 -2.580 1.00 . A A . 33 TRP HA 1 1 1 264 1 1 16 TRP HB2 H -1.152 11.461 -4.138 1.00 . A A . 33 TRP HB2 1 1 1 265 1 1 16 TRP HB3 H -0.959 12.679 -2.880 1.00 . A A . 33 TRP HB3 1 1 1 266 1 1 16 TRP HD1 H 1.017 10.430 -5.178 1.00 . A A . 33 TRP HD1 1 1 1 267 1 1 16 TRP HE1 H 3.529 10.911 -4.891 1.00 . A A . 33 TRP HE1 1 1 1 268 1 1 16 TRP HE3 H 0.804 13.420 -1.036 1.00 . A A . 33 TRP HE3 1 1 1 269 1 1 16 TRP HH2 H 5.056 13.796 -1.150 1.00 . A A . 33 TRP HH2 1 1 1 270 1 1 16 TRP HZ2 H 5.200 12.364 -3.141 1.00 . A A . 33 TRP HZ2 1 1 1 271 1 1 16 TRP HZ3 H 2.905 14.314 -0.118 1.00 . A A . 33 TRP HZ3 1 1 1 272 1 1 16 TRP N N -2.496 10.956 -1.732 1.00 . A A . 33 TRP N 1 1 1 273 1 1 16 TRP NE1 N 2.836 11.267 -4.297 1.00 . A A . 33 TRP NE1 1 1 1 274 1 1 16 TRP O O 0.769 9.922 -0.880 1.00 . A A . 33 TRP O 1 1 1 275 1 1 17 ASP C C 0.688 10.372 1.781 1.00 . A A . 34 ASP C 1 1 1 276 1 1 17 ASP CA C 0.387 11.740 1.177 1.00 . A A . 34 ASP CA 1 1 1 277 1 1 17 ASP CB C -0.307 12.627 2.212 1.00 . A A . 34 ASP CB 1 1 1 278 1 1 17 ASP CG C 0.644 13.612 2.862 1.00 . A A . 34 ASP CG 1 1 1 279 1 1 17 ASP H H -1.213 12.205 -0.130 1.00 . A A . 34 ASP H 1 1 1 280 1 1 17 ASP HA H 1.317 12.204 0.886 1.00 . A A . 34 ASP HA 1 1 1 281 1 1 17 ASP HB2 H -1.097 13.184 1.728 1.00 . A A . 34 ASP HB2 1 1 1 282 1 1 17 ASP HB3 H -0.734 12.002 2.983 1.00 . A A . 34 ASP HB3 1 1 1 283 1 1 17 ASP N N -0.442 11.610 -0.016 1.00 . A A . 34 ASP N 1 1 1 284 1 1 17 ASP O O 1.811 10.104 2.209 1.00 . A A . 34 ASP O 1 1 1 285 1 1 17 ASP OD1 O 1.642 13.163 3.464 1.00 . A A . 34 ASP OD1 1 1 1 286 1 1 17 ASP OD2 O 0.391 14.831 2.770 1.00 . A A . 34 ASP OD2 1 1 1 287 1 1 18 LYS C C -0.084 7.129 1.252 1.00 . A A . 35 LYS C 1 1 1 288 1 1 18 LYS CA C -0.167 8.169 2.365 1.00 . A A . 35 LYS CA 1 1 1 289 1 1 18 LYS CB C -1.335 7.840 3.298 1.00 . A A . 35 LYS CB 1 1 1 290 1 1 18 LYS CD C -3.780 7.264 3.297 1.00 . A A . 35 LYS CD 1 1 1 291 1 1 18 LYS CE C -3.712 5.847 2.748 1.00 . A A . 35 LYS CE 1 1 1 292 1 1 18 LYS CG C -2.697 8.145 2.698 1.00 . A A . 35 LYS CG 1 1 1 293 1 1 18 LYS H H -1.194 9.782 1.457 1.00 . A A . 35 LYS H 1 1 1 294 1 1 18 LYS HA H 0.752 8.147 2.931 1.00 . A A . 35 LYS HA 1 1 1 295 1 1 18 LYS HB2 H -1.300 6.789 3.542 1.00 . A A . 35 LYS HB2 1 1 1 296 1 1 18 LYS HB3 H -1.228 8.416 4.206 1.00 . A A . 35 LYS HB3 1 1 1 297 1 1 18 LYS HD2 H -3.652 7.229 4.368 1.00 . A A . 35 LYS HD2 1 1 1 298 1 1 18 LYS HD3 H -4.747 7.686 3.061 1.00 . A A . 35 LYS HD3 1 1 1 299 1 1 18 LYS HE2 H -4.528 5.703 2.057 1.00 . A A . 35 LYS HE2 1 1 1 300 1 1 18 LYS HE3 H -2.773 5.721 2.228 1.00 . A A . 35 LYS HE3 1 1 1 301 1 1 18 LYS HG2 H -2.942 9.179 2.891 1.00 . A A . 35 LYS HG2 1 1 1 302 1 1 18 LYS HG3 H -2.656 7.977 1.631 1.00 . A A . 35 LYS HG3 1 1 1 303 1 1 18 LYS HZ1 H -3.079 4.097 3.696 1.00 . A A . 35 LYS HZ1 1 1 1 304 1 1 18 LYS HZ2 H -4.743 4.376 3.813 1.00 . A A . 35 LYS HZ2 1 1 1 305 1 1 18 LYS HZ3 H -3.666 5.277 4.757 1.00 . A A . 35 LYS HZ3 1 1 1 306 1 1 18 LYS N N -0.322 9.510 1.814 1.00 . A A . 35 LYS N 1 1 1 307 1 1 18 LYS NZ N -3.807 4.828 3.830 1.00 . A A . 35 LYS NZ 1 1 1 308 1 1 18 LYS O O 0.324 5.991 1.482 1.00 . A A . 35 LYS O 1 1 1 309 1 1 19 TRP C C 0.844 6.822 -1.907 1.00 . A A . 36 TRP C 1 1 1 310 1 1 19 TRP CA C -0.438 6.631 -1.103 1.00 . A A . 36 TRP CA 1 1 1 311 1 1 19 TRP CB C -1.656 6.870 -1.998 1.00 . A A . 36 TRP CB 1 1 1 312 1 1 19 TRP CD1 C -3.742 6.443 -0.573 1.00 . A A . 36 TRP CD1 1 1 1 313 1 1 19 TRP CD2 C -3.342 4.868 -2.113 1.00 . A A . 36 TRP CD2 1 1 1 314 1 1 19 TRP CE2 C -4.507 4.517 -1.404 1.00 . A A . 36 TRP CE2 1 1 1 315 1 1 19 TRP CE3 C -2.896 4.025 -3.135 1.00 . A A . 36 TRP CE3 1 1 1 316 1 1 19 TRP CG C -2.869 6.103 -1.566 1.00 . A A . 36 TRP CG 1 1 1 317 1 1 19 TRP CH2 C -4.769 2.552 -2.689 1.00 . A A . 36 TRP CH2 1 1 1 318 1 1 19 TRP CZ2 C -5.228 3.359 -1.684 1.00 . A A . 36 TRP CZ2 1 1 1 319 1 1 19 TRP CZ3 C -3.612 2.876 -3.411 1.00 . A A . 36 TRP CZ3 1 1 1 320 1 1 19 TRP H H -0.786 8.449 -0.075 1.00 . A A . 36 TRP H 1 1 1 321 1 1 19 TRP HA H -0.469 5.617 -0.732 1.00 . A A . 36 TRP HA 1 1 1 322 1 1 19 TRP HB2 H -1.903 7.921 -1.986 1.00 . A A . 36 TRP HB2 1 1 1 323 1 1 19 TRP HB3 H -1.414 6.572 -3.008 1.00 . A A . 36 TRP HB3 1 1 1 324 1 1 19 TRP HD1 H -3.656 7.331 0.035 1.00 . A A . 36 TRP HD1 1 1 1 325 1 1 19 TRP HE1 H -5.473 5.513 0.169 1.00 . A A . 36 TRP HE1 1 1 1 326 1 1 19 TRP HE3 H -2.007 4.258 -3.703 1.00 . A A . 36 TRP HE3 1 1 1 327 1 1 19 TRP HH2 H -5.297 1.645 -2.939 1.00 . A A . 36 TRP HH2 1 1 1 328 1 1 19 TRP HZ2 H -6.122 3.096 -1.137 1.00 . A A . 36 TRP HZ2 1 1 1 329 1 1 19 TRP HZ3 H -3.283 2.212 -4.197 1.00 . A A . 36 TRP HZ3 1 1 1 330 1 1 19 TRP N N -0.471 7.529 0.046 1.00 . A A . 36 TRP N 1 1 1 331 1 1 19 TRP NE1 N -4.730 5.493 -0.469 1.00 . A A . 36 TRP NE1 1 1 1 332 1 1 19 TRP O O 0.889 6.527 -3.102 1.00 . A A . 36 TRP O 1 1 1 333 1 1 20 CYS C C 3.555 6.356 -2.771 1.00 . A A . 37 CYS C 1 1 1 334 1 1 20 CYS CA C 3.168 7.546 -1.897 1.00 . A A . 37 CYS CA 1 1 1 335 1 1 20 CYS CB C 4.256 7.800 -0.852 1.00 . A A . 37 CYS CB 1 1 1 336 1 1 20 CYS H H 1.787 7.531 -0.292 1.00 . A A . 37 CYS H 1 1 1 337 1 1 20 CYS HA H 3.070 8.420 -2.522 1.00 . A A . 37 CYS HA 1 1 1 338 1 1 20 CYS HB2 H 5.224 7.728 -1.327 1.00 . A A . 37 CYS HB2 1 1 1 339 1 1 20 CYS HB3 H 4.132 8.795 -0.449 1.00 . A A . 37 CYS HB3 1 1 1 340 1 1 20 CYS N N 1.884 7.315 -1.244 1.00 . A A . 37 CYS N 1 1 1 341 1 1 20 CYS O O 4.704 6.232 -3.193 1.00 . A A . 37 CYS O 1 1 1 342 1 1 20 CYS SG S 4.236 6.630 0.543 1.00 . A A . 37 CYS SG 1 1 2 343 1 1 1 ASN C C 3.426 0.489 -1.830 1.00 . A A . 18 ASN C 1 1 2 344 1 1 1 ASN CA C 2.283 -0.510 -1.977 1.00 . A A . 18 ASN CA 1 1 2 345 1 1 1 ASN CB C 1.357 -0.079 -3.116 1.00 . A A . 18 ASN CB 1 1 2 346 1 1 1 ASN CG C 0.177 0.737 -2.625 1.00 . A A . 18 ASN CG 1 1 2 347 1 1 1 ASN H1 H 0.578 -0.850 -0.769 1.00 . A A . 18 ASN H1 1 1 2 348 1 1 1 ASN HA H 2.695 -1.481 -2.208 1.00 . A A . 18 ASN HA 1 1 2 349 1 1 1 ASN HB2 H 1.916 0.521 -3.819 1.00 . A A . 18 ASN HB2 1 1 2 350 1 1 1 ASN HB3 H 0.980 -0.957 -3.619 1.00 . A A . 18 ASN HB3 1 1 2 351 1 1 1 ASN HD21 H 0.960 2.388 -3.409 1.00 . A A . 18 ASN HD21 1 1 2 352 1 1 1 ASN HD22 H -0.554 2.585 -2.600 1.00 . A A . 18 ASN HD22 1 1 2 353 1 1 1 ASN N N 1.532 -0.628 -0.732 1.00 . A A . 18 ASN N 1 1 2 354 1 1 1 ASN ND2 N 0.196 2.034 -2.907 1.00 . A A . 18 ASN ND2 1 1 2 355 1 1 1 ASN O O 4.591 0.104 -1.716 1.00 . A A . 18 ASN O 1 1 2 356 1 1 1 ASN OD1 O -0.741 0.206 -1.999 1.00 . A A . 18 ASN OD1 1 1 2 357 1 1 2 CYS C C 5.184 2.672 -2.745 1.00 . A A . 19 CYS C 1 1 2 358 1 1 2 CYS CA C 4.083 2.829 -1.700 1.00 . A A . 19 CYS CA 1 1 2 359 1 1 2 CYS CB C 4.690 2.812 -0.296 1.00 . A A . 19 CYS CB 1 1 2 360 1 1 2 CYS H H 2.141 2.018 -1.927 1.00 . A A . 19 CYS H 1 1 2 361 1 1 2 CYS HA H 3.587 3.775 -1.857 1.00 . A A . 19 CYS HA 1 1 2 362 1 1 2 CYS HB2 H 3.941 2.480 0.408 1.00 . A A . 19 CYS HB2 1 1 2 363 1 1 2 CYS HB3 H 5.522 2.122 -0.280 1.00 . A A . 19 CYS HB3 1 1 2 364 1 1 2 CYS N N 3.086 1.773 -1.833 1.00 . A A . 19 CYS N 1 1 2 365 1 1 2 CYS O O 6.316 3.112 -2.539 1.00 . A A . 19 CYS O 1 1 2 366 1 1 2 CYS SG S 5.301 4.432 0.270 1.00 . A A . 19 CYS SG 1 1 2 367 1 1 3 ASP C C 5.370 2.561 -6.208 1.00 . A A . 20 ASP C 1 1 2 368 1 1 3 ASP CA C 5.803 1.829 -4.942 1.00 . A A . 20 ASP CA 1 1 2 369 1 1 3 ASP CB C 5.955 0.334 -5.229 1.00 . A A . 20 ASP CB 1 1 2 370 1 1 3 ASP CG C 7.406 -0.093 -5.322 1.00 . A A . 20 ASP CG 1 1 2 371 1 1 3 ASP H H 3.926 1.716 -3.969 1.00 . A A . 20 ASP H 1 1 2 372 1 1 3 ASP HA H 6.756 2.223 -4.622 1.00 . A A . 20 ASP HA 1 1 2 373 1 1 3 ASP HB2 H 5.484 -0.228 -4.435 1.00 . A A . 20 ASP HB2 1 1 2 374 1 1 3 ASP HB3 H 5.469 0.103 -6.165 1.00 . A A . 20 ASP HB3 1 1 2 375 1 1 3 ASP N N 4.844 2.043 -3.864 1.00 . A A . 20 ASP N 1 1 2 376 1 1 3 ASP O O 5.969 2.392 -7.270 1.00 . A A . 20 ASP O 1 1 2 377 1 1 3 ASP OD1 O 8.229 0.705 -5.818 1.00 . A A . 20 ASP OD1 1 1 2 378 1 1 3 ASP OD2 O 7.720 -1.224 -4.897 1.00 . A A . 20 ASP OD2 1 1 2 379 1 1 4 TRP C C 3.062 5.373 -6.755 1.00 . A A . 21 TRP C 1 1 2 380 1 1 4 TRP CA C 3.811 4.130 -7.223 1.00 . A A . 21 TRP CA 1 1 2 381 1 1 4 TRP CB C 2.889 3.253 -8.072 1.00 . A A . 21 TRP CB 1 1 2 382 1 1 4 TRP CD1 C 1.064 2.828 -6.324 1.00 . A A . 21 TRP CD1 1 1 2 383 1 1 4 TRP CD2 C 1.854 0.973 -7.300 1.00 . A A . 21 TRP CD2 1 1 2 384 1 1 4 TRP CE2 C 0.865 0.604 -6.367 1.00 . A A . 21 TRP CE2 1 1 2 385 1 1 4 TRP CE3 C 2.492 -0.028 -8.037 1.00 . A A . 21 TRP CE3 1 1 2 386 1 1 4 TRP CG C 1.965 2.400 -7.256 1.00 . A A . 21 TRP CG 1 1 2 387 1 1 4 TRP CH2 C 1.144 -1.683 -6.889 1.00 . A A . 21 TRP CH2 1 1 2 388 1 1 4 TRP CZ2 C 0.502 -0.724 -6.154 1.00 . A A . 21 TRP CZ2 1 1 2 389 1 1 4 TRP CZ3 C 2.131 -1.345 -7.823 1.00 . A A . 21 TRP CZ3 1 1 2 390 1 1 4 TRP H H 3.890 3.466 -5.215 1.00 . A A . 21 TRP H 1 1 2 391 1 1 4 TRP HA H 4.654 4.437 -7.825 1.00 . A A . 21 TRP HA 1 1 2 392 1 1 4 TRP HB2 H 2.286 3.884 -8.707 1.00 . A A . 21 TRP HB2 1 1 2 393 1 1 4 TRP HB3 H 3.491 2.600 -8.687 1.00 . A A . 21 TRP HB3 1 1 2 394 1 1 4 TRP HD1 H 0.909 3.862 -6.058 1.00 . A A . 21 TRP HD1 1 1 2 395 1 1 4 TRP HE1 H -0.297 1.801 -5.096 1.00 . A A . 21 TRP HE1 1 1 2 396 1 1 4 TRP HE3 H 3.256 0.213 -8.761 1.00 . A A . 21 TRP HE3 1 1 2 397 1 1 4 TRP HH2 H 0.894 -2.724 -6.755 1.00 . A A . 21 TRP HH2 1 1 2 398 1 1 4 TRP HZ2 H -0.258 -1.000 -5.438 1.00 . A A . 21 TRP HZ2 1 1 2 399 1 1 4 TRP HZ3 H 2.614 -2.132 -8.383 1.00 . A A . 21 TRP HZ3 1 1 2 400 1 1 4 TRP N N 4.326 3.373 -6.088 1.00 . A A . 21 TRP N 1 1 2 401 1 1 4 TRP NE1 N 0.399 1.752 -5.785 1.00 . A A . 21 TRP NE1 1 1 2 402 1 1 4 TRP O O 2.524 5.404 -5.648 1.00 . A A . 21 TRP O 1 1 2 403 1 1 5 ASP C C 1.932 8.381 -8.543 1.00 . A A . 22 ASP C 1 1 2 404 1 1 5 ASP CA C 2.345 7.639 -7.276 1.00 . A A . 22 ASP CA 1 1 2 405 1 1 5 ASP CB C 3.245 8.531 -6.419 1.00 . A A . 22 ASP CB 1 1 2 406 1 1 5 ASP CG C 4.718 8.263 -6.653 1.00 . A A . 22 ASP CG 1 1 2 407 1 1 5 ASP H H 3.478 6.308 -8.472 1.00 . A A . 22 ASP H 1 1 2 408 1 1 5 ASP HA H 1.458 7.391 -6.714 1.00 . A A . 22 ASP HA 1 1 2 409 1 1 5 ASP HB2 H 3.044 9.566 -6.654 1.00 . A A . 22 ASP HB2 1 1 2 410 1 1 5 ASP HB3 H 3.026 8.354 -5.376 1.00 . A A . 22 ASP HB3 1 1 2 411 1 1 5 ASP N N 3.030 6.394 -7.604 1.00 . A A . 22 ASP N 1 1 2 412 1 1 5 ASP O O 2.645 8.364 -9.547 1.00 . A A . 22 ASP O 1 1 2 413 1 1 5 ASP OD1 O 5.240 7.281 -6.085 1.00 . A A . 22 ASP OD1 1 1 2 414 1 1 5 ASP OD2 O 5.350 9.036 -7.403 1.00 . A A . 22 ASP OD2 1 1 2 415 1 1 6 LYS C C 0.352 8.952 -10.910 1.00 . A A . 23 LYS C 1 1 2 416 1 1 6 LYS CA C 0.265 9.781 -9.633 1.00 . A A . 23 LYS CA 1 1 2 417 1 1 6 LYS CB C 1.048 11.085 -9.805 1.00 . A A . 23 LYS CB 1 1 2 418 1 1 6 LYS CD C 0.256 13.155 -8.623 1.00 . A A . 23 LYS CD 1 1 2 419 1 1 6 LYS CE C 1.055 14.372 -9.065 1.00 . A A . 23 LYS CE 1 1 2 420 1 1 6 LYS CG C 1.131 11.916 -8.536 1.00 . A A . 23 LYS CG 1 1 2 421 1 1 6 LYS H H 0.251 9.009 -7.662 1.00 . A A . 23 LYS H 1 1 2 422 1 1 6 LYS HA H -0.771 10.016 -9.440 1.00 . A A . 23 LYS HA 1 1 2 423 1 1 6 LYS HB2 H 2.053 10.848 -10.122 1.00 . A A . 23 LYS HB2 1 1 2 424 1 1 6 LYS HB3 H 0.569 11.680 -10.569 1.00 . A A . 23 LYS HB3 1 1 2 425 1 1 6 LYS HD2 H -0.534 12.978 -9.337 1.00 . A A . 23 LYS HD2 1 1 2 426 1 1 6 LYS HD3 H -0.173 13.351 -7.650 1.00 . A A . 23 LYS HD3 1 1 2 427 1 1 6 LYS HE2 H 0.543 15.262 -8.733 1.00 . A A . 23 LYS HE2 1 1 2 428 1 1 6 LYS HE3 H 2.033 14.328 -8.609 1.00 . A A . 23 LYS HE3 1 1 2 429 1 1 6 LYS HG2 H 0.804 11.315 -7.701 1.00 . A A . 23 LYS HG2 1 1 2 430 1 1 6 LYS HG3 H 2.157 12.220 -8.383 1.00 . A A . 23 LYS HG3 1 1 2 431 1 1 6 LYS HZ1 H 1.529 15.371 -10.837 1.00 . A A . 23 LYS HZ1 1 1 2 432 1 1 6 LYS HZ2 H 0.303 14.219 -11.008 1.00 . A A . 23 LYS HZ2 1 1 2 433 1 1 6 LYS HZ3 H 1.913 13.723 -10.856 1.00 . A A . 23 LYS HZ3 1 1 2 434 1 1 6 LYS N N 0.775 9.032 -8.491 1.00 . A A . 23 LYS N 1 1 2 435 1 1 6 LYS NZ N 1.211 14.425 -10.545 1.00 . A A . 23 LYS NZ 1 1 2 436 1 1 6 LYS O O 0.962 9.371 -11.893 1.00 . A A . 23 LYS O 1 1 2 437 1 1 7 SER C C -1.018 5.598 -11.746 1.00 . A A . 24 SER C 1 1 2 438 1 1 7 SER CA C -0.254 6.884 -12.044 1.00 . A A . 24 SER CA 1 1 2 439 1 1 7 SER CB C 1.185 6.555 -12.448 1.00 . A A . 24 SER CB 1 1 2 440 1 1 7 SER H H -0.734 7.495 -10.074 1.00 . A A . 24 SER H 1 1 2 441 1 1 7 SER HA H -0.740 7.397 -12.861 1.00 . A A . 24 SER HA 1 1 2 442 1 1 7 SER HB2 H 1.506 7.241 -13.217 1.00 . A A . 24 SER HB2 1 1 2 443 1 1 7 SER HB3 H 1.829 6.652 -11.586 1.00 . A A . 24 SER HB3 1 1 2 444 1 1 7 SER HG H 1.977 4.764 -12.475 1.00 . A A . 24 SER HG 1 1 2 445 1 1 7 SER N N -0.264 7.774 -10.888 1.00 . A A . 24 SER N 1 1 2 446 1 1 7 SER O O -1.631 5.006 -12.635 1.00 . A A . 24 SER O 1 1 2 447 1 1 7 SER OG O 1.284 5.232 -12.946 1.00 . A A . 24 SER OG 1 1 2 448 1 1 8 HIS C C -3.176 4.121 -10.178 1.00 . A A . 25 HIS C 1 1 2 449 1 1 8 HIS CA C -1.664 3.953 -10.071 1.00 . A A . 25 HIS CA 1 1 2 450 1 1 8 HIS CB C -1.279 3.591 -8.636 1.00 . A A . 25 HIS CB 1 1 2 451 1 1 8 HIS CD2 C -2.346 1.878 -7.007 1.00 . A A . 25 HIS CD2 1 1 2 452 1 1 8 HIS CE1 C -2.359 0.135 -8.338 1.00 . A A . 25 HIS CE1 1 1 2 453 1 1 8 HIS CG C -1.813 2.265 -8.189 1.00 . A A . 25 HIS CG 1 1 2 454 1 1 8 HIS H H -0.470 5.684 -9.825 1.00 . A A . 25 HIS H 1 1 2 455 1 1 8 HIS HA H -1.355 3.155 -10.729 1.00 . A A . 25 HIS HA 1 1 2 456 1 1 8 HIS HB2 H -0.203 3.559 -8.556 1.00 . A A . 25 HIS HB2 1 1 2 457 1 1 8 HIS HB3 H -1.663 4.347 -7.966 1.00 . A A . 25 HIS HB3 1 1 2 458 1 1 8 HIS HD1 H -1.515 1.110 -9.926 1.00 . A A . 25 HIS HD1 1 1 2 459 1 1 8 HIS HD2 H -2.485 2.497 -6.132 1.00 . A A . 25 HIS HD2 1 1 2 460 1 1 8 HIS HE1 H -2.503 -0.864 -8.721 1.00 . A A . 25 HIS HE1 1 1 2 461 1 1 8 HIS N N -0.975 5.170 -10.488 1.00 . A A . 25 HIS N 1 1 2 462 1 1 8 HIS ND1 N -1.835 1.150 -9.001 1.00 . A A . 25 HIS ND1 1 1 2 463 1 1 8 HIS NE2 N -2.677 0.550 -7.125 1.00 . A A . 25 HIS NE2 1 1 2 464 1 1 8 HIS O O -3.695 5.233 -10.084 1.00 . A A . 25 HIS O 1 1 2 465 1 1 9 GLU C C -5.981 3.402 -9.168 1.00 . A A . 26 GLU C 1 1 2 466 1 1 9 GLU CA C -5.330 3.034 -10.498 1.00 . A A . 26 GLU CA 1 1 2 467 1 1 9 GLU CB C -5.849 1.675 -10.973 1.00 . A A . 26 GLU CB 1 1 2 468 1 1 9 GLU CD C -6.242 -0.755 -10.409 1.00 . A A . 26 GLU CD 1 1 2 469 1 1 9 GLU CG C -5.875 0.619 -9.882 1.00 . A A . 26 GLU CG 1 1 2 470 1 1 9 GLU H H -3.407 2.152 -10.443 1.00 . A A . 26 GLU H 1 1 2 471 1 1 9 GLU HA H -5.589 3.784 -11.231 1.00 . A A . 26 GLU HA 1 1 2 472 1 1 9 GLU HB2 H -6.853 1.799 -11.352 1.00 . A A . 26 GLU HB2 1 1 2 473 1 1 9 GLU HB3 H -5.214 1.321 -11.772 1.00 . A A . 26 GLU HB3 1 1 2 474 1 1 9 GLU HG2 H -4.897 0.563 -9.428 1.00 . A A . 26 GLU HG2 1 1 2 475 1 1 9 GLU HG3 H -6.601 0.908 -9.136 1.00 . A A . 26 GLU HG3 1 1 2 476 1 1 9 GLU N N -3.878 3.009 -10.376 1.00 . A A . 26 GLU N 1 1 2 477 1 1 9 GLU O O -7.042 4.027 -9.134 1.00 . A A . 26 GLU O 1 1 2 478 1 1 9 GLU OE1 O -7.235 -0.856 -11.160 1.00 . A A . 26 GLU OE1 1 1 2 479 1 1 9 GLU OE2 O -5.537 -1.729 -10.070 1.00 . A A . 26 GLU OE2 1 1 2 480 1 1 10 LYS C C -5.213 4.561 -6.170 1.00 . A A . 27 LYS C 1 1 2 481 1 1 10 LYS CA C -5.853 3.298 -6.739 1.00 . A A . 27 LYS CA 1 1 2 482 1 1 10 LYS CB C -5.592 2.116 -5.804 1.00 . A A . 27 LYS CB 1 1 2 483 1 1 10 LYS CD C -6.060 -0.284 -5.228 1.00 . A A . 27 LYS CD 1 1 2 484 1 1 10 LYS CE C -4.842 -1.097 -5.640 1.00 . A A . 27 LYS CE 1 1 2 485 1 1 10 LYS CG C -6.328 0.849 -6.204 1.00 . A A . 27 LYS CG 1 1 2 486 1 1 10 LYS H H -4.497 2.516 -8.164 1.00 . A A . 27 LYS H 1 1 2 487 1 1 10 LYS HA H -6.918 3.454 -6.820 1.00 . A A . 27 LYS HA 1 1 2 488 1 1 10 LYS HB2 H -4.533 1.904 -5.797 1.00 . A A . 27 LYS HB2 1 1 2 489 1 1 10 LYS HB3 H -5.902 2.387 -4.805 1.00 . A A . 27 LYS HB3 1 1 2 490 1 1 10 LYS HD2 H -5.887 0.131 -4.247 1.00 . A A . 27 LYS HD2 1 1 2 491 1 1 10 LYS HD3 H -6.923 -0.934 -5.199 1.00 . A A . 27 LYS HD3 1 1 2 492 1 1 10 LYS HE2 H -4.810 -1.154 -6.717 1.00 . A A . 27 LYS HE2 1 1 2 493 1 1 10 LYS HE3 H -3.955 -0.599 -5.279 1.00 . A A . 27 LYS HE3 1 1 2 494 1 1 10 LYS HG2 H -7.389 1.051 -6.222 1.00 . A A . 27 LYS HG2 1 1 2 495 1 1 10 LYS HG3 H -6.000 0.549 -7.189 1.00 . A A . 27 LYS HG3 1 1 2 496 1 1 10 LYS HZ1 H -4.024 -2.664 -4.526 1.00 . A A . 27 LYS HZ1 1 1 2 497 1 1 10 LYS HZ2 H -4.940 -3.173 -5.854 1.00 . A A . 27 LYS HZ2 1 1 2 498 1 1 10 LYS HZ3 H -5.713 -2.591 -4.467 1.00 . A A . 27 LYS HZ3 1 1 2 499 1 1 10 LYS N N -5.339 3.010 -8.073 1.00 . A A . 27 LYS N 1 1 2 500 1 1 10 LYS NZ N -4.883 -2.478 -5.083 1.00 . A A . 27 LYS NZ 1 1 2 501 1 1 10 LYS O O -5.590 5.029 -5.096 1.00 . A A . 27 LYS O 1 1 2 502 1 1 11 TYR C C -4.543 7.447 -6.204 1.00 . A A . 28 TYR C 1 1 2 503 1 1 11 TYR CA C -3.553 6.315 -6.465 1.00 . A A . 28 TYR CA 1 1 2 504 1 1 11 TYR CB C -2.532 6.749 -7.519 1.00 . A A . 28 TYR CB 1 1 2 505 1 1 11 TYR CD1 C -2.405 9.264 -7.332 1.00 . A A . 28 TYR CD1 1 1 2 506 1 1 11 TYR CD2 C -3.371 8.329 -9.300 1.00 . A A . 28 TYR CD2 1 1 2 507 1 1 11 TYR CE1 C -2.625 10.536 -7.823 1.00 . A A . 28 TYR CE1 1 1 2 508 1 1 11 TYR CE2 C -3.594 9.598 -9.800 1.00 . A A . 28 TYR CE2 1 1 2 509 1 1 11 TYR CG C -2.774 8.140 -8.060 1.00 . A A . 28 TYR CG 1 1 2 510 1 1 11 TYR CZ C -3.219 10.698 -9.057 1.00 . A A . 28 TYR CZ 1 1 2 511 1 1 11 TYR H H -3.989 4.688 -7.746 1.00 . A A . 28 TYR H 1 1 2 512 1 1 11 TYR HA H -3.033 6.088 -5.546 1.00 . A A . 28 TYR HA 1 1 2 513 1 1 11 TYR HB2 H -1.545 6.730 -7.083 1.00 . A A . 28 TYR HB2 1 1 2 514 1 1 11 TYR HB3 H -2.567 6.059 -8.349 1.00 . A A . 28 TYR HB3 1 1 2 515 1 1 11 TYR HD1 H -1.939 9.133 -6.366 1.00 . A A . 28 TYR HD1 1 1 2 516 1 1 11 TYR HD2 H -3.664 7.465 -9.880 1.00 . A A . 28 TYR HD2 1 1 2 517 1 1 11 TYR HE1 H -2.331 11.398 -7.242 1.00 . A A . 28 TYR HE1 1 1 2 518 1 1 11 TYR HE2 H -4.060 9.725 -10.766 1.00 . A A . 28 TYR HE2 1 1 2 519 1 1 11 TYR HH H -4.255 12.312 -9.185 1.00 . A A . 28 TYR HH 1 1 2 520 1 1 11 TYR N N -4.245 5.107 -6.898 1.00 . A A . 28 TYR N 1 1 2 521 1 1 11 TYR O O -5.564 7.562 -6.883 1.00 . A A . 28 TYR O 1 1 2 522 1 1 11 TYR OH O -3.439 11.964 -9.550 1.00 . A A . 28 TYR OH 1 1 2 523 1 1 12 ASP C C -4.296 10.704 -4.825 1.00 . A A . 29 ASP C 1 1 2 524 1 1 12 ASP CA C -5.092 9.404 -4.866 1.00 . A A . 29 ASP CA 1 1 2 525 1 1 12 ASP CB C -5.762 9.158 -3.513 1.00 . A A . 29 ASP CB 1 1 2 526 1 1 12 ASP CG C -7.113 8.484 -3.650 1.00 . A A . 29 ASP CG 1 1 2 527 1 1 12 ASP H H -3.404 8.135 -4.712 1.00 . A A . 29 ASP H 1 1 2 528 1 1 12 ASP HA H -5.855 9.487 -5.625 1.00 . A A . 29 ASP HA 1 1 2 529 1 1 12 ASP HB2 H -5.124 8.526 -2.912 1.00 . A A . 29 ASP HB2 1 1 2 530 1 1 12 ASP HB3 H -5.900 10.104 -3.010 1.00 . A A . 29 ASP HB3 1 1 2 531 1 1 12 ASP N N -4.232 8.279 -5.217 1.00 . A A . 29 ASP N 1 1 2 532 1 1 12 ASP O O -3.221 10.767 -4.229 1.00 . A A . 29 ASP O 1 1 2 533 1 1 12 ASP OD1 O -7.167 7.376 -4.222 1.00 . A A . 29 ASP OD1 1 1 2 534 1 1 12 ASP OD2 O -8.116 9.065 -3.185 1.00 . A A . 29 ASP OD2 1 1 2 535 1 1 13 TRP C C -3.925 13.565 -4.088 1.00 . A A . 30 TRP C 1 1 2 536 1 1 13 TRP CA C -4.170 13.039 -5.498 1.00 . A A . 30 TRP CA 1 1 2 537 1 1 13 TRP CB C -5.013 14.041 -6.290 1.00 . A A . 30 TRP CB 1 1 2 538 1 1 13 TRP CD1 C -4.156 15.154 -8.434 1.00 . A A . 30 TRP CD1 1 1 2 539 1 1 13 TRP CD2 C -3.285 15.994 -6.549 1.00 . A A . 30 TRP CD2 1 1 2 540 1 1 13 TRP CE2 C -2.737 16.687 -7.645 1.00 . A A . 30 TRP CE2 1 1 2 541 1 1 13 TRP CE3 C -2.886 16.351 -5.258 1.00 . A A . 30 TRP CE3 1 1 2 542 1 1 13 TRP CG C -4.191 15.018 -7.075 1.00 . A A . 30 TRP CG 1 1 2 543 1 1 13 TRP CH2 C -1.437 18.043 -6.213 1.00 . A A . 30 TRP CH2 1 1 2 544 1 1 13 TRP CZ2 C -1.810 17.714 -7.488 1.00 . A A . 30 TRP CZ2 1 1 2 545 1 1 13 TRP CZ3 C -1.966 17.370 -5.104 1.00 . A A . 30 TRP CZ3 1 1 2 546 1 1 13 TRP H H -5.692 11.628 -5.918 1.00 . A A . 30 TRP H 1 1 2 547 1 1 13 TRP HA H -3.219 12.912 -5.993 1.00 . A A . 30 TRP HA 1 1 2 548 1 1 13 TRP HB2 H -5.644 13.503 -6.982 1.00 . A A . 30 TRP HB2 1 1 2 549 1 1 13 TRP HB3 H -5.632 14.600 -5.604 1.00 . A A . 30 TRP HB3 1 1 2 550 1 1 13 TRP HD1 H -4.734 14.554 -9.120 1.00 . A A . 30 TRP HD1 1 1 2 551 1 1 13 TRP HE1 H -3.086 16.443 -9.700 1.00 . A A . 30 TRP HE1 1 1 2 552 1 1 13 TRP HE3 H -3.283 15.844 -4.391 1.00 . A A . 30 TRP HE3 1 1 2 553 1 1 13 TRP HH2 H -0.720 18.832 -6.046 1.00 . A A . 30 TRP HH2 1 1 2 554 1 1 13 TRP HZ2 H -1.393 18.242 -8.333 1.00 . A A . 30 TRP HZ2 1 1 2 555 1 1 13 TRP HZ3 H -1.645 17.660 -4.114 1.00 . A A . 30 TRP HZ3 1 1 2 556 1 1 13 TRP N N -4.832 11.740 -5.461 1.00 . A A . 30 TRP N 1 1 2 557 1 1 13 TRP NE1 N -3.283 16.155 -8.784 1.00 . A A . 30 TRP NE1 1 1 2 558 1 1 13 TRP O O -2.779 13.712 -3.663 1.00 . A A . 30 TRP O 1 1 2 559 1 1 14 GLU C C -4.410 13.272 -1.055 1.00 . A A . 31 GLU C 1 1 2 560 1 1 14 GLU CA C -4.906 14.357 -2.007 1.00 . A A . 31 GLU CA 1 1 2 561 1 1 14 GLU CB C -6.263 14.884 -1.535 1.00 . A A . 31 GLU CB 1 1 2 562 1 1 14 GLU CD C -7.884 15.910 -3.178 1.00 . A A . 31 GLU CD 1 1 2 563 1 1 14 GLU CG C -6.707 16.148 -2.251 1.00 . A A . 31 GLU CG 1 1 2 564 1 1 14 GLU H H -5.893 13.708 -3.764 1.00 . A A . 31 GLU H 1 1 2 565 1 1 14 GLU HA H -4.195 15.169 -2.009 1.00 . A A . 31 GLU HA 1 1 2 566 1 1 14 GLU HB2 H -7.009 14.121 -1.698 1.00 . A A . 31 GLU HB2 1 1 2 567 1 1 14 GLU HB3 H -6.204 15.097 -0.477 1.00 . A A . 31 GLU HB3 1 1 2 568 1 1 14 GLU HG2 H -6.993 16.883 -1.514 1.00 . A A . 31 GLU HG2 1 1 2 569 1 1 14 GLU HG3 H -5.880 16.526 -2.834 1.00 . A A . 31 GLU HG3 1 1 2 570 1 1 14 GLU N N -5.007 13.847 -3.369 1.00 . A A . 31 GLU N 1 1 2 571 1 1 14 GLU O O -3.465 13.483 -0.293 1.00 . A A . 31 GLU O 1 1 2 572 1 1 14 GLU OE1 O -7.847 14.924 -3.943 1.00 . A A . 31 GLU OE1 1 1 2 573 1 1 14 GLU OE2 O -8.842 16.710 -3.137 1.00 . A A . 31 GLU OE2 1 1 2 574 1 1 15 LEU C C -3.221 10.606 -0.460 1.00 . A A . 32 LEU C 1 1 2 575 1 1 15 LEU CA C -4.681 10.993 -0.245 1.00 . A A . 32 LEU CA 1 1 2 576 1 1 15 LEU CB C -5.585 9.790 -0.519 1.00 . A A . 32 LEU CB 1 1 2 577 1 1 15 LEU CD1 C -6.964 10.079 1.554 1.00 . A A . 32 LEU CD1 1 1 2 578 1 1 15 LEU CD2 C -7.040 7.918 0.296 1.00 . A A . 32 LEU CD2 1 1 2 579 1 1 15 LEU CG C -6.168 9.094 0.711 1.00 . A A . 32 LEU CG 1 1 2 580 1 1 15 LEU H H -5.799 12.003 -1.730 1.00 . A A . 32 LEU H 1 1 2 581 1 1 15 LEU HA H -4.811 11.304 0.781 1.00 . A A . 32 LEU HA 1 1 2 582 1 1 15 LEU HB2 H -6.408 10.127 -1.130 1.00 . A A . 32 LEU HB2 1 1 2 583 1 1 15 LEU HB3 H -5.006 9.061 -1.069 1.00 . A A . 32 LEU HB3 1 1 2 584 1 1 15 LEU HD11 H -7.554 10.711 0.908 1.00 . A A . 32 LEU HD11 1 1 2 585 1 1 15 LEU HD12 H -6.285 10.688 2.132 1.00 . A A . 32 LEU HD12 1 1 2 586 1 1 15 LEU HD13 H -7.616 9.535 2.222 1.00 . A A . 32 LEU HD13 1 1 2 587 1 1 15 LEU HD21 H -6.653 7.488 -0.616 1.00 . A A . 32 LEU HD21 1 1 2 588 1 1 15 LEU HD22 H -8.052 8.261 0.131 1.00 . A A . 32 LEU HD22 1 1 2 589 1 1 15 LEU HD23 H -7.035 7.173 1.077 1.00 . A A . 32 LEU HD23 1 1 2 590 1 1 15 LEU HG H -5.359 8.713 1.319 1.00 . A A . 32 LEU HG 1 1 2 591 1 1 15 LEU N N -5.055 12.112 -1.103 1.00 . A A . 32 LEU N 1 1 2 592 1 1 15 LEU O O -2.624 9.913 0.364 1.00 . A A . 32 LEU O 1 1 2 593 1 1 16 TRP C C -0.375 10.902 -0.659 1.00 . A A . 33 TRP C 1 1 2 594 1 1 16 TRP CA C -1.260 10.763 -1.892 1.00 . A A . 33 TRP CA 1 1 2 595 1 1 16 TRP CB C -0.762 11.692 -3.001 1.00 . A A . 33 TRP CB 1 1 2 596 1 1 16 TRP CD1 C 1.463 10.973 -4.049 1.00 . A A . 33 TRP CD1 1 1 2 597 1 1 16 TRP CD2 C 1.667 12.447 -2.376 1.00 . A A . 33 TRP CD2 1 1 2 598 1 1 16 TRP CE2 C 2.953 12.137 -2.861 1.00 . A A . 33 TRP CE2 1 1 2 599 1 1 16 TRP CE3 C 1.547 13.356 -1.321 1.00 . A A . 33 TRP CE3 1 1 2 600 1 1 16 TRP CG C 0.729 11.692 -3.150 1.00 . A A . 33 TRP CG 1 1 2 601 1 1 16 TRP CH2 C 3.959 13.590 -1.294 1.00 . A A . 33 TRP CH2 1 1 2 602 1 1 16 TRP CZ2 C 4.107 12.703 -2.325 1.00 . A A . 33 TRP CZ2 1 1 2 603 1 1 16 TRP CZ3 C 2.693 13.917 -0.791 1.00 . A A . 33 TRP CZ3 1 1 2 604 1 1 16 TRP H H -3.179 11.608 -2.189 1.00 . A A . 33 TRP H 1 1 2 605 1 1 16 TRP HA H -1.213 9.742 -2.242 1.00 . A A . 33 TRP HA 1 1 2 606 1 1 16 TRP HB2 H -1.191 11.381 -3.942 1.00 . A A . 33 TRP HB2 1 1 2 607 1 1 16 TRP HB3 H -1.077 12.702 -2.782 1.00 . A A . 33 TRP HB3 1 1 2 608 1 1 16 TRP HD1 H 1.040 10.299 -4.779 1.00 . A A . 33 TRP HD1 1 1 2 609 1 1 16 TRP HE1 H 3.529 10.841 -4.407 1.00 . A A . 33 TRP HE1 1 1 2 610 1 1 16 TRP HE3 H 0.580 13.621 -0.920 1.00 . A A . 33 TRP HE3 1 1 2 611 1 1 16 TRP HH2 H 4.827 14.052 -0.849 1.00 . A A . 33 TRP HH2 1 1 2 612 1 1 16 TRP HZ2 H 5.090 12.461 -2.702 1.00 . A A . 33 TRP HZ2 1 1 2 613 1 1 16 TRP HZ3 H 2.620 14.621 0.025 1.00 . A A . 33 TRP HZ3 1 1 2 614 1 1 16 TRP N N -2.652 11.060 -1.570 1.00 . A A . 33 TRP N 1 1 2 615 1 1 16 TRP NE1 N 2.801 11.235 -3.880 1.00 . A A . 33 TRP NE1 1 1 2 616 1 1 16 TRP O O 0.589 10.155 -0.488 1.00 . A A . 33 TRP O 1 1 2 617 1 1 17 ASP C C 0.369 10.784 2.125 1.00 . A A . 34 ASP C 1 1 2 618 1 1 17 ASP CA C 0.059 12.098 1.416 1.00 . A A . 34 ASP CA 1 1 2 619 1 1 17 ASP CB C -0.710 13.029 2.354 1.00 . A A . 34 ASP CB 1 1 2 620 1 1 17 ASP CG C 0.210 13.875 3.213 1.00 . A A . 34 ASP CG 1 1 2 621 1 1 17 ASP H H -1.486 12.425 0.005 1.00 . A A . 34 ASP H 1 1 2 622 1 1 17 ASP HA H 0.989 12.570 1.137 1.00 . A A . 34 ASP HA 1 1 2 623 1 1 17 ASP HB2 H -1.331 13.690 1.766 1.00 . A A . 34 ASP HB2 1 1 2 624 1 1 17 ASP HB3 H -1.337 12.437 3.004 1.00 . A A . 34 ASP HB3 1 1 2 625 1 1 17 ASP N N -0.707 11.862 0.197 1.00 . A A . 34 ASP N 1 1 2 626 1 1 17 ASP O O 1.461 10.599 2.664 1.00 . A A . 34 ASP O 1 1 2 627 1 1 17 ASP OD1 O 1.135 13.305 3.828 1.00 . A A . 34 ASP OD1 1 1 2 628 1 1 17 ASP OD2 O 0.004 15.105 3.270 1.00 . A A . 34 ASP OD2 1 1 2 629 1 1 18 LYS C C -0.204 7.479 1.728 1.00 . A A . 35 LYS C 1 1 2 630 1 1 18 LYS CA C -0.429 8.575 2.765 1.00 . A A . 35 LYS CA 1 1 2 631 1 1 18 LYS CB C -1.656 8.241 3.617 1.00 . A A . 35 LYS CB 1 1 2 632 1 1 18 LYS CD C -4.080 7.597 3.484 1.00 . A A . 35 LYS CD 1 1 2 633 1 1 18 LYS CE C -3.946 6.144 3.055 1.00 . A A . 35 LYS CE 1 1 2 634 1 1 18 LYS CG C -2.975 8.457 2.895 1.00 . A A . 35 LYS CG 1 1 2 635 1 1 18 LYS H H -1.446 10.078 1.676 1.00 . A A . 35 LYS H 1 1 2 636 1 1 18 LYS HA H 0.438 8.632 3.405 1.00 . A A . 35 LYS HA 1 1 2 637 1 1 18 LYS HB2 H -1.599 7.205 3.918 1.00 . A A . 35 LYS HB2 1 1 2 638 1 1 18 LYS HB3 H -1.647 8.865 4.499 1.00 . A A . 35 LYS HB3 1 1 2 639 1 1 18 LYS HD2 H -4.029 7.649 4.562 1.00 . A A . 35 LYS HD2 1 1 2 640 1 1 18 LYS HD3 H -5.036 7.976 3.149 1.00 . A A . 35 LYS HD3 1 1 2 641 1 1 18 LYS HE2 H -4.706 5.928 2.320 1.00 . A A . 35 LYS HE2 1 1 2 642 1 1 18 LYS HE3 H -2.970 6.002 2.616 1.00 . A A . 35 LYS HE3 1 1 2 643 1 1 18 LYS HG2 H -3.257 9.496 2.981 1.00 . A A . 35 LYS HG2 1 1 2 644 1 1 18 LYS HG3 H -2.850 8.201 1.852 1.00 . A A . 35 LYS HG3 1 1 2 645 1 1 18 LYS HZ1 H -4.722 5.631 4.925 1.00 . A A . 35 LYS HZ1 1 1 2 646 1 1 18 LYS HZ2 H -3.175 5.013 4.633 1.00 . A A . 35 LYS HZ2 1 1 2 647 1 1 18 LYS HZ3 H -4.521 4.314 3.882 1.00 . A A . 35 LYS HZ3 1 1 2 648 1 1 18 LYS N N -0.598 9.873 2.122 1.00 . A A . 35 LYS N 1 1 2 649 1 1 18 LYS NZ N -4.102 5.210 4.204 1.00 . A A . 35 LYS NZ 1 1 2 650 1 1 18 LYS O O 0.333 6.417 2.041 1.00 . A A . 35 LYS O 1 1 2 651 1 1 19 TRP C C 0.886 6.962 -1.286 1.00 . A A . 36 TRP C 1 1 2 652 1 1 19 TRP CA C -0.458 6.782 -0.589 1.00 . A A . 36 TRP CA 1 1 2 653 1 1 19 TRP CB C -1.595 6.930 -1.602 1.00 . A A . 36 TRP CB 1 1 2 654 1 1 19 TRP CD1 C -3.769 6.534 -0.304 1.00 . A A . 36 TRP CD1 1 1 2 655 1 1 19 TRP CD2 C -3.256 4.910 -1.759 1.00 . A A . 36 TRP CD2 1 1 2 656 1 1 19 TRP CE2 C -4.463 4.573 -1.116 1.00 . A A . 36 TRP CE2 1 1 2 657 1 1 19 TRP CE3 C -2.737 4.037 -2.719 1.00 . A A . 36 TRP CE3 1 1 2 658 1 1 19 TRP CG C -2.829 6.168 -1.225 1.00 . A A . 36 TRP CG 1 1 2 659 1 1 19 TRP CH2 C -4.626 2.563 -2.347 1.00 . A A . 36 TRP CH2 1 1 2 660 1 1 19 TRP CZ2 C -5.157 3.400 -1.403 1.00 . A A . 36 TRP CZ2 1 1 2 661 1 1 19 TRP CZ3 C -3.426 2.873 -3.002 1.00 . A A . 36 TRP CZ3 1 1 2 662 1 1 19 TRP H H -1.038 8.611 0.306 1.00 . A A . 36 TRP H 1 1 2 663 1 1 19 TRP HA H -0.498 5.792 -0.160 1.00 . A A . 36 TRP HA 1 1 2 664 1 1 19 TRP HB2 H -1.860 7.974 -1.686 1.00 . A A . 36 TRP HB2 1 1 2 665 1 1 19 TRP HB3 H -1.260 6.569 -2.564 1.00 . A A . 36 TRP HB3 1 1 2 666 1 1 19 TRP HD1 H -3.729 7.442 0.277 1.00 . A A . 36 TRP HD1 1 1 2 667 1 1 19 TRP HE1 H -5.539 5.614 0.354 1.00 . A A . 36 TRP HE1 1 1 2 668 1 1 19 TRP HE3 H -1.815 4.258 -3.234 1.00 . A A . 36 TRP HE3 1 1 2 669 1 1 19 TRP HH2 H -5.130 1.643 -2.599 1.00 . A A . 36 TRP HH2 1 1 2 670 1 1 19 TRP HZ2 H -6.083 3.148 -0.907 1.00 . A A . 36 TRP HZ2 1 1 2 671 1 1 19 TRP HZ3 H -3.041 2.186 -3.740 1.00 . A A . 36 TRP HZ3 1 1 2 672 1 1 19 TRP N N -0.617 7.746 0.494 1.00 . A A . 36 TRP N 1 1 2 673 1 1 19 TRP NE1 N -4.754 5.579 -0.233 1.00 . A A . 36 TRP NE1 1 1 2 674 1 1 19 TRP O O 1.128 6.389 -2.349 1.00 . A A . 36 TRP O 1 1 2 675 1 1 20 CYS C C 2.968 8.641 -2.631 1.00 . A A . 37 CYS C 1 1 2 676 1 1 20 CYS CA C 3.080 8.017 -1.243 1.00 . A A . 37 CYS CA 1 1 2 677 1 1 20 CYS CB C 3.885 6.718 -1.319 1.00 . A A . 37 CYS CB 1 1 2 678 1 1 20 CYS H H 1.509 8.189 0.165 1.00 . A A . 37 CYS H 1 1 2 679 1 1 20 CYS HA H 3.590 8.708 -0.590 1.00 . A A . 37 CYS HA 1 1 2 680 1 1 20 CYS HB2 H 3.540 6.139 -2.163 1.00 . A A . 37 CYS HB2 1 1 2 681 1 1 20 CYS HB3 H 4.929 6.958 -1.457 1.00 . A A . 37 CYS HB3 1 1 2 682 1 1 20 CYS N N 1.759 7.761 -0.681 1.00 . A A . 37 CYS N 1 1 2 683 1 1 20 CYS O O 3.969 8.808 -3.329 1.00 . A A . 37 CYS O 1 1 2 684 1 1 20 CYS SG S 3.747 5.669 0.164 1.00 . A A . 37 CYS SG 1 1 3 685 1 1 1 ASN C C 3.774 0.601 -1.846 1.00 . A A . 18 ASN C 1 1 3 686 1 1 1 ASN CA C 2.566 -0.330 -1.801 1.00 . A A . 18 ASN CA 1 1 3 687 1 1 1 ASN CB C 1.485 0.173 -2.761 1.00 . A A . 18 ASN CB 1 1 3 688 1 1 1 ASN CG C 0.327 -0.798 -2.886 1.00 . A A . 18 ASN CG 1 1 3 689 1 1 1 ASN H1 H 1.572 0.347 -0.058 1.00 . A A . 18 ASN H1 1 1 3 690 1 1 1 ASN HA H 2.875 -1.318 -2.106 1.00 . A A . 18 ASN HA 1 1 3 691 1 1 1 ASN HB2 H 1.101 1.116 -2.399 1.00 . A A . 18 ASN HB2 1 1 3 692 1 1 1 ASN HB3 H 1.919 0.316 -3.739 1.00 . A A . 18 ASN HB3 1 1 3 693 1 1 1 ASN HD21 H -0.753 0.574 -3.838 1.00 . A A . 18 ASN HD21 1 1 3 694 1 1 1 ASN HD22 H -1.523 -0.953 -3.598 1.00 . A A . 18 ASN HD22 1 1 3 695 1 1 1 ASN N N 2.034 -0.426 -0.446 1.00 . A A . 18 ASN N 1 1 3 696 1 1 1 ASN ND2 N -0.759 -0.347 -3.503 1.00 . A A . 18 ASN ND2 1 1 3 697 1 1 1 ASN O O 4.917 0.148 -1.912 1.00 . A A . 18 ASN O 1 1 3 698 1 1 1 ASN OD1 O 0.408 -1.941 -2.435 1.00 . A A . 18 ASN OD1 1 1 3 699 1 1 2 CYS C C 5.563 2.599 -2.973 1.00 . A A . 19 CYS C 1 1 3 700 1 1 2 CYS CA C 4.578 2.898 -1.847 1.00 . A A . 19 CYS CA 1 1 3 701 1 1 2 CYS CB C 5.314 2.938 -0.507 1.00 . A A . 19 CYS CB 1 1 3 702 1 1 2 CYS H H 2.580 2.203 -1.758 1.00 . A A . 19 CYS H 1 1 3 703 1 1 2 CYS HA H 4.126 3.861 -2.028 1.00 . A A . 19 CYS HA 1 1 3 704 1 1 2 CYS HB2 H 4.759 2.359 0.217 1.00 . A A . 19 CYS HB2 1 1 3 705 1 1 2 CYS HB3 H 6.295 2.504 -0.631 1.00 . A A . 19 CYS HB3 1 1 3 706 1 1 2 CYS N N 3.513 1.903 -1.811 1.00 . A A . 19 CYS N 1 1 3 707 1 1 2 CYS O O 6.759 2.869 -2.854 1.00 . A A . 19 CYS O 1 1 3 708 1 1 2 CYS SG S 5.529 4.614 0.174 1.00 . A A . 19 CYS SG 1 1 3 709 1 1 3 ASP C C 5.431 2.459 -6.456 1.00 . A A . 20 ASP C 1 1 3 710 1 1 3 ASP CA C 5.888 1.704 -5.213 1.00 . A A . 20 ASP CA 1 1 3 711 1 1 3 ASP CB C 5.852 0.197 -5.474 1.00 . A A . 20 ASP CB 1 1 3 712 1 1 3 ASP CG C 6.982 -0.538 -4.782 1.00 . A A . 20 ASP CG 1 1 3 713 1 1 3 ASP H H 4.093 1.848 -4.100 1.00 . A A . 20 ASP H 1 1 3 714 1 1 3 ASP HA H 6.902 1.995 -4.982 1.00 . A A . 20 ASP HA 1 1 3 715 1 1 3 ASP HB2 H 4.914 -0.202 -5.114 1.00 . A A . 20 ASP HB2 1 1 3 716 1 1 3 ASP HB3 H 5.928 0.021 -6.537 1.00 . A A . 20 ASP HB3 1 1 3 717 1 1 3 ASP N N 5.054 2.039 -4.065 1.00 . A A . 20 ASP N 1 1 3 718 1 1 3 ASP O O 6.004 2.304 -7.535 1.00 . A A . 20 ASP O 1 1 3 719 1 1 3 ASP OD1 O 7.325 -0.162 -3.641 1.00 . A A . 20 ASP OD1 1 1 3 720 1 1 3 ASP OD2 O 7.524 -1.490 -5.381 1.00 . A A . 20 ASP OD2 1 1 3 721 1 1 4 TRP C C 3.105 5.279 -6.902 1.00 . A A . 21 TRP C 1 1 3 722 1 1 4 TRP CA C 3.861 4.056 -7.409 1.00 . A A . 21 TRP CA 1 1 3 723 1 1 4 TRP CB C 2.937 3.190 -8.268 1.00 . A A . 21 TRP CB 1 1 3 724 1 1 4 TRP CD1 C 1.125 2.691 -6.525 1.00 . A A . 21 TRP CD1 1 1 3 725 1 1 4 TRP CD2 C 1.969 0.872 -7.523 1.00 . A A . 21 TRP CD2 1 1 3 726 1 1 4 TRP CE2 C 0.991 0.463 -6.595 1.00 . A A . 21 TRP CE2 1 1 3 727 1 1 4 TRP CE3 C 2.636 -0.101 -8.271 1.00 . A A . 21 TRP CE3 1 1 3 728 1 1 4 TRP CG C 2.038 2.301 -7.463 1.00 . A A . 21 TRP CG 1 1 3 729 1 1 4 TRP CH2 C 1.336 -1.808 -7.143 1.00 . A A . 21 TRP CH2 1 1 3 730 1 1 4 TRP CZ2 C 0.667 -0.876 -6.397 1.00 . A A . 21 TRP CZ2 1 1 3 731 1 1 4 TRP CZ3 C 2.313 -1.430 -8.073 1.00 . A A . 21 TRP CZ3 1 1 3 732 1 1 4 TRP H H 3.981 3.358 -5.414 1.00 . A A . 21 TRP H 1 1 3 733 1 1 4 TRP HA H 4.693 4.386 -8.012 1.00 . A A . 21 TRP HA 1 1 3 734 1 1 4 TRP HB2 H 2.315 3.831 -8.875 1.00 . A A . 21 TRP HB2 1 1 3 735 1 1 4 TRP HB3 H 3.538 2.564 -8.911 1.00 . A A . 21 TRP HB3 1 1 3 736 1 1 4 TRP HD1 H 0.940 3.718 -6.248 1.00 . A A . 21 TRP HD1 1 1 3 737 1 1 4 TRP HE1 H -0.206 1.612 -5.310 1.00 . A A . 21 TRP HE1 1 1 3 738 1 1 4 TRP HE3 H 3.392 0.170 -8.993 1.00 . A A . 21 TRP HE3 1 1 3 739 1 1 4 TRP HH2 H 1.116 -2.858 -7.022 1.00 . A A . 21 TRP HH2 1 1 3 740 1 1 4 TRP HZ2 H -0.085 -1.183 -5.685 1.00 . A A . 21 TRP HZ2 1 1 3 741 1 1 4 TRP HZ3 H 2.819 -2.197 -8.642 1.00 . A A . 21 TRP HZ3 1 1 3 742 1 1 4 TRP N N 4.396 3.276 -6.298 1.00 . A A . 21 TRP N 1 1 3 743 1 1 4 TRP NE1 N 0.492 1.591 -5.999 1.00 . A A . 21 TRP NE1 1 1 3 744 1 1 4 TRP O O 2.569 5.273 -5.793 1.00 . A A . 21 TRP O 1 1 3 745 1 1 5 ASP C C 1.948 8.331 -8.596 1.00 . A A . 22 ASP C 1 1 3 746 1 1 5 ASP CA C 2.374 7.556 -7.353 1.00 . A A . 22 ASP CA 1 1 3 747 1 1 5 ASP CB C 3.272 8.429 -6.475 1.00 . A A . 22 ASP CB 1 1 3 748 1 1 5 ASP CG C 4.746 8.198 -6.745 1.00 . A A . 22 ASP CG 1 1 3 749 1 1 5 ASP H H 3.512 6.269 -8.590 1.00 . A A . 22 ASP H 1 1 3 750 1 1 5 ASP HA H 1.492 7.286 -6.792 1.00 . A A . 22 ASP HA 1 1 3 751 1 1 5 ASP HB2 H 3.049 9.469 -6.666 1.00 . A A . 22 ASP HB2 1 1 3 752 1 1 5 ASP HB3 H 3.075 8.207 -5.437 1.00 . A A . 22 ASP HB3 1 1 3 753 1 1 5 ASP N N 3.066 6.325 -7.719 1.00 . A A . 22 ASP N 1 1 3 754 1 1 5 ASP O O 2.642 8.324 -9.613 1.00 . A A . 22 ASP O 1 1 3 755 1 1 5 ASP OD1 O 5.170 8.364 -7.908 1.00 . A A . 22 ASP OD1 1 1 3 756 1 1 5 ASP OD2 O 5.476 7.853 -5.793 1.00 . A A . 22 ASP OD2 1 1 3 757 1 1 6 LYS C C 0.319 8.969 -10.917 1.00 . A A . 23 LYS C 1 1 3 758 1 1 6 LYS CA C 0.283 9.777 -9.624 1.00 . A A . 23 LYS CA 1 1 3 759 1 1 6 LYS CB C 1.091 11.066 -9.793 1.00 . A A . 23 LYS CB 1 1 3 760 1 1 6 LYS CD C 0.364 13.136 -8.570 1.00 . A A . 23 LYS CD 1 1 3 761 1 1 6 LYS CE C 1.190 14.351 -8.964 1.00 . A A . 23 LYS CE 1 1 3 762 1 1 6 LYS CG C 1.215 11.878 -8.516 1.00 . A A . 23 LYS CG 1 1 3 763 1 1 6 LYS H H 0.294 8.964 -7.670 1.00 . A A . 23 LYS H 1 1 3 764 1 1 6 LYS HA H -0.743 10.032 -9.402 1.00 . A A . 23 LYS HA 1 1 3 765 1 1 6 LYS HB2 H 2.085 10.811 -10.131 1.00 . A A . 23 LYS HB2 1 1 3 766 1 1 6 LYS HB3 H 0.613 11.681 -10.542 1.00 . A A . 23 LYS HB3 1 1 3 767 1 1 6 LYS HD2 H -0.422 12.998 -9.299 1.00 . A A . 23 LYS HD2 1 1 3 768 1 1 6 LYS HD3 H -0.072 13.308 -7.596 1.00 . A A . 23 LYS HD3 1 1 3 769 1 1 6 LYS HE2 H 0.607 15.241 -8.780 1.00 . A A . 23 LYS HE2 1 1 3 770 1 1 6 LYS HE3 H 2.083 14.374 -8.358 1.00 . A A . 23 LYS HE3 1 1 3 771 1 1 6 LYS HG2 H 0.890 11.273 -7.682 1.00 . A A . 23 LYS HG2 1 1 3 772 1 1 6 LYS HG3 H 2.249 12.160 -8.378 1.00 . A A . 23 LYS HG3 1 1 3 773 1 1 6 LYS HZ1 H 0.880 13.773 -10.947 1.00 . A A . 23 LYS HZ1 1 1 3 774 1 1 6 LYS HZ2 H 2.510 13.863 -10.507 1.00 . A A . 23 LYS HZ2 1 1 3 775 1 1 6 LYS HZ3 H 1.629 15.281 -10.783 1.00 . A A . 23 LYS HZ3 1 1 3 776 1 1 6 LYS N N 0.802 8.997 -8.508 1.00 . A A . 23 LYS N 1 1 3 777 1 1 6 LYS NZ N 1.580 14.315 -10.401 1.00 . A A . 23 LYS NZ 1 1 3 778 1 1 6 LYS O O 0.890 9.404 -11.917 1.00 . A A . 23 LYS O 1 1 3 779 1 1 7 SER C C -1.083 5.628 -11.753 1.00 . A A . 24 SER C 1 1 3 780 1 1 7 SER CA C -0.329 6.919 -12.059 1.00 . A A . 24 SER CA 1 1 3 781 1 1 7 SER CB C 1.092 6.596 -12.523 1.00 . A A . 24 SER CB 1 1 3 782 1 1 7 SER H H -0.731 7.498 -10.063 1.00 . A A . 24 SER H 1 1 3 783 1 1 7 SER HA H -0.846 7.445 -12.849 1.00 . A A . 24 SER HA 1 1 3 784 1 1 7 SER HB2 H 1.801 7.027 -11.832 1.00 . A A . 24 SER HB2 1 1 3 785 1 1 7 SER HB3 H 1.223 5.524 -12.552 1.00 . A A . 24 SER HB3 1 1 3 786 1 1 7 SER HG H 2.016 7.799 -13.763 1.00 . A A . 24 SER HG 1 1 3 787 1 1 7 SER N N -0.294 7.790 -10.890 1.00 . A A . 24 SER N 1 1 3 788 1 1 7 SER O O -1.723 5.047 -12.629 1.00 . A A . 24 SER O 1 1 3 789 1 1 7 SER OG O 1.338 7.120 -13.817 1.00 . A A . 24 SER OG 1 1 3 790 1 1 8 HIS C C -3.190 4.119 -10.170 1.00 . A A . 25 HIS C 1 1 3 791 1 1 8 HIS CA C -1.675 3.963 -10.079 1.00 . A A . 25 HIS CA 1 1 3 792 1 1 8 HIS CB C -1.273 3.604 -8.648 1.00 . A A . 25 HIS CB 1 1 3 793 1 1 8 HIS CD2 C -2.322 1.886 -7.012 1.00 . A A . 25 HIS CD2 1 1 3 794 1 1 8 HIS CE1 C -2.316 0.138 -8.335 1.00 . A A . 25 HIS CE1 1 1 3 795 1 1 8 HIS CG C -1.793 2.274 -8.196 1.00 . A A . 25 HIS CG 1 1 3 796 1 1 8 HIS H H -0.475 5.693 -9.849 1.00 . A A . 25 HIS H 1 1 3 797 1 1 8 HIS HA H -1.367 3.168 -10.740 1.00 . A A . 25 HIS HA 1 1 3 798 1 1 8 HIS HB2 H -0.195 3.579 -8.579 1.00 . A A . 25 HIS HB2 1 1 3 799 1 1 8 HIS HB3 H -1.655 4.357 -7.974 1.00 . A A . 25 HIS HB3 1 1 3 800 1 1 8 HIS HD1 H -1.480 1.114 -9.927 1.00 . A A . 25 HIS HD1 1 1 3 801 1 1 8 HIS HD2 H -2.470 2.508 -6.140 1.00 . A A . 25 HIS HD2 1 1 3 802 1 1 8 HIS HE1 H -2.448 -0.864 -8.714 1.00 . A A . 25 HIS HE1 1 1 3 803 1 1 8 HIS N N -1.001 5.185 -10.502 1.00 . A A . 25 HIS N 1 1 3 804 1 1 8 HIS ND1 N -1.802 1.155 -9.003 1.00 . A A . 25 HIS ND1 1 1 3 805 1 1 8 HIS NE2 N -2.639 0.555 -7.124 1.00 . A A . 25 HIS NE2 1 1 3 806 1 1 8 HIS O O -3.716 5.227 -10.076 1.00 . A A . 25 HIS O 1 1 3 807 1 1 9 GLU C C -5.978 3.385 -9.125 1.00 . A A . 26 GLU C 1 1 3 808 1 1 9 GLU CA C -5.339 3.015 -10.461 1.00 . A A . 26 GLU CA 1 1 3 809 1 1 9 GLU CB C -5.852 1.650 -10.924 1.00 . A A . 26 GLU CB 1 1 3 810 1 1 9 GLU CD C -6.288 -0.767 -10.329 1.00 . A A . 26 GLU CD 1 1 3 811 1 1 9 GLU CG C -5.856 0.597 -9.827 1.00 . A A . 26 GLU CG 1 1 3 812 1 1 9 GLU H H -3.409 2.147 -10.423 1.00 . A A . 26 GLU H 1 1 3 813 1 1 9 GLU HA H -5.611 3.759 -11.194 1.00 . A A . 26 GLU HA 1 1 3 814 1 1 9 GLU HB2 H -6.862 1.763 -11.289 1.00 . A A . 26 GLU HB2 1 1 3 815 1 1 9 GLU HB3 H -5.225 1.297 -11.729 1.00 . A A . 26 GLU HB3 1 1 3 816 1 1 9 GLU HG2 H -4.859 0.515 -9.421 1.00 . A A . 26 GLU HG2 1 1 3 817 1 1 9 GLU HG3 H -6.536 0.910 -9.048 1.00 . A A . 26 GLU HG3 1 1 3 818 1 1 9 GLU N N -3.885 3.001 -10.355 1.00 . A A . 26 GLU N 1 1 3 819 1 1 9 GLU O O -7.038 4.010 -9.083 1.00 . A A . 26 GLU O 1 1 3 820 1 1 9 GLU OE1 O -5.556 -1.357 -11.151 1.00 . A A . 26 GLU OE1 1 1 3 821 1 1 9 GLU OE2 O -7.360 -1.244 -9.900 1.00 . A A . 26 GLU OE2 1 1 3 822 1 1 10 LYS C C -5.191 4.551 -6.140 1.00 . A A . 27 LYS C 1 1 3 823 1 1 10 LYS CA C -5.828 3.283 -6.698 1.00 . A A . 27 LYS CA 1 1 3 824 1 1 10 LYS CB C -5.551 2.105 -5.761 1.00 . A A . 27 LYS CB 1 1 3 825 1 1 10 LYS CD C -6.021 -0.288 -5.157 1.00 . A A . 27 LYS CD 1 1 3 826 1 1 10 LYS CE C -4.763 -1.069 -5.504 1.00 . A A . 27 LYS CE 1 1 3 827 1 1 10 LYS CG C -6.275 0.830 -6.155 1.00 . A A . 27 LYS CG 1 1 3 828 1 1 10 LYS H H -4.486 2.498 -8.134 1.00 . A A . 27 LYS H 1 1 3 829 1 1 10 LYS HA H -6.895 3.432 -6.769 1.00 . A A . 27 LYS HA 1 1 3 830 1 1 10 LYS HB2 H -4.489 1.905 -5.758 1.00 . A A . 27 LYS HB2 1 1 3 831 1 1 10 LYS HB3 H -5.860 2.375 -4.761 1.00 . A A . 27 LYS HB3 1 1 3 832 1 1 10 LYS HD2 H -5.906 0.140 -4.172 1.00 . A A . 27 LYS HD2 1 1 3 833 1 1 10 LYS HD3 H -6.866 -0.962 -5.162 1.00 . A A . 27 LYS HD3 1 1 3 834 1 1 10 LYS HE2 H -4.666 -1.112 -6.578 1.00 . A A . 27 LYS HE2 1 1 3 835 1 1 10 LYS HE3 H -3.910 -0.554 -5.086 1.00 . A A . 27 LYS HE3 1 1 3 836 1 1 10 LYS HG2 H -7.336 1.027 -6.196 1.00 . A A . 27 LYS HG2 1 1 3 837 1 1 10 LYS HG3 H -5.928 0.516 -7.129 1.00 . A A . 27 LYS HG3 1 1 3 838 1 1 10 LYS HZ1 H -4.239 -2.517 -4.093 1.00 . A A . 27 LYS HZ1 1 1 3 839 1 1 10 LYS HZ2 H -4.418 -3.123 -5.662 1.00 . A A . 27 LYS HZ2 1 1 3 840 1 1 10 LYS HZ3 H -5.785 -2.726 -4.748 1.00 . A A . 27 LYS HZ3 1 1 3 841 1 1 10 LYS N N -5.326 2.993 -8.036 1.00 . A A . 27 LYS N 1 1 3 842 1 1 10 LYS NZ N -4.805 -2.456 -4.964 1.00 . A A . 27 LYS NZ 1 1 3 843 1 1 10 LYS O O -5.556 5.018 -5.061 1.00 . A A . 27 LYS O 1 1 3 844 1 1 11 TYR C C -4.542 7.449 -6.209 1.00 . A A . 28 TYR C 1 1 3 845 1 1 11 TYR CA C -3.549 6.318 -6.461 1.00 . A A . 28 TYR CA 1 1 3 846 1 1 11 TYR CB C -2.532 6.746 -7.520 1.00 . A A . 28 TYR CB 1 1 3 847 1 1 11 TYR CD1 C -2.395 9.261 -7.336 1.00 . A A . 28 TYR CD1 1 1 3 848 1 1 11 TYR CD2 C -3.371 8.328 -9.300 1.00 . A A . 28 TYR CD2 1 1 3 849 1 1 11 TYR CE1 C -2.611 10.534 -7.827 1.00 . A A . 28 TYR CE1 1 1 3 850 1 1 11 TYR CE2 C -3.590 9.597 -9.800 1.00 . A A . 28 TYR CE2 1 1 3 851 1 1 11 TYR CG C -2.770 8.137 -8.062 1.00 . A A . 28 TYR CG 1 1 3 852 1 1 11 TYR CZ C -3.209 10.697 -9.059 1.00 . A A . 28 TYR CZ 1 1 3 853 1 1 11 TYR H H -3.991 4.686 -7.733 1.00 . A A . 28 TYR H 1 1 3 854 1 1 11 TYR HA H -3.027 6.101 -5.541 1.00 . A A . 28 TYR HA 1 1 3 855 1 1 11 TYR HB2 H -1.543 6.724 -7.089 1.00 . A A . 28 TYR HB2 1 1 3 856 1 1 11 TYR HB3 H -2.573 6.055 -8.349 1.00 . A A . 28 TYR HB3 1 1 3 857 1 1 11 TYR HD1 H -1.927 9.130 -6.371 1.00 . A A . 28 TYR HD1 1 1 3 858 1 1 11 TYR HD2 H -3.669 7.465 -9.877 1.00 . A A . 28 TYR HD2 1 1 3 859 1 1 11 TYR HE1 H -2.313 11.395 -7.248 1.00 . A A . 28 TYR HE1 1 1 3 860 1 1 11 TYR HE2 H -4.059 9.725 -10.764 1.00 . A A . 28 TYR HE2 1 1 3 861 1 1 11 TYR HH H -3.620 12.560 -8.826 1.00 . A A . 28 TYR HH 1 1 3 862 1 1 11 TYR N N -4.238 5.104 -6.882 1.00 . A A . 28 TYR N 1 1 3 863 1 1 11 TYR O O -5.566 7.554 -6.885 1.00 . A A . 28 TYR O 1 1 3 864 1 1 11 TYR OH O -3.427 11.963 -9.553 1.00 . A A . 28 TYR OH 1 1 3 865 1 1 12 ASP C C -4.300 10.717 -4.841 1.00 . A A . 29 ASP C 1 1 3 866 1 1 12 ASP CA C -5.095 9.417 -4.888 1.00 . A A . 29 ASP CA 1 1 3 867 1 1 12 ASP CB C -5.777 9.172 -3.541 1.00 . A A . 29 ASP CB 1 1 3 868 1 1 12 ASP CG C -7.118 8.479 -3.688 1.00 . A A . 29 ASP CG 1 1 3 869 1 1 12 ASP H H -3.402 8.156 -4.727 1.00 . A A . 29 ASP H 1 1 3 870 1 1 12 ASP HA H -5.851 9.500 -5.654 1.00 . A A . 29 ASP HA 1 1 3 871 1 1 12 ASP HB2 H -5.138 8.552 -2.929 1.00 . A A . 29 ASP HB2 1 1 3 872 1 1 12 ASP HB3 H -5.934 10.119 -3.047 1.00 . A A . 29 ASP HB3 1 1 3 873 1 1 12 ASP N N -4.232 8.292 -5.231 1.00 . A A . 29 ASP N 1 1 3 874 1 1 12 ASP O O -3.234 10.782 -4.229 1.00 . A A . 29 ASP O 1 1 3 875 1 1 12 ASP OD1 O -7.174 7.436 -4.373 1.00 . A A . 29 ASP OD1 1 1 3 876 1 1 12 ASP OD2 O -8.111 8.979 -3.119 1.00 . A A . 29 ASP OD2 1 1 3 877 1 1 13 TRP C C -3.942 13.583 -4.112 1.00 . A A . 30 TRP C 1 1 3 878 1 1 13 TRP CA C -4.163 13.049 -5.523 1.00 . A A . 30 TRP CA 1 1 3 879 1 1 13 TRP CB C -4.991 14.046 -6.335 1.00 . A A . 30 TRP CB 1 1 3 880 1 1 13 TRP CD1 C -4.103 15.142 -8.475 1.00 . A A . 30 TRP CD1 1 1 3 881 1 1 13 TRP CD2 C -3.252 15.990 -6.585 1.00 . A A . 30 TRP CD2 1 1 3 882 1 1 13 TRP CE2 C -2.687 16.673 -7.679 1.00 . A A . 30 TRP CE2 1 1 3 883 1 1 13 TRP CE3 C -2.867 16.353 -5.292 1.00 . A A . 30 TRP CE3 1 1 3 884 1 1 13 TRP CG C -4.156 15.015 -7.117 1.00 . A A . 30 TRP CG 1 1 3 885 1 1 13 TRP CH2 C -1.398 18.032 -6.240 1.00 . A A . 30 TRP CH2 1 1 3 886 1 1 13 TRP CZ2 C -1.757 17.697 -7.517 1.00 . A A . 30 TRP CZ2 1 1 3 887 1 1 13 TRP CZ3 C -1.944 17.369 -5.133 1.00 . A A . 30 TRP CZ3 1 1 3 888 1 1 13 TRP H H -5.678 11.636 -5.959 1.00 . A A . 30 TRP H 1 1 3 889 1 1 13 TRP HA H -3.203 12.919 -6.001 1.00 . A A . 30 TRP HA 1 1 3 890 1 1 13 TRP HB2 H -5.613 13.505 -7.032 1.00 . A A . 30 TRP HB2 1 1 3 891 1 1 13 TRP HB3 H -5.619 14.613 -5.663 1.00 . A A . 30 TRP HB3 1 1 3 892 1 1 13 TRP HD1 H -4.675 14.540 -9.165 1.00 . A A . 30 TRP HD1 1 1 3 893 1 1 13 TRP HE1 H -3.011 16.418 -9.736 1.00 . A A . 30 TRP HE1 1 1 3 894 1 1 13 TRP HE3 H -3.277 15.854 -4.426 1.00 . A A . 30 TRP HE3 1 1 3 895 1 1 13 TRP HH2 H -0.681 18.820 -6.068 1.00 . A A . 30 TRP HH2 1 1 3 896 1 1 13 TRP HZ2 H -1.328 18.218 -8.360 1.00 . A A . 30 TRP HZ2 1 1 3 897 1 1 13 TRP HZ3 H -1.634 17.664 -4.141 1.00 . A A . 30 TRP HZ3 1 1 3 898 1 1 13 TRP N N -4.825 11.750 -5.490 1.00 . A A . 30 TRP N 1 1 3 899 1 1 13 TRP NE1 N -3.221 16.137 -8.821 1.00 . A A . 30 TRP NE1 1 1 3 900 1 1 13 TRP O O -2.805 13.730 -3.666 1.00 . A A . 30 TRP O 1 1 3 901 1 1 14 GLU C C -4.475 13.313 -1.088 1.00 . A A . 31 GLU C 1 1 3 902 1 1 14 GLU CA C -4.960 14.390 -2.054 1.00 . A A . 31 GLU CA 1 1 3 903 1 1 14 GLU CB C -6.327 14.914 -1.607 1.00 . A A . 31 GLU CB 1 1 3 904 1 1 14 GLU CD C -7.844 16.934 -1.602 1.00 . A A . 31 GLU CD 1 1 3 905 1 1 14 GLU CG C -6.771 16.164 -2.348 1.00 . A A . 31 GLU CG 1 1 3 906 1 1 14 GLU H H -5.916 13.733 -3.825 1.00 . A A . 31 GLU H 1 1 3 907 1 1 14 GLU HA H -4.253 15.206 -2.049 1.00 . A A . 31 GLU HA 1 1 3 908 1 1 14 GLU HB2 H -7.065 14.143 -1.768 1.00 . A A . 31 GLU HB2 1 1 3 909 1 1 14 GLU HB3 H -6.283 15.143 -0.552 1.00 . A A . 31 GLU HB3 1 1 3 910 1 1 14 GLU HG2 H -5.917 16.809 -2.485 1.00 . A A . 31 GLU HG2 1 1 3 911 1 1 14 GLU HG3 H -7.161 15.875 -3.313 1.00 . A A . 31 GLU HG3 1 1 3 912 1 1 14 GLU N N -5.037 13.872 -3.415 1.00 . A A . 31 GLU N 1 1 3 913 1 1 14 GLU O O -3.543 13.532 -0.313 1.00 . A A . 31 GLU O 1 1 3 914 1 1 14 GLU OE1 O -9.021 16.521 -1.665 1.00 . A A . 31 GLU OE1 1 1 3 915 1 1 14 GLU OE2 O -7.507 17.948 -0.956 1.00 . A A . 31 GLU OE2 1 1 3 916 1 1 15 LEU C C -3.285 10.654 -0.460 1.00 . A A . 32 LEU C 1 1 3 917 1 1 15 LEU CA C -4.749 11.037 -0.269 1.00 . A A . 32 LEU CA 1 1 3 918 1 1 15 LEU CB C -5.645 9.829 -0.550 1.00 . A A . 32 LEU CB 1 1 3 919 1 1 15 LEU CD1 C -7.054 10.125 1.502 1.00 . A A . 32 LEU CD1 1 1 3 920 1 1 15 LEU CD2 C -7.105 7.957 0.255 1.00 . A A . 32 LEU CD2 1 1 3 921 1 1 15 LEU CG C -6.243 9.138 0.676 1.00 . A A . 32 LEU CG 1 1 3 922 1 1 15 LEU H H -5.848 12.034 -1.778 1.00 . A A . 32 LEU H 1 1 3 923 1 1 15 LEU HA H -4.896 11.354 0.753 1.00 . A A . 32 LEU HA 1 1 3 924 1 1 15 LEU HB2 H -6.461 10.160 -1.173 1.00 . A A . 32 LEU HB2 1 1 3 925 1 1 15 LEU HB3 H -5.056 9.100 -1.088 1.00 . A A . 32 LEU HB3 1 1 3 926 1 1 15 LEU HD11 H -7.472 10.879 0.853 1.00 . A A . 32 LEU HD11 1 1 3 927 1 1 15 LEU HD12 H -6.414 10.594 2.234 1.00 . A A . 32 LEU HD12 1 1 3 928 1 1 15 LEU HD13 H -7.853 9.600 2.007 1.00 . A A . 32 LEU HD13 1 1 3 929 1 1 15 LEU HD21 H -8.083 8.311 -0.035 1.00 . A A . 32 LEU HD21 1 1 3 930 1 1 15 LEU HD22 H -7.202 7.269 1.082 1.00 . A A . 32 LEU HD22 1 1 3 931 1 1 15 LEU HD23 H -6.642 7.453 -0.580 1.00 . A A . 32 LEU HD23 1 1 3 932 1 1 15 LEU HG H -5.442 8.764 1.298 1.00 . A A . 32 LEU HG 1 1 3 933 1 1 15 LEU N N -5.114 12.149 -1.140 1.00 . A A . 32 LEU N 1 1 3 934 1 1 15 LEU O O -2.698 9.970 0.379 1.00 . A A . 32 LEU O 1 1 3 935 1 1 16 TRP C C -0.438 10.953 -0.619 1.00 . A A . 33 TRP C 1 1 3 936 1 1 16 TRP CA C -1.305 10.806 -1.865 1.00 . A A . 33 TRP CA 1 1 3 937 1 1 16 TRP CB C -0.792 11.732 -2.970 1.00 . A A . 33 TRP CB 1 1 3 938 1 1 16 TRP CD1 C 1.441 11.004 -3.993 1.00 . A A . 33 TRP CD1 1 1 3 939 1 1 16 TRP CD2 C 1.633 12.481 -2.321 1.00 . A A . 33 TRP CD2 1 1 3 940 1 1 16 TRP CE2 C 2.923 12.166 -2.792 1.00 . A A . 33 TRP CE2 1 1 3 941 1 1 16 TRP CE3 C 1.505 13.394 -1.271 1.00 . A A . 33 TRP CE3 1 1 3 942 1 1 16 TRP CG C 0.700 11.728 -3.104 1.00 . A A . 33 TRP CG 1 1 3 943 1 1 16 TRP CH2 C 3.918 13.619 -1.219 1.00 . A A . 33 TRP CH2 1 1 3 944 1 1 16 TRP CZ2 C 4.073 12.729 -2.247 1.00 . A A . 33 TRP CZ2 1 1 3 945 1 1 16 TRP CZ3 C 2.647 13.952 -0.730 1.00 . A A . 33 TRP CZ3 1 1 3 946 1 1 16 TRP H H -3.222 11.641 -2.197 1.00 . A A . 33 TRP H 1 1 3 947 1 1 16 TRP HA H -1.249 9.784 -2.211 1.00 . A A . 33 TRP HA 1 1 3 948 1 1 16 TRP HB2 H -1.213 11.423 -3.915 1.00 . A A . 33 TRP HB2 1 1 3 949 1 1 16 TRP HB3 H -1.106 12.744 -2.755 1.00 . A A . 33 TRP HB3 1 1 3 950 1 1 16 TRP HD1 H 1.024 10.330 -4.725 1.00 . A A . 33 TRP HD1 1 1 3 951 1 1 16 TRP HE1 H 3.510 10.864 -4.329 1.00 . A A . 33 TRP HE1 1 1 3 952 1 1 16 TRP HE3 H 0.534 13.663 -0.880 1.00 . A A . 33 TRP HE3 1 1 3 953 1 1 16 TRP HH2 H 4.782 14.080 -0.766 1.00 . A A . 33 TRP HH2 1 1 3 954 1 1 16 TRP HZ2 H 5.059 12.484 -2.613 1.00 . A A . 33 TRP HZ2 1 1 3 955 1 1 16 TRP HZ3 H 2.568 14.659 0.083 1.00 . A A . 33 TRP HZ3 1 1 3 956 1 1 16 TRP N N -2.702 11.101 -1.566 1.00 . A A . 33 TRP N 1 1 3 957 1 1 16 TRP NE1 N 2.779 11.262 -3.811 1.00 . A A . 33 TRP NE1 1 1 3 958 1 1 16 TRP O O 0.518 10.202 -0.426 1.00 . A A . 33 TRP O 1 1 3 959 1 1 17 ASP C C 0.254 10.857 2.181 1.00 . A A . 34 ASP C 1 1 3 960 1 1 17 ASP CA C -0.033 12.165 1.451 1.00 . A A . 34 ASP CA 1 1 3 961 1 1 17 ASP CB C -0.809 13.114 2.365 1.00 . A A . 34 ASP CB 1 1 3 962 1 1 17 ASP CG C -0.082 14.426 2.590 1.00 . A A . 34 ASP CG 1 1 3 963 1 1 17 ASP H H -1.552 12.487 0.013 1.00 . A A . 34 ASP H 1 1 3 964 1 1 17 ASP HA H 0.906 12.626 1.183 1.00 . A A . 34 ASP HA 1 1 3 965 1 1 17 ASP HB2 H -1.769 13.329 1.919 1.00 . A A . 34 ASP HB2 1 1 3 966 1 1 17 ASP HB3 H -0.960 12.638 3.323 1.00 . A A . 34 ASP HB3 1 1 3 967 1 1 17 ASP N N -0.779 11.922 0.222 1.00 . A A . 34 ASP N 1 1 3 968 1 1 17 ASP O O 1.344 10.659 2.719 1.00 . A A . 34 ASP O 1 1 3 969 1 1 17 ASP OD1 O 0.901 14.434 3.359 1.00 . A A . 34 ASP OD1 1 1 3 970 1 1 17 ASP OD2 O -0.498 15.444 1.997 1.00 . A A . 34 ASP OD2 1 1 3 971 1 1 18 LYS C C -0.360 7.563 1.843 1.00 . A A . 35 LYS C 1 1 3 972 1 1 18 LYS CA C -0.588 8.676 2.861 1.00 . A A . 35 LYS CA 1 1 3 973 1 1 18 LYS CB C -1.830 8.368 3.699 1.00 . A A . 35 LYS CB 1 1 3 974 1 1 18 LYS CD C -4.253 7.727 3.531 1.00 . A A . 35 LYS CD 1 1 3 975 1 1 18 LYS CE C -4.106 6.266 3.132 1.00 . A A . 35 LYS CE 1 1 3 976 1 1 18 LYS CG C -3.136 8.577 2.951 1.00 . A A . 35 LYS CG 1 1 3 977 1 1 18 LYS H H -1.578 10.182 1.751 1.00 . A A . 35 LYS H 1 1 3 978 1 1 18 LYS HA H 0.271 8.732 3.513 1.00 . A A . 35 LYS HA 1 1 3 979 1 1 18 LYS HB2 H -1.786 7.339 4.022 1.00 . A A . 35 LYS HB2 1 1 3 980 1 1 18 LYS HB3 H -1.831 9.010 4.568 1.00 . A A . 35 LYS HB3 1 1 3 981 1 1 18 LYS HD2 H -4.227 7.798 4.608 1.00 . A A . 35 LYS HD2 1 1 3 982 1 1 18 LYS HD3 H -5.201 8.097 3.167 1.00 . A A . 35 LYS HD3 1 1 3 983 1 1 18 LYS HE2 H -4.854 6.032 2.390 1.00 . A A . 35 LYS HE2 1 1 3 984 1 1 18 LYS HE3 H -3.123 6.119 2.712 1.00 . A A . 35 LYS HE3 1 1 3 985 1 1 18 LYS HG2 H -3.417 9.617 3.019 1.00 . A A . 35 LYS HG2 1 1 3 986 1 1 18 LYS HG3 H -2.992 8.309 1.914 1.00 . A A . 35 LYS HG3 1 1 3 987 1 1 18 LYS HZ1 H -3.706 5.687 5.099 1.00 . A A . 35 LYS HZ1 1 1 3 988 1 1 18 LYS HZ2 H -3.972 4.392 4.045 1.00 . A A . 35 LYS HZ2 1 1 3 989 1 1 18 LYS HZ3 H -5.276 5.325 4.585 1.00 . A A . 35 LYS HZ3 1 1 3 990 1 1 18 LYS N N -0.732 9.966 2.197 1.00 . A A . 35 LYS N 1 1 3 991 1 1 18 LYS NZ N -4.277 5.354 4.297 1.00 . A A . 35 LYS NZ 1 1 3 992 1 1 18 LYS O O 0.127 6.486 2.186 1.00 . A A . 35 LYS O 1 1 3 993 1 1 19 TRP C C 0.812 7.012 -1.154 1.00 . A A . 36 TRP C 1 1 3 994 1 1 19 TRP CA C -0.545 6.852 -0.477 1.00 . A A . 36 TRP CA 1 1 3 995 1 1 19 TRP CB C -1.664 6.997 -1.510 1.00 . A A . 36 TRP CB 1 1 3 996 1 1 19 TRP CD1 C -3.860 6.602 -0.248 1.00 . A A . 36 TRP CD1 1 1 3 997 1 1 19 TRP CD2 C -3.321 4.975 -1.690 1.00 . A A . 36 TRP CD2 1 1 3 998 1 1 19 TRP CE2 C -4.539 4.639 -1.068 1.00 . A A . 36 TRP CE2 1 1 3 999 1 1 19 TRP CE3 C -2.785 4.100 -2.639 1.00 . A A . 36 TRP CE3 1 1 3 1000 1 1 19 TRP CG C -2.904 6.235 -1.152 1.00 . A A . 36 TRP CG 1 1 3 1001 1 1 19 TRP CH2 C -4.679 2.626 -2.296 1.00 . A A . 36 TRP CH2 1 1 3 1002 1 1 19 TRP CZ2 C -5.227 3.465 -1.363 1.00 . A A . 36 TRP CZ2 1 1 3 1003 1 1 19 TRP CZ3 C -3.469 2.935 -2.931 1.00 . A A . 36 TRP CZ3 1 1 3 1004 1 1 19 TRP H H -1.096 8.709 0.379 1.00 . A A . 36 TRP H 1 1 3 1005 1 1 19 TRP HA H -0.600 5.868 -0.035 1.00 . A A . 36 TRP HA 1 1 3 1006 1 1 19 TRP HB2 H -1.929 8.040 -1.602 1.00 . A A . 36 TRP HB2 1 1 3 1007 1 1 19 TRP HB3 H -1.312 6.633 -2.464 1.00 . A A . 36 TRP HB3 1 1 3 1008 1 1 19 TRP HD1 H -3.831 7.512 0.331 1.00 . A A . 36 TRP HD1 1 1 3 1009 1 1 19 TRP HE1 H -5.640 5.683 0.381 1.00 . A A . 36 TRP HE1 1 1 3 1010 1 1 19 TRP HE3 H -1.854 4.321 -3.139 1.00 . A A . 36 TRP HE3 1 1 3 1011 1 1 19 TRP HH2 H -5.178 1.705 -2.554 1.00 . A A . 36 TRP HH2 1 1 3 1012 1 1 19 TRP HZ2 H -6.161 3.213 -0.883 1.00 . A A . 36 TRP HZ2 1 1 3 1013 1 1 19 TRP HZ3 H -3.070 2.246 -3.661 1.00 . A A . 36 TRP HZ3 1 1 3 1014 1 1 19 TRP N N -0.713 7.832 0.591 1.00 . A A . 36 TRP N 1 1 3 1015 1 1 19 TRP NE1 N -4.846 5.647 -0.192 1.00 . A A . 36 TRP NE1 1 1 3 1016 1 1 19 TRP O O 1.047 6.465 -2.231 1.00 . A A . 36 TRP O 1 1 3 1017 1 1 20 CYS C C 2.963 8.774 -2.367 1.00 . A A . 37 CYS C 1 1 3 1018 1 1 20 CYS CA C 3.035 7.997 -1.056 1.00 . A A . 37 CYS CA 1 1 3 1019 1 1 20 CYS CB C 3.757 6.667 -1.277 1.00 . A A . 37 CYS CB 1 1 3 1020 1 1 20 CYS H H 1.455 8.175 0.341 1.00 . A A . 37 CYS H 1 1 3 1021 1 1 20 CYS HA H 3.588 8.581 -0.336 1.00 . A A . 37 CYS HA 1 1 3 1022 1 1 20 CYS HB2 H 3.331 6.174 -2.140 1.00 . A A . 37 CYS HB2 1 1 3 1023 1 1 20 CYS HB3 H 4.804 6.860 -1.460 1.00 . A A . 37 CYS HB3 1 1 3 1024 1 1 20 CYS N N 1.701 7.765 -0.515 1.00 . A A . 37 CYS N 1 1 3 1025 1 1 20 CYS O O 3.887 8.725 -3.180 1.00 . A A . 37 CYS O 1 1 3 1026 1 1 20 CYS SG S 3.643 5.515 0.129 1.00 . A A . 37 CYS SG 1 1 4 1027 1 1 1 ASN C C 3.630 0.550 -1.897 1.00 . A A . 18 ASN C 1 1 4 1028 1 1 1 ASN CA C 2.441 -0.403 -1.972 1.00 . A A . 18 ASN CA 1 1 4 1029 1 1 1 ASN CB C 1.570 -0.056 -3.181 1.00 . A A . 18 ASN CB 1 1 4 1030 1 1 1 ASN CG C 0.091 -0.049 -2.845 1.00 . A A . 18 ASN CG 1 1 4 1031 1 1 1 ASN H1 H 1.728 0.438 -0.165 1.00 . A A . 18 ASN H1 1 1 4 1032 1 1 1 ASN HA H 2.810 -1.412 -2.083 1.00 . A A . 18 ASN HA 1 1 4 1033 1 1 1 ASN HB2 H 1.842 0.925 -3.542 1.00 . A A . 18 ASN HB2 1 1 4 1034 1 1 1 ASN HB3 H 1.740 -0.783 -3.961 1.00 . A A . 18 ASN HB3 1 1 4 1035 1 1 1 ASN HD21 H -0.164 -1.761 -3.824 1.00 . A A . 18 ASN HD21 1 1 4 1036 1 1 1 ASN HD22 H -1.583 -1.090 -3.100 1.00 . A A . 18 ASN HD22 1 1 4 1037 1 1 1 ASN N N 1.652 -0.347 -0.747 1.00 . A A . 18 ASN N 1 1 4 1038 1 1 1 ASN ND2 N -0.624 -1.070 -3.303 1.00 . A A . 18 ASN ND2 1 1 4 1039 1 1 1 ASN O O 4.784 0.120 -1.866 1.00 . A A . 18 ASN O 1 1 4 1040 1 1 1 ASN OD1 O -0.402 0.863 -2.181 1.00 . A A . 18 ASN OD1 1 1 4 1041 1 1 2 CYS C C 5.435 2.640 -2.882 1.00 . A A . 19 CYS C 1 1 4 1042 1 1 2 CYS CA C 4.385 2.862 -1.797 1.00 . A A . 19 CYS CA 1 1 4 1043 1 1 2 CYS CB C 5.048 2.846 -0.419 1.00 . A A . 19 CYS CB 1 1 4 1044 1 1 2 CYS H H 2.402 2.128 -1.896 1.00 . A A . 19 CYS H 1 1 4 1045 1 1 2 CYS HA H 3.922 3.825 -1.953 1.00 . A A . 19 CYS HA 1 1 4 1046 1 1 2 CYS HB2 H 4.426 2.286 0.265 1.00 . A A . 19 CYS HB2 1 1 4 1047 1 1 2 CYS HB3 H 6.012 2.364 -0.497 1.00 . A A . 19 CYS HB3 1 1 4 1048 1 1 2 CYS N N 3.341 1.847 -1.868 1.00 . A A . 19 CYS N 1 1 4 1049 1 1 2 CYS O O 6.603 2.990 -2.711 1.00 . A A . 19 CYS O 1 1 4 1050 1 1 2 CYS SG S 5.310 4.499 0.300 1.00 . A A . 19 CYS SG 1 1 4 1051 1 1 3 ASP C C 5.466 2.536 -6.364 1.00 . A A . 20 ASP C 1 1 4 1052 1 1 3 ASP CA C 5.913 1.789 -5.111 1.00 . A A . 20 ASP CA 1 1 4 1053 1 1 3 ASP CB C 5.977 0.287 -5.393 1.00 . A A . 20 ASP CB 1 1 4 1054 1 1 3 ASP CG C 7.176 -0.374 -4.742 1.00 . A A . 20 ASP CG 1 1 4 1055 1 1 3 ASP H H 4.067 1.801 -4.074 1.00 . A A . 20 ASP H 1 1 4 1056 1 1 3 ASP HA H 6.896 2.136 -4.832 1.00 . A A . 20 ASP HA 1 1 4 1057 1 1 3 ASP HB2 H 5.081 -0.183 -5.014 1.00 . A A . 20 ASP HB2 1 1 4 1058 1 1 3 ASP HB3 H 6.037 0.130 -6.460 1.00 . A A . 20 ASP HB3 1 1 4 1059 1 1 3 ASP N N 5.010 2.057 -3.998 1.00 . A A . 20 ASP N 1 1 4 1060 1 1 3 ASP O O 6.060 2.386 -7.432 1.00 . A A . 20 ASP O 1 1 4 1061 1 1 3 ASP OD1 O 8.317 -0.034 -5.118 1.00 . A A . 20 ASP OD1 1 1 4 1062 1 1 3 ASP OD2 O 6.973 -1.231 -3.857 1.00 . A A . 20 ASP OD2 1 1 4 1063 1 1 4 TRP C C 3.119 5.328 -6.856 1.00 . A A . 21 TRP C 1 1 4 1064 1 1 4 TRP CA C 3.891 4.108 -7.347 1.00 . A A . 21 TRP CA 1 1 4 1065 1 1 4 TRP CB C 2.986 3.231 -8.214 1.00 . A A . 21 TRP CB 1 1 4 1066 1 1 4 TRP CD1 C 1.179 2.711 -6.472 1.00 . A A . 21 TRP CD1 1 1 4 1067 1 1 4 TRP CD2 C 2.023 0.904 -7.492 1.00 . A A . 21 TRP CD2 1 1 4 1068 1 1 4 TRP CE2 C 1.048 0.483 -6.567 1.00 . A A . 21 TRP CE2 1 1 4 1069 1 1 4 TRP CE3 C 2.689 -0.060 -8.254 1.00 . A A . 21 TRP CE3 1 1 4 1070 1 1 4 TRP CG C 2.090 2.332 -7.416 1.00 . A A . 21 TRP CG 1 1 4 1071 1 1 4 TRP CH2 C 1.394 -1.781 -7.142 1.00 . A A . 21 TRP CH2 1 1 4 1072 1 1 4 TRP CZ2 C 0.726 -0.859 -6.383 1.00 . A A . 21 TRP CZ2 1 1 4 1073 1 1 4 TRP CZ3 C 2.369 -1.392 -8.070 1.00 . A A . 21 TRP CZ3 1 1 4 1074 1 1 4 TRP H H 3.987 3.417 -5.348 1.00 . A A . 21 TRP H 1 1 4 1075 1 1 4 TRP HA H 4.729 4.442 -7.941 1.00 . A A . 21 TRP HA 1 1 4 1076 1 1 4 TRP HB2 H 2.362 3.864 -8.827 1.00 . A A . 21 TRP HB2 1 1 4 1077 1 1 4 TRP HB3 H 3.600 2.612 -8.851 1.00 . A A . 21 TRP HB3 1 1 4 1078 1 1 4 TRP HD1 H 0.993 3.733 -6.182 1.00 . A A . 21 TRP HD1 1 1 4 1079 1 1 4 TRP HE1 H -0.147 1.615 -5.266 1.00 . A A . 21 TRP HE1 1 1 4 1080 1 1 4 TRP HE3 H 3.443 0.220 -8.974 1.00 . A A . 21 TRP HE3 1 1 4 1081 1 1 4 TRP HH2 H 1.176 -2.833 -7.031 1.00 . A A . 21 TRP HH2 1 1 4 1082 1 1 4 TRP HZ2 H -0.023 -1.175 -5.672 1.00 . A A . 21 TRP HZ2 1 1 4 1083 1 1 4 TRP HZ3 H 2.873 -2.151 -8.649 1.00 . A A . 21 TRP HZ3 1 1 4 1084 1 1 4 TRP N N 4.418 3.339 -6.226 1.00 . A A . 21 TRP N 1 1 4 1085 1 1 4 TRP NE1 N 0.549 1.604 -5.957 1.00 . A A . 21 TRP NE1 1 1 4 1086 1 1 4 TRP O O 2.575 5.326 -5.752 1.00 . A A . 21 TRP O 1 1 4 1087 1 1 5 ASP C C 1.946 8.354 -8.584 1.00 . A A . 22 ASP C 1 1 4 1088 1 1 5 ASP CA C 2.369 7.594 -7.331 1.00 . A A . 22 ASP CA 1 1 4 1089 1 1 5 ASP CB C 3.251 8.483 -6.453 1.00 . A A . 22 ASP CB 1 1 4 1090 1 1 5 ASP CG C 4.729 8.278 -6.722 1.00 . A A . 22 ASP CG 1 1 4 1091 1 1 5 ASP H H 3.530 6.308 -8.549 1.00 . A A . 22 ASP H 1 1 4 1092 1 1 5 ASP HA H 1.485 7.320 -6.776 1.00 . A A . 22 ASP HA 1 1 4 1093 1 1 5 ASP HB2 H 3.010 9.519 -6.644 1.00 . A A . 22 ASP HB2 1 1 4 1094 1 1 5 ASP HB3 H 3.057 8.258 -5.415 1.00 . A A . 22 ASP HB3 1 1 4 1095 1 1 5 ASP N N 3.076 6.367 -7.682 1.00 . A A . 22 ASP N 1 1 4 1096 1 1 5 ASP O O 2.644 8.340 -9.598 1.00 . A A . 22 ASP O 1 1 4 1097 1 1 5 ASP OD1 O 5.176 8.584 -7.847 1.00 . A A . 22 ASP OD1 1 1 4 1098 1 1 5 ASP OD2 O 5.439 7.812 -5.806 1.00 . A A . 22 ASP OD2 1 1 4 1099 1 1 6 LYS C C 0.334 8.966 -10.921 1.00 . A A . 23 LYS C 1 1 4 1100 1 1 6 LYS CA C 0.279 9.784 -9.635 1.00 . A A . 23 LYS CA 1 1 4 1101 1 1 6 LYS CB C 1.077 11.078 -9.807 1.00 . A A . 23 LYS CB 1 1 4 1102 1 1 6 LYS CD C 0.328 13.150 -8.599 1.00 . A A . 23 LYS CD 1 1 4 1103 1 1 6 LYS CE C 1.148 14.369 -8.991 1.00 . A A . 23 LYS CE 1 1 4 1104 1 1 6 LYS CG C 1.188 11.899 -8.533 1.00 . A A . 23 LYS CG 1 1 4 1105 1 1 6 LYS H H 0.284 8.990 -7.672 1.00 . A A . 23 LYS H 1 1 4 1106 1 1 6 LYS HA H -0.750 10.031 -9.423 1.00 . A A . 23 LYS HA 1 1 4 1107 1 1 6 LYS HB2 H 2.075 10.830 -10.139 1.00 . A A . 23 LYS HB2 1 1 4 1108 1 1 6 LYS HB3 H 0.597 11.686 -10.561 1.00 . A A . 23 LYS HB3 1 1 4 1109 1 1 6 LYS HD2 H -0.450 13.003 -9.333 1.00 . A A . 23 LYS HD2 1 1 4 1110 1 1 6 LYS HD3 H -0.116 13.322 -7.629 1.00 . A A . 23 LYS HD3 1 1 4 1111 1 1 6 LYS HE2 H 0.558 15.255 -8.817 1.00 . A A . 23 LYS HE2 1 1 4 1112 1 1 6 LYS HE3 H 2.036 14.402 -8.377 1.00 . A A . 23 LYS HE3 1 1 4 1113 1 1 6 LYS HG2 H 0.864 11.296 -7.698 1.00 . A A . 23 LYS HG2 1 1 4 1114 1 1 6 LYS HG3 H 2.220 12.189 -8.392 1.00 . A A . 23 LYS HG3 1 1 4 1115 1 1 6 LYS HZ1 H 1.514 15.286 -10.832 1.00 . A A . 23 LYS HZ1 1 1 4 1116 1 1 6 LYS HZ2 H 0.909 13.712 -10.959 1.00 . A A . 23 LYS HZ2 1 1 4 1117 1 1 6 LYS HZ3 H 2.521 13.965 -10.513 1.00 . A A . 23 LYS HZ3 1 1 4 1118 1 1 6 LYS N N 0.797 9.017 -8.508 1.00 . A A . 23 LYS N 1 1 4 1119 1 1 6 LYS NZ N 1.551 14.330 -10.424 1.00 . A A . 23 LYS NZ 1 1 4 1120 1 1 6 LYS O O 0.910 9.398 -11.919 1.00 . A A . 23 LYS O 1 1 4 1121 1 1 7 SER C C -1.036 5.609 -11.744 1.00 . A A . 24 SER C 1 1 4 1122 1 1 7 SER CA C -0.289 6.903 -12.053 1.00 . A A . 24 SER CA 1 1 4 1123 1 1 7 SER CB C 1.139 6.586 -12.501 1.00 . A A . 24 SER CB 1 1 4 1124 1 1 7 SER H H -0.713 7.493 -10.064 1.00 . A A . 24 SER H 1 1 4 1125 1 1 7 SER HA H -0.801 7.419 -12.851 1.00 . A A . 24 SER HA 1 1 4 1126 1 1 7 SER HB2 H 1.838 7.060 -11.829 1.00 . A A . 24 SER HB2 1 1 4 1127 1 1 7 SER HB3 H 1.290 5.516 -12.482 1.00 . A A . 24 SER HB3 1 1 4 1128 1 1 7 SER HG H 0.642 6.812 -14.382 1.00 . A A . 24 SER HG 1 1 4 1129 1 1 7 SER N N -0.271 7.782 -10.890 1.00 . A A . 24 SER N 1 1 4 1130 1 1 7 SER O O -1.666 5.017 -12.622 1.00 . A A . 24 SER O 1 1 4 1131 1 1 7 SER OG O 1.378 7.057 -13.816 1.00 . A A . 24 SER OG 1 1 4 1132 1 1 8 HIS C C -3.147 4.098 -10.163 1.00 . A A . 25 HIS C 1 1 4 1133 1 1 8 HIS CA C -1.631 3.951 -10.063 1.00 . A A . 25 HIS CA 1 1 4 1134 1 1 8 HIS CB C -1.235 3.602 -8.628 1.00 . A A . 25 HIS CB 1 1 4 1135 1 1 8 HIS CD2 C -2.272 1.884 -6.985 1.00 . A A . 25 HIS CD2 1 1 4 1136 1 1 8 HIS CE1 C -2.267 0.134 -8.306 1.00 . A A . 25 HIS CE1 1 1 4 1137 1 1 8 HIS CG C -1.749 2.271 -8.172 1.00 . A A . 25 HIS CG 1 1 4 1138 1 1 8 HIS H H -0.445 5.690 -9.836 1.00 . A A . 25 HIS H 1 1 4 1139 1 1 8 HIS HA H -1.315 3.155 -10.719 1.00 . A A . 25 HIS HA 1 1 4 1140 1 1 8 HIS HB2 H -0.157 3.583 -8.554 1.00 . A A . 25 HIS HB2 1 1 4 1141 1 1 8 HIS HB3 H -1.624 4.356 -7.960 1.00 . A A . 25 HIS HB3 1 1 4 1142 1 1 8 HIS HD1 H -1.442 1.110 -9.903 1.00 . A A . 25 HIS HD1 1 1 4 1143 1 1 8 HIS HD2 H -2.417 2.507 -6.114 1.00 . A A . 25 HIS HD2 1 1 4 1144 1 1 8 HIS HE1 H -2.399 -0.869 -8.683 1.00 . A A . 25 HIS HE1 1 1 4 1145 1 1 8 HIS N N -0.962 5.175 -10.490 1.00 . A A . 25 HIS N 1 1 4 1146 1 1 8 HIS ND1 N -1.759 1.152 -8.977 1.00 . A A . 25 HIS ND1 1 1 4 1147 1 1 8 HIS NE2 N -2.586 0.551 -7.094 1.00 . A A . 25 HIS NE2 1 1 4 1148 1 1 8 HIS O O -3.679 5.203 -10.071 1.00 . A A . 25 HIS O 1 1 4 1149 1 1 9 GLU C C -5.936 3.350 -9.135 1.00 . A A . 26 GLU C 1 1 4 1150 1 1 9 GLU CA C -5.287 2.981 -10.467 1.00 . A A . 26 GLU CA 1 1 4 1151 1 1 9 GLU CB C -5.790 1.612 -10.930 1.00 . A A . 26 GLU CB 1 1 4 1152 1 1 9 GLU CD C -6.164 -0.816 -10.344 1.00 . A A . 26 GLU CD 1 1 4 1153 1 1 9 GLU CG C -5.793 0.562 -9.832 1.00 . A A . 26 GLU CG 1 1 4 1154 1 1 9 GLU H H -3.352 2.125 -10.418 1.00 . A A . 26 GLU H 1 1 4 1155 1 1 9 GLU HA H -5.560 3.722 -11.203 1.00 . A A . 26 GLU HA 1 1 4 1156 1 1 9 GLU HB2 H -6.799 1.719 -11.301 1.00 . A A . 26 GLU HB2 1 1 4 1157 1 1 9 GLU HB3 H -5.157 1.263 -11.732 1.00 . A A . 26 GLU HB3 1 1 4 1158 1 1 9 GLU HG2 H -4.807 0.513 -9.395 1.00 . A A . 26 GLU HG2 1 1 4 1159 1 1 9 GLU HG3 H -6.506 0.852 -9.075 1.00 . A A . 26 GLU HG3 1 1 4 1160 1 1 9 GLU N N -3.834 2.976 -10.353 1.00 . A A . 26 GLU N 1 1 4 1161 1 1 9 GLU O O -7.003 3.964 -9.100 1.00 . A A . 26 GLU O 1 1 4 1162 1 1 9 GLU OE1 O -6.467 -0.940 -11.549 1.00 . A A . 26 GLU OE1 1 1 4 1163 1 1 9 GLU OE2 O -6.150 -1.771 -9.539 1.00 . A A . 26 GLU OE2 1 1 4 1164 1 1 10 LYS C C -5.167 4.532 -6.148 1.00 . A A . 27 LYS C 1 1 4 1165 1 1 10 LYS CA C -5.796 3.260 -6.707 1.00 . A A . 27 LYS CA 1 1 4 1166 1 1 10 LYS CB C -5.518 2.085 -5.766 1.00 . A A . 27 LYS CB 1 1 4 1167 1 1 10 LYS CD C -5.985 -0.306 -5.156 1.00 . A A . 27 LYS CD 1 1 4 1168 1 1 10 LYS CE C -4.725 -1.084 -5.500 1.00 . A A . 27 LYS CE 1 1 4 1169 1 1 10 LYS CG C -6.242 0.809 -6.156 1.00 . A A . 27 LYS CG 1 1 4 1170 1 1 10 LYS H H -4.439 2.483 -8.134 1.00 . A A . 27 LYS H 1 1 4 1171 1 1 10 LYS HA H -6.863 3.403 -6.784 1.00 . A A . 27 LYS HA 1 1 4 1172 1 1 10 LYS HB2 H -4.456 1.886 -5.763 1.00 . A A . 27 LYS HB2 1 1 4 1173 1 1 10 LYS HB3 H -5.827 2.359 -4.767 1.00 . A A . 27 LYS HB3 1 1 4 1174 1 1 10 LYS HD2 H -5.872 0.124 -4.172 1.00 . A A . 27 LYS HD2 1 1 4 1175 1 1 10 LYS HD3 H -6.828 -0.983 -5.160 1.00 . A A . 27 LYS HD3 1 1 4 1176 1 1 10 LYS HE2 H -4.584 -1.061 -6.570 1.00 . A A . 27 LYS HE2 1 1 4 1177 1 1 10 LYS HE3 H -3.883 -0.612 -5.015 1.00 . A A . 27 LYS HE3 1 1 4 1178 1 1 10 LYS HG2 H -7.303 1.005 -6.195 1.00 . A A . 27 LYS HG2 1 1 4 1179 1 1 10 LYS HG3 H -5.896 0.493 -7.130 1.00 . A A . 27 LYS HG3 1 1 4 1180 1 1 10 LYS HZ1 H -4.291 -2.626 -4.159 1.00 . A A . 27 LYS HZ1 1 1 4 1181 1 1 10 LYS HZ2 H -4.392 -3.129 -5.771 1.00 . A A . 27 LYS HZ2 1 1 4 1182 1 1 10 LYS HZ3 H -5.802 -2.773 -4.906 1.00 . A A . 27 LYS HZ3 1 1 4 1183 1 1 10 LYS N N -5.285 2.970 -8.041 1.00 . A A . 27 LYS N 1 1 4 1184 1 1 10 LYS NZ N -4.809 -2.502 -5.053 1.00 . A A . 27 LYS NZ 1 1 4 1185 1 1 10 LYS O O -5.536 4.996 -5.069 1.00 . A A . 27 LYS O 1 1 4 1186 1 1 11 TYR C C -4.539 7.437 -6.222 1.00 . A A . 28 TYR C 1 1 4 1187 1 1 11 TYR CA C -3.538 6.311 -6.467 1.00 . A A . 28 TYR CA 1 1 4 1188 1 1 11 TYR CB C -2.518 6.742 -7.522 1.00 . A A . 28 TYR CB 1 1 4 1189 1 1 11 TYR CD1 C -2.403 9.259 -7.347 1.00 . A A . 28 TYR CD1 1 1 4 1190 1 1 11 TYR CD2 C -3.356 8.310 -9.315 1.00 . A A . 28 TYR CD2 1 1 4 1191 1 1 11 TYR CE1 C -2.626 10.528 -7.845 1.00 . A A . 28 TYR CE1 1 1 4 1192 1 1 11 TYR CE2 C -3.582 9.576 -9.821 1.00 . A A . 28 TYR CE2 1 1 4 1193 1 1 11 TYR CG C -2.764 8.130 -8.071 1.00 . A A . 28 TYR CG 1 1 4 1194 1 1 11 TYR CZ C -3.216 10.681 -9.082 1.00 . A A . 28 TYR CZ 1 1 4 1195 1 1 11 TYR H H -3.968 4.676 -7.740 1.00 . A A . 28 TYR H 1 1 4 1196 1 1 11 TYR HA H -3.019 6.099 -5.544 1.00 . A A . 28 TYR HA 1 1 4 1197 1 1 11 TYR HB2 H -1.531 6.730 -7.085 1.00 . A A . 28 TYR HB2 1 1 4 1198 1 1 11 TYR HB3 H -2.549 6.048 -8.349 1.00 . A A . 28 TYR HB3 1 1 4 1199 1 1 11 TYR HD1 H -1.941 9.135 -6.379 1.00 . A A . 28 TYR HD1 1 1 4 1200 1 1 11 TYR HD2 H -3.642 7.442 -9.892 1.00 . A A . 28 TYR HD2 1 1 4 1201 1 1 11 TYR HE1 H -2.339 11.394 -7.267 1.00 . A A . 28 TYR HE1 1 1 4 1202 1 1 11 TYR HE2 H -4.044 9.696 -10.790 1.00 . A A . 28 TYR HE2 1 1 4 1203 1 1 11 TYR HH H -4.123 11.905 -10.255 1.00 . A A . 28 TYR HH 1 1 4 1204 1 1 11 TYR N N -4.218 5.093 -6.890 1.00 . A A . 28 TYR N 1 1 4 1205 1 1 11 TYR O O -5.558 7.536 -6.905 1.00 . A A . 28 TYR O 1 1 4 1206 1 1 11 TYR OH O -3.439 11.944 -9.582 1.00 . A A . 28 TYR OH 1 1 4 1207 1 1 12 ASP C C -4.324 10.709 -4.862 1.00 . A A . 29 ASP C 1 1 4 1208 1 1 12 ASP CA C -5.111 9.403 -4.907 1.00 . A A . 29 ASP CA 1 1 4 1209 1 1 12 ASP CB C -5.794 9.159 -3.560 1.00 . A A . 29 ASP CB 1 1 4 1210 1 1 12 ASP CG C -7.129 8.455 -3.708 1.00 . A A . 29 ASP CG 1 1 4 1211 1 1 12 ASP H H -3.412 8.151 -4.734 1.00 . A A . 29 ASP H 1 1 4 1212 1 1 12 ASP HA H -5.865 9.478 -5.675 1.00 . A A . 29 ASP HA 1 1 4 1213 1 1 12 ASP HB2 H -5.152 8.547 -2.944 1.00 . A A . 29 ASP HB2 1 1 4 1214 1 1 12 ASP HB3 H -5.959 10.107 -3.071 1.00 . A A . 29 ASP HB3 1 1 4 1215 1 1 12 ASP N N -4.239 8.282 -5.243 1.00 . A A . 29 ASP N 1 1 4 1216 1 1 12 ASP O O -3.259 10.782 -4.249 1.00 . A A . 29 ASP O 1 1 4 1217 1 1 12 ASP OD1 O -7.279 7.662 -4.660 1.00 . A A . 29 ASP OD1 1 1 4 1218 1 1 12 ASP OD2 O -8.024 8.699 -2.872 1.00 . A A . 29 ASP OD2 1 1 4 1219 1 1 13 TRP C C -3.984 13.578 -4.143 1.00 . A A . 30 TRP C 1 1 4 1220 1 1 13 TRP CA C -4.201 13.039 -5.552 1.00 . A A . 30 TRP CA 1 1 4 1221 1 1 13 TRP CB C -5.035 14.028 -6.368 1.00 . A A . 30 TRP CB 1 1 4 1222 1 1 13 TRP CD1 C -4.153 15.124 -8.510 1.00 . A A . 30 TRP CD1 1 1 4 1223 1 1 13 TRP CD2 C -3.308 15.983 -6.622 1.00 . A A . 30 TRP CD2 1 1 4 1224 1 1 13 TRP CE2 C -2.747 16.667 -7.717 1.00 . A A . 30 TRP CE2 1 1 4 1225 1 1 13 TRP CE3 C -2.927 16.352 -5.329 1.00 . A A . 30 TRP CE3 1 1 4 1226 1 1 13 TRP CG C -4.205 15.000 -7.151 1.00 . A A . 30 TRP CG 1 1 4 1227 1 1 13 TRP CH2 C -1.468 18.038 -6.281 1.00 . A A . 30 TRP CH2 1 1 4 1228 1 1 13 TRP CZ2 C -1.824 17.697 -7.557 1.00 . A A . 30 TRP CZ2 1 1 4 1229 1 1 13 TRP CZ3 C -2.010 17.375 -5.172 1.00 . A A . 30 TRP CZ3 1 1 4 1230 1 1 13 TRP H H -5.706 11.615 -5.986 1.00 . A A . 30 TRP H 1 1 4 1231 1 1 13 TRP HA H -3.240 12.914 -6.029 1.00 . A A . 30 TRP HA 1 1 4 1232 1 1 13 TRP HB2 H -5.653 13.481 -7.064 1.00 . A A . 30 TRP HB2 1 1 4 1233 1 1 13 TRP HB3 H -5.667 14.593 -5.697 1.00 . A A . 30 TRP HB3 1 1 4 1234 1 1 13 TRP HD1 H -4.720 14.516 -9.198 1.00 . A A . 30 TRP HD1 1 1 4 1235 1 1 13 TRP HE1 H -3.068 16.404 -9.774 1.00 . A A . 30 TRP HE1 1 1 4 1236 1 1 13 TRP HE3 H -3.334 15.853 -4.462 1.00 . A A . 30 TRP HE3 1 1 4 1237 1 1 13 TRP HH2 H -0.756 18.831 -6.111 1.00 . A A . 30 TRP HH2 1 1 4 1238 1 1 13 TRP HZ2 H -1.397 18.219 -8.402 1.00 . A A . 30 TRP HZ2 1 1 4 1239 1 1 13 TRP HZ3 H -1.703 17.674 -4.181 1.00 . A A . 30 TRP HZ3 1 1 4 1240 1 1 13 TRP N N -4.855 11.735 -5.516 1.00 . A A . 30 TRP N 1 1 4 1241 1 1 13 TRP NE1 N -3.277 16.124 -8.858 1.00 . A A . 30 TRP NE1 1 1 4 1242 1 1 13 TRP O O -2.848 13.733 -3.696 1.00 . A A . 30 TRP O 1 1 4 1243 1 1 14 GLU C C -4.522 13.314 -1.118 1.00 . A A . 31 GLU C 1 1 4 1244 1 1 14 GLU CA C -5.009 14.386 -2.088 1.00 . A A . 31 GLU CA 1 1 4 1245 1 1 14 GLU CB C -6.378 14.907 -1.645 1.00 . A A . 31 GLU CB 1 1 4 1246 1 1 14 GLU CD C -6.117 17.198 -0.613 1.00 . A A . 31 GLU CD 1 1 4 1247 1 1 14 GLU CG C -6.549 16.405 -1.832 1.00 . A A . 31 GLU CG 1 1 4 1248 1 1 14 GLU H H -5.959 13.719 -3.858 1.00 . A A . 31 GLU H 1 1 4 1249 1 1 14 GLU HA H -4.305 15.204 -2.085 1.00 . A A . 31 GLU HA 1 1 4 1250 1 1 14 GLU HB2 H -7.144 14.404 -2.217 1.00 . A A . 31 GLU HB2 1 1 4 1251 1 1 14 GLU HB3 H -6.514 14.678 -0.598 1.00 . A A . 31 GLU HB3 1 1 4 1252 1 1 14 GLU HG2 H -5.954 16.720 -2.676 1.00 . A A . 31 GLU HG2 1 1 4 1253 1 1 14 GLU HG3 H -7.590 16.614 -2.029 1.00 . A A . 31 GLU HG3 1 1 4 1254 1 1 14 GLU N N -5.081 13.863 -3.447 1.00 . A A . 31 GLU N 1 1 4 1255 1 1 14 GLU O O -3.592 13.538 -0.342 1.00 . A A . 31 GLU O 1 1 4 1256 1 1 14 GLU OE1 O -4.973 17.003 -0.152 1.00 . A A . 31 GLU OE1 1 1 4 1257 1 1 14 GLU OE2 O -6.924 18.014 -0.121 1.00 . A A . 31 GLU OE2 1 1 4 1258 1 1 15 LEU C C -3.324 10.663 -0.476 1.00 . A A . 32 LEU C 1 1 4 1259 1 1 15 LEU CA C -4.790 11.040 -0.291 1.00 . A A . 32 LEU CA 1 1 4 1260 1 1 15 LEU CB C -5.680 9.827 -0.572 1.00 . A A . 32 LEU CB 1 1 4 1261 1 1 15 LEU CD1 C -7.100 10.124 1.473 1.00 . A A . 32 LEU CD1 1 1 4 1262 1 1 15 LEU CD2 C -7.136 7.952 0.233 1.00 . A A . 32 LEU CD2 1 1 4 1263 1 1 15 LEU CG C -6.281 9.138 0.654 1.00 . A A . 32 LEU CG 1 1 4 1264 1 1 15 LEU H H -5.891 12.029 -1.805 1.00 . A A . 32 LEU H 1 1 4 1265 1 1 15 LEU HA H -4.942 11.359 0.729 1.00 . A A . 32 LEU HA 1 1 4 1266 1 1 15 LEU HB2 H -6.494 10.153 -1.200 1.00 . A A . 32 LEU HB2 1 1 4 1267 1 1 15 LEU HB3 H -5.085 9.098 -1.104 1.00 . A A . 32 LEU HB3 1 1 4 1268 1 1 15 LEU HD11 H -6.463 10.604 2.200 1.00 . A A . 32 LEU HD11 1 1 4 1269 1 1 15 LEU HD12 H -7.894 9.598 1.981 1.00 . A A . 32 LEU HD12 1 1 4 1270 1 1 15 LEU HD13 H -7.525 10.870 0.817 1.00 . A A . 32 LEU HD13 1 1 4 1271 1 1 15 LEU HD21 H -8.097 8.306 -0.110 1.00 . A A . 32 LEU HD21 1 1 4 1272 1 1 15 LEU HD22 H -7.276 7.292 1.077 1.00 . A A . 32 LEU HD22 1 1 4 1273 1 1 15 LEU HD23 H -6.643 7.418 -0.565 1.00 . A A . 32 LEU HD23 1 1 4 1274 1 1 15 LEU HG H -5.480 8.769 1.280 1.00 . A A . 32 LEU HG 1 1 4 1275 1 1 15 LEU N N -5.157 12.148 -1.166 1.00 . A A . 32 LEU N 1 1 4 1276 1 1 15 LEU O O -2.736 9.985 0.367 1.00 . A A . 32 LEU O 1 1 4 1277 1 1 16 TRP C C -0.478 10.975 -0.629 1.00 . A A . 33 TRP C 1 1 4 1278 1 1 16 TRP CA C -1.340 10.819 -1.876 1.00 . A A . 33 TRP CA 1 1 4 1279 1 1 16 TRP CB C -0.829 11.742 -2.983 1.00 . A A . 33 TRP CB 1 1 4 1280 1 1 16 TRP CD1 C 1.411 11.020 -3.998 1.00 . A A . 33 TRP CD1 1 1 4 1281 1 1 16 TRP CD2 C 1.591 12.505 -2.332 1.00 . A A . 33 TRP CD2 1 1 4 1282 1 1 16 TRP CE2 C 2.883 12.193 -2.798 1.00 . A A . 33 TRP CE2 1 1 4 1283 1 1 16 TRP CE3 C 1.456 13.421 -1.285 1.00 . A A . 33 TRP CE3 1 1 4 1284 1 1 16 TRP CG C 0.664 11.744 -3.113 1.00 . A A . 33 TRP CG 1 1 4 1285 1 1 16 TRP CH2 C 3.868 13.658 -1.228 1.00 . A A . 33 TRP CH2 1 1 4 1286 1 1 16 TRP CZ2 C 4.030 12.765 -2.252 1.00 . A A . 33 TRP CZ2 1 1 4 1287 1 1 16 TRP CZ3 C 2.595 13.987 -0.744 1.00 . A A . 33 TRP CZ3 1 1 4 1288 1 1 16 TRP H H -3.260 11.643 -2.217 1.00 . A A . 33 TRP H 1 1 4 1289 1 1 16 TRP HA H -1.279 9.796 -2.217 1.00 . A A . 33 TRP HA 1 1 4 1290 1 1 16 TRP HB2 H -1.245 11.427 -3.928 1.00 . A A . 33 TRP HB2 1 1 4 1291 1 1 16 TRP HB3 H -1.147 12.753 -2.774 1.00 . A A . 33 TRP HB3 1 1 4 1292 1 1 16 TRP HD1 H 0.998 10.341 -4.728 1.00 . A A . 33 TRP HD1 1 1 4 1293 1 1 16 TRP HE1 H 3.481 10.888 -4.328 1.00 . A A . 33 TRP HE1 1 1 4 1294 1 1 16 TRP HE3 H 0.483 13.688 -0.899 1.00 . A A . 33 TRP HE3 1 1 4 1295 1 1 16 TRP HH2 H 4.729 14.124 -0.775 1.00 . A A . 33 TRP HH2 1 1 4 1296 1 1 16 TRP HZ2 H 5.018 12.522 -2.614 1.00 . A A . 33 TRP HZ2 1 1 4 1297 1 1 16 TRP HZ3 H 2.510 14.697 0.066 1.00 . A A . 33 TRP HZ3 1 1 4 1298 1 1 16 TRP N N -2.739 11.108 -1.582 1.00 . A A . 33 TRP N 1 1 4 1299 1 1 16 TRP NE1 N 2.746 11.284 -3.814 1.00 . A A . 33 TRP NE1 1 1 4 1300 1 1 16 TRP O O 0.482 10.230 -0.429 1.00 . A A . 33 TRP O 1 1 4 1301 1 1 17 ASP C C 0.206 10.895 2.174 1.00 . A A . 34 ASP C 1 1 4 1302 1 1 17 ASP CA C -0.085 12.199 1.438 1.00 . A A . 34 ASP CA 1 1 4 1303 1 1 17 ASP CB C -0.868 13.148 2.346 1.00 . A A . 34 ASP CB 1 1 4 1304 1 1 17 ASP CG C -0.358 14.574 2.271 1.00 . A A . 34 ASP CG 1 1 4 1305 1 1 17 ASP H H -1.602 12.507 -0.006 1.00 . A A . 34 ASP H 1 1 4 1306 1 1 17 ASP HA H 0.852 12.663 1.170 1.00 . A A . 34 ASP HA 1 1 4 1307 1 1 17 ASP HB2 H -1.908 13.141 2.051 1.00 . A A . 34 ASP HB2 1 1 4 1308 1 1 17 ASP HB3 H -0.786 12.808 3.368 1.00 . A A . 34 ASP HB3 1 1 4 1309 1 1 17 ASP N N -0.827 11.946 0.208 1.00 . A A . 34 ASP N 1 1 4 1310 1 1 17 ASP O O 1.296 10.704 2.716 1.00 . A A . 34 ASP O 1 1 4 1311 1 1 17 ASP OD1 O -0.775 15.305 1.348 1.00 . A A . 34 ASP OD1 1 1 4 1312 1 1 17 ASP OD2 O 0.458 14.958 3.134 1.00 . A A . 34 ASP OD2 1 1 4 1313 1 1 18 LYS C C -0.387 7.597 1.849 1.00 . A A . 35 LYS C 1 1 4 1314 1 1 18 LYS CA C -0.626 8.713 2.862 1.00 . A A . 35 LYS CA 1 1 4 1315 1 1 18 LYS CB C -1.871 8.402 3.696 1.00 . A A . 35 LYS CB 1 1 4 1316 1 1 18 LYS CD C -4.289 7.744 3.520 1.00 . A A . 35 LYS CD 1 1 4 1317 1 1 18 LYS CE C -4.132 6.283 3.125 1.00 . A A . 35 LYS CE 1 1 4 1318 1 1 18 LYS CG C -3.174 8.599 2.941 1.00 . A A . 35 LYS CG 1 1 4 1319 1 1 18 LYS H H -1.621 10.209 1.742 1.00 . A A . 35 LYS H 1 1 4 1320 1 1 18 LYS HA H 0.229 8.777 3.517 1.00 . A A . 35 LYS HA 1 1 4 1321 1 1 18 LYS HB2 H -1.821 7.374 4.024 1.00 . A A . 35 LYS HB2 1 1 4 1322 1 1 18 LYS HB3 H -1.879 9.047 4.562 1.00 . A A . 35 LYS HB3 1 1 4 1323 1 1 18 LYS HD2 H -4.266 7.818 4.597 1.00 . A A . 35 LYS HD2 1 1 4 1324 1 1 18 LYS HD3 H -5.238 8.108 3.152 1.00 . A A . 35 LYS HD3 1 1 4 1325 1 1 18 LYS HE2 H -4.872 6.045 2.376 1.00 . A A . 35 LYS HE2 1 1 4 1326 1 1 18 LYS HE3 H -3.145 6.139 2.713 1.00 . A A . 35 LYS HE3 1 1 4 1327 1 1 18 LYS HG2 H -3.462 9.638 3.004 1.00 . A A . 35 LYS HG2 1 1 4 1328 1 1 18 LYS HG3 H -3.024 8.327 1.906 1.00 . A A . 35 LYS HG3 1 1 4 1329 1 1 18 LYS HZ1 H -4.505 4.405 3.959 1.00 . A A . 35 LYS HZ1 1 1 4 1330 1 1 18 LYS HZ2 H -5.106 5.693 4.876 1.00 . A A . 35 LYS HZ2 1 1 4 1331 1 1 18 LYS HZ3 H -3.447 5.362 4.870 1.00 . A A . 35 LYS HZ3 1 1 4 1332 1 1 18 LYS N N -0.775 10.000 2.192 1.00 . A A . 35 LYS N 1 1 4 1333 1 1 18 LYS NZ N -4.310 5.372 4.289 1.00 . A A . 35 LYS NZ 1 1 4 1334 1 1 18 LYS O O 0.104 6.524 2.199 1.00 . A A . 35 LYS O 1 1 4 1335 1 1 19 TRP C C 0.800 7.040 -1.139 1.00 . A A . 36 TRP C 1 1 4 1336 1 1 19 TRP CA C -0.559 6.876 -0.468 1.00 . A A . 36 TRP CA 1 1 4 1337 1 1 19 TRP CB C -1.674 7.010 -1.507 1.00 . A A . 36 TRP CB 1 1 4 1338 1 1 19 TRP CD1 C -3.872 6.606 -0.253 1.00 . A A . 36 TRP CD1 1 1 4 1339 1 1 19 TRP CD2 C -3.319 4.979 -1.689 1.00 . A A . 36 TRP CD2 1 1 4 1340 1 1 19 TRP CE2 C -4.538 4.637 -1.070 1.00 . A A . 36 TRP CE2 1 1 4 1341 1 1 19 TRP CE3 C -2.775 4.104 -2.633 1.00 . A A . 36 TRP CE3 1 1 4 1342 1 1 19 TRP CG C -2.911 6.242 -1.152 1.00 . A A . 36 TRP CG 1 1 4 1343 1 1 19 TRP CH2 C -4.662 2.621 -2.294 1.00 . A A . 36 TRP CH2 1 1 4 1344 1 1 19 TRP CZ2 C -5.218 3.459 -1.366 1.00 . A A . 36 TRP CZ2 1 1 4 1345 1 1 19 TRP CZ3 C -3.451 2.935 -2.925 1.00 . A A . 36 TRP CZ3 1 1 4 1346 1 1 19 TRP H H -1.124 8.733 0.378 1.00 . A A . 36 TRP H 1 1 4 1347 1 1 19 TRP HA H -0.611 5.893 -0.022 1.00 . A A . 36 TRP HA 1 1 4 1348 1 1 19 TRP HB2 H -1.944 8.051 -1.604 1.00 . A A . 36 TRP HB2 1 1 4 1349 1 1 19 TRP HB3 H -1.315 6.645 -2.458 1.00 . A A . 36 TRP HB3 1 1 4 1350 1 1 19 TRP HD1 H -3.850 7.517 0.325 1.00 . A A . 36 TRP HD1 1 1 4 1351 1 1 19 TRP HE1 H -5.650 5.678 0.372 1.00 . A A . 36 TRP HE1 1 1 4 1352 1 1 19 TRP HE3 H -1.843 4.329 -3.131 1.00 . A A . 36 TRP HE3 1 1 4 1353 1 1 19 TRP HH2 H -5.155 1.697 -2.553 1.00 . A A . 36 TRP HH2 1 1 4 1354 1 1 19 TRP HZ2 H -6.152 3.203 -0.888 1.00 . A A . 36 TRP HZ2 1 1 4 1355 1 1 19 TRP HZ3 H -3.046 2.247 -3.652 1.00 . A A . 36 TRP HZ3 1 1 4 1356 1 1 19 TRP N N -0.737 7.858 0.595 1.00 . A A . 36 TRP N 1 1 4 1357 1 1 19 TRP NE1 N -4.853 5.645 -0.198 1.00 . A A . 36 TRP NE1 1 1 4 1358 1 1 19 TRP O O 1.045 6.487 -2.212 1.00 . A A . 36 TRP O 1 1 4 1359 1 1 20 CYS C C 2.946 8.805 -2.356 1.00 . A A . 37 CYS C 1 1 4 1360 1 1 20 CYS CA C 3.017 8.040 -1.037 1.00 . A A . 37 CYS CA 1 1 4 1361 1 1 20 CYS CB C 3.750 6.713 -1.244 1.00 . A A . 37 CYS CB 1 1 4 1362 1 1 20 CYS H H 1.428 8.217 0.351 1.00 . A A . 37 CYS H 1 1 4 1363 1 1 20 CYS HA H 3.562 8.634 -0.319 1.00 . A A . 37 CYS HA 1 1 4 1364 1 1 20 CYS HB2 H 3.334 6.211 -2.105 1.00 . A A . 37 CYS HB2 1 1 4 1365 1 1 20 CYS HB3 H 4.796 6.912 -1.420 1.00 . A A . 37 CYS HB3 1 1 4 1366 1 1 20 CYS N N 1.682 7.803 -0.502 1.00 . A A . 37 CYS N 1 1 4 1367 1 1 20 CYS O O 3.915 8.845 -3.114 1.00 . A A . 37 CYS O 1 1 4 1368 1 1 20 CYS SG S 3.632 5.571 0.171 1.00 . A A . 37 CYS SG 1 1 5 1369 1 1 1 ASN C C 2.372 2.207 -1.543 1.00 . A A . 18 ASN C 1 1 5 1370 1 1 1 ASN CA C 1.377 1.064 -1.719 1.00 . A A . 18 ASN CA 1 1 5 1371 1 1 1 ASN CB C 0.134 1.564 -2.458 1.00 . A A . 18 ASN CB 1 1 5 1372 1 1 1 ASN CG C -0.973 0.528 -2.494 1.00 . A A . 18 ASN CG 1 1 5 1373 1 1 1 ASN H1 H 1.671 0.460 0.288 1.00 . A A . 18 ASN H1 1 1 5 1374 1 1 1 ASN HA H 1.842 0.284 -2.302 1.00 . A A . 18 ASN HA 1 1 5 1375 1 1 1 ASN HB2 H -0.242 2.447 -1.962 1.00 . A A . 18 ASN HB2 1 1 5 1376 1 1 1 ASN HB3 H 0.402 1.813 -3.474 1.00 . A A . 18 ASN HB3 1 1 5 1377 1 1 1 ASN HD21 H 0.143 -0.662 -3.631 1.00 . A A . 18 ASN HD21 1 1 5 1378 1 1 1 ASN HD22 H -1.425 -1.263 -3.228 1.00 . A A . 18 ASN HD22 1 1 5 1379 1 1 1 ASN N N 1.004 0.496 -0.429 1.00 . A A . 18 ASN N 1 1 5 1380 1 1 1 ASN ND2 N -0.727 -0.577 -3.188 1.00 . A A . 18 ASN ND2 1 1 5 1381 1 1 1 ASN O O 2.038 3.256 -0.991 1.00 . A A . 18 ASN O 1 1 5 1382 1 1 1 ASN OD1 O -2.037 0.719 -1.905 1.00 . A A . 18 ASN OD1 1 1 5 1383 1 1 2 CYS C C 5.670 2.845 -3.026 1.00 . A A . 19 CYS C 1 1 5 1384 1 1 2 CYS CA C 4.640 3.009 -1.912 1.00 . A A . 19 CYS CA 1 1 5 1385 1 1 2 CYS CB C 5.329 2.923 -0.549 1.00 . A A . 19 CYS CB 1 1 5 1386 1 1 2 CYS H H 3.802 1.141 -2.447 1.00 . A A . 19 CYS H 1 1 5 1387 1 1 2 CYS HA H 4.174 3.978 -2.010 1.00 . A A . 19 CYS HA 1 1 5 1388 1 1 2 CYS HB2 H 4.780 2.237 0.080 1.00 . A A . 19 CYS HB2 1 1 5 1389 1 1 2 CYS HB3 H 6.334 2.553 -0.685 1.00 . A A . 19 CYS HB3 1 1 5 1390 1 1 2 CYS N N 3.595 1.998 -2.016 1.00 . A A . 19 CYS N 1 1 5 1391 1 1 2 CYS O O 6.801 3.318 -2.915 1.00 . A A . 19 CYS O 1 1 5 1392 1 1 2 CYS SG S 5.437 4.514 0.332 1.00 . A A . 19 CYS SG 1 1 5 1393 1 1 3 ASP C C 5.676 2.714 -6.461 1.00 . A A . 20 ASP C 1 1 5 1394 1 1 3 ASP CA C 6.156 1.945 -5.235 1.00 . A A . 20 ASP CA 1 1 5 1395 1 1 3 ASP CB C 6.240 0.452 -5.554 1.00 . A A . 20 ASP CB 1 1 5 1396 1 1 3 ASP CG C 7.533 -0.173 -5.069 1.00 . A A . 20 ASP CG 1 1 5 1397 1 1 3 ASP H H 4.355 1.819 -4.129 1.00 . A A . 20 ASP H 1 1 5 1398 1 1 3 ASP HA H 7.139 2.301 -4.964 1.00 . A A . 20 ASP HA 1 1 5 1399 1 1 3 ASP HB2 H 5.415 -0.058 -5.078 1.00 . A A . 20 ASP HB2 1 1 5 1400 1 1 3 ASP HB3 H 6.174 0.315 -6.623 1.00 . A A . 20 ASP HB3 1 1 5 1401 1 1 3 ASP N N 5.270 2.172 -4.099 1.00 . A A . 20 ASP N 1 1 5 1402 1 1 3 ASP O O 6.386 2.811 -7.462 1.00 . A A . 20 ASP O 1 1 5 1403 1 1 3 ASP OD1 O 8.060 0.284 -4.033 1.00 . A A . 20 ASP OD1 1 1 5 1404 1 1 3 ASP OD2 O 8.019 -1.118 -5.725 1.00 . A A . 20 ASP OD2 1 1 5 1405 1 1 4 TRP C C 3.142 5.242 -6.965 1.00 . A A . 21 TRP C 1 1 5 1406 1 1 4 TRP CA C 3.892 4.019 -7.480 1.00 . A A . 21 TRP CA 1 1 5 1407 1 1 4 TRP CB C 2.950 3.134 -8.298 1.00 . A A . 21 TRP CB 1 1 5 1408 1 1 4 TRP CD1 C 1.117 2.749 -6.549 1.00 . A A . 21 TRP CD1 1 1 5 1409 1 1 4 TRP CD2 C 1.954 0.870 -7.434 1.00 . A A . 21 TRP CD2 1 1 5 1410 1 1 4 TRP CE2 C 0.964 0.522 -6.494 1.00 . A A . 21 TRP CE2 1 1 5 1411 1 1 4 TRP CE3 C 2.619 -0.150 -8.120 1.00 . A A . 21 TRP CE3 1 1 5 1412 1 1 4 TRP CG C 2.036 2.299 -7.453 1.00 . A A . 21 TRP CG 1 1 5 1413 1 1 4 TRP CH2 C 1.294 -1.779 -6.911 1.00 . A A . 21 TRP CH2 1 1 5 1414 1 1 4 TRP CZ2 C 0.626 -0.801 -6.225 1.00 . A A . 21 TRP CZ2 1 1 5 1415 1 1 4 TRP CZ3 C 2.283 -1.463 -7.851 1.00 . A A . 21 TRP CZ3 1 1 5 1416 1 1 4 TRP H H 3.950 3.147 -5.551 1.00 . A A . 21 TRP H 1 1 5 1417 1 1 4 TRP HA H 4.703 4.347 -8.113 1.00 . A A . 21 TRP HA 1 1 5 1418 1 1 4 TRP HB2 H 2.339 3.759 -8.932 1.00 . A A . 21 TRP HB2 1 1 5 1419 1 1 4 TRP HB3 H 3.537 2.468 -8.913 1.00 . A A . 21 TRP HB3 1 1 5 1420 1 1 4 TRP HD1 H 0.938 3.791 -6.331 1.00 . A A . 21 TRP HD1 1 1 5 1421 1 1 4 TRP HE1 H -0.235 1.751 -5.288 1.00 . A A . 21 TRP HE1 1 1 5 1422 1 1 4 TRP HE3 H 3.385 0.075 -8.848 1.00 . A A . 21 TRP HE3 1 1 5 1423 1 1 4 TRP HH2 H 1.064 -2.818 -6.732 1.00 . A A . 21 TRP HH2 1 1 5 1424 1 1 4 TRP HZ2 H -0.135 -1.062 -5.504 1.00 . A A . 21 TRP HZ2 1 1 5 1425 1 1 4 TRP HZ3 H 2.787 -2.264 -8.370 1.00 . A A . 21 TRP HZ3 1 1 5 1426 1 1 4 TRP N N 4.468 3.259 -6.376 1.00 . A A . 21 TRP N 1 1 5 1427 1 1 4 TRP NE1 N 0.469 1.686 -5.968 1.00 . A A . 21 TRP NE1 1 1 5 1428 1 1 4 TRP O O 2.620 5.238 -5.851 1.00 . A A . 21 TRP O 1 1 5 1429 1 1 5 ASP C C 1.967 8.293 -8.651 1.00 . A A . 22 ASP C 1 1 5 1430 1 1 5 ASP CA C 2.404 7.518 -7.411 1.00 . A A . 22 ASP CA 1 1 5 1431 1 1 5 ASP CB C 3.311 8.391 -6.542 1.00 . A A . 22 ASP CB 1 1 5 1432 1 1 5 ASP CG C 4.782 8.159 -6.825 1.00 . A A . 22 ASP CG 1 1 5 1433 1 1 5 ASP H H 3.528 6.229 -8.660 1.00 . A A . 22 ASP H 1 1 5 1434 1 1 5 ASP HA H 1.527 7.249 -6.843 1.00 . A A . 22 ASP HA 1 1 5 1435 1 1 5 ASP HB2 H 3.087 9.431 -6.731 1.00 . A A . 22 ASP HB2 1 1 5 1436 1 1 5 ASP HB3 H 3.123 8.170 -5.502 1.00 . A A . 22 ASP HB3 1 1 5 1437 1 1 5 ASP N N 3.092 6.287 -7.784 1.00 . A A . 22 ASP N 1 1 5 1438 1 1 5 ASP O O 2.655 8.291 -9.672 1.00 . A A . 22 ASP O 1 1 5 1439 1 1 5 ASP OD1 O 5.219 8.436 -7.962 1.00 . A A . 22 ASP OD1 1 1 5 1440 1 1 5 ASP OD2 O 5.496 7.702 -5.909 1.00 . A A . 22 ASP OD2 1 1 5 1441 1 1 6 LYS C C 0.325 8.929 -10.962 1.00 . A A . 23 LYS C 1 1 5 1442 1 1 6 LYS CA C 0.289 9.734 -9.667 1.00 . A A . 23 LYS CA 1 1 5 1443 1 1 6 LYS CB C 1.088 11.028 -9.836 1.00 . A A . 23 LYS CB 1 1 5 1444 1 1 6 LYS CD C 0.358 13.089 -8.600 1.00 . A A . 23 LYS CD 1 1 5 1445 1 1 6 LYS CE C 1.171 14.306 -9.015 1.00 . A A . 23 LYS CE 1 1 5 1446 1 1 6 LYS CG C 1.216 11.836 -8.556 1.00 . A A . 23 LYS CG 1 1 5 1447 1 1 6 LYS H H 0.316 8.918 -7.714 1.00 . A A . 23 LYS H 1 1 5 1448 1 1 6 LYS HA H -0.737 9.981 -9.439 1.00 . A A . 23 LYS HA 1 1 5 1449 1 1 6 LYS HB2 H 2.081 10.781 -10.182 1.00 . A A . 23 LYS HB2 1 1 5 1450 1 1 6 LYS HB3 H 0.600 11.644 -10.578 1.00 . A A . 23 LYS HB3 1 1 5 1451 1 1 6 LYS HD2 H -0.441 12.944 -9.311 1.00 . A A . 23 LYS HD2 1 1 5 1452 1 1 6 LYS HD3 H -0.059 13.264 -7.618 1.00 . A A . 23 LYS HD3 1 1 5 1453 1 1 6 LYS HE2 H 0.621 15.197 -8.751 1.00 . A A . 23 LYS HE2 1 1 5 1454 1 1 6 LYS HE3 H 2.111 14.293 -8.484 1.00 . A A . 23 LYS HE3 1 1 5 1455 1 1 6 LYS HG2 H 0.900 11.225 -7.723 1.00 . A A . 23 LYS HG2 1 1 5 1456 1 1 6 LYS HG3 H 2.250 12.122 -8.424 1.00 . A A . 23 LYS HG3 1 1 5 1457 1 1 6 LYS HZ1 H 0.739 13.736 -10.977 1.00 . A A . 23 LYS HZ1 1 1 5 1458 1 1 6 LYS HZ2 H 2.390 13.937 -10.671 1.00 . A A . 23 LYS HZ2 1 1 5 1459 1 1 6 LYS HZ3 H 1.391 15.292 -10.844 1.00 . A A . 23 LYS HZ3 1 1 5 1460 1 1 6 LYS N N 0.819 8.954 -8.555 1.00 . A A . 23 LYS N 1 1 5 1461 1 1 6 LYS NZ N 1.441 14.319 -10.479 1.00 . A A . 23 LYS NZ 1 1 5 1462 1 1 6 LYS O O 0.897 9.366 -11.960 1.00 . A A . 23 LYS O 1 1 5 1463 1 1 7 SER C C -1.078 5.591 -11.806 1.00 . A A . 24 SER C 1 1 5 1464 1 1 7 SER CA C -0.327 6.884 -12.110 1.00 . A A . 24 SER CA 1 1 5 1465 1 1 7 SER CB C 1.094 6.564 -12.578 1.00 . A A . 24 SER CB 1 1 5 1466 1 1 7 SER H H -0.729 7.457 -10.112 1.00 . A A . 24 SER H 1 1 5 1467 1 1 7 SER HA H -0.845 7.411 -12.897 1.00 . A A . 24 SER HA 1 1 5 1468 1 1 7 SER HB2 H 1.802 7.090 -11.956 1.00 . A A . 24 SER HB2 1 1 5 1469 1 1 7 SER HB3 H 1.266 5.500 -12.498 1.00 . A A . 24 SER HB3 1 1 5 1470 1 1 7 SER HG H 1.561 7.877 -13.954 1.00 . A A . 24 SER HG 1 1 5 1471 1 1 7 SER N N -0.291 7.751 -10.938 1.00 . A A . 24 SER N 1 1 5 1472 1 1 7 SER O O -1.718 5.010 -12.684 1.00 . A A . 24 SER O 1 1 5 1473 1 1 7 SER OG O 1.289 6.957 -13.925 1.00 . A A . 24 SER OG 1 1 5 1474 1 1 8 HIS C C -3.181 4.077 -10.217 1.00 . A A . 25 HIS C 1 1 5 1475 1 1 8 HIS CA C -1.666 3.921 -10.135 1.00 . A A . 25 HIS CA 1 1 5 1476 1 1 8 HIS CB C -1.256 3.554 -8.709 1.00 . A A . 25 HIS CB 1 1 5 1477 1 1 8 HIS CD2 C -2.306 1.828 -7.082 1.00 . A A . 25 HIS CD2 1 1 5 1478 1 1 8 HIS CE1 C -2.278 0.081 -8.406 1.00 . A A . 25 HIS CE1 1 1 5 1479 1 1 8 HIS CG C -1.770 2.221 -8.262 1.00 . A A . 25 HIS CG 1 1 5 1480 1 1 8 HIS H H -0.469 5.652 -9.903 1.00 . A A . 25 HIS H 1 1 5 1481 1 1 8 HIS HA H -1.361 3.129 -10.803 1.00 . A A . 25 HIS HA 1 1 5 1482 1 1 8 HIS HB2 H -0.178 3.531 -8.646 1.00 . A A . 25 HIS HB2 1 1 5 1483 1 1 8 HIS HB3 H -1.635 4.302 -8.028 1.00 . A A . 25 HIS HB3 1 1 5 1484 1 1 8 HIS HD1 H -1.438 1.064 -9.991 1.00 . A A . 25 HIS HD1 1 1 5 1485 1 1 8 HIS HD2 H -2.463 2.449 -6.211 1.00 . A A . 25 HIS HD2 1 1 5 1486 1 1 8 HIS HE1 H -2.401 -0.921 -8.787 1.00 . A A . 25 HIS HE1 1 1 5 1487 1 1 8 HIS N N -0.994 5.145 -10.557 1.00 . A A . 25 HIS N 1 1 5 1488 1 1 8 HIS ND1 N -1.766 1.103 -9.069 1.00 . A A . 25 HIS ND1 1 1 5 1489 1 1 8 HIS NE2 N -2.613 0.495 -7.198 1.00 . A A . 25 HIS NE2 1 1 5 1490 1 1 8 HIS O O -3.706 5.186 -10.124 1.00 . A A . 25 HIS O 1 1 5 1491 1 1 9 GLU C C -5.963 3.338 -9.148 1.00 . A A . 26 GLU C 1 1 5 1492 1 1 9 GLU CA C -5.333 2.972 -10.489 1.00 . A A . 26 GLU CA 1 1 5 1493 1 1 9 GLU CB C -5.849 1.609 -10.953 1.00 . A A . 26 GLU CB 1 1 5 1494 1 1 9 GLU CD C -6.351 -0.792 -10.347 1.00 . A A . 26 GLU CD 1 1 5 1495 1 1 9 GLU CG C -5.853 0.555 -9.858 1.00 . A A . 26 GLU CG 1 1 5 1496 1 1 9 GLU H H -3.403 2.104 -10.460 1.00 . A A . 26 GLU H 1 1 5 1497 1 1 9 GLU HA H -5.610 3.719 -11.218 1.00 . A A . 26 GLU HA 1 1 5 1498 1 1 9 GLU HB2 H -6.859 1.724 -11.317 1.00 . A A . 26 GLU HB2 1 1 5 1499 1 1 9 GLU HB3 H -5.223 1.257 -11.760 1.00 . A A . 26 GLU HB3 1 1 5 1500 1 1 9 GLU HG2 H -4.846 0.436 -9.487 1.00 . A A . 26 GLU HG2 1 1 5 1501 1 1 9 GLU HG3 H -6.494 0.890 -9.056 1.00 . A A . 26 GLU HG3 1 1 5 1502 1 1 9 GLU N N -3.878 2.958 -10.393 1.00 . A A . 26 GLU N 1 1 5 1503 1 1 9 GLU O O -7.019 3.970 -9.097 1.00 . A A . 26 GLU O 1 1 5 1504 1 1 9 GLU OE1 O -7.241 -0.814 -11.222 1.00 . A A . 26 GLU OE1 1 1 5 1505 1 1 9 GLU OE2 O -5.849 -1.823 -9.853 1.00 . A A . 26 GLU OE2 1 1 5 1506 1 1 10 LYS C C -5.163 4.486 -6.164 1.00 . A A . 27 LYS C 1 1 5 1507 1 1 10 LYS CA C -5.803 3.219 -6.722 1.00 . A A . 27 LYS CA 1 1 5 1508 1 1 10 LYS CB C -5.517 2.039 -5.791 1.00 . A A . 27 LYS CB 1 1 5 1509 1 1 10 LYS CD C -5.983 -0.356 -5.192 1.00 . A A . 27 LYS CD 1 1 5 1510 1 1 10 LYS CE C -4.732 -1.148 -5.537 1.00 . A A . 27 LYS CE 1 1 5 1511 1 1 10 LYS CG C -6.231 0.760 -6.194 1.00 . A A . 27 LYS CG 1 1 5 1512 1 1 10 LYS H H -4.472 2.434 -8.170 1.00 . A A . 27 LYS H 1 1 5 1513 1 1 10 LYS HA H -6.870 3.366 -6.786 1.00 . A A . 27 LYS HA 1 1 5 1514 1 1 10 LYS HB2 H -4.454 1.847 -5.787 1.00 . A A . 27 LYS HB2 1 1 5 1515 1 1 10 LYS HB3 H -5.830 2.301 -4.791 1.00 . A A . 27 LYS HB3 1 1 5 1516 1 1 10 LYS HD2 H -5.864 0.074 -4.209 1.00 . A A . 27 LYS HD2 1 1 5 1517 1 1 10 LYS HD3 H -6.833 -1.024 -5.193 1.00 . A A . 27 LYS HD3 1 1 5 1518 1 1 10 LYS HE2 H -4.538 -1.047 -6.594 1.00 . A A . 27 LYS HE2 1 1 5 1519 1 1 10 LYS HE3 H -3.900 -0.743 -4.979 1.00 . A A . 27 LYS HE3 1 1 5 1520 1 1 10 LYS HG2 H -7.292 0.952 -6.247 1.00 . A A . 27 LYS HG2 1 1 5 1521 1 1 10 LYS HG3 H -5.870 0.447 -7.163 1.00 . A A . 27 LYS HG3 1 1 5 1522 1 1 10 LYS HZ1 H -5.115 -3.132 -6.065 1.00 . A A . 27 LYS HZ1 1 1 5 1523 1 1 10 LYS HZ2 H -5.640 -2.723 -4.510 1.00 . A A . 27 LYS HZ2 1 1 5 1524 1 1 10 LYS HZ3 H -3.993 -2.961 -4.811 1.00 . A A . 27 LYS HZ3 1 1 5 1525 1 1 10 LYS N N -5.309 2.935 -8.064 1.00 . A A . 27 LYS N 1 1 5 1526 1 1 10 LYS NZ N -4.880 -2.592 -5.207 1.00 . A A . 27 LYS NZ 1 1 5 1527 1 1 10 LYS O O -5.525 4.952 -5.084 1.00 . A A . 27 LYS O 1 1 5 1528 1 1 11 TYR C C -4.515 7.382 -6.224 1.00 . A A . 28 TYR C 1 1 5 1529 1 1 11 TYR CA C -3.522 6.254 -6.487 1.00 . A A . 28 TYR CA 1 1 5 1530 1 1 11 TYR CB C -2.512 6.687 -7.551 1.00 . A A . 28 TYR CB 1 1 5 1531 1 1 11 TYR CD1 C -2.367 9.200 -7.353 1.00 . A A . 28 TYR CD1 1 1 5 1532 1 1 11 TYR CD2 C -3.366 8.282 -9.313 1.00 . A A . 28 TYR CD2 1 1 5 1533 1 1 11 TYR CE1 C -2.585 10.477 -7.834 1.00 . A A . 28 TYR CE1 1 1 5 1534 1 1 11 TYR CE2 C -3.587 9.555 -9.802 1.00 . A A . 28 TYR CE2 1 1 5 1535 1 1 11 TYR CG C -2.753 8.082 -8.082 1.00 . A A . 28 TYR CG 1 1 5 1536 1 1 11 TYR CZ C -3.195 10.649 -9.059 1.00 . A A . 28 TYR CZ 1 1 5 1537 1 1 11 TYR H H -3.967 4.623 -7.760 1.00 . A A . 28 TYR H 1 1 5 1538 1 1 11 TYR HA H -2.994 6.034 -5.571 1.00 . A A . 28 TYR HA 1 1 5 1539 1 1 11 TYR HB2 H -1.520 6.660 -7.128 1.00 . A A . 28 TYR HB2 1 1 5 1540 1 1 11 TYR HB3 H -2.562 6.001 -8.384 1.00 . A A . 28 TYR HB3 1 1 5 1541 1 1 11 TYR HD1 H -1.890 9.062 -6.394 1.00 . A A . 28 TYR HD1 1 1 5 1542 1 1 11 TYR HD2 H -3.672 7.423 -9.892 1.00 . A A . 28 TYR HD2 1 1 5 1543 1 1 11 TYR HE1 H -2.278 11.334 -7.253 1.00 . A A . 28 TYR HE1 1 1 5 1544 1 1 11 TYR HE2 H -4.065 9.690 -10.761 1.00 . A A . 28 TYR HE2 1 1 5 1545 1 1 11 TYR HH H -4.207 12.281 -9.140 1.00 . A A . 28 TYR HH 1 1 5 1546 1 1 11 TYR N N -4.213 5.041 -6.908 1.00 . A A . 28 TYR N 1 1 5 1547 1 1 11 TYR O O -5.544 7.487 -6.891 1.00 . A A . 28 TYR O 1 1 5 1548 1 1 11 TYR OH O -3.414 11.918 -9.542 1.00 . A A . 28 TYR OH 1 1 5 1549 1 1 12 ASP C C -4.267 10.648 -4.851 1.00 . A A . 29 ASP C 1 1 5 1550 1 1 12 ASP CA C -5.060 9.346 -4.894 1.00 . A A . 29 ASP CA 1 1 5 1551 1 1 12 ASP CB C -5.730 9.098 -3.542 1.00 . A A . 29 ASP CB 1 1 5 1552 1 1 12 ASP CG C -7.060 8.383 -3.677 1.00 . A A . 29 ASP CG 1 1 5 1553 1 1 12 ASP H H -3.364 8.088 -4.750 1.00 . A A . 29 ASP H 1 1 5 1554 1 1 12 ASP HA H -5.823 9.429 -5.653 1.00 . A A . 29 ASP HA 1 1 5 1555 1 1 12 ASP HB2 H -5.077 8.492 -2.930 1.00 . A A . 29 ASP HB2 1 1 5 1556 1 1 12 ASP HB3 H -5.899 10.045 -3.052 1.00 . A A . 29 ASP HB3 1 1 5 1557 1 1 12 ASP N N -4.198 8.224 -5.246 1.00 . A A . 29 ASP N 1 1 5 1558 1 1 12 ASP O O -3.198 10.716 -4.244 1.00 . A A . 29 ASP O 1 1 5 1559 1 1 12 ASP OD1 O -8.047 9.035 -4.077 1.00 . A A . 29 ASP OD1 1 1 5 1560 1 1 12 ASP OD2 O -7.113 7.170 -3.383 1.00 . A A . 29 ASP OD2 1 1 5 1561 1 1 13 TRP C C -3.912 13.516 -4.128 1.00 . A A . 30 TRP C 1 1 5 1562 1 1 13 TRP CA C -4.136 12.979 -5.537 1.00 . A A . 30 TRP CA 1 1 5 1563 1 1 13 TRP CB C -4.969 13.974 -6.348 1.00 . A A . 30 TRP CB 1 1 5 1564 1 1 13 TRP CD1 C -4.084 15.072 -8.488 1.00 . A A . 30 TRP CD1 1 1 5 1565 1 1 13 TRP CD2 C -3.239 15.926 -6.598 1.00 . A A . 30 TRP CD2 1 1 5 1566 1 1 13 TRP CE2 C -2.676 16.612 -7.692 1.00 . A A . 30 TRP CE2 1 1 5 1567 1 1 13 TRP CE3 C -2.858 16.293 -5.305 1.00 . A A . 30 TRP CE3 1 1 5 1568 1 1 13 TRP CG C -4.137 14.946 -7.129 1.00 . A A . 30 TRP CG 1 1 5 1569 1 1 13 TRP CH2 C -1.397 17.979 -6.253 1.00 . A A . 30 TRP CH2 1 1 5 1570 1 1 13 TRP CZ2 C -1.752 17.641 -7.530 1.00 . A A . 30 TRP CZ2 1 1 5 1571 1 1 13 TRP CZ3 C -1.940 17.314 -5.146 1.00 . A A . 30 TRP CZ3 1 1 5 1572 1 1 13 TRP H H -5.651 11.564 -5.966 1.00 . A A . 30 TRP H 1 1 5 1573 1 1 13 TRP HA H -3.178 12.850 -6.017 1.00 . A A . 30 TRP HA 1 1 5 1574 1 1 13 TRP HB2 H -5.589 13.431 -7.045 1.00 . A A . 30 TRP HB2 1 1 5 1575 1 1 13 TRP HB3 H -5.598 14.538 -5.675 1.00 . A A . 30 TRP HB3 1 1 5 1576 1 1 13 TRP HD1 H -4.652 14.466 -9.178 1.00 . A A . 30 TRP HD1 1 1 5 1577 1 1 13 TRP HE1 H -2.997 16.352 -9.749 1.00 . A A . 30 TRP HE1 1 1 5 1578 1 1 13 TRP HE3 H -3.266 15.793 -4.439 1.00 . A A . 30 TRP HE3 1 1 5 1579 1 1 13 TRP HH2 H -0.683 18.770 -6.082 1.00 . A A . 30 TRP HH2 1 1 5 1580 1 1 13 TRP HZ2 H -1.325 18.163 -8.374 1.00 . A A . 30 TRP HZ2 1 1 5 1581 1 1 13 TRP HZ3 H -1.633 17.611 -4.154 1.00 . A A . 30 TRP HZ3 1 1 5 1582 1 1 13 TRP N N -4.796 11.679 -5.500 1.00 . A A . 30 TRP N 1 1 5 1583 1 1 13 TRP NE1 N -3.207 16.071 -8.834 1.00 . A A . 30 TRP NE1 1 1 5 1584 1 1 13 TRP O O -2.773 13.667 -3.686 1.00 . A A . 30 TRP O 1 1 5 1585 1 1 14 GLU C C -4.436 13.247 -1.101 1.00 . A A . 31 GLU C 1 1 5 1586 1 1 14 GLU CA C -4.925 14.322 -2.067 1.00 . A A . 31 GLU CA 1 1 5 1587 1 1 14 GLU CB C -6.290 14.845 -1.616 1.00 . A A . 31 GLU CB 1 1 5 1588 1 1 14 GLU CD C -7.639 16.951 -1.257 1.00 . A A . 31 GLU CD 1 1 5 1589 1 1 14 GLU CG C -6.596 16.251 -2.106 1.00 . A A . 31 GLU CG 1 1 5 1590 1 1 14 GLU H H -5.885 13.660 -3.833 1.00 . A A . 31 GLU H 1 1 5 1591 1 1 14 GLU HA H -4.219 15.139 -2.065 1.00 . A A . 31 GLU HA 1 1 5 1592 1 1 14 GLU HB2 H -7.057 14.182 -1.988 1.00 . A A . 31 GLU HB2 1 1 5 1593 1 1 14 GLU HB3 H -6.322 14.849 -0.537 1.00 . A A . 31 GLU HB3 1 1 5 1594 1 1 14 GLU HG2 H -5.686 16.832 -2.083 1.00 . A A . 31 GLU HG2 1 1 5 1595 1 1 14 GLU HG3 H -6.959 16.193 -3.122 1.00 . A A . 31 GLU HG3 1 1 5 1596 1 1 14 GLU N N -5.005 13.802 -3.427 1.00 . A A . 31 GLU N 1 1 5 1597 1 1 14 GLU O O -3.500 13.468 -0.331 1.00 . A A . 31 GLU O 1 1 5 1598 1 1 14 GLU OE1 O -8.056 16.373 -0.232 1.00 . A A . 31 GLU OE1 1 1 5 1599 1 1 14 GLU OE2 O -8.038 18.078 -1.618 1.00 . A A . 31 GLU OE2 1 1 5 1600 1 1 15 LEU C C -3.241 10.595 -0.465 1.00 . A A . 32 LEU C 1 1 5 1601 1 1 15 LEU CA C -4.707 10.973 -0.275 1.00 . A A . 32 LEU CA 1 1 5 1602 1 1 15 LEU CB C -5.598 9.762 -0.555 1.00 . A A . 32 LEU CB 1 1 5 1603 1 1 15 LEU CD1 C -7.013 10.057 1.493 1.00 . A A . 32 LEU CD1 1 1 5 1604 1 1 15 LEU CD2 C -7.055 7.887 0.250 1.00 . A A . 32 LEU CD2 1 1 5 1605 1 1 15 LEU CG C -6.197 9.072 0.671 1.00 . A A . 32 LEU CG 1 1 5 1606 1 1 15 LEU H H -5.813 11.968 -1.780 1.00 . A A . 32 LEU H 1 1 5 1607 1 1 15 LEU HA H -4.855 11.291 0.746 1.00 . A A . 32 LEU HA 1 1 5 1608 1 1 15 LEU HB2 H -6.414 10.090 -1.181 1.00 . A A . 32 LEU HB2 1 1 5 1609 1 1 15 LEU HB3 H -5.006 9.034 -1.090 1.00 . A A . 32 LEU HB3 1 1 5 1610 1 1 15 LEU HD11 H -7.113 10.984 0.949 1.00 . A A . 32 LEU HD11 1 1 5 1611 1 1 15 LEU HD12 H -6.512 10.244 2.432 1.00 . A A . 32 LEU HD12 1 1 5 1612 1 1 15 LEU HD13 H -7.992 9.643 1.684 1.00 . A A . 32 LEU HD13 1 1 5 1613 1 1 15 LEU HD21 H -6.582 7.376 -0.575 1.00 . A A . 32 LEU HD21 1 1 5 1614 1 1 15 LEU HD22 H -8.029 8.239 -0.056 1.00 . A A . 32 LEU HD22 1 1 5 1615 1 1 15 LEU HD23 H -7.162 7.207 1.082 1.00 . A A . 32 LEU HD23 1 1 5 1616 1 1 15 LEU HG H -5.395 8.701 1.295 1.00 . A A . 32 LEU HG 1 1 5 1617 1 1 15 LEU N N -5.075 12.084 -1.146 1.00 . A A . 32 LEU N 1 1 5 1618 1 1 15 LEU O O -2.651 9.920 0.377 1.00 . A A . 32 LEU O 1 1 5 1619 1 1 16 TRP C C -0.396 10.908 -0.631 1.00 . A A . 33 TRP C 1 1 5 1620 1 1 16 TRP CA C -1.264 10.747 -1.874 1.00 . A A . 33 TRP CA 1 1 5 1621 1 1 16 TRP CB C -0.757 11.667 -2.987 1.00 . A A . 33 TRP CB 1 1 5 1622 1 1 16 TRP CD1 C 1.479 10.942 -4.008 1.00 . A A . 33 TRP CD1 1 1 5 1623 1 1 16 TRP CD2 C 1.665 12.433 -2.347 1.00 . A A . 33 TRP CD2 1 1 5 1624 1 1 16 TRP CE2 C 2.956 12.120 -2.817 1.00 . A A . 33 TRP CE2 1 1 5 1625 1 1 16 TRP CE3 C 1.533 13.352 -1.303 1.00 . A A . 33 TRP CE3 1 1 5 1626 1 1 16 TRP CG C 0.735 11.669 -3.122 1.00 . A A . 33 TRP CG 1 1 5 1627 1 1 16 TRP CH2 C 3.945 13.591 -1.256 1.00 . A A . 33 TRP CH2 1 1 5 1628 1 1 16 TRP CZ2 C 4.104 12.694 -2.277 1.00 . A A . 33 TRP CZ2 1 1 5 1629 1 1 16 TRP CZ3 C 2.674 13.920 -0.768 1.00 . A A . 33 TRP CZ3 1 1 5 1630 1 1 16 TRP H H -3.185 11.572 -2.208 1.00 . A A . 33 TRP H 1 1 5 1631 1 1 16 TRP HA H -1.204 9.723 -2.211 1.00 . A A . 33 TRP HA 1 1 5 1632 1 1 16 TRP HB2 H -1.177 11.347 -3.929 1.00 . A A . 33 TRP HB2 1 1 5 1633 1 1 16 TRP HB3 H -1.075 12.678 -2.780 1.00 . A A . 33 TRP HB3 1 1 5 1634 1 1 16 TRP HD1 H 1.064 10.260 -4.734 1.00 . A A . 33 TRP HD1 1 1 5 1635 1 1 16 TRP HE1 H 3.548 10.810 -4.345 1.00 . A A . 33 TRP HE1 1 1 5 1636 1 1 16 TRP HE3 H 0.562 13.619 -0.913 1.00 . A A . 33 TRP HE3 1 1 5 1637 1 1 16 TRP HH2 H 4.808 14.059 -0.808 1.00 . A A . 33 TRP HH2 1 1 5 1638 1 1 16 TRP HZ2 H 5.091 12.450 -2.643 1.00 . A A . 33 TRP HZ2 1 1 5 1639 1 1 16 TRP HZ3 H 2.592 14.633 0.040 1.00 . A A . 33 TRP HZ3 1 1 5 1640 1 1 16 TRP N N -2.661 11.037 -1.575 1.00 . A A . 33 TRP N 1 1 5 1641 1 1 16 TRP NE1 N 2.815 11.208 -3.829 1.00 . A A . 33 TRP NE1 1 1 5 1642 1 1 16 TRP O O 0.569 10.168 -0.436 1.00 . A A . 33 TRP O 1 1 5 1643 1 1 17 ASP C C 0.307 10.831 2.166 1.00 . A A . 34 ASP C 1 1 5 1644 1 1 17 ASP CA C 0.002 12.133 1.434 1.00 . A A . 34 ASP CA 1 1 5 1645 1 1 17 ASP CB C -0.784 13.075 2.347 1.00 . A A . 34 ASP CB 1 1 5 1646 1 1 17 ASP CG C -0.226 13.113 3.757 1.00 . A A . 34 ASP CG 1 1 5 1647 1 1 17 ASP H H -1.524 12.434 -0.003 1.00 . A A . 34 ASP H 1 1 5 1648 1 1 17 ASP HA H 0.934 12.605 1.162 1.00 . A A . 34 ASP HA 1 1 5 1649 1 1 17 ASP HB2 H -0.748 14.075 1.939 1.00 . A A . 34 ASP HB2 1 1 5 1650 1 1 17 ASP HB3 H -1.811 12.746 2.395 1.00 . A A . 34 ASP HB3 1 1 5 1651 1 1 17 ASP N N -0.745 11.877 0.208 1.00 . A A . 34 ASP N 1 1 5 1652 1 1 17 ASP O O 1.399 10.650 2.705 1.00 . A A . 34 ASP O 1 1 5 1653 1 1 17 ASP OD1 O -0.505 12.174 4.530 1.00 . A A . 34 ASP OD1 1 1 5 1654 1 1 17 ASP OD2 O 0.489 14.083 4.086 1.00 . A A . 34 ASP OD2 1 1 5 1655 1 1 18 LYS C C -0.275 7.525 1.833 1.00 . A A . 35 LYS C 1 1 5 1656 1 1 18 LYS CA C -0.502 8.639 2.850 1.00 . A A . 35 LYS CA 1 1 5 1657 1 1 18 LYS CB C -1.734 8.323 3.702 1.00 . A A . 35 LYS CB 1 1 5 1658 1 1 18 LYS CD C -4.160 7.690 3.562 1.00 . A A . 35 LYS CD 1 1 5 1659 1 1 18 LYS CE C -4.004 6.228 3.174 1.00 . A A . 35 LYS CE 1 1 5 1660 1 1 18 LYS CG C -3.049 8.544 2.975 1.00 . A A . 35 LYS CG 1 1 5 1661 1 1 18 LYS H H -1.514 10.128 1.736 1.00 . A A . 35 LYS H 1 1 5 1662 1 1 18 LYS HA H 0.362 8.705 3.492 1.00 . A A . 35 LYS HA 1 1 5 1663 1 1 18 LYS HB2 H -1.686 7.290 4.012 1.00 . A A . 35 LYS HB2 1 1 5 1664 1 1 18 LYS HB3 H -1.721 8.954 4.579 1.00 . A A . 35 LYS HB3 1 1 5 1665 1 1 18 LYS HD2 H -4.133 7.769 4.639 1.00 . A A . 35 LYS HD2 1 1 5 1666 1 1 18 LYS HD3 H -5.111 8.051 3.197 1.00 . A A . 35 LYS HD3 1 1 5 1667 1 1 18 LYS HE2 H -4.755 5.982 2.439 1.00 . A A . 35 LYS HE2 1 1 5 1668 1 1 18 LYS HE3 H -3.022 6.085 2.747 1.00 . A A . 35 LYS HE3 1 1 5 1669 1 1 18 LYS HG2 H -3.327 9.584 3.060 1.00 . A A . 35 LYS HG2 1 1 5 1670 1 1 18 LYS HG3 H -2.922 8.286 1.933 1.00 . A A . 35 LYS HG3 1 1 5 1671 1 1 18 LYS HZ1 H -4.411 5.873 5.192 1.00 . A A . 35 LYS HZ1 1 1 5 1672 1 1 18 LYS HZ2 H -3.268 4.818 4.528 1.00 . A A . 35 LYS HZ2 1 1 5 1673 1 1 18 LYS HZ3 H -4.909 4.625 4.163 1.00 . A A . 35 LYS HZ3 1 1 5 1674 1 1 18 LYS N N -0.665 9.926 2.183 1.00 . A A . 35 LYS N 1 1 5 1675 1 1 18 LYS NZ N -4.159 5.322 4.346 1.00 . A A . 35 LYS NZ 1 1 5 1676 1 1 18 LYS O O 0.224 6.453 2.174 1.00 . A A . 35 LYS O 1 1 5 1677 1 1 19 TRP C C 0.879 6.960 -1.159 1.00 . A A . 36 TRP C 1 1 5 1678 1 1 19 TRP CA C -0.479 6.805 -0.482 1.00 . A A . 36 TRP CA 1 1 5 1679 1 1 19 TRP CB C -1.597 6.951 -1.516 1.00 . A A . 36 TRP CB 1 1 5 1680 1 1 19 TRP CD1 C -3.770 6.522 -0.227 1.00 . A A . 36 TRP CD1 1 1 5 1681 1 1 19 TRP CD2 C -3.272 4.949 -1.741 1.00 . A A . 36 TRP CD2 1 1 5 1682 1 1 19 TRP CE2 C -4.480 4.597 -1.107 1.00 . A A . 36 TRP CE2 1 1 5 1683 1 1 19 TRP CE3 C -2.762 4.108 -2.733 1.00 . A A . 36 TRP CE3 1 1 5 1684 1 1 19 TRP CG C -2.836 6.184 -1.163 1.00 . A A . 36 TRP CG 1 1 5 1685 1 1 19 TRP CH2 C -4.659 2.634 -2.409 1.00 . A A . 36 TRP CH2 1 1 5 1686 1 1 19 TRP CZ2 C -5.182 3.439 -1.434 1.00 . A A . 36 TRP CZ2 1 1 5 1687 1 1 19 TRP CZ3 C -3.459 2.959 -3.056 1.00 . A A . 36 TRP CZ3 1 1 5 1688 1 1 19 TRP H H -1.037 8.659 0.374 1.00 . A A . 36 TRP H 1 1 5 1689 1 1 19 TRP HA H -0.537 5.822 -0.039 1.00 . A A . 36 TRP HA 1 1 5 1690 1 1 19 TRP HB2 H -1.864 7.993 -1.603 1.00 . A A . 36 TRP HB2 1 1 5 1691 1 1 19 TRP HB3 H -1.243 6.593 -2.471 1.00 . A A . 36 TRP HB3 1 1 5 1692 1 1 19 TRP HD1 H -3.723 7.409 0.387 1.00 . A A . 36 TRP HD1 1 1 5 1693 1 1 19 TRP HE1 H -5.544 5.590 0.403 1.00 . A A . 36 TRP HE1 1 1 5 1694 1 1 19 TRP HE3 H -1.839 4.341 -3.243 1.00 . A A . 36 TRP HE3 1 1 5 1695 1 1 19 TRP HH2 H -5.170 1.727 -2.693 1.00 . A A . 36 TRP HH2 1 1 5 1696 1 1 19 TRP HZ2 H -6.108 3.175 -0.945 1.00 . A A . 36 TRP HZ2 1 1 5 1697 1 1 19 TRP HZ3 H -3.080 2.297 -3.820 1.00 . A A . 36 TRP HZ3 1 1 5 1698 1 1 19 TRP N N -0.644 7.786 0.584 1.00 . A A . 36 TRP N 1 1 5 1699 1 1 19 TRP NE1 N -4.762 5.572 -0.187 1.00 . A A . 36 TRP NE1 1 1 5 1700 1 1 19 TRP O O 1.125 6.382 -2.218 1.00 . A A . 36 TRP O 1 1 5 1701 1 1 20 CYS C C 3.013 8.699 -2.426 1.00 . A A . 37 CYS C 1 1 5 1702 1 1 20 CYS CA C 3.090 7.975 -1.085 1.00 . A A . 37 CYS CA 1 1 5 1703 1 1 20 CYS CB C 3.833 6.648 -1.251 1.00 . A A . 37 CYS CB 1 1 5 1704 1 1 20 CYS H H 1.502 8.178 0.300 1.00 . A A . 37 CYS H 1 1 5 1705 1 1 20 CYS HA H 3.630 8.595 -0.386 1.00 . A A . 37 CYS HA 1 1 5 1706 1 1 20 CYS HB2 H 3.417 6.114 -2.092 1.00 . A A . 37 CYS HB2 1 1 5 1707 1 1 20 CYS HB3 H 4.877 6.850 -1.440 1.00 . A A . 37 CYS HB3 1 1 5 1708 1 1 20 CYS N N 1.757 7.743 -0.542 1.00 . A A . 37 CYS N 1 1 5 1709 1 1 20 CYS O O 3.943 8.636 -3.230 1.00 . A A . 37 CYS O 1 1 5 1710 1 1 20 CYS SG S 3.734 5.553 0.202 1.00 . A A . 37 CYS SG 1 1 6 1711 1 1 1 ASN C C 2.366 2.180 -1.553 1.00 . A A . 18 ASN C 1 1 6 1712 1 1 1 ASN CA C 1.367 1.041 -1.736 1.00 . A A . 18 ASN CA 1 1 6 1713 1 1 1 ASN CB C 0.126 1.549 -2.472 1.00 . A A . 18 ASN CB 1 1 6 1714 1 1 1 ASN CG C -0.984 0.517 -2.514 1.00 . A A . 18 ASN CG 1 1 6 1715 1 1 1 ASN H1 H 1.269 -0.450 -0.236 1.00 . A A . 18 ASN H1 1 1 6 1716 1 1 1 ASN HA H 1.830 0.263 -2.324 1.00 . A A . 18 ASN HA 1 1 6 1717 1 1 1 ASN HB2 H -0.247 2.430 -1.970 1.00 . A A . 18 ASN HB2 1 1 6 1718 1 1 1 ASN HB3 H 0.394 1.804 -3.486 1.00 . A A . 18 ASN HB3 1 1 6 1719 1 1 1 ASN HD21 H 0.128 -0.669 -3.660 1.00 . A A . 18 ASN HD21 1 1 6 1720 1 1 1 ASN HD22 H -1.442 -1.268 -3.260 1.00 . A A . 18 ASN HD22 1 1 6 1721 1 1 1 ASN N N 0.992 0.466 -0.449 1.00 . A A . 18 ASN N 1 1 6 1722 1 1 1 ASN ND2 N -0.742 -0.585 -3.215 1.00 . A A . 18 ASN ND2 1 1 6 1723 1 1 1 ASN O O 2.035 3.226 -0.995 1.00 . A A . 18 ASN O 1 1 6 1724 1 1 1 ASN OD1 O -2.047 0.708 -1.923 1.00 . A A . 18 ASN OD1 1 1 6 1725 1 1 2 CYS C C 5.665 2.816 -3.034 1.00 . A A . 19 CYS C 1 1 6 1726 1 1 2 CYS CA C 4.636 2.977 -1.918 1.00 . A A . 19 CYS CA 1 1 6 1727 1 1 2 CYS CB C 5.326 2.880 -0.556 1.00 . A A . 19 CYS CB 1 1 6 1728 1 1 2 CYS H H 3.792 1.114 -2.464 1.00 . A A . 19 CYS H 1 1 6 1729 1 1 2 CYS HA H 4.174 3.948 -2.009 1.00 . A A . 19 CYS HA 1 1 6 1730 1 1 2 CYS HB2 H 4.776 2.190 0.069 1.00 . A A . 19 CYS HB2 1 1 6 1731 1 1 2 CYS HB3 H 6.330 2.508 -0.695 1.00 . A A . 19 CYS HB3 1 1 6 1732 1 1 2 CYS N N 3.589 1.969 -2.028 1.00 . A A . 19 CYS N 1 1 6 1733 1 1 2 CYS O O 6.798 3.285 -2.920 1.00 . A A . 19 CYS O 1 1 6 1734 1 1 2 CYS SG S 5.438 4.464 0.336 1.00 . A A . 19 CYS SG 1 1 6 1735 1 1 3 ASP C C 5.669 2.707 -6.469 1.00 . A A . 20 ASP C 1 1 6 1736 1 1 3 ASP CA C 6.148 1.928 -5.248 1.00 . A A . 20 ASP CA 1 1 6 1737 1 1 3 ASP CB C 6.227 0.437 -5.576 1.00 . A A . 20 ASP CB 1 1 6 1738 1 1 3 ASP CG C 7.441 -0.229 -4.960 1.00 . A A . 20 ASP CG 1 1 6 1739 1 1 3 ASP H H 4.347 1.800 -4.142 1.00 . A A . 20 ASP H 1 1 6 1740 1 1 3 ASP HA H 7.132 2.280 -4.975 1.00 . A A . 20 ASP HA 1 1 6 1741 1 1 3 ASP HB2 H 5.341 -0.055 -5.201 1.00 . A A . 20 ASP HB2 1 1 6 1742 1 1 3 ASP HB3 H 6.275 0.313 -6.648 1.00 . A A . 20 ASP HB3 1 1 6 1743 1 1 3 ASP N N 5.262 2.150 -4.110 1.00 . A A . 20 ASP N 1 1 6 1744 1 1 3 ASP O O 6.378 2.805 -7.471 1.00 . A A . 20 ASP O 1 1 6 1745 1 1 3 ASP OD1 O 7.520 -0.283 -3.715 1.00 . A A . 20 ASP OD1 1 1 6 1746 1 1 3 ASP OD2 O 8.314 -0.695 -5.723 1.00 . A A . 20 ASP OD2 1 1 6 1747 1 1 4 TRP C C 3.144 5.247 -6.955 1.00 . A A . 21 TRP C 1 1 6 1748 1 1 4 TRP CA C 3.890 4.025 -7.477 1.00 . A A . 21 TRP CA 1 1 6 1749 1 1 4 TRP CB C 2.946 3.149 -8.302 1.00 . A A . 21 TRP CB 1 1 6 1750 1 1 4 TRP CD1 C 1.111 2.758 -6.555 1.00 . A A . 21 TRP CD1 1 1 6 1751 1 1 4 TRP CD2 C 1.943 0.882 -7.452 1.00 . A A . 21 TRP CD2 1 1 6 1752 1 1 4 TRP CE2 C 0.952 0.531 -6.515 1.00 . A A . 21 TRP CE2 1 1 6 1753 1 1 4 TRP CE3 C 2.606 -0.135 -8.144 1.00 . A A . 21 TRP CE3 1 1 6 1754 1 1 4 TRP CG C 2.029 2.311 -7.462 1.00 . A A . 21 TRP CG 1 1 6 1755 1 1 4 TRP CH2 C 1.275 -1.769 -6.946 1.00 . A A . 21 TRP CH2 1 1 6 1756 1 1 4 TRP CZ2 C 0.610 -0.793 -6.254 1.00 . A A . 21 TRP CZ2 1 1 6 1757 1 1 4 TRP CZ3 C 2.266 -1.449 -7.884 1.00 . A A . 21 TRP CZ3 1 1 6 1758 1 1 4 TRP H H 3.947 3.143 -5.554 1.00 . A A . 21 TRP H 1 1 6 1759 1 1 4 TRP HA H 4.702 4.356 -8.109 1.00 . A A . 21 TRP HA 1 1 6 1760 1 1 4 TRP HB2 H 2.337 3.780 -8.932 1.00 . A A . 21 TRP HB2 1 1 6 1761 1 1 4 TRP HB3 H 3.531 2.485 -8.921 1.00 . A A . 21 TRP HB3 1 1 6 1762 1 1 4 TRP HD1 H 0.936 3.799 -6.330 1.00 . A A . 21 TRP HD1 1 1 6 1763 1 1 4 TRP HE1 H -0.243 1.756 -5.301 1.00 . A A . 21 TRP HE1 1 1 6 1764 1 1 4 TRP HE3 H 3.372 0.091 -8.871 1.00 . A A . 21 TRP HE3 1 1 6 1765 1 1 4 TRP HH2 H 1.042 -2.808 -6.774 1.00 . A A . 21 TRP HH2 1 1 6 1766 1 1 4 TRP HZ2 H -0.152 -1.056 -5.534 1.00 . A A . 21 TRP HZ2 1 1 6 1767 1 1 4 TRP HZ3 H 2.767 -2.249 -8.409 1.00 . A A . 21 TRP HZ3 1 1 6 1768 1 1 4 TRP N N 4.464 3.256 -6.379 1.00 . A A . 21 TRP N 1 1 6 1769 1 1 4 TRP NE1 N 0.460 1.693 -5.981 1.00 . A A . 21 TRP NE1 1 1 6 1770 1 1 4 TRP O O 2.621 5.238 -5.840 1.00 . A A . 21 TRP O 1 1 6 1771 1 1 5 ASP C C 1.978 8.313 -8.620 1.00 . A A . 22 ASP C 1 1 6 1772 1 1 5 ASP CA C 2.412 7.528 -7.386 1.00 . A A . 22 ASP CA 1 1 6 1773 1 1 5 ASP CB C 3.321 8.393 -6.511 1.00 . A A . 22 ASP CB 1 1 6 1774 1 1 5 ASP CG C 4.792 8.157 -6.793 1.00 . A A . 22 ASP CG 1 1 6 1775 1 1 5 ASP H H 3.533 6.245 -8.643 1.00 . A A . 22 ASP H 1 1 6 1776 1 1 5 ASP HA H 1.534 7.258 -6.819 1.00 . A A . 22 ASP HA 1 1 6 1777 1 1 5 ASP HB2 H 3.101 9.435 -6.694 1.00 . A A . 22 ASP HB2 1 1 6 1778 1 1 5 ASP HB3 H 3.131 8.166 -5.472 1.00 . A A . 22 ASP HB3 1 1 6 1779 1 1 5 ASP N N 3.097 6.298 -7.766 1.00 . A A . 22 ASP N 1 1 6 1780 1 1 5 ASP O O 2.666 8.316 -9.641 1.00 . A A . 22 ASP O 1 1 6 1781 1 1 5 ASP OD1 O 5.293 8.686 -7.807 1.00 . A A . 22 ASP OD1 1 1 6 1782 1 1 5 ASP OD2 O 5.441 7.443 -6.001 1.00 . A A . 22 ASP OD2 1 1 6 1783 1 1 6 LYS C C 0.337 8.968 -10.927 1.00 . A A . 23 LYS C 1 1 6 1784 1 1 6 LYS CA C 0.303 9.765 -9.627 1.00 . A A . 23 LYS CA 1 1 6 1785 1 1 6 LYS CB C 1.106 11.058 -9.787 1.00 . A A . 23 LYS CB 1 1 6 1786 1 1 6 LYS CD C 0.381 13.113 -8.538 1.00 . A A . 23 LYS CD 1 1 6 1787 1 1 6 LYS CE C 1.197 14.330 -8.944 1.00 . A A . 23 LYS CE 1 1 6 1788 1 1 6 LYS CG C 1.236 11.857 -8.502 1.00 . A A . 23 LYS CG 1 1 6 1789 1 1 6 LYS H H 0.327 8.935 -7.679 1.00 . A A . 23 LYS H 1 1 6 1790 1 1 6 LYS HA H -0.722 10.014 -9.398 1.00 . A A . 23 LYS HA 1 1 6 1791 1 1 6 LYS HB2 H 2.099 10.810 -10.134 1.00 . A A . 23 LYS HB2 1 1 6 1792 1 1 6 LYS HB3 H 0.621 11.679 -10.526 1.00 . A A . 23 LYS HB3 1 1 6 1793 1 1 6 LYS HD2 H -0.417 12.974 -9.251 1.00 . A A . 23 LYS HD2 1 1 6 1794 1 1 6 LYS HD3 H -0.036 13.282 -7.555 1.00 . A A . 23 LYS HD3 1 1 6 1795 1 1 6 LYS HE2 H 0.648 15.220 -8.679 1.00 . A A . 23 LYS HE2 1 1 6 1796 1 1 6 LYS HE3 H 2.135 14.314 -8.409 1.00 . A A . 23 LYS HE3 1 1 6 1797 1 1 6 LYS HG2 H 0.918 11.242 -7.673 1.00 . A A . 23 LYS HG2 1 1 6 1798 1 1 6 LYS HG3 H 2.270 12.139 -8.367 1.00 . A A . 23 LYS HG3 1 1 6 1799 1 1 6 LYS HZ1 H 0.631 14.670 -10.926 1.00 . A A . 23 LYS HZ1 1 1 6 1800 1 1 6 LYS HZ2 H 1.727 13.395 -10.736 1.00 . A A . 23 LYS HZ2 1 1 6 1801 1 1 6 LYS HZ3 H 2.262 14.995 -10.614 1.00 . A A . 23 LYS HZ3 1 1 6 1802 1 1 6 LYS N N 0.831 8.976 -8.520 1.00 . A A . 23 LYS N 1 1 6 1803 1 1 6 LYS NZ N 1.474 14.349 -10.408 1.00 . A A . 23 LYS NZ 1 1 6 1804 1 1 6 LYS O O 0.911 9.410 -11.922 1.00 . A A . 23 LYS O 1 1 6 1805 1 1 7 SER C C -1.074 5.640 -11.794 1.00 . A A . 24 SER C 1 1 6 1806 1 1 7 SER CA C -0.320 6.933 -12.089 1.00 . A A . 24 SER CA 1 1 6 1807 1 1 7 SER CB C 1.100 6.612 -12.559 1.00 . A A . 24 SER CB 1 1 6 1808 1 1 7 SER H H -0.721 7.494 -10.087 1.00 . A A . 24 SER H 1 1 6 1809 1 1 7 SER HA H -0.837 7.467 -12.872 1.00 . A A . 24 SER HA 1 1 6 1810 1 1 7 SER HB2 H 1.810 7.124 -11.927 1.00 . A A . 24 SER HB2 1 1 6 1811 1 1 7 SER HB3 H 1.265 5.546 -12.495 1.00 . A A . 24 SER HB3 1 1 6 1812 1 1 7 SER HG H 0.583 6.697 -14.446 1.00 . A A . 24 SER HG 1 1 6 1813 1 1 7 SER N N -0.282 7.792 -10.911 1.00 . A A . 24 SER N 1 1 6 1814 1 1 7 SER O O -1.717 5.067 -12.675 1.00 . A A . 24 SER O 1 1 6 1815 1 1 7 SER OG O 1.300 7.026 -13.899 1.00 . A A . 24 SER OG 1 1 6 1816 1 1 8 HIS C C -3.182 4.121 -10.216 1.00 . A A . 25 HIS C 1 1 6 1817 1 1 8 HIS CA C -1.667 3.960 -10.134 1.00 . A A . 25 HIS CA 1 1 6 1818 1 1 8 HIS CB C -1.259 3.583 -8.710 1.00 . A A . 25 HIS CB 1 1 6 1819 1 1 8 HIS CD2 C -2.314 1.849 -7.095 1.00 . A A . 25 HIS CD2 1 1 6 1820 1 1 8 HIS CE1 C -2.291 0.111 -8.431 1.00 . A A . 25 HIS CE1 1 1 6 1821 1 1 8 HIS CG C -1.777 2.248 -8.272 1.00 . A A . 25 HIS CG 1 1 6 1822 1 1 8 HIS H H -0.465 5.686 -9.890 1.00 . A A . 25 HIS H 1 1 6 1823 1 1 8 HIS HA H -1.365 3.172 -10.807 1.00 . A A . 25 HIS HA 1 1 6 1824 1 1 8 HIS HB2 H -0.181 3.557 -8.647 1.00 . A A . 25 HIS HB2 1 1 6 1825 1 1 8 HIS HB3 H -1.636 4.328 -8.025 1.00 . A A . 25 HIS HB3 1 1 6 1826 1 1 8 HIS HD1 H -1.447 1.102 -10.010 1.00 . A A . 25 HIS HD1 1 1 6 1827 1 1 8 HIS HD2 H -2.469 2.464 -6.220 1.00 . A A . 25 HIS HD2 1 1 6 1828 1 1 8 HIS HE1 H -2.417 -0.889 -8.818 1.00 . A A . 25 HIS HE1 1 1 6 1829 1 1 8 HIS N N -0.992 5.185 -10.547 1.00 . A A . 25 HIS N 1 1 6 1830 1 1 8 HIS ND1 N -1.775 1.135 -9.087 1.00 . A A . 25 HIS ND1 1 1 6 1831 1 1 8 HIS NE2 N -2.625 0.518 -7.220 1.00 . A A . 25 HIS NE2 1 1 6 1832 1 1 8 HIS O O -3.704 5.231 -10.115 1.00 . A A . 25 HIS O 1 1 6 1833 1 1 9 GLU C C -5.967 3.382 -9.152 1.00 . A A . 26 GLU C 1 1 6 1834 1 1 9 GLU CA C -5.337 3.025 -10.496 1.00 . A A . 26 GLU CA 1 1 6 1835 1 1 9 GLU CB C -5.857 1.665 -10.969 1.00 . A A . 26 GLU CB 1 1 6 1836 1 1 9 GLU CD C -6.376 -0.735 -10.376 1.00 . A A . 26 GLU CD 1 1 6 1837 1 1 9 GLU CG C -5.864 0.604 -9.881 1.00 . A A . 26 GLU CG 1 1 6 1838 1 1 9 GLU H H -3.409 2.151 -10.472 1.00 . A A . 26 GLU H 1 1 6 1839 1 1 9 GLU HA H -5.612 3.776 -11.220 1.00 . A A . 26 GLU HA 1 1 6 1840 1 1 9 GLU HB2 H -6.866 1.786 -11.333 1.00 . A A . 26 GLU HB2 1 1 6 1841 1 1 9 GLU HB3 H -5.232 1.317 -11.778 1.00 . A A . 26 GLU HB3 1 1 6 1842 1 1 9 GLU HG2 H -4.857 0.475 -9.516 1.00 . A A . 26 GLU HG2 1 1 6 1843 1 1 9 GLU HG3 H -6.499 0.939 -9.074 1.00 . A A . 26 GLU HG3 1 1 6 1844 1 1 9 GLU N N -3.882 3.006 -10.399 1.00 . A A . 26 GLU N 1 1 6 1845 1 1 9 GLU O O -7.020 4.017 -9.097 1.00 . A A . 26 GLU O 1 1 6 1846 1 1 9 GLU OE1 O -7.074 -0.756 -11.411 1.00 . A A . 26 GLU OE1 1 1 6 1847 1 1 9 GLU OE2 O -6.078 -1.760 -9.729 1.00 . A A . 26 GLU OE2 1 1 6 1848 1 1 10 LYS C C -5.164 4.509 -6.160 1.00 . A A . 27 LYS C 1 1 6 1849 1 1 10 LYS CA C -5.807 3.247 -6.727 1.00 . A A . 27 LYS CA 1 1 6 1850 1 1 10 LYS CB C -5.525 2.060 -5.804 1.00 . A A . 27 LYS CB 1 1 6 1851 1 1 10 LYS CD C -5.997 -0.338 -5.222 1.00 . A A . 27 LYS CD 1 1 6 1852 1 1 10 LYS CE C -4.746 -1.129 -5.573 1.00 . A A . 27 LYS CE 1 1 6 1853 1 1 10 LYS CG C -6.242 0.786 -6.215 1.00 . A A . 27 LYS CG 1 1 6 1854 1 1 10 LYS H H -4.478 2.469 -8.180 1.00 . A A . 27 LYS H 1 1 6 1855 1 1 10 LYS HA H -6.874 3.398 -6.790 1.00 . A A . 27 LYS HA 1 1 6 1856 1 1 10 LYS HB2 H -4.462 1.865 -5.801 1.00 . A A . 27 LYS HB2 1 1 6 1857 1 1 10 LYS HB3 H -5.837 2.316 -4.802 1.00 . A A . 27 LYS HB3 1 1 6 1858 1 1 10 LYS HD2 H -5.876 0.085 -4.236 1.00 . A A . 27 LYS HD2 1 1 6 1859 1 1 10 LYS HD3 H -6.848 -1.004 -5.229 1.00 . A A . 27 LYS HD3 1 1 6 1860 1 1 10 LYS HE2 H -4.639 -1.150 -6.646 1.00 . A A . 27 LYS HE2 1 1 6 1861 1 1 10 LYS HE3 H -3.890 -0.638 -5.135 1.00 . A A . 27 LYS HE3 1 1 6 1862 1 1 10 LYS HG2 H -7.303 0.981 -6.267 1.00 . A A . 27 LYS HG2 1 1 6 1863 1 1 10 LYS HG3 H -5.882 0.479 -7.188 1.00 . A A . 27 LYS HG3 1 1 6 1864 1 1 10 LYS HZ1 H -4.760 -3.198 -5.859 1.00 . A A . 27 LYS HZ1 1 1 6 1865 1 1 10 LYS HZ2 H -5.709 -2.681 -4.559 1.00 . A A . 27 LYS HZ2 1 1 6 1866 1 1 10 LYS HZ3 H -4.024 -2.711 -4.415 1.00 . A A . 27 LYS HZ3 1 1 6 1867 1 1 10 LYS N N -5.313 2.971 -8.071 1.00 . A A . 27 LYS N 1 1 6 1868 1 1 10 LYS NZ N -4.814 -2.528 -5.065 1.00 . A A . 27 LYS NZ 1 1 6 1869 1 1 10 LYS O O -5.525 4.968 -5.077 1.00 . A A . 27 LYS O 1 1 6 1870 1 1 11 TYR C C -4.507 7.403 -6.199 1.00 . A A . 28 TYR C 1 1 6 1871 1 1 11 TYR CA C -3.518 6.274 -6.471 1.00 . A A . 28 TYR CA 1 1 6 1872 1 1 11 TYR CB C -2.506 6.711 -7.532 1.00 . A A . 28 TYR CB 1 1 6 1873 1 1 11 TYR CD1 C -2.355 9.223 -7.317 1.00 . A A . 28 TYR CD1 1 1 6 1874 1 1 11 TYR CD2 C -3.354 8.320 -9.283 1.00 . A A . 28 TYR CD2 1 1 6 1875 1 1 11 TYR CE1 C -2.570 10.503 -7.789 1.00 . A A . 28 TYR CE1 1 1 6 1876 1 1 11 TYR CE2 C -3.572 9.597 -9.765 1.00 . A A . 28 TYR CE2 1 1 6 1877 1 1 11 TYR CG C -2.743 8.110 -8.053 1.00 . A A . 28 TYR CG 1 1 6 1878 1 1 11 TYR CZ C -3.178 10.685 -9.014 1.00 . A A . 28 TYR CZ 1 1 6 1879 1 1 11 TYR H H -3.967 4.653 -7.755 1.00 . A A . 28 TYR H 1 1 6 1880 1 1 11 TYR HA H -2.989 6.046 -5.556 1.00 . A A . 28 TYR HA 1 1 6 1881 1 1 11 TYR HB2 H -1.514 6.679 -7.108 1.00 . A A . 28 TYR HB2 1 1 6 1882 1 1 11 TYR HB3 H -2.557 6.031 -8.369 1.00 . A A . 28 TYR HB3 1 1 6 1883 1 1 11 TYR HD1 H -1.878 9.077 -6.358 1.00 . A A . 28 TYR HD1 1 1 6 1884 1 1 11 TYR HD2 H -3.661 7.466 -9.869 1.00 . A A . 28 TYR HD2 1 1 6 1885 1 1 11 TYR HE1 H -2.261 11.355 -7.202 1.00 . A A . 28 TYR HE1 1 1 6 1886 1 1 11 TYR HE2 H -4.049 9.740 -10.723 1.00 . A A . 28 TYR HE2 1 1 6 1887 1 1 11 TYR HH H -4.090 11.940 -10.149 1.00 . A A . 28 TYR HH 1 1 6 1888 1 1 11 TYR N N -4.211 5.065 -6.900 1.00 . A A . 28 TYR N 1 1 6 1889 1 1 11 TYR O O -5.536 7.515 -6.866 1.00 . A A . 28 TYR O 1 1 6 1890 1 1 11 TYR OH O -3.393 11.958 -9.489 1.00 . A A . 28 TYR OH 1 1 6 1891 1 1 12 ASP C C -4.250 10.659 -4.805 1.00 . A A . 29 ASP C 1 1 6 1892 1 1 12 ASP CA C -5.047 9.359 -4.857 1.00 . A A . 29 ASP CA 1 1 6 1893 1 1 12 ASP CB C -5.717 9.104 -3.506 1.00 . A A . 29 ASP CB 1 1 6 1894 1 1 12 ASP CG C -7.050 8.395 -3.645 1.00 . A A . 29 ASP CG 1 1 6 1895 1 1 12 ASP H H -3.353 8.095 -4.721 1.00 . A A . 29 ASP H 1 1 6 1896 1 1 12 ASP HA H -5.810 9.450 -5.615 1.00 . A A . 29 ASP HA 1 1 6 1897 1 1 12 ASP HB2 H -5.066 8.491 -2.899 1.00 . A A . 29 ASP HB2 1 1 6 1898 1 1 12 ASP HB3 H -5.881 10.048 -3.008 1.00 . A A . 29 ASP HB3 1 1 6 1899 1 1 12 ASP N N -4.188 8.237 -5.216 1.00 . A A . 29 ASP N 1 1 6 1900 1 1 12 ASP O O -3.180 10.719 -4.198 1.00 . A A . 29 ASP O 1 1 6 1901 1 1 12 ASP OD1 O -8.062 9.081 -3.897 1.00 . A A . 29 ASP OD1 1 1 6 1902 1 1 12 ASP OD2 O -7.080 7.155 -3.503 1.00 . A A . 29 ASP OD2 1 1 6 1903 1 1 13 TRP C C -3.887 13.521 -4.061 1.00 . A A . 30 TRP C 1 1 6 1904 1 1 13 TRP CA C -4.113 12.995 -5.474 1.00 . A A . 30 TRP CA 1 1 6 1905 1 1 13 TRP CB C -4.943 13.997 -6.278 1.00 . A A . 30 TRP CB 1 1 6 1906 1 1 13 TRP CD1 C -4.057 15.107 -8.411 1.00 . A A . 30 TRP CD1 1 1 6 1907 1 1 13 TRP CD2 C -3.209 15.946 -6.516 1.00 . A A . 30 TRP CD2 1 1 6 1908 1 1 13 TRP CE2 C -2.645 16.637 -7.606 1.00 . A A . 30 TRP CE2 1 1 6 1909 1 1 13 TRP CE3 C -2.825 16.303 -5.220 1.00 . A A . 30 TRP CE3 1 1 6 1910 1 1 13 TRP CG C -4.110 14.972 -7.053 1.00 . A A . 30 TRP CG 1 1 6 1911 1 1 13 TRP CH2 C -1.360 17.991 -6.158 1.00 . A A . 30 TRP CH2 1 1 6 1912 1 1 13 TRP CZ2 C -1.718 17.663 -7.437 1.00 . A A . 30 TRP CZ2 1 1 6 1913 1 1 13 TRP CZ3 C -1.905 17.320 -5.055 1.00 . A A . 30 TRP CZ3 1 1 6 1914 1 1 13 TRP H H -5.632 11.586 -5.912 1.00 . A A . 30 TRP H 1 1 6 1915 1 1 13 TRP HA H -3.155 12.866 -5.956 1.00 . A A . 30 TRP HA 1 1 6 1916 1 1 13 TRP HB2 H -5.566 13.460 -6.978 1.00 . A A . 30 TRP HB2 1 1 6 1917 1 1 13 TRP HB3 H -5.571 14.558 -5.601 1.00 . A A . 30 TRP HB3 1 1 6 1918 1 1 13 TRP HD1 H -4.627 14.508 -9.104 1.00 . A A . 30 TRP HD1 1 1 6 1919 1 1 13 TRP HE1 H -2.967 16.393 -9.664 1.00 . A A . 30 TRP HE1 1 1 6 1920 1 1 13 TRP HE3 H -3.234 15.798 -4.358 1.00 . A A . 30 TRP HE3 1 1 6 1921 1 1 13 TRP HH2 H -0.644 18.779 -5.981 1.00 . A A . 30 TRP HH2 1 1 6 1922 1 1 13 TRP HZ2 H -1.289 18.190 -8.277 1.00 . A A . 30 TRP HZ2 1 1 6 1923 1 1 13 TRP HZ3 H -1.596 17.610 -4.061 1.00 . A A . 30 TRP HZ3 1 1 6 1924 1 1 13 TRP N N -4.777 11.696 -5.446 1.00 . A A . 30 TRP N 1 1 6 1925 1 1 13 TRP NE1 N -3.177 16.106 -8.750 1.00 . A A . 30 TRP NE1 1 1 6 1926 1 1 13 TRP O O -2.747 13.666 -3.619 1.00 . A A . 30 TRP O 1 1 6 1927 1 1 14 GLU C C -4.410 13.232 -1.036 1.00 . A A . 31 GLU C 1 1 6 1928 1 1 14 GLU CA C -4.896 14.315 -1.994 1.00 . A A . 31 GLU CA 1 1 6 1929 1 1 14 GLU CB C -6.260 14.839 -1.539 1.00 . A A . 31 GLU CB 1 1 6 1930 1 1 14 GLU CD C -8.092 16.334 -2.427 1.00 . A A . 31 GLU CD 1 1 6 1931 1 1 14 GLU CG C -6.614 16.199 -2.118 1.00 . A A . 31 GLU CG 1 1 6 1932 1 1 14 GLU H H -5.859 13.668 -3.765 1.00 . A A . 31 GLU H 1 1 6 1933 1 1 14 GLU HA H -4.188 15.130 -1.987 1.00 . A A . 31 GLU HA 1 1 6 1934 1 1 14 GLU HB2 H -7.021 14.134 -1.838 1.00 . A A . 31 GLU HB2 1 1 6 1935 1 1 14 GLU HB3 H -6.260 14.919 -0.462 1.00 . A A . 31 GLU HB3 1 1 6 1936 1 1 14 GLU HG2 H -6.339 16.962 -1.405 1.00 . A A . 31 GLU HG2 1 1 6 1937 1 1 14 GLU HG3 H -6.056 16.343 -3.031 1.00 . A A . 31 GLU HG3 1 1 6 1938 1 1 14 GLU N N -4.978 13.805 -3.358 1.00 . A A . 31 GLU N 1 1 6 1939 1 1 14 GLU O O -3.473 13.445 -0.265 1.00 . A A . 31 GLU O 1 1 6 1940 1 1 14 GLU OE1 O -8.904 15.673 -1.746 1.00 . A A . 31 GLU OE1 1 1 6 1941 1 1 14 GLU OE2 O -8.437 17.102 -3.350 1.00 . A A . 31 GLU OE2 1 1 6 1942 1 1 15 LEU C C -3.222 10.573 -0.419 1.00 . A A . 32 LEU C 1 1 6 1943 1 1 15 LEU CA C -4.687 10.953 -0.226 1.00 . A A . 32 LEU CA 1 1 6 1944 1 1 15 LEU CB C -5.581 9.747 -0.514 1.00 . A A . 32 LEU CB 1 1 6 1945 1 1 15 LEU CD1 C -6.994 10.031 1.537 1.00 . A A . 32 LEU CD1 1 1 6 1946 1 1 15 LEU CD2 C -7.042 7.870 0.278 1.00 . A A . 32 LEU CD2 1 1 6 1947 1 1 15 LEU CG C -6.181 9.049 0.707 1.00 . A A . 32 LEU CG 1 1 6 1948 1 1 15 LEU H H -5.791 11.961 -1.724 1.00 . A A . 32 LEU H 1 1 6 1949 1 1 15 LEU HA H -4.833 11.264 0.798 1.00 . A A . 32 LEU HA 1 1 6 1950 1 1 15 LEU HB2 H -6.397 10.081 -1.137 1.00 . A A . 32 LEU HB2 1 1 6 1951 1 1 15 LEU HB3 H -4.992 9.020 -1.055 1.00 . A A . 32 LEU HB3 1 1 6 1952 1 1 15 LEU HD11 H -7.158 10.933 0.968 1.00 . A A . 32 LEU HD11 1 1 6 1953 1 1 15 LEU HD12 H -6.455 10.269 2.442 1.00 . A A . 32 LEU HD12 1 1 6 1954 1 1 15 LEU HD13 H -7.945 9.586 1.791 1.00 . A A . 32 LEU HD13 1 1 6 1955 1 1 15 LEU HD21 H -8.085 8.137 0.361 1.00 . A A . 32 LEU HD21 1 1 6 1956 1 1 15 LEU HD22 H -6.836 7.023 0.917 1.00 . A A . 32 LEU HD22 1 1 6 1957 1 1 15 LEU HD23 H -6.817 7.613 -0.746 1.00 . A A . 32 LEU HD23 1 1 6 1958 1 1 15 LEU HG H -5.380 8.671 1.328 1.00 . A A . 32 LEU HG 1 1 6 1959 1 1 15 LEU N N -5.053 12.071 -1.089 1.00 . A A . 32 LEU N 1 1 6 1960 1 1 15 LEU O O -2.633 9.889 0.418 1.00 . A A . 32 LEU O 1 1 6 1961 1 1 16 TRP C C -0.376 10.879 -0.584 1.00 . A A . 33 TRP C 1 1 6 1962 1 1 16 TRP CA C -1.245 10.729 -1.828 1.00 . A A . 33 TRP CA 1 1 6 1963 1 1 16 TRP CB C -0.736 11.654 -2.935 1.00 . A A . 33 TRP CB 1 1 6 1964 1 1 16 TRP CD1 C 1.497 10.931 -3.962 1.00 . A A . 33 TRP CD1 1 1 6 1965 1 1 16 TRP CD2 C 1.688 12.410 -2.291 1.00 . A A . 33 TRP CD2 1 1 6 1966 1 1 16 TRP CE2 C 2.978 12.097 -2.764 1.00 . A A . 33 TRP CE2 1 1 6 1967 1 1 16 TRP CE3 C 1.560 13.322 -1.240 1.00 . A A . 33 TRP CE3 1 1 6 1968 1 1 16 TRP CG C 0.756 11.654 -3.071 1.00 . A A . 33 TRP CG 1 1 6 1969 1 1 16 TRP CH2 C 3.972 13.554 -1.193 1.00 . A A . 33 TRP CH2 1 1 6 1970 1 1 16 TRP CZ2 C 4.128 12.664 -2.220 1.00 . A A . 33 TRP CZ2 1 1 6 1971 1 1 16 TRP CZ3 C 2.702 13.884 -0.702 1.00 . A A . 33 TRP CZ3 1 1 6 1972 1 1 16 TRP H H -3.164 11.561 -2.156 1.00 . A A . 33 TRP H 1 1 6 1973 1 1 16 TRP HA H -1.188 9.707 -2.172 1.00 . A A . 33 TRP HA 1 1 6 1974 1 1 16 TRP HB2 H -1.157 11.342 -3.879 1.00 . A A . 33 TRP HB2 1 1 6 1975 1 1 16 TRP HB3 H -1.052 12.666 -2.721 1.00 . A A . 33 TRP HB3 1 1 6 1976 1 1 16 TRP HD1 H 1.080 10.255 -4.693 1.00 . A A . 33 TRP HD1 1 1 6 1977 1 1 16 TRP HE1 H 3.566 10.796 -4.301 1.00 . A A . 33 TRP HE1 1 1 6 1978 1 1 16 TRP HE3 H 0.589 13.589 -0.849 1.00 . A A . 33 TRP HE3 1 1 6 1979 1 1 16 TRP HH2 H 4.836 14.017 -0.742 1.00 . A A . 33 TRP HH2 1 1 6 1980 1 1 16 TRP HZ2 H 5.114 12.420 -2.588 1.00 . A A . 33 TRP HZ2 1 1 6 1981 1 1 16 TRP HZ3 H 2.622 14.591 0.111 1.00 . A A . 33 TRP HZ3 1 1 6 1982 1 1 16 TRP N N -2.641 11.021 -1.526 1.00 . A A . 33 TRP N 1 1 6 1983 1 1 16 TRP NE1 N 2.834 11.192 -3.782 1.00 . A A . 33 TRP NE1 1 1 6 1984 1 1 16 TRP O O 0.587 10.135 -0.395 1.00 . A A . 33 TRP O 1 1 6 1985 1 1 17 ASP C C 0.328 10.781 2.212 1.00 . A A . 34 ASP C 1 1 6 1986 1 1 17 ASP CA C 0.026 12.089 1.488 1.00 . A A . 34 ASP CA 1 1 6 1987 1 1 17 ASP CB C -0.757 13.026 2.409 1.00 . A A . 34 ASP CB 1 1 6 1988 1 1 17 ASP CG C -0.476 14.488 2.122 1.00 . A A . 34 ASP CG 1 1 6 1989 1 1 17 ASP H H -1.500 12.403 0.055 1.00 . A A . 34 ASP H 1 1 6 1990 1 1 17 ASP HA H 0.959 12.561 1.219 1.00 . A A . 34 ASP HA 1 1 6 1991 1 1 17 ASP HB2 H -1.814 12.850 2.277 1.00 . A A . 34 ASP HB2 1 1 6 1992 1 1 17 ASP HB3 H -0.487 12.821 3.435 1.00 . A A . 34 ASP HB3 1 1 6 1993 1 1 17 ASP N N -0.722 11.843 0.261 1.00 . A A . 34 ASP N 1 1 6 1994 1 1 17 ASP O O 1.420 10.593 2.749 1.00 . A A . 34 ASP O 1 1 6 1995 1 1 17 ASP OD1 O 0.486 15.032 2.702 1.00 . A A . 34 ASP OD1 1 1 6 1996 1 1 17 ASP OD2 O -1.219 15.088 1.316 1.00 . A A . 34 ASP OD2 1 1 6 1997 1 1 18 LYS C C -0.262 7.478 1.855 1.00 . A A . 35 LYS C 1 1 6 1998 1 1 18 LYS CA C -0.486 8.586 2.880 1.00 . A A . 35 LYS CA 1 1 6 1999 1 1 18 LYS CB C -1.718 8.267 3.730 1.00 . A A . 35 LYS CB 1 1 6 2000 1 1 18 LYS CD C -4.147 7.643 3.589 1.00 . A A . 35 LYS CD 1 1 6 2001 1 1 18 LYS CE C -3.977 6.178 3.219 1.00 . A A . 35 LYS CE 1 1 6 2002 1 1 18 LYS CG C -3.033 8.497 3.006 1.00 . A A . 35 LYS CG 1 1 6 2003 1 1 18 LYS H H -1.495 10.085 1.777 1.00 . A A . 35 LYS H 1 1 6 2004 1 1 18 LYS HA H 0.379 8.646 3.522 1.00 . A A . 35 LYS HA 1 1 6 2005 1 1 18 LYS HB2 H -1.673 7.231 4.032 1.00 . A A . 35 LYS HB2 1 1 6 2006 1 1 18 LYS HB3 H -1.702 8.891 4.612 1.00 . A A . 35 LYS HB3 1 1 6 2007 1 1 18 LYS HD2 H -4.134 7.735 4.665 1.00 . A A . 35 LYS HD2 1 1 6 2008 1 1 18 LYS HD3 H -5.095 7.995 3.207 1.00 . A A . 35 LYS HD3 1 1 6 2009 1 1 18 LYS HE2 H -4.718 5.919 2.478 1.00 . A A . 35 LYS HE2 1 1 6 2010 1 1 18 LYS HE3 H -2.990 6.036 2.806 1.00 . A A . 35 LYS HE3 1 1 6 2011 1 1 18 LYS HG2 H -3.306 9.538 3.098 1.00 . A A . 35 LYS HG2 1 1 6 2012 1 1 18 LYS HG3 H -2.908 8.246 1.963 1.00 . A A . 35 LYS HG3 1 1 6 2013 1 1 18 LYS HZ1 H -4.829 5.695 5.065 1.00 . A A . 35 LYS HZ1 1 1 6 2014 1 1 18 LYS HZ2 H -3.230 5.170 4.889 1.00 . A A . 35 LYS HZ2 1 1 6 2015 1 1 18 LYS HZ3 H -4.481 4.351 4.098 1.00 . A A . 35 LYS HZ3 1 1 6 2016 1 1 18 LYS N N -0.646 9.878 2.223 1.00 . A A . 35 LYS N 1 1 6 2017 1 1 18 LYS NZ N -4.141 5.285 4.400 1.00 . A A . 35 LYS NZ 1 1 6 2018 1 1 18 LYS O O 0.237 6.403 2.189 1.00 . A A . 35 LYS O 1 1 6 2019 1 1 19 TRP C C 0.888 6.930 -1.141 1.00 . A A . 36 TRP C 1 1 6 2020 1 1 19 TRP CA C -0.470 6.774 -0.465 1.00 . A A . 36 TRP CA 1 1 6 2021 1 1 19 TRP CB C -1.588 6.931 -1.496 1.00 . A A . 36 TRP CB 1 1 6 2022 1 1 19 TRP CD1 C -3.762 6.499 -0.209 1.00 . A A . 36 TRP CD1 1 1 6 2023 1 1 19 TRP CD2 C -3.269 4.936 -1.735 1.00 . A A . 36 TRP CD2 1 1 6 2024 1 1 19 TRP CE2 C -4.478 4.582 -1.104 1.00 . A A . 36 TRP CE2 1 1 6 2025 1 1 19 TRP CE3 C -2.762 4.100 -2.734 1.00 . A A . 36 TRP CE3 1 1 6 2026 1 1 19 TRP CG C -2.829 6.165 -1.149 1.00 . A A . 36 TRP CG 1 1 6 2027 1 1 19 TRP CH2 C -4.663 2.630 -2.420 1.00 . A A . 36 TRP CH2 1 1 6 2028 1 1 19 TRP CZ2 C -5.183 3.429 -1.439 1.00 . A A . 36 TRP CZ2 1 1 6 2029 1 1 19 TRP CZ3 C -3.463 2.956 -3.065 1.00 . A A . 36 TRP CZ3 1 1 6 2030 1 1 19 TRP H H -1.024 8.624 0.405 1.00 . A A . 36 TRP H 1 1 6 2031 1 1 19 TRP HA H -0.531 5.788 -0.028 1.00 . A A . 36 TRP HA 1 1 6 2032 1 1 19 TRP HB2 H -1.852 7.975 -1.576 1.00 . A A . 36 TRP HB2 1 1 6 2033 1 1 19 TRP HB3 H -1.235 6.578 -2.455 1.00 . A A . 36 TRP HB3 1 1 6 2034 1 1 19 TRP HD1 H -3.711 7.381 0.411 1.00 . A A . 36 TRP HD1 1 1 6 2035 1 1 19 TRP HE1 H -5.538 5.568 0.414 1.00 . A A . 36 TRP HE1 1 1 6 2036 1 1 19 TRP HE3 H -1.839 4.335 -3.243 1.00 . A A . 36 TRP HE3 1 1 6 2037 1 1 19 TRP HH2 H -5.177 1.726 -2.711 1.00 . A A . 36 TRP HH2 1 1 6 2038 1 1 19 TRP HZ2 H -6.110 3.164 -0.951 1.00 . A A . 36 TRP HZ2 1 1 6 2039 1 1 19 TRP HZ3 H -3.086 2.298 -3.834 1.00 . A A . 36 TRP HZ3 1 1 6 2040 1 1 19 TRP N N -0.632 7.748 0.609 1.00 . A A . 36 TRP N 1 1 6 2041 1 1 19 TRP NE1 N -4.756 5.551 -0.176 1.00 . A A . 36 TRP NE1 1 1 6 2042 1 1 19 TRP O O 1.133 6.357 -2.202 1.00 . A A . 36 TRP O 1 1 6 2043 1 1 20 CYS C C 3.025 8.672 -2.398 1.00 . A A . 37 CYS C 1 1 6 2044 1 1 20 CYS CA C 3.101 7.941 -1.061 1.00 . A A . 37 CYS CA 1 1 6 2045 1 1 20 CYS CB C 3.842 6.613 -1.234 1.00 . A A . 37 CYS CB 1 1 6 2046 1 1 20 CYS H H 1.513 8.139 0.325 1.00 . A A . 37 CYS H 1 1 6 2047 1 1 20 CYS HA H 3.642 8.556 -0.359 1.00 . A A . 37 CYS HA 1 1 6 2048 1 1 20 CYS HB2 H 3.425 6.085 -2.079 1.00 . A A . 37 CYS HB2 1 1 6 2049 1 1 20 CYS HB3 H 4.886 6.814 -1.421 1.00 . A A . 37 CYS HB3 1 1 6 2050 1 1 20 CYS N N 1.767 7.709 -0.519 1.00 . A A . 37 CYS N 1 1 6 2051 1 1 20 CYS O O 3.996 8.704 -3.155 1.00 . A A . 37 CYS O 1 1 6 2052 1 1 20 CYS SG S 3.738 5.510 0.212 1.00 . A A . 37 CYS SG 1 1 7 2053 1 1 1 ASN C C 3.581 0.565 -1.869 1.00 . A A . 18 ASN C 1 1 7 2054 1 1 1 ASN CA C 2.397 -0.395 -1.951 1.00 . A A . 18 ASN CA 1 1 7 2055 1 1 1 ASN CB C 1.532 -0.054 -3.166 1.00 . A A . 18 ASN CB 1 1 7 2056 1 1 1 ASN CG C 0.052 -0.043 -2.837 1.00 . A A . 18 ASN CG 1 1 7 2057 1 1 1 ASN H1 H 2.005 0.007 0.090 1.00 . A A . 18 ASN H1 1 1 7 2058 1 1 1 ASN HA H 2.772 -1.402 -2.059 1.00 . A A . 18 ASN HA 1 1 7 2059 1 1 1 ASN HB2 H 1.807 0.925 -3.532 1.00 . A A . 18 ASN HB2 1 1 7 2060 1 1 1 ASN HB3 H 1.705 -0.785 -3.941 1.00 . A A . 18 ASN HB3 1 1 7 2061 1 1 1 ASN HD21 H -0.204 -1.753 -3.819 1.00 . A A . 18 ASN HD21 1 1 7 2062 1 1 1 ASN HD22 H -1.624 -1.079 -3.101 1.00 . A A . 18 ASN HD22 1 1 7 2063 1 1 1 ASN N N 1.600 -0.343 -0.731 1.00 . A A . 18 ASN N 1 1 7 2064 1 1 1 ASN ND2 N -0.664 -1.061 -3.299 1.00 . A A . 18 ASN ND2 1 1 7 2065 1 1 1 ASN O O 4.736 0.141 -1.827 1.00 . A A . 18 ASN O 1 1 7 2066 1 1 1 ASN OD1 O -0.442 0.870 -2.174 1.00 . A A . 18 ASN OD1 1 1 7 2067 1 1 2 CYS C C 5.381 2.662 -2.846 1.00 . A A . 19 CYS C 1 1 7 2068 1 1 2 CYS CA C 4.322 2.881 -1.770 1.00 . A A . 19 CYS CA 1 1 7 2069 1 1 2 CYS CB C 4.975 2.871 -0.386 1.00 . A A . 19 CYS CB 1 1 7 2070 1 1 2 CYS H H 2.344 2.136 -1.883 1.00 . A A . 19 CYS H 1 1 7 2071 1 1 2 CYS HA H 3.855 3.841 -1.931 1.00 . A A . 19 CYS HA 1 1 7 2072 1 1 2 CYS HB2 H 4.340 2.329 0.299 1.00 . A A . 19 CYS HB2 1 1 7 2073 1 1 2 CYS HB3 H 5.932 2.374 -0.452 1.00 . A A . 19 CYS HB3 1 1 7 2074 1 1 2 CYS N N 3.284 1.860 -1.847 1.00 . A A . 19 CYS N 1 1 7 2075 1 1 2 CYS O O 6.545 3.024 -2.669 1.00 . A A . 19 CYS O 1 1 7 2076 1 1 2 CYS SG S 5.257 4.528 0.315 1.00 . A A . 19 CYS SG 1 1 7 2077 1 1 3 ASP C C 5.445 2.548 -6.324 1.00 . A A . 20 ASP C 1 1 7 2078 1 1 3 ASP CA C 5.882 1.803 -5.067 1.00 . A A . 20 ASP CA 1 1 7 2079 1 1 3 ASP CB C 5.953 0.301 -5.348 1.00 . A A . 20 ASP CB 1 1 7 2080 1 1 3 ASP CG C 7.153 -0.355 -4.695 1.00 . A A . 20 ASP CG 1 1 7 2081 1 1 3 ASP H H 4.029 1.804 -4.043 1.00 . A A . 20 ASP H 1 1 7 2082 1 1 3 ASP HA H 6.862 2.152 -4.780 1.00 . A A . 20 ASP HA 1 1 7 2083 1 1 3 ASP HB2 H 5.058 -0.172 -4.970 1.00 . A A . 20 ASP HB2 1 1 7 2084 1 1 3 ASP HB3 H 6.014 0.144 -6.415 1.00 . A A . 20 ASP HB3 1 1 7 2085 1 1 3 ASP N N 4.970 2.069 -3.961 1.00 . A A . 20 ASP N 1 1 7 2086 1 1 3 ASP O O 6.044 2.396 -7.388 1.00 . A A . 20 ASP O 1 1 7 2087 1 1 3 ASP OD1 O 7.380 -0.112 -3.492 1.00 . A A . 20 ASP OD1 1 1 7 2088 1 1 3 ASP OD2 O 7.867 -1.110 -5.388 1.00 . A A . 20 ASP OD2 1 1 7 2089 1 1 4 TRP C C 3.105 5.343 -6.834 1.00 . A A . 21 TRP C 1 1 7 2090 1 1 4 TRP CA C 3.878 4.122 -7.319 1.00 . A A . 21 TRP CA 1 1 7 2091 1 1 4 TRP CB C 2.977 3.245 -8.190 1.00 . A A . 21 TRP CB 1 1 7 2092 1 1 4 TRP CD1 C 1.163 2.724 -6.456 1.00 . A A . 21 TRP CD1 1 1 7 2093 1 1 4 TRP CD2 C 2.010 0.917 -7.474 1.00 . A A . 21 TRP CD2 1 1 7 2094 1 1 4 TRP CE2 C 1.031 0.496 -6.552 1.00 . A A . 21 TRP CE2 1 1 7 2095 1 1 4 TRP CE3 C 2.679 -0.047 -8.233 1.00 . A A . 21 TRP CE3 1 1 7 2096 1 1 4 TRP CG C 2.078 2.345 -7.397 1.00 . A A . 21 TRP CG 1 1 7 2097 1 1 4 TRP CH2 C 1.379 -1.768 -7.127 1.00 . A A . 21 TRP CH2 1 1 7 2098 1 1 4 TRP CZ2 C 0.708 -0.846 -6.371 1.00 . A A . 21 TRP CZ2 1 1 7 2099 1 1 4 TRP CZ3 C 2.358 -1.378 -8.051 1.00 . A A . 21 TRP CZ3 1 1 7 2100 1 1 4 TRP H H 3.961 3.433 -5.318 1.00 . A A . 21 TRP H 1 1 7 2101 1 1 4 TRP HA H 4.720 4.454 -7.908 1.00 . A A . 21 TRP HA 1 1 7 2102 1 1 4 TRP HB2 H 2.356 3.878 -8.806 1.00 . A A . 21 TRP HB2 1 1 7 2103 1 1 4 TRP HB3 H 3.594 2.625 -8.824 1.00 . A A . 21 TRP HB3 1 1 7 2104 1 1 4 TRP HD1 H 0.976 3.746 -6.166 1.00 . A A . 21 TRP HD1 1 1 7 2105 1 1 4 TRP HE1 H -0.168 1.628 -5.256 1.00 . A A . 21 TRP HE1 1 1 7 2106 1 1 4 TRP HE3 H 3.436 0.234 -8.950 1.00 . A A . 21 TRP HE3 1 1 7 2107 1 1 4 TRP HH2 H 1.161 -2.819 -7.018 1.00 . A A . 21 TRP HH2 1 1 7 2108 1 1 4 TRP HZ2 H -0.044 -1.162 -5.663 1.00 . A A . 21 TRP HZ2 1 1 7 2109 1 1 4 TRP HZ3 H 2.865 -2.137 -8.629 1.00 . A A . 21 TRP HZ3 1 1 7 2110 1 1 4 TRP N N 4.397 3.353 -6.193 1.00 . A A . 21 TRP N 1 1 7 2111 1 1 4 TRP NE1 N 0.530 1.617 -5.944 1.00 . A A . 21 TRP NE1 1 1 7 2112 1 1 4 TRP O O 2.554 5.344 -5.733 1.00 . A A . 21 TRP O 1 1 7 2113 1 1 5 ASP C C 1.942 8.367 -8.575 1.00 . A A . 22 ASP C 1 1 7 2114 1 1 5 ASP CA C 2.359 7.609 -7.318 1.00 . A A . 22 ASP CA 1 1 7 2115 1 1 5 ASP CB C 3.237 8.499 -6.438 1.00 . A A . 22 ASP CB 1 1 7 2116 1 1 5 ASP CG C 4.716 8.293 -6.699 1.00 . A A . 22 ASP CG 1 1 7 2117 1 1 5 ASP H H 3.525 6.320 -8.527 1.00 . A A . 22 ASP H 1 1 7 2118 1 1 5 ASP HA H 1.472 7.337 -6.766 1.00 . A A . 22 ASP HA 1 1 7 2119 1 1 5 ASP HB2 H 2.998 9.535 -6.632 1.00 . A A . 22 ASP HB2 1 1 7 2120 1 1 5 ASP HB3 H 3.038 8.277 -5.400 1.00 . A A . 22 ASP HB3 1 1 7 2121 1 1 5 ASP N N 3.067 6.381 -7.662 1.00 . A A . 22 ASP N 1 1 7 2122 1 1 5 ASP O O 2.646 8.350 -9.585 1.00 . A A . 22 ASP O 1 1 7 2123 1 1 5 ASP OD1 O 5.316 7.412 -6.048 1.00 . A A . 22 ASP OD1 1 1 7 2124 1 1 5 ASP OD2 O 5.274 9.012 -7.554 1.00 . A A . 22 ASP OD2 1 1 7 2125 1 1 6 LYS C C 0.342 8.973 -10.921 1.00 . A A . 23 LYS C 1 1 7 2126 1 1 6 LYS CA C 0.281 9.794 -9.637 1.00 . A A . 23 LYS CA 1 1 7 2127 1 1 6 LYS CB C 1.080 11.088 -9.808 1.00 . A A . 23 LYS CB 1 1 7 2128 1 1 6 LYS CD C 0.326 13.163 -8.609 1.00 . A A . 23 LYS CD 1 1 7 2129 1 1 6 LYS CE C 1.149 14.380 -9.002 1.00 . A A . 23 LYS CE 1 1 7 2130 1 1 6 LYS CG C 1.185 11.911 -8.535 1.00 . A A . 23 LYS CG 1 1 7 2131 1 1 6 LYS H H 0.276 9.005 -7.672 1.00 . A A . 23 LYS H 1 1 7 2132 1 1 6 LYS HA H -0.749 10.042 -9.431 1.00 . A A . 23 LYS HA 1 1 7 2133 1 1 6 LYS HB2 H 2.079 10.840 -10.134 1.00 . A A . 23 LYS HB2 1 1 7 2134 1 1 6 LYS HB3 H 0.604 11.694 -10.565 1.00 . A A . 23 LYS HB3 1 1 7 2135 1 1 6 LYS HD2 H -0.450 13.014 -9.344 1.00 . A A . 23 LYS HD2 1 1 7 2136 1 1 6 LYS HD3 H -0.121 13.339 -7.641 1.00 . A A . 23 LYS HD3 1 1 7 2137 1 1 6 LYS HE2 H 0.559 15.268 -8.831 1.00 . A A . 23 LYS HE2 1 1 7 2138 1 1 6 LYS HE3 H 2.035 14.413 -8.387 1.00 . A A . 23 LYS HE3 1 1 7 2139 1 1 6 LYS HG2 H 0.855 11.310 -7.700 1.00 . A A . 23 LYS HG2 1 1 7 2140 1 1 6 LYS HG3 H 2.216 12.201 -8.388 1.00 . A A . 23 LYS HG3 1 1 7 2141 1 1 6 LYS HZ1 H 2.395 13.735 -10.549 1.00 . A A . 23 LYS HZ1 1 1 7 2142 1 1 6 LYS HZ2 H 1.778 15.294 -10.772 1.00 . A A . 23 LYS HZ2 1 1 7 2143 1 1 6 LYS HZ3 H 0.782 13.949 -11.013 1.00 . A A . 23 LYS HZ3 1 1 7 2144 1 1 6 LYS N N 0.793 9.030 -8.506 1.00 . A A . 23 LYS N 1 1 7 2145 1 1 6 LYS NZ N 1.554 14.337 -10.434 1.00 . A A . 23 LYS NZ 1 1 7 2146 1 1 6 LYS O O 0.924 9.404 -11.917 1.00 . A A . 23 LYS O 1 1 7 2147 1 1 7 SER C C -1.025 5.616 -11.745 1.00 . A A . 24 SER C 1 1 7 2148 1 1 7 SER CA C -0.275 6.908 -12.052 1.00 . A A . 24 SER CA 1 1 7 2149 1 1 7 SER CB C 1.156 6.589 -12.491 1.00 . A A . 24 SER CB 1 1 7 2150 1 1 7 SER H H -0.709 7.503 -10.067 1.00 . A A . 24 SER H 1 1 7 2151 1 1 7 SER HA H -0.782 7.423 -12.854 1.00 . A A . 24 SER HA 1 1 7 2152 1 1 7 SER HB2 H 1.850 7.133 -11.870 1.00 . A A . 24 SER HB2 1 1 7 2153 1 1 7 SER HB3 H 1.333 5.528 -12.386 1.00 . A A . 24 SER HB3 1 1 7 2154 1 1 7 SER HG H 0.592 6.731 -14.362 1.00 . A A . 24 SER HG 1 1 7 2155 1 1 7 SER N N -0.263 7.790 -10.891 1.00 . A A . 24 SER N 1 1 7 2156 1 1 7 SER O O -1.650 5.023 -12.624 1.00 . A A . 24 SER O 1 1 7 2157 1 1 7 SER OG O 1.368 6.956 -13.843 1.00 . A A . 24 SER OG 1 1 7 2158 1 1 8 HIS C C -3.145 4.110 -10.171 1.00 . A A . 25 HIS C 1 1 7 2159 1 1 8 HIS CA C -1.630 3.962 -10.064 1.00 . A A . 25 HIS CA 1 1 7 2160 1 1 8 HIS CB C -1.240 3.613 -8.627 1.00 . A A . 25 HIS CB 1 1 7 2161 1 1 8 HIS CD2 C -2.286 1.898 -6.987 1.00 . A A . 25 HIS CD2 1 1 7 2162 1 1 8 HIS CE1 C -2.278 0.147 -8.306 1.00 . A A . 25 HIS CE1 1 1 7 2163 1 1 8 HIS CG C -1.758 2.284 -8.172 1.00 . A A . 25 HIS CG 1 1 7 2164 1 1 8 HIS H H -0.443 5.700 -9.834 1.00 . A A . 25 HIS H 1 1 7 2165 1 1 8 HIS HA H -1.312 3.164 -10.717 1.00 . A A . 25 HIS HA 1 1 7 2166 1 1 8 HIS HB2 H -0.163 3.594 -8.548 1.00 . A A . 25 HIS HB2 1 1 7 2167 1 1 8 HIS HB3 H -1.632 4.369 -7.961 1.00 . A A . 25 HIS HB3 1 1 7 2168 1 1 8 HIS HD1 H -1.445 1.121 -9.900 1.00 . A A . 25 HIS HD1 1 1 7 2169 1 1 8 HIS HD2 H -2.433 2.522 -6.116 1.00 . A A . 25 HIS HD2 1 1 7 2170 1 1 8 HIS HE1 H -2.409 -0.857 -8.682 1.00 . A A . 25 HIS HE1 1 1 7 2171 1 1 8 HIS N N -0.957 5.184 -10.489 1.00 . A A . 25 HIS N 1 1 7 2172 1 1 8 HIS ND1 N -1.766 1.163 -8.976 1.00 . A A . 25 HIS ND1 1 1 7 2173 1 1 8 HIS NE2 N -2.601 0.566 -7.095 1.00 . A A . 25 HIS NE2 1 1 7 2174 1 1 8 HIS O O -3.677 5.216 -10.082 1.00 . A A . 25 HIS O 1 1 7 2175 1 1 9 GLU C C -5.940 3.366 -9.155 1.00 . A A . 26 GLU C 1 1 7 2176 1 1 9 GLU CA C -5.286 2.996 -10.483 1.00 . A A . 26 GLU CA 1 1 7 2177 1 1 9 GLU CB C -5.788 1.627 -10.948 1.00 . A A . 26 GLU CB 1 1 7 2178 1 1 9 GLU CD C -6.178 -0.799 -10.360 1.00 . A A . 26 GLU CD 1 1 7 2179 1 1 9 GLU CG C -5.800 0.578 -9.849 1.00 . A A . 26 GLU CG 1 1 7 2180 1 1 9 GLU H H -3.352 2.137 -10.425 1.00 . A A . 26 GLU H 1 1 7 2181 1 1 9 GLU HA H -5.554 3.736 -11.221 1.00 . A A . 26 GLU HA 1 1 7 2182 1 1 9 GLU HB2 H -6.794 1.735 -11.325 1.00 . A A . 26 GLU HB2 1 1 7 2183 1 1 9 GLU HB3 H -5.150 1.275 -11.745 1.00 . A A . 26 GLU HB3 1 1 7 2184 1 1 9 GLU HG2 H -4.815 0.524 -9.410 1.00 . A A . 26 GLU HG2 1 1 7 2185 1 1 9 GLU HG3 H -6.513 0.874 -9.094 1.00 . A A . 26 GLU HG3 1 1 7 2186 1 1 9 GLU N N -3.833 2.989 -10.363 1.00 . A A . 26 GLU N 1 1 7 2187 1 1 9 GLU O O -7.007 3.979 -9.125 1.00 . A A . 26 GLU O 1 1 7 2188 1 1 9 GLU OE1 O -5.409 -1.363 -11.166 1.00 . A A . 26 GLU OE1 1 1 7 2189 1 1 9 GLU OE2 O -7.242 -1.311 -9.955 1.00 . A A . 26 GLU OE2 1 1 7 2190 1 1 10 LYS C C -5.180 4.551 -6.165 1.00 . A A . 27 LYS C 1 1 7 2191 1 1 10 LYS CA C -5.809 3.280 -6.726 1.00 . A A . 27 LYS CA 1 1 7 2192 1 1 10 LYS CB C -5.538 2.105 -5.783 1.00 . A A . 27 LYS CB 1 1 7 2193 1 1 10 LYS CD C -6.026 -0.281 -5.167 1.00 . A A . 27 LYS CD 1 1 7 2194 1 1 10 LYS CE C -4.768 -1.070 -5.495 1.00 . A A . 27 LYS CE 1 1 7 2195 1 1 10 LYS CG C -6.265 0.830 -6.175 1.00 . A A . 27 LYS CG 1 1 7 2196 1 1 10 LYS H H -4.446 2.502 -8.147 1.00 . A A . 27 LYS H 1 1 7 2197 1 1 10 LYS HA H -6.875 3.426 -6.808 1.00 . A A . 27 LYS HA 1 1 7 2198 1 1 10 LYS HB2 H -4.477 1.903 -5.776 1.00 . A A . 27 LYS HB2 1 1 7 2199 1 1 10 LYS HB3 H -5.850 2.380 -4.786 1.00 . A A . 27 LYS HB3 1 1 7 2200 1 1 10 LYS HD2 H -5.917 0.154 -4.184 1.00 . A A . 27 LYS HD2 1 1 7 2201 1 1 10 LYS HD3 H -6.874 -0.951 -5.175 1.00 . A A . 27 LYS HD3 1 1 7 2202 1 1 10 LYS HE2 H -4.558 -0.965 -6.549 1.00 . A A . 27 LYS HE2 1 1 7 2203 1 1 10 LYS HE3 H -3.946 -0.667 -4.922 1.00 . A A . 27 LYS HE3 1 1 7 2204 1 1 10 LYS HG2 H -7.324 1.032 -6.228 1.00 . A A . 27 LYS HG2 1 1 7 2205 1 1 10 LYS HG3 H -5.909 0.508 -7.144 1.00 . A A . 27 LYS HG3 1 1 7 2206 1 1 10 LYS HZ1 H -5.501 -2.632 -4.318 1.00 . A A . 27 LYS HZ1 1 1 7 2207 1 1 10 LYS HZ2 H -3.989 -2.946 -5.006 1.00 . A A . 27 LYS HZ2 1 1 7 2208 1 1 10 LYS HZ3 H -5.383 -3.011 -5.962 1.00 . A A . 27 LYS HZ3 1 1 7 2209 1 1 10 LYS N N -5.293 2.988 -8.058 1.00 . A A . 27 LYS N 1 1 7 2210 1 1 10 LYS NZ N -4.921 -2.516 -5.173 1.00 . A A . 27 LYS NZ 1 1 7 2211 1 1 10 LYS O O -5.551 5.015 -5.087 1.00 . A A . 27 LYS O 1 1 7 2212 1 1 11 TYR C C -4.547 7.455 -6.236 1.00 . A A . 28 TYR C 1 1 7 2213 1 1 11 TYR CA C -3.547 6.328 -6.479 1.00 . A A . 28 TYR CA 1 1 7 2214 1 1 11 TYR CB C -2.523 6.758 -7.530 1.00 . A A . 28 TYR CB 1 1 7 2215 1 1 11 TYR CD1 C -2.409 9.274 -7.359 1.00 . A A . 28 TYR CD1 1 1 7 2216 1 1 11 TYR CD2 C -3.358 8.323 -9.328 1.00 . A A . 28 TYR CD2 1 1 7 2217 1 1 11 TYR CE1 C -2.631 10.543 -7.859 1.00 . A A . 28 TYR CE1 1 1 7 2218 1 1 11 TYR CE2 C -3.582 9.588 -9.836 1.00 . A A . 28 TYR CE2 1 1 7 2219 1 1 11 TYR CG C -2.767 8.144 -8.083 1.00 . A A . 28 TYR CG 1 1 7 2220 1 1 11 TYR CZ C -3.217 10.694 -9.098 1.00 . A A . 28 TYR CZ 1 1 7 2221 1 1 11 TYR H H -3.976 4.694 -7.754 1.00 . A A . 28 TYR H 1 1 7 2222 1 1 11 TYR HA H -3.032 6.114 -5.554 1.00 . A A . 28 TYR HA 1 1 7 2223 1 1 11 TYR HB2 H -1.538 6.746 -7.090 1.00 . A A . 28 TYR HB2 1 1 7 2224 1 1 11 TYR HB3 H -2.551 6.062 -8.356 1.00 . A A . 28 TYR HB3 1 1 7 2225 1 1 11 TYR HD1 H -1.950 9.153 -6.388 1.00 . A A . 28 TYR HD1 1 1 7 2226 1 1 11 TYR HD2 H -3.643 7.454 -9.903 1.00 . A A . 28 TYR HD2 1 1 7 2227 1 1 11 TYR HE1 H -2.345 11.410 -7.282 1.00 . A A . 28 TYR HE1 1 1 7 2228 1 1 11 TYR HE2 H -4.041 9.707 -10.807 1.00 . A A . 28 TYR HE2 1 1 7 2229 1 1 11 TYR HH H -4.168 11.927 -10.227 1.00 . A A . 28 TYR HH 1 1 7 2230 1 1 11 TYR N N -4.228 5.111 -6.904 1.00 . A A . 28 TYR N 1 1 7 2231 1 1 11 TYR O O -5.566 7.554 -6.921 1.00 . A A . 28 TYR O 1 1 7 2232 1 1 11 TYR OH O -3.440 11.956 -9.601 1.00 . A A . 28 TYR OH 1 1 7 2233 1 1 12 ASP C C -4.330 10.729 -4.883 1.00 . A A . 29 ASP C 1 1 7 2234 1 1 12 ASP CA C -5.118 9.423 -4.924 1.00 . A A . 29 ASP CA 1 1 7 2235 1 1 12 ASP CB C -5.801 9.183 -3.577 1.00 . A A . 29 ASP CB 1 1 7 2236 1 1 12 ASP CG C -7.137 8.481 -3.723 1.00 . A A . 29 ASP CG 1 1 7 2237 1 1 12 ASP H H -3.421 8.169 -4.747 1.00 . A A . 29 ASP H 1 1 7 2238 1 1 12 ASP HA H -5.873 9.497 -5.692 1.00 . A A . 29 ASP HA 1 1 7 2239 1 1 12 ASP HB2 H -5.160 8.571 -2.959 1.00 . A A . 29 ASP HB2 1 1 7 2240 1 1 12 ASP HB3 H -5.965 10.133 -3.089 1.00 . A A . 29 ASP HB3 1 1 7 2241 1 1 12 ASP N N -4.248 8.301 -5.257 1.00 . A A . 29 ASP N 1 1 7 2242 1 1 12 ASP O O -3.263 10.802 -4.272 1.00 . A A . 29 ASP O 1 1 7 2243 1 1 12 ASP OD1 O -7.853 8.767 -4.705 1.00 . A A . 29 ASP OD1 1 1 7 2244 1 1 12 ASP OD2 O -7.467 7.647 -2.854 1.00 . A A . 29 ASP OD2 1 1 7 2245 1 1 13 TRP C C -3.991 13.601 -4.167 1.00 . A A . 30 TRP C 1 1 7 2246 1 1 13 TRP CA C -4.207 13.058 -5.575 1.00 . A A . 30 TRP CA 1 1 7 2247 1 1 13 TRP CB C -5.039 14.046 -6.394 1.00 . A A . 30 TRP CB 1 1 7 2248 1 1 13 TRP CD1 C -4.153 15.135 -8.537 1.00 . A A . 30 TRP CD1 1 1 7 2249 1 1 13 TRP CD2 C -3.314 16.001 -6.650 1.00 . A A . 30 TRP CD2 1 1 7 2250 1 1 13 TRP CE2 C -2.750 16.682 -7.746 1.00 . A A . 30 TRP CE2 1 1 7 2251 1 1 13 TRP CE3 C -2.935 16.374 -5.358 1.00 . A A . 30 TRP CE3 1 1 7 2252 1 1 13 TRP CG C -4.209 15.016 -7.178 1.00 . A A . 30 TRP CG 1 1 7 2253 1 1 13 TRP CH2 C -1.476 18.059 -6.311 1.00 . A A . 30 TRP CH2 1 1 7 2254 1 1 13 TRP CZ2 C -1.828 17.713 -7.587 1.00 . A A . 30 TRP CZ2 1 1 7 2255 1 1 13 TRP CZ3 C -2.020 17.398 -5.201 1.00 . A A . 30 TRP CZ3 1 1 7 2256 1 1 13 TRP H H -5.715 11.635 -6.004 1.00 . A A . 30 TRP H 1 1 7 2257 1 1 13 TRP HA H -3.245 12.931 -6.050 1.00 . A A . 30 TRP HA 1 1 7 2258 1 1 13 TRP HB2 H -5.657 13.497 -7.089 1.00 . A A . 30 TRP HB2 1 1 7 2259 1 1 13 TRP HB3 H -5.672 14.612 -5.726 1.00 . A A . 30 TRP HB3 1 1 7 2260 1 1 13 TRP HD1 H -4.718 14.525 -9.225 1.00 . A A . 30 TRP HD1 1 1 7 2261 1 1 13 TRP HE1 H -3.066 16.412 -9.802 1.00 . A A . 30 TRP HE1 1 1 7 2262 1 1 13 TRP HE3 H -3.344 15.877 -4.490 1.00 . A A . 30 TRP HE3 1 1 7 2263 1 1 13 TRP HH2 H -0.764 18.852 -6.141 1.00 . A A . 30 TRP HH2 1 1 7 2264 1 1 13 TRP HZ2 H -1.400 18.233 -8.432 1.00 . A A . 30 TRP HZ2 1 1 7 2265 1 1 13 TRP HZ3 H -1.716 17.701 -4.210 1.00 . A A . 30 TRP HZ3 1 1 7 2266 1 1 13 TRP N N -4.861 11.755 -5.536 1.00 . A A . 30 TRP N 1 1 7 2267 1 1 13 TRP NE1 N -3.277 16.135 -8.886 1.00 . A A . 30 TRP NE1 1 1 7 2268 1 1 13 TRP O O -2.855 13.754 -3.719 1.00 . A A . 30 TRP O 1 1 7 2269 1 1 14 GLU C C -4.530 13.347 -1.142 1.00 . A A . 31 GLU C 1 1 7 2270 1 1 14 GLU CA C -5.017 14.417 -2.116 1.00 . A A . 31 GLU CA 1 1 7 2271 1 1 14 GLU CB C -6.386 14.938 -1.675 1.00 . A A . 31 GLU CB 1 1 7 2272 1 1 14 GLU CD C -6.653 17.392 -1.136 1.00 . A A . 31 GLU CD 1 1 7 2273 1 1 14 GLU CG C -6.711 16.323 -2.210 1.00 . A A . 31 GLU CG 1 1 7 2274 1 1 14 GLU H H -5.966 13.746 -3.885 1.00 . A A . 31 GLU H 1 1 7 2275 1 1 14 GLU HA H -4.313 15.235 -2.114 1.00 . A A . 31 GLU HA 1 1 7 2276 1 1 14 GLU HB2 H -7.147 14.254 -2.019 1.00 . A A . 31 GLU HB2 1 1 7 2277 1 1 14 GLU HB3 H -6.412 14.978 -0.596 1.00 . A A . 31 GLU HB3 1 1 7 2278 1 1 14 GLU HG2 H -6.000 16.572 -2.983 1.00 . A A . 31 GLU HG2 1 1 7 2279 1 1 14 GLU HG3 H -7.706 16.308 -2.629 1.00 . A A . 31 GLU HG3 1 1 7 2280 1 1 14 GLU N N -5.088 13.890 -3.474 1.00 . A A . 31 GLU N 1 1 7 2281 1 1 14 GLU O O -3.602 13.575 -0.365 1.00 . A A . 31 GLU O 1 1 7 2282 1 1 14 GLU OE1 O -5.541 17.684 -0.650 1.00 . A A . 31 GLU OE1 1 1 7 2283 1 1 14 GLU OE2 O -7.720 17.936 -0.781 1.00 . A A . 31 GLU OE2 1 1 7 2284 1 1 15 LEU C C -3.329 10.695 -0.499 1.00 . A A . 32 LEU C 1 1 7 2285 1 1 15 LEU CA C -4.795 11.074 -0.313 1.00 . A A . 32 LEU CA 1 1 7 2286 1 1 15 LEU CB C -5.686 9.861 -0.588 1.00 . A A . 32 LEU CB 1 1 7 2287 1 1 15 LEU CD1 C -7.102 10.165 1.458 1.00 . A A . 32 LEU CD1 1 1 7 2288 1 1 15 LEU CD2 C -7.142 7.989 0.224 1.00 . A A . 32 LEU CD2 1 1 7 2289 1 1 15 LEU CG C -6.285 9.176 0.640 1.00 . A A . 32 LEU CG 1 1 7 2290 1 1 15 LEU H H -5.894 12.058 -1.831 1.00 . A A . 32 LEU H 1 1 7 2291 1 1 15 LEU HA H -4.945 11.396 0.706 1.00 . A A . 32 LEU HA 1 1 7 2292 1 1 15 LEU HB2 H -6.501 10.186 -1.216 1.00 . A A . 32 LEU HB2 1 1 7 2293 1 1 15 LEU HB3 H -5.093 9.130 -1.120 1.00 . A A . 32 LEU HB3 1 1 7 2294 1 1 15 LEU HD11 H -8.037 9.709 1.744 1.00 . A A . 32 LEU HD11 1 1 7 2295 1 1 15 LEU HD12 H -7.297 11.047 0.866 1.00 . A A . 32 LEU HD12 1 1 7 2296 1 1 15 LEU HD13 H -6.549 10.441 2.344 1.00 . A A . 32 LEU HD13 1 1 7 2297 1 1 15 LEU HD21 H -7.159 7.261 1.021 1.00 . A A . 32 LEU HD21 1 1 7 2298 1 1 15 LEU HD22 H -6.726 7.539 -0.666 1.00 . A A . 32 LEU HD22 1 1 7 2299 1 1 15 LEU HD23 H -8.148 8.325 0.022 1.00 . A A . 32 LEU HD23 1 1 7 2300 1 1 15 LEU HG H -5.484 8.808 1.266 1.00 . A A . 32 LEU HG 1 1 7 2301 1 1 15 LEU N N -5.162 12.180 -1.191 1.00 . A A . 32 LEU N 1 1 7 2302 1 1 15 LEU O O -2.743 10.014 0.342 1.00 . A A . 32 LEU O 1 1 7 2303 1 1 16 TRP C C -0.483 11.005 -0.651 1.00 . A A . 33 TRP C 1 1 7 2304 1 1 16 TRP CA C -1.345 10.851 -1.899 1.00 . A A . 33 TRP CA 1 1 7 2305 1 1 16 TRP CB C -0.833 11.776 -3.005 1.00 . A A . 33 TRP CB 1 1 7 2306 1 1 16 TRP CD1 C 1.405 11.049 -4.019 1.00 . A A . 33 TRP CD1 1 1 7 2307 1 1 16 TRP CD2 C 1.588 12.537 -2.355 1.00 . A A . 33 TRP CD2 1 1 7 2308 1 1 16 TRP CE2 C 2.880 12.223 -2.821 1.00 . A A . 33 TRP CE2 1 1 7 2309 1 1 16 TRP CE3 C 1.454 13.455 -1.310 1.00 . A A . 33 TRP CE3 1 1 7 2310 1 1 16 TRP CG C 0.660 11.776 -3.135 1.00 . A A . 33 TRP CG 1 1 7 2311 1 1 16 TRP CH2 C 3.866 13.689 -1.254 1.00 . A A . 33 TRP CH2 1 1 7 2312 1 1 16 TRP CZ2 C 4.027 12.794 -2.276 1.00 . A A . 33 TRP CZ2 1 1 7 2313 1 1 16 TRP CZ3 C 2.593 14.020 -0.770 1.00 . A A . 33 TRP CZ3 1 1 7 2314 1 1 16 TRP H H -3.264 11.680 -2.237 1.00 . A A . 33 TRP H 1 1 7 2315 1 1 16 TRP HA H -1.285 9.829 -2.240 1.00 . A A . 33 TRP HA 1 1 7 2316 1 1 16 TRP HB2 H -1.250 11.461 -3.950 1.00 . A A . 33 TRP HB2 1 1 7 2317 1 1 16 TRP HB3 H -1.150 12.787 -2.794 1.00 . A A . 33 TRP HB3 1 1 7 2318 1 1 16 TRP HD1 H 0.992 10.369 -4.748 1.00 . A A . 33 TRP HD1 1 1 7 2319 1 1 16 TRP HE1 H 3.476 10.915 -4.349 1.00 . A A . 33 TRP HE1 1 1 7 2320 1 1 16 TRP HE3 H 0.481 13.723 -0.923 1.00 . A A . 33 TRP HE3 1 1 7 2321 1 1 16 TRP HH2 H 4.728 14.155 -0.802 1.00 . A A . 33 TRP HH2 1 1 7 2322 1 1 16 TRP HZ2 H 5.014 12.550 -2.638 1.00 . A A . 33 TRP HZ2 1 1 7 2323 1 1 16 TRP HZ3 H 2.509 14.731 0.039 1.00 . A A . 33 TRP HZ3 1 1 7 2324 1 1 16 TRP N N -2.744 11.142 -1.604 1.00 . A A . 33 TRP N 1 1 7 2325 1 1 16 TRP NE1 N 2.741 11.313 -3.835 1.00 . A A . 33 TRP NE1 1 1 7 2326 1 1 16 TRP O O 0.475 10.258 -0.452 1.00 . A A . 33 TRP O 1 1 7 2327 1 1 17 ASP C C 0.208 10.922 2.148 1.00 . A A . 34 ASP C 1 1 7 2328 1 1 17 ASP CA C -0.085 12.228 1.415 1.00 . A A . 34 ASP CA 1 1 7 2329 1 1 17 ASP CB C -0.870 13.173 2.327 1.00 . A A . 34 ASP CB 1 1 7 2330 1 1 17 ASP CG C 0.036 14.079 3.138 1.00 . A A . 34 ASP CG 1 1 7 2331 1 1 17 ASP H H -1.602 12.540 -0.029 1.00 . A A . 34 ASP H 1 1 7 2332 1 1 17 ASP HA H 0.851 12.694 1.148 1.00 . A A . 34 ASP HA 1 1 7 2333 1 1 17 ASP HB2 H -1.517 13.791 1.722 1.00 . A A . 34 ASP HB2 1 1 7 2334 1 1 17 ASP HB3 H -1.470 12.590 3.008 1.00 . A A . 34 ASP HB3 1 1 7 2335 1 1 17 ASP N N -0.828 11.977 0.186 1.00 . A A . 34 ASP N 1 1 7 2336 1 1 17 ASP O O 1.292 10.738 2.702 1.00 . A A . 34 ASP O 1 1 7 2337 1 1 17 ASP OD1 O 0.942 13.555 3.820 1.00 . A A . 34 ASP OD1 1 1 7 2338 1 1 17 ASP OD2 O -0.161 15.311 3.092 1.00 . A A . 34 ASP OD2 1 1 7 2339 1 1 18 LYS C C -0.376 7.617 1.796 1.00 . A A . 35 LYS C 1 1 7 2340 1 1 18 LYS CA C -0.613 8.729 2.813 1.00 . A A . 35 LYS CA 1 1 7 2341 1 1 18 LYS CB C -1.855 8.413 3.650 1.00 . A A . 35 LYS CB 1 1 7 2342 1 1 18 LYS CD C -4.121 7.335 3.541 1.00 . A A . 35 LYS CD 1 1 7 2343 1 1 18 LYS CE C -3.682 5.879 3.557 1.00 . A A . 35 LYS CE 1 1 7 2344 1 1 18 LYS CG C -3.112 8.214 2.821 1.00 . A A . 35 LYS CG 1 1 7 2345 1 1 18 LYS H H -1.608 10.223 1.690 1.00 . A A . 35 LYS H 1 1 7 2346 1 1 18 LYS HA H 0.244 8.792 3.466 1.00 . A A . 35 LYS HA 1 1 7 2347 1 1 18 LYS HB2 H -1.674 7.510 4.214 1.00 . A A . 35 LYS HB2 1 1 7 2348 1 1 18 LYS HB3 H -2.028 9.229 4.337 1.00 . A A . 35 LYS HB3 1 1 7 2349 1 1 18 LYS HD2 H -4.223 7.679 4.560 1.00 . A A . 35 LYS HD2 1 1 7 2350 1 1 18 LYS HD3 H -5.075 7.410 3.037 1.00 . A A . 35 LYS HD3 1 1 7 2351 1 1 18 LYS HE2 H -4.339 5.312 2.915 1.00 . A A . 35 LYS HE2 1 1 7 2352 1 1 18 LYS HE3 H -2.671 5.818 3.181 1.00 . A A . 35 LYS HE3 1 1 7 2353 1 1 18 LYS HG2 H -3.562 9.176 2.628 1.00 . A A . 35 LYS HG2 1 1 7 2354 1 1 18 LYS HG3 H -2.844 7.745 1.884 1.00 . A A . 35 LYS HG3 1 1 7 2355 1 1 18 LYS HZ1 H -3.478 4.291 4.898 1.00 . A A . 35 LYS HZ1 1 1 7 2356 1 1 18 LYS HZ2 H -4.681 5.400 5.328 1.00 . A A . 35 LYS HZ2 1 1 7 2357 1 1 18 LYS HZ3 H -3.050 5.795 5.546 1.00 . A A . 35 LYS HZ3 1 1 7 2358 1 1 18 LYS N N -0.766 10.018 2.149 1.00 . A A . 35 LYS N 1 1 7 2359 1 1 18 LYS NZ N -3.726 5.301 4.928 1.00 . A A . 35 LYS NZ 1 1 7 2360 1 1 18 LYS O O 0.139 6.552 2.135 1.00 . A A . 35 LYS O 1 1 7 2361 1 1 19 TRP C C 0.780 7.051 -1.186 1.00 . A A . 36 TRP C 1 1 7 2362 1 1 19 TRP CA C -0.582 6.894 -0.518 1.00 . A A . 36 TRP CA 1 1 7 2363 1 1 19 TRP CB C -1.693 7.040 -1.559 1.00 . A A . 36 TRP CB 1 1 7 2364 1 1 19 TRP CD1 C -3.908 6.667 -0.324 1.00 . A A . 36 TRP CD1 1 1 7 2365 1 1 19 TRP CD2 C -3.348 5.016 -1.730 1.00 . A A . 36 TRP CD2 1 1 7 2366 1 1 19 TRP CE2 C -4.575 4.690 -1.120 1.00 . A A . 36 TRP CE2 1 1 7 2367 1 1 19 TRP CE3 C -2.798 4.125 -2.655 1.00 . A A . 36 TRP CE3 1 1 7 2368 1 1 19 TRP CG C -2.939 6.285 -1.207 1.00 . A A . 36 TRP CG 1 1 7 2369 1 1 19 TRP CH2 C -4.697 2.657 -2.316 1.00 . A A . 36 TRP CH2 1 1 7 2370 1 1 19 TRP CZ2 C -5.258 3.511 -1.406 1.00 . A A . 36 TRP CZ2 1 1 7 2371 1 1 19 TRP CZ3 C -3.477 2.955 -2.937 1.00 . A A . 36 TRP CZ3 1 1 7 2372 1 1 19 TRP H H -1.160 8.741 0.340 1.00 . A A . 36 TRP H 1 1 7 2373 1 1 19 TRP HA H -0.642 5.910 -0.077 1.00 . A A . 36 TRP HA 1 1 7 2374 1 1 19 TRP HB2 H -1.952 8.084 -1.655 1.00 . A A . 36 TRP HB2 1 1 7 2375 1 1 19 TRP HB3 H -1.337 6.673 -2.510 1.00 . A A . 36 TRP HB3 1 1 7 2376 1 1 19 TRP HD1 H -3.888 7.587 0.240 1.00 . A A . 36 TRP HD1 1 1 7 2377 1 1 19 TRP HE1 H -5.698 5.759 0.293 1.00 . A A . 36 TRP HE1 1 1 7 2378 1 1 19 TRP HE3 H -1.859 4.337 -3.145 1.00 . A A . 36 TRP HE3 1 1 7 2379 1 1 19 TRP HH2 H -5.192 1.732 -2.567 1.00 . A A . 36 TRP HH2 1 1 7 2380 1 1 19 TRP HZ2 H -6.200 3.268 -0.936 1.00 . A A . 36 TRP HZ2 1 1 7 2381 1 1 19 TRP HZ3 H -3.067 2.253 -3.649 1.00 . A A . 36 TRP HZ3 1 1 7 2382 1 1 19 TRP N N -0.754 7.873 0.548 1.00 . A A . 36 TRP N 1 1 7 2383 1 1 19 TRP NE1 N -4.895 5.713 -0.267 1.00 . A A . 36 TRP NE1 1 1 7 2384 1 1 19 TRP O O 1.035 6.473 -2.243 1.00 . A A . 36 TRP O 1 1 7 2385 1 1 20 CYS C C 2.921 8.801 -2.433 1.00 . A A . 37 CYS C 1 1 7 2386 1 1 20 CYS CA C 2.989 8.068 -1.096 1.00 . A A . 37 CYS CA 1 1 7 2387 1 1 20 CYS CB C 3.732 6.741 -1.267 1.00 . A A . 37 CYS CB 1 1 7 2388 1 1 20 CYS H H 1.392 8.268 0.278 1.00 . A A . 37 CYS H 1 1 7 2389 1 1 20 CYS HA H 3.526 8.683 -0.390 1.00 . A A . 37 CYS HA 1 1 7 2390 1 1 20 CYS HB2 H 3.333 6.222 -2.127 1.00 . A A . 37 CYS HB2 1 1 7 2391 1 1 20 CYS HB3 H 4.780 6.943 -1.430 1.00 . A A . 37 CYS HB3 1 1 7 2392 1 1 20 CYS N N 1.653 7.835 -0.563 1.00 . A A . 37 CYS N 1 1 7 2393 1 1 20 CYS O O 3.885 8.808 -3.198 1.00 . A A . 37 CYS O 1 1 7 2394 1 1 20 CYS SG S 3.597 5.624 0.165 1.00 . A A . 37 CYS SG 1 1 8 2395 1 1 1 ASN C C 3.573 0.550 -1.890 1.00 . A A . 18 ASN C 1 1 8 2396 1 1 1 ASN CA C 2.386 -0.405 -1.969 1.00 . A A . 18 ASN CA 1 1 8 2397 1 1 1 ASN CB C 1.518 -0.059 -3.181 1.00 . A A . 18 ASN CB 1 1 8 2398 1 1 1 ASN CG C 0.039 -0.046 -2.847 1.00 . A A . 18 ASN CG 1 1 8 2399 1 1 1 ASN H1 H 2.051 -0.312 0.119 1.00 . A A . 18 ASN H1 1 1 8 2400 1 1 1 ASN HA H 2.756 -1.413 -2.080 1.00 . A A . 18 ASN HA 1 1 8 2401 1 1 1 ASN HB2 H 1.794 0.920 -3.545 1.00 . A A . 18 ASN HB2 1 1 8 2402 1 1 1 ASN HB3 H 1.687 -0.789 -3.958 1.00 . A A . 18 ASN HB3 1 1 8 2403 1 1 1 ASN HD21 H -0.224 -1.754 -3.831 1.00 . A A . 18 ASN HD21 1 1 8 2404 1 1 1 ASN HD22 H -1.640 -1.078 -3.108 1.00 . A A . 18 ASN HD22 1 1 8 2405 1 1 1 ASN N N 1.593 -0.352 -0.747 1.00 . A A . 18 ASN N 1 1 8 2406 1 1 1 ASN ND2 N -0.681 -1.062 -3.309 1.00 . A A . 18 ASN ND2 1 1 8 2407 1 1 1 ASN O O 4.727 0.122 -1.853 1.00 . A A . 18 ASN O 1 1 8 2408 1 1 1 ASN OD1 O -0.451 0.867 -2.182 1.00 . A A . 18 ASN OD1 1 1 8 2409 1 1 2 CYS C C 5.378 2.642 -2.870 1.00 . A A . 19 CYS C 1 1 8 2410 1 1 2 CYS CA C 4.323 2.863 -1.790 1.00 . A A . 19 CYS CA 1 1 8 2411 1 1 2 CYS CB C 4.981 2.849 -0.409 1.00 . A A . 19 CYS CB 1 1 8 2412 1 1 2 CYS H H 2.342 2.126 -1.897 1.00 . A A . 19 CYS H 1 1 8 2413 1 1 2 CYS HA H 3.860 3.825 -1.948 1.00 . A A . 19 CYS HA 1 1 8 2414 1 1 2 CYS HB2 H 4.348 2.304 0.277 1.00 . A A . 19 CYS HB2 1 1 8 2415 1 1 2 CYS HB3 H 5.938 2.353 -0.479 1.00 . A A . 19 CYS HB3 1 1 8 2416 1 1 2 CYS N N 3.281 1.846 -1.865 1.00 . A A . 19 CYS N 1 1 8 2417 1 1 2 CYS O O 6.544 2.998 -2.696 1.00 . A A . 19 CYS O 1 1 8 2418 1 1 2 CYS SG S 5.264 4.504 0.297 1.00 . A A . 19 CYS SG 1 1 8 2419 1 1 3 ASP C C 5.429 2.533 -6.349 1.00 . A A . 20 ASP C 1 1 8 2420 1 1 3 ASP CA C 5.868 1.785 -5.094 1.00 . A A . 20 ASP CA 1 1 8 2421 1 1 3 ASP CB C 5.932 0.283 -5.378 1.00 . A A . 20 ASP CB 1 1 8 2422 1 1 3 ASP CG C 7.133 -0.377 -4.729 1.00 . A A . 20 ASP CG 1 1 8 2423 1 1 3 ASP H H 4.019 1.792 -4.064 1.00 . A A . 20 ASP H 1 1 8 2424 1 1 3 ASP HA H 6.850 2.130 -4.810 1.00 . A A . 20 ASP HA 1 1 8 2425 1 1 3 ASP HB2 H 5.037 -0.187 -4.997 1.00 . A A . 20 ASP HB2 1 1 8 2426 1 1 3 ASP HB3 H 5.990 0.127 -6.445 1.00 . A A . 20 ASP HB3 1 1 8 2427 1 1 3 ASP N N 4.960 2.053 -3.985 1.00 . A A . 20 ASP N 1 1 8 2428 1 1 3 ASP O O 6.024 2.380 -7.415 1.00 . A A . 20 ASP O 1 1 8 2429 1 1 3 ASP OD1 O 8.252 0.161 -4.865 1.00 . A A . 20 ASP OD1 1 1 8 2430 1 1 3 ASP OD2 O 6.954 -1.432 -4.086 1.00 . A A . 20 ASP OD2 1 1 8 2431 1 1 4 TRP C C 3.094 5.335 -6.849 1.00 . A A . 21 TRP C 1 1 8 2432 1 1 4 TRP CA C 3.863 4.112 -7.337 1.00 . A A . 21 TRP CA 1 1 8 2433 1 1 4 TRP CB C 2.957 3.238 -8.206 1.00 . A A . 21 TRP CB 1 1 8 2434 1 1 4 TRP CD1 C 1.146 2.720 -6.468 1.00 . A A . 21 TRP CD1 1 1 8 2435 1 1 4 TRP CD2 C 1.985 0.913 -7.490 1.00 . A A . 21 TRP CD2 1 1 8 2436 1 1 4 TRP CE2 C 1.008 0.494 -6.566 1.00 . A A . 21 TRP CE2 1 1 8 2437 1 1 4 TRP CE3 C 2.650 -0.052 -8.252 1.00 . A A . 21 TRP CE3 1 1 8 2438 1 1 4 TRP CG C 2.057 2.340 -7.412 1.00 . A A . 21 TRP CG 1 1 8 2439 1 1 4 TRP CH2 C 1.348 -1.771 -7.144 1.00 . A A . 21 TRP CH2 1 1 8 2440 1 1 4 TRP CZ2 C 0.682 -0.848 -6.385 1.00 . A A . 21 TRP CZ2 1 1 8 2441 1 1 4 TRP CZ3 C 2.325 -1.383 -8.070 1.00 . A A . 21 TRP CZ3 1 1 8 2442 1 1 4 TRP H H 3.950 3.420 -5.338 1.00 . A A . 21 TRP H 1 1 8 2443 1 1 4 TRP HA H 4.704 4.442 -7.929 1.00 . A A . 21 TRP HA 1 1 8 2444 1 1 4 TRP HB2 H 2.336 3.873 -8.820 1.00 . A A . 21 TRP HB2 1 1 8 2445 1 1 4 TRP HB3 H 3.571 2.617 -8.843 1.00 . A A . 21 TRP HB3 1 1 8 2446 1 1 4 TRP HD1 H 0.963 3.743 -6.177 1.00 . A A . 21 TRP HD1 1 1 8 2447 1 1 4 TRP HE1 H -0.185 1.628 -5.265 1.00 . A A . 21 TRP HE1 1 1 8 2448 1 1 4 TRP HE3 H 3.406 0.227 -8.971 1.00 . A A . 21 TRP HE3 1 1 8 2449 1 1 4 TRP HH2 H 1.127 -2.822 -7.035 1.00 . A A . 21 TRP HH2 1 1 8 2450 1 1 4 TRP HZ2 H -0.069 -1.163 -5.675 1.00 . A A . 21 TRP HZ2 1 1 8 2451 1 1 4 TRP HZ3 H 2.828 -2.143 -8.650 1.00 . A A . 21 TRP HZ3 1 1 8 2452 1 1 4 TRP N N 4.383 3.341 -6.214 1.00 . A A . 21 TRP N 1 1 8 2453 1 1 4 TRP NE1 N 0.511 1.615 -5.955 1.00 . A A . 21 TRP NE1 1 1 8 2454 1 1 4 TRP O O 2.547 5.335 -5.746 1.00 . A A . 21 TRP O 1 1 8 2455 1 1 5 ASP C C 1.935 8.363 -8.582 1.00 . A A . 22 ASP C 1 1 8 2456 1 1 5 ASP CA C 2.353 7.603 -7.327 1.00 . A A . 22 ASP CA 1 1 8 2457 1 1 5 ASP CB C 3.237 8.490 -6.449 1.00 . A A . 22 ASP CB 1 1 8 2458 1 1 5 ASP CG C 4.715 8.277 -6.712 1.00 . A A . 22 ASP CG 1 1 8 2459 1 1 5 ASP H H 3.512 6.312 -8.541 1.00 . A A . 22 ASP H 1 1 8 2460 1 1 5 ASP HA H 1.467 7.332 -6.774 1.00 . A A . 22 ASP HA 1 1 8 2461 1 1 5 ASP HB2 H 3.001 9.526 -6.643 1.00 . A A . 22 ASP HB2 1 1 8 2462 1 1 5 ASP HB3 H 3.039 8.268 -5.411 1.00 . A A . 22 ASP HB3 1 1 8 2463 1 1 5 ASP N N 3.057 6.374 -7.676 1.00 . A A . 22 ASP N 1 1 8 2464 1 1 5 ASP O O 2.636 8.347 -9.594 1.00 . A A . 22 ASP O 1 1 8 2465 1 1 5 ASP OD1 O 5.260 8.951 -7.612 1.00 . A A . 22 ASP OD1 1 1 8 2466 1 1 5 ASP OD2 O 5.326 7.438 -6.019 1.00 . A A . 22 ASP OD2 1 1 8 2467 1 1 6 LYS C C 0.331 8.977 -10.923 1.00 . A A . 23 LYS C 1 1 8 2468 1 1 6 LYS CA C 0.274 9.796 -9.638 1.00 . A A . 23 LYS CA 1 1 8 2469 1 1 6 LYS CB C 1.076 11.089 -9.808 1.00 . A A . 23 LYS CB 1 1 8 2470 1 1 6 LYS CD C 0.328 13.163 -8.604 1.00 . A A . 23 LYS CD 1 1 8 2471 1 1 6 LYS CE C 1.150 14.379 -9.002 1.00 . A A . 23 LYS CE 1 1 8 2472 1 1 6 LYS CG C 1.185 11.910 -8.535 1.00 . A A . 23 LYS CG 1 1 8 2473 1 1 6 LYS H H 0.273 9.004 -7.675 1.00 . A A . 23 LYS H 1 1 8 2474 1 1 6 LYS HA H -0.755 10.046 -9.429 1.00 . A A . 23 LYS HA 1 1 8 2475 1 1 6 LYS HB2 H 2.074 10.839 -10.137 1.00 . A A . 23 LYS HB2 1 1 8 2476 1 1 6 LYS HB3 H 0.599 11.697 -10.564 1.00 . A A . 23 LYS HB3 1 1 8 2477 1 1 6 LYS HD2 H -0.453 13.015 -9.336 1.00 . A A . 23 LYS HD2 1 1 8 2478 1 1 6 LYS HD3 H -0.115 13.340 -7.634 1.00 . A A . 23 LYS HD3 1 1 8 2479 1 1 6 LYS HE2 H 0.567 15.268 -8.815 1.00 . A A . 23 LYS HE2 1 1 8 2480 1 1 6 LYS HE3 H 2.047 14.403 -8.401 1.00 . A A . 23 LYS HE3 1 1 8 2481 1 1 6 LYS HG2 H 0.857 11.308 -7.700 1.00 . A A . 23 LYS HG2 1 1 8 2482 1 1 6 LYS HG3 H 2.216 12.197 -8.390 1.00 . A A . 23 LYS HG3 1 1 8 2483 1 1 6 LYS HZ1 H 1.762 13.370 -10.726 1.00 . A A . 23 LYS HZ1 1 1 8 2484 1 1 6 LYS HZ2 H 2.363 14.946 -10.606 1.00 . A A . 23 LYS HZ2 1 1 8 2485 1 1 6 LYS HZ3 H 0.745 14.688 -11.028 1.00 . A A . 23 LYS HZ3 1 1 8 2486 1 1 6 LYS N N 0.787 9.029 -8.509 1.00 . A A . 23 LYS N 1 1 8 2487 1 1 6 LYS NZ N 1.531 14.343 -10.441 1.00 . A A . 23 LYS NZ 1 1 8 2488 1 1 6 LYS O O 0.911 9.407 -11.920 1.00 . A A . 23 LYS O 1 1 8 2489 1 1 7 SER C C -1.047 5.624 -11.749 1.00 . A A . 24 SER C 1 1 8 2490 1 1 7 SER CA C -0.294 6.915 -12.056 1.00 . A A . 24 SER CA 1 1 8 2491 1 1 7 SER CB C 1.134 6.593 -12.499 1.00 . A A . 24 SER CB 1 1 8 2492 1 1 7 SER H H -0.723 7.508 -10.069 1.00 . A A . 24 SER H 1 1 8 2493 1 1 7 SER HA H -0.802 7.433 -12.856 1.00 . A A . 24 SER HA 1 1 8 2494 1 1 7 SER HB2 H 1.829 6.949 -11.753 1.00 . A A . 24 SER HB2 1 1 8 2495 1 1 7 SER HB3 H 1.241 5.524 -12.610 1.00 . A A . 24 SER HB3 1 1 8 2496 1 1 7 SER HG H 2.386 7.200 -13.879 1.00 . A A . 24 SER HG 1 1 8 2497 1 1 7 SER N N -0.277 7.795 -10.894 1.00 . A A . 24 SER N 1 1 8 2498 1 1 7 SER O O -1.676 5.034 -12.629 1.00 . A A . 24 SER O 1 1 8 2499 1 1 7 SER OG O 1.437 7.214 -13.737 1.00 . A A . 24 SER OG 1 1 8 2500 1 1 8 HIS C C -3.167 4.121 -10.173 1.00 . A A . 25 HIS C 1 1 8 2501 1 1 8 HIS CA C -1.652 3.969 -10.070 1.00 . A A . 25 HIS CA 1 1 8 2502 1 1 8 HIS CB C -1.260 3.617 -8.635 1.00 . A A . 25 HIS CB 1 1 8 2503 1 1 8 HIS CD2 C -2.305 1.901 -6.994 1.00 . A A . 25 HIS CD2 1 1 8 2504 1 1 8 HIS CE1 C -2.305 0.152 -8.317 1.00 . A A . 25 HIS CE1 1 1 8 2505 1 1 8 HIS CG C -1.779 2.288 -8.180 1.00 . A A . 25 HIS CG 1 1 8 2506 1 1 8 HIS H H -0.461 5.704 -9.839 1.00 . A A . 25 HIS H 1 1 8 2507 1 1 8 HIS HA H -1.338 3.171 -10.726 1.00 . A A . 25 HIS HA 1 1 8 2508 1 1 8 HIS HB2 H -0.182 3.595 -8.558 1.00 . A A . 25 HIS HB2 1 1 8 2509 1 1 8 HIS HB3 H -1.648 4.372 -7.966 1.00 . A A . 25 HIS HB3 1 1 8 2510 1 1 8 HIS HD1 H -1.474 1.127 -9.912 1.00 . A A . 25 HIS HD1 1 1 8 2511 1 1 8 HIS HD2 H -2.448 2.524 -6.122 1.00 . A A . 25 HIS HD2 1 1 8 2512 1 1 8 HIS HE1 H -2.440 -0.850 -8.695 1.00 . A A . 25 HIS HE1 1 1 8 2513 1 1 8 HIS N N -0.977 5.190 -10.495 1.00 . A A . 25 HIS N 1 1 8 2514 1 1 8 HIS ND1 N -1.792 1.169 -8.987 1.00 . A A . 25 HIS ND1 1 1 8 2515 1 1 8 HIS NE2 N -2.624 0.570 -7.105 1.00 . A A . 25 HIS NE2 1 1 8 2516 1 1 8 HIS O O -3.696 5.229 -10.080 1.00 . A A . 25 HIS O 1 1 8 2517 1 1 9 GLU C C -5.961 3.382 -9.151 1.00 . A A . 26 GLU C 1 1 8 2518 1 1 9 GLU CA C -5.311 3.013 -10.482 1.00 . A A . 26 GLU CA 1 1 8 2519 1 1 9 GLU CB C -5.818 1.646 -10.947 1.00 . A A . 26 GLU CB 1 1 8 2520 1 1 9 GLU CD C -6.291 -0.761 -10.347 1.00 . A A . 26 GLU CD 1 1 8 2521 1 1 9 GLU CG C -5.830 0.595 -9.850 1.00 . A A . 26 GLU CG 1 1 8 2522 1 1 9 GLU H H -3.379 2.149 -10.430 1.00 . A A . 26 GLU H 1 1 8 2523 1 1 9 GLU HA H -5.579 3.756 -11.217 1.00 . A A . 26 GLU HA 1 1 8 2524 1 1 9 GLU HB2 H -6.825 1.758 -11.322 1.00 . A A . 26 GLU HB2 1 1 8 2525 1 1 9 GLU HB3 H -5.183 1.294 -11.747 1.00 . A A . 26 GLU HB3 1 1 8 2526 1 1 9 GLU HG2 H -4.831 0.496 -9.454 1.00 . A A . 26 GLU HG2 1 1 8 2527 1 1 9 GLU HG3 H -6.497 0.920 -9.065 1.00 . A A . 26 GLU HG3 1 1 8 2528 1 1 9 GLU N N -3.858 3.002 -10.365 1.00 . A A . 26 GLU N 1 1 8 2529 1 1 9 GLU O O -7.027 3.998 -9.117 1.00 . A A . 26 GLU O 1 1 8 2530 1 1 9 GLU OE1 O -7.413 -0.846 -10.888 1.00 . A A . 26 GLU OE1 1 1 8 2531 1 1 9 GLU OE2 O -5.528 -1.738 -10.195 1.00 . A A . 26 GLU OE2 1 1 8 2532 1 1 10 LYS C C -5.190 4.560 -6.160 1.00 . A A . 27 LYS C 1 1 8 2533 1 1 10 LYS CA C -5.824 3.291 -6.722 1.00 . A A . 27 LYS CA 1 1 8 2534 1 1 10 LYS CB C -5.554 2.114 -5.783 1.00 . A A . 27 LYS CB 1 1 8 2535 1 1 10 LYS CD C -6.047 -0.272 -5.169 1.00 . A A . 27 LYS CD 1 1 8 2536 1 1 10 LYS CE C -4.792 -1.064 -5.501 1.00 . A A . 27 LYS CE 1 1 8 2537 1 1 10 LYS CG C -6.285 0.842 -6.175 1.00 . A A . 27 LYS CG 1 1 8 2538 1 1 10 LYS H H -4.466 2.513 -8.148 1.00 . A A . 27 LYS H 1 1 8 2539 1 1 10 LYS HA H -6.890 3.440 -6.801 1.00 . A A . 27 LYS HA 1 1 8 2540 1 1 10 LYS HB2 H -4.494 1.908 -5.779 1.00 . A A . 27 LYS HB2 1 1 8 2541 1 1 10 LYS HB3 H -5.862 2.388 -4.784 1.00 . A A . 27 LYS HB3 1 1 8 2542 1 1 10 LYS HD2 H -5.937 0.161 -4.186 1.00 . A A . 27 LYS HD2 1 1 8 2543 1 1 10 LYS HD3 H -6.897 -0.940 -5.177 1.00 . A A . 27 LYS HD3 1 1 8 2544 1 1 10 LYS HE2 H -4.715 -1.159 -6.573 1.00 . A A . 27 LYS HE2 1 1 8 2545 1 1 10 LYS HE3 H -3.934 -0.527 -5.124 1.00 . A A . 27 LYS HE3 1 1 8 2546 1 1 10 LYS HG2 H -7.344 1.047 -6.225 1.00 . A A . 27 LYS HG2 1 1 8 2547 1 1 10 LYS HG3 H -5.933 0.520 -7.145 1.00 . A A . 27 LYS HG3 1 1 8 2548 1 1 10 LYS HZ1 H -4.745 -3.148 -5.637 1.00 . A A . 27 LYS HZ1 1 1 8 2549 1 1 10 LYS HZ2 H -5.707 -2.566 -4.373 1.00 . A A . 27 LYS HZ2 1 1 8 2550 1 1 10 LYS HZ3 H -4.021 -2.536 -4.235 1.00 . A A . 27 LYS HZ3 1 1 8 2551 1 1 10 LYS N N -5.312 3.001 -8.056 1.00 . A A . 27 LYS N 1 1 8 2552 1 1 10 LYS NZ N -4.818 -2.424 -4.894 1.00 . A A . 27 LYS NZ 1 1 8 2553 1 1 10 LYS O O -5.557 5.022 -5.080 1.00 . A A . 27 LYS O 1 1 8 2554 1 1 11 TYR C C -4.551 7.462 -6.228 1.00 . A A . 28 TYR C 1 1 8 2555 1 1 11 TYR CA C -3.555 6.333 -6.475 1.00 . A A . 28 TYR CA 1 1 8 2556 1 1 11 TYR CB C -2.532 6.762 -7.529 1.00 . A A . 28 TYR CB 1 1 8 2557 1 1 11 TYR CD1 C -2.411 9.279 -7.353 1.00 . A A . 28 TYR CD1 1 1 8 2558 1 1 11 TYR CD2 C -3.366 8.333 -9.321 1.00 . A A . 28 TYR CD2 1 1 8 2559 1 1 11 TYR CE1 C -2.631 10.549 -7.850 1.00 . A A . 28 TYR CE1 1 1 8 2560 1 1 11 TYR CE2 C -3.588 9.599 -9.827 1.00 . A A . 28 TYR CE2 1 1 8 2561 1 1 11 TYR CG C -2.774 8.150 -8.077 1.00 . A A . 28 TYR CG 1 1 8 2562 1 1 11 TYR CZ C -3.220 10.704 -9.088 1.00 . A A . 28 TYR CZ 1 1 8 2563 1 1 11 TYR H H -3.991 4.703 -7.753 1.00 . A A . 28 TYR H 1 1 8 2564 1 1 11 TYR HA H -3.037 6.116 -5.552 1.00 . A A . 28 TYR HA 1 1 8 2565 1 1 11 TYR HB2 H -1.546 6.747 -7.090 1.00 . A A . 28 TYR HB2 1 1 8 2566 1 1 11 TYR HB3 H -2.564 6.068 -8.355 1.00 . A A . 28 TYR HB3 1 1 8 2567 1 1 11 TYR HD1 H -1.949 9.154 -6.384 1.00 . A A . 28 TYR HD1 1 1 8 2568 1 1 11 TYR HD2 H -3.654 7.466 -9.898 1.00 . A A . 28 TYR HD2 1 1 8 2569 1 1 11 TYR HE1 H -2.341 11.413 -7.272 1.00 . A A . 28 TYR HE1 1 1 8 2570 1 1 11 TYR HE2 H -4.050 9.721 -10.796 1.00 . A A . 28 TYR HE2 1 1 8 2571 1 1 11 TYR HH H -3.169 12.619 -8.937 1.00 . A A . 28 TYR HH 1 1 8 2572 1 1 11 TYR N N -4.240 5.118 -6.901 1.00 . A A . 28 TYR N 1 1 8 2573 1 1 11 TYR O O -5.571 7.565 -6.909 1.00 . A A . 28 TYR O 1 1 8 2574 1 1 11 TYR OH O -3.439 11.967 -9.588 1.00 . A A . 28 TYR OH 1 1 8 2575 1 1 12 ASP C C -4.321 10.733 -4.869 1.00 . A A . 29 ASP C 1 1 8 2576 1 1 12 ASP CA C -5.113 9.430 -4.911 1.00 . A A . 29 ASP CA 1 1 8 2577 1 1 12 ASP CB C -5.793 9.189 -3.562 1.00 . A A . 29 ASP CB 1 1 8 2578 1 1 12 ASP CG C -7.131 8.490 -3.706 1.00 . A A . 29 ASP CG 1 1 8 2579 1 1 12 ASP H H -3.418 8.172 -4.741 1.00 . A A . 29 ASP H 1 1 8 2580 1 1 12 ASP HA H -5.870 9.507 -5.677 1.00 . A A . 29 ASP HA 1 1 8 2581 1 1 12 ASP HB2 H -5.152 8.575 -2.947 1.00 . A A . 29 ASP HB2 1 1 8 2582 1 1 12 ASP HB3 H -5.953 10.138 -3.073 1.00 . A A . 29 ASP HB3 1 1 8 2583 1 1 12 ASP N N -4.246 8.307 -5.249 1.00 . A A . 29 ASP N 1 1 8 2584 1 1 12 ASP O O -3.253 10.803 -4.262 1.00 . A A . 29 ASP O 1 1 8 2585 1 1 12 ASP OD1 O -7.196 7.476 -4.431 1.00 . A A . 29 ASP OD1 1 1 8 2586 1 1 12 ASP OD2 O -8.113 8.958 -3.091 1.00 . A A . 29 ASP OD2 1 1 8 2587 1 1 13 TRP C C -3.974 13.604 -4.149 1.00 . A A . 30 TRP C 1 1 8 2588 1 1 13 TRP CA C -4.195 13.064 -5.558 1.00 . A A . 30 TRP CA 1 1 8 2589 1 1 13 TRP CB C -5.027 14.055 -6.373 1.00 . A A . 30 TRP CB 1 1 8 2590 1 1 13 TRP CD1 C -4.143 15.146 -8.517 1.00 . A A . 30 TRP CD1 1 1 8 2591 1 1 13 TRP CD2 C -3.297 16.006 -6.630 1.00 . A A . 30 TRP CD2 1 1 8 2592 1 1 13 TRP CE2 C -2.734 16.688 -7.727 1.00 . A A . 30 TRP CE2 1 1 8 2593 1 1 13 TRP CE3 C -2.915 16.377 -5.338 1.00 . A A . 30 TRP CE3 1 1 8 2594 1 1 13 TRP CG C -4.196 15.024 -7.158 1.00 . A A . 30 TRP CG 1 1 8 2595 1 1 13 TRP CH2 C -1.453 18.059 -6.292 1.00 . A A . 30 TRP CH2 1 1 8 2596 1 1 13 TRP CZ2 C -1.810 17.717 -7.568 1.00 . A A . 30 TRP CZ2 1 1 8 2597 1 1 13 TRP CZ3 C -1.997 17.398 -5.182 1.00 . A A . 30 TRP CZ3 1 1 8 2598 1 1 13 TRP H H -5.707 11.645 -5.985 1.00 . A A . 30 TRP H 1 1 8 2599 1 1 13 TRP HA H -3.235 12.935 -6.036 1.00 . A A . 30 TRP HA 1 1 8 2600 1 1 13 TRP HB2 H -5.647 13.509 -7.068 1.00 . A A . 30 TRP HB2 1 1 8 2601 1 1 13 TRP HB3 H -5.657 14.621 -5.702 1.00 . A A . 30 TRP HB3 1 1 8 2602 1 1 13 TRP HD1 H -4.711 14.538 -9.204 1.00 . A A . 30 TRP HD1 1 1 8 2603 1 1 13 TRP HE1 H -3.056 16.422 -9.782 1.00 . A A . 30 TRP HE1 1 1 8 2604 1 1 13 TRP HE3 H -3.323 15.879 -4.470 1.00 . A A . 30 TRP HE3 1 1 8 2605 1 1 13 TRP HH2 H -0.740 18.851 -6.123 1.00 . A A . 30 TRP HH2 1 1 8 2606 1 1 13 TRP HZ2 H -1.382 18.236 -8.413 1.00 . A A . 30 TRP HZ2 1 1 8 2607 1 1 13 TRP HZ3 H -1.689 17.698 -4.191 1.00 . A A . 30 TRP HZ3 1 1 8 2608 1 1 13 TRP N N -4.852 11.762 -5.520 1.00 . A A . 30 TRP N 1 1 8 2609 1 1 13 TRP NE1 N -3.265 16.144 -8.866 1.00 . A A . 30 TRP NE1 1 1 8 2610 1 1 13 TRP O O -2.836 13.753 -3.705 1.00 . A A . 30 TRP O 1 1 8 2611 1 1 14 GLU C C -4.505 13.346 -1.124 1.00 . A A . 31 GLU C 1 1 8 2612 1 1 14 GLU CA C -4.992 14.418 -2.095 1.00 . A A . 31 GLU CA 1 1 8 2613 1 1 14 GLU CB C -6.359 14.943 -1.649 1.00 . A A . 31 GLU CB 1 1 8 2614 1 1 14 GLU CD C -7.538 17.170 -1.477 1.00 . A A . 31 GLU CD 1 1 8 2615 1 1 14 GLU CG C -6.794 16.203 -2.377 1.00 . A A . 31 GLU CG 1 1 8 2616 1 1 14 GLU H H -5.947 13.753 -3.863 1.00 . A A . 31 GLU H 1 1 8 2617 1 1 14 GLU HA H -4.286 15.235 -2.093 1.00 . A A . 31 GLU HA 1 1 8 2618 1 1 14 GLU HB2 H -7.099 14.176 -1.823 1.00 . A A . 31 GLU HB2 1 1 8 2619 1 1 14 GLU HB3 H -6.320 15.159 -0.591 1.00 . A A . 31 GLU HB3 1 1 8 2620 1 1 14 GLU HG2 H -5.918 16.699 -2.767 1.00 . A A . 31 GLU HG2 1 1 8 2621 1 1 14 GLU HG3 H -7.442 15.925 -3.195 1.00 . A A . 31 GLU HG3 1 1 8 2622 1 1 14 GLU N N -5.068 13.894 -3.453 1.00 . A A . 31 GLU N 1 1 8 2623 1 1 14 GLU O O -3.575 13.570 -0.348 1.00 . A A . 31 GLU O 1 1 8 2624 1 1 14 GLU OE1 O -6.960 17.589 -0.452 1.00 . A A . 31 GLU OE1 1 1 8 2625 1 1 14 GLU OE2 O -8.697 17.507 -1.796 1.00 . A A . 31 GLU OE2 1 1 8 2626 1 1 15 LEU C C -3.310 10.689 -0.488 1.00 . A A . 32 LEU C 1 1 8 2627 1 1 15 LEU CA C -4.774 11.072 -0.298 1.00 . A A . 32 LEU CA 1 1 8 2628 1 1 15 LEU CB C -5.669 9.862 -0.573 1.00 . A A . 32 LEU CB 1 1 8 2629 1 1 15 LEU CD1 C -7.078 10.166 1.477 1.00 . A A . 32 LEU CD1 1 1 8 2630 1 1 15 LEU CD2 C -7.128 7.992 0.240 1.00 . A A . 32 LEU CD2 1 1 8 2631 1 1 15 LEU CG C -6.267 9.176 0.656 1.00 . A A . 32 LEU CG 1 1 8 2632 1 1 15 LEU H H -5.874 12.061 -1.812 1.00 . A A . 32 LEU H 1 1 8 2633 1 1 15 LEU HA H -4.920 11.393 0.722 1.00 . A A . 32 LEU HA 1 1 8 2634 1 1 15 LEU HB2 H -6.485 10.189 -1.198 1.00 . A A . 32 LEU HB2 1 1 8 2635 1 1 15 LEU HB3 H -5.079 9.130 -1.107 1.00 . A A . 32 LEU HB3 1 1 8 2636 1 1 15 LEU HD11 H -7.744 9.627 2.135 1.00 . A A . 32 LEU HD11 1 1 8 2637 1 1 15 LEU HD12 H -7.656 10.794 0.816 1.00 . A A . 32 LEU HD12 1 1 8 2638 1 1 15 LEU HD13 H -6.410 10.779 2.064 1.00 . A A . 32 LEU HD13 1 1 8 2639 1 1 15 LEU HD21 H -6.650 7.469 -0.575 1.00 . A A . 32 LEU HD21 1 1 8 2640 1 1 15 LEU HD22 H -8.097 8.347 -0.079 1.00 . A A . 32 LEU HD22 1 1 8 2641 1 1 15 LEU HD23 H -7.247 7.322 1.078 1.00 . A A . 32 LEU HD23 1 1 8 2642 1 1 15 LEU HG H -5.464 8.805 1.279 1.00 . A A . 32 LEU HG 1 1 8 2643 1 1 15 LEU N N -5.141 12.180 -1.173 1.00 . A A . 32 LEU N 1 1 8 2644 1 1 15 LEU O O -2.723 10.006 0.350 1.00 . A A . 32 LEU O 1 1 8 2645 1 1 16 TRP C C -0.463 10.993 -0.647 1.00 . A A . 33 TRP C 1 1 8 2646 1 1 16 TRP CA C -1.329 10.843 -1.893 1.00 . A A . 33 TRP CA 1 1 8 2647 1 1 16 TRP CB C -0.817 11.768 -2.999 1.00 . A A . 33 TRP CB 1 1 8 2648 1 1 16 TRP CD1 C 1.417 11.038 -4.020 1.00 . A A . 33 TRP CD1 1 1 8 2649 1 1 16 TRP CD2 C 1.607 12.522 -2.354 1.00 . A A . 33 TRP CD2 1 1 8 2650 1 1 16 TRP CE2 C 2.897 12.206 -2.824 1.00 . A A . 33 TRP CE2 1 1 8 2651 1 1 16 TRP CE3 C 1.478 13.439 -1.307 1.00 . A A . 33 TRP CE3 1 1 8 2652 1 1 16 TRP CG C 0.675 11.765 -3.133 1.00 . A A . 33 TRP CG 1 1 8 2653 1 1 16 TRP CH2 C 3.890 13.668 -1.256 1.00 . A A . 33 TRP CH2 1 1 8 2654 1 1 16 TRP CZ2 C 4.047 12.774 -2.280 1.00 . A A . 33 TRP CZ2 1 1 8 2655 1 1 16 TRP CZ3 C 2.620 14.001 -0.769 1.00 . A A . 33 TRP CZ3 1 1 8 2656 1 1 16 TRP H H -3.247 11.678 -2.225 1.00 . A A . 33 TRP H 1 1 8 2657 1 1 16 TRP HA H -1.272 9.821 -2.236 1.00 . A A . 33 TRP HA 1 1 8 2658 1 1 16 TRP HB2 H -1.237 11.456 -3.943 1.00 . A A . 33 TRP HB2 1 1 8 2659 1 1 16 TRP HB3 H -1.132 12.780 -2.786 1.00 . A A . 33 TRP HB3 1 1 8 2660 1 1 16 TRP HD1 H 1.000 10.360 -4.749 1.00 . A A . 33 TRP HD1 1 1 8 2661 1 1 16 TRP HE1 H 3.486 10.899 -4.355 1.00 . A A . 33 TRP HE1 1 1 8 2662 1 1 16 TRP HE3 H 0.507 13.709 -0.917 1.00 . A A . 33 TRP HE3 1 1 8 2663 1 1 16 TRP HH2 H 4.755 14.131 -0.806 1.00 . A A . 33 TRP HH2 1 1 8 2664 1 1 16 TRP HZ2 H 5.033 12.528 -2.646 1.00 . A A . 33 TRP HZ2 1 1 8 2665 1 1 16 TRP HZ3 H 2.539 14.711 0.042 1.00 . A A . 33 TRP HZ3 1 1 8 2666 1 1 16 TRP N N -2.726 11.137 -1.594 1.00 . A A . 33 TRP N 1 1 8 2667 1 1 16 TRP NE1 N 2.754 11.298 -3.839 1.00 . A A . 33 TRP NE1 1 1 8 2668 1 1 16 TRP O O 0.494 10.243 -0.452 1.00 . A A . 33 TRP O 1 1 8 2669 1 1 17 ASP C C 0.235 10.903 2.150 1.00 . A A . 34 ASP C 1 1 8 2670 1 1 17 ASP CA C -0.057 12.210 1.420 1.00 . A A . 34 ASP CA 1 1 8 2671 1 1 17 ASP CB C -0.836 13.156 2.335 1.00 . A A . 34 ASP CB 1 1 8 2672 1 1 17 ASP CG C -0.044 14.398 2.694 1.00 . A A . 34 ASP CG 1 1 8 2673 1 1 17 ASP H H -1.577 12.529 -0.019 1.00 . A A . 34 ASP H 1 1 8 2674 1 1 17 ASP HA H 0.880 12.675 1.151 1.00 . A A . 34 ASP HA 1 1 8 2675 1 1 17 ASP HB2 H -1.744 13.463 1.836 1.00 . A A . 34 ASP HB2 1 1 8 2676 1 1 17 ASP HB3 H -1.090 12.637 3.247 1.00 . A A . 34 ASP HB3 1 1 8 2677 1 1 17 ASP N N -0.804 11.964 0.192 1.00 . A A . 34 ASP N 1 1 8 2678 1 1 17 ASP O O 1.320 10.716 2.701 1.00 . A A . 34 ASP O 1 1 8 2679 1 1 17 ASP OD1 O 0.724 14.348 3.677 1.00 . A A . 34 ASP OD1 1 1 8 2680 1 1 17 ASP OD2 O -0.193 15.421 1.992 1.00 . A A . 34 ASP OD2 1 1 8 2681 1 1 18 LYS C C -0.357 7.600 1.792 1.00 . A A . 35 LYS C 1 1 8 2682 1 1 18 LYS CA C -0.589 8.711 2.812 1.00 . A A . 35 LYS CA 1 1 8 2683 1 1 18 LYS CB C -1.830 8.396 3.651 1.00 . A A . 35 LYS CB 1 1 8 2684 1 1 18 LYS CD C -4.099 7.324 3.546 1.00 . A A . 35 LYS CD 1 1 8 2685 1 1 18 LYS CE C -3.671 5.864 3.545 1.00 . A A . 35 LYS CE 1 1 8 2686 1 1 18 LYS CG C -3.089 8.201 2.825 1.00 . A A . 35 LYS CG 1 1 8 2687 1 1 18 LYS H H -1.583 10.208 1.694 1.00 . A A . 35 LYS H 1 1 8 2688 1 1 18 LYS HA H 0.270 8.770 3.463 1.00 . A A . 35 LYS HA 1 1 8 2689 1 1 18 LYS HB2 H -1.649 7.492 4.214 1.00 . A A . 35 LYS HB2 1 1 8 2690 1 1 18 LYS HB3 H -2.000 9.211 4.341 1.00 . A A . 35 LYS HB3 1 1 8 2691 1 1 18 LYS HD2 H -4.189 7.660 4.569 1.00 . A A . 35 LYS HD2 1 1 8 2692 1 1 18 LYS HD3 H -5.056 7.410 3.051 1.00 . A A . 35 LYS HD3 1 1 8 2693 1 1 18 LYS HE2 H -4.333 5.309 2.898 1.00 . A A . 35 LYS HE2 1 1 8 2694 1 1 18 LYS HE3 H -2.661 5.799 3.169 1.00 . A A . 35 LYS HE3 1 1 8 2695 1 1 18 LYS HG2 H -3.537 9.165 2.634 1.00 . A A . 35 LYS HG2 1 1 8 2696 1 1 18 LYS HG3 H -2.825 7.733 1.887 1.00 . A A . 35 LYS HG3 1 1 8 2697 1 1 18 LYS HZ1 H -2.816 4.802 5.128 1.00 . A A . 35 LYS HZ1 1 1 8 2698 1 1 18 LYS HZ2 H -4.484 4.569 4.968 1.00 . A A . 35 LYS HZ2 1 1 8 2699 1 1 18 LYS HZ3 H -3.891 6.014 5.617 1.00 . A A . 35 LYS HZ3 1 1 8 2700 1 1 18 LYS N N -0.740 10.001 2.151 1.00 . A A . 35 LYS N 1 1 8 2701 1 1 18 LYS NZ N -3.719 5.271 4.910 1.00 . A A . 35 LYS NZ 1 1 8 2702 1 1 18 LYS O O 0.158 6.534 2.128 1.00 . A A . 35 LYS O 1 1 8 2703 1 1 19 TRP C C 0.789 7.035 -1.192 1.00 . A A . 36 TRP C 1 1 8 2704 1 1 19 TRP CA C -0.571 6.880 -0.522 1.00 . A A . 36 TRP CA 1 1 8 2705 1 1 19 TRP CB C -1.685 7.032 -1.559 1.00 . A A . 36 TRP CB 1 1 8 2706 1 1 19 TRP CD1 C -3.898 6.663 -0.320 1.00 . A A . 36 TRP CD1 1 1 8 2707 1 1 19 TRP CD2 C -3.346 5.012 -1.730 1.00 . A A . 36 TRP CD2 1 1 8 2708 1 1 19 TRP CE2 C -4.572 4.689 -1.118 1.00 . A A . 36 TRP CE2 1 1 8 2709 1 1 19 TRP CE3 C -2.800 4.121 -2.658 1.00 . A A . 36 TRP CE3 1 1 8 2710 1 1 19 TRP CG C -2.932 6.279 -1.206 1.00 . A A . 36 TRP CG 1 1 8 2711 1 1 19 TRP CH2 C -4.703 2.658 -2.317 1.00 . A A . 36 TRP CH2 1 1 8 2712 1 1 19 TRP CZ2 C -5.260 3.512 -1.405 1.00 . A A . 36 TRP CZ2 1 1 8 2713 1 1 19 TRP CZ3 C -3.483 2.953 -2.941 1.00 . A A . 36 TRP CZ3 1 1 8 2714 1 1 19 TRP H H -1.144 8.727 0.341 1.00 . A A . 36 TRP H 1 1 8 2715 1 1 19 TRP HA H -0.633 5.896 -0.082 1.00 . A A . 36 TRP HA 1 1 8 2716 1 1 19 TRP HB2 H -1.942 8.076 -1.653 1.00 . A A . 36 TRP HB2 1 1 8 2717 1 1 19 TRP HB3 H -1.331 6.665 -2.512 1.00 . A A . 36 TRP HB3 1 1 8 2718 1 1 19 TRP HD1 H -3.873 7.581 0.245 1.00 . A A . 36 TRP HD1 1 1 8 2719 1 1 19 TRP HE1 H -5.689 5.758 0.300 1.00 . A A . 36 TRP HE1 1 1 8 2720 1 1 19 TRP HE3 H -1.862 4.331 -3.150 1.00 . A A . 36 TRP HE3 1 1 8 2721 1 1 19 TRP HH2 H -5.201 1.734 -2.568 1.00 . A A . 36 TRP HH2 1 1 8 2722 1 1 19 TRP HZ2 H -6.201 3.270 -0.932 1.00 . A A . 36 TRP HZ2 1 1 8 2723 1 1 19 TRP HZ3 H -3.077 2.252 -3.655 1.00 . A A . 36 TRP HZ3 1 1 8 2724 1 1 19 TRP N N -0.739 7.858 0.547 1.00 . A A . 36 TRP N 1 1 8 2725 1 1 19 TRP NE1 N -4.887 5.711 -0.262 1.00 . A A . 36 TRP NE1 1 1 8 2726 1 1 19 TRP O O 1.041 6.458 -2.251 1.00 . A A . 36 TRP O 1 1 8 2727 1 1 20 CYS C C 2.931 8.783 -2.444 1.00 . A A . 37 CYS C 1 1 8 2728 1 1 20 CYS CA C 3.001 8.049 -1.107 1.00 . A A . 37 CYS CA 1 1 8 2729 1 1 20 CYS CB C 3.740 6.721 -1.280 1.00 . A A . 37 CYS CB 1 1 8 2730 1 1 20 CYS H H 1.406 8.251 0.270 1.00 . A A . 37 CYS H 1 1 8 2731 1 1 20 CYS HA H 3.540 8.663 -0.402 1.00 . A A . 37 CYS HA 1 1 8 2732 1 1 20 CYS HB2 H 3.339 6.203 -2.139 1.00 . A A . 37 CYS HB2 1 1 8 2733 1 1 20 CYS HB3 H 4.789 6.921 -1.444 1.00 . A A . 37 CYS HB3 1 1 8 2734 1 1 20 CYS N N 1.665 7.818 -0.571 1.00 . A A . 37 CYS N 1 1 8 2735 1 1 20 CYS O O 3.885 8.767 -3.221 1.00 . A A . 37 CYS O 1 1 8 2736 1 1 20 CYS SG S 3.606 5.603 0.152 1.00 . A A . 37 CYS SG 1 1 9 2737 1 1 1 ASN C C 3.661 0.533 -1.967 1.00 . A A . 18 ASN C 1 1 9 2738 1 1 1 ASN CA C 2.474 -0.423 -2.029 1.00 . A A . 18 ASN CA 1 1 9 2739 1 1 1 ASN CB C 1.589 -0.078 -3.228 1.00 . A A . 18 ASN CB 1 1 9 2740 1 1 1 ASN CG C 0.114 -0.072 -2.875 1.00 . A A . 18 ASN CG 1 1 9 2741 1 1 1 ASN H1 H 1.250 0.467 -0.549 1.00 . A A . 18 ASN H1 1 1 9 2742 1 1 1 ASN HA H 2.844 -1.431 -2.144 1.00 . A A . 18 ASN HA 1 1 9 2743 1 1 1 ASN HB2 H 1.856 0.903 -3.594 1.00 . A A . 18 ASN HB2 1 1 9 2744 1 1 1 ASN HB3 H 1.751 -0.805 -4.009 1.00 . A A . 18 ASN HB3 1 1 9 2745 1 1 1 ASN HD21 H -0.152 -1.782 -3.854 1.00 . A A . 18 ASN HD21 1 1 9 2746 1 1 1 ASN HD22 H -1.562 -1.113 -3.113 1.00 . A A . 18 ASN HD22 1 1 9 2747 1 1 1 ASN N N 1.698 -0.369 -0.795 1.00 . A A . 18 ASN N 1 1 9 2748 1 1 1 ASN ND2 N -0.606 -1.092 -3.326 1.00 . A A . 18 ASN ND2 1 1 9 2749 1 1 1 ASN O O 4.816 0.106 -1.946 1.00 . A A . 18 ASN O 1 1 9 2750 1 1 1 ASN OD1 O -0.371 0.840 -2.205 1.00 . A A . 18 ASN OD1 1 1 9 2751 1 1 2 CYS C C 5.451 2.627 -2.972 1.00 . A A . 19 CYS C 1 1 9 2752 1 1 2 CYS CA C 4.411 2.847 -1.877 1.00 . A A . 19 CYS CA 1 1 9 2753 1 1 2 CYS CB C 5.089 2.833 -0.505 1.00 . A A . 19 CYS CB 1 1 9 2754 1 1 2 CYS H H 2.429 2.108 -1.955 1.00 . A A . 19 CYS H 1 1 9 2755 1 1 2 CYS HA H 3.945 3.809 -2.028 1.00 . A A . 19 CYS HA 1 1 9 2756 1 1 2 CYS HB2 H 4.473 2.276 0.186 1.00 . A A . 19 CYS HB2 1 1 9 2757 1 1 2 CYS HB3 H 6.051 2.351 -0.592 1.00 . A A . 19 CYS HB3 1 1 9 2758 1 1 2 CYS N N 3.369 1.829 -1.937 1.00 . A A . 19 CYS N 1 1 9 2759 1 1 2 CYS O O 6.618 2.984 -2.815 1.00 . A A . 19 CYS O 1 1 9 2760 1 1 2 CYS SG S 5.360 4.488 0.207 1.00 . A A . 19 CYS SG 1 1 9 2761 1 1 3 ASP C C 5.450 2.517 -6.452 1.00 . A A . 20 ASP C 1 1 9 2762 1 1 3 ASP CA C 5.909 1.770 -5.203 1.00 . A A . 20 ASP CA 1 1 9 2763 1 1 3 ASP CB C 5.972 0.269 -5.486 1.00 . A A . 20 ASP CB 1 1 9 2764 1 1 3 ASP CG C 7.179 -0.391 -4.847 1.00 . A A . 20 ASP CG 1 1 9 2765 1 1 3 ASP H H 4.075 1.776 -4.146 1.00 . A A . 20 ASP H 1 1 9 2766 1 1 3 ASP HA H 6.895 2.118 -4.934 1.00 . A A . 20 ASP HA 1 1 9 2767 1 1 3 ASP HB2 H 5.081 -0.202 -5.098 1.00 . A A . 20 ASP HB2 1 1 9 2768 1 1 3 ASP HB3 H 6.021 0.112 -6.554 1.00 . A A . 20 ASP HB3 1 1 9 2769 1 1 3 ASP N N 5.017 2.037 -4.081 1.00 . A A . 20 ASP N 1 1 9 2770 1 1 3 ASP O O 6.032 2.367 -7.526 1.00 . A A . 20 ASP O 1 1 9 2771 1 1 3 ASP OD1 O 7.395 -0.186 -3.634 1.00 . A A . 20 ASP OD1 1 1 9 2772 1 1 3 ASP OD2 O 7.907 -1.112 -5.560 1.00 . A A . 20 ASP OD2 1 1 9 2773 1 1 4 TRP C C 3.097 5.308 -6.920 1.00 . A A . 21 TRP C 1 1 9 2774 1 1 4 TRP CA C 3.864 4.089 -7.419 1.00 . A A . 21 TRP CA 1 1 9 2775 1 1 4 TRP CB C 2.950 3.211 -8.276 1.00 . A A . 21 TRP CB 1 1 9 2776 1 1 4 TRP CD1 C 1.162 2.690 -6.515 1.00 . A A . 21 TRP CD1 1 1 9 2777 1 1 4 TRP CD2 C 1.995 0.884 -7.544 1.00 . A A . 21 TRP CD2 1 1 9 2778 1 1 4 TRP CE2 C 1.030 0.463 -6.608 1.00 . A A . 21 TRP CE2 1 1 9 2779 1 1 4 TRP CE3 C 2.653 -0.080 -8.313 1.00 . A A . 21 TRP CE3 1 1 9 2780 1 1 4 TRP CG C 2.063 2.312 -7.469 1.00 . A A . 21 TRP CG 1 1 9 2781 1 1 4 TRP CH2 C 1.371 -1.802 -7.187 1.00 . A A . 21 TRP CH2 1 1 9 2782 1 1 4 TRP CZ2 C 0.711 -0.880 -6.421 1.00 . A A . 21 TRP CZ2 1 1 9 2783 1 1 4 TRP CZ3 C 2.335 -1.412 -8.126 1.00 . A A . 21 TRP CZ3 1 1 9 2784 1 1 4 TRP H H 3.981 3.397 -5.421 1.00 . A A . 21 TRP H 1 1 9 2785 1 1 4 TRP HA H 4.696 4.423 -8.022 1.00 . A A . 21 TRP HA 1 1 9 2786 1 1 4 TRP HB2 H 2.319 3.844 -8.883 1.00 . A A . 21 TRP HB2 1 1 9 2787 1 1 4 TRP HB3 H 3.558 2.592 -8.919 1.00 . A A . 21 TRP HB3 1 1 9 2788 1 1 4 TRP HD1 H 0.979 3.713 -6.223 1.00 . A A . 21 TRP HD1 1 1 9 2789 1 1 4 TRP HE1 H -0.150 1.595 -5.294 1.00 . A A . 21 TRP HE1 1 1 9 2790 1 1 4 TRP HE3 H 3.399 0.200 -9.041 1.00 . A A . 21 TRP HE3 1 1 9 2791 1 1 4 TRP HH2 H 1.154 -2.853 -7.075 1.00 . A A . 21 TRP HH2 1 1 9 2792 1 1 4 TRP HZ2 H -0.031 -1.196 -5.702 1.00 . A A . 21 TRP HZ2 1 1 9 2793 1 1 4 TRP HZ3 H 2.834 -2.171 -8.710 1.00 . A A . 21 TRP HZ3 1 1 9 2794 1 1 4 TRP N N 4.402 3.320 -6.303 1.00 . A A . 21 TRP N 1 1 9 2795 1 1 4 TRP NE1 N 0.538 1.583 -5.993 1.00 . A A . 21 TRP NE1 1 1 9 2796 1 1 4 TRP O O 2.563 5.306 -5.811 1.00 . A A . 21 TRP O 1 1 9 2797 1 1 5 ASP C C 1.907 8.335 -8.637 1.00 . A A . 22 ASP C 1 1 9 2798 1 1 5 ASP CA C 2.342 7.574 -7.388 1.00 . A A . 22 ASP CA 1 1 9 2799 1 1 5 ASP CB C 3.233 8.463 -6.519 1.00 . A A . 22 ASP CB 1 1 9 2800 1 1 5 ASP CG C 4.708 8.261 -6.805 1.00 . A A . 22 ASP CG 1 1 9 2801 1 1 5 ASP H H 3.491 6.289 -8.617 1.00 . A A . 22 ASP H 1 1 9 2802 1 1 5 ASP HA H 1.464 7.300 -6.824 1.00 . A A . 22 ASP HA 1 1 9 2803 1 1 5 ASP HB2 H 2.988 9.499 -6.706 1.00 . A A . 22 ASP HB2 1 1 9 2804 1 1 5 ASP HB3 H 3.051 8.237 -5.479 1.00 . A A . 22 ASP HB3 1 1 9 2805 1 1 5 ASP N N 3.046 6.348 -7.746 1.00 . A A . 22 ASP N 1 1 9 2806 1 1 5 ASP O O 2.593 8.317 -9.659 1.00 . A A . 22 ASP O 1 1 9 2807 1 1 5 ASP OD1 O 5.301 7.323 -6.231 1.00 . A A . 22 ASP OD1 1 1 9 2808 1 1 5 ASP OD2 O 5.270 9.040 -7.603 1.00 . A A . 22 ASP OD2 1 1 9 2809 1 1 6 LYS C C 0.268 8.949 -10.954 1.00 . A A . 23 LYS C 1 1 9 2810 1 1 6 LYS CA C 0.233 9.769 -9.669 1.00 . A A . 23 LYS CA 1 1 9 2811 1 1 6 LYS CB C 1.034 11.060 -9.853 1.00 . A A . 23 LYS CB 1 1 9 2812 1 1 6 LYS CD C 0.328 13.128 -8.615 1.00 . A A . 23 LYS CD 1 1 9 2813 1 1 6 LYS CE C 1.181 14.378 -8.762 1.00 . A A . 23 LYS CE 1 1 9 2814 1 1 6 LYS CG C 1.182 11.872 -8.578 1.00 . A A . 23 LYS CG 1 1 9 2815 1 1 6 LYS H H 0.259 8.978 -7.705 1.00 . A A . 23 LYS H 1 1 9 2816 1 1 6 LYS HA H -0.793 10.021 -9.445 1.00 . A A . 23 LYS HA 1 1 9 2817 1 1 6 LYS HB2 H 2.021 10.808 -10.211 1.00 . A A . 23 LYS HB2 1 1 9 2818 1 1 6 LYS HB3 H 0.539 11.675 -10.591 1.00 . A A . 23 LYS HB3 1 1 9 2819 1 1 6 LYS HD2 H -0.350 13.068 -9.453 1.00 . A A . 23 LYS HD2 1 1 9 2820 1 1 6 LYS HD3 H -0.238 13.195 -7.696 1.00 . A A . 23 LYS HD3 1 1 9 2821 1 1 6 LYS HE2 H 1.708 14.329 -9.703 1.00 . A A . 23 LYS HE2 1 1 9 2822 1 1 6 LYS HE3 H 0.534 15.242 -8.757 1.00 . A A . 23 LYS HE3 1 1 9 2823 1 1 6 LYS HG2 H 0.875 11.265 -7.738 1.00 . A A . 23 LYS HG2 1 1 9 2824 1 1 6 LYS HG3 H 2.218 12.155 -8.460 1.00 . A A . 23 LYS HG3 1 1 9 2825 1 1 6 LYS HZ1 H 3.031 13.965 -7.883 1.00 . A A . 23 LYS HZ1 1 1 9 2826 1 1 6 LYS HZ2 H 1.768 14.142 -6.772 1.00 . A A . 23 LYS HZ2 1 1 9 2827 1 1 6 LYS HZ3 H 2.429 15.505 -7.523 1.00 . A A . 23 LYS HZ3 1 1 9 2828 1 1 6 LYS N N 0.761 9.002 -8.547 1.00 . A A . 23 LYS N 1 1 9 2829 1 1 6 LYS NZ N 2.172 14.507 -7.658 1.00 . A A . 23 LYS NZ 1 1 9 2830 1 1 6 LYS O O 0.830 9.379 -11.961 1.00 . A A . 23 LYS O 1 1 9 2831 1 1 7 SER C C -1.118 5.592 -11.752 1.00 . A A . 24 SER C 1 1 9 2832 1 1 7 SER CA C -0.373 6.884 -12.074 1.00 . A A . 24 SER CA 1 1 9 2833 1 1 7 SER CB C 1.048 6.564 -12.541 1.00 . A A . 24 SER CB 1 1 9 2834 1 1 7 SER H H -0.768 7.479 -10.080 1.00 . A A . 24 SER H 1 1 9 2835 1 1 7 SER HA H -0.896 7.400 -12.865 1.00 . A A . 24 SER HA 1 1 9 2836 1 1 7 SER HB2 H 1.757 6.981 -11.842 1.00 . A A . 24 SER HB2 1 1 9 2837 1 1 7 SER HB3 H 1.175 5.492 -12.588 1.00 . A A . 24 SER HB3 1 1 9 2838 1 1 7 SER HG H 1.320 6.404 -14.475 1.00 . A A . 24 SER HG 1 1 9 2839 1 1 7 SER N N -0.337 7.766 -10.913 1.00 . A A . 24 SER N 1 1 9 2840 1 1 7 SER O O -1.762 5.001 -12.619 1.00 . A A . 24 SER O 1 1 9 2841 1 1 7 SER OG O 1.298 7.111 -13.825 1.00 . A A . 24 SER OG 1 1 9 2842 1 1 8 HIS C C -3.208 4.085 -10.143 1.00 . A A . 25 HIS C 1 1 9 2843 1 1 8 HIS CA C -1.691 3.938 -10.061 1.00 . A A . 25 HIS CA 1 1 9 2844 1 1 8 HIS CB C -1.278 3.592 -8.630 1.00 . A A . 25 HIS CB 1 1 9 2845 1 1 8 HIS CD2 C -2.300 1.881 -6.969 1.00 . A A . 25 HIS CD2 1 1 9 2846 1 1 8 HIS CE1 C -2.311 0.127 -8.284 1.00 . A A . 25 HIS CE1 1 1 9 2847 1 1 8 HIS CG C -1.789 2.264 -8.163 1.00 . A A . 25 HIS CG 1 1 9 2848 1 1 8 HIS H H -0.498 5.675 -9.853 1.00 . A A . 25 HIS H 1 1 9 2849 1 1 8 HIS HA H -1.383 3.139 -10.718 1.00 . A A . 25 HIS HA 1 1 9 2850 1 1 8 HIS HB2 H -0.200 3.573 -8.568 1.00 . A A . 25 HIS HB2 1 1 9 2851 1 1 8 HIS HB3 H -1.659 4.349 -7.959 1.00 . A A . 25 HIS HB3 1 1 9 2852 1 1 8 HIS HD1 H -1.502 1.096 -9.893 1.00 . A A . 25 HIS HD1 1 1 9 2853 1 1 8 HIS HD2 H -2.434 2.507 -6.098 1.00 . A A . 25 HIS HD2 1 1 9 2854 1 1 8 HIS HE1 H -2.448 -0.878 -8.656 1.00 . A A . 25 HIS HE1 1 1 9 2855 1 1 8 HIS N N -1.026 5.160 -10.499 1.00 . A A . 25 HIS N 1 1 9 2856 1 1 8 HIS ND1 N -1.809 1.142 -8.964 1.00 . A A . 25 HIS ND1 1 1 9 2857 1 1 8 HIS NE2 N -2.616 0.549 -7.070 1.00 . A A . 25 HIS NE2 1 1 9 2858 1 1 8 HIS O O -3.739 5.191 -10.048 1.00 . A A . 25 HIS O 1 1 9 2859 1 1 9 GLU C C -5.986 3.344 -9.083 1.00 . A A . 26 GLU C 1 1 9 2860 1 1 9 GLU CA C -5.352 2.969 -10.420 1.00 . A A . 26 GLU CA 1 1 9 2861 1 1 9 GLU CB C -5.861 1.598 -10.871 1.00 . A A . 26 GLU CB 1 1 9 2862 1 1 9 GLU CD C -6.270 -0.819 -10.263 1.00 . A A . 26 GLU CD 1 1 9 2863 1 1 9 GLU CG C -5.851 0.552 -9.769 1.00 . A A . 26 GLU CG 1 1 9 2864 1 1 9 GLU H H -3.417 2.112 -10.391 1.00 . A A . 26 GLU H 1 1 9 2865 1 1 9 GLU HA H -5.632 3.707 -11.156 1.00 . A A . 26 GLU HA 1 1 9 2866 1 1 9 GLU HB2 H -6.874 1.704 -11.230 1.00 . A A . 26 GLU HB2 1 1 9 2867 1 1 9 GLU HB3 H -5.238 1.245 -11.679 1.00 . A A . 26 GLU HB3 1 1 9 2868 1 1 9 GLU HG2 H -4.851 0.482 -9.366 1.00 . A A . 26 GLU HG2 1 1 9 2869 1 1 9 GLU HG3 H -6.531 0.862 -8.990 1.00 . A A . 26 GLU HG3 1 1 9 2870 1 1 9 GLU N N -3.898 2.963 -10.322 1.00 . A A . 26 GLU N 1 1 9 2871 1 1 9 GLU O O -7.051 3.959 -9.038 1.00 . A A . 26 GLU O 1 1 9 2872 1 1 9 GLU OE1 O -5.641 -1.325 -11.216 1.00 . A A . 26 GLU OE1 1 1 9 2873 1 1 9 GLU OE2 O -7.227 -1.386 -9.695 1.00 . A A . 26 GLU OE2 1 1 9 2874 1 1 10 LYS C C -5.180 4.537 -6.108 1.00 . A A . 27 LYS C 1 1 9 2875 1 1 10 LYS CA C -5.818 3.263 -6.655 1.00 . A A . 27 LYS CA 1 1 9 2876 1 1 10 LYS CB C -5.532 2.092 -5.713 1.00 . A A . 27 LYS CB 1 1 9 2877 1 1 10 LYS CD C -6.002 -0.295 -5.086 1.00 . A A . 27 LYS CD 1 1 9 2878 1 1 10 LYS CE C -4.748 -1.080 -5.437 1.00 . A A . 27 LYS CE 1 1 9 2879 1 1 10 LYS CG C -6.263 0.815 -6.091 1.00 . A A . 27 LYS CG 1 1 9 2880 1 1 10 LYS H H -4.478 2.479 -8.095 1.00 . A A . 27 LYS H 1 1 9 2881 1 1 10 LYS HA H -6.885 3.409 -6.721 1.00 . A A . 27 LYS HA 1 1 9 2882 1 1 10 LYS HB2 H -4.471 1.890 -5.721 1.00 . A A . 27 LYS HB2 1 1 9 2883 1 1 10 LYS HB3 H -5.829 2.370 -4.712 1.00 . A A . 27 LYS HB3 1 1 9 2884 1 1 10 LYS HD2 H -5.879 0.140 -4.106 1.00 . A A . 27 LYS HD2 1 1 9 2885 1 1 10 LYS HD3 H -6.848 -0.968 -5.079 1.00 . A A . 27 LYS HD3 1 1 9 2886 1 1 10 LYS HE2 H -4.572 -0.997 -6.499 1.00 . A A . 27 LYS HE2 1 1 9 2887 1 1 10 LYS HE3 H -3.912 -0.656 -4.900 1.00 . A A . 27 LYS HE3 1 1 9 2888 1 1 10 LYS HG2 H -7.324 1.015 -6.122 1.00 . A A . 27 LYS HG2 1 1 9 2889 1 1 10 LYS HG3 H -5.926 0.493 -7.066 1.00 . A A . 27 LYS HG3 1 1 9 2890 1 1 10 LYS HZ1 H -3.955 -2.894 -4.772 1.00 . A A . 27 LYS HZ1 1 1 9 2891 1 1 10 LYS HZ2 H -5.203 -3.065 -5.900 1.00 . A A . 27 LYS HZ2 1 1 9 2892 1 1 10 LYS HZ3 H -5.559 -2.635 -4.303 1.00 . A A . 27 LYS HZ3 1 1 9 2893 1 1 10 LYS N N -5.322 2.968 -7.995 1.00 . A A . 27 LYS N 1 1 9 2894 1 1 10 LYS NZ N -4.876 -2.519 -5.078 1.00 . A A . 27 LYS NZ 1 1 9 2895 1 1 10 LYS O O -5.535 5.004 -5.026 1.00 . A A . 27 LYS O 1 1 9 2896 1 1 11 TYR C C -4.548 7.439 -6.199 1.00 . A A . 28 TYR C 1 1 9 2897 1 1 11 TYR CA C -3.552 6.312 -6.453 1.00 . A A . 28 TYR CA 1 1 9 2898 1 1 11 TYR CB C -2.544 6.738 -7.522 1.00 . A A . 28 TYR CB 1 1 9 2899 1 1 11 TYR CD1 C -2.427 9.255 -7.357 1.00 . A A . 28 TYR CD1 1 1 9 2900 1 1 11 TYR CD2 C -3.402 8.300 -9.311 1.00 . A A . 28 TYR CD2 1 1 9 2901 1 1 11 TYR CE1 C -2.655 10.522 -7.857 1.00 . A A . 28 TYR CE1 1 1 9 2902 1 1 11 TYR CE2 C -3.633 9.563 -9.819 1.00 . A A . 28 TYR CE2 1 1 9 2903 1 1 11 TYR CG C -2.795 8.123 -8.073 1.00 . A A . 28 TYR CG 1 1 9 2904 1 1 11 TYR CZ C -3.258 10.671 -9.088 1.00 . A A . 28 TYR CZ 1 1 9 2905 1 1 11 TYR H H -4.000 4.673 -7.716 1.00 . A A . 28 TYR H 1 1 9 2906 1 1 11 TYR HA H -3.022 6.101 -5.536 1.00 . A A . 28 TYR HA 1 1 9 2907 1 1 11 TYR HB2 H -1.552 6.726 -7.096 1.00 . A A . 28 TYR HB2 1 1 9 2908 1 1 11 TYR HB3 H -2.586 6.040 -8.345 1.00 . A A . 28 TYR HB3 1 1 9 2909 1 1 11 TYR HD1 H -1.955 9.135 -6.392 1.00 . A A . 28 TYR HD1 1 1 9 2910 1 1 11 TYR HD2 H -3.695 7.429 -9.880 1.00 . A A . 28 TYR HD2 1 1 9 2911 1 1 11 TYR HE1 H -2.361 11.390 -7.285 1.00 . A A . 28 TYR HE1 1 1 9 2912 1 1 11 TYR HE2 H -4.106 9.680 -10.783 1.00 . A A . 28 TYR HE2 1 1 9 2913 1 1 11 TYR HH H -3.871 11.862 -10.468 1.00 . A A . 28 TYR HH 1 1 9 2914 1 1 11 TYR N N -4.239 5.093 -6.863 1.00 . A A . 28 TYR N 1 1 9 2915 1 1 11 TYR O O -5.574 7.539 -6.871 1.00 . A A . 28 TYR O 1 1 9 2916 1 1 11 TYR OH O -3.488 11.932 -9.590 1.00 . A A . 28 TYR OH 1 1 9 2917 1 1 12 ASP C C -4.313 10.715 -4.858 1.00 . A A . 29 ASP C 1 1 9 2918 1 1 12 ASP CA C -5.101 9.409 -4.881 1.00 . A A . 29 ASP CA 1 1 9 2919 1 1 12 ASP CB C -5.762 9.174 -3.521 1.00 . A A . 29 ASP CB 1 1 9 2920 1 1 12 ASP CG C -7.093 8.459 -3.641 1.00 . A A . 29 ASP CG 1 1 9 2921 1 1 12 ASP H H -3.403 8.154 -4.724 1.00 . A A . 29 ASP H 1 1 9 2922 1 1 12 ASP HA H -5.868 9.479 -5.636 1.00 . A A . 29 ASP HA 1 1 9 2923 1 1 12 ASP HB2 H -5.106 8.573 -2.909 1.00 . A A . 29 ASP HB2 1 1 9 2924 1 1 12 ASP HB3 H -5.926 10.126 -3.039 1.00 . A A . 29 ASP HB3 1 1 9 2925 1 1 12 ASP N N -4.236 8.286 -5.224 1.00 . A A . 29 ASP N 1 1 9 2926 1 1 12 ASP O O -3.239 10.793 -4.262 1.00 . A A . 29 ASP O 1 1 9 2927 1 1 12 ASP OD1 O -7.091 7.215 -3.758 1.00 . A A . 29 ASP OD1 1 1 9 2928 1 1 12 ASP OD2 O -8.138 9.143 -3.617 1.00 . A A . 29 ASP OD2 1 1 9 2929 1 1 13 TRP C C -3.961 13.589 -4.165 1.00 . A A . 30 TRP C 1 1 9 2930 1 1 13 TRP CA C -4.200 13.040 -5.567 1.00 . A A . 30 TRP CA 1 1 9 2931 1 1 13 TRP CB C -5.047 14.024 -6.375 1.00 . A A . 30 TRP CB 1 1 9 2932 1 1 13 TRP CD1 C -4.209 15.098 -8.547 1.00 . A A . 30 TRP CD1 1 1 9 2933 1 1 13 TRP CD2 C -3.314 15.965 -6.685 1.00 . A A . 30 TRP CD2 1 1 9 2934 1 1 13 TRP CE2 C -2.774 16.637 -7.799 1.00 . A A . 30 TRP CE2 1 1 9 2935 1 1 13 TRP CE3 C -2.899 16.341 -5.405 1.00 . A A . 30 TRP CE3 1 1 9 2936 1 1 13 TRP CG C -4.230 14.984 -7.186 1.00 . A A . 30 TRP CG 1 1 9 2937 1 1 13 TRP CH2 C -1.453 18.010 -6.404 1.00 . A A . 30 TRP CH2 1 1 9 2938 1 1 13 TRP CZ2 C -1.841 17.662 -7.669 1.00 . A A . 30 TRP CZ2 1 1 9 2939 1 1 13 TRP CZ3 C -1.973 17.359 -5.278 1.00 . A A . 30 TRP CZ3 1 1 9 2940 1 1 13 TRP H H -5.713 11.613 -5.967 1.00 . A A . 30 TRP H 1 1 9 2941 1 1 13 TRP HA H -3.247 12.911 -6.058 1.00 . A A . 30 TRP HA 1 1 9 2942 1 1 13 TRP HB2 H -5.681 13.472 -7.053 1.00 . A A . 30 TRP HB2 1 1 9 2943 1 1 13 TRP HB3 H -5.663 14.598 -5.699 1.00 . A A . 30 TRP HB3 1 1 9 2944 1 1 13 TRP HD1 H -4.797 14.489 -9.216 1.00 . A A . 30 TRP HD1 1 1 9 2945 1 1 13 TRP HE1 H -3.147 16.361 -9.845 1.00 . A A . 30 TRP HE1 1 1 9 2946 1 1 13 TRP HE3 H -3.289 15.851 -4.525 1.00 . A A . 30 TRP HE3 1 1 9 2947 1 1 13 TRP HH2 H -0.732 18.799 -6.257 1.00 . A A . 30 TRP HH2 1 1 9 2948 1 1 13 TRP HZ2 H -1.432 18.175 -8.527 1.00 . A A . 30 TRP HZ2 1 1 9 2949 1 1 13 TRP HZ3 H -1.640 17.663 -4.296 1.00 . A A . 30 TRP HZ3 1 1 9 2950 1 1 13 TRP N N -4.854 11.737 -5.511 1.00 . A A . 30 TRP N 1 1 9 2951 1 1 13 TRP NE1 N -3.336 16.089 -8.922 1.00 . A A . 30 TRP NE1 1 1 9 2952 1 1 13 TRP O O -2.818 13.742 -3.736 1.00 . A A . 30 TRP O 1 1 9 2953 1 1 14 GLU C C -4.456 13.349 -1.130 1.00 . A A . 31 GLU C 1 1 9 2954 1 1 14 GLU CA C -4.952 14.417 -2.102 1.00 . A A . 31 GLU CA 1 1 9 2955 1 1 14 GLU CB C -6.311 14.948 -1.643 1.00 . A A . 31 GLU CB 1 1 9 2956 1 1 14 GLU CD C -8.083 16.680 -2.134 1.00 . A A . 31 GLU CD 1 1 9 2957 1 1 14 GLU CG C -6.600 16.365 -2.110 1.00 . A A . 31 GLU CG 1 1 9 2958 1 1 14 GLU H H -5.930 13.740 -3.852 1.00 . A A . 31 GLU H 1 1 9 2959 1 1 14 GLU HA H -4.243 15.231 -2.114 1.00 . A A . 31 GLU HA 1 1 9 2960 1 1 14 GLU HB2 H -7.086 14.299 -2.026 1.00 . A A . 31 GLU HB2 1 1 9 2961 1 1 14 GLU HB3 H -6.344 14.934 -0.563 1.00 . A A . 31 GLU HB3 1 1 9 2962 1 1 14 GLU HG2 H -6.112 17.057 -1.440 1.00 . A A . 31 GLU HG2 1 1 9 2963 1 1 14 GLU HG3 H -6.204 16.490 -3.107 1.00 . A A . 31 GLU HG3 1 1 9 2964 1 1 14 GLU N N -5.046 13.884 -3.456 1.00 . A A . 31 GLU N 1 1 9 2965 1 1 14 GLU O O -3.514 13.575 -0.370 1.00 . A A . 31 GLU O 1 1 9 2966 1 1 14 GLU OE1 O -8.819 16.011 -2.890 1.00 . A A . 31 GLU OE1 1 1 9 2967 1 1 14 GLU OE2 O -8.508 17.595 -1.399 1.00 . A A . 31 GLU OE2 1 1 9 2968 1 1 15 LEU C C -3.263 10.698 -0.484 1.00 . A A . 32 LEU C 1 1 9 2969 1 1 15 LEU CA C -4.725 11.083 -0.282 1.00 . A A . 32 LEU CA 1 1 9 2970 1 1 15 LEU CB C -5.624 9.873 -0.541 1.00 . A A . 32 LEU CB 1 1 9 2971 1 1 15 LEU CD1 C -7.017 10.197 1.517 1.00 . A A . 32 LEU CD1 1 1 9 2972 1 1 15 LEU CD2 C -7.082 8.014 0.297 1.00 . A A . 32 LEU CD2 1 1 9 2973 1 1 15 LEU CG C -6.214 9.198 0.698 1.00 . A A . 32 LEU CG 1 1 9 2974 1 1 15 LEU H H -5.842 12.067 -1.787 1.00 . A A . 32 LEU H 1 1 9 2975 1 1 15 LEU HA H -4.860 11.411 0.738 1.00 . A A . 32 LEU HA 1 1 9 2976 1 1 15 LEU HB2 H -6.443 10.197 -1.163 1.00 . A A . 32 LEU HB2 1 1 9 2977 1 1 15 LEU HB3 H -5.039 9.136 -1.073 1.00 . A A . 32 LEU HB3 1 1 9 2978 1 1 15 LEU HD11 H -7.151 11.104 0.949 1.00 . A A . 32 LEU HD11 1 1 9 2979 1 1 15 LEU HD12 H -6.487 10.420 2.432 1.00 . A A . 32 LEU HD12 1 1 9 2980 1 1 15 LEU HD13 H -7.982 9.774 1.755 1.00 . A A . 32 LEU HD13 1 1 9 2981 1 1 15 LEU HD21 H -8.095 8.351 0.132 1.00 . A A . 32 LEU HD21 1 1 9 2982 1 1 15 LEU HD22 H -7.073 7.278 1.088 1.00 . A A . 32 LEU HD22 1 1 9 2983 1 1 15 LEU HD23 H -6.695 7.575 -0.610 1.00 . A A . 32 LEU HD23 1 1 9 2984 1 1 15 LEU HG H -5.409 8.829 1.318 1.00 . A A . 32 LEU HG 1 1 9 2985 1 1 15 LEU N N -5.099 12.187 -1.160 1.00 . A A . 32 LEU N 1 1 9 2986 1 1 15 LEU O O -2.667 10.022 0.355 1.00 . A A . 32 LEU O 1 1 9 2987 1 1 16 TRP C C -0.418 10.992 -0.676 1.00 . A A . 33 TRP C 1 1 9 2988 1 1 16 TRP CA C -1.297 10.836 -1.912 1.00 . A A . 33 TRP CA 1 1 9 2989 1 1 16 TRP CB C -0.795 11.753 -3.029 1.00 . A A . 33 TRP CB 1 1 9 2990 1 1 16 TRP CD1 C 1.429 11.015 -4.067 1.00 . A A . 33 TRP CD1 1 1 9 2991 1 1 16 TRP CD2 C 1.636 12.508 -2.410 1.00 . A A . 33 TRP CD2 1 1 9 2992 1 1 16 TRP CE2 C 2.921 12.188 -2.891 1.00 . A A . 33 TRP CE2 1 1 9 2993 1 1 16 TRP CE3 C 1.518 13.430 -1.367 1.00 . A A . 33 TRP CE3 1 1 9 2994 1 1 16 TRP CG C 0.696 11.747 -3.177 1.00 . A A . 33 TRP CG 1 1 9 2995 1 1 16 TRP CH2 C 3.931 13.656 -1.340 1.00 . A A . 33 TRP CH2 1 1 9 2996 1 1 16 TRP CZ2 C 4.076 12.757 -2.361 1.00 . A A . 33 TRP CZ2 1 1 9 2997 1 1 16 TRP CZ3 C 2.665 13.993 -0.842 1.00 . A A . 33 TRP CZ3 1 1 9 2998 1 1 16 TRP H H -3.217 11.669 -2.231 1.00 . A A . 33 TRP H 1 1 9 2999 1 1 16 TRP HA H -1.245 9.811 -2.249 1.00 . A A . 33 TRP HA 1 1 9 3000 1 1 16 TRP HB2 H -1.225 11.435 -3.967 1.00 . A A . 33 TRP HB2 1 1 9 3001 1 1 16 TRP HB3 H -1.107 12.766 -2.819 1.00 . A A . 33 TRP HB3 1 1 9 3002 1 1 16 TRP HD1 H 1.004 10.334 -4.789 1.00 . A A . 33 TRP HD1 1 1 9 3003 1 1 16 TRP HE1 H 3.494 10.873 -4.421 1.00 . A A . 33 TRP HE1 1 1 9 3004 1 1 16 TRP HE3 H 0.551 13.702 -0.969 1.00 . A A . 33 TRP HE3 1 1 9 3005 1 1 16 TRP HH2 H 4.800 14.120 -0.900 1.00 . A A . 33 TRP HH2 1 1 9 3006 1 1 16 TRP HZ2 H 5.059 12.508 -2.735 1.00 . A A . 33 TRP HZ2 1 1 9 3007 1 1 16 TRP HZ3 H 2.593 14.707 -0.035 1.00 . A A . 33 TRP HZ3 1 1 9 3008 1 1 16 TRP N N -2.691 11.134 -1.601 1.00 . A A . 33 TRP N 1 1 9 3009 1 1 16 TRP NE1 N 2.767 11.275 -3.900 1.00 . A A . 33 TRP NE1 1 1 9 3010 1 1 16 TRP O O 0.540 10.243 -0.485 1.00 . A A . 33 TRP O 1 1 9 3011 1 1 17 ASP C C 0.302 10.920 2.119 1.00 . A A . 34 ASP C 1 1 9 3012 1 1 17 ASP CA C 0.009 12.222 1.380 1.00 . A A . 34 ASP CA 1 1 9 3013 1 1 17 ASP CB C -0.757 13.180 2.294 1.00 . A A . 34 ASP CB 1 1 9 3014 1 1 17 ASP CG C -0.678 14.618 1.822 1.00 . A A . 34 ASP CG 1 1 9 3015 1 1 17 ASP H H -1.525 12.533 -0.045 1.00 . A A . 34 ASP H 1 1 9 3016 1 1 17 ASP HA H 0.946 12.680 1.099 1.00 . A A . 34 ASP HA 1 1 9 3017 1 1 17 ASP HB2 H -1.796 12.887 2.322 1.00 . A A . 34 ASP HB2 1 1 9 3018 1 1 17 ASP HB3 H -0.345 13.123 3.291 1.00 . A A . 34 ASP HB3 1 1 9 3019 1 1 17 ASP N N -0.750 11.969 0.161 1.00 . A A . 34 ASP N 1 1 9 3020 1 1 17 ASP O O 1.398 10.723 2.644 1.00 . A A . 34 ASP O 1 1 9 3021 1 1 17 ASP OD1 O 0.326 14.974 1.169 1.00 . A A . 34 ASP OD1 1 1 9 3022 1 1 17 ASP OD2 O -1.619 15.388 2.105 1.00 . A A . 34 ASP OD2 1 1 9 3023 1 1 18 LYS C C -0.312 7.626 1.819 1.00 . A A . 35 LYS C 1 1 9 3024 1 1 18 LYS CA C -0.536 8.747 2.829 1.00 . A A . 35 LYS CA 1 1 9 3025 1 1 18 LYS CB C -1.774 8.445 3.677 1.00 . A A . 35 LYS CB 1 1 9 3026 1 1 18 LYS CD C -4.195 7.791 3.525 1.00 . A A . 35 LYS CD 1 1 9 3027 1 1 18 LYS CE C -4.069 6.336 3.100 1.00 . A A . 35 LYS CE 1 1 9 3028 1 1 18 LYS CG C -3.083 8.642 2.933 1.00 . A A . 35 LYS CG 1 1 9 3029 1 1 18 LYS H H -1.537 10.246 1.719 1.00 . A A . 35 LYS H 1 1 9 3030 1 1 18 LYS HA H 0.326 8.810 3.476 1.00 . A A . 35 LYS HA 1 1 9 3031 1 1 18 LYS HB2 H -1.725 7.419 4.012 1.00 . A A . 35 LYS HB2 1 1 9 3032 1 1 18 LYS HB3 H -1.773 9.096 4.539 1.00 . A A . 35 LYS HB3 1 1 9 3033 1 1 18 LYS HD2 H -4.143 7.845 4.602 1.00 . A A . 35 LYS HD2 1 1 9 3034 1 1 18 LYS HD3 H -5.148 8.174 3.189 1.00 . A A . 35 LYS HD3 1 1 9 3035 1 1 18 LYS HE2 H -4.825 6.124 2.360 1.00 . A A . 35 LYS HE2 1 1 9 3036 1 1 18 LYS HE3 H -3.091 6.183 2.669 1.00 . A A . 35 LYS HE3 1 1 9 3037 1 1 18 LYS HG2 H -3.369 9.681 2.994 1.00 . A A . 35 LYS HG2 1 1 9 3038 1 1 18 LYS HG3 H -2.943 8.365 1.897 1.00 . A A . 35 LYS HG3 1 1 9 3039 1 1 18 LYS HZ1 H -3.469 4.710 4.267 1.00 . A A . 35 LYS HZ1 1 1 9 3040 1 1 18 LYS HZ2 H -5.147 4.899 4.167 1.00 . A A . 35 LYS HZ2 1 1 9 3041 1 1 18 LYS HZ3 H -4.236 5.937 5.144 1.00 . A A . 35 LYS HZ3 1 1 9 3042 1 1 18 LYS N N -0.686 10.032 2.156 1.00 . A A . 35 LYS N 1 1 9 3043 1 1 18 LYS NZ N -4.242 5.406 4.250 1.00 . A A . 35 LYS NZ 1 1 9 3044 1 1 18 LYS O O 0.177 6.552 2.169 1.00 . A A . 35 LYS O 1 1 9 3045 1 1 19 TRP C C 0.844 7.054 -1.180 1.00 . A A . 36 TRP C 1 1 9 3046 1 1 19 TRP CA C -0.509 6.897 -0.493 1.00 . A A . 36 TRP CA 1 1 9 3047 1 1 19 TRP CB C -1.634 7.030 -1.520 1.00 . A A . 36 TRP CB 1 1 9 3048 1 1 19 TRP CD1 C -3.821 6.639 -0.243 1.00 . A A . 36 TRP CD1 1 1 9 3049 1 1 19 TRP CD2 C -3.286 5.002 -1.675 1.00 . A A . 36 TRP CD2 1 1 9 3050 1 1 19 TRP CE2 C -4.499 4.667 -1.042 1.00 . A A . 36 TRP CE2 1 1 9 3051 1 1 19 TRP CE3 C -2.753 4.121 -2.620 1.00 . A A . 36 TRP CE3 1 1 9 3052 1 1 19 TRP CG C -2.870 6.267 -1.150 1.00 . A A . 36 TRP CG 1 1 9 3053 1 1 19 TRP CH2 C -4.640 2.644 -2.253 1.00 . A A . 36 TRP CH2 1 1 9 3054 1 1 19 TRP CZ2 C -5.185 3.488 -1.325 1.00 . A A . 36 TRP CZ2 1 1 9 3055 1 1 19 TRP CZ3 C -3.435 2.951 -2.898 1.00 . A A . 36 TRP CZ3 1 1 9 3056 1 1 19 TRP H H -1.057 8.759 0.350 1.00 . A A . 36 TRP H 1 1 9 3057 1 1 19 TRP HA H -0.559 5.916 -0.043 1.00 . A A . 36 TRP HA 1 1 9 3058 1 1 19 TRP HB2 H -1.902 8.071 -1.619 1.00 . A A . 36 TRP HB2 1 1 9 3059 1 1 19 TRP HB3 H -1.287 6.660 -2.474 1.00 . A A . 36 TRP HB3 1 1 9 3060 1 1 19 TRP HD1 H -3.792 7.553 0.329 1.00 . A A . 36 TRP HD1 1 1 9 3061 1 1 19 TRP HE1 H -5.595 5.719 0.405 1.00 . A A . 36 TRP HE1 1 1 9 3062 1 1 19 TRP HE3 H -1.826 4.340 -3.127 1.00 . A A . 36 TRP HE3 1 1 9 3063 1 1 19 TRP HH2 H -5.138 1.719 -2.502 1.00 . A A . 36 TRP HH2 1 1 9 3064 1 1 19 TRP HZ2 H -6.115 3.237 -0.837 1.00 . A A . 36 TRP HZ2 1 1 9 3065 1 1 19 TRP HZ3 H -3.038 2.258 -3.625 1.00 . A A . 36 TRP HZ3 1 1 9 3066 1 1 19 TRP N N -0.672 7.884 0.567 1.00 . A A . 36 TRP N 1 1 9 3067 1 1 19 TRP NE1 N -4.804 5.681 -0.173 1.00 . A A . 36 TRP NE1 1 1 9 3068 1 1 19 TRP O O 1.072 6.501 -2.256 1.00 . A A . 36 TRP O 1 1 9 3069 1 1 20 CYS C C 2.986 8.811 -2.416 1.00 . A A . 37 CYS C 1 1 9 3070 1 1 20 CYS CA C 3.067 8.040 -1.102 1.00 . A A . 37 CYS CA 1 1 9 3071 1 1 20 CYS CB C 3.788 6.709 -1.322 1.00 . A A . 37 CYS CB 1 1 9 3072 1 1 20 CYS H H 1.496 8.224 0.304 1.00 . A A . 37 CYS H 1 1 9 3073 1 1 20 CYS HA H 3.625 8.628 -0.388 1.00 . A A . 37 CYS HA 1 1 9 3074 1 1 20 CYS HB2 H 3.356 6.211 -2.178 1.00 . A A . 37 CYS HB2 1 1 9 3075 1 1 20 CYS HB3 H 4.834 6.902 -1.514 1.00 . A A . 37 CYS HB3 1 1 9 3076 1 1 20 CYS N N 1.737 7.810 -0.551 1.00 . A A . 37 CYS N 1 1 9 3077 1 1 20 CYS O O 3.927 8.802 -3.211 1.00 . A A . 37 CYS O 1 1 9 3078 1 1 20 CYS SG S 3.686 5.565 0.092 1.00 . A A . 37 CYS SG 1 1 10 3079 1 1 1 ASN C C 3.663 0.588 -1.899 1.00 . A A . 18 ASN C 1 1 10 3080 1 1 1 ASN CA C 2.467 -0.358 -1.953 1.00 . A A . 18 ASN CA 1 1 10 3081 1 1 1 ASN CB C 1.585 -0.014 -3.156 1.00 . A A . 18 ASN CB 1 1 10 3082 1 1 1 ASN CG C 0.108 -0.037 -2.815 1.00 . A A . 18 ASN CG 1 1 10 3083 1 1 1 ASN H1 H 1.754 0.516 -0.162 1.00 . A A . 18 ASN H1 1 1 10 3084 1 1 1 ASN HA H 2.827 -1.370 -2.060 1.00 . A A . 18 ASN HA 1 1 10 3085 1 1 1 ASN HB2 H 1.838 0.975 -3.509 1.00 . A A . 18 ASN HB2 1 1 10 3086 1 1 1 ASN HB3 H 1.766 -0.731 -3.943 1.00 . A A . 18 ASN HB3 1 1 10 3087 1 1 1 ASN HD21 H -0.116 -1.755 -3.791 1.00 . A A . 18 ASN HD21 1 1 10 3088 1 1 1 ASN HD22 H -1.546 -1.112 -3.063 1.00 . A A . 18 ASN HD22 1 1 10 3089 1 1 1 ASN N N 1.691 -0.286 -0.721 1.00 . A A . 18 ASN N 1 1 10 3090 1 1 1 ASN ND2 N -0.588 -1.073 -3.269 1.00 . A A . 18 ASN ND2 1 1 10 3091 1 1 1 ASN O O 4.814 0.151 -1.877 1.00 . A A . 18 ASN O 1 1 10 3092 1 1 1 ASN OD1 O -0.401 0.866 -2.151 1.00 . A A . 18 ASN OD1 1 1 10 3093 1 1 2 CYS C C 5.471 2.658 -2.917 1.00 . A A . 19 CYS C 1 1 10 3094 1 1 2 CYS CA C 4.433 2.896 -1.824 1.00 . A A . 19 CYS CA 1 1 10 3095 1 1 2 CYS CB C 5.111 2.886 -0.452 1.00 . A A . 19 CYS CB 1 1 10 3096 1 1 2 CYS H H 2.445 2.174 -1.895 1.00 . A A . 19 CYS H 1 1 10 3097 1 1 2 CYS HA H 3.976 3.860 -1.983 1.00 . A A . 19 CYS HA 1 1 10 3098 1 1 2 CYS HB2 H 4.511 2.304 0.233 1.00 . A A . 19 CYS HB2 1 1 10 3099 1 1 2 CYS HB3 H 6.086 2.431 -0.544 1.00 . A A . 19 CYS HB3 1 1 10 3100 1 1 2 CYS N N 3.382 1.887 -1.876 1.00 . A A . 19 CYS N 1 1 10 3101 1 1 2 CYS O O 6.642 3.003 -2.762 1.00 . A A . 19 CYS O 1 1 10 3102 1 1 2 CYS SG S 5.336 4.540 0.278 1.00 . A A . 19 CYS SG 1 1 10 3103 1 1 3 ASP C C 5.466 2.520 -6.398 1.00 . A A . 20 ASP C 1 1 10 3104 1 1 3 ASP CA C 5.921 1.783 -5.143 1.00 . A A . 20 ASP CA 1 1 10 3105 1 1 3 ASP CB C 5.974 0.278 -5.412 1.00 . A A . 20 ASP CB 1 1 10 3106 1 1 3 ASP CG C 6.985 -0.084 -6.482 1.00 . A A . 20 ASP CG 1 1 10 3107 1 1 3 ASP H H 4.086 1.814 -4.087 1.00 . A A . 20 ASP H 1 1 10 3108 1 1 3 ASP HA H 6.909 2.126 -4.877 1.00 . A A . 20 ASP HA 1 1 10 3109 1 1 3 ASP HB2 H 6.245 -0.235 -4.500 1.00 . A A . 20 ASP HB2 1 1 10 3110 1 1 3 ASP HB3 H 4.999 -0.058 -5.733 1.00 . A A . 20 ASP HB3 1 1 10 3111 1 1 3 ASP N N 5.032 2.066 -4.022 1.00 . A A . 20 ASP N 1 1 10 3112 1 1 3 ASP O O 6.053 2.365 -7.469 1.00 . A A . 20 ASP O 1 1 10 3113 1 1 3 ASP OD1 O 7.987 0.648 -6.623 1.00 . A A . 20 ASP OD1 1 1 10 3114 1 1 3 ASP OD2 O 6.773 -1.098 -7.180 1.00 . A A . 20 ASP OD2 1 1 10 3115 1 1 4 TRP C C 3.108 5.303 -6.894 1.00 . A A . 21 TRP C 1 1 10 3116 1 1 4 TRP CA C 3.881 4.082 -7.382 1.00 . A A . 21 TRP CA 1 1 10 3117 1 1 4 TRP CB C 2.973 3.198 -8.238 1.00 . A A . 21 TRP CB 1 1 10 3118 1 1 4 TRP CD1 C 1.170 2.690 -6.488 1.00 . A A . 21 TRP CD1 1 1 10 3119 1 1 4 TRP CD2 C 2.017 0.875 -7.491 1.00 . A A . 21 TRP CD2 1 1 10 3120 1 1 4 TRP CE2 C 1.044 0.462 -6.559 1.00 . A A . 21 TRP CE2 1 1 10 3121 1 1 4 TRP CE3 C 2.684 -0.095 -8.244 1.00 . A A . 21 TRP CE3 1 1 10 3122 1 1 4 TRP CG C 2.081 2.304 -7.430 1.00 . A A . 21 TRP CG 1 1 10 3123 1 1 4 TRP CH2 C 1.395 -1.808 -7.112 1.00 . A A . 21 TRP CH2 1 1 10 3124 1 1 4 TRP CZ2 C 0.726 -0.879 -6.362 1.00 . A A . 21 TRP CZ2 1 1 10 3125 1 1 4 TRP CZ3 C 2.367 -1.425 -8.046 1.00 . A A . 21 TRP CZ3 1 1 10 3126 1 1 4 TRP H H 3.990 3.404 -5.380 1.00 . A A . 21 TRP H 1 1 10 3127 1 1 4 TRP HA H 4.714 4.415 -7.983 1.00 . A A . 21 TRP HA 1 1 10 3128 1 1 4 TRP HB2 H 2.346 3.825 -8.854 1.00 . A A . 21 TRP HB2 1 1 10 3129 1 1 4 TRP HB3 H 3.585 2.573 -8.872 1.00 . A A . 21 TRP HB3 1 1 10 3130 1 1 4 TRP HD1 H 0.983 3.715 -6.208 1.00 . A A . 21 TRP HD1 1 1 10 3131 1 1 4 TRP HE1 H -0.150 1.604 -5.268 1.00 . A A . 21 TRP HE1 1 1 10 3132 1 1 4 TRP HE3 H 3.436 0.180 -8.969 1.00 . A A . 21 TRP HE3 1 1 10 3133 1 1 4 TRP HH2 H 1.180 -2.858 -6.990 1.00 . A A . 21 TRP HH2 1 1 10 3134 1 1 4 TRP HZ2 H -0.021 -1.190 -5.646 1.00 . A A . 21 TRP HZ2 1 1 10 3135 1 1 4 TRP HZ3 H 2.873 -2.189 -8.618 1.00 . A A . 21 TRP HZ3 1 1 10 3136 1 1 4 TRP N N 4.416 3.321 -6.259 1.00 . A A . 21 TRP N 1 1 10 3137 1 1 4 TRP NE1 N 0.544 1.587 -5.960 1.00 . A A . 21 TRP NE1 1 1 10 3138 1 1 4 TRP O O 2.568 5.306 -5.788 1.00 . A A . 21 TRP O 1 1 10 3139 1 1 5 ASP C C 1.922 8.318 -8.634 1.00 . A A . 22 ASP C 1 1 10 3140 1 1 5 ASP CA C 2.352 7.565 -7.379 1.00 . A A . 22 ASP CA 1 1 10 3141 1 1 5 ASP CB C 3.236 8.461 -6.509 1.00 . A A . 22 ASP CB 1 1 10 3142 1 1 5 ASP CG C 4.713 8.259 -6.784 1.00 . A A . 22 ASP CG 1 1 10 3143 1 1 5 ASP H H 3.511 6.275 -8.594 1.00 . A A . 22 ASP H 1 1 10 3144 1 1 5 ASP HA H 1.470 7.292 -6.819 1.00 . A A . 22 ASP HA 1 1 10 3145 1 1 5 ASP HB2 H 2.990 9.495 -6.703 1.00 . A A . 22 ASP HB2 1 1 10 3146 1 1 5 ASP HB3 H 3.048 8.239 -5.469 1.00 . A A . 22 ASP HB3 1 1 10 3147 1 1 5 ASP N N 3.060 6.338 -7.726 1.00 . A A . 22 ASP N 1 1 10 3148 1 1 5 ASP O O 2.615 8.297 -9.651 1.00 . A A . 22 ASP O 1 1 10 3149 1 1 5 ASP OD1 O 5.150 8.552 -7.916 1.00 . A A . 22 ASP OD1 1 1 10 3150 1 1 5 ASP OD2 O 5.431 7.807 -5.867 1.00 . A A . 22 ASP OD2 1 1 10 3151 1 1 6 LYS C C 0.297 8.916 -10.965 1.00 . A A . 23 LYS C 1 1 10 3152 1 1 6 LYS CA C 0.251 9.743 -9.684 1.00 . A A . 23 LYS CA 1 1 10 3153 1 1 6 LYS CB C 1.050 11.035 -9.869 1.00 . A A . 23 LYS CB 1 1 10 3154 1 1 6 LYS CD C 0.331 13.107 -8.644 1.00 . A A . 23 LYS CD 1 1 10 3155 1 1 6 LYS CE C 1.182 14.358 -8.790 1.00 . A A . 23 LYS CE 1 1 10 3156 1 1 6 LYS CG C 1.187 11.853 -8.597 1.00 . A A . 23 LYS CG 1 1 10 3157 1 1 6 LYS H H 0.267 8.962 -7.716 1.00 . A A . 23 LYS H 1 1 10 3158 1 1 6 LYS HA H -0.777 9.993 -9.467 1.00 . A A . 23 LYS HA 1 1 10 3159 1 1 6 LYS HB2 H 2.040 10.785 -10.220 1.00 . A A . 23 LYS HB2 1 1 10 3160 1 1 6 LYS HB3 H 0.557 11.645 -10.612 1.00 . A A . 23 LYS HB3 1 1 10 3161 1 1 6 LYS HD2 H -0.341 13.042 -9.488 1.00 . A A . 23 LYS HD2 1 1 10 3162 1 1 6 LYS HD3 H -0.242 13.176 -7.730 1.00 . A A . 23 LYS HD3 1 1 10 3163 1 1 6 LYS HE2 H 1.717 14.307 -9.726 1.00 . A A . 23 LYS HE2 1 1 10 3164 1 1 6 LYS HE3 H 0.533 15.221 -8.793 1.00 . A A . 23 LYS HE3 1 1 10 3165 1 1 6 LYS HG2 H 0.877 11.250 -7.756 1.00 . A A . 23 LYS HG2 1 1 10 3166 1 1 6 LYS HG3 H 2.222 12.139 -8.474 1.00 . A A . 23 LYS HG3 1 1 10 3167 1 1 6 LYS HZ1 H 2.471 15.484 -7.592 1.00 . A A . 23 LYS HZ1 1 1 10 3168 1 1 6 LYS HZ2 H 2.997 13.900 -7.863 1.00 . A A . 23 LYS HZ2 1 1 10 3169 1 1 6 LYS HZ3 H 1.731 14.197 -6.781 1.00 . A A . 23 LYS HZ3 1 1 10 3170 1 1 6 LYS N N 0.774 8.982 -8.555 1.00 . A A . 23 LYS N 1 1 10 3171 1 1 6 LYS NZ N 2.164 14.494 -7.678 1.00 . A A . 23 LYS NZ 1 1 10 3172 1 1 6 LYS O O 0.865 9.343 -11.970 1.00 . A A . 23 LYS O 1 1 10 3173 1 1 7 SER C C -1.076 5.553 -11.756 1.00 . A A . 24 SER C 1 1 10 3174 1 1 7 SER CA C -0.331 6.845 -12.079 1.00 . A A . 24 SER CA 1 1 10 3175 1 1 7 SER CB C 1.094 6.526 -12.535 1.00 . A A . 24 SER CB 1 1 10 3176 1 1 7 SER H H -0.741 7.448 -10.091 1.00 . A A . 24 SER H 1 1 10 3177 1 1 7 SER HA H -0.850 7.356 -12.877 1.00 . A A . 24 SER HA 1 1 10 3178 1 1 7 SER HB2 H 1.795 6.894 -11.802 1.00 . A A . 24 SER HB2 1 1 10 3179 1 1 7 SER HB3 H 1.206 5.456 -12.634 1.00 . A A . 24 SER HB3 1 1 10 3180 1 1 7 SER HG H 1.318 6.475 -14.480 1.00 . A A . 24 SER HG 1 1 10 3181 1 1 7 SER N N -0.306 7.732 -10.922 1.00 . A A . 24 SER N 1 1 10 3182 1 1 7 SER O O -1.712 4.956 -12.625 1.00 . A A . 24 SER O 1 1 10 3183 1 1 7 SER OG O 1.377 7.133 -13.784 1.00 . A A . 24 SER OG 1 1 10 3184 1 1 8 HIS C C -3.173 4.049 -10.154 1.00 . A A . 25 HIS C 1 1 10 3185 1 1 8 HIS CA C -1.657 3.906 -10.061 1.00 . A A . 25 HIS CA 1 1 10 3186 1 1 8 HIS CB C -1.253 3.567 -8.625 1.00 . A A . 25 HIS CB 1 1 10 3187 1 1 8 HIS CD2 C -2.283 1.862 -6.965 1.00 . A A . 25 HIS CD2 1 1 10 3188 1 1 8 HIS CE1 C -2.278 0.100 -8.270 1.00 . A A . 25 HIS CE1 1 1 10 3189 1 1 8 HIS CG C -1.764 2.240 -8.156 1.00 . A A . 25 HIS CG 1 1 10 3190 1 1 8 HIS H H -0.470 5.646 -9.853 1.00 . A A . 25 HIS H 1 1 10 3191 1 1 8 HIS HA H -1.343 3.104 -10.712 1.00 . A A . 25 HIS HA 1 1 10 3192 1 1 8 HIS HB2 H -0.175 3.550 -8.556 1.00 . A A . 25 HIS HB2 1 1 10 3193 1 1 8 HIS HB3 H -1.640 4.326 -7.961 1.00 . A A . 25 HIS HB3 1 1 10 3194 1 1 8 HIS HD1 H -1.459 1.064 -9.878 1.00 . A A . 25 HIS HD1 1 1 10 3195 1 1 8 HIS HD2 H -2.427 2.492 -6.098 1.00 . A A . 25 HIS HD2 1 1 10 3196 1 1 8 HIS HE1 H -2.409 -0.906 -8.638 1.00 . A A . 25 HIS HE1 1 1 10 3197 1 1 8 HIS N N -0.991 5.127 -10.500 1.00 . A A . 25 HIS N 1 1 10 3198 1 1 8 HIS ND1 N -1.773 1.113 -8.951 1.00 . A A . 25 HIS ND1 1 1 10 3199 1 1 8 HIS NE2 N -2.595 0.528 -7.061 1.00 . A A . 25 HIS NE2 1 1 10 3200 1 1 8 HIS O O -3.707 5.155 -10.069 1.00 . A A . 25 HIS O 1 1 10 3201 1 1 9 GLU C C -5.957 3.307 -9.106 1.00 . A A . 26 GLU C 1 1 10 3202 1 1 9 GLU CA C -5.314 2.927 -10.437 1.00 . A A . 26 GLU CA 1 1 10 3203 1 1 9 GLU CB C -5.817 1.553 -10.885 1.00 . A A . 26 GLU CB 1 1 10 3204 1 1 9 GLU CD C -6.174 -0.873 -10.279 1.00 . A A . 26 GLU CD 1 1 10 3205 1 1 9 GLU CG C -5.812 0.512 -9.779 1.00 . A A . 26 GLU CG 1 1 10 3206 1 1 9 GLU H H -3.377 2.074 -10.390 1.00 . A A . 26 GLU H 1 1 10 3207 1 1 9 GLU HA H -5.591 3.661 -11.179 1.00 . A A . 26 GLU HA 1 1 10 3208 1 1 9 GLU HB2 H -6.828 1.655 -11.251 1.00 . A A . 26 GLU HB2 1 1 10 3209 1 1 9 GLU HB3 H -5.188 1.198 -11.688 1.00 . A A . 26 GLU HB3 1 1 10 3210 1 1 9 GLU HG2 H -4.825 0.474 -9.342 1.00 . A A . 26 GLU HG2 1 1 10 3211 1 1 9 GLU HG3 H -6.527 0.805 -9.024 1.00 . A A . 26 GLU HG3 1 1 10 3212 1 1 9 GLU N N -3.860 2.925 -10.330 1.00 . A A . 26 GLU N 1 1 10 3213 1 1 9 GLU O O -7.023 3.921 -9.071 1.00 . A A . 26 GLU O 1 1 10 3214 1 1 9 GLU OE1 O -7.379 -1.201 -10.295 1.00 . A A . 26 GLU OE1 1 1 10 3215 1 1 9 GLU OE2 O -5.253 -1.628 -10.654 1.00 . A A . 26 GLU OE2 1 1 10 3216 1 1 10 LYS C C -5.174 4.513 -6.132 1.00 . A A . 27 LYS C 1 1 10 3217 1 1 10 LYS CA C -5.805 3.236 -6.677 1.00 . A A . 27 LYS CA 1 1 10 3218 1 1 10 LYS CB C -5.522 2.069 -5.728 1.00 . A A . 27 LYS CB 1 1 10 3219 1 1 10 LYS CD C -5.989 -0.316 -5.094 1.00 . A A . 27 LYS CD 1 1 10 3220 1 1 10 LYS CE C -4.729 -1.099 -5.432 1.00 . A A . 27 LYS CE 1 1 10 3221 1 1 10 LYS CG C -6.246 0.789 -6.105 1.00 . A A . 27 LYS CG 1 1 10 3222 1 1 10 LYS H H -4.455 2.447 -8.104 1.00 . A A . 27 LYS H 1 1 10 3223 1 1 10 LYS HA H -6.872 3.379 -6.751 1.00 . A A . 27 LYS HA 1 1 10 3224 1 1 10 LYS HB2 H -4.460 1.871 -5.727 1.00 . A A . 27 LYS HB2 1 1 10 3225 1 1 10 LYS HB3 H -5.828 2.351 -4.730 1.00 . A A . 27 LYS HB3 1 1 10 3226 1 1 10 LYS HD2 H -5.873 0.124 -4.115 1.00 . A A . 27 LYS HD2 1 1 10 3227 1 1 10 LYS HD3 H -6.832 -0.992 -5.090 1.00 . A A . 27 LYS HD3 1 1 10 3228 1 1 10 LYS HE2 H -4.631 -1.151 -6.506 1.00 . A A . 27 LYS HE2 1 1 10 3229 1 1 10 LYS HE3 H -3.877 -0.580 -5.018 1.00 . A A . 27 LYS HE3 1 1 10 3230 1 1 10 LYS HG2 H -7.307 0.984 -6.146 1.00 . A A . 27 LYS HG2 1 1 10 3231 1 1 10 LYS HG3 H -5.901 0.463 -7.076 1.00 . A A . 27 LYS HG3 1 1 10 3232 1 1 10 LYS HZ1 H -3.847 -2.943 -5.006 1.00 . A A . 27 LYS HZ1 1 1 10 3233 1 1 10 LYS HZ2 H -5.495 -3.041 -5.374 1.00 . A A . 27 LYS HZ2 1 1 10 3234 1 1 10 LYS HZ3 H -4.998 -2.455 -3.866 1.00 . A A . 27 LYS HZ3 1 1 10 3235 1 1 10 LYS N N -5.300 2.935 -8.012 1.00 . A A . 27 LYS N 1 1 10 3236 1 1 10 LYS NZ N -4.770 -2.481 -4.881 1.00 . A A . 27 LYS NZ 1 1 10 3237 1 1 10 LYS O O -5.538 4.986 -5.055 1.00 . A A . 27 LYS O 1 1 10 3238 1 1 11 TYR C C -4.548 7.417 -6.233 1.00 . A A . 28 TYR C 1 1 10 3239 1 1 11 TYR CA C -3.548 6.291 -6.475 1.00 . A A . 28 TYR CA 1 1 10 3240 1 1 11 TYR CB C -2.534 6.714 -7.538 1.00 . A A . 28 TYR CB 1 1 10 3241 1 1 11 TYR CD1 C -2.422 9.232 -7.384 1.00 . A A . 28 TYR CD1 1 1 10 3242 1 1 11 TYR CD2 C -3.382 8.267 -9.340 1.00 . A A . 28 TYR CD2 1 1 10 3243 1 1 11 TYR CE1 C -2.649 10.497 -7.891 1.00 . A A . 28 TYR CE1 1 1 10 3244 1 1 11 TYR CE2 C -3.612 9.528 -9.855 1.00 . A A . 28 TYR CE2 1 1 10 3245 1 1 11 TYR CG C -2.784 8.096 -8.097 1.00 . A A . 28 TYR CG 1 1 10 3246 1 1 11 TYR CZ C -3.244 10.639 -9.127 1.00 . A A . 28 TYR CZ 1 1 10 3247 1 1 11 TYR H H -3.983 4.645 -7.732 1.00 . A A . 28 TYR H 1 1 10 3248 1 1 11 TYR HA H -3.024 6.086 -5.553 1.00 . A A . 28 TYR HA 1 1 10 3249 1 1 11 TYR HB2 H -1.545 6.706 -7.107 1.00 . A A . 28 TYR HB2 1 1 10 3250 1 1 11 TYR HB3 H -2.569 6.013 -8.359 1.00 . A A . 28 TYR HB3 1 1 10 3251 1 1 11 TYR HD1 H -1.955 9.117 -6.416 1.00 . A A . 28 TYR HD1 1 1 10 3252 1 1 11 TYR HD2 H -3.669 7.394 -9.909 1.00 . A A . 28 TYR HD2 1 1 10 3253 1 1 11 TYR HE1 H -2.361 11.368 -7.321 1.00 . A A . 28 TYR HE1 1 1 10 3254 1 1 11 TYR HE2 H -4.078 9.640 -10.823 1.00 . A A . 28 TYR HE2 1 1 10 3255 1 1 11 TYR HH H -4.415 12.029 -9.754 1.00 . A A . 28 TYR HH 1 1 10 3256 1 1 11 TYR N N -4.230 5.068 -6.883 1.00 . A A . 28 TYR N 1 1 10 3257 1 1 11 TYR O O -5.571 7.511 -6.912 1.00 . A A . 28 TYR O 1 1 10 3258 1 1 11 TYR OH O -3.471 11.898 -9.636 1.00 . A A . 28 TYR OH 1 1 10 3259 1 1 12 ASP C C -4.330 10.700 -4.906 1.00 . A A . 29 ASP C 1 1 10 3260 1 1 12 ASP CA C -5.115 9.392 -4.928 1.00 . A A . 29 ASP CA 1 1 10 3261 1 1 12 ASP CB C -5.785 9.162 -3.573 1.00 . A A . 29 ASP CB 1 1 10 3262 1 1 12 ASP CG C -7.113 8.441 -3.698 1.00 . A A . 29 ASP CG 1 1 10 3263 1 1 12 ASP H H -3.415 8.142 -4.754 1.00 . A A . 29 ASP H 1 1 10 3264 1 1 12 ASP HA H -5.877 9.457 -5.689 1.00 . A A . 29 ASP HA 1 1 10 3265 1 1 12 ASP HB2 H -5.131 8.567 -2.951 1.00 . A A . 29 ASP HB2 1 1 10 3266 1 1 12 ASP HB3 H -5.957 10.116 -3.097 1.00 . A A . 29 ASP HB3 1 1 10 3267 1 1 12 ASP N N -4.245 8.270 -5.260 1.00 . A A . 29 ASP N 1 1 10 3268 1 1 12 ASP O O -3.261 10.783 -4.302 1.00 . A A . 29 ASP O 1 1 10 3269 1 1 12 ASP OD1 O -7.103 7.207 -3.894 1.00 . A A . 29 ASP OD1 1 1 10 3270 1 1 12 ASP OD2 O -8.162 9.110 -3.600 1.00 . A A . 29 ASP OD2 1 1 10 3271 1 1 13 TRP C C -3.990 13.578 -4.224 1.00 . A A . 30 TRP C 1 1 10 3272 1 1 13 TRP CA C -4.218 13.022 -5.625 1.00 . A A . 30 TRP CA 1 1 10 3273 1 1 13 TRP CB C -5.061 14.000 -6.445 1.00 . A A . 30 TRP CB 1 1 10 3274 1 1 13 TRP CD1 C -4.210 15.065 -8.615 1.00 . A A . 30 TRP CD1 1 1 10 3275 1 1 13 TRP CD2 C -3.330 15.943 -6.752 1.00 . A A . 30 TRP CD2 1 1 10 3276 1 1 13 TRP CE2 C -2.784 16.611 -7.865 1.00 . A A . 30 TRP CE2 1 1 10 3277 1 1 13 TRP CE3 C -2.925 16.326 -5.470 1.00 . A A . 30 TRP CE3 1 1 10 3278 1 1 13 TRP CG C -4.240 14.958 -7.254 1.00 . A A . 30 TRP CG 1 1 10 3279 1 1 13 TRP CH2 C -1.475 17.994 -6.467 1.00 . A A . 30 TRP CH2 1 1 10 3280 1 1 13 TRP CZ2 C -1.854 17.639 -7.733 1.00 . A A . 30 TRP CZ2 1 1 10 3281 1 1 13 TRP CZ3 C -2.002 17.346 -5.341 1.00 . A A . 30 TRP CZ3 1 1 10 3282 1 1 13 TRP H H -5.724 11.589 -6.030 1.00 . A A . 30 TRP H 1 1 10 3283 1 1 13 TRP HA H -3.261 12.893 -6.109 1.00 . A A . 30 TRP HA 1 1 10 3284 1 1 13 TRP HB2 H -5.689 13.443 -7.124 1.00 . A A . 30 TRP HB2 1 1 10 3285 1 1 13 TRP HB3 H -5.683 14.576 -5.775 1.00 . A A . 30 TRP HB3 1 1 10 3286 1 1 13 TRP HD1 H -4.792 14.452 -9.286 1.00 . A A . 30 TRP HD1 1 1 10 3287 1 1 13 TRP HE1 H -3.141 16.325 -9.912 1.00 . A A . 30 TRP HE1 1 1 10 3288 1 1 13 TRP HE3 H -3.320 15.839 -4.591 1.00 . A A . 30 TRP HE3 1 1 10 3289 1 1 13 TRP HH2 H -0.757 18.785 -6.318 1.00 . A A . 30 TRP HH2 1 1 10 3290 1 1 13 TRP HZ2 H -1.440 18.149 -8.591 1.00 . A A . 30 TRP HZ2 1 1 10 3291 1 1 13 TRP HZ3 H -1.676 17.656 -4.359 1.00 . A A . 30 TRP HZ3 1 1 10 3292 1 1 13 TRP N N -4.868 11.718 -5.568 1.00 . A A . 30 TRP N 1 1 10 3293 1 1 13 TRP NE1 N -3.336 16.057 -8.989 1.00 . A A . 30 TRP NE1 1 1 10 3294 1 1 13 TRP O O -2.850 13.735 -3.788 1.00 . A A . 30 TRP O 1 1 10 3295 1 1 14 GLU C C -4.508 13.351 -1.192 1.00 . A A . 31 GLU C 1 1 10 3296 1 1 14 GLU CA C -4.997 14.413 -2.172 1.00 . A A . 31 GLU CA 1 1 10 3297 1 1 14 GLU CB C -6.361 14.945 -1.727 1.00 . A A . 31 GLU CB 1 1 10 3298 1 1 14 GLU CD C -7.202 17.259 -1.162 1.00 . A A . 31 GLU CD 1 1 10 3299 1 1 14 GLU CG C -6.670 16.340 -2.244 1.00 . A A . 31 GLU CG 1 1 10 3300 1 1 14 GLU H H -5.962 13.726 -3.927 1.00 . A A . 31 GLU H 1 1 10 3301 1 1 14 GLU HA H -4.290 15.229 -2.184 1.00 . A A . 31 GLU HA 1 1 10 3302 1 1 14 GLU HB2 H -7.129 14.273 -2.081 1.00 . A A . 31 GLU HB2 1 1 10 3303 1 1 14 GLU HB3 H -6.388 14.970 -0.647 1.00 . A A . 31 GLU HB3 1 1 10 3304 1 1 14 GLU HG2 H -5.764 16.769 -2.646 1.00 . A A . 31 GLU HG2 1 1 10 3305 1 1 14 GLU HG3 H -7.409 16.263 -3.028 1.00 . A A . 31 GLU HG3 1 1 10 3306 1 1 14 GLU N N -5.081 13.874 -3.525 1.00 . A A . 31 GLU N 1 1 10 3307 1 1 14 GLU O O -3.571 13.581 -0.426 1.00 . A A . 31 GLU O 1 1 10 3308 1 1 14 GLU OE1 O -8.435 17.292 -0.965 1.00 . A A . 31 GLU OE1 1 1 10 3309 1 1 14 GLU OE2 O -6.386 17.945 -0.513 1.00 . A A . 31 GLU OE2 1 1 10 3310 1 1 15 LEU C C -3.316 10.706 -0.523 1.00 . A A . 32 LEU C 1 1 10 3311 1 1 15 LEU CA C -4.780 11.089 -0.335 1.00 . A A . 32 LEU CA 1 1 10 3312 1 1 15 LEU CB C -5.674 9.876 -0.595 1.00 . A A . 32 LEU CB 1 1 10 3313 1 1 15 LEU CD1 C -7.086 10.208 1.450 1.00 . A A . 32 LEU CD1 1 1 10 3314 1 1 15 LEU CD2 C -7.138 8.019 0.240 1.00 . A A . 32 LEU CD2 1 1 10 3315 1 1 15 LEU CG C -6.275 9.207 0.642 1.00 . A A . 32 LEU CG 1 1 10 3316 1 1 15 LEU H H -5.887 12.064 -1.852 1.00 . A A . 32 LEU H 1 1 10 3317 1 1 15 LEU HA H -4.925 11.421 0.682 1.00 . A A . 32 LEU HA 1 1 10 3318 1 1 15 LEU HB2 H -6.489 10.195 -1.226 1.00 . A A . 32 LEU HB2 1 1 10 3319 1 1 15 LEU HB3 H -5.084 9.137 -1.119 1.00 . A A . 32 LEU HB3 1 1 10 3320 1 1 15 LEU HD11 H -7.997 9.741 1.791 1.00 . A A . 32 LEU HD11 1 1 10 3321 1 1 15 LEU HD12 H -7.328 11.059 0.830 1.00 . A A . 32 LEU HD12 1 1 10 3322 1 1 15 LEU HD13 H -6.507 10.537 2.301 1.00 . A A . 32 LEU HD13 1 1 10 3323 1 1 15 LEU HD21 H -6.738 7.573 -0.659 1.00 . A A . 32 LEU HD21 1 1 10 3324 1 1 15 LEU HD22 H -8.148 8.355 0.056 1.00 . A A . 32 LEU HD22 1 1 10 3325 1 1 15 LEU HD23 H -7.139 7.290 1.036 1.00 . A A . 32 LEU HD23 1 1 10 3326 1 1 15 LEU HG H -5.474 8.842 1.270 1.00 . A A . 32 LEU HG 1 1 10 3327 1 1 15 LEU N N -5.149 12.188 -1.221 1.00 . A A . 32 LEU N 1 1 10 3328 1 1 15 LEU O O -2.726 10.035 0.324 1.00 . A A . 32 LEU O 1 1 10 3329 1 1 16 TRP C C -0.470 11.005 -0.693 1.00 . A A . 33 TRP C 1 1 10 3330 1 1 16 TRP CA C -1.339 10.840 -1.936 1.00 . A A . 33 TRP CA 1 1 10 3331 1 1 16 TRP CB C -0.830 11.752 -3.053 1.00 . A A . 33 TRP CB 1 1 10 3332 1 1 16 TRP CD1 C 1.403 11.013 -4.070 1.00 . A A . 33 TRP CD1 1 1 10 3333 1 1 16 TRP CD2 C 1.595 12.515 -2.420 1.00 . A A . 33 TRP CD2 1 1 10 3334 1 1 16 TRP CE2 C 2.884 12.195 -2.888 1.00 . A A . 33 TRP CE2 1 1 10 3335 1 1 16 TRP CE3 C 1.466 13.442 -1.382 1.00 . A A . 33 TRP CE3 1 1 10 3336 1 1 16 TRP CG C 0.662 11.748 -3.190 1.00 . A A . 33 TRP CG 1 1 10 3337 1 1 16 TRP CH2 C 3.879 13.673 -1.337 1.00 . A A . 33 TRP CH2 1 1 10 3338 1 1 16 TRP CZ2 C 4.034 12.769 -2.353 1.00 . A A . 33 TRP CZ2 1 1 10 3339 1 1 16 TRP CZ3 C 2.609 14.010 -0.851 1.00 . A A . 33 TRP CZ3 1 1 10 3340 1 1 16 TRP H H -3.258 11.667 -2.275 1.00 . A A . 33 TRP H 1 1 10 3341 1 1 16 TRP HA H -1.283 9.813 -2.267 1.00 . A A . 33 TRP HA 1 1 10 3342 1 1 16 TRP HB2 H -1.251 11.428 -3.993 1.00 . A A . 33 TRP HB2 1 1 10 3343 1 1 16 TRP HB3 H -1.145 12.765 -2.852 1.00 . A A . 33 TRP HB3 1 1 10 3344 1 1 16 TRP HD1 H 0.986 10.327 -4.792 1.00 . A A . 33 TRP HD1 1 1 10 3345 1 1 16 TRP HE1 H 3.472 10.872 -4.407 1.00 . A A . 33 TRP HE1 1 1 10 3346 1 1 16 TRP HE3 H 0.496 13.715 -0.994 1.00 . A A . 33 TRP HE3 1 1 10 3347 1 1 16 TRP HH2 H 4.743 14.142 -0.893 1.00 . A A . 33 TRP HH2 1 1 10 3348 1 1 16 TRP HZ2 H 5.020 12.520 -2.717 1.00 . A A . 33 TRP HZ2 1 1 10 3349 1 1 16 TRP HZ3 H 2.529 14.728 -0.048 1.00 . A A . 33 TRP HZ3 1 1 10 3350 1 1 16 TRP N N -2.736 11.137 -1.637 1.00 . A A . 33 TRP N 1 1 10 3351 1 1 16 TRP NE1 N 2.740 11.276 -3.894 1.00 . A A . 33 TRP NE1 1 1 10 3352 1 1 16 TRP O O 0.488 10.258 -0.492 1.00 . A A . 33 TRP O 1 1 10 3353 1 1 17 ASP C C 0.228 10.948 2.107 1.00 . A A . 34 ASP C 1 1 10 3354 1 1 17 ASP CA C -0.062 12.246 1.359 1.00 . A A . 34 ASP CA 1 1 10 3355 1 1 17 ASP CB C -0.837 13.207 2.262 1.00 . A A . 34 ASP CB 1 1 10 3356 1 1 17 ASP CG C 0.077 14.072 3.108 1.00 . A A . 34 ASP CG 1 1 10 3357 1 1 17 ASP H H -1.585 12.546 -0.080 1.00 . A A . 34 ASP H 1 1 10 3358 1 1 17 ASP HA H 0.876 12.704 1.083 1.00 . A A . 34 ASP HA 1 1 10 3359 1 1 17 ASP HB2 H -1.448 13.854 1.648 1.00 . A A . 34 ASP HB2 1 1 10 3360 1 1 17 ASP HB3 H -1.475 12.636 2.921 1.00 . A A . 34 ASP HB3 1 1 10 3361 1 1 17 ASP N N -0.811 11.985 0.136 1.00 . A A . 34 ASP N 1 1 10 3362 1 1 17 ASP O O 1.321 10.757 2.640 1.00 . A A . 34 ASP O 1 1 10 3363 1 1 17 ASP OD1 O 0.529 13.595 4.170 1.00 . A A . 34 ASP OD1 1 1 10 3364 1 1 17 ASP OD2 O 0.340 15.225 2.707 1.00 . A A . 34 ASP OD2 1 1 10 3365 1 1 18 LYS C C -0.377 7.653 1.822 1.00 . A A . 35 LYS C 1 1 10 3366 1 1 18 LYS CA C -0.612 8.779 2.824 1.00 . A A . 35 LYS CA 1 1 10 3367 1 1 18 LYS CB C -1.857 8.478 3.663 1.00 . A A . 35 LYS CB 1 1 10 3368 1 1 18 LYS CD C -4.274 7.818 3.493 1.00 . A A . 35 LYS CD 1 1 10 3369 1 1 18 LYS CE C -4.141 6.361 3.078 1.00 . A A . 35 LYS CE 1 1 10 3370 1 1 18 LYS CG C -3.160 8.668 2.906 1.00 . A A . 35 LYS CG 1 1 10 3371 1 1 18 LYS H H -1.608 10.270 1.698 1.00 . A A . 35 LYS H 1 1 10 3372 1 1 18 LYS HA H 0.244 8.847 3.478 1.00 . A A . 35 LYS HA 1 1 10 3373 1 1 18 LYS HB2 H -1.808 7.454 4.003 1.00 . A A . 35 LYS HB2 1 1 10 3374 1 1 18 LYS HB3 H -1.864 9.134 4.522 1.00 . A A . 35 LYS HB3 1 1 10 3375 1 1 18 LYS HD2 H -4.233 7.879 4.571 1.00 . A A . 35 LYS HD2 1 1 10 3376 1 1 18 LYS HD3 H -5.225 8.197 3.146 1.00 . A A . 35 LYS HD3 1 1 10 3377 1 1 18 LYS HE2 H -4.891 6.142 2.334 1.00 . A A . 35 LYS HE2 1 1 10 3378 1 1 18 LYS HE3 H -3.159 6.209 2.655 1.00 . A A . 35 LYS HE3 1 1 10 3379 1 1 18 LYS HG2 H -3.449 9.707 2.960 1.00 . A A . 35 LYS HG2 1 1 10 3380 1 1 18 LYS HG3 H -3.011 8.387 1.874 1.00 . A A . 35 LYS HG3 1 1 10 3381 1 1 18 LYS HZ1 H -5.319 5.165 4.322 1.00 . A A . 35 LYS HZ1 1 1 10 3382 1 1 18 LYS HZ2 H -4.018 5.902 5.112 1.00 . A A . 35 LYS HZ2 1 1 10 3383 1 1 18 LYS HZ3 H -3.749 4.578 4.095 1.00 . A A . 35 LYS HZ3 1 1 10 3384 1 1 18 LYS N N -0.759 10.059 2.143 1.00 . A A . 35 LYS N 1 1 10 3385 1 1 18 LYS NZ N -4.319 5.437 4.233 1.00 . A A . 35 LYS NZ 1 1 10 3386 1 1 18 LYS O O 0.111 6.582 2.182 1.00 . A A . 35 LYS O 1 1 10 3387 1 1 19 TRP C C 0.806 7.067 -1.164 1.00 . A A . 36 TRP C 1 1 10 3388 1 1 19 TRP CA C -0.551 6.910 -0.488 1.00 . A A . 36 TRP CA 1 1 10 3389 1 1 19 TRP CB C -1.668 7.036 -1.526 1.00 . A A . 36 TRP CB 1 1 10 3390 1 1 19 TRP CD1 C -3.865 6.644 -0.264 1.00 . A A . 36 TRP CD1 1 1 10 3391 1 1 19 TRP CD2 C -3.314 5.003 -1.685 1.00 . A A . 36 TRP CD2 1 1 10 3392 1 1 19 TRP CE2 C -4.532 4.668 -1.061 1.00 . A A . 36 TRP CE2 1 1 10 3393 1 1 19 TRP CE3 C -2.772 4.119 -2.622 1.00 . A A . 36 TRP CE3 1 1 10 3394 1 1 19 TRP CG C -2.905 6.271 -1.161 1.00 . A A . 36 TRP CG 1 1 10 3395 1 1 19 TRP CH2 C -4.659 2.640 -2.265 1.00 . A A . 36 TRP CH2 1 1 10 3396 1 1 19 TRP CZ2 C -5.212 3.487 -1.344 1.00 . A A . 36 TRP CZ2 1 1 10 3397 1 1 19 TRP CZ3 C -3.449 2.947 -2.901 1.00 . A A . 36 TRP CZ3 1 1 10 3398 1 1 19 TRP H H -1.111 8.777 0.341 1.00 . A A . 36 TRP H 1 1 10 3399 1 1 19 TRP HA H -0.603 5.932 -0.033 1.00 . A A . 36 TRP HA 1 1 10 3400 1 1 19 TRP HB2 H -1.938 8.076 -1.631 1.00 . A A . 36 TRP HB2 1 1 10 3401 1 1 19 TRP HB3 H -1.312 6.661 -2.475 1.00 . A A . 36 TRP HB3 1 1 10 3402 1 1 19 TRP HD1 H -3.841 7.561 0.305 1.00 . A A . 36 TRP HD1 1 1 10 3403 1 1 19 TRP HE1 H -5.641 5.723 0.373 1.00 . A A . 36 TRP HE1 1 1 10 3404 1 1 19 TRP HE3 H -1.841 4.339 -3.123 1.00 . A A . 36 TRP HE3 1 1 10 3405 1 1 19 TRP HH2 H -5.152 1.713 -2.513 1.00 . A A . 36 TRP HH2 1 1 10 3406 1 1 19 TRP HZ2 H -6.146 3.236 -0.862 1.00 . A A . 36 TRP HZ2 1 1 10 3407 1 1 19 TRP HZ3 H -3.045 2.252 -3.622 1.00 . A A . 36 TRP HZ3 1 1 10 3408 1 1 19 TRP N N -0.726 7.903 0.566 1.00 . A A . 36 TRP N 1 1 10 3409 1 1 19 TRP NE1 N -4.846 5.684 -0.198 1.00 . A A . 36 TRP NE1 1 1 10 3410 1 1 19 TRP O O 1.046 6.510 -2.236 1.00 . A A . 36 TRP O 1 1 10 3411 1 1 20 CYS C C 2.956 8.822 -2.391 1.00 . A A . 37 CYS C 1 1 10 3412 1 1 20 CYS CA C 3.027 8.059 -1.072 1.00 . A A . 37 CYS CA 1 1 10 3413 1 1 20 CYS CB C 3.753 6.728 -1.279 1.00 . A A . 37 CYS CB 1 1 10 3414 1 1 20 CYS H H 1.444 8.246 0.320 1.00 . A A . 37 CYS H 1 1 10 3415 1 1 20 CYS HA H 3.577 8.651 -0.356 1.00 . A A . 37 CYS HA 1 1 10 3416 1 1 20 CYS HB2 H 3.327 6.224 -2.134 1.00 . A A . 37 CYS HB2 1 1 10 3417 1 1 20 CYS HB3 H 4.799 6.923 -1.467 1.00 . A A . 37 CYS HB3 1 1 10 3418 1 1 20 CYS N N 1.693 7.829 -0.532 1.00 . A A . 37 CYS N 1 1 10 3419 1 1 20 CYS O O 3.933 8.883 -3.138 1.00 . A A . 37 CYS O 1 1 10 3420 1 1 20 CYS SG S 3.646 5.594 0.143 1.00 . A A . 37 CYS SG 1 1 11 3421 1 1 1 ASN C C 3.679 0.552 -1.978 1.00 . A A . 18 ASN C 1 1 11 3422 1 1 1 ASN CA C 2.492 -0.404 -2.034 1.00 . A A . 18 ASN CA 1 1 11 3423 1 1 1 ASN CB C 1.601 -0.061 -3.230 1.00 . A A . 18 ASN CB 1 1 11 3424 1 1 1 ASN CG C 0.128 -0.058 -2.872 1.00 . A A . 18 ASN CG 1 1 11 3425 1 1 1 ASN H1 H 1.782 0.449 -0.231 1.00 . A A . 18 ASN H1 1 1 11 3426 1 1 1 ASN HA H 2.861 -1.412 -2.149 1.00 . A A . 18 ASN HA 1 1 11 3427 1 1 1 ASN HB2 H 1.865 0.920 -3.597 1.00 . A A . 18 ASN HB2 1 1 11 3428 1 1 1 ASN HB3 H 1.762 -0.788 -4.011 1.00 . A A . 18 ASN HB3 1 1 11 3429 1 1 1 ASN HD21 H -0.138 -1.771 -3.847 1.00 . A A . 18 ASN HD21 1 1 11 3430 1 1 1 ASN HD22 H -1.547 -1.103 -3.102 1.00 . A A . 18 ASN HD22 1 1 11 3431 1 1 1 ASN N N 1.721 -0.349 -0.797 1.00 . A A . 18 ASN N 1 1 11 3432 1 1 1 ASN ND2 N -0.592 -1.081 -3.318 1.00 . A A . 18 ASN ND2 1 1 11 3433 1 1 1 ASN O O 4.834 0.126 -1.963 1.00 . A A . 18 ASN O 1 1 11 3434 1 1 1 ASN OD1 O -0.357 0.853 -2.201 1.00 . A A . 18 ASN OD1 1 1 11 3435 1 1 2 CYS C C 5.465 2.643 -2.991 1.00 . A A . 19 CYS C 1 1 11 3436 1 1 2 CYS CA C 4.429 2.866 -1.894 1.00 . A A . 19 CYS CA 1 1 11 3437 1 1 2 CYS CB C 5.110 2.857 -0.524 1.00 . A A . 19 CYS CB 1 1 11 3438 1 1 2 CYS H H 2.447 2.127 -1.963 1.00 . A A . 19 CYS H 1 1 11 3439 1 1 2 CYS HA H 3.962 3.827 -2.048 1.00 . A A . 19 CYS HA 1 1 11 3440 1 1 2 CYS HB2 H 4.504 2.288 0.166 1.00 . A A . 19 CYS HB2 1 1 11 3441 1 1 2 CYS HB3 H 6.079 2.388 -0.616 1.00 . A A . 19 CYS HB3 1 1 11 3442 1 1 2 CYS N N 3.387 1.848 -1.948 1.00 . A A . 19 CYS N 1 1 11 3443 1 1 2 CYS O O 6.636 2.991 -2.834 1.00 . A A . 19 CYS O 1 1 11 3444 1 1 2 CYS SG S 5.359 4.512 0.194 1.00 . A A . 19 CYS SG 1 1 11 3445 1 1 3 ASP C C 5.450 2.532 -6.476 1.00 . A A . 20 ASP C 1 1 11 3446 1 1 3 ASP CA C 5.915 1.791 -5.226 1.00 . A A . 20 ASP CA 1 1 11 3447 1 1 3 ASP CB C 5.981 0.288 -5.504 1.00 . A A . 20 ASP CB 1 1 11 3448 1 1 3 ASP CG C 7.194 -0.365 -4.871 1.00 . A A . 20 ASP CG 1 1 11 3449 1 1 3 ASP H H 4.082 1.805 -4.167 1.00 . A A . 20 ASP H 1 1 11 3450 1 1 3 ASP HA H 6.901 2.141 -4.961 1.00 . A A . 20 ASP HA 1 1 11 3451 1 1 3 ASP HB2 H 5.093 -0.184 -5.107 1.00 . A A . 20 ASP HB2 1 1 11 3452 1 1 3 ASP HB3 H 6.023 0.127 -6.571 1.00 . A A . 20 ASP HB3 1 1 11 3453 1 1 3 ASP N N 5.027 2.060 -4.102 1.00 . A A . 20 ASP N 1 1 11 3454 1 1 3 ASP O O 6.029 2.378 -7.552 1.00 . A A . 20 ASP O 1 1 11 3455 1 1 3 ASP OD1 O 8.318 -0.128 -5.360 1.00 . A A . 20 ASP OD1 1 1 11 3456 1 1 3 ASP OD2 O 7.019 -1.113 -3.887 1.00 . A A . 20 ASP OD2 1 1 11 3457 1 1 4 TRP C C 3.091 5.318 -6.946 1.00 . A A . 21 TRP C 1 1 11 3458 1 1 4 TRP CA C 3.859 4.097 -7.443 1.00 . A A . 21 TRP CA 1 1 11 3459 1 1 4 TRP CB C 2.943 3.215 -8.293 1.00 . A A . 21 TRP CB 1 1 11 3460 1 1 4 TRP CD1 C 1.165 2.698 -6.522 1.00 . A A . 21 TRP CD1 1 1 11 3461 1 1 4 TRP CD2 C 1.991 0.889 -7.553 1.00 . A A . 21 TRP CD2 1 1 11 3462 1 1 4 TRP CE2 C 1.031 0.471 -6.611 1.00 . A A . 21 TRP CE2 1 1 11 3463 1 1 4 TRP CE3 C 2.644 -0.076 -8.323 1.00 . A A . 21 TRP CE3 1 1 11 3464 1 1 4 TRP CG C 2.060 2.317 -7.480 1.00 . A A . 21 TRP CG 1 1 11 3465 1 1 4 TRP CH2 C 1.367 -1.795 -7.187 1.00 . A A . 21 TRP CH2 1 1 11 3466 1 1 4 TRP CZ2 C 0.712 -0.871 -6.420 1.00 . A A . 21 TRP CZ2 1 1 11 3467 1 1 4 TRP CZ3 C 2.327 -1.408 -8.132 1.00 . A A . 21 TRP CZ3 1 1 11 3468 1 1 4 TRP H H 3.984 3.414 -5.443 1.00 . A A . 21 TRP H 1 1 11 3469 1 1 4 TRP HA H 4.688 4.431 -8.050 1.00 . A A . 21 TRP HA 1 1 11 3470 1 1 4 TRP HB2 H 2.310 3.844 -8.901 1.00 . A A . 21 TRP HB2 1 1 11 3471 1 1 4 TRP HB3 H 3.550 2.594 -8.936 1.00 . A A . 21 TRP HB3 1 1 11 3472 1 1 4 TRP HD1 H 0.984 3.721 -6.231 1.00 . A A . 21 TRP HD1 1 1 11 3473 1 1 4 TRP HE1 H -0.141 1.605 -5.292 1.00 . A A . 21 TRP HE1 1 1 11 3474 1 1 4 TRP HE3 H 3.386 0.203 -9.056 1.00 . A A . 21 TRP HE3 1 1 11 3475 1 1 4 TRP HH2 H 1.151 -2.846 -7.072 1.00 . A A . 21 TRP HH2 1 1 11 3476 1 1 4 TRP HZ2 H -0.026 -1.186 -5.696 1.00 . A A . 21 TRP HZ2 1 1 11 3477 1 1 4 TRP HZ3 H 2.822 -2.168 -8.718 1.00 . A A . 21 TRP HZ3 1 1 11 3478 1 1 4 TRP N N 4.402 3.333 -6.326 1.00 . A A . 21 TRP N 1 1 11 3479 1 1 4 TRP NE1 N 0.543 1.592 -5.994 1.00 . A A . 21 TRP NE1 1 1 11 3480 1 1 4 TRP O O 2.559 5.318 -5.836 1.00 . A A . 21 TRP O 1 1 11 3481 1 1 5 ASP C C 1.895 8.338 -8.668 1.00 . A A . 22 ASP C 1 1 11 3482 1 1 5 ASP CA C 2.334 7.582 -7.419 1.00 . A A . 22 ASP CA 1 1 11 3483 1 1 5 ASP CB C 3.225 8.474 -6.553 1.00 . A A . 22 ASP CB 1 1 11 3484 1 1 5 ASP CG C 4.700 8.269 -6.838 1.00 . A A . 22 ASP CG 1 1 11 3485 1 1 5 ASP H H 3.482 6.294 -8.646 1.00 . A A . 22 ASP H 1 1 11 3486 1 1 5 ASP HA H 1.457 7.308 -6.852 1.00 . A A . 22 ASP HA 1 1 11 3487 1 1 5 ASP HB2 H 2.982 9.509 -6.745 1.00 . A A . 22 ASP HB2 1 1 11 3488 1 1 5 ASP HB3 H 3.043 8.252 -5.512 1.00 . A A . 22 ASP HB3 1 1 11 3489 1 1 5 ASP N N 3.038 6.355 -7.774 1.00 . A A . 22 ASP N 1 1 11 3490 1 1 5 ASP O O 2.583 8.323 -9.690 1.00 . A A . 22 ASP O 1 1 11 3491 1 1 5 ASP OD1 O 5.308 7.376 -6.210 1.00 . A A . 22 ASP OD1 1 1 11 3492 1 1 5 ASP OD2 O 5.247 9.000 -7.689 1.00 . A A . 22 ASP OD2 1 1 11 3493 1 1 6 LYS C C 0.245 8.937 -10.986 1.00 . A A . 23 LYS C 1 1 11 3494 1 1 6 LYS CA C 0.214 9.762 -9.704 1.00 . A A . 23 LYS CA 1 1 11 3495 1 1 6 LYS CB C 1.016 11.052 -9.896 1.00 . A A . 23 LYS CB 1 1 11 3496 1 1 6 LYS CD C 0.309 13.121 -8.658 1.00 . A A . 23 LYS CD 1 1 11 3497 1 1 6 LYS CE C 1.158 14.374 -8.809 1.00 . A A . 23 LYS CE 1 1 11 3498 1 1 6 LYS CG C 1.168 11.868 -8.624 1.00 . A A . 23 LYS CG 1 1 11 3499 1 1 6 LYS H H 0.243 8.973 -7.740 1.00 . A A . 23 LYS H 1 1 11 3500 1 1 6 LYS HA H -0.810 10.015 -9.477 1.00 . A A . 23 LYS HA 1 1 11 3501 1 1 6 LYS HB2 H 2.001 10.799 -10.257 1.00 . A A . 23 LYS HB2 1 1 11 3502 1 1 6 LYS HB3 H 0.518 11.664 -10.633 1.00 . A A . 23 LYS HB3 1 1 11 3503 1 1 6 LYS HD2 H -0.371 13.058 -9.494 1.00 . A A . 23 LYS HD2 1 1 11 3504 1 1 6 LYS HD3 H -0.254 13.186 -7.738 1.00 . A A . 23 LYS HD3 1 1 11 3505 1 1 6 LYS HE2 H 1.681 14.328 -9.751 1.00 . A A . 23 LYS HE2 1 1 11 3506 1 1 6 LYS HE3 H 0.507 15.236 -8.801 1.00 . A A . 23 LYS HE3 1 1 11 3507 1 1 6 LYS HG2 H 0.870 11.263 -7.780 1.00 . A A . 23 LYS HG2 1 1 11 3508 1 1 6 LYS HG3 H 2.204 12.156 -8.514 1.00 . A A . 23 LYS HG3 1 1 11 3509 1 1 6 LYS HZ1 H 1.979 15.383 -7.175 1.00 . A A . 23 LYS HZ1 1 1 11 3510 1 1 6 LYS HZ2 H 3.115 14.536 -8.099 1.00 . A A . 23 LYS HZ2 1 1 11 3511 1 1 6 LYS HZ3 H 2.077 13.698 -7.059 1.00 . A A . 23 LYS HZ3 1 1 11 3512 1 1 6 LYS N N 0.746 8.999 -8.581 1.00 . A A . 23 LYS N 1 1 11 3513 1 1 6 LYS NZ N 2.152 14.507 -7.708 1.00 . A A . 23 LYS NZ 1 1 11 3514 1 1 6 LYS O O 0.741 9.392 -12.017 1.00 . A A . 23 LYS O 1 1 11 3515 1 1 7 SER C C -1.081 5.549 -11.747 1.00 . A A . 24 SER C 1 1 11 3516 1 1 7 SER CA C -0.320 6.832 -12.070 1.00 . A A . 24 SER CA 1 1 11 3517 1 1 7 SER CB C 1.103 6.495 -12.520 1.00 . A A . 24 SER CB 1 1 11 3518 1 1 7 SER H H -0.668 7.415 -10.065 1.00 . A A . 24 SER H 1 1 11 3519 1 1 7 SER HA H -0.829 7.347 -12.871 1.00 . A A . 24 SER HA 1 1 11 3520 1 1 7 SER HB2 H 1.078 6.112 -13.529 1.00 . A A . 24 SER HB2 1 1 11 3521 1 1 7 SER HB3 H 1.708 7.389 -12.489 1.00 . A A . 24 SER HB3 1 1 11 3522 1 1 7 SER HG H 2.422 5.908 -11.196 1.00 . A A . 24 SER HG 1 1 11 3523 1 1 7 SER N N -0.289 7.722 -10.915 1.00 . A A . 24 SER N 1 1 11 3524 1 1 7 SER O O -1.733 4.966 -12.614 1.00 . A A . 24 SER O 1 1 11 3525 1 1 7 SER OG O 1.687 5.518 -11.675 1.00 . A A . 24 SER OG 1 1 11 3526 1 1 8 HIS C C -3.187 4.062 -10.155 1.00 . A A . 25 HIS C 1 1 11 3527 1 1 8 HIS CA C -1.673 3.903 -10.055 1.00 . A A . 25 HIS CA 1 1 11 3528 1 1 8 HIS CB C -1.279 3.564 -8.617 1.00 . A A . 25 HIS CB 1 1 11 3529 1 1 8 HIS CD2 C -2.315 1.862 -6.957 1.00 . A A . 25 HIS CD2 1 1 11 3530 1 1 8 HIS CE1 C -2.333 0.105 -8.269 1.00 . A A . 25 HIS CE1 1 1 11 3531 1 1 8 HIS CG C -1.799 2.239 -8.150 1.00 . A A . 25 HIS CG 1 1 11 3532 1 1 8 HIS H H -0.459 5.625 -9.849 1.00 . A A . 25 HIS H 1 1 11 3533 1 1 8 HIS HA H -1.365 3.097 -10.703 1.00 . A A . 25 HIS HA 1 1 11 3534 1 1 8 HIS HB2 H -0.201 3.541 -8.542 1.00 . A A . 25 HIS HB2 1 1 11 3535 1 1 8 HIS HB3 H -1.665 4.325 -7.955 1.00 . A A . 25 HIS HB3 1 1 11 3536 1 1 8 HIS HD1 H -1.513 1.067 -9.877 1.00 . A A . 25 HIS HD1 1 1 11 3537 1 1 8 HIS HD2 H -2.449 2.490 -6.088 1.00 . A A . 25 HIS HD2 1 1 11 3538 1 1 8 HIS HE1 H -2.475 -0.900 -8.639 1.00 . A A . 25 HIS HE1 1 1 11 3539 1 1 8 HIS N N -0.993 5.116 -10.494 1.00 . A A . 25 HIS N 1 1 11 3540 1 1 8 HIS ND1 N -1.823 1.116 -8.949 1.00 . A A . 25 HIS ND1 1 1 11 3541 1 1 8 HIS NE2 N -2.640 0.531 -7.057 1.00 . A A . 25 HIS NE2 1 1 11 3542 1 1 8 HIS O O -3.710 5.173 -10.074 1.00 . A A . 25 HIS O 1 1 11 3543 1 1 9 GLU C C -5.983 3.341 -9.117 1.00 . A A . 26 GLU C 1 1 11 3544 1 1 9 GLU CA C -5.338 2.962 -10.447 1.00 . A A . 26 GLU CA 1 1 11 3545 1 1 9 GLU CB C -5.853 1.595 -10.904 1.00 . A A . 26 GLU CB 1 1 11 3546 1 1 9 GLU CD C -6.265 -0.824 -10.303 1.00 . A A . 26 GLU CD 1 1 11 3547 1 1 9 GLU CG C -5.873 0.552 -9.800 1.00 . A A . 26 GLU CG 1 1 11 3548 1 1 9 GLU H H -3.410 2.089 -10.391 1.00 . A A . 26 GLU H 1 1 11 3549 1 1 9 GLU HA H -5.604 3.702 -11.187 1.00 . A A . 26 GLU HA 1 1 11 3550 1 1 9 GLU HB2 H -6.858 1.710 -11.281 1.00 . A A . 26 GLU HB2 1 1 11 3551 1 1 9 GLU HB3 H -5.218 1.233 -11.700 1.00 . A A . 26 GLU HB3 1 1 11 3552 1 1 9 GLU HG2 H -4.888 0.490 -9.362 1.00 . A A . 26 GLU HG2 1 1 11 3553 1 1 9 GLU HG3 H -6.582 0.858 -9.045 1.00 . A A . 26 GLU HG3 1 1 11 3554 1 1 9 GLU N N -3.884 2.944 -10.334 1.00 . A A . 26 GLU N 1 1 11 3555 1 1 9 GLU O O -7.047 3.960 -9.084 1.00 . A A . 26 GLU O 1 1 11 3556 1 1 9 GLU OE1 O -7.247 -0.918 -11.068 1.00 . A A . 26 GLU OE1 1 1 11 3557 1 1 9 GLU OE2 O -5.588 -1.806 -9.932 1.00 . A A . 26 GLU OE2 1 1 11 3558 1 1 10 LYS C C -5.205 4.541 -6.140 1.00 . A A . 27 LYS C 1 1 11 3559 1 1 10 LYS CA C -5.838 3.266 -6.688 1.00 . A A . 27 LYS CA 1 1 11 3560 1 1 10 LYS CB C -5.562 2.097 -5.740 1.00 . A A . 27 LYS CB 1 1 11 3561 1 1 10 LYS CD C -6.033 -0.290 -5.115 1.00 . A A . 27 LYS CD 1 1 11 3562 1 1 10 LYS CE C -4.777 -1.073 -5.467 1.00 . A A . 27 LYS CE 1 1 11 3563 1 1 10 LYS CG C -6.295 0.822 -6.117 1.00 . A A . 27 LYS CG 1 1 11 3564 1 1 10 LYS H H -4.487 2.475 -8.113 1.00 . A A . 27 LYS H 1 1 11 3565 1 1 10 LYS HA H -6.905 3.413 -6.764 1.00 . A A . 27 LYS HA 1 1 11 3566 1 1 10 LYS HB2 H -4.502 1.892 -5.740 1.00 . A A . 27 LYS HB2 1 1 11 3567 1 1 10 LYS HB3 H -5.865 2.380 -4.742 1.00 . A A . 27 LYS HB3 1 1 11 3568 1 1 10 LYS HD2 H -5.909 0.144 -4.133 1.00 . A A . 27 LYS HD2 1 1 11 3569 1 1 10 LYS HD3 H -6.877 -0.964 -5.108 1.00 . A A . 27 LYS HD3 1 1 11 3570 1 1 10 LYS HE2 H -4.709 -1.154 -6.541 1.00 . A A . 27 LYS HE2 1 1 11 3571 1 1 10 LYS HE3 H -3.918 -0.537 -5.091 1.00 . A A . 27 LYS HE3 1 1 11 3572 1 1 10 LYS HG2 H -7.356 1.022 -6.147 1.00 . A A . 27 LYS HG2 1 1 11 3573 1 1 10 LYS HG3 H -5.960 0.500 -7.093 1.00 . A A . 27 LYS HG3 1 1 11 3574 1 1 10 LYS HZ1 H -5.695 -2.911 -5.091 1.00 . A A . 27 LYS HZ1 1 1 11 3575 1 1 10 LYS HZ2 H -4.680 -2.385 -3.845 1.00 . A A . 27 LYS HZ2 1 1 11 3576 1 1 10 LYS HZ3 H -4.015 -3.008 -5.270 1.00 . A A . 27 LYS HZ3 1 1 11 3577 1 1 10 LYS N N -5.331 2.966 -8.022 1.00 . A A . 27 LYS N 1 1 11 3578 1 1 10 LYS NZ N -4.793 -2.440 -4.877 1.00 . A A . 27 LYS NZ 1 1 11 3579 1 1 10 LYS O O -5.581 5.022 -5.070 1.00 . A A . 27 LYS O 1 1 11 3580 1 1 11 TYR C C -4.554 7.429 -6.212 1.00 . A A . 28 TYR C 1 1 11 3581 1 1 11 TYR CA C -3.557 6.301 -6.465 1.00 . A A . 28 TYR CA 1 1 11 3582 1 1 11 TYR CB C -2.546 6.729 -7.530 1.00 . A A . 28 TYR CB 1 1 11 3583 1 1 11 TYR CD1 C -2.435 9.247 -7.372 1.00 . A A . 28 TYR CD1 1 1 11 3584 1 1 11 TYR CD2 C -3.404 8.284 -9.325 1.00 . A A . 28 TYR CD2 1 1 11 3585 1 1 11 TYR CE1 C -2.666 10.512 -7.875 1.00 . A A . 28 TYR CE1 1 1 11 3586 1 1 11 TYR CE2 C -3.638 9.545 -9.837 1.00 . A A . 28 TYR CE2 1 1 11 3587 1 1 11 TYR CG C -2.800 8.112 -8.085 1.00 . A A . 28 TYR CG 1 1 11 3588 1 1 11 TYR CZ C -3.267 10.656 -9.108 1.00 . A A . 28 TYR CZ 1 1 11 3589 1 1 11 TYR H H -3.987 4.654 -7.721 1.00 . A A . 28 TYR H 1 1 11 3590 1 1 11 TYR HA H -3.030 6.090 -5.546 1.00 . A A . 28 TYR HA 1 1 11 3591 1 1 11 TYR HB2 H -1.556 6.721 -7.100 1.00 . A A . 28 TYR HB2 1 1 11 3592 1 1 11 TYR HB3 H -2.582 6.029 -8.352 1.00 . A A . 28 TYR HB3 1 1 11 3593 1 1 11 TYR HD1 H -1.964 9.130 -6.406 1.00 . A A . 28 TYR HD1 1 1 11 3594 1 1 11 TYR HD2 H -3.693 7.411 -9.893 1.00 . A A . 28 TYR HD2 1 1 11 3595 1 1 11 TYR HE1 H -2.376 11.382 -7.305 1.00 . A A . 28 TYR HE1 1 1 11 3596 1 1 11 TYR HE2 H -4.109 9.659 -10.802 1.00 . A A . 28 TYR HE2 1 1 11 3597 1 1 11 TYR HH H -4.062 12.404 -9.011 1.00 . A A . 28 TYR HH 1 1 11 3598 1 1 11 TYR N N -4.243 5.083 -6.878 1.00 . A A . 28 TYR N 1 1 11 3599 1 1 11 TYR O O -5.580 7.528 -6.885 1.00 . A A . 28 TYR O 1 1 11 3600 1 1 11 TYR OH O -3.498 11.915 -9.614 1.00 . A A . 28 TYR OH 1 1 11 3601 1 1 12 ASP C C -4.323 10.706 -4.876 1.00 . A A . 29 ASP C 1 1 11 3602 1 1 12 ASP CA C -5.109 9.399 -4.895 1.00 . A A . 29 ASP CA 1 1 11 3603 1 1 12 ASP CB C -5.768 9.166 -3.534 1.00 . A A . 29 ASP CB 1 1 11 3604 1 1 12 ASP CG C -7.099 8.450 -3.651 1.00 . A A . 29 ASP CG 1 1 11 3605 1 1 12 ASP H H -3.411 8.144 -4.736 1.00 . A A . 29 ASP H 1 1 11 3606 1 1 12 ASP HA H -5.878 9.467 -5.650 1.00 . A A . 29 ASP HA 1 1 11 3607 1 1 12 ASP HB2 H -5.111 8.566 -2.921 1.00 . A A . 29 ASP HB2 1 1 11 3608 1 1 12 ASP HB3 H -5.932 10.119 -3.053 1.00 . A A . 29 ASP HB3 1 1 11 3609 1 1 12 ASP N N -4.243 8.276 -5.237 1.00 . A A . 29 ASP N 1 1 11 3610 1 1 12 ASP O O -3.247 10.785 -4.283 1.00 . A A . 29 ASP O 1 1 11 3611 1 1 12 ASP OD1 O -7.347 7.826 -4.704 1.00 . A A . 29 ASP OD1 1 1 11 3612 1 1 12 ASP OD2 O -7.894 8.514 -2.689 1.00 . A A . 29 ASP OD2 1 1 11 3613 1 1 13 TRP C C -3.973 13.581 -4.187 1.00 . A A . 30 TRP C 1 1 11 3614 1 1 13 TRP CA C -4.214 13.030 -5.588 1.00 . A A . 30 TRP CA 1 1 11 3615 1 1 13 TRP CB C -5.064 14.011 -6.397 1.00 . A A . 30 TRP CB 1 1 11 3616 1 1 13 TRP CD1 C -4.233 15.082 -8.572 1.00 . A A . 30 TRP CD1 1 1 11 3617 1 1 13 TRP CD2 C -3.333 15.952 -6.715 1.00 . A A . 30 TRP CD2 1 1 11 3618 1 1 13 TRP CE2 C -2.797 16.623 -7.831 1.00 . A A . 30 TRP CE2 1 1 11 3619 1 1 13 TRP CE3 C -2.914 16.331 -5.437 1.00 . A A . 30 TRP CE3 1 1 11 3620 1 1 13 TRP CG C -4.250 14.971 -7.211 1.00 . A A . 30 TRP CG 1 1 11 3621 1 1 13 TRP CH2 C -1.471 17.999 -6.442 1.00 . A A . 30 TRP CH2 1 1 11 3622 1 1 13 TRP CZ2 C -1.863 17.649 -7.706 1.00 . A A . 30 TRP CZ2 1 1 11 3623 1 1 13 TRP CZ3 C -1.987 17.349 -5.314 1.00 . A A . 30 TRP CZ3 1 1 11 3624 1 1 13 TRP H H -5.726 11.601 -5.983 1.00 . A A . 30 TRP H 1 1 11 3625 1 1 13 TRP HA H -3.262 12.901 -6.081 1.00 . A A . 30 TRP HA 1 1 11 3626 1 1 13 TRP HB2 H -5.699 13.457 -7.071 1.00 . A A . 30 TRP HB2 1 1 11 3627 1 1 13 TRP HB3 H -5.679 14.586 -5.719 1.00 . A A . 30 TRP HB3 1 1 11 3628 1 1 13 TRP HD1 H -4.823 14.472 -9.239 1.00 . A A . 30 TRP HD1 1 1 11 3629 1 1 13 TRP HE1 H -3.175 16.344 -9.876 1.00 . A A . 30 TRP HE1 1 1 11 3630 1 1 13 TRP HE3 H -3.300 15.842 -4.555 1.00 . A A . 30 TRP HE3 1 1 11 3631 1 1 13 TRP HH2 H -0.749 18.788 -6.299 1.00 . A A . 30 TRP HH2 1 1 11 3632 1 1 13 TRP HZ2 H -1.457 18.160 -8.566 1.00 . A A . 30 TRP HZ2 1 1 11 3633 1 1 13 TRP HZ3 H -1.651 17.654 -4.334 1.00 . A A . 30 TRP HZ3 1 1 11 3634 1 1 13 TRP N N -4.866 11.726 -5.529 1.00 . A A . 30 TRP N 1 1 11 3635 1 1 13 TRP NE1 N -3.361 16.074 -8.952 1.00 . A A . 30 TRP NE1 1 1 11 3636 1 1 13 TRP O O -2.829 13.735 -3.761 1.00 . A A . 30 TRP O 1 1 11 3637 1 1 14 GLU C C -4.464 13.346 -1.151 1.00 . A A . 31 GLU C 1 1 11 3638 1 1 14 GLU CA C -4.960 14.412 -2.124 1.00 . A A . 31 GLU CA 1 1 11 3639 1 1 14 GLU CB C -6.319 14.945 -1.664 1.00 . A A . 31 GLU CB 1 1 11 3640 1 1 14 GLU CD C -7.839 16.950 -1.441 1.00 . A A . 31 GLU CD 1 1 11 3641 1 1 14 GLU CG C -6.569 16.392 -2.054 1.00 . A A . 31 GLU CG 1 1 11 3642 1 1 14 GLU H H -5.942 13.732 -3.872 1.00 . A A . 31 GLU H 1 1 11 3643 1 1 14 GLU HA H -4.251 15.226 -2.139 1.00 . A A . 31 GLU HA 1 1 11 3644 1 1 14 GLU HB2 H -7.097 14.336 -2.100 1.00 . A A . 31 GLU HB2 1 1 11 3645 1 1 14 GLU HB3 H -6.376 14.869 -0.588 1.00 . A A . 31 GLU HB3 1 1 11 3646 1 1 14 GLU HG2 H -5.734 16.991 -1.721 1.00 . A A . 31 GLU HG2 1 1 11 3647 1 1 14 GLU HG3 H -6.648 16.453 -3.129 1.00 . A A . 31 GLU HG3 1 1 11 3648 1 1 14 GLU N N -5.057 13.877 -3.477 1.00 . A A . 31 GLU N 1 1 11 3649 1 1 14 GLU O O -3.520 13.573 -0.393 1.00 . A A . 31 GLU O 1 1 11 3650 1 1 14 GLU OE1 O -8.925 16.406 -1.728 1.00 . A A . 31 GLU OE1 1 1 11 3651 1 1 14 GLU OE2 O -7.745 17.931 -0.674 1.00 . A A . 31 GLU OE2 1 1 11 3652 1 1 15 LEU C C -3.270 10.695 -0.504 1.00 . A A . 32 LEU C 1 1 11 3653 1 1 15 LEU CA C -4.731 11.082 -0.300 1.00 . A A . 32 LEU CA 1 1 11 3654 1 1 15 LEU CB C -5.631 9.871 -0.555 1.00 . A A . 32 LEU CB 1 1 11 3655 1 1 15 LEU CD1 C -7.021 10.200 1.504 1.00 . A A . 32 LEU CD1 1 1 11 3656 1 1 15 LEU CD2 C -7.090 8.015 0.289 1.00 . A A . 32 LEU CD2 1 1 11 3657 1 1 15 LEU CG C -6.221 9.200 0.686 1.00 . A A . 32 LEU CG 1 1 11 3658 1 1 15 LEU H H -5.850 12.063 -1.805 1.00 . A A . 32 LEU H 1 1 11 3659 1 1 15 LEU HA H -4.865 11.411 0.720 1.00 . A A . 32 LEU HA 1 1 11 3660 1 1 15 LEU HB2 H -6.451 10.194 -1.177 1.00 . A A . 32 LEU HB2 1 1 11 3661 1 1 15 LEU HB3 H -5.047 9.133 -1.086 1.00 . A A . 32 LEU HB3 1 1 11 3662 1 1 15 LEU HD11 H -7.048 11.148 0.988 1.00 . A A . 32 LEU HD11 1 1 11 3663 1 1 15 LEU HD12 H -6.556 10.330 2.470 1.00 . A A . 32 LEU HD12 1 1 11 3664 1 1 15 LEU HD13 H -8.028 9.833 1.637 1.00 . A A . 32 LEU HD13 1 1 11 3665 1 1 15 LEU HD21 H -8.036 8.375 -0.089 1.00 . A A . 32 LEU HD21 1 1 11 3666 1 1 15 LEU HD22 H -7.261 7.390 1.153 1.00 . A A . 32 LEU HD22 1 1 11 3667 1 1 15 LEU HD23 H -6.590 7.443 -0.478 1.00 . A A . 32 LEU HD23 1 1 11 3668 1 1 15 LEU HG H -5.415 8.831 1.305 1.00 . A A . 32 LEU HG 1 1 11 3669 1 1 15 LEU N N -5.106 12.184 -1.179 1.00 . A A . 32 LEU N 1 1 11 3670 1 1 15 LEU O O -2.674 10.019 0.335 1.00 . A A . 32 LEU O 1 1 11 3671 1 1 16 TRP C C -0.425 10.989 -0.698 1.00 . A A . 33 TRP C 1 1 11 3672 1 1 16 TRP CA C -1.305 10.832 -1.933 1.00 . A A . 33 TRP CA 1 1 11 3673 1 1 16 TRP CB C -0.805 11.748 -3.051 1.00 . A A . 33 TRP CB 1 1 11 3674 1 1 16 TRP CD1 C 1.419 11.011 -4.091 1.00 . A A . 33 TRP CD1 1 1 11 3675 1 1 16 TRP CD2 C 1.627 12.504 -2.435 1.00 . A A . 33 TRP CD2 1 1 11 3676 1 1 16 TRP CE2 C 2.912 12.184 -2.916 1.00 . A A . 33 TRP CE2 1 1 11 3677 1 1 16 TRP CE3 C 1.509 13.426 -1.391 1.00 . A A . 33 TRP CE3 1 1 11 3678 1 1 16 TRP CG C 0.687 11.743 -3.200 1.00 . A A . 33 TRP CG 1 1 11 3679 1 1 16 TRP CH2 C 3.922 13.653 -1.366 1.00 . A A . 33 TRP CH2 1 1 11 3680 1 1 16 TRP CZ2 C 4.068 12.753 -2.387 1.00 . A A . 33 TRP CZ2 1 1 11 3681 1 1 16 TRP CZ3 C 2.657 13.990 -0.868 1.00 . A A . 33 TRP CZ3 1 1 11 3682 1 1 16 TRP H H -3.226 11.666 -2.250 1.00 . A A . 33 TRP H 1 1 11 3683 1 1 16 TRP HA H -1.254 9.807 -2.270 1.00 . A A . 33 TRP HA 1 1 11 3684 1 1 16 TRP HB2 H -1.234 11.429 -3.989 1.00 . A A . 33 TRP HB2 1 1 11 3685 1 1 16 TRP HB3 H -1.116 12.762 -2.843 1.00 . A A . 33 TRP HB3 1 1 11 3686 1 1 16 TRP HD1 H 0.994 10.329 -4.812 1.00 . A A . 33 TRP HD1 1 1 11 3687 1 1 16 TRP HE1 H 3.484 10.868 -4.446 1.00 . A A . 33 TRP HE1 1 1 11 3688 1 1 16 TRP HE3 H 0.543 13.699 -0.994 1.00 . A A . 33 TRP HE3 1 1 11 3689 1 1 16 TRP HH2 H 4.791 14.118 -0.927 1.00 . A A . 33 TRP HH2 1 1 11 3690 1 1 16 TRP HZ2 H 5.050 12.504 -2.761 1.00 . A A . 33 TRP HZ2 1 1 11 3691 1 1 16 TRP HZ3 H 2.586 14.704 -0.061 1.00 . A A . 33 TRP HZ3 1 1 11 3692 1 1 16 TRP N N -2.698 11.131 -1.621 1.00 . A A . 33 TRP N 1 1 11 3693 1 1 16 TRP NE1 N 2.758 11.271 -3.925 1.00 . A A . 33 TRP NE1 1 1 11 3694 1 1 16 TRP O O 0.534 10.240 -0.510 1.00 . A A . 33 TRP O 1 1 11 3695 1 1 17 ASP C C 0.299 10.916 2.095 1.00 . A A . 34 ASP C 1 1 11 3696 1 1 17 ASP CA C 0.004 12.218 1.358 1.00 . A A . 34 ASP CA 1 1 11 3697 1 1 17 ASP CB C -0.761 13.175 2.273 1.00 . A A . 34 ASP CB 1 1 11 3698 1 1 17 ASP CG C -0.955 14.543 1.649 1.00 . A A . 34 ASP CG 1 1 11 3699 1 1 17 ASP H H -1.532 12.529 -0.066 1.00 . A A . 34 ASP H 1 1 11 3700 1 1 17 ASP HA H 0.940 12.677 1.075 1.00 . A A . 34 ASP HA 1 1 11 3701 1 1 17 ASP HB2 H -1.734 12.757 2.487 1.00 . A A . 34 ASP HB2 1 1 11 3702 1 1 17 ASP HB3 H -0.214 13.294 3.196 1.00 . A A . 34 ASP HB3 1 1 11 3703 1 1 17 ASP N N -0.756 11.965 0.139 1.00 . A A . 34 ASP N 1 1 11 3704 1 1 17 ASP O O 1.395 10.722 2.622 1.00 . A A . 34 ASP O 1 1 11 3705 1 1 17 ASP OD1 O -0.001 15.050 1.021 1.00 . A A . 34 ASP OD1 1 1 11 3706 1 1 17 ASP OD2 O -2.060 15.107 1.787 1.00 . A A . 34 ASP OD2 1 1 11 3707 1 1 18 LYS C C -0.313 7.620 1.790 1.00 . A A . 35 LYS C 1 1 11 3708 1 1 18 LYS CA C -0.534 8.740 2.801 1.00 . A A . 35 LYS CA 1 1 11 3709 1 1 18 LYS CB C -1.769 8.437 3.652 1.00 . A A . 35 LYS CB 1 1 11 3710 1 1 18 LYS CD C -4.192 7.788 3.509 1.00 . A A . 35 LYS CD 1 1 11 3711 1 1 18 LYS CE C -4.067 6.332 3.088 1.00 . A A . 35 LYS CE 1 1 11 3712 1 1 18 LYS CG C -3.081 8.637 2.913 1.00 . A A . 35 LYS CG 1 1 11 3713 1 1 18 LYS H H -1.537 10.237 1.690 1.00 . A A . 35 LYS H 1 1 11 3714 1 1 18 LYS HA H 0.330 8.803 3.445 1.00 . A A . 35 LYS HA 1 1 11 3715 1 1 18 LYS HB2 H -1.720 7.411 3.985 1.00 . A A . 35 LYS HB2 1 1 11 3716 1 1 18 LYS HB3 H -1.765 9.087 4.516 1.00 . A A . 35 LYS HB3 1 1 11 3717 1 1 18 LYS HD2 H -4.139 7.845 4.586 1.00 . A A . 35 LYS HD2 1 1 11 3718 1 1 18 LYS HD3 H -5.145 8.170 3.173 1.00 . A A . 35 LYS HD3 1 1 11 3719 1 1 18 LYS HE2 H -4.825 6.117 2.351 1.00 . A A . 35 LYS HE2 1 1 11 3720 1 1 18 LYS HE3 H -3.090 6.179 2.653 1.00 . A A . 35 LYS HE3 1 1 11 3721 1 1 18 LYS HG2 H -3.365 9.677 2.976 1.00 . A A . 35 LYS HG2 1 1 11 3722 1 1 18 LYS HG3 H -2.946 8.361 1.877 1.00 . A A . 35 LYS HG3 1 1 11 3723 1 1 18 LYS HZ1 H -4.070 4.423 3.937 1.00 . A A . 35 LYS HZ1 1 1 11 3724 1 1 18 LYS HZ2 H -5.199 5.479 4.622 1.00 . A A . 35 LYS HZ2 1 1 11 3725 1 1 18 LYS HZ3 H -3.557 5.642 4.992 1.00 . A A . 35 LYS HZ3 1 1 11 3726 1 1 18 LYS N N -0.686 10.025 2.129 1.00 . A A . 35 LYS N 1 1 11 3727 1 1 18 LYS NZ N -4.235 5.404 4.241 1.00 . A A . 35 LYS NZ 1 1 11 3728 1 1 18 LYS O O 0.181 6.547 2.137 1.00 . A A . 35 LYS O 1 1 11 3729 1 1 19 TRP C C 0.830 7.045 -1.210 1.00 . A A . 36 TRP C 1 1 11 3730 1 1 19 TRP CA C -0.521 6.890 -0.522 1.00 . A A . 36 TRP CA 1 1 11 3731 1 1 19 TRP CB C -1.648 7.026 -1.546 1.00 . A A . 36 TRP CB 1 1 11 3732 1 1 19 TRP CD1 C -3.832 6.635 -0.263 1.00 . A A . 36 TRP CD1 1 1 11 3733 1 1 19 TRP CD2 C -3.305 5.002 -1.702 1.00 . A A . 36 TRP CD2 1 1 11 3734 1 1 19 TRP CE2 C -4.517 4.667 -1.067 1.00 . A A . 36 TRP CE2 1 1 11 3735 1 1 19 TRP CE3 C -2.777 4.122 -2.651 1.00 . A A . 36 TRP CE3 1 1 11 3736 1 1 19 TRP CG C -2.885 6.264 -1.174 1.00 . A A . 36 TRP CG 1 1 11 3737 1 1 19 TRP CH2 C -4.666 2.648 -2.283 1.00 . A A . 36 TRP CH2 1 1 11 3738 1 1 19 TRP CZ2 C -5.206 3.491 -1.350 1.00 . A A . 36 TRP CZ2 1 1 11 3739 1 1 19 TRP CZ3 C -3.462 2.955 -2.931 1.00 . A A . 36 TRP CZ3 1 1 11 3740 1 1 19 TRP H H -1.069 8.751 0.325 1.00 . A A . 36 TRP H 1 1 11 3741 1 1 19 TRP HA H -0.572 5.909 -0.072 1.00 . A A . 36 TRP HA 1 1 11 3742 1 1 19 TRP HB2 H -1.915 8.067 -1.643 1.00 . A A . 36 TRP HB2 1 1 11 3743 1 1 19 TRP HB3 H -1.303 6.656 -2.501 1.00 . A A . 36 TRP HB3 1 1 11 3744 1 1 19 TRP HD1 H -3.799 7.548 0.312 1.00 . A A . 36 TRP HD1 1 1 11 3745 1 1 19 TRP HE1 H -5.606 5.717 0.387 1.00 . A A . 36 TRP HE1 1 1 11 3746 1 1 19 TRP HE3 H -1.850 4.341 -3.161 1.00 . A A . 36 TRP HE3 1 1 11 3747 1 1 19 TRP HH2 H -5.166 1.725 -2.533 1.00 . A A . 36 TRP HH2 1 1 11 3748 1 1 19 TRP HZ2 H -6.135 3.240 -0.860 1.00 . A A . 36 TRP HZ2 1 1 11 3749 1 1 19 TRP HZ3 H -3.069 2.263 -3.661 1.00 . A A . 36 TRP HZ3 1 1 11 3750 1 1 19 TRP N N -0.681 7.877 0.540 1.00 . A A . 36 TRP N 1 1 11 3751 1 1 19 TRP NE1 N -4.817 5.679 -0.193 1.00 . A A . 36 TRP NE1 1 1 11 3752 1 1 19 TRP O O 1.060 6.485 -2.283 1.00 . A A . 36 TRP O 1 1 11 3753 1 1 20 CYS C C 2.967 8.794 -2.464 1.00 . A A . 37 CYS C 1 1 11 3754 1 1 20 CYS CA C 3.052 8.038 -1.142 1.00 . A A . 37 CYS CA 1 1 11 3755 1 1 20 CYS CB C 3.777 6.707 -1.349 1.00 . A A . 37 CYS CB 1 1 11 3756 1 1 20 CYS H H 1.481 8.229 0.264 1.00 . A A . 37 CYS H 1 1 11 3757 1 1 20 CYS HA H 3.607 8.634 -0.434 1.00 . A A . 37 CYS HA 1 1 11 3758 1 1 20 CYS HB2 H 3.349 6.201 -2.202 1.00 . A A . 37 CYS HB2 1 1 11 3759 1 1 20 CYS HB3 H 4.822 6.901 -1.539 1.00 . A A . 37 CYS HB3 1 1 11 3760 1 1 20 CYS N N 1.722 7.808 -0.588 1.00 . A A . 37 CYS N 1 1 11 3761 1 1 20 CYS O O 3.912 8.792 -3.253 1.00 . A A . 37 CYS O 1 1 11 3762 1 1 20 CYS SG S 3.673 5.574 0.074 1.00 . A A . 37 CYS SG 1 1 12 3763 1 1 1 ASN C C 2.242 2.929 -2.877 1.00 . A A . 18 ASN C 1 1 12 3764 1 1 1 ASN CA C 1.282 1.761 -2.669 1.00 . A A . 18 ASN CA 1 1 12 3765 1 1 1 ASN CB C -0.145 2.284 -2.498 1.00 . A A . 18 ASN CB 1 1 12 3766 1 1 1 ASN CG C -1.134 1.176 -2.189 1.00 . A A . 18 ASN CG 1 1 12 3767 1 1 1 ASN H1 H 1.955 0.038 -1.640 1.00 . A A . 18 ASN H1 1 1 12 3768 1 1 1 ASN HA H 1.320 1.121 -3.537 1.00 . A A . 18 ASN HA 1 1 12 3769 1 1 1 ASN HB2 H -0.167 2.996 -1.686 1.00 . A A . 18 ASN HB2 1 1 12 3770 1 1 1 ASN HB3 H -0.455 2.774 -3.409 1.00 . A A . 18 ASN HB3 1 1 12 3771 1 1 1 ASN HD21 H -0.336 0.035 -3.609 1.00 . A A . 18 ASN HD21 1 1 12 3772 1 1 1 ASN HD22 H -1.660 -0.659 -2.741 1.00 . A A . 18 ASN HD22 1 1 12 3773 1 1 1 ASN N N 1.673 0.968 -1.509 1.00 . A A . 18 ASN N 1 1 12 3774 1 1 1 ASN ND2 N -1.033 0.073 -2.920 1.00 . A A . 18 ASN ND2 1 1 12 3775 1 1 1 ASN O O 2.016 3.789 -3.729 1.00 . A A . 18 ASN O 1 1 12 3776 1 1 1 ASN OD1 O -1.977 1.312 -1.302 1.00 . A A . 18 ASN OD1 1 1 12 3777 1 1 2 CYS C C 5.260 3.763 -3.357 1.00 . A A . 19 CYS C 1 1 12 3778 1 1 2 CYS CA C 4.310 4.014 -2.190 1.00 . A A . 19 CYS CA 1 1 12 3779 1 1 2 CYS CB C 5.102 4.119 -0.885 1.00 . A A . 19 CYS CB 1 1 12 3780 1 1 2 CYS H H 3.440 2.239 -1.432 1.00 . A A . 19 CYS H 1 1 12 3781 1 1 2 CYS HA H 3.788 4.944 -2.360 1.00 . A A . 19 CYS HA 1 1 12 3782 1 1 2 CYS HB2 H 4.418 4.055 -0.051 1.00 . A A . 19 CYS HB2 1 1 12 3783 1 1 2 CYS HB3 H 5.804 3.299 -0.832 1.00 . A A . 19 CYS HB3 1 1 12 3784 1 1 2 CYS N N 3.314 2.953 -2.093 1.00 . A A . 19 CYS N 1 1 12 3785 1 1 2 CYS O O 6.048 4.633 -3.727 1.00 . A A . 19 CYS O 1 1 12 3786 1 1 2 CYS SG S 6.044 5.668 -0.710 1.00 . A A . 19 CYS SG 1 1 12 3787 1 1 3 ASP C C 5.572 2.896 -6.335 1.00 . A A . 20 ASP C 1 1 12 3788 1 1 3 ASP CA C 6.032 2.202 -5.057 1.00 . A A . 20 ASP CA 1 1 12 3789 1 1 3 ASP CB C 6.028 0.685 -5.255 1.00 . A A . 20 ASP CB 1 1 12 3790 1 1 3 ASP CG C 7.181 0.005 -4.544 1.00 . A A . 20 ASP CG 1 1 12 3791 1 1 3 ASP H H 4.532 1.916 -3.590 1.00 . A A . 20 ASP H 1 1 12 3792 1 1 3 ASP HA H 7.038 2.523 -4.830 1.00 . A A . 20 ASP HA 1 1 12 3793 1 1 3 ASP HB2 H 5.103 0.281 -4.870 1.00 . A A . 20 ASP HB2 1 1 12 3794 1 1 3 ASP HB3 H 6.100 0.467 -6.310 1.00 . A A . 20 ASP HB3 1 1 12 3795 1 1 3 ASP N N 5.180 2.568 -3.931 1.00 . A A . 20 ASP N 1 1 12 3796 1 1 3 ASP O O 6.232 2.812 -7.370 1.00 . A A . 20 ASP O 1 1 12 3797 1 1 3 ASP OD1 O 8.299 -0.001 -5.099 1.00 . A A . 20 ASP OD1 1 1 12 3798 1 1 3 ASP OD2 O 6.965 -0.522 -3.432 1.00 . A A . 20 ASP OD2 1 1 12 3799 1 1 4 TRP C C 3.130 5.536 -6.966 1.00 . A A . 21 TRP C 1 1 12 3800 1 1 4 TRP CA C 3.886 4.287 -7.405 1.00 . A A . 21 TRP CA 1 1 12 3801 1 1 4 TRP CB C 2.959 3.367 -8.200 1.00 . A A . 21 TRP CB 1 1 12 3802 1 1 4 TRP CD1 C 1.229 2.912 -6.364 1.00 . A A . 21 TRP CD1 1 1 12 3803 1 1 4 TRP CD2 C 2.025 1.069 -7.356 1.00 . A A . 21 TRP CD2 1 1 12 3804 1 1 4 TRP CE2 C 1.091 0.683 -6.375 1.00 . A A . 21 TRP CE2 1 1 12 3805 1 1 4 TRP CE3 C 2.656 0.077 -8.112 1.00 . A A . 21 TRP CE3 1 1 12 3806 1 1 4 TRP CG C 2.098 2.498 -7.333 1.00 . A A . 21 TRP CG 1 1 12 3807 1 1 4 TRP CH2 C 1.410 -1.601 -6.884 1.00 . A A . 21 TRP CH2 1 1 12 3808 1 1 4 TRP CZ2 C 0.776 -0.651 -6.130 1.00 . A A . 21 TRP CZ2 1 1 12 3809 1 1 4 TRP CZ3 C 2.343 -1.247 -7.868 1.00 . A A . 21 TRP CZ3 1 1 12 3810 1 1 4 TRP H H 3.955 3.609 -5.400 1.00 . A A . 21 TRP H 1 1 12 3811 1 1 4 TRP HA H 4.712 4.583 -8.036 1.00 . A A . 21 TRP HA 1 1 12 3812 1 1 4 TRP HB2 H 2.309 3.968 -8.819 1.00 . A A . 21 TRP HB2 1 1 12 3813 1 1 4 TRP HB3 H 3.556 2.723 -8.830 1.00 . A A . 21 TRP HB3 1 1 12 3814 1 1 4 TRP HD1 H 1.057 3.945 -6.103 1.00 . A A . 21 TRP HD1 1 1 12 3815 1 1 4 TRP HE1 H -0.044 1.863 -5.063 1.00 . A A . 21 TRP HE1 1 1 12 3816 1 1 4 TRP HE3 H 3.379 0.330 -8.874 1.00 . A A . 21 TRP HE3 1 1 12 3817 1 1 4 TRP HH2 H 1.196 -2.647 -6.728 1.00 . A A . 21 TRP HH2 1 1 12 3818 1 1 4 TRP HZ2 H 0.059 -0.940 -5.377 1.00 . A A . 21 TRP HZ2 1 1 12 3819 1 1 4 TRP HZ3 H 2.821 -2.027 -8.441 1.00 . A A . 21 TRP HZ3 1 1 12 3820 1 1 4 TRP N N 4.436 3.579 -6.254 1.00 . A A . 21 TRP N 1 1 12 3821 1 1 4 TRP NE1 N 0.621 1.826 -5.783 1.00 . A A . 21 TRP NE1 1 1 12 3822 1 1 4 TRP O O 2.612 5.599 -5.851 1.00 . A A . 21 TRP O 1 1 12 3823 1 1 5 ASP C C 1.920 8.461 -8.836 1.00 . A A . 22 ASP C 1 1 12 3824 1 1 5 ASP CA C 2.375 7.774 -7.552 1.00 . A A . 22 ASP CA 1 1 12 3825 1 1 5 ASP CB C 3.282 8.710 -6.751 1.00 . A A . 22 ASP CB 1 1 12 3826 1 1 5 ASP CG C 4.753 8.430 -6.985 1.00 . A A . 22 ASP CG 1 1 12 3827 1 1 5 ASP H H 3.502 6.416 -8.722 1.00 . A A . 22 ASP H 1 1 12 3828 1 1 5 ASP HA H 1.505 7.536 -6.959 1.00 . A A . 22 ASP HA 1 1 12 3829 1 1 5 ASP HB2 H 3.078 9.731 -7.039 1.00 . A A . 22 ASP HB2 1 1 12 3830 1 1 5 ASP HB3 H 3.073 8.588 -5.699 1.00 . A A . 22 ASP HB3 1 1 12 3831 1 1 5 ASP N N 3.070 6.527 -7.849 1.00 . A A . 22 ASP N 1 1 12 3832 1 1 5 ASP O O 2.622 8.438 -9.847 1.00 . A A . 22 ASP O 1 1 12 3833 1 1 5 ASP OD1 O 5.172 8.399 -8.162 1.00 . A A . 22 ASP OD1 1 1 12 3834 1 1 5 ASP OD2 O 5.486 8.243 -5.992 1.00 . A A . 22 ASP OD2 1 1 12 3835 1 1 6 LYS C C 0.304 8.906 -11.201 1.00 . A A . 23 LYS C 1 1 12 3836 1 1 6 LYS CA C 0.191 9.766 -9.946 1.00 . A A . 23 LYS CA 1 1 12 3837 1 1 6 LYS CB C 0.916 11.097 -10.160 1.00 . A A . 23 LYS CB 1 1 12 3838 1 1 6 LYS CD C 0.055 13.147 -8.991 1.00 . A A . 23 LYS CD 1 1 12 3839 1 1 6 LYS CE C 0.772 14.388 -9.501 1.00 . A A . 23 LYS CE 1 1 12 3840 1 1 6 LYS CG C 0.994 11.955 -8.910 1.00 . A A . 23 LYS CG 1 1 12 3841 1 1 6 LYS H H 0.228 9.055 -7.953 1.00 . A A . 23 LYS H 1 1 12 3842 1 1 6 LYS HA H -0.852 9.962 -9.751 1.00 . A A . 23 LYS HA 1 1 12 3843 1 1 6 LYS HB2 H 1.922 10.895 -10.497 1.00 . A A . 23 LYS HB2 1 1 12 3844 1 1 6 LYS HB3 H 0.396 11.657 -10.924 1.00 . A A . 23 LYS HB3 1 1 12 3845 1 1 6 LYS HD2 H -0.755 12.911 -9.666 1.00 . A A . 23 LYS HD2 1 1 12 3846 1 1 6 LYS HD3 H -0.342 13.350 -8.007 1.00 . A A . 23 LYS HD3 1 1 12 3847 1 1 6 LYS HE2 H 0.318 15.259 -9.054 1.00 . A A . 23 LYS HE2 1 1 12 3848 1 1 6 LYS HE3 H 1.810 14.333 -9.208 1.00 . A A . 23 LYS HE3 1 1 12 3849 1 1 6 LYS HG2 H 0.723 11.354 -8.054 1.00 . A A . 23 LYS HG2 1 1 12 3850 1 1 6 LYS HG3 H 2.007 12.314 -8.793 1.00 . A A . 23 LYS HG3 1 1 12 3851 1 1 6 LYS HZ1 H -0.276 14.755 -11.270 1.00 . A A . 23 LYS HZ1 1 1 12 3852 1 1 6 LYS HZ2 H 0.950 13.601 -11.428 1.00 . A A . 23 LYS HZ2 1 1 12 3853 1 1 6 LYS HZ3 H 1.343 15.243 -11.319 1.00 . A A . 23 LYS HZ3 1 1 12 3854 1 1 6 LYS N N 0.741 9.072 -8.788 1.00 . A A . 23 LYS N 1 1 12 3855 1 1 6 LYS NZ N 0.692 14.505 -10.983 1.00 . A A . 23 LYS NZ 1 1 12 3856 1 1 6 LYS O O 0.894 9.321 -12.198 1.00 . A A . 23 LYS O 1 1 12 3857 1 1 7 SER C C -0.962 5.491 -11.947 1.00 . A A . 24 SER C 1 1 12 3858 1 1 7 SER CA C -0.227 6.787 -12.275 1.00 . A A . 24 SER CA 1 1 12 3859 1 1 7 SER CB C 1.221 6.482 -12.662 1.00 . A A . 24 SER CB 1 1 12 3860 1 1 7 SER H H -0.722 7.433 -10.320 1.00 . A A . 24 SER H 1 1 12 3861 1 1 7 SER HA H -0.720 7.266 -13.108 1.00 . A A . 24 SER HA 1 1 12 3862 1 1 7 SER HB2 H 1.882 6.849 -11.891 1.00 . A A . 24 SER HB2 1 1 12 3863 1 1 7 SER HB3 H 1.346 5.413 -12.764 1.00 . A A . 24 SER HB3 1 1 12 3864 1 1 7 SER HG H 2.508 7.268 -13.912 1.00 . A A . 24 SER HG 1 1 12 3865 1 1 7 SER N N -0.266 7.707 -11.144 1.00 . A A . 24 SER N 1 1 12 3866 1 1 7 SER O O -1.563 4.866 -12.822 1.00 . A A . 24 SER O 1 1 12 3867 1 1 7 SER OG O 1.563 7.101 -13.889 1.00 . A A . 24 SER OG 1 1 12 3868 1 1 8 HIS C C -3.088 4.015 -10.313 1.00 . A A . 25 HIS C 1 1 12 3869 1 1 8 HIS CA C -1.571 3.871 -10.235 1.00 . A A . 25 HIS CA 1 1 12 3870 1 1 8 HIS CB C -1.152 3.532 -8.804 1.00 . A A . 25 HIS CB 1 1 12 3871 1 1 8 HIS CD2 C -2.101 1.789 -7.135 1.00 . A A . 25 HIS CD2 1 1 12 3872 1 1 8 HIS CE1 C -2.146 0.053 -8.474 1.00 . A A . 25 HIS CE1 1 1 12 3873 1 1 8 HIS CG C -1.636 2.193 -8.340 1.00 . A A . 25 HIS CG 1 1 12 3874 1 1 8 HIS H H -0.415 5.633 -10.030 1.00 . A A . 25 HIS H 1 1 12 3875 1 1 8 HIS HA H -1.263 3.070 -10.890 1.00 . A A . 25 HIS HA 1 1 12 3876 1 1 8 HIS HB2 H -0.073 3.534 -8.742 1.00 . A A . 25 HIS HB2 1 1 12 3877 1 1 8 HIS HB3 H -1.548 4.280 -8.133 1.00 . A A . 25 HIS HB3 1 1 12 3878 1 1 8 HIS HD1 H -1.401 1.053 -10.096 1.00 . A A . 25 HIS HD1 1 1 12 3879 1 1 8 HIS HD2 H -2.210 2.401 -6.251 1.00 . A A . 25 HIS HD2 1 1 12 3880 1 1 8 HIS HE1 H -2.288 -0.947 -8.855 1.00 . A A . 25 HIS HE1 1 1 12 3881 1 1 8 HIS N N -0.910 5.093 -10.680 1.00 . A A . 25 HIS N 1 1 12 3882 1 1 8 HIS ND1 N -1.675 1.082 -9.156 1.00 . A A . 25 HIS ND1 1 1 12 3883 1 1 8 HIS NE2 N -2.412 0.455 -7.244 1.00 . A A . 25 HIS NE2 1 1 12 3884 1 1 8 HIS O O -3.622 5.116 -10.195 1.00 . A A . 25 HIS O 1 1 12 3885 1 1 9 GLU C C -5.861 3.243 -9.263 1.00 . A A . 26 GLU C 1 1 12 3886 1 1 9 GLU CA C -5.229 2.897 -10.608 1.00 . A A . 26 GLU CA 1 1 12 3887 1 1 9 GLU CB C -5.734 1.533 -11.086 1.00 . A A . 26 GLU CB 1 1 12 3888 1 1 9 GLU CD C -6.238 -0.871 -10.497 1.00 . A A . 26 GLU CD 1 1 12 3889 1 1 9 GLU CG C -5.760 0.477 -9.993 1.00 . A A . 26 GLU CG 1 1 12 3890 1 1 9 GLU H H -3.291 2.046 -10.599 1.00 . A A . 26 GLU H 1 1 12 3891 1 1 9 GLU HA H -5.513 3.648 -11.330 1.00 . A A . 26 GLU HA 1 1 12 3892 1 1 9 GLU HB2 H -6.736 1.648 -11.471 1.00 . A A . 26 GLU HB2 1 1 12 3893 1 1 9 GLU HB3 H -5.091 1.183 -11.880 1.00 . A A . 26 GLU HB3 1 1 12 3894 1 1 9 GLU HG2 H -4.762 0.363 -9.597 1.00 . A A . 26 GLU HG2 1 1 12 3895 1 1 9 GLU HG3 H -6.423 0.807 -9.207 1.00 . A A . 26 GLU HG3 1 1 12 3896 1 1 9 GLU N N -3.774 2.894 -10.513 1.00 . A A . 26 GLU N 1 1 12 3897 1 1 9 GLU O O -6.946 3.822 -9.205 1.00 . A A . 26 GLU O 1 1 12 3898 1 1 9 GLU OE1 O -6.780 -0.927 -11.620 1.00 . A A . 26 GLU OE1 1 1 12 3899 1 1 9 GLU OE2 O -6.070 -1.870 -9.766 1.00 . A A . 26 GLU OE2 1 1 12 3900 1 1 10 LYS C C -5.018 4.410 -6.265 1.00 . A A . 27 LYS C 1 1 12 3901 1 1 10 LYS CA C -5.668 3.155 -6.838 1.00 . A A . 27 LYS CA 1 1 12 3902 1 1 10 LYS CB C -5.393 1.961 -5.921 1.00 . A A . 27 LYS CB 1 1 12 3903 1 1 10 LYS CD C -6.110 -0.343 -5.223 1.00 . A A . 27 LYS CD 1 1 12 3904 1 1 10 LYS CE C -4.858 -1.205 -5.293 1.00 . A A . 27 LYS CE 1 1 12 3905 1 1 10 LYS CG C -6.132 0.698 -6.330 1.00 . A A . 27 LYS CG 1 1 12 3906 1 1 10 LYS H H -4.316 2.424 -8.294 1.00 . A A . 27 LYS H 1 1 12 3907 1 1 10 LYS HA H -6.734 3.313 -6.901 1.00 . A A . 27 LYS HA 1 1 12 3908 1 1 10 LYS HB2 H -4.334 1.752 -5.930 1.00 . A A . 27 LYS HB2 1 1 12 3909 1 1 10 LYS HB3 H -5.692 2.219 -4.916 1.00 . A A . 27 LYS HB3 1 1 12 3910 1 1 10 LYS HD2 H -6.134 0.159 -4.267 1.00 . A A . 27 LYS HD2 1 1 12 3911 1 1 10 LYS HD3 H -6.979 -0.978 -5.321 1.00 . A A . 27 LYS HD3 1 1 12 3912 1 1 10 LYS HE2 H -4.340 -0.990 -6.215 1.00 . A A . 27 LYS HE2 1 1 12 3913 1 1 10 LYS HE3 H -4.221 -0.959 -4.456 1.00 . A A . 27 LYS HE3 1 1 12 3914 1 1 10 LYS HG2 H -7.158 0.948 -6.553 1.00 . A A . 27 LYS HG2 1 1 12 3915 1 1 10 LYS HG3 H -5.660 0.285 -7.210 1.00 . A A . 27 LYS HG3 1 1 12 3916 1 1 10 LYS HZ1 H -5.689 -2.938 -6.110 1.00 . A A . 27 LYS HZ1 1 1 12 3917 1 1 10 LYS HZ2 H -5.783 -2.863 -4.423 1.00 . A A . 27 LYS HZ2 1 1 12 3918 1 1 10 LYS HZ3 H -4.308 -3.216 -5.173 1.00 . A A . 27 LYS HZ3 1 1 12 3919 1 1 10 LYS N N -5.176 2.883 -8.184 1.00 . A A . 27 LYS N 1 1 12 3920 1 1 10 LYS NZ N -5.182 -2.657 -5.246 1.00 . A A . 27 LYS NZ 1 1 12 3921 1 1 10 LYS O O -5.348 4.842 -5.160 1.00 . A A . 27 LYS O 1 1 12 3922 1 1 11 TYR C C -4.387 7.312 -6.269 1.00 . A A . 28 TYR C 1 1 12 3923 1 1 11 TYR CA C -3.397 6.196 -6.588 1.00 . A A . 28 TYR CA 1 1 12 3924 1 1 11 TYR CB C -2.417 6.661 -7.667 1.00 . A A . 28 TYR CB 1 1 12 3925 1 1 11 TYR CD1 C -2.332 9.176 -7.459 1.00 . A A . 28 TYR CD1 1 1 12 3926 1 1 11 TYR CD2 C -3.347 8.241 -9.403 1.00 . A A . 28 TYR CD2 1 1 12 3927 1 1 11 TYR CE1 C -2.592 10.448 -7.930 1.00 . A A . 28 TYR CE1 1 1 12 3928 1 1 11 TYR CE2 C -3.609 9.510 -9.882 1.00 . A A . 28 TYR CE2 1 1 12 3929 1 1 11 TYR CG C -2.704 8.051 -8.186 1.00 . A A . 28 TYR CG 1 1 12 3930 1 1 11 TYR CZ C -3.230 10.611 -9.141 1.00 . A A . 28 TYR CZ 1 1 12 3931 1 1 11 TYR H H -3.874 4.599 -7.893 1.00 . A A . 28 TYR H 1 1 12 3932 1 1 11 TYR HA H -2.843 5.955 -5.692 1.00 . A A . 28 TYR HA 1 1 12 3933 1 1 11 TYR HB2 H -1.418 6.658 -7.261 1.00 . A A . 28 TYR HB2 1 1 12 3934 1 1 11 TYR HB3 H -2.463 5.978 -8.503 1.00 . A A . 28 TYR HB3 1 1 12 3935 1 1 11 TYR HD1 H -1.831 9.046 -6.511 1.00 . A A . 28 TYR HD1 1 1 12 3936 1 1 11 TYR HD2 H -3.643 7.377 -9.980 1.00 . A A . 28 TYR HD2 1 1 12 3937 1 1 11 TYR HE1 H -2.295 11.310 -7.350 1.00 . A A . 28 TYR HE1 1 1 12 3938 1 1 11 TYR HE2 H -4.110 9.637 -10.830 1.00 . A A . 28 TYR HE2 1 1 12 3939 1 1 11 TYR HH H -2.780 12.153 -10.197 1.00 . A A . 28 TYR HH 1 1 12 3940 1 1 11 TYR N N -4.094 4.991 -7.022 1.00 . A A . 28 TYR N 1 1 12 3941 1 1 11 TYR O O -5.425 7.442 -6.918 1.00 . A A . 28 TYR O 1 1 12 3942 1 1 11 TYR OH O -3.491 11.876 -9.614 1.00 . A A . 28 TYR OH 1 1 12 3943 1 1 12 ASP C C -4.136 10.537 -4.841 1.00 . A A . 29 ASP C 1 1 12 3944 1 1 12 ASP CA C -4.914 9.225 -4.859 1.00 . A A . 29 ASP CA 1 1 12 3945 1 1 12 ASP CB C -5.514 8.954 -3.479 1.00 . A A . 29 ASP CB 1 1 12 3946 1 1 12 ASP CG C -6.742 8.067 -3.545 1.00 . A A . 29 ASP CG 1 1 12 3947 1 1 12 ASP H H -3.216 7.963 -4.785 1.00 . A A . 29 ASP H 1 1 12 3948 1 1 12 ASP HA H -5.714 9.306 -5.579 1.00 . A A . 29 ASP HA 1 1 12 3949 1 1 12 ASP HB2 H -4.774 8.467 -2.861 1.00 . A A . 29 ASP HB2 1 1 12 3950 1 1 12 ASP HB3 H -5.795 9.893 -3.025 1.00 . A A . 29 ASP HB3 1 1 12 3951 1 1 12 ASP N N -4.057 8.117 -5.265 1.00 . A A . 29 ASP N 1 1 12 3952 1 1 12 ASP O O -3.043 10.613 -4.279 1.00 . A A . 29 ASP O 1 1 12 3953 1 1 12 ASP OD1 O -7.818 8.570 -3.928 1.00 . A A . 29 ASP OD1 1 1 12 3954 1 1 12 ASP OD2 O -6.627 6.868 -3.212 1.00 . A A . 29 ASP OD2 1 1 12 3955 1 1 13 TRP C C -3.707 13.365 -4.116 1.00 . A A . 30 TRP C 1 1 12 3956 1 1 13 TRP CA C -4.063 12.873 -5.515 1.00 . A A . 30 TRP CA 1 1 12 3957 1 1 13 TRP CB C -4.979 13.884 -6.206 1.00 . A A . 30 TRP CB 1 1 12 3958 1 1 13 TRP CD1 C -4.314 15.052 -8.389 1.00 . A A . 30 TRP CD1 1 1 12 3959 1 1 13 TRP CD2 C -3.305 15.868 -6.563 1.00 . A A . 30 TRP CD2 1 1 12 3960 1 1 13 TRP CE2 C -2.855 16.590 -7.686 1.00 . A A . 30 TRP CE2 1 1 12 3961 1 1 13 TRP CE3 C -2.807 16.205 -5.302 1.00 . A A . 30 TRP CE3 1 1 12 3962 1 1 13 TRP CG C -4.237 14.889 -7.035 1.00 . A A . 30 TRP CG 1 1 12 3963 1 1 13 TRP CH2 C -1.462 17.937 -6.336 1.00 . A A . 30 TRP CH2 1 1 12 3964 1 1 13 TRP CZ2 C -1.933 17.627 -7.583 1.00 . A A . 30 TRP CZ2 1 1 12 3965 1 1 13 TRP CZ3 C -1.891 17.235 -5.201 1.00 . A A . 30 TRP CZ3 1 1 12 3966 1 1 13 TRP H H -5.578 11.442 -5.889 1.00 . A A . 30 TRP H 1 1 12 3967 1 1 13 TRP HA H -3.155 12.772 -6.090 1.00 . A A . 30 TRP HA 1 1 12 3968 1 1 13 TRP HB2 H -5.663 13.357 -6.855 1.00 . A A . 30 TRP HB2 1 1 12 3969 1 1 13 TRP HB3 H -5.542 14.421 -5.456 1.00 . A A . 30 TRP HB3 1 1 12 3970 1 1 13 TRP HD1 H -4.937 14.456 -9.038 1.00 . A A . 30 TRP HD1 1 1 12 3971 1 1 13 TRP HE1 H -3.366 16.381 -9.710 1.00 . A A . 30 TRP HE1 1 1 12 3972 1 1 13 TRP HE3 H -3.125 15.676 -4.416 1.00 . A A . 30 TRP HE3 1 1 12 3973 1 1 13 TRP HH2 H -0.745 18.733 -6.210 1.00 . A A . 30 TRP HH2 1 1 12 3974 1 1 13 TRP HZ2 H -1.593 18.178 -8.448 1.00 . A A . 30 TRP HZ2 1 1 12 3975 1 1 13 TRP HZ3 H -1.495 17.510 -4.235 1.00 . A A . 30 TRP HZ3 1 1 12 3976 1 1 13 TRP N N -4.705 11.565 -5.459 1.00 . A A . 30 TRP N 1 1 12 3977 1 1 13 TRP NE1 N -3.485 16.073 -8.787 1.00 . A A . 30 TRP NE1 1 1 12 3978 1 1 13 TRP O O -2.532 13.453 -3.761 1.00 . A A . 30 TRP O 1 1 12 3979 1 1 14 GLU C C -4.068 13.034 -1.051 1.00 . A A . 31 GLU C 1 1 12 3980 1 1 14 GLU CA C -4.521 14.167 -1.967 1.00 . A A . 31 GLU CA 1 1 12 3981 1 1 14 GLU CB C -5.806 14.795 -1.424 1.00 . A A . 31 GLU CB 1 1 12 3982 1 1 14 GLU CD C -7.155 16.900 -1.065 1.00 . A A . 31 GLU CD 1 1 12 3983 1 1 14 GLU CG C -5.855 16.306 -1.572 1.00 . A A . 31 GLU CG 1 1 12 3984 1 1 14 GLU H H -5.643 13.592 -3.668 1.00 . A A . 31 GLU H 1 1 12 3985 1 1 14 GLU HA H -3.748 14.920 -1.997 1.00 . A A . 31 GLU HA 1 1 12 3986 1 1 14 GLU HB2 H -6.649 14.374 -1.951 1.00 . A A . 31 GLU HB2 1 1 12 3987 1 1 14 GLU HB3 H -5.894 14.554 -0.374 1.00 . A A . 31 GLU HB3 1 1 12 3988 1 1 14 GLU HG2 H -5.038 16.736 -1.011 1.00 . A A . 31 GLU HG2 1 1 12 3989 1 1 14 GLU HG3 H -5.744 16.557 -2.616 1.00 . A A . 31 GLU HG3 1 1 12 3990 1 1 14 GLU N N -4.729 13.683 -3.327 1.00 . A A . 31 GLU N 1 1 12 3991 1 1 14 GLU O O -3.059 13.149 -0.353 1.00 . A A . 31 GLU O 1 1 12 3992 1 1 14 GLU OE1 O -7.273 17.114 0.159 1.00 . A A . 31 GLU OE1 1 1 12 3993 1 1 14 GLU OE2 O -8.054 17.152 -1.894 1.00 . A A . 31 GLU OE2 1 1 12 3994 1 1 15 LEU C C -3.068 10.318 -0.472 1.00 . A A . 32 LEU C 1 1 12 3995 1 1 15 LEU CA C -4.499 10.785 -0.225 1.00 . A A . 32 LEU CA 1 1 12 3996 1 1 15 LEU CB C -5.476 9.641 -0.506 1.00 . A A . 32 LEU CB 1 1 12 3997 1 1 15 LEU CD1 C -6.802 10.134 1.563 1.00 . A A . 32 LEU CD1 1 1 12 3998 1 1 15 LEU CD2 C -7.225 8.027 0.283 1.00 . A A . 32 LEU CD2 1 1 12 3999 1 1 15 LEU CG C -6.174 9.040 0.715 1.00 . A A . 32 LEU CG 1 1 12 4000 1 1 15 LEU H H -5.613 11.906 -1.632 1.00 . A A . 32 LEU H 1 1 12 4001 1 1 15 LEU HA H -4.594 11.083 0.808 1.00 . A A . 32 LEU HA 1 1 12 4002 1 1 15 LEU HB2 H -6.238 10.014 -1.172 1.00 . A A . 32 LEU HB2 1 1 12 4003 1 1 15 LEU HB3 H -4.926 8.851 -0.997 1.00 . A A . 32 LEU HB3 1 1 12 4004 1 1 15 LEU HD11 H -7.728 9.775 1.986 1.00 . A A . 32 LEU HD11 1 1 12 4005 1 1 15 LEU HD12 H -6.999 10.999 0.947 1.00 . A A . 32 LEU HD12 1 1 12 4006 1 1 15 LEU HD13 H -6.124 10.407 2.359 1.00 . A A . 32 LEU HD13 1 1 12 4007 1 1 15 LEU HD21 H -7.293 7.243 1.022 1.00 . A A . 32 LEU HD21 1 1 12 4008 1 1 15 LEU HD22 H -6.944 7.601 -0.670 1.00 . A A . 32 LEU HD22 1 1 12 4009 1 1 15 LEU HD23 H -8.181 8.519 0.190 1.00 . A A . 32 LEU HD23 1 1 12 4010 1 1 15 LEU HG H -5.442 8.526 1.323 1.00 . A A . 32 LEU HG 1 1 12 4011 1 1 15 LEU N N -4.821 11.939 -1.056 1.00 . A A . 32 LEU N 1 1 12 4012 1 1 15 LEU O O -2.491 9.596 0.340 1.00 . A A . 32 LEU O 1 1 12 4013 1 1 16 TRP C C -0.221 10.430 -0.731 1.00 . A A . 33 TRP C 1 1 12 4014 1 1 16 TRP CA C -1.135 10.365 -1.950 1.00 . A A . 33 TRP CA 1 1 12 4015 1 1 16 TRP CB C -0.603 11.283 -3.052 1.00 . A A . 33 TRP CB 1 1 12 4016 1 1 16 TRP CD1 C 1.535 10.439 -4.186 1.00 . A A . 33 TRP CD1 1 1 12 4017 1 1 16 TRP CD2 C 1.892 11.840 -2.476 1.00 . A A . 33 TRP CD2 1 1 12 4018 1 1 16 TRP CE2 C 3.138 11.454 -3.007 1.00 . A A . 33 TRP CE2 1 1 12 4019 1 1 16 TRP CE3 C 1.866 12.721 -1.391 1.00 . A A . 33 TRP CE3 1 1 12 4020 1 1 16 TRP CG C 0.880 11.181 -3.245 1.00 . A A . 33 TRP CG 1 1 12 4021 1 1 16 TRP CH2 C 4.289 12.779 -1.428 1.00 . A A . 33 TRP CH2 1 1 12 4022 1 1 16 TRP CZ2 C 4.344 11.918 -2.489 1.00 . A A . 33 TRP CZ2 1 1 12 4023 1 1 16 TRP CZ3 C 3.065 13.181 -0.878 1.00 . A A . 33 TRP CZ3 1 1 12 4024 1 1 16 TRP H H -3.012 11.313 -2.205 1.00 . A A . 33 TRP H 1 1 12 4025 1 1 16 TRP HA H -1.155 9.350 -2.318 1.00 . A A . 33 TRP HA 1 1 12 4026 1 1 16 TRP HB2 H -1.079 11.027 -3.986 1.00 . A A . 33 TRP HB2 1 1 12 4027 1 1 16 TRP HB3 H -0.837 12.307 -2.801 1.00 . A A . 33 TRP HB3 1 1 12 4028 1 1 16 TRP HD1 H 1.044 9.822 -4.923 1.00 . A A . 33 TRP HD1 1 1 12 4029 1 1 16 TRP HE1 H 3.575 10.170 -4.608 1.00 . A A . 33 TRP HE1 1 1 12 4030 1 1 16 TRP HE3 H 0.932 13.042 -0.954 1.00 . A A . 33 TRP HE3 1 1 12 4031 1 1 16 TRP HH2 H 5.200 13.163 -0.995 1.00 . A A . 33 TRP HH2 1 1 12 4032 1 1 16 TRP HZ2 H 5.296 11.618 -2.902 1.00 . A A . 33 TRP HZ2 1 1 12 4033 1 1 16 TRP HZ3 H 3.065 13.862 -0.040 1.00 . A A . 33 TRP HZ3 1 1 12 4034 1 1 16 TRP N N -2.501 10.738 -1.597 1.00 . A A . 33 TRP N 1 1 12 4035 1 1 16 TRP NE1 N 2.893 10.599 -4.049 1.00 . A A . 33 TRP NE1 1 1 12 4036 1 1 16 TRP O O 0.676 9.602 -0.572 1.00 . A A . 33 TRP O 1 1 12 4037 1 1 17 ASP C C 0.330 10.322 2.181 1.00 . A A . 34 ASP C 1 1 12 4038 1 1 17 ASP CA C 0.348 11.589 1.331 1.00 . A A . 34 ASP CA 1 1 12 4039 1 1 17 ASP CB C -0.168 12.774 2.149 1.00 . A A . 34 ASP CB 1 1 12 4040 1 1 17 ASP CG C 0.750 13.125 3.303 1.00 . A A . 34 ASP CG 1 1 12 4041 1 1 17 ASP H H -1.184 12.046 -0.056 1.00 . A A . 34 ASP H 1 1 12 4042 1 1 17 ASP HA H 1.364 11.789 1.028 1.00 . A A . 34 ASP HA 1 1 12 4043 1 1 17 ASP HB2 H -0.254 13.637 1.506 1.00 . A A . 34 ASP HB2 1 1 12 4044 1 1 17 ASP HB3 H -1.142 12.530 2.549 1.00 . A A . 34 ASP HB3 1 1 12 4045 1 1 17 ASP N N -0.454 11.418 0.126 1.00 . A A . 34 ASP N 1 1 12 4046 1 1 17 ASP O O 1.378 9.769 2.514 1.00 . A A . 34 ASP O 1 1 12 4047 1 1 17 ASP OD1 O 0.740 12.392 4.313 1.00 . A A . 34 ASP OD1 1 1 12 4048 1 1 17 ASP OD2 O 1.479 14.134 3.195 1.00 . A A . 34 ASP OD2 1 1 12 4049 1 1 18 LYS C C -0.881 7.410 2.486 1.00 . A A . 35 LYS C 1 1 12 4050 1 1 18 LYS CA C -1.025 8.665 3.341 1.00 . A A . 35 LYS CA 1 1 12 4051 1 1 18 LYS CB C -2.389 8.668 4.036 1.00 . A A . 35 LYS CB 1 1 12 4052 1 1 18 LYS CD C -4.497 7.408 3.513 1.00 . A A . 35 LYS CD 1 1 12 4053 1 1 18 LYS CE C -3.999 6.048 3.048 1.00 . A A . 35 LYS CE 1 1 12 4054 1 1 18 LYS CG C -3.559 8.522 3.080 1.00 . A A . 35 LYS CG 1 1 12 4055 1 1 18 LYS H H -1.669 10.351 2.234 1.00 . A A . 35 LYS H 1 1 12 4056 1 1 18 LYS HA H -0.248 8.667 4.090 1.00 . A A . 35 LYS HA 1 1 12 4057 1 1 18 LYS HB2 H -2.422 7.850 4.740 1.00 . A A . 35 LYS HB2 1 1 12 4058 1 1 18 LYS HB3 H -2.503 9.599 4.573 1.00 . A A . 35 LYS HB3 1 1 12 4059 1 1 18 LYS HD2 H -4.565 7.404 4.590 1.00 . A A . 35 LYS HD2 1 1 12 4060 1 1 18 LYS HD3 H -5.476 7.587 3.089 1.00 . A A . 35 LYS HD3 1 1 12 4061 1 1 18 LYS HE2 H -4.730 5.621 2.378 1.00 . A A . 35 LYS HE2 1 1 12 4062 1 1 18 LYS HE3 H -3.065 6.181 2.524 1.00 . A A . 35 LYS HE3 1 1 12 4063 1 1 18 LYS HG2 H -4.109 9.451 3.053 1.00 . A A . 35 LYS HG2 1 1 12 4064 1 1 18 LYS HG3 H -3.180 8.298 2.093 1.00 . A A . 35 LYS HG3 1 1 12 4065 1 1 18 LYS HZ1 H -2.794 5.152 4.500 1.00 . A A . 35 LYS HZ1 1 1 12 4066 1 1 18 LYS HZ2 H -4.011 4.142 3.903 1.00 . A A . 35 LYS HZ2 1 1 12 4067 1 1 18 LYS HZ3 H -4.398 5.381 4.987 1.00 . A A . 35 LYS HZ3 1 1 12 4068 1 1 18 LYS N N -0.869 9.867 2.530 1.00 . A A . 35 LYS N 1 1 12 4069 1 1 18 LYS NZ N -3.786 5.115 4.190 1.00 . A A . 35 LYS NZ 1 1 12 4070 1 1 18 LYS O O -0.753 6.303 3.009 1.00 . A A . 35 LYS O 1 1 12 4071 1 1 19 TRP C C 0.682 6.272 -0.169 1.00 . A A . 36 TRP C 1 1 12 4072 1 1 19 TRP CA C -0.772 6.471 0.244 1.00 . A A . 36 TRP CA 1 1 12 4073 1 1 19 TRP CB C -1.639 6.704 -0.994 1.00 . A A . 36 TRP CB 1 1 12 4074 1 1 19 TRP CD1 C -4.040 6.547 -0.112 1.00 . A A . 36 TRP CD1 1 1 12 4075 1 1 19 TRP CD2 C -3.487 4.937 -1.568 1.00 . A A . 36 TRP CD2 1 1 12 4076 1 1 19 TRP CE2 C -4.821 4.737 -1.162 1.00 . A A . 36 TRP CE2 1 1 12 4077 1 1 19 TRP CE3 C -2.921 4.047 -2.484 1.00 . A A . 36 TRP CE3 1 1 12 4078 1 1 19 TRP CG C -3.006 6.100 -0.884 1.00 . A A . 36 TRP CG 1 1 12 4079 1 1 19 TRP CH2 C -5.014 2.827 -2.537 1.00 . A A . 36 TRP CH2 1 1 12 4080 1 1 19 TRP CZ2 C -5.594 3.683 -1.642 1.00 . A A . 36 TRP CZ2 1 1 12 4081 1 1 19 TRP CZ3 C -3.689 3.001 -2.958 1.00 . A A . 36 TRP CZ3 1 1 12 4082 1 1 19 TRP H H -1.007 8.497 0.813 1.00 . A A . 36 TRP H 1 1 12 4083 1 1 19 TRP HA H -1.115 5.581 0.750 1.00 . A A . 36 TRP HA 1 1 12 4084 1 1 19 TRP HB2 H -1.756 7.766 -1.150 1.00 . A A . 36 TRP HB2 1 1 12 4085 1 1 19 TRP HB3 H -1.150 6.270 -1.854 1.00 . A A . 36 TRP HB3 1 1 12 4086 1 1 19 TRP HD1 H -3.990 7.414 0.529 1.00 . A A . 36 TRP HD1 1 1 12 4087 1 1 19 TRP HE1 H -6.000 5.846 0.173 1.00 . A A . 36 TRP HE1 1 1 12 4088 1 1 19 TRP HE3 H -1.901 4.164 -2.820 1.00 . A A . 36 TRP HE3 1 1 12 4089 1 1 19 TRP HH2 H -5.577 1.996 -2.934 1.00 . A A . 36 TRP HH2 1 1 12 4090 1 1 19 TRP HZ2 H -6.617 3.536 -1.328 1.00 . A A . 36 TRP HZ2 1 1 12 4091 1 1 19 TRP HZ3 H -3.268 2.302 -3.666 1.00 . A A . 36 TRP HZ3 1 1 12 4092 1 1 19 TRP N N -0.902 7.590 1.170 1.00 . A A . 36 TRP N 1 1 12 4093 1 1 19 TRP NE1 N -5.135 5.732 -0.274 1.00 . A A . 36 TRP NE1 1 1 12 4094 1 1 19 TRP O O 0.969 5.632 -1.181 1.00 . A A . 36 TRP O 1 1 12 4095 1 1 20 CYS C C 3.852 7.344 1.448 1.00 . A A . 37 CYS C 1 1 12 4096 1 1 20 CYS CA C 3.023 6.708 0.336 1.00 . A A . 37 CYS CA 1 1 12 4097 1 1 20 CYS CB C 3.353 7.368 -1.003 1.00 . A A . 37 CYS CB 1 1 12 4098 1 1 20 CYS H H 1.308 7.323 1.413 1.00 . A A . 37 CYS H 1 1 12 4099 1 1 20 CYS HA H 3.265 5.658 0.280 1.00 . A A . 37 CYS HA 1 1 12 4100 1 1 20 CYS HB2 H 2.764 6.904 -1.780 1.00 . A A . 37 CYS HB2 1 1 12 4101 1 1 20 CYS HB3 H 3.105 8.418 -0.949 1.00 . A A . 37 CYS HB3 1 1 12 4102 1 1 20 CYS N N 1.598 6.824 0.620 1.00 . A A . 37 CYS N 1 1 12 4103 1 1 20 CYS O O 3.675 7.031 2.625 1.00 . A A . 37 CYS O 1 1 12 4104 1 1 20 CYS SG S 5.105 7.236 -1.486 1.00 . A A . 37 CYS SG 1 1 13 4105 1 1 1 ASN C C 2.236 2.895 -2.888 1.00 . A A . 18 ASN C 1 1 13 4106 1 1 1 ASN CA C 1.274 1.728 -2.687 1.00 . A A . 18 ASN CA 1 1 13 4107 1 1 1 ASN CB C -0.153 2.253 -2.514 1.00 . A A . 18 ASN CB 1 1 13 4108 1 1 1 ASN CG C -1.144 1.145 -2.212 1.00 . A A . 18 ASN CG 1 1 13 4109 1 1 1 ASN H1 H 1.589 1.314 -0.635 1.00 . A A . 18 ASN H1 1 1 13 4110 1 1 1 ASN HA H 1.310 1.093 -3.559 1.00 . A A . 18 ASN HA 1 1 13 4111 1 1 1 ASN HB2 H -0.173 2.960 -1.697 1.00 . A A . 18 ASN HB2 1 1 13 4112 1 1 1 ASN HB3 H -0.461 2.750 -3.421 1.00 . A A . 18 ASN HB3 1 1 13 4113 1 1 1 ASN HD21 H -0.347 0.011 -3.639 1.00 . A A . 18 ASN HD21 1 1 13 4114 1 1 1 ASN HD22 H -1.673 -0.686 -2.778 1.00 . A A . 18 ASN HD22 1 1 13 4115 1 1 1 ASN N N 1.662 0.927 -1.533 1.00 . A A . 18 ASN N 1 1 13 4116 1 1 1 ASN ND2 N -1.044 0.046 -2.951 1.00 . A A . 18 ASN ND2 1 1 13 4117 1 1 1 ASN O O 2.012 3.761 -3.734 1.00 . A A . 18 ASN O 1 1 13 4118 1 1 1 ASN OD1 O -1.988 1.277 -1.326 1.00 . A A . 18 ASN OD1 1 1 13 4119 1 1 2 CYS C C 5.257 3.726 -3.361 1.00 . A A . 19 CYS C 1 1 13 4120 1 1 2 CYS CA C 4.306 3.972 -2.193 1.00 . A A . 19 CYS CA 1 1 13 4121 1 1 2 CYS CB C 5.098 4.067 -0.888 1.00 . A A . 19 CYS CB 1 1 13 4122 1 1 2 CYS H H 3.432 2.194 -1.447 1.00 . A A . 19 CYS H 1 1 13 4123 1 1 2 CYS HA H 3.786 4.903 -2.358 1.00 . A A . 19 CYS HA 1 1 13 4124 1 1 2 CYS HB2 H 4.413 4.002 -0.055 1.00 . A A . 19 CYS HB2 1 1 13 4125 1 1 2 CYS HB3 H 5.796 3.245 -0.838 1.00 . A A . 19 CYS HB3 1 1 13 4126 1 1 2 CYS N N 3.308 2.912 -2.103 1.00 . A A . 19 CYS N 1 1 13 4127 1 1 2 CYS O O 6.045 4.598 -3.728 1.00 . A A . 19 CYS O 1 1 13 4128 1 1 2 CYS SG S 6.045 5.612 -0.705 1.00 . A A . 19 CYS SG 1 1 13 4129 1 1 3 ASP C C 5.570 2.876 -6.342 1.00 . A A . 20 ASP C 1 1 13 4130 1 1 3 ASP CA C 6.028 2.172 -5.068 1.00 . A A . 20 ASP CA 1 1 13 4131 1 1 3 ASP CB C 6.020 0.657 -5.276 1.00 . A A . 20 ASP CB 1 1 13 4132 1 1 3 ASP CG C 7.171 -0.031 -4.569 1.00 . A A . 20 ASP CG 1 1 13 4133 1 1 3 ASP H H 4.528 1.880 -3.603 1.00 . A A . 20 ASP H 1 1 13 4134 1 1 3 ASP HA H 7.034 2.489 -4.839 1.00 . A A . 20 ASP HA 1 1 13 4135 1 1 3 ASP HB2 H 5.094 0.252 -4.894 1.00 . A A . 20 ASP HB2 1 1 13 4136 1 1 3 ASP HB3 H 6.092 0.445 -6.333 1.00 . A A . 20 ASP HB3 1 1 13 4137 1 1 3 ASP N N 5.176 2.533 -3.941 1.00 . A A . 20 ASP N 1 1 13 4138 1 1 3 ASP O O 6.233 2.799 -7.377 1.00 . A A . 20 ASP O 1 1 13 4139 1 1 3 ASP OD1 O 7.065 -0.258 -3.345 1.00 . A A . 20 ASP OD1 1 1 13 4140 1 1 3 ASP OD2 O 8.177 -0.343 -5.239 1.00 . A A . 20 ASP OD2 1 1 13 4141 1 1 4 TRP C C 3.135 5.523 -6.960 1.00 . A A . 21 TRP C 1 1 13 4142 1 1 4 TRP CA C 3.888 4.275 -7.406 1.00 . A A . 21 TRP CA 1 1 13 4143 1 1 4 TRP CB C 2.958 3.362 -8.207 1.00 . A A . 21 TRP CB 1 1 13 4144 1 1 4 TRP CD1 C 1.226 2.902 -6.375 1.00 . A A . 21 TRP CD1 1 1 13 4145 1 1 4 TRP CD2 C 2.018 1.062 -7.377 1.00 . A A . 21 TRP CD2 1 1 13 4146 1 1 4 TRP CE2 C 1.082 0.673 -6.398 1.00 . A A . 21 TRP CE2 1 1 13 4147 1 1 4 TRP CE3 C 2.647 0.072 -8.137 1.00 . A A . 21 TRP CE3 1 1 13 4148 1 1 4 TRP CG C 2.094 2.491 -7.346 1.00 . A A . 21 TRP CG 1 1 13 4149 1 1 4 TRP CH2 C 1.395 -1.609 -6.920 1.00 . A A . 21 TRP CH2 1 1 13 4150 1 1 4 TRP CZ2 C 0.764 -0.661 -6.161 1.00 . A A . 21 TRP CZ2 1 1 13 4151 1 1 4 TRP CZ3 C 2.331 -1.252 -7.901 1.00 . A A . 21 TRP CZ3 1 1 13 4152 1 1 4 TRP H H 3.952 3.582 -5.406 1.00 . A A . 21 TRP H 1 1 13 4153 1 1 4 TRP HA H 4.714 4.572 -8.035 1.00 . A A . 21 TRP HA 1 1 13 4154 1 1 4 TRP HB2 H 2.311 3.969 -8.823 1.00 . A A . 21 TRP HB2 1 1 13 4155 1 1 4 TRP HB3 H 3.553 2.720 -8.841 1.00 . A A . 21 TRP HB3 1 1 13 4156 1 1 4 TRP HD1 H 1.056 3.933 -6.108 1.00 . A A . 21 TRP HD1 1 1 13 4157 1 1 4 TRP HE1 H -0.051 1.849 -5.081 1.00 . A A . 21 TRP HE1 1 1 13 4158 1 1 4 TRP HE3 H 3.371 0.328 -8.897 1.00 . A A . 21 TRP HE3 1 1 13 4159 1 1 4 TRP HH2 H 1.179 -2.655 -6.770 1.00 . A A . 21 TRP HH2 1 1 13 4160 1 1 4 TRP HZ2 H 0.045 -0.953 -5.410 1.00 . A A . 21 TRP HZ2 1 1 13 4161 1 1 4 TRP HZ3 H 2.807 -2.030 -8.478 1.00 . A A . 21 TRP HZ3 1 1 13 4162 1 1 4 TRP N N 4.435 3.559 -6.259 1.00 . A A . 21 TRP N 1 1 13 4163 1 1 4 TRP NE1 N 0.614 1.813 -5.801 1.00 . A A . 21 TRP NE1 1 1 13 4164 1 1 4 TRP O O 2.617 5.581 -5.845 1.00 . A A . 21 TRP O 1 1 13 4165 1 1 5 ASP C C 1.935 8.463 -8.813 1.00 . A A . 22 ASP C 1 1 13 4166 1 1 5 ASP CA C 2.387 7.767 -7.533 1.00 . A A . 22 ASP CA 1 1 13 4167 1 1 5 ASP CB C 3.296 8.695 -6.727 1.00 . A A . 22 ASP CB 1 1 13 4168 1 1 5 ASP CG C 4.767 8.413 -6.962 1.00 . A A . 22 ASP CG 1 1 13 4169 1 1 5 ASP H H 3.511 6.413 -8.710 1.00 . A A . 22 ASP H 1 1 13 4170 1 1 5 ASP HA H 1.516 7.528 -6.942 1.00 . A A . 22 ASP HA 1 1 13 4171 1 1 5 ASP HB2 H 3.096 9.719 -7.009 1.00 . A A . 22 ASP HB2 1 1 13 4172 1 1 5 ASP HB3 H 3.087 8.569 -5.675 1.00 . A A . 22 ASP HB3 1 1 13 4173 1 1 5 ASP N N 3.078 6.519 -7.837 1.00 . A A . 22 ASP N 1 1 13 4174 1 1 5 ASP O O 2.637 8.445 -9.825 1.00 . A A . 22 ASP O 1 1 13 4175 1 1 5 ASP OD1 O 5.194 8.428 -8.135 1.00 . A A . 22 ASP OD1 1 1 13 4176 1 1 5 ASP OD2 O 5.491 8.176 -5.972 1.00 . A A . 22 ASP OD2 1 1 13 4177 1 1 6 LYS C C 0.320 8.926 -11.176 1.00 . A A . 23 LYS C 1 1 13 4178 1 1 6 LYS CA C 0.210 9.779 -9.917 1.00 . A A . 23 LYS CA 1 1 13 4179 1 1 6 LYS CB C 0.939 11.109 -10.123 1.00 . A A . 23 LYS CB 1 1 13 4180 1 1 6 LYS CD C 0.085 13.155 -8.943 1.00 . A A . 23 LYS CD 1 1 13 4181 1 1 6 LYS CE C 0.806 14.396 -9.445 1.00 . A A . 23 LYS CE 1 1 13 4182 1 1 6 LYS CG C 1.020 11.960 -8.868 1.00 . A A . 23 LYS CG 1 1 13 4183 1 1 6 LYS H H 0.243 9.056 -7.927 1.00 . A A . 23 LYS H 1 1 13 4184 1 1 6 LYS HA H -0.833 9.978 -9.721 1.00 . A A . 23 LYS HA 1 1 13 4185 1 1 6 LYS HB2 H 1.945 10.905 -10.461 1.00 . A A . 23 LYS HB2 1 1 13 4186 1 1 6 LYS HB3 H 0.422 11.675 -10.884 1.00 . A A . 23 LYS HB3 1 1 13 4187 1 1 6 LYS HD2 H -0.725 12.925 -9.619 1.00 . A A . 23 LYS HD2 1 1 13 4188 1 1 6 LYS HD3 H -0.312 13.353 -7.958 1.00 . A A . 23 LYS HD3 1 1 13 4189 1 1 6 LYS HE2 H 0.353 15.266 -8.996 1.00 . A A . 23 LYS HE2 1 1 13 4190 1 1 6 LYS HE3 H 1.844 14.338 -9.151 1.00 . A A . 23 LYS HE3 1 1 13 4191 1 1 6 LYS HG2 H 0.746 11.355 -8.016 1.00 . A A . 23 LYS HG2 1 1 13 4192 1 1 6 LYS HG3 H 2.034 12.314 -8.749 1.00 . A A . 23 LYS HG3 1 1 13 4193 1 1 6 LYS HZ1 H -0.069 13.963 -11.292 1.00 . A A . 23 LYS HZ1 1 1 13 4194 1 1 6 LYS HZ2 H 1.607 14.172 -11.361 1.00 . A A . 23 LYS HZ2 1 1 13 4195 1 1 6 LYS HZ3 H 0.594 15.517 -11.196 1.00 . A A . 23 LYS HZ3 1 1 13 4196 1 1 6 LYS N N 0.757 9.076 -8.763 1.00 . A A . 23 LYS N 1 1 13 4197 1 1 6 LYS NZ N 0.729 14.521 -10.927 1.00 . A A . 23 LYS NZ 1 1 13 4198 1 1 6 LYS O O 0.911 9.345 -12.171 1.00 . A A . 23 LYS O 1 1 13 4199 1 1 7 SER C C -0.957 5.519 -11.941 1.00 . A A . 24 SER C 1 1 13 4200 1 1 7 SER CA C -0.218 6.815 -12.262 1.00 . A A . 24 SER CA 1 1 13 4201 1 1 7 SER CB C 1.229 6.507 -12.651 1.00 . A A . 24 SER CB 1 1 13 4202 1 1 7 SER H H -0.711 7.451 -10.304 1.00 . A A . 24 SER H 1 1 13 4203 1 1 7 SER HA H -0.710 7.300 -13.093 1.00 . A A . 24 SER HA 1 1 13 4204 1 1 7 SER HB2 H 1.887 6.822 -11.855 1.00 . A A . 24 SER HB2 1 1 13 4205 1 1 7 SER HB3 H 1.338 5.444 -12.809 1.00 . A A . 24 SER HB3 1 1 13 4206 1 1 7 SER HG H 2.452 6.875 -14.136 1.00 . A A . 24 SER HG 1 1 13 4207 1 1 7 SER N N -0.254 7.728 -11.126 1.00 . A A . 24 SER N 1 1 13 4208 1 1 7 SER O O -1.560 4.901 -12.819 1.00 . A A . 24 SER O 1 1 13 4209 1 1 7 SER OG O 1.593 7.185 -13.840 1.00 . A A . 24 SER OG 1 1 13 4210 1 1 8 HIS C C -3.087 4.040 -10.315 1.00 . A A . 25 HIS C 1 1 13 4211 1 1 8 HIS CA C -1.570 3.891 -10.238 1.00 . A A . 25 HIS CA 1 1 13 4212 1 1 8 HIS CB C -1.152 3.543 -8.809 1.00 . A A . 25 HIS CB 1 1 13 4213 1 1 8 HIS CD2 C -2.109 1.794 -7.150 1.00 . A A . 25 HIS CD2 1 1 13 4214 1 1 8 HIS CE1 C -2.156 0.066 -8.497 1.00 . A A . 25 HIS CE1 1 1 13 4215 1 1 8 HIS CG C -1.641 2.203 -8.352 1.00 . A A . 25 HIS CG 1 1 13 4216 1 1 8 HIS H H -0.410 5.649 -10.023 1.00 . A A . 25 HIS H 1 1 13 4217 1 1 8 HIS HA H -1.266 3.093 -10.898 1.00 . A A . 25 HIS HA 1 1 13 4218 1 1 8 HIS HB2 H -0.074 3.541 -8.747 1.00 . A A . 25 HIS HB2 1 1 13 4219 1 1 8 HIS HB3 H -1.545 4.289 -8.134 1.00 . A A . 25 HIS HB3 1 1 13 4220 1 1 8 HIS HD1 H -1.407 1.071 -10.113 1.00 . A A . 25 HIS HD1 1 1 13 4221 1 1 8 HIS HD2 H -2.217 2.403 -6.262 1.00 . A A . 25 HIS HD2 1 1 13 4222 1 1 8 HIS HE1 H -2.301 -0.932 -8.884 1.00 . A A . 25 HIS HE1 1 1 13 4223 1 1 8 HIS N N -0.906 5.113 -10.677 1.00 . A A . 25 HIS N 1 1 13 4224 1 1 8 HIS ND1 N -1.682 1.096 -9.174 1.00 . A A . 25 HIS ND1 1 1 13 4225 1 1 8 HIS NE2 N -2.423 0.463 -7.266 1.00 . A A . 25 HIS NE2 1 1 13 4226 1 1 8 HIS O O -3.618 5.143 -10.192 1.00 . A A . 25 HIS O 1 1 13 4227 1 1 9 GLU C C -5.863 3.272 -9.267 1.00 . A A . 26 GLU C 1 1 13 4228 1 1 9 GLU CA C -5.232 2.930 -10.614 1.00 . A A . 26 GLU CA 1 1 13 4229 1 1 9 GLU CB C -5.741 1.571 -11.098 1.00 . A A . 26 GLU CB 1 1 13 4230 1 1 9 GLU CD C -6.245 -0.837 -10.522 1.00 . A A . 26 GLU CD 1 1 13 4231 1 1 9 GLU CG C -5.770 0.510 -10.011 1.00 . A A . 26 GLU CG 1 1 13 4232 1 1 9 GLU H H -3.296 2.073 -10.609 1.00 . A A . 26 GLU H 1 1 13 4233 1 1 9 GLU HA H -5.513 3.686 -11.332 1.00 . A A . 26 GLU HA 1 1 13 4234 1 1 9 GLU HB2 H -6.743 1.691 -11.483 1.00 . A A . 26 GLU HB2 1 1 13 4235 1 1 9 GLU HB3 H -5.099 1.223 -11.894 1.00 . A A . 26 GLU HB3 1 1 13 4236 1 1 9 GLU HG2 H -4.774 0.394 -9.611 1.00 . A A . 26 GLU HG2 1 1 13 4237 1 1 9 GLU HG3 H -6.437 0.835 -9.226 1.00 . A A . 26 GLU HG3 1 1 13 4238 1 1 9 GLU N N -3.777 2.922 -10.519 1.00 . A A . 26 GLU N 1 1 13 4239 1 1 9 GLU O O -6.945 3.855 -9.206 1.00 . A A . 26 GLU O 1 1 13 4240 1 1 9 GLU OE1 O -6.824 -0.880 -11.628 1.00 . A A . 26 GLU OE1 1 1 13 4241 1 1 9 GLU OE2 O -6.037 -1.847 -9.818 1.00 . A A . 26 GLU OE2 1 1 13 4242 1 1 10 LYS C C -5.016 4.420 -6.263 1.00 . A A . 27 LYS C 1 1 13 4243 1 1 10 LYS CA C -5.670 3.169 -6.843 1.00 . A A . 27 LYS CA 1 1 13 4244 1 1 10 LYS CB C -5.398 1.970 -5.932 1.00 . A A . 27 LYS CB 1 1 13 4245 1 1 10 LYS CD C -6.120 -0.336 -5.247 1.00 . A A . 27 LYS CD 1 1 13 4246 1 1 10 LYS CE C -4.868 -1.197 -5.316 1.00 . A A . 27 LYS CE 1 1 13 4247 1 1 10 LYS CG C -6.139 0.710 -6.348 1.00 . A A . 27 LYS CG 1 1 13 4248 1 1 10 LYS H H -4.321 2.440 -8.303 1.00 . A A . 27 LYS H 1 1 13 4249 1 1 10 LYS HA H -6.735 3.330 -6.904 1.00 . A A . 27 LYS HA 1 1 13 4250 1 1 10 LYS HB2 H -4.339 1.759 -5.940 1.00 . A A . 27 LYS HB2 1 1 13 4251 1 1 10 LYS HB3 H -5.698 2.223 -4.925 1.00 . A A . 27 LYS HB3 1 1 13 4252 1 1 10 LYS HD2 H -6.149 0.161 -4.288 1.00 . A A . 27 LYS HD2 1 1 13 4253 1 1 10 LYS HD3 H -6.989 -0.971 -5.351 1.00 . A A . 27 LYS HD3 1 1 13 4254 1 1 10 LYS HE2 H -4.346 -0.976 -6.235 1.00 . A A . 27 LYS HE2 1 1 13 4255 1 1 10 LYS HE3 H -4.235 -0.956 -4.475 1.00 . A A . 27 LYS HE3 1 1 13 4256 1 1 10 LYS HG2 H -7.164 0.964 -6.572 1.00 . A A . 27 LYS HG2 1 1 13 4257 1 1 10 LYS HG3 H -5.666 0.301 -7.229 1.00 . A A . 27 LYS HG3 1 1 13 4258 1 1 10 LYS HZ1 H -4.577 -3.169 -5.939 1.00 . A A . 27 LYS HZ1 1 1 13 4259 1 1 10 LYS HZ2 H -6.183 -2.803 -5.553 1.00 . A A . 27 LYS HZ2 1 1 13 4260 1 1 10 LYS HZ3 H -5.046 -3.025 -4.320 1.00 . A A . 27 LYS HZ3 1 1 13 4261 1 1 10 LYS N N -5.179 2.903 -8.189 1.00 . A A . 27 LYS N 1 1 13 4262 1 1 10 LYS NZ N -5.191 -2.650 -5.279 1.00 . A A . 27 LYS NZ 1 1 13 4263 1 1 10 LYS O O -5.344 4.847 -5.156 1.00 . A A . 27 LYS O 1 1 13 4264 1 1 11 TYR C C -4.377 7.321 -6.254 1.00 . A A . 28 TYR C 1 1 13 4265 1 1 11 TYR CA C -3.391 6.203 -6.578 1.00 . A A . 28 TYR CA 1 1 13 4266 1 1 11 TYR CB C -2.410 6.670 -7.655 1.00 . A A . 28 TYR CB 1 1 13 4267 1 1 11 TYR CD1 C -2.316 9.183 -7.434 1.00 . A A . 28 TYR CD1 1 1 13 4268 1 1 11 TYR CD2 C -3.334 8.262 -9.383 1.00 . A A . 28 TYR CD2 1 1 13 4269 1 1 11 TYR CE1 C -2.571 10.459 -7.898 1.00 . A A . 28 TYR CE1 1 1 13 4270 1 1 11 TYR CE2 C -3.592 9.535 -9.855 1.00 . A A . 28 TYR CE2 1 1 13 4271 1 1 11 TYR CG C -2.691 8.064 -8.167 1.00 . A A . 28 TYR CG 1 1 13 4272 1 1 11 TYR CZ C -3.209 10.630 -9.109 1.00 . A A . 28 TYR CZ 1 1 13 4273 1 1 11 TYR H H -3.872 4.614 -7.891 1.00 . A A . 28 TYR H 1 1 13 4274 1 1 11 TYR HA H -2.837 5.956 -5.684 1.00 . A A . 28 TYR HA 1 1 13 4275 1 1 11 TYR HB2 H -1.410 6.662 -7.249 1.00 . A A . 28 TYR HB2 1 1 13 4276 1 1 11 TYR HB3 H -2.458 5.992 -8.494 1.00 . A A . 28 TYR HB3 1 1 13 4277 1 1 11 TYR HD1 H -1.816 9.047 -6.486 1.00 . A A . 28 TYR HD1 1 1 13 4278 1 1 11 TYR HD2 H -3.632 7.402 -9.964 1.00 . A A . 28 TYR HD2 1 1 13 4279 1 1 11 TYR HE1 H -2.272 11.317 -7.314 1.00 . A A . 28 TYR HE1 1 1 13 4280 1 1 11 TYR HE2 H -4.092 9.668 -10.803 1.00 . A A . 28 TYR HE2 1 1 13 4281 1 1 11 TYR HH H -3.302 12.536 -8.876 1.00 . A A . 28 TYR HH 1 1 13 4282 1 1 11 TYR N N -4.091 5.002 -7.018 1.00 . A A . 28 TYR N 1 1 13 4283 1 1 11 TYR O O -5.414 7.456 -6.903 1.00 . A A . 28 TYR O 1 1 13 4284 1 1 11 TYR OH O -3.466 11.899 -9.575 1.00 . A A . 28 TYR OH 1 1 13 4285 1 1 12 ASP C C -4.117 10.537 -4.809 1.00 . A A . 29 ASP C 1 1 13 4286 1 1 12 ASP CA C -4.899 9.227 -4.834 1.00 . A A . 29 ASP CA 1 1 13 4287 1 1 12 ASP CB C -5.500 8.952 -3.455 1.00 . A A . 29 ASP CB 1 1 13 4288 1 1 12 ASP CG C -6.730 8.068 -3.526 1.00 . A A . 29 ASP CG 1 1 13 4289 1 1 12 ASP H H -3.205 7.960 -4.766 1.00 . A A . 29 ASP H 1 1 13 4290 1 1 12 ASP HA H -5.699 9.314 -5.554 1.00 . A A . 29 ASP HA 1 1 13 4291 1 1 12 ASP HB2 H -4.762 8.459 -2.839 1.00 . A A . 29 ASP HB2 1 1 13 4292 1 1 12 ASP HB3 H -5.778 9.889 -2.997 1.00 . A A . 29 ASP HB3 1 1 13 4293 1 1 12 ASP N N -4.045 8.119 -5.245 1.00 . A A . 29 ASP N 1 1 13 4294 1 1 12 ASP O O -3.024 10.607 -4.247 1.00 . A A . 29 ASP O 1 1 13 4295 1 1 12 ASP OD1 O -6.569 6.831 -3.598 1.00 . A A . 29 ASP OD1 1 1 13 4296 1 1 12 ASP OD2 O -7.854 8.613 -3.508 1.00 . A A . 29 ASP OD2 1 1 13 4297 1 1 13 TRP C C -3.680 13.360 -4.070 1.00 . A A . 30 TRP C 1 1 13 4298 1 1 13 TRP CA C -4.037 12.877 -5.471 1.00 . A A . 30 TRP CA 1 1 13 4299 1 1 13 TRP CB C -4.950 13.894 -6.158 1.00 . A A . 30 TRP CB 1 1 13 4300 1 1 13 TRP CD1 C -4.281 15.070 -8.334 1.00 . A A . 30 TRP CD1 1 1 13 4301 1 1 13 TRP CD2 C -3.270 15.874 -6.504 1.00 . A A . 30 TRP CD2 1 1 13 4302 1 1 13 TRP CE2 C -2.818 16.601 -7.623 1.00 . A A . 30 TRP CE2 1 1 13 4303 1 1 13 TRP CE3 C -2.772 16.204 -5.241 1.00 . A A . 30 TRP CE3 1 1 13 4304 1 1 13 TRP CG C -4.205 14.900 -6.981 1.00 . A A . 30 TRP CG 1 1 13 4305 1 1 13 TRP CH2 C -1.422 17.937 -6.265 1.00 . A A . 30 TRP CH2 1 1 13 4306 1 1 13 TRP CZ2 C -1.893 17.636 -7.514 1.00 . A A . 30 TRP CZ2 1 1 13 4307 1 1 13 TRP CZ3 C -1.853 17.231 -5.135 1.00 . A A . 30 TRP CZ3 1 1 13 4308 1 1 13 TRP H H -5.556 11.451 -5.853 1.00 . A A . 30 TRP H 1 1 13 4309 1 1 13 TRP HA H -3.129 12.775 -6.047 1.00 . A A . 30 TRP HA 1 1 13 4310 1 1 13 TRP HB2 H -5.635 13.372 -6.809 1.00 . A A . 30 TRP HB2 1 1 13 4311 1 1 13 TRP HB3 H -5.512 14.428 -5.405 1.00 . A A . 30 TRP HB3 1 1 13 4312 1 1 13 TRP HD1 H -4.905 14.480 -8.987 1.00 . A A . 30 TRP HD1 1 1 13 4313 1 1 13 TRP HE1 H -3.328 16.404 -9.648 1.00 . A A . 30 TRP HE1 1 1 13 4314 1 1 13 TRP HE3 H -3.092 15.672 -4.358 1.00 . A A . 30 TRP HE3 1 1 13 4315 1 1 13 TRP HH2 H -0.703 18.731 -6.135 1.00 . A A . 30 TRP HH2 1 1 13 4316 1 1 13 TRP HZ2 H -1.551 18.190 -8.376 1.00 . A A . 30 TRP HZ2 1 1 13 4317 1 1 13 TRP HZ3 H -1.457 17.500 -4.166 1.00 . A A . 30 TRP HZ3 1 1 13 4318 1 1 13 TRP N N -4.683 11.570 -5.423 1.00 . A A . 30 TRP N 1 1 13 4319 1 1 13 TRP NE1 N -3.449 16.091 -8.727 1.00 . A A . 30 TRP NE1 1 1 13 4320 1 1 13 TRP O O -2.505 13.443 -3.714 1.00 . A A . 30 TRP O 1 1 13 4321 1 1 14 GLU C C -4.042 13.014 -1.006 1.00 . A A . 31 GLU C 1 1 13 4322 1 1 14 GLU CA C -4.491 14.153 -1.917 1.00 . A A . 31 GLU CA 1 1 13 4323 1 1 14 GLU CB C -5.775 14.782 -1.371 1.00 . A A . 31 GLU CB 1 1 13 4324 1 1 14 GLU CD C -7.368 16.742 -1.421 1.00 . A A . 31 GLU CD 1 1 13 4325 1 1 14 GLU CG C -6.122 16.114 -2.015 1.00 . A A . 31 GLU CG 1 1 13 4326 1 1 14 GLU H H -5.615 13.590 -3.621 1.00 . A A . 31 GLU H 1 1 13 4327 1 1 14 GLU HA H -3.716 14.904 -1.944 1.00 . A A . 31 GLU HA 1 1 13 4328 1 1 14 GLU HB2 H -6.595 14.100 -1.537 1.00 . A A . 31 GLU HB2 1 1 13 4329 1 1 14 GLU HB3 H -5.659 14.940 -0.309 1.00 . A A . 31 GLU HB3 1 1 13 4330 1 1 14 GLU HG2 H -5.294 16.793 -1.877 1.00 . A A . 31 GLU HG2 1 1 13 4331 1 1 14 GLU HG3 H -6.285 15.956 -3.071 1.00 . A A . 31 GLU HG3 1 1 13 4332 1 1 14 GLU N N -4.700 13.677 -3.280 1.00 . A A . 31 GLU N 1 1 13 4333 1 1 14 GLU O O -3.033 13.123 -0.309 1.00 . A A . 31 GLU O 1 1 13 4334 1 1 14 GLU OE1 O -7.298 17.227 -0.273 1.00 . A A . 31 GLU OE1 1 1 13 4335 1 1 14 GLU OE2 O -8.412 16.749 -2.106 1.00 . A A . 31 GLU OE2 1 1 13 4336 1 1 15 LEU C C -3.050 10.293 -0.442 1.00 . A A . 32 LEU C 1 1 13 4337 1 1 15 LEU CA C -4.480 10.762 -0.192 1.00 . A A . 32 LEU CA 1 1 13 4338 1 1 15 LEU CB C -5.460 9.623 -0.479 1.00 . A A . 32 LEU CB 1 1 13 4339 1 1 15 LEU CD1 C -6.785 10.110 1.593 1.00 . A A . 32 LEU CD1 1 1 13 4340 1 1 15 LEU CD2 C -7.215 8.011 0.301 1.00 . A A . 32 LEU CD2 1 1 13 4341 1 1 15 LEU CG C -6.160 9.018 0.738 1.00 . A A . 32 LEU CG 1 1 13 4342 1 1 15 LEU H H -5.590 11.894 -1.594 1.00 . A A . 32 LEU H 1 1 13 4343 1 1 15 LEU HA H -4.575 11.056 0.842 1.00 . A A . 32 LEU HA 1 1 13 4344 1 1 15 LEU HB2 H -6.222 10.002 -1.144 1.00 . A A . 32 LEU HB2 1 1 13 4345 1 1 15 LEU HB3 H -4.913 8.834 -0.974 1.00 . A A . 32 LEU HB3 1 1 13 4346 1 1 15 LEU HD11 H -6.947 10.990 0.989 1.00 . A A . 32 LEU HD11 1 1 13 4347 1 1 15 LEU HD12 H -6.122 10.350 2.410 1.00 . A A . 32 LEU HD12 1 1 13 4348 1 1 15 LEU HD13 H -7.730 9.763 1.986 1.00 . A A . 32 LEU HD13 1 1 13 4349 1 1 15 LEU HD21 H -8.143 8.527 0.101 1.00 . A A . 32 LEU HD21 1 1 13 4350 1 1 15 LEU HD22 H -7.368 7.286 1.087 1.00 . A A . 32 LEU HD22 1 1 13 4351 1 1 15 LEU HD23 H -6.882 7.508 -0.594 1.00 . A A . 32 LEU HD23 1 1 13 4352 1 1 15 LEU HG H -5.431 8.498 1.343 1.00 . A A . 32 LEU HG 1 1 13 4353 1 1 15 LEU N N -4.799 11.922 -1.018 1.00 . A A . 32 LEU N 1 1 13 4354 1 1 15 LEU O O -2.476 9.564 0.368 1.00 . A A . 32 LEU O 1 1 13 4355 1 1 16 TRP C C -0.203 10.397 -0.700 1.00 . A A . 33 TRP C 1 1 13 4356 1 1 16 TRP CA C -1.118 10.341 -1.919 1.00 . A A . 33 TRP CA 1 1 13 4357 1 1 16 TRP CB C -0.582 11.263 -3.016 1.00 . A A . 33 TRP CB 1 1 13 4358 1 1 16 TRP CD1 C 1.554 10.418 -4.154 1.00 . A A . 33 TRP CD1 1 1 13 4359 1 1 16 TRP CD2 C 1.914 11.810 -2.437 1.00 . A A . 33 TRP CD2 1 1 13 4360 1 1 16 TRP CE2 C 3.159 11.423 -2.970 1.00 . A A . 33 TRP CE2 1 1 13 4361 1 1 16 TRP CE3 C 1.891 12.687 -1.348 1.00 . A A . 33 TRP CE3 1 1 13 4362 1 1 16 TRP CG C 0.901 11.157 -3.209 1.00 . A A . 33 TRP CG 1 1 13 4363 1 1 16 TRP CH2 C 4.314 12.738 -1.384 1.00 . A A . 33 TRP CH2 1 1 13 4364 1 1 16 TRP CZ2 C 4.366 11.881 -2.449 1.00 . A A . 33 TRP CZ2 1 1 13 4365 1 1 16 TRP CZ3 C 3.090 13.140 -0.833 1.00 . A A . 33 TRP CZ3 1 1 13 4366 1 1 16 TRP H H -2.991 11.296 -2.170 1.00 . A A . 33 TRP H 1 1 13 4367 1 1 16 TRP HA H -1.140 9.328 -2.291 1.00 . A A . 33 TRP HA 1 1 13 4368 1 1 16 TRP HB2 H -1.058 11.012 -3.952 1.00 . A A . 33 TRP HB2 1 1 13 4369 1 1 16 TRP HB3 H -0.814 12.287 -2.761 1.00 . A A . 33 TRP HB3 1 1 13 4370 1 1 16 TRP HD1 H 1.062 9.805 -4.893 1.00 . A A . 33 TRP HD1 1 1 13 4371 1 1 16 TRP HE1 H 3.593 10.145 -4.576 1.00 . A A . 33 TRP HE1 1 1 13 4372 1 1 16 TRP HE3 H 0.958 13.008 -0.910 1.00 . A A . 33 TRP HE3 1 1 13 4373 1 1 16 TRP HH2 H 5.226 13.117 -0.949 1.00 . A A . 33 TRP HH2 1 1 13 4374 1 1 16 TRP HZ2 H 5.318 11.580 -2.863 1.00 . A A . 33 TRP HZ2 1 1 13 4375 1 1 16 TRP HZ3 H 3.092 13.818 0.008 1.00 . A A . 33 TRP HZ3 1 1 13 4376 1 1 16 TRP N N -2.482 10.717 -1.564 1.00 . A A . 33 TRP N 1 1 13 4377 1 1 16 TRP NE1 N 2.912 10.573 -4.015 1.00 . A A . 33 TRP NE1 1 1 13 4378 1 1 16 TRP O O 0.691 9.565 -0.544 1.00 . A A . 33 TRP O 1 1 13 4379 1 1 17 ASP C C 0.348 10.273 2.212 1.00 . A A . 34 ASP C 1 1 13 4380 1 1 17 ASP CA C 0.369 11.545 1.369 1.00 . A A . 34 ASP CA 1 1 13 4381 1 1 17 ASP CB C -0.144 12.727 2.193 1.00 . A A . 34 ASP CB 1 1 13 4382 1 1 17 ASP CG C 0.740 13.951 2.061 1.00 . A A . 34 ASP CG 1 1 13 4383 1 1 17 ASP H H -1.161 12.014 -0.017 1.00 . A A . 34 ASP H 1 1 13 4384 1 1 17 ASP HA H 1.386 11.743 1.066 1.00 . A A . 34 ASP HA 1 1 13 4385 1 1 17 ASP HB2 H -1.138 12.986 1.858 1.00 . A A . 34 ASP HB2 1 1 13 4386 1 1 17 ASP HB3 H -0.181 12.442 3.234 1.00 . A A . 34 ASP HB3 1 1 13 4387 1 1 17 ASP N N -0.433 11.382 0.162 1.00 . A A . 34 ASP N 1 1 13 4388 1 1 17 ASP O O 1.395 9.717 2.542 1.00 . A A . 34 ASP O 1 1 13 4389 1 1 17 ASP OD1 O 1.964 13.825 2.271 1.00 . A A . 34 ASP OD1 1 1 13 4390 1 1 17 ASP OD2 O 0.207 15.036 1.746 1.00 . A A . 34 ASP OD2 1 1 13 4391 1 1 18 LYS C C -0.871 7.363 2.501 1.00 . A A . 35 LYS C 1 1 13 4392 1 1 18 LYS CA C -1.012 8.614 3.362 1.00 . A A . 35 LYS CA 1 1 13 4393 1 1 18 LYS CB C -2.375 8.617 4.057 1.00 . A A . 35 LYS CB 1 1 13 4394 1 1 18 LYS CD C -4.496 7.377 3.531 1.00 . A A . 35 LYS CD 1 1 13 4395 1 1 18 LYS CE C -4.016 6.014 3.055 1.00 . A A . 35 LYS CE 1 1 13 4396 1 1 18 LYS CG C -3.547 8.483 3.100 1.00 . A A . 35 LYS CG 1 1 13 4397 1 1 18 LYS H H -1.651 10.307 2.264 1.00 . A A . 35 LYS H 1 1 13 4398 1 1 18 LYS HA H -0.235 8.610 4.112 1.00 . A A . 35 LYS HA 1 1 13 4399 1 1 18 LYS HB2 H -2.412 7.794 4.756 1.00 . A A . 35 LYS HB2 1 1 13 4400 1 1 18 LYS HB3 H -2.487 9.544 4.601 1.00 . A A . 35 LYS HB3 1 1 13 4401 1 1 18 LYS HD2 H -4.558 7.368 4.609 1.00 . A A . 35 LYS HD2 1 1 13 4402 1 1 18 LYS HD3 H -5.474 7.571 3.114 1.00 . A A . 35 LYS HD3 1 1 13 4403 1 1 18 LYS HE2 H -4.714 5.637 2.324 1.00 . A A . 35 LYS HE2 1 1 13 4404 1 1 18 LYS HE3 H -3.044 6.128 2.599 1.00 . A A . 35 LYS HE3 1 1 13 4405 1 1 18 LYS HG2 H -4.088 9.417 3.074 1.00 . A A . 35 LYS HG2 1 1 13 4406 1 1 18 LYS HG3 H -3.169 8.256 2.113 1.00 . A A . 35 LYS HG3 1 1 13 4407 1 1 18 LYS HZ1 H -4.596 4.265 4.039 1.00 . A A . 35 LYS HZ1 1 1 13 4408 1 1 18 LYS HZ2 H -4.121 5.511 5.080 1.00 . A A . 35 LYS HZ2 1 1 13 4409 1 1 18 LYS HZ3 H -2.956 4.640 4.217 1.00 . A A . 35 LYS HZ3 1 1 13 4410 1 1 18 LYS N N -0.852 9.820 2.558 1.00 . A A . 35 LYS N 1 1 13 4411 1 1 18 LYS NZ N -3.915 5.039 4.176 1.00 . A A . 35 LYS NZ 1 1 13 4412 1 1 18 LYS O O -0.746 6.253 3.019 1.00 . A A . 35 LYS O 1 1 13 4413 1 1 19 TRP C C 0.689 6.234 -0.159 1.00 . A A . 36 TRP C 1 1 13 4414 1 1 19 TRP CA C -0.765 6.435 0.254 1.00 . A A . 36 TRP CA 1 1 13 4415 1 1 19 TRP CB C -1.631 6.677 -0.983 1.00 . A A . 36 TRP CB 1 1 13 4416 1 1 19 TRP CD1 C -4.033 6.523 -0.103 1.00 . A A . 36 TRP CD1 1 1 13 4417 1 1 19 TRP CD2 C -3.484 4.918 -1.565 1.00 . A A . 36 TRP CD2 1 1 13 4418 1 1 19 TRP CE2 C -4.819 4.720 -1.161 1.00 . A A . 36 TRP CE2 1 1 13 4419 1 1 19 TRP CE3 C -2.919 4.029 -2.484 1.00 . A A . 36 TRP CE3 1 1 13 4420 1 1 19 TRP CG C -3.000 6.077 -0.876 1.00 . A A . 36 TRP CG 1 1 13 4421 1 1 19 TRP CH2 C -5.017 2.816 -2.544 1.00 . A A . 36 TRP CH2 1 1 13 4422 1 1 19 TRP CZ2 C -5.595 3.671 -1.646 1.00 . A A . 36 TRP CZ2 1 1 13 4423 1 1 19 TRP CZ3 C -3.691 2.988 -2.963 1.00 . A A . 36 TRP CZ3 1 1 13 4424 1 1 19 TRP H H -0.995 8.459 0.834 1.00 . A A . 36 TRP H 1 1 13 4425 1 1 19 TRP HA H -1.111 5.544 0.756 1.00 . A A . 36 TRP HA 1 1 13 4426 1 1 19 TRP HB2 H -1.745 7.741 -1.133 1.00 . A A . 36 TRP HB2 1 1 13 4427 1 1 19 TRP HB3 H -1.143 6.246 -1.845 1.00 . A A . 36 TRP HB3 1 1 13 4428 1 1 19 TRP HD1 H -3.981 7.388 0.541 1.00 . A A . 36 TRP HD1 1 1 13 4429 1 1 19 TRP HE1 H -5.995 5.827 0.178 1.00 . A A . 36 TRP HE1 1 1 13 4430 1 1 19 TRP HE3 H -1.899 4.145 -2.819 1.00 . A A . 36 TRP HE3 1 1 13 4431 1 1 19 TRP HH2 H -5.582 1.988 -2.945 1.00 . A A . 36 TRP HH2 1 1 13 4432 1 1 19 TRP HZ2 H -6.618 3.525 -1.333 1.00 . A A . 36 TRP HZ2 1 1 13 4433 1 1 19 TRP HZ3 H -3.272 2.291 -3.674 1.00 . A A . 36 TRP HZ3 1 1 13 4434 1 1 19 TRP N N -0.892 7.550 1.187 1.00 . A A . 36 TRP N 1 1 13 4435 1 1 19 TRP NE1 N -5.130 5.712 -0.269 1.00 . A A . 36 TRP NE1 1 1 13 4436 1 1 19 TRP O O 0.973 5.597 -1.174 1.00 . A A . 36 TRP O 1 1 13 4437 1 1 20 CYS C C 3.861 7.289 1.464 1.00 . A A . 37 CYS C 1 1 13 4438 1 1 20 CYS CA C 3.030 6.661 0.349 1.00 . A A . 37 CYS CA 1 1 13 4439 1 1 20 CYS CB C 3.363 7.329 -0.987 1.00 . A A . 37 CYS CB 1 1 13 4440 1 1 20 CYS H H 1.317 7.277 1.428 1.00 . A A . 37 CYS H 1 1 13 4441 1 1 20 CYS HA H 3.270 5.611 0.286 1.00 . A A . 37 CYS HA 1 1 13 4442 1 1 20 CYS HB2 H 2.769 6.874 -1.766 1.00 . A A . 37 CYS HB2 1 1 13 4443 1 1 20 CYS HB3 H 3.123 8.380 -0.926 1.00 . A A . 37 CYS HB3 1 1 13 4444 1 1 20 CYS N N 1.605 6.780 0.632 1.00 . A A . 37 CYS N 1 1 13 4445 1 1 20 CYS O O 3.707 8.469 1.777 1.00 . A A . 37 CYS O 1 1 13 4446 1 1 20 CYS SG S 5.113 7.187 -1.474 1.00 . A A . 37 CYS SG 1 1 14 4447 1 1 1 ASN C C 2.229 2.902 -2.896 1.00 . A A . 18 ASN C 1 1 14 4448 1 1 1 ASN CA C 1.266 1.735 -2.698 1.00 . A A . 18 ASN CA 1 1 14 4449 1 1 1 ASN CB C -0.161 2.260 -2.530 1.00 . A A . 18 ASN CB 1 1 14 4450 1 1 1 ASN CG C -1.153 1.152 -2.230 1.00 . A A . 18 ASN CG 1 1 14 4451 1 1 1 ASN H1 H 2.340 0.246 -1.645 1.00 . A A . 18 ASN H1 1 1 14 4452 1 1 1 ASN HA H 1.306 1.099 -3.569 1.00 . A A . 18 ASN HA 1 1 14 4453 1 1 1 ASN HB2 H -0.184 2.967 -1.713 1.00 . A A . 18 ASN HB2 1 1 14 4454 1 1 1 ASN HB3 H -0.466 2.756 -3.439 1.00 . A A . 18 ASN HB3 1 1 14 4455 1 1 1 ASN HD21 H -0.351 0.017 -3.652 1.00 . A A . 18 ASN HD21 1 1 14 4456 1 1 1 ASN HD22 H -1.679 -0.680 -2.795 1.00 . A A . 18 ASN HD22 1 1 14 4457 1 1 1 ASN N N 1.651 0.935 -1.541 1.00 . A A . 18 ASN N 1 1 14 4458 1 1 1 ASN ND2 N -1.051 0.052 -2.967 1.00 . A A . 18 ASN ND2 1 1 14 4459 1 1 1 ASN O O 2.007 3.767 -3.745 1.00 . A A . 18 ASN O 1 1 14 4460 1 1 1 ASN OD1 O -2.000 1.285 -1.347 1.00 . A A . 18 ASN OD1 1 1 14 4461 1 1 2 CYS C C 5.251 3.733 -3.361 1.00 . A A . 19 CYS C 1 1 14 4462 1 1 2 CYS CA C 4.296 3.980 -2.196 1.00 . A A . 19 CYS CA 1 1 14 4463 1 1 2 CYS CB C 5.084 4.077 -0.888 1.00 . A A . 19 CYS CB 1 1 14 4464 1 1 2 CYS H H 3.420 2.203 -1.451 1.00 . A A . 19 CYS H 1 1 14 4465 1 1 2 CYS HA H 3.777 4.911 -2.363 1.00 . A A . 19 CYS HA 1 1 14 4466 1 1 2 CYS HB2 H 4.397 4.010 -0.057 1.00 . A A . 19 CYS HB2 1 1 14 4467 1 1 2 CYS HB3 H 5.784 3.256 -0.837 1.00 . A A . 19 CYS HB3 1 1 14 4468 1 1 2 CYS N N 3.298 2.920 -2.108 1.00 . A A . 19 CYS N 1 1 14 4469 1 1 2 CYS O O 6.040 4.605 -3.724 1.00 . A A . 19 CYS O 1 1 14 4470 1 1 2 CYS SG S 6.027 5.624 -0.701 1.00 . A A . 19 CYS SG 1 1 14 4471 1 1 3 ASP C C 5.573 2.881 -6.341 1.00 . A A . 20 ASP C 1 1 14 4472 1 1 3 ASP CA C 6.027 2.179 -5.065 1.00 . A A . 20 ASP CA 1 1 14 4473 1 1 3 ASP CB C 6.020 0.664 -5.272 1.00 . A A . 20 ASP CB 1 1 14 4474 1 1 3 ASP CG C 7.169 -0.023 -4.559 1.00 . A A . 20 ASP CG 1 1 14 4475 1 1 3 ASP H H 4.521 1.888 -3.605 1.00 . A A . 20 ASP H 1 1 14 4476 1 1 3 ASP HA H 7.032 2.497 -4.833 1.00 . A A . 20 ASP HA 1 1 14 4477 1 1 3 ASP HB2 H 5.093 0.259 -4.893 1.00 . A A . 20 ASP HB2 1 1 14 4478 1 1 3 ASP HB3 H 6.096 0.451 -6.328 1.00 . A A . 20 ASP HB3 1 1 14 4479 1 1 3 ASP N N 5.171 2.541 -3.941 1.00 . A A . 20 ASP N 1 1 14 4480 1 1 3 ASP O O 6.238 2.803 -7.374 1.00 . A A . 20 ASP O 1 1 14 4481 1 1 3 ASP OD1 O 8.304 0.492 -4.632 1.00 . A A . 20 ASP OD1 1 1 14 4482 1 1 3 ASP OD2 O 6.932 -1.076 -3.930 1.00 . A A . 20 ASP OD2 1 1 14 4483 1 1 4 TRP C C 3.139 5.528 -6.968 1.00 . A A . 21 TRP C 1 1 14 4484 1 1 4 TRP CA C 3.894 4.280 -7.411 1.00 . A A . 21 TRP CA 1 1 14 4485 1 1 4 TRP CB C 2.967 3.366 -8.214 1.00 . A A . 21 TRP CB 1 1 14 4486 1 1 4 TRP CD1 C 1.229 2.906 -6.388 1.00 . A A . 21 TRP CD1 1 1 14 4487 1 1 4 TRP CD2 C 2.026 1.066 -7.386 1.00 . A A . 21 TRP CD2 1 1 14 4488 1 1 4 TRP CE2 C 1.087 0.678 -6.410 1.00 . A A . 21 TRP CE2 1 1 14 4489 1 1 4 TRP CE3 C 2.657 0.076 -8.144 1.00 . A A . 21 TRP CE3 1 1 14 4490 1 1 4 TRP CG C 2.101 2.495 -7.355 1.00 . A A . 21 TRP CG 1 1 14 4491 1 1 4 TRP CH2 C 1.402 -1.605 -6.930 1.00 . A A . 21 TRP CH2 1 1 14 4492 1 1 4 TRP CZ2 C 0.768 -0.657 -6.173 1.00 . A A . 21 TRP CZ2 1 1 14 4493 1 1 4 TRP CZ3 C 2.340 -1.248 -7.908 1.00 . A A . 21 TRP CZ3 1 1 14 4494 1 1 4 TRP H H 3.952 3.590 -5.410 1.00 . A A . 21 TRP H 1 1 14 4495 1 1 4 TRP HA H 4.722 4.578 -8.037 1.00 . A A . 21 TRP HA 1 1 14 4496 1 1 4 TRP HB2 H 2.321 3.972 -8.832 1.00 . A A . 21 TRP HB2 1 1 14 4497 1 1 4 TRP HB3 H 3.565 2.725 -8.845 1.00 . A A . 21 TRP HB3 1 1 14 4498 1 1 4 TRP HD1 H 1.059 3.938 -6.121 1.00 . A A . 21 TRP HD1 1 1 14 4499 1 1 4 TRP HE1 H -0.051 1.854 -5.097 1.00 . A A . 21 TRP HE1 1 1 14 4500 1 1 4 TRP HE3 H 3.383 0.332 -8.902 1.00 . A A . 21 TRP HE3 1 1 14 4501 1 1 4 TRP HH2 H 1.186 -2.651 -6.779 1.00 . A A . 21 TRP HH2 1 1 14 4502 1 1 4 TRP HZ2 H 0.047 -0.948 -5.424 1.00 . A A . 21 TRP HZ2 1 1 14 4503 1 1 4 TRP HZ3 H 2.819 -2.026 -8.483 1.00 . A A . 21 TRP HZ3 1 1 14 4504 1 1 4 TRP N N 4.437 3.565 -6.262 1.00 . A A . 21 TRP N 1 1 14 4505 1 1 4 TRP NE1 N 0.617 1.818 -5.814 1.00 . A A . 21 TRP NE1 1 1 14 4506 1 1 4 TRP O O 2.617 5.587 -5.855 1.00 . A A . 21 TRP O 1 1 14 4507 1 1 5 ASP C C 1.943 8.467 -8.827 1.00 . A A . 22 ASP C 1 1 14 4508 1 1 5 ASP CA C 2.391 7.771 -7.545 1.00 . A A . 22 ASP CA 1 1 14 4509 1 1 5 ASP CB C 3.297 8.701 -6.736 1.00 . A A . 22 ASP CB 1 1 14 4510 1 1 5 ASP CG C 4.769 8.418 -6.965 1.00 . A A . 22 ASP CG 1 1 14 4511 1 1 5 ASP H H 3.520 6.417 -8.718 1.00 . A A . 22 ASP H 1 1 14 4512 1 1 5 ASP HA H 1.519 7.532 -6.957 1.00 . A A . 22 ASP HA 1 1 14 4513 1 1 5 ASP HB2 H 3.098 9.724 -7.021 1.00 . A A . 22 ASP HB2 1 1 14 4514 1 1 5 ASP HB3 H 3.084 8.575 -5.685 1.00 . A A . 22 ASP HB3 1 1 14 4515 1 1 5 ASP N N 3.084 6.524 -7.846 1.00 . A A . 22 ASP N 1 1 14 4516 1 1 5 ASP O O 2.649 8.448 -9.836 1.00 . A A . 22 ASP O 1 1 14 4517 1 1 5 ASP OD1 O 5.341 8.985 -7.920 1.00 . A A . 22 ASP OD1 1 1 14 4518 1 1 5 ASP OD2 O 5.349 7.631 -6.189 1.00 . A A . 22 ASP OD2 1 1 14 4519 1 1 6 LYS C C 0.337 8.927 -11.196 1.00 . A A . 23 LYS C 1 1 14 4520 1 1 6 LYS CA C 0.221 9.781 -9.938 1.00 . A A . 23 LYS CA 1 1 14 4521 1 1 6 LYS CB C 0.950 11.111 -10.142 1.00 . A A . 23 LYS CB 1 1 14 4522 1 1 6 LYS CD C 0.087 13.155 -8.965 1.00 . A A . 23 LYS CD 1 1 14 4523 1 1 6 LYS CE C 0.806 14.398 -9.469 1.00 . A A . 23 LYS CE 1 1 14 4524 1 1 6 LYS CG C 1.025 11.963 -8.887 1.00 . A A . 23 LYS CG 1 1 14 4525 1 1 6 LYS H H 0.248 9.059 -7.948 1.00 . A A . 23 LYS H 1 1 14 4526 1 1 6 LYS HA H -0.823 9.978 -9.746 1.00 . A A . 23 LYS HA 1 1 14 4527 1 1 6 LYS HB2 H 1.957 10.908 -10.475 1.00 . A A . 23 LYS HB2 1 1 14 4528 1 1 6 LYS HB3 H 0.435 11.676 -10.905 1.00 . A A . 23 LYS HB3 1 1 14 4529 1 1 6 LYS HD2 H -0.722 12.923 -9.642 1.00 . A A . 23 LYS HD2 1 1 14 4530 1 1 6 LYS HD3 H -0.312 13.355 -7.980 1.00 . A A . 23 LYS HD3 1 1 14 4531 1 1 6 LYS HE2 H 0.351 15.267 -9.020 1.00 . A A . 23 LYS HE2 1 1 14 4532 1 1 6 LYS HE3 H 1.843 14.341 -9.174 1.00 . A A . 23 LYS HE3 1 1 14 4533 1 1 6 LYS HG2 H 0.750 11.358 -8.035 1.00 . A A . 23 LYS HG2 1 1 14 4534 1 1 6 LYS HG3 H 2.038 12.320 -8.765 1.00 . A A . 23 LYS HG3 1 1 14 4535 1 1 6 LYS HZ1 H 1.029 15.472 -11.246 1.00 . A A . 23 LYS HZ1 1 1 14 4536 1 1 6 LYS HZ2 H -0.248 14.363 -11.272 1.00 . A A . 23 LYS HZ2 1 1 14 4537 1 1 6 LYS HZ3 H 1.349 13.818 -11.401 1.00 . A A . 23 LYS HZ3 1 1 14 4538 1 1 6 LYS N N 0.765 9.079 -8.781 1.00 . A A . 23 LYS N 1 1 14 4539 1 1 6 LYS NZ N 0.729 14.521 -10.951 1.00 . A A . 23 LYS NZ 1 1 14 4540 1 1 6 LYS O O 0.932 9.346 -12.189 1.00 . A A . 23 LYS O 1 1 14 4541 1 1 7 SER C C -0.934 5.519 -11.965 1.00 . A A . 24 SER C 1 1 14 4542 1 1 7 SER CA C -0.195 6.815 -12.284 1.00 . A A . 24 SER CA 1 1 14 4543 1 1 7 SER CB C 1.254 6.509 -12.666 1.00 . A A . 24 SER CB 1 1 14 4544 1 1 7 SER H H -0.696 7.452 -10.328 1.00 . A A . 24 SER H 1 1 14 4545 1 1 7 SER HA H -0.684 7.299 -13.116 1.00 . A A . 24 SER HA 1 1 14 4546 1 1 7 SER HB2 H 1.914 7.165 -12.121 1.00 . A A . 24 SER HB2 1 1 14 4547 1 1 7 SER HB3 H 1.480 5.482 -12.417 1.00 . A A . 24 SER HB3 1 1 14 4548 1 1 7 SER HG H 1.683 5.857 -14.464 1.00 . A A . 24 SER HG 1 1 14 4549 1 1 7 SER N N -0.236 7.729 -11.148 1.00 . A A . 24 SER N 1 1 14 4550 1 1 7 SER O O -1.533 4.900 -12.846 1.00 . A A . 24 SER O 1 1 14 4551 1 1 7 SER OG O 1.466 6.699 -14.055 1.00 . A A . 24 SER OG 1 1 14 4552 1 1 8 HIS C C -3.069 4.039 -10.347 1.00 . A A . 25 HIS C 1 1 14 4553 1 1 8 HIS CA C -1.552 3.891 -10.264 1.00 . A A . 25 HIS CA 1 1 14 4554 1 1 8 HIS CB C -1.139 3.543 -8.834 1.00 . A A . 25 HIS CB 1 1 14 4555 1 1 8 HIS CD2 C -2.100 1.794 -7.177 1.00 . A A . 25 HIS CD2 1 1 14 4556 1 1 8 HIS CE1 C -2.143 0.066 -8.524 1.00 . A A . 25 HIS CE1 1 1 14 4557 1 1 8 HIS CG C -1.629 2.203 -8.378 1.00 . A A . 25 HIS CG 1 1 14 4558 1 1 8 HIS H H -0.394 5.650 -10.045 1.00 . A A . 25 HIS H 1 1 14 4559 1 1 8 HIS HA H -1.245 3.093 -10.922 1.00 . A A . 25 HIS HA 1 1 14 4560 1 1 8 HIS HB2 H -0.061 3.543 -8.767 1.00 . A A . 25 HIS HB2 1 1 14 4561 1 1 8 HIS HB3 H -1.536 4.289 -8.160 1.00 . A A . 25 HIS HB3 1 1 14 4562 1 1 8 HIS HD1 H -1.389 1.072 -10.139 1.00 . A A . 25 HIS HD1 1 1 14 4563 1 1 8 HIS HD2 H -2.211 2.403 -6.290 1.00 . A A . 25 HIS HD2 1 1 14 4564 1 1 8 HIS HE1 H -2.286 -0.932 -8.912 1.00 . A A . 25 HIS HE1 1 1 14 4565 1 1 8 HIS N N -0.887 5.114 -10.700 1.00 . A A . 25 HIS N 1 1 14 4566 1 1 8 HIS ND1 N -1.667 1.097 -9.200 1.00 . A A . 25 HIS ND1 1 1 14 4567 1 1 8 HIS NE2 N -2.413 0.462 -7.294 1.00 . A A . 25 HIS NE2 1 1 14 4568 1 1 8 HIS O O -3.602 5.141 -10.225 1.00 . A A . 25 HIS O 1 1 14 4569 1 1 9 GLU C C -5.848 3.267 -9.311 1.00 . A A . 26 GLU C 1 1 14 4570 1 1 9 GLU CA C -5.212 2.927 -10.655 1.00 . A A . 26 GLU CA 1 1 14 4571 1 1 9 GLU CB C -5.717 1.567 -11.142 1.00 . A A . 26 GLU CB 1 1 14 4572 1 1 9 GLU CD C -6.230 -0.839 -10.567 1.00 . A A . 26 GLU CD 1 1 14 4573 1 1 9 GLU CG C -5.749 0.505 -10.056 1.00 . A A . 26 GLU CG 1 1 14 4574 1 1 9 GLU H H -3.275 2.072 -10.644 1.00 . A A . 26 GLU H 1 1 14 4575 1 1 9 GLU HA H -5.491 3.682 -11.374 1.00 . A A . 26 GLU HA 1 1 14 4576 1 1 9 GLU HB2 H -6.718 1.686 -11.529 1.00 . A A . 26 GLU HB2 1 1 14 4577 1 1 9 GLU HB3 H -5.073 1.220 -11.936 1.00 . A A . 26 GLU HB3 1 1 14 4578 1 1 9 GLU HG2 H -4.752 0.386 -9.658 1.00 . A A . 26 GLU HG2 1 1 14 4579 1 1 9 GLU HG3 H -6.412 0.833 -9.269 1.00 . A A . 26 GLU HG3 1 1 14 4580 1 1 9 GLU N N -3.757 2.920 -10.555 1.00 . A A . 26 GLU N 1 1 14 4581 1 1 9 GLU O O -6.932 3.849 -9.254 1.00 . A A . 26 GLU O 1 1 14 4582 1 1 9 GLU OE1 O -5.636 -1.352 -11.538 1.00 . A A . 26 GLU OE1 1 1 14 4583 1 1 9 GLU OE2 O -7.201 -1.377 -9.996 1.00 . A A . 26 GLU OE2 1 1 14 4584 1 1 10 LYS C C -5.013 4.417 -6.303 1.00 . A A . 27 LYS C 1 1 14 4585 1 1 10 LYS CA C -5.664 3.166 -6.886 1.00 . A A . 27 LYS CA 1 1 14 4586 1 1 10 LYS CB C -5.395 1.967 -5.974 1.00 . A A . 27 LYS CB 1 1 14 4587 1 1 10 LYS CD C -6.121 -0.339 -5.291 1.00 . A A . 27 LYS CD 1 1 14 4588 1 1 10 LYS CE C -4.870 -1.203 -5.359 1.00 . A A . 27 LYS CE 1 1 14 4589 1 1 10 LYS CG C -6.135 0.708 -6.392 1.00 . A A . 27 LYS CG 1 1 14 4590 1 1 10 LYS H H -4.309 2.439 -8.341 1.00 . A A . 27 LYS H 1 1 14 4591 1 1 10 LYS HA H -6.729 3.326 -6.951 1.00 . A A . 27 LYS HA 1 1 14 4592 1 1 10 LYS HB2 H -4.336 1.755 -5.980 1.00 . A A . 27 LYS HB2 1 1 14 4593 1 1 10 LYS HB3 H -5.698 2.220 -4.968 1.00 . A A . 27 LYS HB3 1 1 14 4594 1 1 10 LYS HD2 H -6.149 0.158 -4.333 1.00 . A A . 27 LYS HD2 1 1 14 4595 1 1 10 LYS HD3 H -6.991 -0.972 -5.396 1.00 . A A . 27 LYS HD3 1 1 14 4596 1 1 10 LYS HE2 H -4.980 -1.908 -6.169 1.00 . A A . 27 LYS HE2 1 1 14 4597 1 1 10 LYS HE3 H -4.019 -0.566 -5.549 1.00 . A A . 27 LYS HE3 1 1 14 4598 1 1 10 LYS HG2 H -7.160 0.962 -6.619 1.00 . A A . 27 LYS HG2 1 1 14 4599 1 1 10 LYS HG3 H -5.661 0.298 -7.272 1.00 . A A . 27 LYS HG3 1 1 14 4600 1 1 10 LYS HZ1 H -4.101 -2.818 -4.282 1.00 . A A . 27 LYS HZ1 1 1 14 4601 1 1 10 LYS HZ2 H -5.554 -2.214 -3.664 1.00 . A A . 27 LYS HZ2 1 1 14 4602 1 1 10 LYS HZ3 H -4.113 -1.363 -3.419 1.00 . A A . 27 LYS HZ3 1 1 14 4603 1 1 10 LYS N N -5.167 2.900 -8.231 1.00 . A A . 27 LYS N 1 1 14 4604 1 1 10 LYS NZ N -4.643 -1.952 -4.092 1.00 . A A . 27 LYS NZ 1 1 14 4605 1 1 10 LYS O O -5.345 4.843 -5.197 1.00 . A A . 27 LYS O 1 1 14 4606 1 1 11 TYR C C -4.377 7.319 -6.292 1.00 . A A . 28 TYR C 1 1 14 4607 1 1 11 TYR CA C -3.389 6.202 -6.612 1.00 . A A . 28 TYR CA 1 1 14 4608 1 1 11 TYR CB C -2.404 6.670 -7.685 1.00 . A A . 28 TYR CB 1 1 14 4609 1 1 11 TYR CD1 C -2.313 9.183 -7.464 1.00 . A A . 28 TYR CD1 1 1 14 4610 1 1 11 TYR CD2 C -3.322 8.261 -9.417 1.00 . A A . 28 TYR CD2 1 1 14 4611 1 1 11 TYR CE1 C -2.568 10.459 -7.929 1.00 . A A . 28 TYR CE1 1 1 14 4612 1 1 11 TYR CE2 C -3.580 9.533 -9.890 1.00 . A A . 28 TYR CE2 1 1 14 4613 1 1 11 TYR CG C -2.685 8.064 -8.198 1.00 . A A . 28 TYR CG 1 1 14 4614 1 1 11 TYR CZ C -3.201 10.629 -9.142 1.00 . A A . 28 TYR CZ 1 1 14 4615 1 1 11 TYR H H -3.865 4.614 -7.928 1.00 . A A . 28 TYR H 1 1 14 4616 1 1 11 TYR HA H -2.839 5.955 -5.716 1.00 . A A . 28 TYR HA 1 1 14 4617 1 1 11 TYR HB2 H -1.406 6.663 -7.275 1.00 . A A . 28 TYR HB2 1 1 14 4618 1 1 11 TYR HB3 H -2.448 5.991 -8.524 1.00 . A A . 28 TYR HB3 1 1 14 4619 1 1 11 TYR HD1 H -1.817 9.047 -6.514 1.00 . A A . 28 TYR HD1 1 1 14 4620 1 1 11 TYR HD2 H -3.618 7.401 -9.999 1.00 . A A . 28 TYR HD2 1 1 14 4621 1 1 11 TYR HE1 H -2.271 11.318 -7.344 1.00 . A A . 28 TYR HE1 1 1 14 4622 1 1 11 TYR HE2 H -4.076 9.667 -10.840 1.00 . A A . 28 TYR HE2 1 1 14 4623 1 1 11 TYR HH H -4.394 12.090 -9.517 1.00 . A A . 28 TYR HH 1 1 14 4624 1 1 11 TYR N N -4.087 5.001 -7.055 1.00 . A A . 28 TYR N 1 1 14 4625 1 1 11 TYR O O -5.412 7.454 -6.945 1.00 . A A . 28 TYR O 1 1 14 4626 1 1 11 TYR OH O -3.458 11.898 -9.610 1.00 . A A . 28 TYR OH 1 1 14 4627 1 1 12 ASP C C -4.126 10.535 -4.846 1.00 . A A . 29 ASP C 1 1 14 4628 1 1 12 ASP CA C -4.907 9.225 -4.874 1.00 . A A . 29 ASP CA 1 1 14 4629 1 1 12 ASP CB C -5.513 8.949 -3.497 1.00 . A A . 29 ASP CB 1 1 14 4630 1 1 12 ASP CG C -6.743 8.065 -3.573 1.00 . A A . 29 ASP CG 1 1 14 4631 1 1 12 ASP H H -3.212 7.959 -4.799 1.00 . A A . 29 ASP H 1 1 14 4632 1 1 12 ASP HA H -5.704 9.312 -5.597 1.00 . A A . 29 ASP HA 1 1 14 4633 1 1 12 ASP HB2 H -4.777 8.457 -2.879 1.00 . A A . 29 ASP HB2 1 1 14 4634 1 1 12 ASP HB3 H -5.793 9.886 -3.040 1.00 . A A . 29 ASP HB3 1 1 14 4635 1 1 12 ASP N N -4.050 8.118 -5.282 1.00 . A A . 29 ASP N 1 1 14 4636 1 1 12 ASP O O -3.035 10.606 -4.279 1.00 . A A . 29 ASP O 1 1 14 4637 1 1 12 ASP OD1 O -7.791 8.546 -4.052 1.00 . A A . 29 ASP OD1 1 1 14 4638 1 1 12 ASP OD2 O -6.656 6.892 -3.153 1.00 . A A . 29 ASP OD2 1 1 14 4639 1 1 13 TRP C C -3.694 13.359 -4.105 1.00 . A A . 30 TRP C 1 1 14 4640 1 1 13 TRP CA C -4.045 12.875 -5.508 1.00 . A A . 30 TRP CA 1 1 14 4641 1 1 13 TRP CB C -4.956 13.892 -6.198 1.00 . A A . 30 TRP CB 1 1 14 4642 1 1 13 TRP CD1 C -4.279 15.069 -8.371 1.00 . A A . 30 TRP CD1 1 1 14 4643 1 1 13 TRP CD2 C -3.276 15.873 -6.537 1.00 . A A . 30 TRP CD2 1 1 14 4644 1 1 13 TRP CE2 C -2.820 16.600 -7.655 1.00 . A A . 30 TRP CE2 1 1 14 4645 1 1 13 TRP CE3 C -2.783 16.203 -5.272 1.00 . A A . 30 TRP CE3 1 1 14 4646 1 1 13 TRP CG C -4.208 14.899 -7.018 1.00 . A A . 30 TRP CG 1 1 14 4647 1 1 13 TRP CH2 C -1.429 17.937 -6.291 1.00 . A A . 30 TRP CH2 1 1 14 4648 1 1 13 TRP CZ2 C -1.895 17.635 -7.542 1.00 . A A . 30 TRP CZ2 1 1 14 4649 1 1 13 TRP CZ3 C -1.865 17.230 -5.162 1.00 . A A . 30 TRP CZ3 1 1 14 4650 1 1 13 TRP H H -5.561 11.448 -5.895 1.00 . A A . 30 TRP H 1 1 14 4651 1 1 13 TRP HA H -3.135 12.774 -6.080 1.00 . A A . 30 TRP HA 1 1 14 4652 1 1 13 TRP HB2 H -5.638 13.369 -6.852 1.00 . A A . 30 TRP HB2 1 1 14 4653 1 1 13 TRP HB3 H -5.521 14.425 -5.447 1.00 . A A . 30 TRP HB3 1 1 14 4654 1 1 13 TRP HD1 H -4.900 14.478 -9.027 1.00 . A A . 30 TRP HD1 1 1 14 4655 1 1 13 TRP HE1 H -3.322 16.403 -9.682 1.00 . A A . 30 TRP HE1 1 1 14 4656 1 1 13 TRP HE3 H -3.106 15.670 -4.390 1.00 . A A . 30 TRP HE3 1 1 14 4657 1 1 13 TRP HH2 H -0.711 18.731 -6.158 1.00 . A A . 30 TRP HH2 1 1 14 4658 1 1 13 TRP HZ2 H -1.551 18.190 -8.403 1.00 . A A . 30 TRP HZ2 1 1 14 4659 1 1 13 TRP HZ3 H -1.472 17.499 -4.193 1.00 . A A . 30 TRP HZ3 1 1 14 4660 1 1 13 TRP N N -4.690 11.568 -5.461 1.00 . A A . 30 TRP N 1 1 14 4661 1 1 13 TRP NE1 N -3.446 16.090 -8.761 1.00 . A A . 30 TRP NE1 1 1 14 4662 1 1 13 TRP O O -2.520 13.443 -3.744 1.00 . A A . 30 TRP O 1 1 14 4663 1 1 14 GLU C C -4.068 13.013 -1.043 1.00 . A A . 31 GLU C 1 1 14 4664 1 1 14 GLU CA C -4.515 14.151 -1.956 1.00 . A A . 31 GLU CA 1 1 14 4665 1 1 14 GLU CB C -5.801 14.780 -1.414 1.00 . A A . 31 GLU CB 1 1 14 4666 1 1 14 GLU CD C -7.052 16.929 -0.974 1.00 . A A . 31 GLU CD 1 1 14 4667 1 1 14 GLU CG C -5.960 16.247 -1.774 1.00 . A A . 31 GLU CG 1 1 14 4668 1 1 14 GLU H H -5.631 13.587 -3.664 1.00 . A A . 31 GLU H 1 1 14 4669 1 1 14 GLU HA H -3.740 14.903 -1.979 1.00 . A A . 31 GLU HA 1 1 14 4670 1 1 14 GLU HB2 H -6.647 14.239 -1.812 1.00 . A A . 31 GLU HB2 1 1 14 4671 1 1 14 GLU HB3 H -5.804 14.692 -0.338 1.00 . A A . 31 GLU HB3 1 1 14 4672 1 1 14 GLU HG2 H -5.026 16.755 -1.584 1.00 . A A . 31 GLU HG2 1 1 14 4673 1 1 14 GLU HG3 H -6.202 16.323 -2.824 1.00 . A A . 31 GLU HG3 1 1 14 4674 1 1 14 GLU N N -4.718 13.675 -3.319 1.00 . A A . 31 GLU N 1 1 14 4675 1 1 14 GLU O O -3.062 13.123 -0.341 1.00 . A A . 31 GLU O 1 1 14 4676 1 1 14 GLU OE1 O -7.223 16.583 0.214 1.00 . A A . 31 GLU OE1 1 1 14 4677 1 1 14 GLU OE2 O -7.737 17.810 -1.536 1.00 . A A . 31 GLU OE2 1 1 14 4678 1 1 15 LEU C C -3.076 10.293 -0.474 1.00 . A A . 32 LEU C 1 1 14 4679 1 1 15 LEU CA C -4.507 10.761 -0.231 1.00 . A A . 32 LEU CA 1 1 14 4680 1 1 15 LEU CB C -5.485 9.621 -0.521 1.00 . A A . 32 LEU CB 1 1 14 4681 1 1 15 LEU CD1 C -6.818 10.106 1.546 1.00 . A A . 32 LEU CD1 1 1 14 4682 1 1 15 LEU CD2 C -7.241 8.008 0.252 1.00 . A A . 32 LEU CD2 1 1 14 4683 1 1 15 LEU CG C -6.189 9.015 0.694 1.00 . A A . 32 LEU CG 1 1 14 4684 1 1 15 LEU H H -5.613 11.892 -1.637 1.00 . A A . 32 LEU H 1 1 14 4685 1 1 15 LEU HA H -4.606 11.054 0.804 1.00 . A A . 32 LEU HA 1 1 14 4686 1 1 15 LEU HB2 H -6.244 9.998 -1.189 1.00 . A A . 32 LEU HB2 1 1 14 4687 1 1 15 LEU HB3 H -4.935 8.832 -1.014 1.00 . A A . 32 LEU HB3 1 1 14 4688 1 1 15 LEU HD11 H -7.828 9.825 1.804 1.00 . A A . 32 LEU HD11 1 1 14 4689 1 1 15 LEU HD12 H -6.833 11.033 0.990 1.00 . A A . 32 LEU HD12 1 1 14 4690 1 1 15 LEU HD13 H -6.238 10.237 2.448 1.00 . A A . 32 LEU HD13 1 1 14 4691 1 1 15 LEU HD21 H -7.369 7.260 1.022 1.00 . A A . 32 LEU HD21 1 1 14 4692 1 1 15 LEU HD22 H -6.921 7.531 -0.663 1.00 . A A . 32 LEU HD22 1 1 14 4693 1 1 15 LEU HD23 H -8.179 8.516 0.085 1.00 . A A . 32 LEU HD23 1 1 14 4694 1 1 15 LEU HG H -5.462 8.495 1.302 1.00 . A A . 32 LEU HG 1 1 14 4695 1 1 15 LEU N N -4.824 11.920 -1.057 1.00 . A A . 32 LEU N 1 1 14 4696 1 1 15 LEU O O -2.504 9.565 0.337 1.00 . A A . 32 LEU O 1 1 14 4697 1 1 16 TRP C C -0.228 10.400 -0.721 1.00 . A A . 33 TRP C 1 1 14 4698 1 1 16 TRP CA C -1.137 10.343 -1.943 1.00 . A A . 33 TRP CA 1 1 14 4699 1 1 16 TRP CB C -0.598 11.265 -3.039 1.00 . A A . 33 TRP CB 1 1 14 4700 1 1 16 TRP CD1 C 1.542 10.422 -4.168 1.00 . A A . 33 TRP CD1 1 1 14 4701 1 1 16 TRP CD2 C 1.895 11.814 -2.449 1.00 . A A . 33 TRP CD2 1 1 14 4702 1 1 16 TRP CE2 C 3.142 11.427 -2.978 1.00 . A A . 33 TRP CE2 1 1 14 4703 1 1 16 TRP CE3 C 1.867 12.690 -1.361 1.00 . A A . 33 TRP CE3 1 1 14 4704 1 1 16 TRP CG C 0.885 11.160 -3.226 1.00 . A A . 33 TRP CG 1 1 14 4705 1 1 16 TRP CH2 C 4.290 12.743 -1.387 1.00 . A A . 33 TRP CH2 1 1 14 4706 1 1 16 TRP CZ2 C 4.347 11.886 -2.453 1.00 . A A . 33 TRP CZ2 1 1 14 4707 1 1 16 TRP CZ3 C 3.064 13.144 -0.841 1.00 . A A . 33 TRP CZ3 1 1 14 4708 1 1 16 TRP H H -3.010 11.296 -2.202 1.00 . A A . 33 TRP H 1 1 14 4709 1 1 16 TRP HA H -1.157 9.329 -2.316 1.00 . A A . 33 TRP HA 1 1 14 4710 1 1 16 TRP HB2 H -1.071 11.014 -3.976 1.00 . A A . 33 TRP HB2 1 1 14 4711 1 1 16 TRP HB3 H -0.832 12.288 -2.784 1.00 . A A . 33 TRP HB3 1 1 14 4712 1 1 16 TRP HD1 H 1.054 9.809 -4.910 1.00 . A A . 33 TRP HD1 1 1 14 4713 1 1 16 TRP HE1 H 3.584 10.151 -4.583 1.00 . A A . 33 TRP HE1 1 1 14 4714 1 1 16 TRP HE3 H 0.932 13.011 -0.926 1.00 . A A . 33 TRP HE3 1 1 14 4715 1 1 16 TRP HH2 H 5.200 13.122 -0.949 1.00 . A A . 33 TRP HH2 1 1 14 4716 1 1 16 TRP HZ2 H 5.301 11.587 -2.863 1.00 . A A . 33 TRP HZ2 1 1 14 4717 1 1 16 TRP HZ3 H 3.062 13.821 0.001 1.00 . A A . 33 TRP HZ3 1 1 14 4718 1 1 16 TRP N N -2.503 10.717 -1.594 1.00 . A A . 33 TRP N 1 1 14 4719 1 1 16 TRP NE1 N 2.900 10.578 -4.025 1.00 . A A . 33 TRP NE1 1 1 14 4720 1 1 16 TRP O O 0.666 9.569 -0.562 1.00 . A A . 33 TRP O 1 1 14 4721 1 1 17 ASP C C 0.311 10.276 2.193 1.00 . A A . 34 ASP C 1 1 14 4722 1 1 17 ASP CA C 0.335 11.548 1.350 1.00 . A A . 34 ASP CA 1 1 14 4723 1 1 17 ASP CB C -0.183 12.729 2.172 1.00 . A A . 34 ASP CB 1 1 14 4724 1 1 17 ASP CG C 0.736 13.078 3.326 1.00 . A A . 34 ASP CG 1 1 14 4725 1 1 17 ASP H H -1.190 12.015 -0.042 1.00 . A A . 34 ASP H 1 1 14 4726 1 1 17 ASP HA H 1.353 11.748 1.051 1.00 . A A . 34 ASP HA 1 1 14 4727 1 1 17 ASP HB2 H -0.269 13.595 1.531 1.00 . A A . 34 ASP HB2 1 1 14 4728 1 1 17 ASP HB3 H -1.156 12.483 2.570 1.00 . A A . 34 ASP HB3 1 1 14 4729 1 1 17 ASP N N -0.463 11.384 0.140 1.00 . A A . 34 ASP N 1 1 14 4730 1 1 17 ASP O O 1.358 9.721 2.528 1.00 . A A . 34 ASP O 1 1 14 4731 1 1 17 ASP OD1 O 1.905 13.435 3.069 1.00 . A A . 34 ASP OD1 1 1 14 4732 1 1 17 ASP OD2 O 0.285 12.994 4.488 1.00 . A A . 34 ASP OD2 1 1 14 4733 1 1 18 LYS C C -0.906 7.364 2.477 1.00 . A A . 35 LYS C 1 1 14 4734 1 1 18 LYS CA C -1.051 8.615 3.337 1.00 . A A . 35 LYS CA 1 1 14 4735 1 1 18 LYS CB C -2.417 8.617 4.028 1.00 . A A . 35 LYS CB 1 1 14 4736 1 1 18 LYS CD C -4.538 7.381 3.495 1.00 . A A . 35 LYS CD 1 1 14 4737 1 1 18 LYS CE C -4.063 6.017 3.019 1.00 . A A . 35 LYS CE 1 1 14 4738 1 1 18 LYS CG C -3.585 8.484 3.066 1.00 . A A . 35 LYS CG 1 1 14 4739 1 1 18 LYS H H -1.687 10.308 2.236 1.00 . A A . 35 LYS H 1 1 14 4740 1 1 18 LYS HA H -0.277 8.612 4.090 1.00 . A A . 35 LYS HA 1 1 14 4741 1 1 18 LYS HB2 H -2.456 7.793 4.725 1.00 . A A . 35 LYS HB2 1 1 14 4742 1 1 18 LYS HB3 H -2.530 9.544 4.572 1.00 . A A . 35 LYS HB3 1 1 14 4743 1 1 18 LYS HD2 H -4.601 7.372 4.573 1.00 . A A . 35 LYS HD2 1 1 14 4744 1 1 18 LYS HD3 H -5.515 7.579 3.077 1.00 . A A . 35 LYS HD3 1 1 14 4745 1 1 18 LYS HE2 H -4.735 5.663 2.254 1.00 . A A . 35 LYS HE2 1 1 14 4746 1 1 18 LYS HE3 H -3.070 6.120 2.607 1.00 . A A . 35 LYS HE3 1 1 14 4747 1 1 18 LYS HG2 H -4.124 9.419 3.036 1.00 . A A . 35 LYS HG2 1 1 14 4748 1 1 18 LYS HG3 H -3.204 8.255 2.081 1.00 . A A . 35 LYS HG3 1 1 14 4749 1 1 18 LYS HZ1 H -3.285 4.317 3.950 1.00 . A A . 35 LYS HZ1 1 1 14 4750 1 1 18 LYS HZ2 H -4.942 4.538 4.204 1.00 . A A . 35 LYS HZ2 1 1 14 4751 1 1 18 LYS HZ3 H -3.824 5.503 5.030 1.00 . A A . 35 LYS HZ3 1 1 14 4752 1 1 18 LYS N N -0.889 9.821 2.534 1.00 . A A . 35 LYS N 1 1 14 4753 1 1 18 LYS NZ N -4.026 5.025 4.129 1.00 . A A . 35 LYS NZ 1 1 14 4754 1 1 18 LYS O O -0.783 6.254 2.995 1.00 . A A . 35 LYS O 1 1 14 4755 1 1 19 TRP C C 0.665 6.237 -0.178 1.00 . A A . 36 TRP C 1 1 14 4756 1 1 19 TRP CA C -0.790 6.437 0.230 1.00 . A A . 36 TRP CA 1 1 14 4757 1 1 19 TRP CB C -1.652 6.679 -1.010 1.00 . A A . 36 TRP CB 1 1 14 4758 1 1 19 TRP CD1 C -4.057 6.523 -0.139 1.00 . A A . 36 TRP CD1 1 1 14 4759 1 1 19 TRP CD2 C -3.500 4.918 -1.599 1.00 . A A . 36 TRP CD2 1 1 14 4760 1 1 19 TRP CE2 C -4.837 4.719 -1.201 1.00 . A A . 36 TRP CE2 1 1 14 4761 1 1 19 TRP CE3 C -2.932 4.030 -2.516 1.00 . A A . 36 TRP CE3 1 1 14 4762 1 1 19 TRP CG C -3.021 6.077 -0.909 1.00 . A A . 36 TRP CG 1 1 14 4763 1 1 19 TRP CH2 C -5.028 2.815 -2.585 1.00 . A A . 36 TRP CH2 1 1 14 4764 1 1 19 TRP CZ2 C -5.610 3.669 -1.688 1.00 . A A . 36 TRP CZ2 1 1 14 4765 1 1 19 TRP CZ3 C -3.701 2.988 -2.999 1.00 . A A . 36 TRP CZ3 1 1 14 4766 1 1 19 TRP H H -1.023 8.460 0.809 1.00 . A A . 36 TRP H 1 1 14 4767 1 1 19 TRP HA H -1.137 5.545 0.730 1.00 . A A . 36 TRP HA 1 1 14 4768 1 1 19 TRP HB2 H -1.766 7.742 -1.160 1.00 . A A . 36 TRP HB2 1 1 14 4769 1 1 19 TRP HB3 H -1.160 6.248 -1.870 1.00 . A A . 36 TRP HB3 1 1 14 4770 1 1 19 TRP HD1 H -4.008 7.387 0.505 1.00 . A A . 36 TRP HD1 1 1 14 4771 1 1 19 TRP HE1 H -6.019 5.824 0.134 1.00 . A A . 36 TRP HE1 1 1 14 4772 1 1 19 TRP HE3 H -1.911 4.147 -2.847 1.00 . A A . 36 TRP HE3 1 1 14 4773 1 1 19 TRP HH2 H -5.591 1.987 -2.987 1.00 . A A . 36 TRP HH2 1 1 14 4774 1 1 19 TRP HZ2 H -6.635 3.522 -1.379 1.00 . A A . 36 TRP HZ2 1 1 14 4775 1 1 19 TRP HZ3 H -3.278 2.291 -3.708 1.00 . A A . 36 TRP HZ3 1 1 14 4776 1 1 19 TRP N N -0.921 7.551 1.162 1.00 . A A . 36 TRP N 1 1 14 4777 1 1 19 TRP NE1 N -5.152 5.710 -0.310 1.00 . A A . 36 TRP NE1 1 1 14 4778 1 1 19 TRP O O 0.954 5.601 -1.192 1.00 . A A . 36 TRP O 1 1 14 4779 1 1 20 CYS C C 3.831 7.294 1.457 1.00 . A A . 37 CYS C 1 1 14 4780 1 1 20 CYS CA C 3.005 6.666 0.339 1.00 . A A . 37 CYS CA 1 1 14 4781 1 1 20 CYS CB C 3.342 7.333 -0.996 1.00 . A A . 37 CYS CB 1 1 14 4782 1 1 20 CYS H H 1.287 7.280 1.412 1.00 . A A . 37 CYS H 1 1 14 4783 1 1 20 CYS HA H 3.245 5.615 0.277 1.00 . A A . 37 CYS HA 1 1 14 4784 1 1 20 CYS HB2 H 2.753 6.875 -1.778 1.00 . A A . 37 CYS HB2 1 1 14 4785 1 1 20 CYS HB3 H 3.097 8.383 -0.937 1.00 . A A . 37 CYS HB3 1 1 14 4786 1 1 20 CYS N N 1.579 6.784 0.617 1.00 . A A . 37 CYS N 1 1 14 4787 1 1 20 CYS O O 3.640 8.460 1.803 1.00 . A A . 37 CYS O 1 1 14 4788 1 1 20 CYS SG S 5.095 7.197 -1.473 1.00 . A A . 37 CYS SG 1 1 15 4789 1 1 1 ASN C C 2.236 2.911 -2.879 1.00 . A A . 18 ASN C 1 1 15 4790 1 1 1 ASN CA C 1.278 1.740 -2.679 1.00 . A A . 18 ASN CA 1 1 15 4791 1 1 1 ASN CB C -0.151 2.260 -2.510 1.00 . A A . 18 ASN CB 1 1 15 4792 1 1 1 ASN CG C -1.138 1.149 -2.209 1.00 . A A . 18 ASN CG 1 1 15 4793 1 1 1 ASN H1 H 1.422 1.250 -0.625 1.00 . A A . 18 ASN H1 1 1 15 4794 1 1 1 ASN HA H 1.319 1.104 -3.551 1.00 . A A . 18 ASN HA 1 1 15 4795 1 1 1 ASN HB2 H -0.176 2.967 -1.694 1.00 . A A . 18 ASN HB2 1 1 15 4796 1 1 1 ASN HB3 H -0.459 2.754 -3.419 1.00 . A A . 18 ASN HB3 1 1 15 4797 1 1 1 ASN HD21 H -0.333 0.015 -3.631 1.00 . A A . 18 ASN HD21 1 1 15 4798 1 1 1 ASN HD22 H -1.659 -0.686 -2.772 1.00 . A A . 18 ASN HD22 1 1 15 4799 1 1 1 ASN N N 1.667 0.941 -1.523 1.00 . A A . 18 ASN N 1 1 15 4800 1 1 1 ASN ND2 N -1.032 0.048 -2.945 1.00 . A A . 18 ASN ND2 1 1 15 4801 1 1 1 ASN O O 2.011 3.775 -3.727 1.00 . A A . 18 ASN O 1 1 15 4802 1 1 1 ASN OD1 O -1.986 1.278 -1.326 1.00 . A A . 18 ASN OD1 1 1 15 4803 1 1 2 CYS C C 5.255 3.751 -3.347 1.00 . A A . 19 CYS C 1 1 15 4804 1 1 2 CYS CA C 4.301 3.995 -2.182 1.00 . A A . 19 CYS CA 1 1 15 4805 1 1 2 CYS CB C 5.090 4.095 -0.875 1.00 . A A . 19 CYS CB 1 1 15 4806 1 1 2 CYS H H 3.433 2.215 -1.435 1.00 . A A . 19 CYS H 1 1 15 4807 1 1 2 CYS HA H 3.778 4.925 -2.348 1.00 . A A . 19 CYS HA 1 1 15 4808 1 1 2 CYS HB2 H 4.404 4.028 -0.043 1.00 . A A . 19 CYS HB2 1 1 15 4809 1 1 2 CYS HB3 H 5.791 3.275 -0.823 1.00 . A A . 19 CYS HB3 1 1 15 4810 1 1 2 CYS N N 3.307 2.932 -2.093 1.00 . A A . 19 CYS N 1 1 15 4811 1 1 2 CYS O O 6.040 4.626 -3.713 1.00 . A A . 19 CYS O 1 1 15 4812 1 1 2 CYS SG S 6.031 5.644 -0.691 1.00 . A A . 19 CYS SG 1 1 15 4813 1 1 3 ASP C C 5.579 2.899 -6.326 1.00 . A A . 20 ASP C 1 1 15 4814 1 1 3 ASP CA C 6.037 2.199 -5.050 1.00 . A A . 20 ASP CA 1 1 15 4815 1 1 3 ASP CB C 6.035 0.683 -5.257 1.00 . A A . 20 ASP CB 1 1 15 4816 1 1 3 ASP CG C 7.186 0.000 -4.545 1.00 . A A . 20 ASP CG 1 1 15 4817 1 1 3 ASP H H 4.535 1.903 -3.588 1.00 . A A . 20 ASP H 1 1 15 4818 1 1 3 ASP HA H 7.041 2.520 -4.819 1.00 . A A . 20 ASP HA 1 1 15 4819 1 1 3 ASP HB2 H 5.109 0.276 -4.877 1.00 . A A . 20 ASP HB2 1 1 15 4820 1 1 3 ASP HB3 H 6.110 0.470 -6.313 1.00 . A A . 20 ASP HB3 1 1 15 4821 1 1 3 ASP N N 5.181 2.558 -3.926 1.00 . A A . 20 ASP N 1 1 15 4822 1 1 3 ASP O O 6.245 2.825 -7.359 1.00 . A A . 20 ASP O 1 1 15 4823 1 1 3 ASP OD1 O 8.275 0.606 -4.463 1.00 . A A . 20 ASP OD1 1 1 15 4824 1 1 3 ASP OD2 O 6.998 -1.140 -4.071 1.00 . A A . 20 ASP OD2 1 1 15 4825 1 1 4 TRP C C 3.135 5.536 -6.953 1.00 . A A . 21 TRP C 1 1 15 4826 1 1 4 TRP CA C 3.894 4.290 -7.396 1.00 . A A . 21 TRP CA 1 1 15 4827 1 1 4 TRP CB C 2.968 3.373 -8.198 1.00 . A A . 21 TRP CB 1 1 15 4828 1 1 4 TRP CD1 C 1.234 2.908 -6.369 1.00 . A A . 21 TRP CD1 1 1 15 4829 1 1 4 TRP CD2 C 2.035 1.070 -7.367 1.00 . A A . 21 TRP CD2 1 1 15 4830 1 1 4 TRP CE2 C 1.099 0.679 -6.390 1.00 . A A . 21 TRP CE2 1 1 15 4831 1 1 4 TRP CE3 C 2.670 0.083 -8.125 1.00 . A A . 21 TRP CE3 1 1 15 4832 1 1 4 TRP CG C 2.106 2.500 -7.337 1.00 . A A . 21 TRP CG 1 1 15 4833 1 1 4 TRP CH2 C 1.422 -1.602 -6.909 1.00 . A A . 21 TRP CH2 1 1 15 4834 1 1 4 TRP CZ2 C 0.785 -0.656 -6.152 1.00 . A A . 21 TRP CZ2 1 1 15 4835 1 1 4 TRP CZ3 C 2.358 -1.243 -7.887 1.00 . A A . 21 TRP CZ3 1 1 15 4836 1 1 4 TRP H H 3.955 3.600 -5.395 1.00 . A A . 21 TRP H 1 1 15 4837 1 1 4 TRP HA H 4.720 4.590 -8.023 1.00 . A A . 21 TRP HA 1 1 15 4838 1 1 4 TRP HB2 H 2.320 3.977 -8.815 1.00 . A A . 21 TRP HB2 1 1 15 4839 1 1 4 TRP HB3 H 3.568 2.733 -8.829 1.00 . A A . 21 TRP HB3 1 1 15 4840 1 1 4 TRP HD1 H 1.060 3.940 -6.103 1.00 . A A . 21 TRP HD1 1 1 15 4841 1 1 4 TRP HE1 H -0.041 1.852 -5.077 1.00 . A A . 21 TRP HE1 1 1 15 4842 1 1 4 TRP HE3 H 3.394 0.340 -8.883 1.00 . A A . 21 TRP HE3 1 1 15 4843 1 1 4 TRP HH2 H 1.209 -2.649 -6.757 1.00 . A A . 21 TRP HH2 1 1 15 4844 1 1 4 TRP HZ2 H 0.065 -0.950 -5.402 1.00 . A A . 21 TRP HZ2 1 1 15 4845 1 1 4 TRP HZ3 H 2.839 -2.020 -8.463 1.00 . A A . 21 TRP HZ3 1 1 15 4846 1 1 4 TRP N N 4.440 3.577 -6.247 1.00 . A A . 21 TRP N 1 1 15 4847 1 1 4 TRP NE1 N 0.625 1.819 -5.795 1.00 . A A . 21 TRP NE1 1 1 15 4848 1 1 4 TRP O O 2.614 5.594 -5.839 1.00 . A A . 21 TRP O 1 1 15 4849 1 1 5 ASP C C 1.930 8.471 -8.811 1.00 . A A . 22 ASP C 1 1 15 4850 1 1 5 ASP CA C 2.381 7.777 -7.530 1.00 . A A . 22 ASP CA 1 1 15 4851 1 1 5 ASP CB C 3.285 8.710 -6.722 1.00 . A A . 22 ASP CB 1 1 15 4852 1 1 5 ASP CG C 4.757 8.429 -6.950 1.00 . A A . 22 ASP CG 1 1 15 4853 1 1 5 ASP H H 3.513 6.426 -8.702 1.00 . A A . 22 ASP H 1 1 15 4854 1 1 5 ASP HA H 1.510 7.536 -6.940 1.00 . A A . 22 ASP HA 1 1 15 4855 1 1 5 ASP HB2 H 3.084 9.732 -7.007 1.00 . A A . 22 ASP HB2 1 1 15 4856 1 1 5 ASP HB3 H 3.072 8.585 -5.670 1.00 . A A . 22 ASP HB3 1 1 15 4857 1 1 5 ASP N N 3.077 6.532 -7.830 1.00 . A A . 22 ASP N 1 1 15 4858 1 1 5 ASP O O 2.635 8.454 -9.820 1.00 . A A . 22 ASP O 1 1 15 4859 1 1 5 ASP OD1 O 5.291 7.501 -6.308 1.00 . A A . 22 ASP OD1 1 1 15 4860 1 1 5 ASP OD2 O 5.377 9.139 -7.770 1.00 . A A . 22 ASP OD2 1 1 15 4861 1 1 6 LYS C C 0.319 8.925 -11.179 1.00 . A A . 23 LYS C 1 1 15 4862 1 1 6 LYS CA C 0.203 9.780 -9.921 1.00 . A A . 23 LYS CA 1 1 15 4863 1 1 6 LYS CB C 0.928 11.111 -10.126 1.00 . A A . 23 LYS CB 1 1 15 4864 1 1 6 LYS CD C 0.062 13.155 -8.950 1.00 . A A . 23 LYS CD 1 1 15 4865 1 1 6 LYS CE C 0.778 14.399 -9.452 1.00 . A A . 23 LYS CE 1 1 15 4866 1 1 6 LYS CG C 1.002 11.964 -8.871 1.00 . A A . 23 LYS CG 1 1 15 4867 1 1 6 LYS H H 0.234 9.058 -7.930 1.00 . A A . 23 LYS H 1 1 15 4868 1 1 6 LYS HA H -0.841 9.974 -9.727 1.00 . A A . 23 LYS HA 1 1 15 4869 1 1 6 LYS HB2 H 1.935 10.911 -10.460 1.00 . A A . 23 LYS HB2 1 1 15 4870 1 1 6 LYS HB3 H 0.410 11.675 -10.889 1.00 . A A . 23 LYS HB3 1 1 15 4871 1 1 6 LYS HD2 H -0.747 12.920 -9.627 1.00 . A A . 23 LYS HD2 1 1 15 4872 1 1 6 LYS HD3 H -0.338 13.352 -7.965 1.00 . A A . 23 LYS HD3 1 1 15 4873 1 1 6 LYS HE2 H 0.323 15.267 -9.001 1.00 . A A . 23 LYS HE2 1 1 15 4874 1 1 6 LYS HE3 H 1.816 14.343 -9.159 1.00 . A A . 23 LYS HE3 1 1 15 4875 1 1 6 LYS HG2 H 0.729 11.359 -8.019 1.00 . A A . 23 LYS HG2 1 1 15 4876 1 1 6 LYS HG3 H 2.014 12.323 -8.751 1.00 . A A . 23 LYS HG3 1 1 15 4877 1 1 6 LYS HZ1 H -0.069 13.926 -11.302 1.00 . A A . 23 LYS HZ1 1 1 15 4878 1 1 6 LYS HZ2 H 1.595 14.223 -11.366 1.00 . A A . 23 LYS HZ2 1 1 15 4879 1 1 6 LYS HZ3 H 0.512 15.512 -11.199 1.00 . A A . 23 LYS HZ3 1 1 15 4880 1 1 6 LYS N N 0.750 9.080 -8.764 1.00 . A A . 23 LYS N 1 1 15 4881 1 1 6 LYS NZ N 0.699 14.524 -10.934 1.00 . A A . 23 LYS NZ 1 1 15 4882 1 1 6 LYS O O 0.911 9.346 -12.173 1.00 . A A . 23 LYS O 1 1 15 4883 1 1 7 SER C C -0.943 5.513 -11.945 1.00 . A A . 24 SER C 1 1 15 4884 1 1 7 SER CA C -0.208 6.812 -12.265 1.00 . A A . 24 SER CA 1 1 15 4885 1 1 7 SER CB C 1.242 6.509 -12.649 1.00 . A A . 24 SER CB 1 1 15 4886 1 1 7 SER H H -0.708 7.447 -10.308 1.00 . A A . 24 SER H 1 1 15 4887 1 1 7 SER HA H -0.698 7.294 -13.097 1.00 . A A . 24 SER HA 1 1 15 4888 1 1 7 SER HB2 H 1.899 6.859 -11.868 1.00 . A A . 24 SER HB2 1 1 15 4889 1 1 7 SER HB3 H 1.364 5.442 -12.771 1.00 . A A . 24 SER HB3 1 1 15 4890 1 1 7 SER HG H 2.457 7.557 -13.772 1.00 . A A . 24 SER HG 1 1 15 4891 1 1 7 SER N N -0.250 7.725 -11.129 1.00 . A A . 24 SER N 1 1 15 4892 1 1 7 SER O O -1.541 4.893 -12.824 1.00 . A A . 24 SER O 1 1 15 4893 1 1 7 SER OG O 1.592 7.150 -13.863 1.00 . A A . 24 SER OG 1 1 15 4894 1 1 8 HIS C C -3.071 4.027 -10.323 1.00 . A A . 25 HIS C 1 1 15 4895 1 1 8 HIS CA C -1.554 3.884 -10.242 1.00 . A A . 25 HIS CA 1 1 15 4896 1 1 8 HIS CB C -1.139 3.539 -8.812 1.00 . A A . 25 HIS CB 1 1 15 4897 1 1 8 HIS CD2 C -2.093 1.788 -7.153 1.00 . A A . 25 HIS CD2 1 1 15 4898 1 1 8 HIS CE1 C -2.131 0.058 -8.500 1.00 . A A . 25 HIS CE1 1 1 15 4899 1 1 8 HIS CG C -1.623 2.197 -8.355 1.00 . A A . 25 HIS CG 1 1 15 4900 1 1 8 HIS H H -0.400 5.646 -10.025 1.00 . A A . 25 HIS H 1 1 15 4901 1 1 8 HIS HA H -1.244 3.087 -10.900 1.00 . A A . 25 HIS HA 1 1 15 4902 1 1 8 HIS HB2 H -0.061 3.541 -8.746 1.00 . A A . 25 HIS HB2 1 1 15 4903 1 1 8 HIS HB3 H -1.537 4.284 -8.138 1.00 . A A . 25 HIS HB3 1 1 15 4904 1 1 8 HIS HD1 H -1.381 1.065 -10.115 1.00 . A A . 25 HIS HD1 1 1 15 4905 1 1 8 HIS HD2 H -2.205 2.396 -6.267 1.00 . A A . 25 HIS HD2 1 1 15 4906 1 1 8 HIS HE1 H -2.271 -0.940 -8.886 1.00 . A A . 25 HIS HE1 1 1 15 4907 1 1 8 HIS N N -0.893 5.109 -10.680 1.00 . A A . 25 HIS N 1 1 15 4908 1 1 8 HIS ND1 N -1.659 1.090 -9.176 1.00 . A A . 25 HIS ND1 1 1 15 4909 1 1 8 HIS NE2 N -2.401 0.455 -7.269 1.00 . A A . 25 HIS NE2 1 1 15 4910 1 1 8 HIS O O -3.607 5.128 -10.202 1.00 . A A . 25 HIS O 1 1 15 4911 1 1 9 GLU C C -5.847 3.249 -9.284 1.00 . A A . 26 GLU C 1 1 15 4912 1 1 9 GLU CA C -5.211 2.909 -10.629 1.00 . A A . 26 GLU CA 1 1 15 4913 1 1 9 GLU CB C -5.713 1.547 -11.114 1.00 . A A . 26 GLU CB 1 1 15 4914 1 1 9 GLU CD C -6.208 -0.862 -10.538 1.00 . A A . 26 GLU CD 1 1 15 4915 1 1 9 GLU CG C -5.741 0.487 -10.026 1.00 . A A . 26 GLU CG 1 1 15 4916 1 1 9 GLU H H -3.272 2.059 -10.618 1.00 . A A . 26 GLU H 1 1 15 4917 1 1 9 GLU HA H -5.493 3.663 -11.348 1.00 . A A . 26 GLU HA 1 1 15 4918 1 1 9 GLU HB2 H -6.714 1.663 -11.501 1.00 . A A . 26 GLU HB2 1 1 15 4919 1 1 9 GLU HB3 H -5.068 1.201 -11.908 1.00 . A A . 26 GLU HB3 1 1 15 4920 1 1 9 GLU HG2 H -4.746 0.376 -9.623 1.00 . A A . 26 GLU HG2 1 1 15 4921 1 1 9 GLU HG3 H -6.412 0.810 -9.243 1.00 . A A . 26 GLU HG3 1 1 15 4922 1 1 9 GLU N N -3.756 2.907 -10.530 1.00 . A A . 26 GLU N 1 1 15 4923 1 1 9 GLU O O -6.932 3.828 -9.226 1.00 . A A . 26 GLU O 1 1 15 4924 1 1 9 GLU OE1 O -6.130 -1.092 -11.763 1.00 . A A . 26 GLU OE1 1 1 15 4925 1 1 9 GLU OE2 O -6.652 -1.688 -9.713 1.00 . A A . 26 GLU OE2 1 1 15 4926 1 1 10 LYS C C -5.014 4.403 -6.279 1.00 . A A . 27 LYS C 1 1 15 4927 1 1 10 LYS CA C -5.660 3.150 -6.859 1.00 . A A . 27 LYS CA 1 1 15 4928 1 1 10 LYS CB C -5.387 1.952 -5.947 1.00 . A A . 27 LYS CB 1 1 15 4929 1 1 10 LYS CD C -6.099 -0.357 -5.262 1.00 . A A . 27 LYS CD 1 1 15 4930 1 1 10 LYS CE C -4.845 -1.215 -5.333 1.00 . A A . 27 LYS CE 1 1 15 4931 1 1 10 LYS CG C -6.121 0.690 -6.363 1.00 . A A . 27 LYS CG 1 1 15 4932 1 1 10 LYS H H -4.305 2.425 -8.315 1.00 . A A . 27 LYS H 1 1 15 4933 1 1 10 LYS HA H -6.727 3.306 -6.924 1.00 . A A . 27 LYS HA 1 1 15 4934 1 1 10 LYS HB2 H -4.327 1.746 -5.952 1.00 . A A . 27 LYS HB2 1 1 15 4935 1 1 10 LYS HB3 H -5.690 2.205 -4.941 1.00 . A A . 27 LYS HB3 1 1 15 4936 1 1 10 LYS HD2 H -6.128 0.140 -4.304 1.00 . A A . 27 LYS HD2 1 1 15 4937 1 1 10 LYS HD3 H -6.967 -0.994 -5.366 1.00 . A A . 27 LYS HD3 1 1 15 4938 1 1 10 LYS HE2 H -4.324 -0.992 -6.251 1.00 . A A . 27 LYS HE2 1 1 15 4939 1 1 10 LYS HE3 H -4.212 -0.974 -4.492 1.00 . A A . 27 LYS HE3 1 1 15 4940 1 1 10 LYS HG2 H -7.148 0.939 -6.588 1.00 . A A . 27 LYS HG2 1 1 15 4941 1 1 10 LYS HG3 H -5.646 0.282 -7.245 1.00 . A A . 27 LYS HG3 1 1 15 4942 1 1 10 LYS HZ1 H -4.822 -3.130 -6.165 1.00 . A A . 27 LYS HZ1 1 1 15 4943 1 1 10 LYS HZ2 H -6.193 -2.807 -5.229 1.00 . A A . 27 LYS HZ2 1 1 15 4944 1 1 10 LYS HZ3 H -4.709 -3.115 -4.477 1.00 . A A . 27 LYS HZ3 1 1 15 4945 1 1 10 LYS N N -5.164 2.884 -8.204 1.00 . A A . 27 LYS N 1 1 15 4946 1 1 10 LYS NZ N -5.165 -2.669 -5.298 1.00 . A A . 27 LYS NZ 1 1 15 4947 1 1 10 LYS O O -5.349 4.832 -5.174 1.00 . A A . 27 LYS O 1 1 15 4948 1 1 11 TYR C C -4.384 7.305 -6.268 1.00 . A A . 28 TYR C 1 1 15 4949 1 1 11 TYR CA C -3.393 6.191 -6.589 1.00 . A A . 28 TYR CA 1 1 15 4950 1 1 11 TYR CB C -2.411 6.662 -7.663 1.00 . A A . 28 TYR CB 1 1 15 4951 1 1 11 TYR CD1 C -2.327 9.176 -7.445 1.00 . A A . 28 TYR CD1 1 1 15 4952 1 1 11 TYR CD2 C -3.335 8.249 -9.396 1.00 . A A . 28 TYR CD2 1 1 15 4953 1 1 11 TYR CE1 C -2.587 10.450 -7.910 1.00 . A A . 28 TYR CE1 1 1 15 4954 1 1 11 TYR CE2 C -3.597 9.520 -9.870 1.00 . A A . 28 TYR CE2 1 1 15 4955 1 1 11 TYR CG C -2.696 8.055 -8.177 1.00 . A A . 28 TYR CG 1 1 15 4956 1 1 11 TYR CZ C -3.222 10.617 -9.123 1.00 . A A . 28 TYR CZ 1 1 15 4957 1 1 11 TYR H H -3.863 4.599 -7.901 1.00 . A A . 28 TYR H 1 1 15 4958 1 1 11 TYR HA H -2.841 5.947 -5.693 1.00 . A A . 28 TYR HA 1 1 15 4959 1 1 11 TYR HB2 H -1.412 6.658 -7.255 1.00 . A A . 28 TYR HB2 1 1 15 4960 1 1 11 TYR HB3 H -2.454 5.983 -8.503 1.00 . A A . 28 TYR HB3 1 1 15 4961 1 1 11 TYR HD1 H -1.830 9.042 -6.495 1.00 . A A . 28 TYR HD1 1 1 15 4962 1 1 11 TYR HD2 H -3.628 7.388 -9.979 1.00 . A A . 28 TYR HD2 1 1 15 4963 1 1 11 TYR HE1 H -2.293 11.310 -7.326 1.00 . A A . 28 TYR HE1 1 1 15 4964 1 1 11 TYR HE2 H -4.095 9.651 -10.819 1.00 . A A . 28 TYR HE2 1 1 15 4965 1 1 11 TYR HH H -3.986 12.371 -8.934 1.00 . A A . 28 TYR HH 1 1 15 4966 1 1 11 TYR N N -4.087 4.987 -7.030 1.00 . A A . 28 TYR N 1 1 15 4967 1 1 11 TYR O O -5.421 7.436 -6.920 1.00 . A A . 28 TYR O 1 1 15 4968 1 1 11 TYR OH O -3.482 11.885 -9.591 1.00 . A A . 28 TYR OH 1 1 15 4969 1 1 12 ASP C C -4.141 10.523 -4.825 1.00 . A A . 29 ASP C 1 1 15 4970 1 1 12 ASP CA C -4.918 9.211 -4.852 1.00 . A A . 29 ASP CA 1 1 15 4971 1 1 12 ASP CB C -5.522 8.934 -3.474 1.00 . A A . 29 ASP CB 1 1 15 4972 1 1 12 ASP CG C -6.749 8.047 -3.548 1.00 . A A . 29 ASP CG 1 1 15 4973 1 1 12 ASP H H -3.218 7.951 -4.778 1.00 . A A . 29 ASP H 1 1 15 4974 1 1 12 ASP HA H -5.716 9.295 -5.574 1.00 . A A . 29 ASP HA 1 1 15 4975 1 1 12 ASP HB2 H -4.783 8.443 -2.857 1.00 . A A . 29 ASP HB2 1 1 15 4976 1 1 12 ASP HB3 H -5.803 9.871 -3.016 1.00 . A A . 29 ASP HB3 1 1 15 4977 1 1 12 ASP N N -4.058 8.106 -5.260 1.00 . A A . 29 ASP N 1 1 15 4978 1 1 12 ASP O O -3.050 10.599 -4.260 1.00 . A A . 29 ASP O 1 1 15 4979 1 1 12 ASP OD1 O -7.738 8.454 -4.195 1.00 . A A . 29 ASP OD1 1 1 15 4980 1 1 12 ASP OD2 O -6.722 6.946 -2.960 1.00 . A A . 29 ASP OD2 1 1 15 4981 1 1 13 TRP C C -3.717 13.349 -4.086 1.00 . A A . 30 TRP C 1 1 15 4982 1 1 13 TRP CA C -4.069 12.864 -5.488 1.00 . A A . 30 TRP CA 1 1 15 4983 1 1 13 TRP CB C -4.984 13.877 -6.178 1.00 . A A . 30 TRP CB 1 1 15 4984 1 1 13 TRP CD1 C -4.313 15.054 -8.353 1.00 . A A . 30 TRP CD1 1 1 15 4985 1 1 13 TRP CD2 C -3.310 15.863 -6.521 1.00 . A A . 30 TRP CD2 1 1 15 4986 1 1 13 TRP CE2 C -2.858 16.591 -7.639 1.00 . A A . 30 TRP CE2 1 1 15 4987 1 1 13 TRP CE3 C -2.816 16.196 -5.256 1.00 . A A . 30 TRP CE3 1 1 15 4988 1 1 13 TRP CG C -4.240 14.886 -6.999 1.00 . A A . 30 TRP CG 1 1 15 4989 1 1 13 TRP CH2 C -1.470 17.933 -6.278 1.00 . A A . 30 TRP CH2 1 1 15 4990 1 1 13 TRP CZ2 C -1.937 17.629 -7.528 1.00 . A A . 30 TRP CZ2 1 1 15 4991 1 1 13 TRP CZ3 C -1.901 17.226 -5.148 1.00 . A A . 30 TRP CZ3 1 1 15 4992 1 1 13 TRP H H -5.580 11.432 -5.873 1.00 . A A . 30 TRP H 1 1 15 4993 1 1 13 TRP HA H -3.158 12.766 -6.061 1.00 . A A . 30 TRP HA 1 1 15 4994 1 1 13 TRP HB2 H -5.665 13.352 -6.830 1.00 . A A . 30 TRP HB2 1 1 15 4995 1 1 13 TRP HB3 H -5.549 14.409 -5.426 1.00 . A A . 30 TRP HB3 1 1 15 4996 1 1 13 TRP HD1 H -4.934 14.462 -9.007 1.00 . A A . 30 TRP HD1 1 1 15 4997 1 1 13 TRP HE1 H -3.362 16.391 -9.665 1.00 . A A . 30 TRP HE1 1 1 15 4998 1 1 13 TRP HE3 H -3.137 15.662 -4.374 1.00 . A A . 30 TRP HE3 1 1 15 4999 1 1 13 TRP HH2 H -0.754 18.730 -6.147 1.00 . A A . 30 TRP HH2 1 1 15 5000 1 1 13 TRP HZ2 H -1.595 18.184 -8.390 1.00 . A A . 30 TRP HZ2 1 1 15 5001 1 1 13 TRP HZ3 H -1.508 17.497 -4.179 1.00 . A A . 30 TRP HZ3 1 1 15 5002 1 1 13 TRP N N -4.709 11.554 -5.440 1.00 . A A . 30 TRP N 1 1 15 5003 1 1 13 TRP NE1 N -3.484 16.078 -8.744 1.00 . A A . 30 TRP NE1 1 1 15 5004 1 1 13 TRP O O -2.543 13.437 -3.727 1.00 . A A . 30 TRP O 1 1 15 5005 1 1 14 GLU C C -4.087 13.003 -1.023 1.00 . A A . 31 GLU C 1 1 15 5006 1 1 14 GLU CA C -4.538 14.140 -1.936 1.00 . A A . 31 GLU CA 1 1 15 5007 1 1 14 GLU CB C -5.825 14.764 -1.393 1.00 . A A . 31 GLU CB 1 1 15 5008 1 1 14 GLU CD C -5.700 17.280 -1.203 1.00 . A A . 31 GLU CD 1 1 15 5009 1 1 14 GLU CG C -6.170 16.099 -2.031 1.00 . A A . 31 GLU CG 1 1 15 5010 1 1 14 GLU H H -5.654 13.572 -3.643 1.00 . A A . 31 GLU H 1 1 15 5011 1 1 14 GLU HA H -3.766 14.894 -1.960 1.00 . A A . 31 GLU HA 1 1 15 5012 1 1 14 GLU HB2 H -6.644 14.082 -1.569 1.00 . A A . 31 GLU HB2 1 1 15 5013 1 1 14 GLU HB3 H -5.717 14.914 -0.329 1.00 . A A . 31 GLU HB3 1 1 15 5014 1 1 14 GLU HG2 H -5.702 16.152 -3.002 1.00 . A A . 31 GLU HG2 1 1 15 5015 1 1 14 GLU HG3 H -7.242 16.163 -2.145 1.00 . A A . 31 GLU HG3 1 1 15 5016 1 1 14 GLU N N -4.741 13.663 -3.299 1.00 . A A . 31 GLU N 1 1 15 5017 1 1 14 GLU O O -3.080 13.117 -0.323 1.00 . A A . 31 GLU O 1 1 15 5018 1 1 14 GLU OE1 O -4.473 17.501 -1.130 1.00 . A A . 31 GLU OE1 1 1 15 5019 1 1 14 GLU OE2 O -6.558 17.981 -0.628 1.00 . A A . 31 GLU OE2 1 1 15 5020 1 1 15 LEU C C -3.085 10.286 -0.455 1.00 . A A . 32 LEU C 1 1 15 5021 1 1 15 LEU CA C -4.517 10.750 -0.209 1.00 . A A . 32 LEU CA 1 1 15 5022 1 1 15 LEU CB C -5.492 9.607 -0.498 1.00 . A A . 32 LEU CB 1 1 15 5023 1 1 15 LEU CD1 C -6.824 10.088 1.570 1.00 . A A . 32 LEU CD1 1 1 15 5024 1 1 15 LEU CD2 C -7.241 7.987 0.278 1.00 . A A . 32 LEU CD2 1 1 15 5025 1 1 15 LEU CG C -6.192 8.999 0.718 1.00 . A A . 32 LEU CG 1 1 15 5026 1 1 15 LEU H H -5.628 11.877 -1.615 1.00 . A A . 32 LEU H 1 1 15 5027 1 1 15 LEU HA H -4.616 11.044 0.825 1.00 . A A . 32 LEU HA 1 1 15 5028 1 1 15 LEU HB2 H -6.253 9.982 -1.165 1.00 . A A . 32 LEU HB2 1 1 15 5029 1 1 15 LEU HB3 H -4.940 8.819 -0.991 1.00 . A A . 32 LEU HB3 1 1 15 5030 1 1 15 LEU HD11 H -6.884 11.003 0.999 1.00 . A A . 32 LEU HD11 1 1 15 5031 1 1 15 LEU HD12 H -6.221 10.252 2.450 1.00 . A A . 32 LEU HD12 1 1 15 5032 1 1 15 LEU HD13 H -7.817 9.783 1.866 1.00 . A A . 32 LEU HD13 1 1 15 5033 1 1 15 LEU HD21 H -7.285 7.181 0.996 1.00 . A A . 32 LEU HD21 1 1 15 5034 1 1 15 LEU HD22 H -6.975 7.591 -0.691 1.00 . A A . 32 LEU HD22 1 1 15 5035 1 1 15 LEU HD23 H -8.205 8.470 0.219 1.00 . A A . 32 LEU HD23 1 1 15 5036 1 1 15 LEU HG H -5.462 8.482 1.325 1.00 . A A . 32 LEU HG 1 1 15 5037 1 1 15 LEU N N -4.839 11.908 -1.036 1.00 . A A . 32 LEU N 1 1 15 5038 1 1 15 LEU O O -2.510 9.561 0.357 1.00 . A A . 32 LEU O 1 1 15 5039 1 1 16 TRP C C -0.238 10.402 -0.705 1.00 . A A . 33 TRP C 1 1 15 5040 1 1 16 TRP CA C -1.148 10.342 -1.926 1.00 . A A . 33 TRP CA 1 1 15 5041 1 1 16 TRP CB C -0.614 11.265 -3.023 1.00 . A A . 33 TRP CB 1 1 15 5042 1 1 16 TRP CD1 C 1.528 10.429 -4.155 1.00 . A A . 33 TRP CD1 1 1 15 5043 1 1 16 TRP CD2 C 1.879 11.823 -2.437 1.00 . A A . 33 TRP CD2 1 1 15 5044 1 1 16 TRP CE2 C 3.126 11.440 -2.967 1.00 . A A . 33 TRP CE2 1 1 15 5045 1 1 16 TRP CE3 C 1.849 12.699 -1.349 1.00 . A A . 33 TRP CE3 1 1 15 5046 1 1 16 TRP CG C 0.870 11.166 -3.212 1.00 . A A . 33 TRP CG 1 1 15 5047 1 1 16 TRP CH2 C 4.272 12.760 -1.378 1.00 . A A . 33 TRP CH2 1 1 15 5048 1 1 16 TRP CZ2 C 4.331 11.903 -2.443 1.00 . A A . 33 TRP CZ2 1 1 15 5049 1 1 16 TRP CZ3 C 3.045 13.158 -0.830 1.00 . A A . 33 TRP CZ3 1 1 15 5050 1 1 16 TRP H H -3.025 11.289 -2.183 1.00 . A A . 33 TRP H 1 1 15 5051 1 1 16 TRP HA H -1.165 9.328 -2.299 1.00 . A A . 33 TRP HA 1 1 15 5052 1 1 16 TRP HB2 H -1.086 11.013 -3.960 1.00 . A A . 33 TRP HB2 1 1 15 5053 1 1 16 TRP HB3 H -0.850 12.288 -2.768 1.00 . A A . 33 TRP HB3 1 1 15 5054 1 1 16 TRP HD1 H 1.041 9.815 -4.896 1.00 . A A . 33 TRP HD1 1 1 15 5055 1 1 16 TRP HE1 H 3.570 10.164 -4.572 1.00 . A A . 33 TRP HE1 1 1 15 5056 1 1 16 TRP HE3 H 0.913 13.017 -0.913 1.00 . A A . 33 TRP HE3 1 1 15 5057 1 1 16 TRP HH2 H 5.181 13.143 -0.940 1.00 . A A . 33 TRP HH2 1 1 15 5058 1 1 16 TRP HZ2 H 5.284 11.607 -2.854 1.00 . A A . 33 TRP HZ2 1 1 15 5059 1 1 16 TRP HZ3 H 3.042 13.835 0.011 1.00 . A A . 33 TRP HZ3 1 1 15 5060 1 1 16 TRP N N -2.515 10.712 -1.576 1.00 . A A . 33 TRP N 1 1 15 5061 1 1 16 TRP NE1 N 2.886 10.589 -4.013 1.00 . A A . 33 TRP NE1 1 1 15 5062 1 1 16 TRP O O 0.660 9.575 -0.547 1.00 . A A . 33 TRP O 1 1 15 5063 1 1 17 ASP C C 0.305 10.282 2.208 1.00 . A A . 34 ASP C 1 1 15 5064 1 1 17 ASP CA C 0.324 11.553 1.365 1.00 . A A . 34 ASP CA 1 1 15 5065 1 1 17 ASP CB C -0.196 12.733 2.186 1.00 . A A . 34 ASP CB 1 1 15 5066 1 1 17 ASP CG C 0.813 13.860 2.283 1.00 . A A . 34 ASP CG 1 1 15 5067 1 1 17 ASP H H -1.205 12.014 -0.025 1.00 . A A . 34 ASP H 1 1 15 5068 1 1 17 ASP HA H 1.341 11.755 1.065 1.00 . A A . 34 ASP HA 1 1 15 5069 1 1 17 ASP HB2 H -1.094 13.118 1.724 1.00 . A A . 34 ASP HB2 1 1 15 5070 1 1 17 ASP HB3 H -0.427 12.394 3.185 1.00 . A A . 34 ASP HB3 1 1 15 5071 1 1 17 ASP N N -0.474 11.386 0.156 1.00 . A A . 34 ASP N 1 1 15 5072 1 1 17 ASP O O 1.354 9.729 2.542 1.00 . A A . 34 ASP O 1 1 15 5073 1 1 17 ASP OD1 O 1.884 13.648 2.891 1.00 . A A . 34 ASP OD1 1 1 15 5074 1 1 17 ASP OD2 O 0.533 14.954 1.751 1.00 . A A . 34 ASP OD2 1 1 15 5075 1 1 18 LYS C C -0.903 7.367 2.496 1.00 . A A . 35 LYS C 1 1 15 5076 1 1 18 LYS CA C -1.051 8.618 3.356 1.00 . A A . 35 LYS CA 1 1 15 5077 1 1 18 LYS CB C -2.416 8.616 4.048 1.00 . A A . 35 LYS CB 1 1 15 5078 1 1 18 LYS CD C -4.520 7.352 3.512 1.00 . A A . 35 LYS CD 1 1 15 5079 1 1 18 LYS CE C -4.013 5.995 3.046 1.00 . A A . 35 LYS CE 1 1 15 5080 1 1 18 LYS CG C -3.584 8.471 3.088 1.00 . A A . 35 LYS CG 1 1 15 5081 1 1 18 LYS H H -1.693 10.308 2.255 1.00 . A A . 35 LYS H 1 1 15 5082 1 1 18 LYS HA H -0.276 8.617 4.108 1.00 . A A . 35 LYS HA 1 1 15 5083 1 1 18 LYS HB2 H -2.450 7.795 4.749 1.00 . A A . 35 LYS HB2 1 1 15 5084 1 1 18 LYS HB3 H -2.534 9.545 4.587 1.00 . A A . 35 LYS HB3 1 1 15 5085 1 1 18 LYS HD2 H -4.594 7.345 4.589 1.00 . A A . 35 LYS HD2 1 1 15 5086 1 1 18 LYS HD3 H -5.496 7.528 3.083 1.00 . A A . 35 LYS HD3 1 1 15 5087 1 1 18 LYS HE2 H -4.744 5.561 2.382 1.00 . A A . 35 LYS HE2 1 1 15 5088 1 1 18 LYS HE3 H -3.083 6.136 2.516 1.00 . A A . 35 LYS HE3 1 1 15 5089 1 1 18 LYS HG2 H -4.137 9.399 3.065 1.00 . A A . 35 LYS HG2 1 1 15 5090 1 1 18 LYS HG3 H -3.202 8.254 2.100 1.00 . A A . 35 LYS HG3 1 1 15 5091 1 1 18 LYS HZ1 H -4.492 4.305 4.176 1.00 . A A . 35 LYS HZ1 1 1 15 5092 1 1 18 LYS HZ2 H -3.861 5.582 5.088 1.00 . A A . 35 LYS HZ2 1 1 15 5093 1 1 18 LYS HZ3 H -2.835 4.646 4.122 1.00 . A A . 35 LYS HZ3 1 1 15 5094 1 1 18 LYS N N -0.894 9.824 2.552 1.00 . A A . 35 LYS N 1 1 15 5095 1 1 18 LYS NZ N -3.784 5.067 4.188 1.00 . A A . 35 LYS NZ 1 1 15 5096 1 1 18 LYS O O -0.775 6.258 3.015 1.00 . A A . 35 LYS O 1 1 15 5097 1 1 19 TRP C C 0.669 6.243 -0.160 1.00 . A A . 36 TRP C 1 1 15 5098 1 1 19 TRP CA C -0.786 6.438 0.250 1.00 . A A . 36 TRP CA 1 1 15 5099 1 1 19 TRP CB C -1.651 6.676 -0.989 1.00 . A A . 36 TRP CB 1 1 15 5100 1 1 19 TRP CD1 C -4.054 6.512 -0.114 1.00 . A A . 36 TRP CD1 1 1 15 5101 1 1 19 TRP CD2 C -3.494 4.909 -1.575 1.00 . A A . 36 TRP CD2 1 1 15 5102 1 1 19 TRP CE2 C -4.829 4.706 -1.174 1.00 . A A . 36 TRP CE2 1 1 15 5103 1 1 19 TRP CE3 C -2.925 4.023 -2.494 1.00 . A A . 36 TRP CE3 1 1 15 5104 1 1 19 TRP CG C -3.017 6.070 -0.885 1.00 . A A . 36 TRP CG 1 1 15 5105 1 1 19 TRP CH2 C -5.017 2.801 -2.558 1.00 . A A . 36 TRP CH2 1 1 15 5106 1 1 19 TRP CZ2 C -5.600 3.653 -1.660 1.00 . A A . 36 TRP CZ2 1 1 15 5107 1 1 19 TRP CZ3 C -3.691 2.979 -2.975 1.00 . A A . 36 TRP CZ3 1 1 15 5108 1 1 19 TRP H H -1.025 8.461 0.828 1.00 . A A . 36 TRP H 1 1 15 5109 1 1 19 TRP HA H -1.130 5.546 0.752 1.00 . A A . 36 TRP HA 1 1 15 5110 1 1 19 TRP HB2 H -1.768 7.739 -1.140 1.00 . A A . 36 TRP HB2 1 1 15 5111 1 1 19 TRP HB3 H -1.159 6.246 -1.849 1.00 . A A . 36 TRP HB3 1 1 15 5112 1 1 19 TRP HD1 H -4.006 7.376 0.531 1.00 . A A . 36 TRP HD1 1 1 15 5113 1 1 19 TRP HE1 H -6.013 5.807 0.163 1.00 . A A . 36 TRP HE1 1 1 15 5114 1 1 19 TRP HE3 H -1.904 4.144 -2.827 1.00 . A A . 36 TRP HE3 1 1 15 5115 1 1 19 TRP HH2 H -5.578 1.972 -2.960 1.00 . A A . 36 TRP HH2 1 1 15 5116 1 1 19 TRP HZ2 H -6.624 3.503 -1.350 1.00 . A A . 36 TRP HZ2 1 1 15 5117 1 1 19 TRP HZ3 H -3.267 2.284 -3.685 1.00 . A A . 36 TRP HZ3 1 1 15 5118 1 1 19 TRP N N -0.920 7.553 1.182 1.00 . A A . 36 TRP N 1 1 15 5119 1 1 19 TRP NE1 N -5.146 5.696 -0.282 1.00 . A A . 36 TRP NE1 1 1 15 5120 1 1 19 TRP O O 0.959 5.608 -1.174 1.00 . A A . 36 TRP O 1 1 15 5121 1 1 20 CYS C C 3.834 7.310 1.472 1.00 . A A . 37 CYS C 1 1 15 5122 1 1 20 CYS CA C 3.008 6.680 0.355 1.00 . A A . 37 CYS CA 1 1 15 5123 1 1 20 CYS CB C 3.342 7.349 -0.980 1.00 . A A . 37 CYS CB 1 1 15 5124 1 1 20 CYS H H 1.289 7.288 1.430 1.00 . A A . 37 CYS H 1 1 15 5125 1 1 20 CYS HA H 3.252 5.630 0.292 1.00 . A A . 37 CYS HA 1 1 15 5126 1 1 20 CYS HB2 H 2.751 6.892 -1.761 1.00 . A A . 37 CYS HB2 1 1 15 5127 1 1 20 CYS HB3 H 3.097 8.399 -0.919 1.00 . A A . 37 CYS HB3 1 1 15 5128 1 1 20 CYS N N 1.582 6.793 0.635 1.00 . A A . 37 CYS N 1 1 15 5129 1 1 20 CYS O O 3.289 7.768 2.477 1.00 . A A . 37 CYS O 1 1 15 5130 1 1 20 CYS SG S 5.093 7.214 -1.463 1.00 . A A . 37 CYS SG 1 1 16 5131 1 1 1 ASN C C 2.230 2.901 -2.903 1.00 . A A . 18 ASN C 1 1 16 5132 1 1 1 ASN CA C 1.268 1.733 -2.703 1.00 . A A . 18 ASN CA 1 1 16 5133 1 1 1 ASN CB C -0.159 2.257 -2.531 1.00 . A A . 18 ASN CB 1 1 16 5134 1 1 1 ASN CG C -1.149 1.149 -2.231 1.00 . A A . 18 ASN CG 1 1 16 5135 1 1 1 ASN H1 H 2.336 0.234 -1.657 1.00 . A A . 18 ASN H1 1 1 16 5136 1 1 1 ASN HA H 1.306 1.098 -3.575 1.00 . A A . 18 ASN HA 1 1 16 5137 1 1 1 ASN HB2 H -0.180 2.964 -1.714 1.00 . A A . 18 ASN HB2 1 1 16 5138 1 1 1 ASN HB3 H -0.466 2.754 -3.439 1.00 . A A . 18 ASN HB3 1 1 16 5139 1 1 1 ASN HD21 H -0.350 0.015 -3.655 1.00 . A A . 18 ASN HD21 1 1 16 5140 1 1 1 ASN HD22 H -1.676 -0.683 -2.796 1.00 . A A . 18 ASN HD22 1 1 16 5141 1 1 1 ASN N N 1.656 0.932 -1.548 1.00 . A A . 18 ASN N 1 1 16 5142 1 1 1 ASN ND2 N -1.048 0.049 -2.968 1.00 . A A . 18 ASN ND2 1 1 16 5143 1 1 1 ASN O O 2.007 3.766 -3.751 1.00 . A A . 18 ASN O 1 1 16 5144 1 1 1 ASN OD1 O -1.995 1.280 -1.346 1.00 . A A . 18 ASN OD1 1 1 16 5145 1 1 2 CYS C C 5.251 3.733 -3.372 1.00 . A A . 19 CYS C 1 1 16 5146 1 1 2 CYS CA C 4.298 3.979 -2.206 1.00 . A A . 19 CYS CA 1 1 16 5147 1 1 2 CYS CB C 5.088 4.076 -0.899 1.00 . A A . 19 CYS CB 1 1 16 5148 1 1 2 CYS H H 3.425 2.201 -1.460 1.00 . A A . 19 CYS H 1 1 16 5149 1 1 2 CYS HA H 3.778 4.910 -2.372 1.00 . A A . 19 CYS HA 1 1 16 5150 1 1 2 CYS HB2 H 4.403 4.009 -0.067 1.00 . A A . 19 CYS HB2 1 1 16 5151 1 1 2 CYS HB3 H 5.788 3.254 -0.849 1.00 . A A . 19 CYS HB3 1 1 16 5152 1 1 2 CYS N N 3.301 2.919 -2.117 1.00 . A A . 19 CYS N 1 1 16 5153 1 1 2 CYS O O 6.039 4.605 -3.738 1.00 . A A . 19 CYS O 1 1 16 5154 1 1 2 CYS SG S 6.033 5.622 -0.715 1.00 . A A . 19 CYS SG 1 1 16 5155 1 1 3 ASP C C 5.569 2.881 -6.353 1.00 . A A . 20 ASP C 1 1 16 5156 1 1 3 ASP CA C 6.026 2.179 -5.078 1.00 . A A . 20 ASP CA 1 1 16 5157 1 1 3 ASP CB C 6.019 0.664 -5.285 1.00 . A A . 20 ASP CB 1 1 16 5158 1 1 3 ASP CG C 7.169 -0.023 -4.574 1.00 . A A . 20 ASP CG 1 1 16 5159 1 1 3 ASP H H 4.524 1.887 -3.614 1.00 . A A . 20 ASP H 1 1 16 5160 1 1 3 ASP HA H 7.031 2.497 -4.847 1.00 . A A . 20 ASP HA 1 1 16 5161 1 1 3 ASP HB2 H 5.093 0.259 -4.904 1.00 . A A . 20 ASP HB2 1 1 16 5162 1 1 3 ASP HB3 H 6.094 0.451 -6.341 1.00 . A A . 20 ASP HB3 1 1 16 5163 1 1 3 ASP N N 5.172 2.540 -3.952 1.00 . A A . 20 ASP N 1 1 16 5164 1 1 3 ASP O O 6.233 2.805 -7.387 1.00 . A A . 20 ASP O 1 1 16 5165 1 1 3 ASP OD1 O 8.331 0.374 -4.804 1.00 . A A . 20 ASP OD1 1 1 16 5166 1 1 3 ASP OD2 O 6.908 -0.956 -3.787 1.00 . A A . 20 ASP OD2 1 1 16 5167 1 1 4 TRP C C 3.132 5.526 -6.976 1.00 . A A . 21 TRP C 1 1 16 5168 1 1 4 TRP CA C 3.887 4.278 -7.420 1.00 . A A . 21 TRP CA 1 1 16 5169 1 1 4 TRP CB C 2.958 3.364 -8.221 1.00 . A A . 21 TRP CB 1 1 16 5170 1 1 4 TRP CD1 C 1.223 2.905 -6.392 1.00 . A A . 21 TRP CD1 1 1 16 5171 1 1 4 TRP CD2 C 2.018 1.064 -7.389 1.00 . A A . 21 TRP CD2 1 1 16 5172 1 1 4 TRP CE2 C 1.081 0.676 -6.412 1.00 . A A . 21 TRP CE2 1 1 16 5173 1 1 4 TRP CE3 C 2.650 0.074 -8.147 1.00 . A A . 21 TRP CE3 1 1 16 5174 1 1 4 TRP CG C 2.094 2.493 -7.360 1.00 . A A . 21 TRP CG 1 1 16 5175 1 1 4 TRP CH2 C 1.397 -1.607 -6.930 1.00 . A A . 21 TRP CH2 1 1 16 5176 1 1 4 TRP CZ2 C 0.763 -0.658 -6.173 1.00 . A A . 21 TRP CZ2 1 1 16 5177 1 1 4 TRP CZ3 C 2.333 -1.250 -7.909 1.00 . A A . 21 TRP CZ3 1 1 16 5178 1 1 4 TRP H H 3.948 3.587 -5.420 1.00 . A A . 21 TRP H 1 1 16 5179 1 1 4 TRP HA H 4.714 4.575 -8.048 1.00 . A A . 21 TRP HA 1 1 16 5180 1 1 4 TRP HB2 H 2.312 3.969 -8.838 1.00 . A A . 21 TRP HB2 1 1 16 5181 1 1 4 TRP HB3 H 3.555 2.722 -8.853 1.00 . A A . 21 TRP HB3 1 1 16 5182 1 1 4 TRP HD1 H 1.052 3.937 -6.126 1.00 . A A . 21 TRP HD1 1 1 16 5183 1 1 4 TRP HE1 H -0.055 1.853 -5.099 1.00 . A A . 21 TRP HE1 1 1 16 5184 1 1 4 TRP HE3 H 3.374 0.329 -8.906 1.00 . A A . 21 TRP HE3 1 1 16 5185 1 1 4 TRP HH2 H 1.181 -2.653 -6.778 1.00 . A A . 21 TRP HH2 1 1 16 5186 1 1 4 TRP HZ2 H 0.043 -0.949 -5.423 1.00 . A A . 21 TRP HZ2 1 1 16 5187 1 1 4 TRP HZ3 H 2.812 -2.029 -8.484 1.00 . A A . 21 TRP HZ3 1 1 16 5188 1 1 4 TRP N N 4.433 3.563 -6.272 1.00 . A A . 21 TRP N 1 1 16 5189 1 1 4 TRP NE1 N 0.611 1.817 -5.817 1.00 . A A . 21 TRP NE1 1 1 16 5190 1 1 4 TRP O O 2.612 5.585 -5.862 1.00 . A A . 21 TRP O 1 1 16 5191 1 1 5 ASP C C 1.933 8.464 -8.833 1.00 . A A . 22 ASP C 1 1 16 5192 1 1 5 ASP CA C 2.384 7.769 -7.552 1.00 . A A . 22 ASP CA 1 1 16 5193 1 1 5 ASP CB C 3.292 8.699 -6.744 1.00 . A A . 22 ASP CB 1 1 16 5194 1 1 5 ASP CG C 4.763 8.415 -6.975 1.00 . A A . 22 ASP CG 1 1 16 5195 1 1 5 ASP H H 3.511 6.415 -8.726 1.00 . A A . 22 ASP H 1 1 16 5196 1 1 5 ASP HA H 1.513 7.530 -6.961 1.00 . A A . 22 ASP HA 1 1 16 5197 1 1 5 ASP HB2 H 3.093 9.722 -7.029 1.00 . A A . 22 ASP HB2 1 1 16 5198 1 1 5 ASP HB3 H 3.080 8.574 -5.693 1.00 . A A . 22 ASP HB3 1 1 16 5199 1 1 5 ASP N N 3.077 6.522 -7.854 1.00 . A A . 22 ASP N 1 1 16 5200 1 1 5 ASP O O 2.637 8.445 -9.843 1.00 . A A . 22 ASP O 1 1 16 5201 1 1 5 ASP OD1 O 5.253 8.695 -8.089 1.00 . A A . 22 ASP OD1 1 1 16 5202 1 1 5 ASP OD2 O 5.424 7.912 -6.043 1.00 . A A . 22 ASP OD2 1 1 16 5203 1 1 6 LYS C C 0.323 8.924 -11.199 1.00 . A A . 23 LYS C 1 1 16 5204 1 1 6 LYS CA C 0.209 9.778 -9.940 1.00 . A A . 23 LYS CA 1 1 16 5205 1 1 6 LYS CB C 0.938 11.108 -10.146 1.00 . A A . 23 LYS CB 1 1 16 5206 1 1 6 LYS CD C 0.078 13.154 -8.969 1.00 . A A . 23 LYS CD 1 1 16 5207 1 1 6 LYS CE C 0.799 14.396 -9.470 1.00 . A A . 23 LYS CE 1 1 16 5208 1 1 6 LYS CG C 1.015 11.960 -8.891 1.00 . A A . 23 LYS CG 1 1 16 5209 1 1 6 LYS H H 0.240 9.057 -7.950 1.00 . A A . 23 LYS H 1 1 16 5210 1 1 6 LYS HA H -0.834 9.975 -9.746 1.00 . A A . 23 LYS HA 1 1 16 5211 1 1 6 LYS HB2 H 1.944 10.906 -10.481 1.00 . A A . 23 LYS HB2 1 1 16 5212 1 1 6 LYS HB3 H 0.421 11.674 -10.908 1.00 . A A . 23 LYS HB3 1 1 16 5213 1 1 6 LYS HD2 H -0.730 12.923 -9.646 1.00 . A A . 23 LYS HD2 1 1 16 5214 1 1 6 LYS HD3 H -0.321 13.353 -7.984 1.00 . A A . 23 LYS HD3 1 1 16 5215 1 1 6 LYS HE2 H 0.347 15.266 -9.018 1.00 . A A . 23 LYS HE2 1 1 16 5216 1 1 6 LYS HE3 H 1.837 14.337 -9.176 1.00 . A A . 23 LYS HE3 1 1 16 5217 1 1 6 LYS HG2 H 0.740 11.356 -8.039 1.00 . A A . 23 LYS HG2 1 1 16 5218 1 1 6 LYS HG3 H 2.028 12.316 -8.770 1.00 . A A . 23 LYS HG3 1 1 16 5219 1 1 6 LYS HZ1 H 0.071 13.808 -11.337 1.00 . A A . 23 LYS HZ1 1 1 16 5220 1 1 6 LYS HZ2 H 1.661 14.384 -11.372 1.00 . A A . 23 LYS HZ2 1 1 16 5221 1 1 6 LYS HZ3 H 0.372 15.468 -11.211 1.00 . A A . 23 LYS HZ3 1 1 16 5222 1 1 6 LYS N N 0.755 9.077 -8.784 1.00 . A A . 23 LYS N 1 1 16 5223 1 1 6 LYS NZ N 0.720 14.523 -10.951 1.00 . A A . 23 LYS NZ 1 1 16 5224 1 1 6 LYS O O 0.915 9.343 -12.193 1.00 . A A . 23 LYS O 1 1 16 5225 1 1 7 SER C C -0.949 5.516 -11.965 1.00 . A A . 24 SER C 1 1 16 5226 1 1 7 SER CA C -0.211 6.812 -12.285 1.00 . A A . 24 SER CA 1 1 16 5227 1 1 7 SER CB C 1.237 6.506 -12.670 1.00 . A A . 24 SER CB 1 1 16 5228 1 1 7 SER H H -0.708 7.449 -10.328 1.00 . A A . 24 SER H 1 1 16 5229 1 1 7 SER HA H -0.701 7.296 -13.117 1.00 . A A . 24 SER HA 1 1 16 5230 1 1 7 SER HB2 H 1.893 6.809 -11.868 1.00 . A A . 24 SER HB2 1 1 16 5231 1 1 7 SER HB3 H 1.344 5.444 -12.841 1.00 . A A . 24 SER HB3 1 1 16 5232 1 1 7 SER HG H 1.796 8.116 -13.637 1.00 . A A . 24 SER HG 1 1 16 5233 1 1 7 SER N N -0.250 7.726 -11.149 1.00 . A A . 24 SER N 1 1 16 5234 1 1 7 SER O O -1.550 4.897 -12.844 1.00 . A A . 24 SER O 1 1 16 5235 1 1 7 SER OG O 1.609 7.198 -13.849 1.00 . A A . 24 SER OG 1 1 16 5236 1 1 8 HIS C C -3.081 4.036 -10.343 1.00 . A A . 25 HIS C 1 1 16 5237 1 1 8 HIS CA C -1.564 3.888 -10.263 1.00 . A A . 25 HIS CA 1 1 16 5238 1 1 8 HIS CB C -1.149 3.541 -8.833 1.00 . A A . 25 HIS CB 1 1 16 5239 1 1 8 HIS CD2 C -2.108 1.792 -7.174 1.00 . A A . 25 HIS CD2 1 1 16 5240 1 1 8 HIS CE1 C -2.150 0.063 -8.521 1.00 . A A . 25 HIS CE1 1 1 16 5241 1 1 8 HIS CG C -1.637 2.201 -8.376 1.00 . A A . 25 HIS CG 1 1 16 5242 1 1 8 HIS H H -0.406 5.647 -10.046 1.00 . A A . 25 HIS H 1 1 16 5243 1 1 8 HIS HA H -1.258 3.090 -10.921 1.00 . A A . 25 HIS HA 1 1 16 5244 1 1 8 HIS HB2 H -0.071 3.540 -8.768 1.00 . A A . 25 HIS HB2 1 1 16 5245 1 1 8 HIS HB3 H -1.544 4.287 -8.158 1.00 . A A . 25 HIS HB3 1 1 16 5246 1 1 8 HIS HD1 H -1.398 1.068 -10.136 1.00 . A A . 25 HIS HD1 1 1 16 5247 1 1 8 HIS HD2 H -2.219 2.401 -6.288 1.00 . A A . 25 HIS HD2 1 1 16 5248 1 1 8 HIS HE1 H -2.293 -0.935 -8.908 1.00 . A A . 25 HIS HE1 1 1 16 5249 1 1 8 HIS N N -0.900 5.111 -10.700 1.00 . A A . 25 HIS N 1 1 16 5250 1 1 8 HIS ND1 N -1.676 1.094 -9.197 1.00 . A A . 25 HIS ND1 1 1 16 5251 1 1 8 HIS NE2 N -2.420 0.460 -7.291 1.00 . A A . 25 HIS NE2 1 1 16 5252 1 1 8 HIS O O -3.613 5.138 -10.222 1.00 . A A . 25 HIS O 1 1 16 5253 1 1 9 GLU C C -5.858 3.265 -9.301 1.00 . A A . 26 GLU C 1 1 16 5254 1 1 9 GLU CA C -5.224 2.924 -10.646 1.00 . A A . 26 GLU CA 1 1 16 5255 1 1 9 GLU CB C -5.731 1.564 -11.130 1.00 . A A . 26 GLU CB 1 1 16 5256 1 1 9 GLU CD C -6.231 -0.845 -10.555 1.00 . A A . 26 GLU CD 1 1 16 5257 1 1 9 GLU CG C -5.761 0.503 -10.043 1.00 . A A . 26 GLU CG 1 1 16 5258 1 1 9 GLU H H -3.288 2.068 -10.636 1.00 . A A . 26 GLU H 1 1 16 5259 1 1 9 GLU HA H -5.505 3.679 -11.364 1.00 . A A . 26 GLU HA 1 1 16 5260 1 1 9 GLU HB2 H -6.733 1.683 -11.516 1.00 . A A . 26 GLU HB2 1 1 16 5261 1 1 9 GLU HB3 H -5.088 1.216 -11.925 1.00 . A A . 26 GLU HB3 1 1 16 5262 1 1 9 GLU HG2 H -4.766 0.390 -9.640 1.00 . A A . 26 GLU HG2 1 1 16 5263 1 1 9 GLU HG3 H -6.430 0.827 -9.260 1.00 . A A . 26 GLU HG3 1 1 16 5264 1 1 9 GLU N N -3.769 2.917 -10.548 1.00 . A A . 26 GLU N 1 1 16 5265 1 1 9 GLU O O -6.941 3.849 -9.242 1.00 . A A . 26 GLU O 1 1 16 5266 1 1 9 GLU OE1 O -6.811 -0.889 -11.660 1.00 . A A . 26 GLU OE1 1 1 16 5267 1 1 9 GLU OE2 O -6.019 -1.855 -9.852 1.00 . A A . 26 GLU OE2 1 1 16 5268 1 1 10 LYS C C -5.019 4.415 -6.295 1.00 . A A . 27 LYS C 1 1 16 5269 1 1 10 LYS CA C -5.671 3.164 -6.876 1.00 . A A . 27 LYS CA 1 1 16 5270 1 1 10 LYS CB C -5.400 1.965 -5.964 1.00 . A A . 27 LYS CB 1 1 16 5271 1 1 10 LYS CD C -6.119 -0.342 -5.280 1.00 . A A . 27 LYS CD 1 1 16 5272 1 1 10 LYS CE C -4.870 -1.207 -5.354 1.00 . A A . 27 LYS CE 1 1 16 5273 1 1 10 LYS CG C -6.137 0.705 -6.381 1.00 . A A . 27 LYS CG 1 1 16 5274 1 1 10 LYS H H -4.319 2.435 -8.332 1.00 . A A . 27 LYS H 1 1 16 5275 1 1 10 LYS HA H -6.736 3.324 -6.939 1.00 . A A . 27 LYS HA 1 1 16 5276 1 1 10 LYS HB2 H -4.340 1.756 -5.969 1.00 . A A . 27 LYS HB2 1 1 16 5277 1 1 10 LYS HB3 H -5.703 2.218 -4.958 1.00 . A A . 27 LYS HB3 1 1 16 5278 1 1 10 LYS HD2 H -6.143 0.155 -4.321 1.00 . A A . 27 LYS HD2 1 1 16 5279 1 1 10 LYS HD3 H -6.991 -0.974 -5.381 1.00 . A A . 27 LYS HD3 1 1 16 5280 1 1 10 LYS HE2 H -4.982 -1.910 -6.165 1.00 . A A . 27 LYS HE2 1 1 16 5281 1 1 10 LYS HE3 H -4.019 -0.571 -5.544 1.00 . A A . 27 LYS HE3 1 1 16 5282 1 1 10 LYS HG2 H -7.163 0.956 -6.606 1.00 . A A . 27 LYS HG2 1 1 16 5283 1 1 10 LYS HG3 H -5.663 0.296 -7.262 1.00 . A A . 27 LYS HG3 1 1 16 5284 1 1 10 LYS HZ1 H -3.621 -2.050 -3.908 1.00 . A A . 27 LYS HZ1 1 1 16 5285 1 1 10 LYS HZ2 H -5.055 -2.910 -4.159 1.00 . A A . 27 LYS HZ2 1 1 16 5286 1 1 10 LYS HZ3 H -5.081 -1.459 -3.290 1.00 . A A . 27 LYS HZ3 1 1 16 5287 1 1 10 LYS N N -5.177 2.897 -8.221 1.00 . A A . 27 LYS N 1 1 16 5288 1 1 10 LYS NZ N -4.641 -1.959 -4.089 1.00 . A A . 27 LYS NZ 1 1 16 5289 1 1 10 LYS O O -5.352 4.844 -5.190 1.00 . A A . 27 LYS O 1 1 16 5290 1 1 11 TYR C C -4.382 7.316 -6.285 1.00 . A A . 28 TYR C 1 1 16 5291 1 1 11 TYR CA C -3.394 6.199 -6.607 1.00 . A A . 28 TYR CA 1 1 16 5292 1 1 11 TYR CB C -2.412 6.667 -7.682 1.00 . A A . 28 TYR CB 1 1 16 5293 1 1 11 TYR CD1 C -2.321 9.181 -7.462 1.00 . A A . 28 TYR CD1 1 1 16 5294 1 1 11 TYR CD2 C -3.332 8.258 -9.413 1.00 . A A . 28 TYR CD2 1 1 16 5295 1 1 11 TYR CE1 C -2.577 10.456 -7.927 1.00 . A A . 28 TYR CE1 1 1 16 5296 1 1 11 TYR CE2 C -3.591 9.530 -9.886 1.00 . A A . 28 TYR CE2 1 1 16 5297 1 1 11 TYR CG C -2.694 8.061 -8.195 1.00 . A A . 28 TYR CG 1 1 16 5298 1 1 11 TYR CZ C -3.212 10.625 -9.139 1.00 . A A . 28 TYR CZ 1 1 16 5299 1 1 11 TYR H H -3.871 4.609 -7.919 1.00 . A A . 28 TYR H 1 1 16 5300 1 1 11 TYR HA H -2.842 5.953 -5.711 1.00 . A A . 28 TYR HA 1 1 16 5301 1 1 11 TYR HB2 H -1.413 6.660 -7.274 1.00 . A A . 28 TYR HB2 1 1 16 5302 1 1 11 TYR HB3 H -2.458 5.988 -8.521 1.00 . A A . 28 TYR HB3 1 1 16 5303 1 1 11 TYR HD1 H -1.823 9.044 -6.513 1.00 . A A . 28 TYR HD1 1 1 16 5304 1 1 11 TYR HD2 H -3.628 7.397 -9.996 1.00 . A A . 28 TYR HD2 1 1 16 5305 1 1 11 TYR HE1 H -2.280 11.314 -7.342 1.00 . A A . 28 TYR HE1 1 1 16 5306 1 1 11 TYR HE2 H -4.089 9.663 -10.836 1.00 . A A . 28 TYR HE2 1 1 16 5307 1 1 11 TYR HH H -4.402 12.091 -9.501 1.00 . A A . 28 TYR HH 1 1 16 5308 1 1 11 TYR N N -4.092 4.997 -7.047 1.00 . A A . 28 TYR N 1 1 16 5309 1 1 11 TYR O O -5.418 7.450 -6.936 1.00 . A A . 28 TYR O 1 1 16 5310 1 1 11 TYR OH O -3.468 11.894 -9.606 1.00 . A A . 28 TYR OH 1 1 16 5311 1 1 12 ASP C C -4.128 10.533 -4.841 1.00 . A A . 29 ASP C 1 1 16 5312 1 1 12 ASP CA C -4.909 9.223 -4.867 1.00 . A A . 29 ASP CA 1 1 16 5313 1 1 12 ASP CB C -5.513 8.946 -3.489 1.00 . A A . 29 ASP CB 1 1 16 5314 1 1 12 ASP CG C -6.742 8.062 -3.562 1.00 . A A . 29 ASP CG 1 1 16 5315 1 1 12 ASP H H -3.213 7.957 -4.795 1.00 . A A . 29 ASP H 1 1 16 5316 1 1 12 ASP HA H -5.708 9.309 -5.588 1.00 . A A . 29 ASP HA 1 1 16 5317 1 1 12 ASP HB2 H -4.775 8.455 -2.872 1.00 . A A . 29 ASP HB2 1 1 16 5318 1 1 12 ASP HB3 H -5.792 9.884 -3.031 1.00 . A A . 29 ASP HB3 1 1 16 5319 1 1 12 ASP N N -4.053 8.115 -5.276 1.00 . A A . 29 ASP N 1 1 16 5320 1 1 12 ASP O O -3.036 10.604 -4.276 1.00 . A A . 29 ASP O 1 1 16 5321 1 1 12 ASP OD1 O -7.743 8.486 -4.176 1.00 . A A . 29 ASP OD1 1 1 16 5322 1 1 12 ASP OD2 O -6.702 6.945 -3.005 1.00 . A A . 29 ASP OD2 1 1 16 5323 1 1 13 TRP C C -3.695 13.357 -4.101 1.00 . A A . 30 TRP C 1 1 16 5324 1 1 13 TRP CA C -4.050 12.873 -5.503 1.00 . A A . 30 TRP CA 1 1 16 5325 1 1 13 TRP CB C -4.963 13.889 -6.191 1.00 . A A . 30 TRP CB 1 1 16 5326 1 1 13 TRP CD1 C -4.290 15.065 -8.367 1.00 . A A . 30 TRP CD1 1 1 16 5327 1 1 13 TRP CD2 C -3.283 15.871 -6.535 1.00 . A A . 30 TRP CD2 1 1 16 5328 1 1 13 TRP CE2 C -2.831 16.598 -7.654 1.00 . A A . 30 TRP CE2 1 1 16 5329 1 1 13 TRP CE3 C -2.788 16.201 -5.271 1.00 . A A . 30 TRP CE3 1 1 16 5330 1 1 13 TRP CG C -4.217 14.896 -7.014 1.00 . A A . 30 TRP CG 1 1 16 5331 1 1 13 TRP CH2 C -1.437 17.935 -6.294 1.00 . A A . 30 TRP CH2 1 1 16 5332 1 1 13 TRP CZ2 C -1.906 17.633 -7.543 1.00 . A A . 30 TRP CZ2 1 1 16 5333 1 1 13 TRP CZ3 C -1.870 17.229 -5.164 1.00 . A A . 30 TRP CZ3 1 1 16 5334 1 1 13 TRP H H -5.566 11.446 -5.887 1.00 . A A . 30 TRP H 1 1 16 5335 1 1 13 TRP HA H -3.140 12.772 -6.077 1.00 . A A . 30 TRP HA 1 1 16 5336 1 1 13 TRP HB2 H -5.646 13.366 -6.844 1.00 . A A . 30 TRP HB2 1 1 16 5337 1 1 13 TRP HB3 H -5.526 14.422 -5.440 1.00 . A A . 30 TRP HB3 1 1 16 5338 1 1 13 TRP HD1 H -4.913 14.474 -9.020 1.00 . A A . 30 TRP HD1 1 1 16 5339 1 1 13 TRP HE1 H -3.337 16.399 -9.680 1.00 . A A . 30 TRP HE1 1 1 16 5340 1 1 13 TRP HE3 H -3.109 15.669 -4.388 1.00 . A A . 30 TRP HE3 1 1 16 5341 1 1 13 TRP HH2 H -0.719 18.730 -6.163 1.00 . A A . 30 TRP HH2 1 1 16 5342 1 1 13 TRP HZ2 H -1.563 18.187 -8.405 1.00 . A A . 30 TRP HZ2 1 1 16 5343 1 1 13 TRP HZ3 H -1.475 17.498 -4.195 1.00 . A A . 30 TRP HZ3 1 1 16 5344 1 1 13 TRP N N -4.694 11.565 -5.455 1.00 . A A . 30 TRP N 1 1 16 5345 1 1 13 TRP NE1 N -3.459 16.087 -8.758 1.00 . A A . 30 TRP NE1 1 1 16 5346 1 1 13 TRP O O -2.521 13.441 -3.743 1.00 . A A . 30 TRP O 1 1 16 5347 1 1 14 GLU C C -4.064 13.011 -1.038 1.00 . A A . 31 GLU C 1 1 16 5348 1 1 14 GLU CA C -4.512 14.149 -1.950 1.00 . A A . 31 GLU CA 1 1 16 5349 1 1 14 GLU CB C -5.797 14.778 -1.406 1.00 . A A . 31 GLU CB 1 1 16 5350 1 1 14 GLU CD C -7.251 16.784 -1.898 1.00 . A A . 31 GLU CD 1 1 16 5351 1 1 14 GLU CG C -5.855 16.287 -1.575 1.00 . A A . 31 GLU CG 1 1 16 5352 1 1 14 GLU H H -5.632 13.585 -3.656 1.00 . A A . 31 GLU H 1 1 16 5353 1 1 14 GLU HA H -3.738 14.901 -1.975 1.00 . A A . 31 GLU HA 1 1 16 5354 1 1 14 GLU HB2 H -6.641 14.345 -1.922 1.00 . A A . 31 GLU HB2 1 1 16 5355 1 1 14 GLU HB3 H -5.875 14.551 -0.353 1.00 . A A . 31 GLU HB3 1 1 16 5356 1 1 14 GLU HG2 H -5.528 16.752 -0.657 1.00 . A A . 31 GLU HG2 1 1 16 5357 1 1 14 GLU HG3 H -5.192 16.572 -2.379 1.00 . A A . 31 GLU HG3 1 1 16 5358 1 1 14 GLU N N -4.718 13.673 -3.313 1.00 . A A . 31 GLU N 1 1 16 5359 1 1 14 GLU O O -3.056 13.121 -0.338 1.00 . A A . 31 GLU O 1 1 16 5360 1 1 14 GLU OE1 O -8.145 16.643 -1.038 1.00 . A A . 31 GLU OE1 1 1 16 5361 1 1 14 GLU OE2 O -7.448 17.313 -3.012 1.00 . A A . 31 GLU OE2 1 1 16 5362 1 1 15 LEU C C -3.070 10.291 -0.471 1.00 . A A . 32 LEU C 1 1 16 5363 1 1 15 LEU CA C -4.501 10.759 -0.225 1.00 . A A . 32 LEU CA 1 1 16 5364 1 1 15 LEU CB C -5.479 9.619 -0.513 1.00 . A A . 32 LEU CB 1 1 16 5365 1 1 15 LEU CD1 C -6.808 10.105 1.556 1.00 . A A . 32 LEU CD1 1 1 16 5366 1 1 15 LEU CD2 C -7.234 8.006 0.264 1.00 . A A . 32 LEU CD2 1 1 16 5367 1 1 15 LEU CG C -6.181 9.013 0.703 1.00 . A A . 32 LEU CG 1 1 16 5368 1 1 15 LEU H H -5.609 11.890 -1.629 1.00 . A A . 32 LEU H 1 1 16 5369 1 1 15 LEU HA H -4.597 11.053 0.810 1.00 . A A . 32 LEU HA 1 1 16 5370 1 1 15 LEU HB2 H -6.240 9.996 -1.179 1.00 . A A . 32 LEU HB2 1 1 16 5371 1 1 15 LEU HB3 H -4.930 8.830 -1.007 1.00 . A A . 32 LEU HB3 1 1 16 5372 1 1 15 LEU HD11 H -7.050 10.953 0.935 1.00 . A A . 32 LEU HD11 1 1 16 5373 1 1 15 LEU HD12 H -6.110 10.408 2.323 1.00 . A A . 32 LEU HD12 1 1 16 5374 1 1 15 LEU HD13 H -7.708 9.728 2.019 1.00 . A A . 32 LEU HD13 1 1 16 5375 1 1 15 LEU HD21 H -7.379 7.275 1.046 1.00 . A A . 32 LEU HD21 1 1 16 5376 1 1 15 LEU HD22 H -6.903 7.509 -0.636 1.00 . A A . 32 LEU HD22 1 1 16 5377 1 1 15 LEU HD23 H -8.164 8.519 0.072 1.00 . A A . 32 LEU HD23 1 1 16 5378 1 1 15 LEU HG H -5.452 8.494 1.310 1.00 . A A . 32 LEU HG 1 1 16 5379 1 1 15 LEU N N -4.819 11.919 -1.051 1.00 . A A . 32 LEU N 1 1 16 5380 1 1 15 LEU O O -2.497 9.563 0.339 1.00 . A A . 32 LEU O 1 1 16 5381 1 1 16 TRP C C -0.222 10.398 -0.724 1.00 . A A . 33 TRP C 1 1 16 5382 1 1 16 TRP CA C -1.134 10.341 -1.945 1.00 . A A . 33 TRP CA 1 1 16 5383 1 1 16 TRP CB C -0.597 11.263 -3.041 1.00 . A A . 33 TRP CB 1 1 16 5384 1 1 16 TRP CD1 C 1.541 10.420 -4.175 1.00 . A A . 33 TRP CD1 1 1 16 5385 1 1 16 TRP CD2 C 1.897 11.813 -2.457 1.00 . A A . 33 TRP CD2 1 1 16 5386 1 1 16 TRP CE2 C 3.143 11.426 -2.988 1.00 . A A . 33 TRP CE2 1 1 16 5387 1 1 16 TRP CE3 C 1.871 12.689 -1.369 1.00 . A A . 33 TRP CE3 1 1 16 5388 1 1 16 TRP CG C 0.886 11.158 -3.231 1.00 . A A . 33 TRP CG 1 1 16 5389 1 1 16 TRP CH2 C 4.294 12.742 -1.400 1.00 . A A . 33 TRP CH2 1 1 16 5390 1 1 16 TRP CZ2 C 4.349 11.885 -2.465 1.00 . A A . 33 TRP CZ2 1 1 16 5391 1 1 16 TRP CZ3 C 3.069 13.144 -0.851 1.00 . A A . 33 TRP CZ3 1 1 16 5392 1 1 16 TRP H H -3.008 11.294 -2.199 1.00 . A A . 33 TRP H 1 1 16 5393 1 1 16 TRP HA H -1.155 9.327 -2.317 1.00 . A A . 33 TRP HA 1 1 16 5394 1 1 16 TRP HB2 H -1.072 11.012 -3.978 1.00 . A A . 33 TRP HB2 1 1 16 5395 1 1 16 TRP HB3 H -0.831 12.286 -2.786 1.00 . A A . 33 TRP HB3 1 1 16 5396 1 1 16 TRP HD1 H 1.051 9.807 -4.915 1.00 . A A . 33 TRP HD1 1 1 16 5397 1 1 16 TRP HE1 H 3.581 10.149 -4.593 1.00 . A A . 33 TRP HE1 1 1 16 5398 1 1 16 TRP HE3 H 0.937 13.010 -0.932 1.00 . A A . 33 TRP HE3 1 1 16 5399 1 1 16 TRP HH2 H 5.205 13.122 -0.963 1.00 . A A . 33 TRP HH2 1 1 16 5400 1 1 16 TRP HZ2 H 5.302 11.586 -2.877 1.00 . A A . 33 TRP HZ2 1 1 16 5401 1 1 16 TRP HZ3 H 3.069 13.821 -0.010 1.00 . A A . 33 TRP HZ3 1 1 16 5402 1 1 16 TRP N N -2.499 10.715 -1.593 1.00 . A A . 33 TRP N 1 1 16 5403 1 1 16 TRP NE1 N 2.899 10.576 -4.034 1.00 . A A . 33 TRP NE1 1 1 16 5404 1 1 16 TRP O O 0.672 9.567 -0.567 1.00 . A A . 33 TRP O 1 1 16 5405 1 1 17 ASP C C 0.323 10.275 2.189 1.00 . A A . 34 ASP C 1 1 16 5406 1 1 17 ASP CA C 0.345 11.546 1.345 1.00 . A A . 34 ASP CA 1 1 16 5407 1 1 17 ASP CB C -0.171 12.728 2.168 1.00 . A A . 34 ASP CB 1 1 16 5408 1 1 17 ASP CG C 0.830 13.189 3.209 1.00 . A A . 34 ASP CG 1 1 16 5409 1 1 17 ASP H H -1.183 12.013 -0.043 1.00 . A A . 34 ASP H 1 1 16 5410 1 1 17 ASP HA H 1.363 11.746 1.045 1.00 . A A . 34 ASP HA 1 1 16 5411 1 1 17 ASP HB2 H -0.380 13.556 1.506 1.00 . A A . 34 ASP HB2 1 1 16 5412 1 1 17 ASP HB3 H -1.080 12.437 2.672 1.00 . A A . 34 ASP HB3 1 1 16 5413 1 1 17 ASP N N -0.455 11.382 0.137 1.00 . A A . 34 ASP N 1 1 16 5414 1 1 17 ASP O O 1.370 9.719 2.522 1.00 . A A . 34 ASP O 1 1 16 5415 1 1 17 ASP OD1 O 1.917 13.665 2.819 1.00 . A A . 34 ASP OD1 1 1 16 5416 1 1 17 ASP OD2 O 0.526 13.075 4.415 1.00 . A A . 34 ASP OD2 1 1 16 5417 1 1 18 LYS C C -0.895 7.364 2.476 1.00 . A A . 35 LYS C 1 1 16 5418 1 1 18 LYS CA C -1.038 8.615 3.337 1.00 . A A . 35 LYS CA 1 1 16 5419 1 1 18 LYS CB C -2.402 8.617 4.030 1.00 . A A . 35 LYS CB 1 1 16 5420 1 1 18 LYS CD C -4.522 7.378 3.501 1.00 . A A . 35 LYS CD 1 1 16 5421 1 1 18 LYS CE C -4.044 6.014 3.025 1.00 . A A . 35 LYS CE 1 1 16 5422 1 1 18 LYS CG C -3.572 8.482 3.070 1.00 . A A . 35 LYS CG 1 1 16 5423 1 1 18 LYS H H -1.675 10.307 2.237 1.00 . A A . 35 LYS H 1 1 16 5424 1 1 18 LYS HA H -0.262 8.611 4.088 1.00 . A A . 35 LYS HA 1 1 16 5425 1 1 18 LYS HB2 H -2.439 7.794 4.728 1.00 . A A . 35 LYS HB2 1 1 16 5426 1 1 18 LYS HB3 H -2.515 9.544 4.573 1.00 . A A . 35 LYS HB3 1 1 16 5427 1 1 18 LYS HD2 H -4.584 7.368 4.579 1.00 . A A . 35 LYS HD2 1 1 16 5428 1 1 18 LYS HD3 H -5.500 7.573 3.083 1.00 . A A . 35 LYS HD3 1 1 16 5429 1 1 18 LYS HE2 H -4.731 5.647 2.278 1.00 . A A . 35 LYS HE2 1 1 16 5430 1 1 18 LYS HE3 H -3.062 6.124 2.588 1.00 . A A . 35 LYS HE3 1 1 16 5431 1 1 18 LYS HG2 H -4.112 9.417 3.042 1.00 . A A . 35 LYS HG2 1 1 16 5432 1 1 18 LYS HG3 H -3.192 8.254 2.084 1.00 . A A . 35 LYS HG3 1 1 16 5433 1 1 18 LYS HZ1 H -4.920 4.662 4.354 1.00 . A A . 35 LYS HZ1 1 1 16 5434 1 1 18 LYS HZ2 H -3.589 5.487 4.994 1.00 . A A . 35 LYS HZ2 1 1 16 5435 1 1 18 LYS HZ3 H -3.353 4.237 3.878 1.00 . A A . 35 LYS HZ3 1 1 16 5436 1 1 18 LYS N N -0.877 9.820 2.532 1.00 . A A . 35 LYS N 1 1 16 5437 1 1 18 LYS NZ N -3.971 5.031 4.141 1.00 . A A . 35 LYS NZ 1 1 16 5438 1 1 18 LYS O O -0.770 6.254 2.994 1.00 . A A . 35 LYS O 1 1 16 5439 1 1 19 TRP C C 0.672 6.236 -0.181 1.00 . A A . 36 TRP C 1 1 16 5440 1 1 19 TRP CA C -0.783 6.436 0.230 1.00 . A A . 36 TRP CA 1 1 16 5441 1 1 19 TRP CB C -1.647 6.677 -1.009 1.00 . A A . 36 TRP CB 1 1 16 5442 1 1 19 TRP CD1 C -4.051 6.521 -0.134 1.00 . A A . 36 TRP CD1 1 1 16 5443 1 1 19 TRP CD2 C -3.496 4.916 -1.594 1.00 . A A . 36 TRP CD2 1 1 16 5444 1 1 19 TRP CE2 C -4.832 4.717 -1.193 1.00 . A A . 36 TRP CE2 1 1 16 5445 1 1 19 TRP CE3 C -2.930 4.027 -2.512 1.00 . A A . 36 TRP CE3 1 1 16 5446 1 1 19 TRP CG C -3.016 6.075 -0.905 1.00 . A A . 36 TRP CG 1 1 16 5447 1 1 19 TRP CH2 C -5.026 2.812 -2.576 1.00 . A A . 36 TRP CH2 1 1 16 5448 1 1 19 TRP CZ2 C -5.606 3.666 -1.678 1.00 . A A . 36 TRP CZ2 1 1 16 5449 1 1 19 TRP CZ3 C -3.699 2.985 -2.992 1.00 . A A . 36 TRP CZ3 1 1 16 5450 1 1 19 TRP H H -1.014 8.459 0.809 1.00 . A A . 36 TRP H 1 1 16 5451 1 1 19 TRP HA H -1.129 5.544 0.731 1.00 . A A . 36 TRP HA 1 1 16 5452 1 1 19 TRP HB2 H -1.761 7.740 -1.159 1.00 . A A . 36 TRP HB2 1 1 16 5453 1 1 19 TRP HB3 H -1.157 6.246 -1.870 1.00 . A A . 36 TRP HB3 1 1 16 5454 1 1 19 TRP HD1 H -4.000 7.385 0.511 1.00 . A A . 36 TRP HD1 1 1 16 5455 1 1 19 TRP HE1 H -6.012 5.822 0.144 1.00 . A A . 36 TRP HE1 1 1 16 5456 1 1 19 TRP HE3 H -1.909 4.144 -2.845 1.00 . A A . 36 TRP HE3 1 1 16 5457 1 1 19 TRP HH2 H -5.589 1.984 -2.977 1.00 . A A . 36 TRP HH2 1 1 16 5458 1 1 19 TRP HZ2 H -6.630 3.520 -1.368 1.00 . A A . 36 TRP HZ2 1 1 16 5459 1 1 19 TRP HZ3 H -3.278 2.288 -3.702 1.00 . A A . 36 TRP HZ3 1 1 16 5460 1 1 19 TRP N N -0.912 7.550 1.162 1.00 . A A . 36 TRP N 1 1 16 5461 1 1 19 TRP NE1 N -5.146 5.708 -0.302 1.00 . A A . 36 TRP NE1 1 1 16 5462 1 1 19 TRP O O 0.959 5.599 -1.195 1.00 . A A . 36 TRP O 1 1 16 5463 1 1 20 CYS C C 3.841 7.293 1.448 1.00 . A A . 37 CYS C 1 1 16 5464 1 1 20 CYS CA C 3.012 6.664 0.331 1.00 . A A . 37 CYS CA 1 1 16 5465 1 1 20 CYS CB C 3.347 7.331 -1.005 1.00 . A A . 37 CYS CB 1 1 16 5466 1 1 20 CYS H H 1.296 7.278 1.407 1.00 . A A . 37 CYS H 1 1 16 5467 1 1 20 CYS HA H 3.253 5.614 0.269 1.00 . A A . 37 CYS HA 1 1 16 5468 1 1 20 CYS HB2 H 2.757 6.872 -1.785 1.00 . A A . 37 CYS HB2 1 1 16 5469 1 1 20 CYS HB3 H 3.102 8.381 -0.945 1.00 . A A . 37 CYS HB3 1 1 16 5470 1 1 20 CYS N N 1.587 6.782 0.612 1.00 . A A . 37 CYS N 1 1 16 5471 1 1 20 CYS O O 3.671 6.962 2.621 1.00 . A A . 37 CYS O 1 1 16 5472 1 1 20 CYS SG S 5.099 7.195 -1.485 1.00 . A A . 37 CYS SG 1 1 17 5473 1 1 1 ASN C C 2.219 2.882 -2.873 1.00 . A A . 18 ASN C 1 1 17 5474 1 1 1 ASN CA C 1.253 1.716 -2.677 1.00 . A A . 18 ASN CA 1 1 17 5475 1 1 1 ASN CB C -0.174 2.244 -2.513 1.00 . A A . 18 ASN CB 1 1 17 5476 1 1 1 ASN CG C -1.169 1.137 -2.219 1.00 . A A . 18 ASN CG 1 1 17 5477 1 1 1 ASN H1 H 1.142 1.027 -0.679 1.00 . A A . 18 ASN H1 1 1 17 5478 1 1 1 ASN HA H 1.294 1.080 -3.549 1.00 . A A . 18 ASN HA 1 1 17 5479 1 1 1 ASN HB2 H -0.198 2.949 -1.695 1.00 . A A . 18 ASN HB2 1 1 17 5480 1 1 1 ASN HB3 H -0.474 2.742 -3.422 1.00 . A A . 18 ASN HB3 1 1 17 5481 1 1 1 ASN HD21 H -0.361 0.002 -3.639 1.00 . A A . 18 ASN HD21 1 1 17 5482 1 1 1 ASN HD22 H -1.695 -0.693 -2.788 1.00 . A A . 18 ASN HD22 1 1 17 5483 1 1 1 ASN N N 1.633 0.915 -1.520 1.00 . A A . 18 ASN N 1 1 17 5484 1 1 1 ASN ND2 N -1.064 0.038 -2.956 1.00 . A A . 18 ASN ND2 1 1 17 5485 1 1 1 ASN O O 1.999 3.749 -3.718 1.00 . A A . 18 ASN O 1 1 17 5486 1 1 1 ASN OD1 O -2.020 1.270 -1.341 1.00 . A A . 18 ASN OD1 1 1 17 5487 1 1 2 CYS C C 5.243 3.706 -3.336 1.00 . A A . 19 CYS C 1 1 17 5488 1 1 2 CYS CA C 4.289 3.952 -2.171 1.00 . A A . 19 CYS CA 1 1 17 5489 1 1 2 CYS CB C 5.077 4.043 -0.863 1.00 . A A . 19 CYS CB 1 1 17 5490 1 1 2 CYS H H 3.409 2.174 -1.430 1.00 . A A . 19 CYS H 1 1 17 5491 1 1 2 CYS HA H 3.772 4.885 -2.335 1.00 . A A . 19 CYS HA 1 1 17 5492 1 1 2 CYS HB2 H 4.390 3.978 -0.032 1.00 . A A . 19 CYS HB2 1 1 17 5493 1 1 2 CYS HB3 H 5.773 3.219 -0.812 1.00 . A A . 19 CYS HB3 1 1 17 5494 1 1 2 CYS N N 3.289 2.894 -2.086 1.00 . A A . 19 CYS N 1 1 17 5495 1 1 2 CYS O O 6.033 4.577 -3.700 1.00 . A A . 19 CYS O 1 1 17 5496 1 1 2 CYS SG S 6.028 5.586 -0.674 1.00 . A A . 19 CYS SG 1 1 17 5497 1 1 3 ASP C C 5.567 2.862 -6.316 1.00 . A A . 20 ASP C 1 1 17 5498 1 1 3 ASP CA C 6.017 2.153 -5.043 1.00 . A A . 20 ASP CA 1 1 17 5499 1 1 3 ASP CB C 6.003 0.638 -5.256 1.00 . A A . 20 ASP CB 1 1 17 5500 1 1 3 ASP CG C 6.843 0.213 -6.444 1.00 . A A . 20 ASP CG 1 1 17 5501 1 1 3 ASP H H 4.512 1.861 -3.582 1.00 . A A . 20 ASP H 1 1 17 5502 1 1 3 ASP HA H 7.024 2.465 -4.808 1.00 . A A . 20 ASP HA 1 1 17 5503 1 1 3 ASP HB2 H 6.392 0.153 -4.372 1.00 . A A . 20 ASP HB2 1 1 17 5504 1 1 3 ASP HB3 H 4.986 0.314 -5.422 1.00 . A A . 20 ASP HB3 1 1 17 5505 1 1 3 ASP N N 5.163 2.514 -3.917 1.00 . A A . 20 ASP N 1 1 17 5506 1 1 3 ASP O O 6.236 2.790 -7.347 1.00 . A A . 20 ASP O 1 1 17 5507 1 1 3 ASP OD1 O 7.955 0.758 -6.611 1.00 . A A . 20 ASP OD1 1 1 17 5508 1 1 3 ASP OD2 O 6.390 -0.665 -7.207 1.00 . A A . 20 ASP OD2 1 1 17 5509 1 1 4 TRP C C 3.142 5.518 -6.936 1.00 . A A . 21 TRP C 1 1 17 5510 1 1 4 TRP CA C 3.892 4.268 -7.383 1.00 . A A . 21 TRP CA 1 1 17 5511 1 1 4 TRP CB C 2.962 3.361 -8.191 1.00 . A A . 21 TRP CB 1 1 17 5512 1 1 4 TRP CD1 C 1.223 2.898 -6.366 1.00 . A A . 21 TRP CD1 1 1 17 5513 1 1 4 TRP CD2 C 2.013 1.060 -7.373 1.00 . A A . 21 TRP CD2 1 1 17 5514 1 1 4 TRP CE2 C 1.074 0.670 -6.399 1.00 . A A . 21 TRP CE2 1 1 17 5515 1 1 4 TRP CE3 C 2.642 0.072 -8.136 1.00 . A A . 21 TRP CE3 1 1 17 5516 1 1 4 TRP CG C 2.094 2.489 -7.336 1.00 . A A . 21 TRP CG 1 1 17 5517 1 1 4 TRP CH2 C 1.382 -1.611 -6.931 1.00 . A A . 21 TRP CH2 1 1 17 5518 1 1 4 TRP CZ2 C 0.751 -0.665 -6.169 1.00 . A A . 21 TRP CZ2 1 1 17 5519 1 1 4 TRP CZ3 C 2.321 -1.252 -7.906 1.00 . A A . 21 TRP CZ3 1 1 17 5520 1 1 4 TRP H H 3.944 3.567 -5.386 1.00 . A A . 21 TRP H 1 1 17 5521 1 1 4 TRP HA H 4.722 4.565 -8.007 1.00 . A A . 21 TRP HA 1 1 17 5522 1 1 4 TRP HB2 H 2.318 3.972 -8.806 1.00 . A A . 21 TRP HB2 1 1 17 5523 1 1 4 TRP HB3 H 3.558 2.721 -8.825 1.00 . A A . 21 TRP HB3 1 1 17 5524 1 1 4 TRP HD1 H 1.056 3.929 -6.095 1.00 . A A . 21 TRP HD1 1 1 17 5525 1 1 4 TRP HE1 H -0.060 1.843 -5.081 1.00 . A A . 21 TRP HE1 1 1 17 5526 1 1 4 TRP HE3 H 3.369 0.329 -8.893 1.00 . A A . 21 TRP HE3 1 1 17 5527 1 1 4 TRP HH2 H 1.162 -2.657 -6.785 1.00 . A A . 21 TRP HH2 1 1 17 5528 1 1 4 TRP HZ2 H 0.029 -0.958 -5.421 1.00 . A A . 21 TRP HZ2 1 1 17 5529 1 1 4 TRP HZ3 H 2.797 -2.029 -8.486 1.00 . A A . 21 TRP HZ3 1 1 17 5530 1 1 4 TRP N N 4.432 3.546 -6.236 1.00 . A A . 21 TRP N 1 1 17 5531 1 1 4 TRP NE1 N 0.607 1.809 -5.798 1.00 . A A . 21 TRP NE1 1 1 17 5532 1 1 4 TRP O O 2.620 5.574 -5.823 1.00 . A A . 21 TRP O 1 1 17 5533 1 1 5 ASP C C 1.960 8.468 -8.784 1.00 . A A . 22 ASP C 1 1 17 5534 1 1 5 ASP CA C 2.404 7.766 -7.505 1.00 . A A . 22 ASP CA 1 1 17 5535 1 1 5 ASP CB C 3.314 8.689 -6.692 1.00 . A A . 22 ASP CB 1 1 17 5536 1 1 5 ASP CG C 4.784 8.398 -6.918 1.00 . A A . 22 ASP CG 1 1 17 5537 1 1 5 ASP H H 3.528 6.412 -8.682 1.00 . A A . 22 ASP H 1 1 17 5538 1 1 5 ASP HA H 1.531 7.528 -6.917 1.00 . A A . 22 ASP HA 1 1 17 5539 1 1 5 ASP HB2 H 3.121 9.714 -6.974 1.00 . A A . 22 ASP HB2 1 1 17 5540 1 1 5 ASP HB3 H 3.097 8.562 -5.641 1.00 . A A . 22 ASP HB3 1 1 17 5541 1 1 5 ASP N N 3.092 6.517 -7.810 1.00 . A A . 22 ASP N 1 1 17 5542 1 1 5 ASP O O 2.666 8.451 -9.792 1.00 . A A . 22 ASP O 1 1 17 5543 1 1 5 ASP OD1 O 5.255 8.576 -8.060 1.00 . A A . 22 ASP OD1 1 1 17 5544 1 1 5 ASP OD2 O 5.465 7.991 -5.952 1.00 . A A . 22 ASP OD2 1 1 17 5545 1 1 6 LYS C C 0.355 8.942 -11.152 1.00 . A A . 23 LYS C 1 1 17 5546 1 1 6 LYS CA C 0.243 9.792 -9.891 1.00 . A A . 23 LYS CA 1 1 17 5547 1 1 6 LYS CB C 0.977 11.120 -10.090 1.00 . A A . 23 LYS CB 1 1 17 5548 1 1 6 LYS CD C 0.124 13.165 -8.909 1.00 . A A . 23 LYS CD 1 1 17 5549 1 1 6 LYS CE C 0.852 14.406 -9.402 1.00 . A A . 23 LYS CE 1 1 17 5550 1 1 6 LYS CG C 1.055 11.967 -8.832 1.00 . A A . 23 LYS CG 1 1 17 5551 1 1 6 LYS H H 0.266 9.062 -7.904 1.00 . A A . 23 LYS H 1 1 17 5552 1 1 6 LYS HA H -0.800 9.993 -9.698 1.00 . A A . 23 LYS HA 1 1 17 5553 1 1 6 LYS HB2 H 1.984 10.914 -10.423 1.00 . A A . 23 LYS HB2 1 1 17 5554 1 1 6 LYS HB3 H 0.465 11.690 -10.852 1.00 . A A . 23 LYS HB3 1 1 17 5555 1 1 6 LYS HD2 H -0.683 12.941 -9.590 1.00 . A A . 23 LYS HD2 1 1 17 5556 1 1 6 LYS HD3 H -0.278 13.362 -7.925 1.00 . A A . 23 LYS HD3 1 1 17 5557 1 1 6 LYS HE2 H 0.400 15.276 -8.951 1.00 . A A . 23 LYS HE2 1 1 17 5558 1 1 6 LYS HE3 H 1.888 14.343 -9.102 1.00 . A A . 23 LYS HE3 1 1 17 5559 1 1 6 LYS HG2 H 0.775 11.361 -7.983 1.00 . A A . 23 LYS HG2 1 1 17 5560 1 1 6 LYS HG3 H 2.069 12.318 -8.707 1.00 . A A . 23 LYS HG3 1 1 17 5561 1 1 6 LYS HZ1 H 0.106 13.850 -11.272 1.00 . A A . 23 LYS HZ1 1 1 17 5562 1 1 6 LYS HZ2 H 1.719 14.359 -11.302 1.00 . A A . 23 LYS HZ2 1 1 17 5563 1 1 6 LYS HZ3 H 0.476 15.496 -11.144 1.00 . A A . 23 LYS HZ3 1 1 17 5564 1 1 6 LYS N N 0.783 9.084 -8.737 1.00 . A A . 23 LYS N 1 1 17 5565 1 1 6 LYS NZ N 0.784 14.537 -10.884 1.00 . A A . 23 LYS NZ 1 1 17 5566 1 1 6 LYS O O 0.951 9.362 -12.144 1.00 . A A . 23 LYS O 1 1 17 5567 1 1 7 SER C C -0.929 5.542 -11.934 1.00 . A A . 24 SER C 1 1 17 5568 1 1 7 SER CA C -0.185 6.836 -12.247 1.00 . A A . 24 SER CA 1 1 17 5569 1 1 7 SER CB C 1.263 6.525 -12.631 1.00 . A A . 24 SER CB 1 1 17 5570 1 1 7 SER H H -0.683 7.468 -10.289 1.00 . A A . 24 SER H 1 1 17 5571 1 1 7 SER HA H -0.671 7.325 -13.078 1.00 . A A . 24 SER HA 1 1 17 5572 1 1 7 SER HB2 H 1.924 6.902 -11.865 1.00 . A A . 24 SER HB2 1 1 17 5573 1 1 7 SER HB3 H 1.387 5.455 -12.719 1.00 . A A . 24 SER HB3 1 1 17 5574 1 1 7 SER HG H 2.441 6.773 -14.176 1.00 . A A . 24 SER HG 1 1 17 5575 1 1 7 SER N N -0.222 7.746 -11.108 1.00 . A A . 24 SER N 1 1 17 5576 1 1 7 SER O O -1.531 4.929 -12.816 1.00 . A A . 24 SER O 1 1 17 5577 1 1 7 SER OG O 1.604 7.128 -13.867 1.00 . A A . 24 SER OG 1 1 17 5578 1 1 8 HIS C C -3.070 4.064 -10.321 1.00 . A A . 25 HIS C 1 1 17 5579 1 1 8 HIS CA C -1.554 3.910 -10.238 1.00 . A A . 25 HIS CA 1 1 17 5580 1 1 8 HIS CB C -1.143 3.556 -8.809 1.00 . A A . 25 HIS CB 1 1 17 5581 1 1 8 HIS CD2 C -2.111 1.805 -7.158 1.00 . A A . 25 HIS CD2 1 1 17 5582 1 1 8 HIS CE1 C -2.160 0.081 -8.512 1.00 . A A . 25 HIS CE1 1 1 17 5583 1 1 8 HIS CG C -1.638 2.216 -8.358 1.00 . A A . 25 HIS CG 1 1 17 5584 1 1 8 HIS H H -0.388 5.663 -10.013 1.00 . A A . 25 HIS H 1 1 17 5585 1 1 8 HIS HA H -1.249 3.113 -10.899 1.00 . A A . 25 HIS HA 1 1 17 5586 1 1 8 HIS HB2 H -0.065 3.551 -8.742 1.00 . A A . 25 HIS HB2 1 1 17 5587 1 1 8 HIS HB3 H -1.537 4.301 -8.132 1.00 . A A . 25 HIS HB3 1 1 17 5588 1 1 8 HIS HD1 H -1.401 1.090 -10.123 1.00 . A A . 25 HIS HD1 1 1 17 5589 1 1 8 HIS HD2 H -2.220 2.411 -6.270 1.00 . A A . 25 HIS HD2 1 1 17 5590 1 1 8 HIS HE1 H -2.306 -0.915 -8.903 1.00 . A A . 25 HIS HE1 1 1 17 5591 1 1 8 HIS N N -0.884 5.132 -10.670 1.00 . A A . 25 HIS N 1 1 17 5592 1 1 8 HIS ND1 N -1.680 1.113 -9.184 1.00 . A A . 25 HIS ND1 1 1 17 5593 1 1 8 HIS NE2 N -2.429 0.475 -7.280 1.00 . A A . 25 HIS NE2 1 1 17 5594 1 1 8 HIS O O -3.598 5.168 -10.196 1.00 . A A . 25 HIS O 1 1 17 5595 1 1 9 GLU C C -5.853 3.301 -9.289 1.00 . A A . 26 GLU C 1 1 17 5596 1 1 9 GLU CA C -5.217 2.962 -10.634 1.00 . A A . 26 GLU CA 1 1 17 5597 1 1 9 GLU CB C -5.728 1.606 -11.125 1.00 . A A . 26 GLU CB 1 1 17 5598 1 1 9 GLU CD C -6.245 -0.801 -10.560 1.00 . A A . 26 GLU CD 1 1 17 5599 1 1 9 GLU CG C -5.764 0.541 -10.042 1.00 . A A . 26 GLU CG 1 1 17 5600 1 1 9 GLU H H -3.284 2.099 -10.625 1.00 . A A . 26 GLU H 1 1 17 5601 1 1 9 GLU HA H -5.493 3.721 -11.351 1.00 . A A . 26 GLU HA 1 1 17 5602 1 1 9 GLU HB2 H -6.728 1.730 -11.513 1.00 . A A . 26 GLU HB2 1 1 17 5603 1 1 9 GLU HB3 H -5.084 1.259 -11.920 1.00 . A A . 26 GLU HB3 1 1 17 5604 1 1 9 GLU HG2 H -4.769 0.419 -9.641 1.00 . A A . 26 GLU HG2 1 1 17 5605 1 1 9 GLU HG3 H -6.430 0.867 -9.257 1.00 . A A . 26 GLU HG3 1 1 17 5606 1 1 9 GLU N N -3.762 2.949 -10.533 1.00 . A A . 26 GLU N 1 1 17 5607 1 1 9 GLU O O -6.934 3.887 -9.231 1.00 . A A . 26 GLU O 1 1 17 5608 1 1 9 GLU OE1 O -5.997 -1.104 -11.745 1.00 . A A . 26 GLU OE1 1 1 17 5609 1 1 9 GLU OE2 O -6.869 -1.549 -9.778 1.00 . A A . 26 GLU OE2 1 1 17 5610 1 1 10 LYS C C -5.016 4.437 -6.278 1.00 . A A . 27 LYS C 1 1 17 5611 1 1 10 LYS CA C -5.670 3.190 -6.864 1.00 . A A . 27 LYS CA 1 1 17 5612 1 1 10 LYS CB C -5.406 1.987 -5.956 1.00 . A A . 27 LYS CB 1 1 17 5613 1 1 10 LYS CD C -6.133 -0.321 -5.283 1.00 . A A . 27 LYS CD 1 1 17 5614 1 1 10 LYS CE C -4.887 -1.189 -5.360 1.00 . A A . 27 LYS CE 1 1 17 5615 1 1 10 LYS CG C -6.147 0.731 -6.380 1.00 . A A . 27 LYS CG 1 1 17 5616 1 1 10 LYS H H -4.318 2.462 -8.321 1.00 . A A . 27 LYS H 1 1 17 5617 1 1 10 LYS HA H -6.735 3.354 -6.930 1.00 . A A . 27 LYS HA 1 1 17 5618 1 1 10 LYS HB2 H -4.347 1.774 -5.960 1.00 . A A . 27 LYS HB2 1 1 17 5619 1 1 10 LYS HB3 H -5.710 2.238 -4.950 1.00 . A A . 27 LYS HB3 1 1 17 5620 1 1 10 LYS HD2 H -6.155 0.172 -4.323 1.00 . A A . 27 LYS HD2 1 1 17 5621 1 1 10 LYS HD3 H -7.006 -0.949 -5.388 1.00 . A A . 27 LYS HD3 1 1 17 5622 1 1 10 LYS HE2 H -5.001 -1.890 -6.173 1.00 . A A . 27 LYS HE2 1 1 17 5623 1 1 10 LYS HE3 H -4.033 -0.555 -5.549 1.00 . A A . 27 LYS HE3 1 1 17 5624 1 1 10 LYS HG2 H -7.171 0.987 -6.605 1.00 . A A . 27 LYS HG2 1 1 17 5625 1 1 10 LYS HG3 H -5.673 0.325 -7.262 1.00 . A A . 27 LYS HG3 1 1 17 5626 1 1 10 LYS HZ1 H -3.892 -2.636 -4.228 1.00 . A A . 27 LYS HZ1 1 1 17 5627 1 1 10 LYS HZ2 H -5.524 -2.454 -3.824 1.00 . A A . 27 LYS HZ2 1 1 17 5628 1 1 10 LYS HZ3 H -4.396 -1.292 -3.332 1.00 . A A . 27 LYS HZ3 1 1 17 5629 1 1 10 LYS N N -5.174 2.927 -8.210 1.00 . A A . 27 LYS N 1 1 17 5630 1 1 10 LYS NZ N -4.659 -1.945 -4.098 1.00 . A A . 27 LYS NZ 1 1 17 5631 1 1 10 LYS O O -5.350 4.864 -5.172 1.00 . A A . 27 LYS O 1 1 17 5632 1 1 11 TYR C C -4.367 7.335 -6.255 1.00 . A A . 28 TYR C 1 1 17 5633 1 1 11 TYR CA C -3.382 6.215 -6.579 1.00 . A A . 28 TYR CA 1 1 17 5634 1 1 11 TYR CB C -2.395 6.683 -7.650 1.00 . A A . 28 TYR CB 1 1 17 5635 1 1 11 TYR CD1 C -2.295 9.196 -7.421 1.00 . A A . 28 TYR CD1 1 1 17 5636 1 1 11 TYR CD2 C -3.306 8.284 -9.377 1.00 . A A . 28 TYR CD2 1 1 17 5637 1 1 11 TYR CE1 C -2.545 10.474 -7.881 1.00 . A A . 28 TYR CE1 1 1 17 5638 1 1 11 TYR CE2 C -3.559 9.559 -9.846 1.00 . A A . 28 TYR CE2 1 1 17 5639 1 1 11 TYR CG C -2.671 8.080 -8.158 1.00 . A A . 28 TYR CG 1 1 17 5640 1 1 11 TYR CZ C -3.178 10.650 -9.094 1.00 . A A . 28 TYR CZ 1 1 17 5641 1 1 11 TYR H H -3.861 4.631 -7.898 1.00 . A A . 28 TYR H 1 1 17 5642 1 1 11 TYR HA H -2.833 5.963 -5.683 1.00 . A A . 28 TYR HA 1 1 17 5643 1 1 11 TYR HB2 H -1.397 6.671 -7.240 1.00 . A A . 28 TYR HB2 1 1 17 5644 1 1 11 TYR HB3 H -2.442 6.008 -8.492 1.00 . A A . 28 TYR HB3 1 1 17 5645 1 1 11 TYR HD1 H -1.799 9.054 -6.471 1.00 . A A . 28 TYR HD1 1 1 17 5646 1 1 11 TYR HD2 H -3.604 7.427 -9.964 1.00 . A A . 28 TYR HD2 1 1 17 5647 1 1 11 TYR HE1 H -2.246 11.329 -7.293 1.00 . A A . 28 TYR HE1 1 1 17 5648 1 1 11 TYR HE2 H -4.055 9.697 -10.796 1.00 . A A . 28 TYR HE2 1 1 17 5649 1 1 11 TYR HH H -3.053 12.022 -10.436 1.00 . A A . 28 TYR HH 1 1 17 5650 1 1 11 TYR N N -4.084 5.018 -7.025 1.00 . A A . 28 TYR N 1 1 17 5651 1 1 11 TYR O O -5.401 7.475 -6.907 1.00 . A A . 28 TYR O 1 1 17 5652 1 1 11 TYR OH O -3.428 11.922 -9.557 1.00 . A A . 28 TYR OH 1 1 17 5653 1 1 12 ASP C C -4.104 10.545 -4.799 1.00 . A A . 29 ASP C 1 1 17 5654 1 1 12 ASP CA C -4.889 9.238 -4.831 1.00 . A A . 29 ASP CA 1 1 17 5655 1 1 12 ASP CB C -5.497 8.959 -3.456 1.00 . A A . 29 ASP CB 1 1 17 5656 1 1 12 ASP CG C -6.726 8.075 -3.534 1.00 . A A . 29 ASP CG 1 1 17 5657 1 1 12 ASP H H -3.198 7.966 -4.761 1.00 . A A . 29 ASP H 1 1 17 5658 1 1 12 ASP HA H -5.686 9.330 -5.554 1.00 . A A . 29 ASP HA 1 1 17 5659 1 1 12 ASP HB2 H -4.761 8.467 -2.837 1.00 . A A . 29 ASP HB2 1 1 17 5660 1 1 12 ASP HB3 H -5.777 9.896 -2.997 1.00 . A A . 29 ASP HB3 1 1 17 5661 1 1 12 ASP N N -4.036 8.129 -5.243 1.00 . A A . 29 ASP N 1 1 17 5662 1 1 12 ASP O O -3.013 10.611 -4.232 1.00 . A A . 29 ASP O 1 1 17 5663 1 1 12 ASP OD1 O -6.565 6.837 -3.571 1.00 . A A . 29 ASP OD1 1 1 17 5664 1 1 12 ASP OD2 O -7.849 8.621 -3.556 1.00 . A A . 29 ASP OD2 1 1 17 5665 1 1 13 TRP C C -3.663 13.365 -4.049 1.00 . A A . 30 TRP C 1 1 17 5666 1 1 13 TRP CA C -4.015 12.887 -5.453 1.00 . A A . 30 TRP CA 1 1 17 5667 1 1 13 TRP CB C -4.922 13.909 -6.141 1.00 . A A . 30 TRP CB 1 1 17 5668 1 1 13 TRP CD1 C -4.239 15.090 -8.311 1.00 . A A . 30 TRP CD1 1 1 17 5669 1 1 13 TRP CD2 C -3.234 15.885 -6.474 1.00 . A A . 30 TRP CD2 1 1 17 5670 1 1 13 TRP CE2 C -2.775 16.614 -7.589 1.00 . A A . 30 TRP CE2 1 1 17 5671 1 1 13 TRP CE3 C -2.741 16.210 -5.207 1.00 . A A . 30 TRP CE3 1 1 17 5672 1 1 13 TRP CG C -4.170 14.916 -6.958 1.00 . A A . 30 TRP CG 1 1 17 5673 1 1 13 TRP CH2 C -1.381 17.942 -6.221 1.00 . A A . 30 TRP CH2 1 1 17 5674 1 1 13 TRP CZ2 C -1.847 17.645 -7.473 1.00 . A A . 30 TRP CZ2 1 1 17 5675 1 1 13 TRP CZ3 C -1.819 17.234 -5.094 1.00 . A A . 30 TRP CZ3 1 1 17 5676 1 1 13 TRP H H -5.536 11.467 -5.845 1.00 . A A . 30 TRP H 1 1 17 5677 1 1 13 TRP HA H -3.104 12.785 -6.025 1.00 . A A . 30 TRP HA 1 1 17 5678 1 1 13 TRP HB2 H -5.605 13.391 -6.797 1.00 . A A . 30 TRP HB2 1 1 17 5679 1 1 13 TRP HB3 H -5.485 14.442 -5.389 1.00 . A A . 30 TRP HB3 1 1 17 5680 1 1 13 TRP HD1 H -4.862 14.503 -8.968 1.00 . A A . 30 TRP HD1 1 1 17 5681 1 1 13 TRP HE1 H -3.277 16.424 -9.617 1.00 . A A . 30 TRP HE1 1 1 17 5682 1 1 13 TRP HE3 H -3.067 15.676 -4.327 1.00 . A A . 30 TRP HE3 1 1 17 5683 1 1 13 TRP HH2 H -0.660 18.733 -6.085 1.00 . A A . 30 TRP HH2 1 1 17 5684 1 1 13 TRP HZ2 H -1.500 18.201 -8.331 1.00 . A A . 30 TRP HZ2 1 1 17 5685 1 1 13 TRP HZ3 H -1.426 17.499 -4.123 1.00 . A A . 30 TRP HZ3 1 1 17 5686 1 1 13 TRP N N -4.664 11.582 -5.411 1.00 . A A . 30 TRP N 1 1 17 5687 1 1 13 TRP NE1 N -3.402 16.109 -8.697 1.00 . A A . 30 TRP NE1 1 1 17 5688 1 1 13 TRP O O -2.489 13.444 -3.687 1.00 . A A . 30 TRP O 1 1 17 5689 1 1 14 GLU C C -4.041 13.012 -0.988 1.00 . A A . 31 GLU C 1 1 17 5690 1 1 14 GLU CA C -4.483 14.154 -1.897 1.00 . A A . 31 GLU CA 1 1 17 5691 1 1 14 GLU CB C -5.767 14.785 -1.355 1.00 . A A . 31 GLU CB 1 1 17 5692 1 1 14 GLU CD C -7.537 16.564 -1.646 1.00 . A A . 31 GLU CD 1 1 17 5693 1 1 14 GLU CG C -6.367 15.834 -2.276 1.00 . A A . 31 GLU CG 1 1 17 5694 1 1 14 GLU H H -5.600 13.599 -3.608 1.00 . A A . 31 GLU H 1 1 17 5695 1 1 14 GLU HA H -3.706 14.903 -1.918 1.00 . A A . 31 GLU HA 1 1 17 5696 1 1 14 GLU HB2 H -6.500 14.006 -1.204 1.00 . A A . 31 GLU HB2 1 1 17 5697 1 1 14 GLU HB3 H -5.551 15.252 -0.405 1.00 . A A . 31 GLU HB3 1 1 17 5698 1 1 14 GLU HG2 H -5.603 16.556 -2.524 1.00 . A A . 31 GLU HG2 1 1 17 5699 1 1 14 GLU HG3 H -6.708 15.349 -3.179 1.00 . A A . 31 GLU HG3 1 1 17 5700 1 1 14 GLU N N -4.687 13.683 -3.262 1.00 . A A . 31 GLU N 1 1 17 5701 1 1 14 GLU O O -3.035 13.117 -0.284 1.00 . A A . 31 GLU O 1 1 17 5702 1 1 14 GLU OE1 O -8.184 15.985 -0.749 1.00 . A A . 31 GLU OE1 1 1 17 5703 1 1 14 GLU OE2 O -7.805 17.714 -2.051 1.00 . A A . 31 GLU OE2 1 1 17 5704 1 1 15 LEU C C -3.057 10.286 -0.428 1.00 . A A . 32 LEU C 1 1 17 5705 1 1 15 LEU CA C -4.487 10.758 -0.183 1.00 . A A . 32 LEU CA 1 1 17 5706 1 1 15 LEU CB C -5.468 9.622 -0.477 1.00 . A A . 32 LEU CB 1 1 17 5707 1 1 15 LEU CD1 C -6.800 10.106 1.590 1.00 . A A . 32 LEU CD1 1 1 17 5708 1 1 15 LEU CD2 C -7.230 8.013 0.291 1.00 . A A . 32 LEU CD2 1 1 17 5709 1 1 15 LEU CG C -6.175 9.015 0.735 1.00 . A A . 32 LEU CG 1 1 17 5710 1 1 15 LEU H H -5.587 11.896 -1.587 1.00 . A A . 32 LEU H 1 1 17 5711 1 1 15 LEU HA H -4.585 11.049 0.852 1.00 . A A . 32 LEU HA 1 1 17 5712 1 1 15 LEU HB2 H -6.226 10.004 -1.144 1.00 . A A . 32 LEU HB2 1 1 17 5713 1 1 15 LEU HB3 H -4.921 8.832 -0.972 1.00 . A A . 32 LEU HB3 1 1 17 5714 1 1 15 LEU HD11 H -6.166 10.306 2.440 1.00 . A A . 32 LEU HD11 1 1 17 5715 1 1 15 LEU HD12 H -7.771 9.782 1.934 1.00 . A A . 32 LEU HD12 1 1 17 5716 1 1 15 LEU HD13 H -6.909 11.006 1.002 1.00 . A A . 32 LEU HD13 1 1 17 5717 1 1 15 LEU HD21 H -7.244 7.178 0.976 1.00 . A A . 32 LEU HD21 1 1 17 5718 1 1 15 LEU HD22 H -6.995 7.659 -0.703 1.00 . A A . 32 LEU HD22 1 1 17 5719 1 1 15 LEU HD23 H -8.199 8.489 0.283 1.00 . A A . 32 LEU HD23 1 1 17 5720 1 1 15 LEU HG H -5.449 8.491 1.342 1.00 . A A . 32 LEU HG 1 1 17 5721 1 1 15 LEU N N -4.799 11.921 -1.007 1.00 . A A . 32 LEU N 1 1 17 5722 1 1 15 LEU O O -2.488 9.553 0.381 1.00 . A A . 32 LEU O 1 1 17 5723 1 1 16 TRP C C -0.209 10.383 -0.673 1.00 . A A . 33 TRP C 1 1 17 5724 1 1 16 TRP CA C -1.117 10.334 -1.896 1.00 . A A . 33 TRP CA 1 1 17 5725 1 1 16 TRP CB C -0.575 11.258 -2.988 1.00 . A A . 33 TRP CB 1 1 17 5726 1 1 16 TRP CD1 C 1.564 10.412 -4.120 1.00 . A A . 33 TRP CD1 1 1 17 5727 1 1 16 TRP CD2 C 1.920 11.797 -2.396 1.00 . A A . 33 TRP CD2 1 1 17 5728 1 1 16 TRP CE2 C 3.166 11.408 -2.925 1.00 . A A . 33 TRP CE2 1 1 17 5729 1 1 16 TRP CE3 C 1.895 12.669 -1.304 1.00 . A A . 33 TRP CE3 1 1 17 5730 1 1 16 TRP CG C 0.908 11.149 -3.175 1.00 . A A . 33 TRP CG 1 1 17 5731 1 1 16 TRP CH2 C 4.318 12.714 -1.329 1.00 . A A . 33 TRP CH2 1 1 17 5732 1 1 16 TRP CZ2 C 4.373 11.860 -2.398 1.00 . A A . 33 TRP CZ2 1 1 17 5733 1 1 16 TRP CZ3 C 3.093 13.117 -0.782 1.00 . A A . 33 TRP CZ3 1 1 17 5734 1 1 16 TRP H H -2.987 11.295 -2.152 1.00 . A A . 33 TRP H 1 1 17 5735 1 1 16 TRP HA H -1.141 9.322 -2.273 1.00 . A A . 33 TRP HA 1 1 17 5736 1 1 16 TRP HB2 H -1.048 11.013 -3.927 1.00 . A A . 33 TRP HB2 1 1 17 5737 1 1 16 TRP HB3 H -0.805 12.282 -2.730 1.00 . A A . 33 TRP HB3 1 1 17 5738 1 1 16 TRP HD1 H 1.073 9.803 -4.863 1.00 . A A . 33 TRP HD1 1 1 17 5739 1 1 16 TRP HE1 H 3.604 10.135 -4.534 1.00 . A A . 33 TRP HE1 1 1 17 5740 1 1 16 TRP HE3 H 0.961 12.992 -0.869 1.00 . A A . 33 TRP HE3 1 1 17 5741 1 1 16 TRP HH2 H 5.229 13.089 -0.889 1.00 . A A . 33 TRP HH2 1 1 17 5742 1 1 16 TRP HZ2 H 5.325 11.559 -2.809 1.00 . A A . 33 TRP HZ2 1 1 17 5743 1 1 16 TRP HZ3 H 3.093 13.792 0.062 1.00 . A A . 33 TRP HZ3 1 1 17 5744 1 1 16 TRP N N -2.482 10.712 -1.547 1.00 . A A . 33 TRP N 1 1 17 5745 1 1 16 TRP NE1 N 2.922 10.562 -3.975 1.00 . A A . 33 TRP NE1 1 1 17 5746 1 1 16 TRP O O 0.683 9.549 -0.517 1.00 . A A . 33 TRP O 1 1 17 5747 1 1 17 ASP C C 0.330 10.247 2.240 1.00 . A A . 34 ASP C 1 1 17 5748 1 1 17 ASP CA C 0.358 11.522 1.402 1.00 . A A . 34 ASP CA 1 1 17 5749 1 1 17 ASP CB C -0.156 12.702 2.228 1.00 . A A . 34 ASP CB 1 1 17 5750 1 1 17 ASP CG C 0.138 14.038 1.575 1.00 . A A . 34 ASP CG 1 1 17 5751 1 1 17 ASP H H -1.165 12.000 0.011 1.00 . A A . 34 ASP H 1 1 17 5752 1 1 17 ASP HA H 1.377 11.720 1.104 1.00 . A A . 34 ASP HA 1 1 17 5753 1 1 17 ASP HB2 H -1.226 12.609 2.349 1.00 . A A . 34 ASP HB2 1 1 17 5754 1 1 17 ASP HB3 H 0.314 12.684 3.200 1.00 . A A . 34 ASP HB3 1 1 17 5755 1 1 17 ASP N N -0.440 11.365 0.191 1.00 . A A . 34 ASP N 1 1 17 5756 1 1 17 ASP O O 1.375 9.687 2.573 1.00 . A A . 34 ASP O 1 1 17 5757 1 1 17 ASP OD1 O 1.275 14.532 1.723 1.00 . A A . 34 ASP OD1 1 1 17 5758 1 1 17 ASP OD2 O -0.769 14.589 0.917 1.00 . A A . 34 ASP OD2 1 1 17 5759 1 1 18 LYS C C -0.897 7.338 2.512 1.00 . A A . 35 LYS C 1 1 17 5760 1 1 18 LYS CA C -1.038 8.586 3.377 1.00 . A A . 35 LYS CA 1 1 17 5761 1 1 18 LYS CB C -2.404 8.589 4.067 1.00 . A A . 35 LYS CB 1 1 17 5762 1 1 18 LYS CD C -4.527 7.359 3.529 1.00 . A A . 35 LYS CD 1 1 17 5763 1 1 18 LYS CE C -4.052 5.996 3.049 1.00 . A A . 35 LYS CE 1 1 17 5764 1 1 18 LYS CG C -3.572 8.462 3.105 1.00 . A A . 35 LYS CG 1 1 17 5765 1 1 18 LYS H H -1.668 10.285 2.283 1.00 . A A . 35 LYS H 1 1 17 5766 1 1 18 LYS HA H -0.264 8.577 4.130 1.00 . A A . 35 LYS HA 1 1 17 5767 1 1 18 LYS HB2 H -2.445 7.763 4.762 1.00 . A A . 35 LYS HB2 1 1 17 5768 1 1 18 LYS HB3 H -2.515 9.514 4.615 1.00 . A A . 35 LYS HB3 1 1 17 5769 1 1 18 LYS HD2 H -4.592 7.346 4.606 1.00 . A A . 35 LYS HD2 1 1 17 5770 1 1 18 LYS HD3 H -5.503 7.559 3.110 1.00 . A A . 35 LYS HD3 1 1 17 5771 1 1 18 LYS HE2 H -4.743 5.631 2.304 1.00 . A A . 35 LYS HE2 1 1 17 5772 1 1 18 LYS HE3 H -3.072 6.106 2.607 1.00 . A A . 35 LYS HE3 1 1 17 5773 1 1 18 LYS HG2 H -4.110 9.399 3.079 1.00 . A A . 35 LYS HG2 1 1 17 5774 1 1 18 LYS HG3 H -3.191 8.237 2.119 1.00 . A A . 35 LYS HG3 1 1 17 5775 1 1 18 LYS HZ1 H -4.902 4.921 4.625 1.00 . A A . 35 LYS HZ1 1 1 17 5776 1 1 18 LYS HZ2 H -3.278 5.325 4.869 1.00 . A A . 35 LYS HZ2 1 1 17 5777 1 1 18 LYS HZ3 H -3.688 4.081 3.799 1.00 . A A . 35 LYS HZ3 1 1 17 5778 1 1 18 LYS N N -0.872 9.794 2.578 1.00 . A A . 35 LYS N 1 1 17 5779 1 1 18 LYS NZ N -3.974 5.012 4.163 1.00 . A A . 35 LYS NZ 1 1 17 5780 1 1 18 LYS O O -0.775 6.226 3.025 1.00 . A A . 35 LYS O 1 1 17 5781 1 1 19 TRP C C 0.669 6.216 -0.147 1.00 . A A . 36 TRP C 1 1 17 5782 1 1 19 TRP CA C -0.785 6.419 0.261 1.00 . A A . 36 TRP CA 1 1 17 5783 1 1 19 TRP CB C -1.646 6.668 -0.978 1.00 . A A . 36 TRP CB 1 1 17 5784 1 1 19 TRP CD1 C -4.052 6.518 -0.108 1.00 . A A . 36 TRP CD1 1 1 17 5785 1 1 19 TRP CD2 C -3.500 4.915 -1.572 1.00 . A A . 36 TRP CD2 1 1 17 5786 1 1 19 TRP CE2 C -4.838 4.720 -1.175 1.00 . A A . 36 TRP CE2 1 1 17 5787 1 1 19 TRP CE3 C -2.935 4.028 -2.492 1.00 . A A . 36 TRP CE3 1 1 17 5788 1 1 19 TRP CG C -3.017 6.071 -0.879 1.00 . A A . 36 TRP CG 1 1 17 5789 1 1 19 TRP CH2 C -5.035 2.820 -2.564 1.00 . A A . 36 TRP CH2 1 1 17 5790 1 1 19 TRP CZ2 C -5.614 3.673 -1.666 1.00 . A A . 36 TRP CZ2 1 1 17 5791 1 1 19 TRP CZ3 C -3.707 2.990 -2.977 1.00 . A A . 36 TRP CZ3 1 1 17 5792 1 1 19 TRP H H -1.013 8.441 0.849 1.00 . A A . 36 TRP H 1 1 17 5793 1 1 19 TRP HA H -1.135 5.526 0.758 1.00 . A A . 36 TRP HA 1 1 17 5794 1 1 19 TRP HB2 H -1.757 7.732 -1.124 1.00 . A A . 36 TRP HB2 1 1 17 5795 1 1 19 TRP HB3 H -1.156 6.239 -1.840 1.00 . A A . 36 TRP HB3 1 1 17 5796 1 1 19 TRP HD1 H -4.001 7.380 0.539 1.00 . A A . 36 TRP HD1 1 1 17 5797 1 1 19 TRP HE1 H -6.017 5.825 0.162 1.00 . A A . 36 TRP HE1 1 1 17 5798 1 1 19 TRP HE3 H -1.913 4.142 -2.822 1.00 . A A . 36 TRP HE3 1 1 17 5799 1 1 19 TRP HH2 H -5.600 1.995 -2.970 1.00 . A A . 36 TRP HH2 1 1 17 5800 1 1 19 TRP HZ2 H -6.640 3.529 -1.357 1.00 . A A . 36 TRP HZ2 1 1 17 5801 1 1 19 TRP HZ3 H -3.286 2.294 -3.688 1.00 . A A . 36 TRP HZ3 1 1 17 5802 1 1 19 TRP N N -0.913 7.530 1.198 1.00 . A A . 36 TRP N 1 1 17 5803 1 1 19 TRP NE1 N -5.150 5.709 -0.281 1.00 . A A . 36 TRP NE1 1 1 17 5804 1 1 19 TRP O O 0.957 5.583 -1.163 1.00 . A A . 36 TRP O 1 1 17 5805 1 1 20 CYS C C 3.839 7.257 1.492 1.00 . A A . 37 CYS C 1 1 17 5806 1 1 20 CYS CA C 3.010 6.636 0.371 1.00 . A A . 37 CYS CA 1 1 17 5807 1 1 20 CYS CB C 3.350 7.308 -0.962 1.00 . A A . 37 CYS CB 1 1 17 5808 1 1 20 CYS H H 1.294 7.252 1.446 1.00 . A A . 37 CYS H 1 1 17 5809 1 1 20 CYS HA H 3.248 5.585 0.304 1.00 . A A . 37 CYS HA 1 1 17 5810 1 1 20 CYS HB2 H 2.757 6.858 -1.744 1.00 . A A . 37 CYS HB2 1 1 17 5811 1 1 20 CYS HB3 H 3.112 8.359 -0.897 1.00 . A A . 37 CYS HB3 1 1 17 5812 1 1 20 CYS N N 1.585 6.758 0.650 1.00 . A A . 37 CYS N 1 1 17 5813 1 1 20 CYS O O 4.564 6.559 2.201 1.00 . A A . 37 CYS O 1 1 17 5814 1 1 20 CYS SG S 5.101 7.164 -1.442 1.00 . A A . 37 CYS SG 1 1 18 5815 1 1 1 ASN C C 2.222 2.892 -2.874 1.00 . A A . 18 ASN C 1 1 18 5816 1 1 1 ASN CA C 1.257 1.727 -2.680 1.00 . A A . 18 ASN CA 1 1 18 5817 1 1 1 ASN CB C -0.170 2.254 -2.516 1.00 . A A . 18 ASN CB 1 1 18 5818 1 1 1 ASN CG C -1.165 1.147 -2.224 1.00 . A A . 18 ASN CG 1 1 18 5819 1 1 1 ASN H1 H 1.996 0.025 -1.661 1.00 . A A . 18 ASN H1 1 1 18 5820 1 1 1 ASN HA H 1.298 1.091 -3.551 1.00 . A A . 18 ASN HA 1 1 18 5821 1 1 1 ASN HB2 H -0.195 2.959 -1.697 1.00 . A A . 18 ASN HB2 1 1 18 5822 1 1 1 ASN HB3 H -0.470 2.753 -3.425 1.00 . A A . 18 ASN HB3 1 1 18 5823 1 1 1 ASN HD21 H -0.357 0.013 -3.644 1.00 . A A . 18 ASN HD21 1 1 18 5824 1 1 1 ASN HD22 H -1.692 -0.683 -2.795 1.00 . A A . 18 ASN HD22 1 1 18 5825 1 1 1 ASN N N 1.636 0.926 -1.521 1.00 . A A . 18 ASN N 1 1 18 5826 1 1 1 ASN ND2 N -1.060 0.048 -2.962 1.00 . A A . 18 ASN ND2 1 1 18 5827 1 1 1 ASN O O 2.003 3.760 -3.720 1.00 . A A . 18 ASN O 1 1 18 5828 1 1 1 ASN OD1 O -2.018 1.279 -1.346 1.00 . A A . 18 ASN OD1 1 1 18 5829 1 1 2 CYS C C 5.246 3.717 -3.337 1.00 . A A . 19 CYS C 1 1 18 5830 1 1 2 CYS CA C 4.292 3.963 -2.171 1.00 . A A . 19 CYS CA 1 1 18 5831 1 1 2 CYS CB C 5.080 4.054 -0.863 1.00 . A A . 19 CYS CB 1 1 18 5832 1 1 2 CYS H H 3.412 2.186 -1.431 1.00 . A A . 19 CYS H 1 1 18 5833 1 1 2 CYS HA H 3.775 4.896 -2.336 1.00 . A A . 19 CYS HA 1 1 18 5834 1 1 2 CYS HB2 H 4.393 3.987 -0.032 1.00 . A A . 19 CYS HB2 1 1 18 5835 1 1 2 CYS HB3 H 5.778 3.231 -0.814 1.00 . A A . 19 CYS HB3 1 1 18 5836 1 1 2 CYS N N 3.292 2.905 -2.086 1.00 . A A . 19 CYS N 1 1 18 5837 1 1 2 CYS O O 6.038 4.588 -3.698 1.00 . A A . 19 CYS O 1 1 18 5838 1 1 2 CYS SG S 6.028 5.598 -0.672 1.00 . A A . 19 CYS SG 1 1 18 5839 1 1 3 ASP C C 5.568 2.876 -6.319 1.00 . A A . 20 ASP C 1 1 18 5840 1 1 3 ASP CA C 6.018 2.166 -5.046 1.00 . A A . 20 ASP CA 1 1 18 5841 1 1 3 ASP CB C 6.005 0.652 -5.259 1.00 . A A . 20 ASP CB 1 1 18 5842 1 1 3 ASP CG C 6.854 0.226 -6.441 1.00 . A A . 20 ASP CG 1 1 18 5843 1 1 3 ASP H H 4.512 1.875 -3.586 1.00 . A A . 20 ASP H 1 1 18 5844 1 1 3 ASP HA H 7.025 2.479 -4.811 1.00 . A A . 20 ASP HA 1 1 18 5845 1 1 3 ASP HB2 H 6.387 0.167 -4.372 1.00 . A A . 20 ASP HB2 1 1 18 5846 1 1 3 ASP HB3 H 4.990 0.328 -5.432 1.00 . A A . 20 ASP HB3 1 1 18 5847 1 1 3 ASP N N 5.164 2.527 -3.920 1.00 . A A . 20 ASP N 1 1 18 5848 1 1 3 ASP O O 6.234 2.800 -7.352 1.00 . A A . 20 ASP O 1 1 18 5849 1 1 3 ASP OD1 O 8.051 0.581 -6.469 1.00 . A A . 20 ASP OD1 1 1 18 5850 1 1 3 ASP OD2 O 6.321 -0.461 -7.337 1.00 . A A . 20 ASP OD2 1 1 18 5851 1 1 4 TRP C C 3.143 5.533 -6.936 1.00 . A A . 21 TRP C 1 1 18 5852 1 1 4 TRP CA C 3.894 4.285 -7.384 1.00 . A A . 21 TRP CA 1 1 18 5853 1 1 4 TRP CB C 2.966 3.377 -8.193 1.00 . A A . 21 TRP CB 1 1 18 5854 1 1 4 TRP CD1 C 1.227 2.911 -6.368 1.00 . A A . 21 TRP CD1 1 1 18 5855 1 1 4 TRP CD2 C 2.018 1.075 -7.378 1.00 . A A . 21 TRP CD2 1 1 18 5856 1 1 4 TRP CE2 C 1.079 0.683 -6.404 1.00 . A A . 21 TRP CE2 1 1 18 5857 1 1 4 TRP CE3 C 2.647 0.088 -8.141 1.00 . A A . 21 TRP CE3 1 1 18 5858 1 1 4 TRP CG C 2.097 2.504 -7.339 1.00 . A A . 21 TRP CG 1 1 18 5859 1 1 4 TRP CH2 C 1.388 -1.597 -6.937 1.00 . A A . 21 TRP CH2 1 1 18 5860 1 1 4 TRP CZ2 C 0.756 -0.652 -6.175 1.00 . A A . 21 TRP CZ2 1 1 18 5861 1 1 4 TRP CZ3 C 2.327 -1.237 -7.913 1.00 . A A . 21 TRP CZ3 1 1 18 5862 1 1 4 TRP H H 3.949 3.585 -5.386 1.00 . A A . 21 TRP H 1 1 18 5863 1 1 4 TRP HA H 4.724 4.583 -8.008 1.00 . A A . 21 TRP HA 1 1 18 5864 1 1 4 TRP HB2 H 2.322 3.988 -8.807 1.00 . A A . 21 TRP HB2 1 1 18 5865 1 1 4 TRP HB3 H 3.562 2.738 -8.827 1.00 . A A . 21 TRP HB3 1 1 18 5866 1 1 4 TRP HD1 H 1.059 3.942 -6.096 1.00 . A A . 21 TRP HD1 1 1 18 5867 1 1 4 TRP HE1 H -0.056 1.854 -5.084 1.00 . A A . 21 TRP HE1 1 1 18 5868 1 1 4 TRP HE3 H 3.374 0.346 -8.898 1.00 . A A . 21 TRP HE3 1 1 18 5869 1 1 4 TRP HH2 H 1.169 -2.644 -6.793 1.00 . A A . 21 TRP HH2 1 1 18 5870 1 1 4 TRP HZ2 H 0.034 -0.946 -5.427 1.00 . A A . 21 TRP HZ2 1 1 18 5871 1 1 4 TRP HZ3 H 2.804 -2.013 -8.493 1.00 . A A . 21 TRP HZ3 1 1 18 5872 1 1 4 TRP N N 4.434 3.563 -6.237 1.00 . A A . 21 TRP N 1 1 18 5873 1 1 4 TRP NE1 N 0.611 1.821 -5.802 1.00 . A A . 21 TRP NE1 1 1 18 5874 1 1 4 TRP O O 2.620 5.588 -5.823 1.00 . A A . 21 TRP O 1 1 18 5875 1 1 5 ASP C C 1.956 8.483 -8.783 1.00 . A A . 22 ASP C 1 1 18 5876 1 1 5 ASP CA C 2.402 7.781 -7.504 1.00 . A A . 22 ASP CA 1 1 18 5877 1 1 5 ASP CB C 3.310 8.704 -6.690 1.00 . A A . 22 ASP CB 1 1 18 5878 1 1 5 ASP CG C 4.781 8.420 -6.921 1.00 . A A . 22 ASP CG 1 1 18 5879 1 1 5 ASP H H 3.528 6.429 -8.681 1.00 . A A . 22 ASP H 1 1 18 5880 1 1 5 ASP HA H 1.528 7.542 -6.917 1.00 . A A . 22 ASP HA 1 1 18 5881 1 1 5 ASP HB2 H 3.113 9.729 -6.969 1.00 . A A . 22 ASP HB2 1 1 18 5882 1 1 5 ASP HB3 H 3.097 8.574 -5.640 1.00 . A A . 22 ASP HB3 1 1 18 5883 1 1 5 ASP N N 3.092 6.533 -7.810 1.00 . A A . 22 ASP N 1 1 18 5884 1 1 5 ASP O O 2.662 8.466 -9.792 1.00 . A A . 22 ASP O 1 1 18 5885 1 1 5 ASP OD1 O 5.347 8.971 -7.888 1.00 . A A . 22 ASP OD1 1 1 18 5886 1 1 5 ASP OD2 O 5.366 7.645 -6.135 1.00 . A A . 22 ASP OD2 1 1 18 5887 1 1 6 LYS C C 0.353 8.958 -11.151 1.00 . A A . 23 LYS C 1 1 18 5888 1 1 6 LYS CA C 0.239 9.807 -9.888 1.00 . A A . 23 LYS CA 1 1 18 5889 1 1 6 LYS CB C 0.972 11.136 -10.087 1.00 . A A . 23 LYS CB 1 1 18 5890 1 1 6 LYS CD C 0.113 13.178 -8.903 1.00 . A A . 23 LYS CD 1 1 18 5891 1 1 6 LYS CE C 0.836 14.420 -9.401 1.00 . A A . 23 LYS CE 1 1 18 5892 1 1 6 LYS CG C 1.047 11.982 -8.828 1.00 . A A . 23 LYS CG 1 1 18 5893 1 1 6 LYS H H 0.263 9.077 -7.902 1.00 . A A . 23 LYS H 1 1 18 5894 1 1 6 LYS HA H -0.805 10.006 -9.696 1.00 . A A . 23 LYS HA 1 1 18 5895 1 1 6 LYS HB2 H 1.979 10.932 -10.419 1.00 . A A . 23 LYS HB2 1 1 18 5896 1 1 6 LYS HB3 H 0.459 11.706 -10.848 1.00 . A A . 23 LYS HB3 1 1 18 5897 1 1 6 LYS HD2 H -0.696 12.950 -9.581 1.00 . A A . 23 LYS HD2 1 1 18 5898 1 1 6 LYS HD3 H -0.286 13.375 -7.917 1.00 . A A . 23 LYS HD3 1 1 18 5899 1 1 6 LYS HE2 H 0.380 15.290 -8.953 1.00 . A A . 23 LYS HE2 1 1 18 5900 1 1 6 LYS HE3 H 1.872 14.362 -9.101 1.00 . A A . 23 LYS HE3 1 1 18 5901 1 1 6 LYS HG2 H 0.770 11.375 -7.979 1.00 . A A . 23 LYS HG2 1 1 18 5902 1 1 6 LYS HG3 H 2.061 12.336 -8.704 1.00 . A A . 23 LYS HG3 1 1 18 5903 1 1 6 LYS HZ1 H -0.174 14.255 -11.222 1.00 . A A . 23 LYS HZ1 1 1 18 5904 1 1 6 LYS HZ2 H 1.484 13.940 -11.327 1.00 . A A . 23 LYS HZ2 1 1 18 5905 1 1 6 LYS HZ3 H 0.935 15.532 -11.167 1.00 . A A . 23 LYS HZ3 1 1 18 5906 1 1 6 LYS N N 0.780 9.099 -8.735 1.00 . A A . 23 LYS N 1 1 18 5907 1 1 6 LYS NZ N 0.766 14.546 -10.883 1.00 . A A . 23 LYS NZ 1 1 18 5908 1 1 6 LYS O O 0.949 9.380 -12.142 1.00 . A A . 23 LYS O 1 1 18 5909 1 1 7 SER C C -0.928 5.557 -11.935 1.00 . A A . 24 SER C 1 1 18 5910 1 1 7 SER CA C -0.184 6.852 -12.247 1.00 . A A . 24 SER CA 1 1 18 5911 1 1 7 SER CB C 1.264 6.543 -12.630 1.00 . A A . 24 SER CB 1 1 18 5912 1 1 7 SER H H -0.683 7.482 -10.288 1.00 . A A . 24 SER H 1 1 18 5913 1 1 7 SER HA H -0.670 7.342 -13.078 1.00 . A A . 24 SER HA 1 1 18 5914 1 1 7 SER HB2 H 1.583 7.223 -13.405 1.00 . A A . 24 SER HB2 1 1 18 5915 1 1 7 SER HB3 H 1.897 6.664 -11.762 1.00 . A A . 24 SER HB3 1 1 18 5916 1 1 7 SER HG H 1.358 4.604 -12.368 1.00 . A A . 24 SER HG 1 1 18 5917 1 1 7 SER N N -0.223 7.761 -11.107 1.00 . A A . 24 SER N 1 1 18 5918 1 1 7 SER O O -1.530 4.945 -12.818 1.00 . A A . 24 SER O 1 1 18 5919 1 1 7 SER OG O 1.393 5.215 -13.107 1.00 . A A . 24 SER OG 1 1 18 5920 1 1 8 HIS C C -3.066 4.075 -10.326 1.00 . A A . 25 HIS C 1 1 18 5921 1 1 8 HIS CA C -1.550 3.923 -10.242 1.00 . A A . 25 HIS CA 1 1 18 5922 1 1 8 HIS CB C -1.140 3.568 -8.812 1.00 . A A . 25 HIS CB 1 1 18 5923 1 1 8 HIS CD2 C -2.107 1.814 -7.164 1.00 . A A . 25 HIS CD2 1 1 18 5924 1 1 8 HIS CE1 C -2.154 0.092 -8.519 1.00 . A A . 25 HIS CE1 1 1 18 5925 1 1 8 HIS CG C -1.634 2.227 -8.363 1.00 . A A . 25 HIS CG 1 1 18 5926 1 1 8 HIS H H -0.385 5.676 -10.014 1.00 . A A . 25 HIS H 1 1 18 5927 1 1 8 HIS HA H -1.244 3.126 -10.903 1.00 . A A . 25 HIS HA 1 1 18 5928 1 1 8 HIS HB2 H -0.062 3.564 -8.744 1.00 . A A . 25 HIS HB2 1 1 18 5929 1 1 8 HIS HB3 H -1.536 4.312 -8.136 1.00 . A A . 25 HIS HB3 1 1 18 5930 1 1 8 HIS HD1 H -1.397 1.103 -10.129 1.00 . A A . 25 HIS HD1 1 1 18 5931 1 1 8 HIS HD2 H -2.216 2.419 -6.274 1.00 . A A . 25 HIS HD2 1 1 18 5932 1 1 8 HIS HE1 H -2.300 -0.904 -8.911 1.00 . A A . 25 HIS HE1 1 1 18 5933 1 1 8 HIS N N -0.881 5.145 -10.672 1.00 . A A . 25 HIS N 1 1 18 5934 1 1 8 HIS ND1 N -1.675 1.125 -9.190 1.00 . A A . 25 HIS ND1 1 1 18 5935 1 1 8 HIS NE2 N -2.423 0.484 -7.287 1.00 . A A . 25 HIS NE2 1 1 18 5936 1 1 8 HIS O O -3.596 5.178 -10.199 1.00 . A A . 25 HIS O 1 1 18 5937 1 1 9 GLU C C -5.849 3.307 -9.299 1.00 . A A . 26 GLU C 1 1 18 5938 1 1 9 GLU CA C -5.212 2.971 -10.644 1.00 . A A . 26 GLU CA 1 1 18 5939 1 1 9 GLU CB C -5.721 1.615 -11.137 1.00 . A A . 26 GLU CB 1 1 18 5940 1 1 9 GLU CD C -6.239 -0.793 -10.574 1.00 . A A . 26 GLU CD 1 1 18 5941 1 1 9 GLU CG C -5.758 0.549 -10.055 1.00 . A A . 26 GLU CG 1 1 18 5942 1 1 9 GLU H H -3.278 2.110 -10.633 1.00 . A A . 26 GLU H 1 1 18 5943 1 1 9 GLU HA H -5.488 3.730 -11.359 1.00 . A A . 26 GLU HA 1 1 18 5944 1 1 9 GLU HB2 H -6.720 1.739 -11.526 1.00 . A A . 26 GLU HB2 1 1 18 5945 1 1 9 GLU HB3 H -5.075 1.269 -11.931 1.00 . A A . 26 GLU HB3 1 1 18 5946 1 1 9 GLU HG2 H -4.764 0.426 -9.653 1.00 . A A . 26 GLU HG2 1 1 18 5947 1 1 9 GLU HG3 H -6.425 0.874 -9.270 1.00 . A A . 26 GLU HG3 1 1 18 5948 1 1 9 GLU N N -3.757 2.960 -10.541 1.00 . A A . 26 GLU N 1 1 18 5949 1 1 9 GLU O O -6.932 3.891 -9.240 1.00 . A A . 26 GLU O 1 1 18 5950 1 1 9 GLU OE1 O -6.925 -0.815 -11.617 1.00 . A A . 26 GLU OE1 1 1 18 5951 1 1 9 GLU OE2 O -5.928 -1.821 -9.936 1.00 . A A . 26 GLU OE2 1 1 18 5952 1 1 10 LYS C C -5.015 4.442 -6.285 1.00 . A A . 27 LYS C 1 1 18 5953 1 1 10 LYS CA C -5.668 3.196 -6.874 1.00 . A A . 27 LYS CA 1 1 18 5954 1 1 10 LYS CB C -5.404 1.992 -5.967 1.00 . A A . 27 LYS CB 1 1 18 5955 1 1 10 LYS CD C -6.133 -0.316 -5.296 1.00 . A A . 27 LYS CD 1 1 18 5956 1 1 10 LYS CE C -4.887 -1.185 -5.370 1.00 . A A . 27 LYS CE 1 1 18 5957 1 1 10 LYS CG C -6.145 0.736 -6.392 1.00 . A A . 27 LYS CG 1 1 18 5958 1 1 10 LYS H H -4.313 2.472 -8.330 1.00 . A A . 27 LYS H 1 1 18 5959 1 1 10 LYS HA H -6.733 3.359 -6.940 1.00 . A A . 27 LYS HA 1 1 18 5960 1 1 10 LYS HB2 H -4.345 1.779 -5.971 1.00 . A A . 27 LYS HB2 1 1 18 5961 1 1 10 LYS HB3 H -5.709 2.241 -4.960 1.00 . A A . 27 LYS HB3 1 1 18 5962 1 1 10 LYS HD2 H -6.158 0.176 -4.335 1.00 . A A . 27 LYS HD2 1 1 18 5963 1 1 10 LYS HD3 H -7.006 -0.945 -5.403 1.00 . A A . 27 LYS HD3 1 1 18 5964 1 1 10 LYS HE2 H -4.999 -1.885 -6.183 1.00 . A A . 27 LYS HE2 1 1 18 5965 1 1 10 LYS HE3 H -4.033 -0.550 -5.558 1.00 . A A . 27 LYS HE3 1 1 18 5966 1 1 10 LYS HG2 H -7.169 0.992 -6.619 1.00 . A A . 27 LYS HG2 1 1 18 5967 1 1 10 LYS HG3 H -5.670 0.330 -7.274 1.00 . A A . 27 LYS HG3 1 1 18 5968 1 1 10 LYS HZ1 H -4.706 -2.963 -4.290 1.00 . A A . 27 LYS HZ1 1 1 18 5969 1 1 10 LYS HZ2 H -5.390 -1.693 -3.408 1.00 . A A . 27 LYS HZ2 1 1 18 5970 1 1 10 LYS HZ3 H -3.726 -1.710 -3.715 1.00 . A A . 27 LYS HZ3 1 1 18 5971 1 1 10 LYS N N -5.171 2.934 -8.219 1.00 . A A . 27 LYS N 1 1 18 5972 1 1 10 LYS NZ N -4.661 -1.940 -4.107 1.00 . A A . 27 LYS NZ 1 1 18 5973 1 1 10 LYS O O -5.350 4.866 -5.178 1.00 . A A . 27 LYS O 1 1 18 5974 1 1 11 TYR C C -4.370 7.341 -6.258 1.00 . A A . 28 TYR C 1 1 18 5975 1 1 11 TYR CA C -3.384 6.223 -6.583 1.00 . A A . 28 TYR CA 1 1 18 5976 1 1 11 TYR CB C -2.397 6.693 -7.652 1.00 . A A . 28 TYR CB 1 1 18 5977 1 1 11 TYR CD1 C -2.300 9.205 -7.421 1.00 . A A . 28 TYR CD1 1 1 18 5978 1 1 11 TYR CD2 C -3.310 8.294 -9.378 1.00 . A A . 28 TYR CD2 1 1 18 5979 1 1 11 TYR CE1 C -2.551 10.484 -7.880 1.00 . A A . 28 TYR CE1 1 1 18 5980 1 1 11 TYR CE2 C -3.564 9.569 -9.846 1.00 . A A . 28 TYR CE2 1 1 18 5981 1 1 11 TYR CG C -2.673 8.090 -8.160 1.00 . A A . 28 TYR CG 1 1 18 5982 1 1 11 TYR CZ C -3.183 10.660 -9.093 1.00 . A A . 28 TYR CZ 1 1 18 5983 1 1 11 TYR H H -3.861 4.641 -7.905 1.00 . A A . 28 TYR H 1 1 18 5984 1 1 11 TYR HA H -2.836 5.970 -5.687 1.00 . A A . 28 TYR HA 1 1 18 5985 1 1 11 TYR HB2 H -1.399 6.682 -7.241 1.00 . A A . 28 TYR HB2 1 1 18 5986 1 1 11 TYR HB3 H -2.441 6.018 -8.495 1.00 . A A . 28 TYR HB3 1 1 18 5987 1 1 11 TYR HD1 H -1.805 9.064 -6.471 1.00 . A A . 28 TYR HD1 1 1 18 5988 1 1 11 TYR HD2 H -3.607 7.437 -9.965 1.00 . A A . 28 TYR HD2 1 1 18 5989 1 1 11 TYR HE1 H -2.253 11.339 -7.291 1.00 . A A . 28 TYR HE1 1 1 18 5990 1 1 11 TYR HE2 H -4.059 9.708 -10.796 1.00 . A A . 28 TYR HE2 1 1 18 5991 1 1 11 TYR HH H -3.639 12.507 -8.814 1.00 . A A . 28 TYR HH 1 1 18 5992 1 1 11 TYR N N -4.084 5.025 -7.032 1.00 . A A . 28 TYR N 1 1 18 5993 1 1 11 TYR O O -5.404 7.481 -6.911 1.00 . A A . 28 TYR O 1 1 18 5994 1 1 11 TYR OH O -3.436 11.932 -9.555 1.00 . A A . 28 TYR OH 1 1 18 5995 1 1 12 ASP C C -4.110 10.550 -4.798 1.00 . A A . 29 ASP C 1 1 18 5996 1 1 12 ASP CA C -4.895 9.243 -4.833 1.00 . A A . 29 ASP CA 1 1 18 5997 1 1 12 ASP CB C -5.503 8.962 -3.458 1.00 . A A . 29 ASP CB 1 1 18 5998 1 1 12 ASP CG C -6.735 8.082 -3.538 1.00 . A A . 29 ASP CG 1 1 18 5999 1 1 12 ASP H H -3.203 7.972 -4.763 1.00 . A A . 29 ASP H 1 1 18 6000 1 1 12 ASP HA H -5.691 9.334 -5.556 1.00 . A A . 29 ASP HA 1 1 18 6001 1 1 12 ASP HB2 H -4.769 8.465 -2.841 1.00 . A A . 29 ASP HB2 1 1 18 6002 1 1 12 ASP HB3 H -5.781 9.898 -2.996 1.00 . A A . 29 ASP HB3 1 1 18 6003 1 1 12 ASP N N -4.041 8.135 -5.245 1.00 . A A . 29 ASP N 1 1 18 6004 1 1 12 ASP O O -3.020 10.616 -4.231 1.00 . A A . 29 ASP O 1 1 18 6005 1 1 12 ASP OD1 O -6.734 7.131 -4.349 1.00 . A A . 29 ASP OD1 1 1 18 6006 1 1 12 ASP OD2 O -7.700 8.343 -2.791 1.00 . A A . 29 ASP OD2 1 1 18 6007 1 1 13 TRP C C -3.672 13.369 -4.044 1.00 . A A . 30 TRP C 1 1 18 6008 1 1 13 TRP CA C -4.023 12.893 -5.449 1.00 . A A . 30 TRP CA 1 1 18 6009 1 1 13 TRP CB C -4.931 13.915 -6.135 1.00 . A A . 30 TRP CB 1 1 18 6010 1 1 13 TRP CD1 C -4.249 15.099 -8.303 1.00 . A A . 30 TRP CD1 1 1 18 6011 1 1 13 TRP CD2 C -3.245 15.893 -6.465 1.00 . A A . 30 TRP CD2 1 1 18 6012 1 1 13 TRP CE2 C -2.787 16.624 -7.579 1.00 . A A . 30 TRP CE2 1 1 18 6013 1 1 13 TRP CE3 C -2.752 16.217 -5.199 1.00 . A A . 30 TRP CE3 1 1 18 6014 1 1 13 TRP CG C -4.180 14.924 -6.951 1.00 . A A . 30 TRP CG 1 1 18 6015 1 1 13 TRP CH2 C -1.393 17.951 -6.210 1.00 . A A . 30 TRP CH2 1 1 18 6016 1 1 13 TRP CZ2 C -1.860 17.656 -7.462 1.00 . A A . 30 TRP CZ2 1 1 18 6017 1 1 13 TRP CZ3 C -1.831 17.241 -5.084 1.00 . A A . 30 TRP CZ3 1 1 18 6018 1 1 13 TRP H H -5.543 11.472 -5.844 1.00 . A A . 30 TRP H 1 1 18 6019 1 1 13 TRP HA H -3.113 12.793 -6.021 1.00 . A A . 30 TRP HA 1 1 18 6020 1 1 13 TRP HB2 H -5.614 13.397 -6.792 1.00 . A A . 30 TRP HB2 1 1 18 6021 1 1 13 TRP HB3 H -5.495 14.447 -5.383 1.00 . A A . 30 TRP HB3 1 1 18 6022 1 1 13 TRP HD1 H -4.872 14.513 -8.961 1.00 . A A . 30 TRP HD1 1 1 18 6023 1 1 13 TRP HE1 H -3.288 16.437 -9.608 1.00 . A A . 30 TRP HE1 1 1 18 6024 1 1 13 TRP HE3 H -3.077 15.681 -4.319 1.00 . A A . 30 TRP HE3 1 1 18 6025 1 1 13 TRP HH2 H -0.673 18.743 -6.073 1.00 . A A . 30 TRP HH2 1 1 18 6026 1 1 13 TRP HZ2 H -1.513 18.213 -8.320 1.00 . A A . 30 TRP HZ2 1 1 18 6027 1 1 13 TRP HZ3 H -1.439 17.505 -4.113 1.00 . A A . 30 TRP HZ3 1 1 18 6028 1 1 13 TRP N N -4.672 11.587 -5.409 1.00 . A A . 30 TRP N 1 1 18 6029 1 1 13 TRP NE1 N -3.414 16.120 -8.688 1.00 . A A . 30 TRP NE1 1 1 18 6030 1 1 13 TRP O O -2.498 13.448 -3.682 1.00 . A A . 30 TRP O 1 1 18 6031 1 1 14 GLU C C -4.050 13.011 -0.984 1.00 . A A . 31 GLU C 1 1 18 6032 1 1 14 GLU CA C -4.493 14.155 -1.892 1.00 . A A . 31 GLU CA 1 1 18 6033 1 1 14 GLU CB C -5.777 14.783 -1.348 1.00 . A A . 31 GLU CB 1 1 18 6034 1 1 14 GLU CD C -7.363 16.050 -2.853 1.00 . A A . 31 GLU CD 1 1 18 6035 1 1 14 GLU CG C -6.119 16.119 -1.988 1.00 . A A . 31 GLU CG 1 1 18 6036 1 1 14 GLU H H -5.609 13.601 -3.603 1.00 . A A . 31 GLU H 1 1 18 6037 1 1 14 GLU HA H -3.716 14.904 -1.911 1.00 . A A . 31 GLU HA 1 1 18 6038 1 1 14 GLU HB2 H -6.598 14.103 -1.522 1.00 . A A . 31 GLU HB2 1 1 18 6039 1 1 14 GLU HB3 H -5.667 14.936 -0.285 1.00 . A A . 31 GLU HB3 1 1 18 6040 1 1 14 GLU HG2 H -6.283 16.846 -1.207 1.00 . A A . 31 GLU HG2 1 1 18 6041 1 1 14 GLU HG3 H -5.288 16.432 -2.603 1.00 . A A . 31 GLU HG3 1 1 18 6042 1 1 14 GLU N N -4.696 13.685 -3.257 1.00 . A A . 31 GLU N 1 1 18 6043 1 1 14 GLU O O -3.044 13.115 -0.280 1.00 . A A . 31 GLU O 1 1 18 6044 1 1 14 GLU OE1 O -7.350 15.299 -3.851 1.00 . A A . 31 GLU OE1 1 1 18 6045 1 1 14 GLU OE2 O -8.348 16.746 -2.533 1.00 . A A . 31 GLU OE2 1 1 18 6046 1 1 15 LEU C C -3.065 10.285 -0.427 1.00 . A A . 32 LEU C 1 1 18 6047 1 1 15 LEU CA C -4.495 10.756 -0.182 1.00 . A A . 32 LEU CA 1 1 18 6048 1 1 15 LEU CB C -5.476 9.620 -0.478 1.00 . A A . 32 LEU CB 1 1 18 6049 1 1 15 LEU CD1 C -6.809 10.099 1.589 1.00 . A A . 32 LEU CD1 1 1 18 6050 1 1 15 LEU CD2 C -7.237 8.008 0.287 1.00 . A A . 32 LEU CD2 1 1 18 6051 1 1 15 LEU CG C -6.182 9.010 0.733 1.00 . A A . 32 LEU CG 1 1 18 6052 1 1 15 LEU H H -5.596 11.896 -1.584 1.00 . A A . 32 LEU H 1 1 18 6053 1 1 15 LEU HA H -4.594 11.045 0.853 1.00 . A A . 32 LEU HA 1 1 18 6054 1 1 15 LEU HB2 H -6.233 10.002 -1.145 1.00 . A A . 32 LEU HB2 1 1 18 6055 1 1 15 LEU HB3 H -4.927 8.831 -0.974 1.00 . A A . 32 LEU HB3 1 1 18 6056 1 1 15 LEU HD11 H -7.684 9.708 2.086 1.00 . A A . 32 LEU HD11 1 1 18 6057 1 1 15 LEU HD12 H -7.092 10.932 0.963 1.00 . A A . 32 LEU HD12 1 1 18 6058 1 1 15 LEU HD13 H -6.094 10.432 2.328 1.00 . A A . 32 LEU HD13 1 1 18 6059 1 1 15 LEU HD21 H -7.393 7.279 1.068 1.00 . A A . 32 LEU HD21 1 1 18 6060 1 1 15 LEU HD22 H -6.900 7.507 -0.610 1.00 . A A . 32 LEU HD22 1 1 18 6061 1 1 15 LEU HD23 H -8.163 8.525 0.085 1.00 . A A . 32 LEU HD23 1 1 18 6062 1 1 15 LEU HG H -5.456 8.486 1.339 1.00 . A A . 32 LEU HG 1 1 18 6063 1 1 15 LEU N N -4.808 11.920 -1.004 1.00 . A A . 32 LEU N 1 1 18 6064 1 1 15 LEU O O -2.496 9.552 0.381 1.00 . A A . 32 LEU O 1 1 18 6065 1 1 16 TRP C C -0.216 10.385 -0.671 1.00 . A A . 33 TRP C 1 1 18 6066 1 1 16 TRP CA C -1.125 10.337 -1.895 1.00 . A A . 33 TRP CA 1 1 18 6067 1 1 16 TRP CB C -0.582 11.263 -2.985 1.00 . A A . 33 TRP CB 1 1 18 6068 1 1 16 TRP CD1 C 1.557 10.420 -4.117 1.00 . A A . 33 TRP CD1 1 1 18 6069 1 1 16 TRP CD2 C 1.912 11.802 -2.392 1.00 . A A . 33 TRP CD2 1 1 18 6070 1 1 16 TRP CE2 C 3.158 11.415 -2.921 1.00 . A A . 33 TRP CE2 1 1 18 6071 1 1 16 TRP CE3 C 1.886 12.673 -1.299 1.00 . A A . 33 TRP CE3 1 1 18 6072 1 1 16 TRP CG C 0.901 11.155 -3.172 1.00 . A A . 33 TRP CG 1 1 18 6073 1 1 16 TRP CH2 C 4.309 12.720 -1.323 1.00 . A A . 33 TRP CH2 1 1 18 6074 1 1 16 TRP CZ2 C 4.364 11.868 -2.393 1.00 . A A . 33 TRP CZ2 1 1 18 6075 1 1 16 TRP CZ3 C 3.083 13.122 -0.776 1.00 . A A . 33 TRP CZ3 1 1 18 6076 1 1 16 TRP H H -2.995 11.296 -2.150 1.00 . A A . 33 TRP H 1 1 18 6077 1 1 16 TRP HA H -1.147 9.325 -2.272 1.00 . A A . 33 TRP HA 1 1 18 6078 1 1 16 TRP HB2 H -1.055 11.018 -3.924 1.00 . A A . 33 TRP HB2 1 1 18 6079 1 1 16 TRP HB3 H -0.813 12.286 -2.725 1.00 . A A . 33 TRP HB3 1 1 18 6080 1 1 16 TRP HD1 H 1.067 9.811 -4.862 1.00 . A A . 33 TRP HD1 1 1 18 6081 1 1 16 TRP HE1 H 3.597 10.144 -4.531 1.00 . A A . 33 TRP HE1 1 1 18 6082 1 1 16 TRP HE3 H 0.951 12.995 -0.863 1.00 . A A . 33 TRP HE3 1 1 18 6083 1 1 16 TRP HH2 H 5.220 13.095 -0.882 1.00 . A A . 33 TRP HH2 1 1 18 6084 1 1 16 TRP HZ2 H 5.317 11.567 -2.804 1.00 . A A . 33 TRP HZ2 1 1 18 6085 1 1 16 TRP HZ3 H 3.083 13.795 0.069 1.00 . A A . 33 TRP HZ3 1 1 18 6086 1 1 16 TRP N N -2.490 10.713 -1.545 1.00 . A A . 33 TRP N 1 1 18 6087 1 1 16 TRP NE1 N 2.915 10.571 -3.972 1.00 . A A . 33 TRP NE1 1 1 18 6088 1 1 16 TRP O O 0.676 9.551 -0.516 1.00 . A A . 33 TRP O 1 1 18 6089 1 1 17 ASP C C 0.321 10.246 2.242 1.00 . A A . 34 ASP C 1 1 18 6090 1 1 17 ASP CA C 0.349 11.522 1.405 1.00 . A A . 34 ASP CA 1 1 18 6091 1 1 17 ASP CB C -0.167 12.700 2.233 1.00 . A A . 34 ASP CB 1 1 18 6092 1 1 17 ASP CG C 0.257 14.039 1.661 1.00 . A A . 34 ASP CG 1 1 18 6093 1 1 17 ASP H H -1.175 12.000 0.015 1.00 . A A . 34 ASP H 1 1 18 6094 1 1 17 ASP HA H 1.367 11.721 1.109 1.00 . A A . 34 ASP HA 1 1 18 6095 1 1 17 ASP HB2 H -1.246 12.667 2.261 1.00 . A A . 34 ASP HB2 1 1 18 6096 1 1 17 ASP HB3 H 0.218 12.621 3.239 1.00 . A A . 34 ASP HB3 1 1 18 6097 1 1 17 ASP N N -0.449 11.366 0.194 1.00 . A A . 34 ASP N 1 1 18 6098 1 1 17 ASP O O 1.366 9.686 2.575 1.00 . A A . 34 ASP O 1 1 18 6099 1 1 17 ASP OD1 O 1.392 14.475 1.947 1.00 . A A . 34 ASP OD1 1 1 18 6100 1 1 17 ASP OD2 O -0.546 14.650 0.925 1.00 . A A . 34 ASP OD2 1 1 18 6101 1 1 18 LYS C C -0.904 7.336 2.510 1.00 . A A . 35 LYS C 1 1 18 6102 1 1 18 LYS CA C -1.046 8.583 3.377 1.00 . A A . 35 LYS CA 1 1 18 6103 1 1 18 LYS CB C -2.412 8.585 4.067 1.00 . A A . 35 LYS CB 1 1 18 6104 1 1 18 LYS CD C -4.533 7.352 3.525 1.00 . A A . 35 LYS CD 1 1 18 6105 1 1 18 LYS CE C -4.054 5.991 3.045 1.00 . A A . 35 LYS CE 1 1 18 6106 1 1 18 LYS CG C -3.580 8.458 3.104 1.00 . A A . 35 LYS CG 1 1 18 6107 1 1 18 LYS H H -1.677 10.283 2.284 1.00 . A A . 35 LYS H 1 1 18 6108 1 1 18 LYS HA H -0.273 8.574 4.130 1.00 . A A . 35 LYS HA 1 1 18 6109 1 1 18 LYS HB2 H -2.453 7.758 4.760 1.00 . A A . 35 LYS HB2 1 1 18 6110 1 1 18 LYS HB3 H -2.524 9.509 4.615 1.00 . A A . 35 LYS HB3 1 1 18 6111 1 1 18 LYS HD2 H -4.600 7.338 4.603 1.00 . A A . 35 LYS HD2 1 1 18 6112 1 1 18 LYS HD3 H -5.509 7.550 3.105 1.00 . A A . 35 LYS HD3 1 1 18 6113 1 1 18 LYS HE2 H -4.747 5.620 2.305 1.00 . A A . 35 LYS HE2 1 1 18 6114 1 1 18 LYS HE3 H -3.077 6.104 2.598 1.00 . A A . 35 LYS HE3 1 1 18 6115 1 1 18 LYS HG2 H -4.119 9.393 3.081 1.00 . A A . 35 LYS HG2 1 1 18 6116 1 1 18 LYS HG3 H -3.199 8.236 2.117 1.00 . A A . 35 LYS HG3 1 1 18 6117 1 1 18 LYS HZ1 H -4.181 4.052 3.813 1.00 . A A . 35 LYS HZ1 1 1 18 6118 1 1 18 LYS HZ2 H -4.646 5.254 4.908 1.00 . A A . 35 LYS HZ2 1 1 18 6119 1 1 18 LYS HZ3 H -3.007 5.011 4.565 1.00 . A A . 35 LYS HZ3 1 1 18 6120 1 1 18 LYS N N -0.881 9.792 2.580 1.00 . A A . 35 LYS N 1 1 18 6121 1 1 18 LYS NZ N -3.966 5.009 4.161 1.00 . A A . 35 LYS NZ 1 1 18 6122 1 1 18 LYS O O -0.783 6.223 3.023 1.00 . A A . 35 LYS O 1 1 18 6123 1 1 19 TRP C C 0.665 6.218 -0.149 1.00 . A A . 36 TRP C 1 1 18 6124 1 1 19 TRP CA C -0.790 6.420 0.259 1.00 . A A . 36 TRP CA 1 1 18 6125 1 1 19 TRP CB C -1.651 6.670 -0.980 1.00 . A A . 36 TRP CB 1 1 18 6126 1 1 19 TRP CD1 C -4.057 6.516 -0.111 1.00 . A A . 36 TRP CD1 1 1 18 6127 1 1 19 TRP CD2 C -3.504 4.916 -1.578 1.00 . A A . 36 TRP CD2 1 1 18 6128 1 1 19 TRP CE2 C -4.841 4.719 -1.181 1.00 . A A . 36 TRP CE2 1 1 18 6129 1 1 19 TRP CE3 C -2.937 4.031 -2.499 1.00 . A A . 36 TRP CE3 1 1 18 6130 1 1 19 TRP CG C -3.021 6.071 -0.882 1.00 . A A . 36 TRP CG 1 1 18 6131 1 1 19 TRP CH2 C -5.036 2.821 -2.574 1.00 . A A . 36 TRP CH2 1 1 18 6132 1 1 19 TRP CZ2 C -5.616 3.673 -1.674 1.00 . A A . 36 TRP CZ2 1 1 18 6133 1 1 19 TRP CZ3 C -3.708 2.993 -2.986 1.00 . A A . 36 TRP CZ3 1 1 18 6134 1 1 19 TRP H H -1.018 8.441 0.848 1.00 . A A . 36 TRP H 1 1 18 6135 1 1 19 TRP HA H -1.140 5.526 0.755 1.00 . A A . 36 TRP HA 1 1 18 6136 1 1 19 TRP HB2 H -1.762 7.734 -1.125 1.00 . A A . 36 TRP HB2 1 1 18 6137 1 1 19 TRP HB3 H -1.160 6.242 -1.842 1.00 . A A . 36 TRP HB3 1 1 18 6138 1 1 19 TRP HD1 H -4.006 7.377 0.537 1.00 . A A . 36 TRP HD1 1 1 18 6139 1 1 19 TRP HE1 H -6.021 5.821 0.158 1.00 . A A . 36 TRP HE1 1 1 18 6140 1 1 19 TRP HE3 H -1.915 4.147 -2.829 1.00 . A A . 36 TRP HE3 1 1 18 6141 1 1 19 TRP HH2 H -5.601 1.997 -2.980 1.00 . A A . 36 TRP HH2 1 1 18 6142 1 1 19 TRP HZ2 H -6.642 3.528 -1.366 1.00 . A A . 36 TRP HZ2 1 1 18 6143 1 1 19 TRP HZ3 H -3.287 2.298 -3.698 1.00 . A A . 36 TRP HZ3 1 1 18 6144 1 1 19 TRP N N -0.919 7.530 1.197 1.00 . A A . 36 TRP N 1 1 18 6145 1 1 19 TRP NE1 N -5.154 5.707 -0.286 1.00 . A A . 36 TRP NE1 1 1 18 6146 1 1 19 TRP O O 0.953 5.587 -1.167 1.00 . A A . 36 TRP O 1 1 18 6147 1 1 20 CYS C C 3.833 7.258 1.493 1.00 . A A . 37 CYS C 1 1 18 6148 1 1 20 CYS CA C 3.006 6.638 0.371 1.00 . A A . 37 CYS CA 1 1 18 6149 1 1 20 CYS CB C 3.345 7.312 -0.960 1.00 . A A . 37 CYS CB 1 1 18 6150 1 1 20 CYS H H 1.288 7.250 1.446 1.00 . A A . 37 CYS H 1 1 18 6151 1 1 20 CYS HA H 3.243 5.588 0.303 1.00 . A A . 37 CYS HA 1 1 18 6152 1 1 20 CYS HB2 H 2.756 6.859 -1.745 1.00 . A A . 37 CYS HB2 1 1 18 6153 1 1 20 CYS HB3 H 3.102 8.362 -0.896 1.00 . A A . 37 CYS HB3 1 1 18 6154 1 1 20 CYS N N 1.580 6.758 0.649 1.00 . A A . 37 CYS N 1 1 18 6155 1 1 20 CYS O O 4.633 6.578 2.136 1.00 . A A . 37 CYS O 1 1 18 6156 1 1 20 CYS SG S 5.098 7.175 -1.437 1.00 . A A . 37 CYS SG 1 1 stop_ save_
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