NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
457958 | 2w9v | 16151 | cing | 4-filtered-FRED | STAR | entry | full | 382 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2w9v # This FRED archive file contains, for PDB entry <2w9v>: # # - 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.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_2w9v _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2w9v _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4730.37 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $SHORT_DISINTEGRIN_JERDOSTATIN A . 1 1 stop_ save_ save_SHORT_DISINTEGRIN_JERDOSTATIN _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "SHORT DISINTEGRIN JERDOSTATIN" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code AMDCTTGPCCRQCKLKPAGTTCWRTSVSSHYCTGRSCECPSYPG _Entity.Number_of_monomers 44 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ALA . 1 1 2 MET . 1 1 3 ASP . 1 1 4 CYS . 1 1 5 THR . 1 1 6 THR . 1 1 7 GLY . 1 1 8 PRO . 1 1 9 CYS . 1 1 10 CYS . 1 1 11 ARG . 1 1 12 GLN . 1 1 13 CYS . 1 1 14 LYS . 1 1 15 LEU . 1 1 16 LYS . 1 1 17 PRO . 1 1 18 ALA . 1 1 19 GLY . 1 1 20 THR . 1 1 21 THR . 1 1 22 CYS . 1 1 23 TRP . 1 1 24 ARG . 1 1 25 THR . 1 1 26 SER . 1 1 27 VAL . 1 1 28 SER . 1 1 29 SER . 1 1 30 HIS . 1 1 31 TYR . 1 1 32 CYS . 1 1 33 THR . 1 1 34 GLY . 1 1 35 ARG . 1 1 36 SER . 1 1 37 CYS . 1 1 38 GLU . 1 1 39 CYS . 1 1 40 PRO . 1 1 41 SER . 1 1 42 TYR . 1 1 43 PRO . 1 1 44 GLY . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ALA 1 1 1 1 MET 2 2 1 1 ASP 3 3 1 1 CYS 4 4 1 1 THR 5 5 1 1 THR 6 6 1 1 GLY 7 7 1 1 PRO 8 8 1 1 CYS 9 9 1 1 CYS 10 10 1 1 ARG 11 11 1 1 GLN 12 12 1 1 CYS 13 13 1 1 LYS 14 14 1 1 LEU 15 15 1 1 LYS 16 16 1 1 PRO 17 17 1 1 ALA 18 18 1 1 GLY 19 19 1 1 THR 20 20 1 1 THR 21 21 1 1 CYS 22 22 1 1 TRP 23 23 1 1 ARG 24 24 1 1 THR 25 25 1 1 SER 26 26 1 1 VAL 27 27 1 1 SER 28 28 1 1 SER 29 29 1 1 HIS 30 30 1 1 TYR 31 31 1 1 CYS 32 32 1 1 THR 33 33 1 1 GLY 34 34 1 1 ARG 35 35 1 1 SER 36 36 1 1 CYS 37 37 1 1 GLU 38 38 1 1 CYS 39 39 1 1 PRO 40 40 1 1 SER 41 41 1 1 TYR 42 42 1 1 PRO 43 43 1 1 GLY 44 44 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_2 _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 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 ALA HA . 1 . HA 1 1 1 1 2 1 1 2 MET H . 2 . HN 1 1 2 1 1 1 1 2 MET H . 2 . HN 1 1 2 1 2 1 1 2 MET QG . 2 . HG# 1 1 3 1 1 1 1 2 MET HA . 2 . HA 1 1 3 1 2 1 1 3 ASP H . 3 . HN 1 1 4 1 1 1 1 2 MET QB . 2 . HB# 1 1 4 1 2 1 1 3 ASP H . 3 . HN 1 1 5 1 1 1 1 3 ASP H . 3 . HN 1 1 5 1 2 1 1 4 CYS H . 4 . HN 1 1 6 1 1 1 1 3 ASP HA . 3 . HA 1 1 6 1 2 1 1 4 CYS H . 4 . HN 1 1 7 1 1 1 1 3 ASP QB . 3 . HB# 1 1 7 1 2 1 1 4 CYS H . 4 . HN 1 1 8 1 1 1 1 3 ASP HA . 3 . HA 1 1 8 1 2 1 1 4 CYS QB . 4 . HB# 1 1 9 1 1 1 1 4 CYS HA . 4 . HA 1 1 9 1 2 1 1 5 THR H . 5 . HN 1 1 10 1 1 1 1 4 CYS QB . 4 . HB# 1 1 10 1 2 1 1 5 THR H . 5 . HN 1 1 11 1 1 1 1 4 CYS QB . 4 . HB# 1 1 11 1 2 1 1 5 THR HA . 5 . HA 1 1 12 1 1 1 1 4 CYS QB . 4 . HB# 1 1 12 1 2 1 1 6 THR MG . 6 . HG2# 1 1 13 1 1 1 1 4 CYS HA . 4 . HA 1 1 13 1 2 1 1 13 CYS H . 13 . HN 1 1 14 1 1 1 1 4 CYS QB . 4 . HB# 1 1 14 1 2 1 1 13 CYS H . 13 . HN 1 1 15 1 1 1 1 5 THR HA . 5 . HA 1 1 15 1 2 1 1 6 THR H . 6 . HN 1 1 16 1 1 1 1 5 THR HB . 5 . HB 1 1 16 1 2 1 1 6 THR H . 6 . HN 1 1 17 1 1 1 1 5 THR MG . 5 . HG2# 1 1 17 1 2 1 1 6 THR H . 6 . HN 1 1 18 1 1 1 1 5 THR H . 5 . HN 1 1 18 1 2 1 1 13 CYS HA . 13 . HA 1 1 19 1 1 1 1 5 THR HA . 5 . HA 1 1 19 1 2 1 1 37 CYS H . 37 . HN 1 1 20 1 1 1 1 5 THR MG . 5 . HG2# 1 1 20 1 2 1 1 37 CYS H . 37 . HN 1 1 21 1 1 1 1 5 THR MG . 5 . HG2# 1 1 21 1 2 1 1 37 CYS QB . 37 . HB# 1 1 22 1 1 1 1 6 THR HA . 6 . HA 1 1 22 1 2 1 1 7 GLY H . 7 . HN 1 1 23 1 1 1 1 6 THR HB . 6 . HB 1 1 23 1 2 1 1 7 GLY H . 7 . HN 1 1 24 1 1 1 1 6 THR MG . 6 . HG2# 1 1 24 1 2 1 1 7 GLY H . 7 . HN 1 1 25 1 1 1 1 6 THR HA . 6 . HA 1 1 25 1 2 1 1 10 CYS QB . 10 . HB# 1 1 26 1 1 1 1 6 THR MG . 6 . HG2# 1 1 26 1 2 1 1 12 GLN HA . 12 . HA 1 1 27 1 1 1 1 6 THR MG . 6 . HG2# 1 1 27 1 2 1 1 13 CYS H . 13 . HN 1 1 28 1 1 1 1 7 GLY H . 7 . HN 1 1 28 1 2 1 1 8 PRO QD . 8 . HD# 1 1 29 1 1 1 1 7 GLY QA . 7 . HA# 1 1 29 1 2 1 1 8 PRO QD . 8 . HD# 1 1 30 1 1 1 1 7 GLY H . 7 . HN 1 1 30 1 2 1 1 10 CYS QB . 10 . HB# 1 1 31 1 1 1 1 7 GLY H . 7 . HN 1 1 31 1 2 1 1 37 CYS QB . 37 . HB# 1 1 32 1 1 1 1 7 GLY QA . 7 . HA# 1 1 32 1 2 1 1 37 CYS QB . 37 . HB# 1 1 33 1 1 1 1 8 PRO HA . 8 . HA 1 1 33 1 2 1 1 9 CYS H . 9 . HN 1 1 34 1 1 1 1 8 PRO QB . 8 . HB# 1 1 34 1 2 1 1 9 CYS H . 9 . HN 1 1 35 1 1 1 1 8 PRO QG . 8 . HG# 1 1 35 1 2 1 1 9 CYS H . 9 . HN 1 1 36 1 1 1 1 8 PRO QD . 8 . HD# 1 1 36 1 2 1 1 9 CYS H . 9 . HN 1 1 37 1 1 1 1 8 PRO QB . 8 . HB# 1 1 37 1 2 1 1 22 CYS HA . 22 . HA 1 1 38 1 1 1 1 8 PRO QB . 8 . HB# 1 1 38 1 2 1 1 22 CYS QB . 22 . HB# 1 1 39 1 1 1 1 8 PRO QG . 8 . HG# 1 1 39 1 2 1 1 22 CYS QB . 22 . HB# 1 1 40 1 1 1 1 8 PRO QD . 8 . HD# 1 1 40 1 2 1 1 37 CYS QB . 37 . HB# 1 1 41 1 1 1 1 8 PRO QD . 8 . HD# 1 1 41 1 2 1 1 38 GLU HA . 38 . HA 1 1 42 1 1 1 1 8 PRO QG . 8 . HG# 1 1 42 1 2 1 1 39 CYS H . 39 . HN 1 1 43 1 1 1 1 8 PRO QD . 8 . HD# 1 1 43 1 2 1 1 39 CYS H . 39 . HN 1 1 44 1 1 1 1 8 PRO QB . 8 . HB# 1 1 44 1 2 1 1 39 CYS QB . 39 . HB# 1 1 45 1 1 1 1 8 PRO QG . 8 . HG# 1 1 45 1 2 1 1 39 CYS QB . 39 . HB# 1 1 46 1 1 1 1 9 CYS H . 9 . HN 1 1 46 1 2 1 1 10 CYS H . 10 . HN 1 1 47 1 1 1 1 9 CYS HA . 9 . HA 1 1 47 1 2 1 1 10 CYS H . 10 . HN 1 1 48 1 1 1 1 9 CYS QB . 9 . HB# 1 1 48 1 2 1 1 10 CYS H . 10 . HN 1 1 49 1 1 1 1 9 CYS QB . 9 . HB# 1 1 49 1 2 1 1 15 LEU QD . 15 . HD# 1 1 50 1 1 1 1 9 CYS HA . 9 . HA 1 1 50 1 2 1 1 16 LYS QB . 16 . HB# 1 1 51 1 1 1 1 9 CYS HA . 9 . HA 1 1 51 1 2 1 1 16 LYS QG . 16 . HG# 1 1 52 1 1 1 1 9 CYS HA . 9 . HA 1 1 52 1 2 1 1 16 LYS QD . 16 . HD# 1 1 53 1 1 1 1 9 CYS HA . 9 . HA 1 1 53 1 2 1 1 16 LYS QE . 16 . HE# 1 1 54 1 1 1 1 9 CYS H . 9 . HN 1 1 54 1 2 1 1 37 CYS HA . 37 . HA 1 1 55 1 1 1 1 9 CYS H . 9 . HN 1 1 55 1 2 1 1 37 CYS QB . 37 . HB# 1 1 56 1 1 1 1 9 CYS QB . 9 . HB# 1 1 56 1 2 1 1 37 CYS HA . 37 . HA 1 1 57 1 1 1 1 9 CYS H . 9 . HN 1 1 57 1 2 1 1 38 GLU HA . 38 . HA 1 1 58 1 1 1 1 9 CYS QB . 9 . HB# 1 1 58 1 2 1 1 38 GLU H . 38 . HN 1 1 59 1 1 1 1 9 CYS QB . 9 . HB# 1 1 59 1 2 1 1 38 GLU HA . 38 . HA 1 1 60 1 1 1 1 9 CYS QB . 9 . HB# 1 1 60 1 2 1 1 39 CYS HA . 39 . HA 1 1 61 1 1 1 1 10 CYS H . 10 . HN 1 1 61 1 2 1 1 11 ARG H . 11 . HN 1 1 62 1 1 1 1 10 CYS HA . 10 . HA 1 1 62 1 2 1 1 11 ARG H . 11 . HN 1 1 63 1 1 1 1 10 CYS QB . 10 . HB# 1 1 63 1 2 1 1 11 ARG H . 11 . HN 1 1 64 1 1 1 1 10 CYS QB . 10 . HB# 1 1 64 1 2 1 1 13 CYS H . 13 . HN 1 1 65 1 1 1 1 10 CYS HA . 10 . HA 1 1 65 1 2 1 1 14 LYS H . 14 . HN 1 1 66 1 1 1 1 10 CYS QB . 10 . HB# 1 1 66 1 2 1 1 14 LYS H . 14 . HN 1 1 67 1 1 1 1 10 CYS H . 10 . HN 1 1 67 1 2 1 1 15 LEU QD . 15 . HD# 1 1 68 1 1 1 1 10 CYS HA . 10 . HA 1 1 68 1 2 1 1 15 LEU H . 15 . HN 1 1 69 1 1 1 1 10 CYS HA . 10 . HA 1 1 69 1 2 1 1 15 LEU HA . 15 . HA 1 1 70 1 1 1 1 10 CYS HA . 10 . HA 1 1 70 1 2 1 1 15 LEU QB . 15 . HB# 1 1 71 1 1 1 1 10 CYS HA . 10 . HA 1 1 71 1 2 1 1 15 LEU QD . 15 . HD# 1 1 72 1 1 1 1 10 CYS QB . 10 . HB# 1 1 72 1 2 1 1 15 LEU HA . 15 . HA 1 1 73 1 1 1 1 10 CYS QB . 10 . HB# 1 1 73 1 2 1 1 15 LEU QB . 15 . HB# 1 1 74 1 1 1 1 10 CYS QB . 10 . HB# 1 1 74 1 2 1 1 15 LEU QD . 15 . HD# 1 1 75 1 1 1 1 10 CYS H . 10 . HN 1 1 75 1 2 1 1 16 LYS QB . 16 . HB# 1 1 76 1 1 1 1 10 CYS H . 10 . HN 1 1 76 1 2 1 1 16 LYS QG . 16 . HG# 1 1 77 1 1 1 1 10 CYS H . 10 . HN 1 1 77 1 2 1 1 16 LYS QE . 16 . HE# 1 1 78 1 1 1 1 10 CYS HA . 10 . HA 1 1 78 1 2 1 1 16 LYS H . 16 . HN 1 1 79 1 1 1 1 10 CYS HA . 10 . HA 1 1 79 1 2 1 1 16 LYS QB . 16 . HB# 1 1 80 1 1 1 1 10 CYS HA . 10 . HA 1 1 80 1 2 1 1 16 LYS QG . 16 . HG# 1 1 81 1 1 1 1 10 CYS HA . 10 . HA 1 1 81 1 2 1 1 16 LYS QD . 16 . HD# 1 1 82 1 1 1 1 10 CYS HA . 10 . HA 1 1 82 1 2 1 1 16 LYS QE . 16 . HE# 1 1 83 1 1 1 1 10 CYS QB . 10 . HB# 1 1 83 1 2 1 1 16 LYS H . 16 . HN 1 1 84 1 1 1 1 10 CYS H . 10 . HN 1 1 84 1 2 1 1 37 CYS HA . 37 . HA 1 1 85 1 1 1 1 10 CYS H . 10 . HN 1 1 85 1 2 1 1 37 CYS QB . 37 . HB# 1 1 86 1 1 1 1 10 CYS QB . 10 . HB# 1 1 86 1 2 1 1 37 CYS HA . 37 . HA 1 1 87 1 1 1 1 10 CYS QB . 10 . HB# 1 1 87 1 2 1 1 37 CYS QB . 37 . HB# 1 1 88 1 1 1 1 11 ARG H . 11 . HN 1 1 88 1 2 1 1 11 ARG QG . 11 . HG# 1 1 89 1 1 1 1 11 ARG H . 11 . HN 1 1 89 1 2 1 1 11 ARG QD . 11 . HD# 1 1 90 1 1 1 1 11 ARG HA . 11 . HA 1 1 90 1 2 1 1 12 GLN H . 12 . HN 1 1 91 1 1 1 1 11 ARG QB . 11 . HB# 1 1 91 1 2 1 1 12 GLN H . 12 . HN 1 1 92 1 1 1 1 11 ARG QG . 11 . HG# 1 1 92 1 2 1 1 12 GLN H . 12 . HN 1 1 93 1 1 1 1 11 ARG HA . 11 . HA 1 1 93 1 2 1 1 13 CYS H . 13 . HN 1 1 94 1 1 1 1 11 ARG H . 11 . HN 1 1 94 1 2 1 1 14 LYS H . 14 . HN 1 1 95 1 1 1 1 11 ARG H . 11 . HN 1 1 95 1 2 1 1 14 LYS QB . 14 . HB# 1 1 96 1 1 1 1 11 ARG H . 11 . HN 1 1 96 1 2 1 1 15 LEU HA . 15 . HA 1 1 97 1 1 1 1 11 ARG H . 11 . HN 1 1 97 1 2 1 1 15 LEU QD . 15 . HD# 1 1 98 1 1 1 1 11 ARG H . 11 . HN 1 1 98 1 2 1 1 16 LYS H . 16 . HN 1 1 99 1 1 1 1 11 ARG H . 11 . HN 1 1 99 1 2 1 1 16 LYS QG . 16 . HG# 1 1 100 1 1 1 1 11 ARG H . 11 . HN 1 1 100 1 2 1 1 16 LYS QE . 16 . HE# 1 1 101 1 1 1 1 12 GLN H . 12 . HN 1 1 101 1 2 1 1 12 GLN QG . 12 . HG# 1 1 102 1 1 1 1 12 GLN H . 12 . HN 1 1 102 1 2 1 1 13 CYS H . 13 . HN 1 1 103 1 1 1 1 12 GLN HA . 12 . HA 1 1 103 1 2 1 1 13 CYS H . 13 . HN 1 1 104 1 1 1 1 12 GLN QB . 12 . HB# 1 1 104 1 2 1 1 13 CYS H . 13 . HN 1 1 105 1 1 1 1 12 GLN QG . 12 . HG# 1 1 105 1 2 1 1 13 CYS H . 13 . HN 1 1 106 1 1 1 1 12 GLN HA . 12 . HA 1 1 106 1 2 1 1 14 LYS H . 14 . HN 1 1 107 1 1 1 1 12 GLN QB . 12 . HB# 1 1 107 1 2 1 1 14 LYS H . 14 . HN 1 1 108 1 1 1 1 13 CYS H . 13 . HN 1 1 108 1 2 1 1 14 LYS H . 14 . HN 1 1 109 1 1 1 1 13 CYS H . 13 . HN 1 1 109 1 2 1 1 14 LYS QG . 14 . HG# 1 1 110 1 1 1 1 13 CYS HA . 13 . HA 1 1 110 1 2 1 1 14 LYS H . 14 . HN 1 1 111 1 1 1 1 13 CYS QB . 13 . HB# 1 1 111 1 2 1 1 14 LYS H . 14 . HN 1 1 112 1 1 1 1 14 LYS H . 14 . HN 1 1 112 1 2 1 1 14 LYS QG . 14 . HG# 1 1 113 1 1 1 1 14 LYS H . 14 . HN 1 1 113 1 2 1 1 15 LEU H . 15 . HN 1 1 114 1 1 1 1 14 LYS HA . 14 . HA 1 1 114 1 2 1 1 15 LEU H . 15 . HN 1 1 115 1 1 1 1 14 LYS QB . 14 . HB# 1 1 115 1 2 1 1 15 LEU H . 15 . HN 1 1 116 1 1 1 1 14 LYS QG . 14 . HG# 1 1 116 1 2 1 1 15 LEU H . 15 . HN 1 1 117 1 1 1 1 14 LYS H . 14 . HN 1 1 117 1 2 1 1 16 LYS HA . 16 . HA 1 1 118 1 1 1 1 15 LEU H . 15 . HN 1 1 118 1 2 1 1 15 LEU HG . 15 . HG 1 1 119 1 1 1 1 15 LEU H . 15 . HN 1 1 119 1 2 1 1 15 LEU QD . 15 . HD# 1 1 120 1 1 1 1 15 LEU HA . 15 . HA 1 1 120 1 2 1 1 16 LYS H . 16 . HN 1 1 121 1 1 1 1 15 LEU HA . 15 . HA 1 1 121 1 2 1 1 16 LYS QG . 16 . HG# 1 1 122 1 1 1 1 15 LEU QB . 15 . HB# 1 1 122 1 2 1 1 16 LYS H . 16 . HN 1 1 123 1 1 1 1 15 LEU QD . 15 . HD# 1 1 123 1 2 1 1 16 LYS H . 16 . HN 1 1 124 1 1 1 1 15 LEU QD . 15 . HD# 1 1 124 1 2 1 1 18 ALA H . 18 . HN 1 1 125 1 1 1 1 15 LEU QD . 15 . HD# 1 1 125 1 2 1 1 34 GLY H . 34 . HN 1 1 126 1 1 1 1 15 LEU QB . 15 . HB# 1 1 126 1 2 1 1 34 GLY H . 34 . HN 1 1 127 1 1 1 1 15 LEU QD . 15 . HD# 1 1 127 1 2 1 1 35 ARG H . 35 . HN 1 1 128 1 1 1 1 15 LEU QD . 15 . HD# 1 1 128 1 2 1 1 35 ARG HA . 35 . HA 1 1 129 1 1 1 1 15 LEU QB . 15 . HB# 1 1 129 1 2 1 1 36 SER H . 36 . HN 1 1 130 1 1 1 1 15 LEU QD . 15 . HD# 1 1 130 1 2 1 1 36 SER H . 36 . HN 1 1 131 1 1 1 1 15 LEU QD . 15 . HD# 1 1 131 1 2 1 1 36 SER HA . 36 . HA 1 1 132 1 1 1 1 15 LEU QD . 15 . HD# 1 1 132 1 2 1 1 36 SER QB . 36 . HB# 1 1 133 1 1 1 1 15 LEU QB . 15 . HB# 1 1 133 1 2 1 1 37 CYS H . 37 . HN 1 1 134 1 1 1 1 15 LEU QD . 15 . HD# 1 1 134 1 2 1 1 37 CYS H . 37 . HN 1 1 135 1 1 1 1 15 LEU QD . 15 . HD# 1 1 135 1 2 1 1 37 CYS HA . 37 . HA 1 1 136 1 1 1 1 15 LEU QD . 15 . HD# 1 1 136 1 2 1 1 38 GLU H . 38 . HN 1 1 137 1 1 1 1 16 LYS H . 16 . HN 1 1 137 1 2 1 1 16 LYS QG . 16 . HG# 1 1 138 1 1 1 1 16 LYS H . 16 . HN 1 1 138 1 2 1 1 16 LYS QD . 16 . HD# 1 1 139 1 1 1 1 16 LYS H . 16 . HN 1 1 139 1 2 1 1 17 PRO QD . 17 . HD# 1 1 140 1 1 1 1 16 LYS HA . 16 . HA 1 1 140 1 2 1 1 17 PRO QD . 17 . HD# 1 1 141 1 1 1 1 16 LYS QG . 16 . HG# 1 1 141 1 2 1 1 17 PRO QD . 17 . HD# 1 1 142 1 1 1 1 16 LYS HA . 16 . HA 1 1 142 1 2 1 1 20 THR MG . 20 . HG2# 1 1 143 1 1 1 1 16 LYS QB . 16 . HB# 1 1 143 1 2 1 1 20 THR HB . 20 . HB 1 1 144 1 1 1 1 16 LYS QB . 16 . HB# 1 1 144 1 2 1 1 20 THR MG . 20 . HG2# 1 1 145 1 1 1 1 16 LYS QD . 16 . HD# 1 1 145 1 2 1 1 20 THR MG . 20 . HG2# 1 1 146 1 1 1 1 16 LYS QE . 16 . HE# 1 1 146 1 2 1 1 20 THR MG . 20 . HG2# 1 1 147 1 1 1 1 16 LYS QB . 16 . HB# 1 1 147 1 2 1 1 32 CYS QB . 32 . HB# 1 1 148 1 1 1 1 17 PRO HA . 17 . HA 1 1 148 1 2 1 1 18 ALA H . 18 . HN 1 1 149 1 1 1 1 17 PRO QB . 17 . HB# 1 1 149 1 2 1 1 18 ALA H . 18 . HN 1 1 150 1 1 1 1 17 PRO QG . 17 . HG# 1 1 150 1 2 1 1 18 ALA H . 18 . HN 1 1 151 1 1 1 1 17 PRO HA . 17 . HA 1 1 151 1 2 1 1 18 ALA MB . 18 . HB# 1 1 152 1 1 1 1 17 PRO QB . 17 . HB# 1 1 152 1 2 1 1 18 ALA MB . 18 . HB# 1 1 153 1 1 1 1 17 PRO QB . 17 . HB# 1 1 153 1 2 1 1 19 GLY H . 19 . HN 1 1 154 1 1 1 1 17 PRO QB . 17 . HB# 1 1 154 1 2 1 1 20 THR H . 20 . HN 1 1 155 1 1 1 1 17 PRO QG . 17 . HG# 1 1 155 1 2 1 1 20 THR H . 20 . HN 1 1 156 1 1 1 1 17 PRO QD . 17 . HD# 1 1 156 1 2 1 1 20 THR MG . 20 . HG2# 1 1 157 1 1 1 1 18 ALA H . 18 . HN 1 1 157 1 2 1 1 19 GLY H . 19 . HN 1 1 158 1 1 1 1 18 ALA HA . 18 . HA 1 1 158 1 2 1 1 19 GLY H . 19 . HN 1 1 159 1 1 1 1 18 ALA MB . 18 . HB# 1 1 159 1 2 1 1 19 GLY H . 19 . HN 1 1 160 1 1 1 1 18 ALA HA . 18 . HA 1 1 160 1 2 1 1 19 GLY QA . 19 . HA# 1 1 161 1 1 1 1 18 ALA MB . 18 . HB# 1 1 161 1 2 1 1 19 GLY QA . 19 . HA# 1 1 162 1 1 1 1 18 ALA H . 18 . HN 1 1 162 1 2 1 1 20 THR H . 20 . HN 1 1 163 1 1 1 1 18 ALA MB . 18 . HB# 1 1 163 1 2 1 1 20 THR H . 20 . HN 1 1 164 1 1 1 1 18 ALA HA . 18 . HA 1 1 164 1 2 1 1 20 THR H . 20 . HN 1 1 165 1 1 1 1 18 ALA H . 18 . HN 1 1 165 1 2 1 1 32 CYS QB . 32 . HB# 1 1 166 1 1 1 1 18 ALA HA . 18 . HA 1 1 166 1 2 1 1 32 CYS H . 32 . HN 1 1 167 1 1 1 1 18 ALA HA . 18 . HA 1 1 167 1 2 1 1 33 THR H . 33 . HN 1 1 168 1 1 1 1 18 ALA HA . 18 . HA 1 1 168 1 2 1 1 33 THR HA . 33 . HA 1 1 169 1 1 1 1 18 ALA HA . 18 . HA 1 1 169 1 2 1 1 33 THR MG . 33 . HG2# 1 1 170 1 1 1 1 18 ALA MB . 18 . HB# 1 1 170 1 2 1 1 33 THR H . 33 . HN 1 1 171 1 1 1 1 18 ALA MB . 18 . HB# 1 1 171 1 2 1 1 33 THR HA . 33 . HA 1 1 172 1 1 1 1 18 ALA H . 18 . HN 1 1 172 1 2 1 1 34 GLY H . 34 . HN 1 1 173 1 1 1 1 18 ALA H . 18 . HN 1 1 173 1 2 1 1 34 GLY QA . 34 . HA# 1 1 174 1 1 1 1 18 ALA HA . 18 . HA 1 1 174 1 2 1 1 34 GLY QA . 34 . HA# 1 1 175 1 1 1 1 18 ALA MB . 18 . HB# 1 1 175 1 2 1 1 34 GLY H . 34 . HN 1 1 176 1 1 1 1 18 ALA MB . 18 . HB# 1 1 176 1 2 1 1 34 GLY QA . 34 . HA# 1 1 177 1 1 1 1 18 ALA MB . 18 . HB# 1 1 177 1 2 1 1 35 ARG H . 35 . HN 1 1 178 1 1 1 1 19 GLY H . 19 . HN 1 1 178 1 2 1 1 20 THR H . 20 . HN 1 1 179 1 1 1 1 19 GLY QA . 19 . HA# 1 1 179 1 2 1 1 20 THR H . 20 . HN 1 1 180 1 1 1 1 19 GLY H . 19 . HN 1 1 180 1 2 1 1 31 TYR HA . 31 . HA 1 1 181 1 1 1 1 19 GLY H . 19 . HN 1 1 181 1 2 1 1 31 TYR QB . 31 . HB# 1 1 182 1 1 1 1 19 GLY H . 19 . HN 1 1 182 1 2 1 1 31 TYR QD . 31 . HD# 1 1 183 1 1 1 1 19 GLY QA . 19 . HA# 1 1 183 1 2 1 1 31 TYR QB . 31 . HB# 1 1 184 1 1 1 1 19 GLY QA . 19 . HA# 1 1 184 1 2 1 1 31 TYR QD . 31 . HD# 1 1 185 1 1 1 1 19 GLY QA . 19 . HA# 1 1 185 1 2 1 1 31 TYR QE . 31 . HE# 1 1 186 1 1 1 1 19 GLY H . 19 . HN 1 1 186 1 2 1 1 32 CYS H . 32 . HN 1 1 187 1 1 1 1 19 GLY H . 19 . HN 1 1 187 1 2 1 1 32 CYS QB . 32 . HB# 1 1 188 1 1 1 1 19 GLY QA . 19 . HA# 1 1 188 1 2 1 1 32 CYS H . 32 . HN 1 1 189 1 1 1 1 19 GLY H . 19 . HN 1 1 189 1 2 1 1 33 THR HA . 33 . HA 1 1 190 1 1 1 1 20 THR H . 20 . HN 1 1 190 1 2 1 1 21 THR H . 21 . HN 1 1 191 1 1 1 1 20 THR H . 20 . HN 1 1 191 1 2 1 1 21 THR MG . 21 . HG2# 1 1 192 1 1 1 1 20 THR HA . 20 . HA 1 1 192 1 2 1 1 21 THR H . 21 . HN 1 1 193 1 1 1 1 20 THR HB . 20 . HB 1 1 193 1 2 1 1 21 THR H . 21 . HN 1 1 194 1 1 1 1 20 THR MG . 20 . HG2# 1 1 194 1 2 1 1 21 THR H . 21 . HN 1 1 195 1 1 1 1 20 THR MG . 20 . HG2# 1 1 195 1 2 1 1 21 THR HA . 21 . HA 1 1 196 1 1 1 1 20 THR MG . 20 . HG2# 1 1 196 1 2 1 1 21 THR HB . 21 . HB 1 1 197 1 1 1 1 20 THR MG . 20 . HG2# 1 1 197 1 2 1 1 22 CYS HA . 22 . HA 1 1 198 1 1 1 1 20 THR MG . 20 . HG2# 1 1 198 1 2 1 1 22 CYS QB . 22 . HB# 1 1 199 1 1 1 1 20 THR H . 20 . HN 1 1 199 1 2 1 1 31 TYR HA . 31 . HA 1 1 200 1 1 1 1 20 THR H . 20 . HN 1 1 200 1 2 1 1 31 TYR QB . 31 . HB# 1 1 201 1 1 1 1 20 THR HA . 20 . HA 1 1 201 1 2 1 1 31 TYR QD . 31 . HD# 1 1 202 1 1 1 1 20 THR H . 20 . HN 1 1 202 1 2 1 1 32 CYS H . 32 . HN 1 1 203 1 1 1 1 20 THR H . 20 . HN 1 1 203 1 2 1 1 32 CYS HA . 32 . HA 1 1 204 1 1 1 1 20 THR HA . 20 . HA 1 1 204 1 2 1 1 32 CYS H . 32 . HN 1 1 205 1 1 1 1 20 THR H . 20 . HN 1 1 205 1 2 1 1 32 CYS QB . 32 . HB# 1 1 206 1 1 1 1 20 THR HB . 20 . HB 1 1 206 1 2 1 1 32 CYS H . 32 . HN 1 1 207 1 1 1 1 20 THR HB . 20 . HB 1 1 207 1 2 1 1 32 CYS QB . 32 . HB# 1 1 208 1 1 1 1 20 THR MG . 20 . HG2# 1 1 208 1 2 1 1 32 CYS H . 32 . HN 1 1 209 1 1 1 1 20 THR MG . 20 . HG2# 1 1 209 1 2 1 1 32 CYS QB . 32 . HB# 1 1 210 1 1 1 1 21 THR HA . 21 . HA 1 1 210 1 2 1 1 22 CYS H . 22 . HN 1 1 211 1 1 1 1 21 THR HB . 21 . HB 1 1 211 1 2 1 1 22 CYS H . 22 . HN 1 1 212 1 1 1 1 21 THR MG . 21 . HG2# 1 1 212 1 2 1 1 22 CYS H . 22 . HN 1 1 213 1 1 1 1 21 THR MG . 21 . HG2# 1 1 213 1 2 1 1 22 CYS HA . 22 . HA 1 1 214 1 1 1 1 21 THR MG . 21 . HG2# 1 1 214 1 2 1 1 23 TRP H . 23 . HN 1 1 215 1 1 1 1 21 THR MG . 21 . HG2# 1 1 215 1 2 1 1 24 ARG QD . 24 . HD# 1 1 216 1 1 1 1 21 THR MG . 21 . HG2# 1 1 216 1 2 1 1 24 ARG HE . 24 . HE 1 1 217 1 1 1 1 21 THR MG . 21 . HG2# 1 1 217 1 2 1 1 29 SER QB . 29 . HB# 1 1 218 1 1 1 1 21 THR HA . 21 . HA 1 1 218 1 2 1 1 30 HIS H . 30 . HN 1 1 219 1 1 1 1 21 THR MG . 21 . HG2# 1 1 219 1 2 1 1 30 HIS H . 30 . HN 1 1 220 1 1 1 1 21 THR H . 21 . HN 1 1 220 1 2 1 1 31 TYR QD . 31 . HD# 1 1 221 1 1 1 1 21 THR H . 21 . HN 1 1 221 1 2 1 1 31 TYR QE . 31 . HE# 1 1 222 1 1 1 1 21 THR HA . 21 . HA 1 1 222 1 2 1 1 31 TYR HA . 31 . HA 1 1 223 1 1 1 1 21 THR HA . 21 . HA 1 1 223 1 2 1 1 31 TYR QD . 31 . HD# 1 1 224 1 1 1 1 21 THR HA . 21 . HA 1 1 224 1 2 1 1 31 TYR QE . 31 . HE# 1 1 225 1 1 1 1 21 THR HB . 21 . HB 1 1 225 1 2 1 1 31 TYR QD . 31 . HD# 1 1 226 1 1 1 1 21 THR HB . 21 . HB 1 1 226 1 2 1 1 31 TYR QE . 31 . HE# 1 1 227 1 1 1 1 21 THR MG . 21 . HG2# 1 1 227 1 2 1 1 31 TYR HA . 31 . HA 1 1 228 1 1 1 1 21 THR MG . 21 . HG2# 1 1 228 1 2 1 1 31 TYR QD . 31 . HD# 1 1 229 1 1 1 1 21 THR MG . 21 . HG2# 1 1 229 1 2 1 1 31 TYR QE . 31 . HE# 1 1 230 1 1 1 1 21 THR HA . 21 . HA 1 1 230 1 2 1 1 32 CYS H . 32 . HN 1 1 231 1 1 1 1 21 THR MG . 21 . HG2# 1 1 231 1 2 1 1 32 CYS H . 32 . HN 1 1 232 1 1 1 1 22 CYS H . 22 . HN 1 1 232 1 2 1 1 23 TRP H . 23 . HN 1 1 233 1 1 1 1 22 CYS HA . 22 . HA 1 1 233 1 2 1 1 23 TRP H . 23 . HN 1 1 234 1 1 1 1 22 CYS H . 22 . HN 1 1 234 1 2 1 1 30 HIS H . 30 . HN 1 1 235 1 1 1 1 22 CYS H . 22 . HN 1 1 235 1 2 1 1 31 TYR HA . 31 . HA 1 1 236 1 1 1 1 22 CYS H . 22 . HN 1 1 236 1 2 1 1 31 TYR QD . 31 . HD# 1 1 237 1 1 1 1 22 CYS H . 22 . HN 1 1 237 1 2 1 1 32 CYS H . 32 . HN 1 1 238 1 1 1 1 22 CYS QB . 22 . HB# 1 1 238 1 2 1 1 32 CYS H . 32 . HN 1 1 239 1 1 1 1 22 CYS HA . 22 . HA 1 1 239 1 2 1 1 39 CYS QB . 39 . HB# 1 1 240 1 1 1 1 22 CYS QB . 22 . HB# 1 1 240 1 2 1 1 39 CYS HA . 39 . HA 1 1 241 1 1 1 1 22 CYS QB . 22 . HB# 1 1 241 1 2 1 1 39 CYS QB . 39 . HB# 1 1 242 1 1 1 1 23 TRP HA . 23 . HA 1 1 242 1 2 1 1 24 ARG H . 24 . HN 1 1 243 1 1 1 1 23 TRP HD1 . 23 . HD1 1 1 243 1 2 1 1 25 THR MG . 25 . HG2# 1 1 244 1 1 1 1 23 TRP HE1 . 23 . HE1 1 1 244 1 2 1 1 25 THR MG . 25 . HG2# 1 1 245 1 1 1 1 23 TRP HZ2 . 23 . HZ2 1 1 245 1 2 1 1 25 THR MG . 25 . HG2# 1 1 246 1 1 1 1 23 TRP HH2 . 23 . HH2 1 1 246 1 2 1 1 25 THR MG . 25 . HG2# 1 1 247 1 1 1 1 23 TRP QB . 23 . HB# 1 1 247 1 2 1 1 30 HIS H . 30 . HN 1 1 248 1 1 1 1 23 TRP QB . 23 . HB# 1 1 248 1 2 1 1 30 HIS QB . 30 . HB# 1 1 249 1 1 1 1 23 TRP QB . 23 . HB# 1 1 249 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 250 1 1 1 1 24 ARG HA . 24 . HA 1 1 250 1 2 1 1 25 THR H . 25 . HN 1 1 251 1 1 1 1 24 ARG QB . 24 . HB# 1 1 251 1 2 1 1 25 THR H . 25 . HN 1 1 252 1 1 1 1 24 ARG QG . 24 . HG# 1 1 252 1 2 1 1 25 THR H . 25 . HN 1 1 253 1 1 1 1 24 ARG HA . 24 . HA 1 1 253 1 2 1 1 28 SER H . 28 . HN 1 1 254 1 1 1 1 24 ARG HA . 24 . HA 1 1 254 1 2 1 1 30 HIS H . 30 . HN 1 1 255 1 1 1 1 24 ARG HA . 24 . HA 1 1 255 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 256 1 1 1 1 25 THR H . 25 . HN 1 1 256 1 2 1 1 26 SER H . 26 . HN 1 1 257 1 1 1 1 25 THR HA . 25 . HA 1 1 257 1 2 1 1 26 SER H . 26 . HN 1 1 258 1 1 1 1 25 THR MG . 25 . HG2# 1 1 258 1 2 1 1 26 SER H . 26 . HN 1 1 259 1 1 1 1 25 THR H . 25 . HN 1 1 259 1 2 1 1 27 VAL H . 27 . HN 1 1 260 1 1 1 1 25 THR H . 25 . HN 1 1 260 1 2 1 1 28 SER H . 28 . HN 1 1 261 1 1 1 1 26 SER H . 26 . HN 1 1 261 1 2 1 1 27 VAL H . 27 . HN 1 1 262 1 1 1 1 26 SER HA . 26 . HA 1 1 262 1 2 1 1 27 VAL H . 27 . HN 1 1 263 1 1 1 1 26 SER QB . 26 . HB# 1 1 263 1 2 1 1 27 VAL H . 27 . HN 1 1 264 1 1 1 1 26 SER HA . 26 . HA 1 1 264 1 2 1 1 27 VAL QG . 27 . HG# 1 1 265 1 1 1 1 26 SER QB . 26 . HB# 1 1 265 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 266 1 1 1 1 26 SER QB . 26 . HB# 1 1 266 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 267 1 1 1 1 26 SER H . 26 . HN 1 1 267 1 2 1 1 28 SER H . 28 . HN 1 1 268 1 1 1 1 26 SER QB . 26 . HB# 1 1 268 1 2 1 1 28 SER H . 28 . HN 1 1 269 1 1 1 1 27 VAL H . 27 . HN 1 1 269 1 2 1 1 28 SER H . 28 . HN 1 1 270 1 1 1 1 27 VAL HA . 27 . HA 1 1 270 1 2 1 1 28 SER H . 28 . HN 1 1 271 1 1 1 1 27 VAL HB . 27 . HB 1 1 271 1 2 1 1 28 SER H . 28 . HN 1 1 272 1 1 1 1 27 VAL QG . 27 . HG# 1 1 272 1 2 1 1 28 SER H . 28 . HN 1 1 273 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 273 1 2 1 1 28 SER QB . 28 . HB# 1 1 274 1 1 1 1 27 VAL MG2 . 27 . HG2# 1 1 274 1 2 1 1 28 SER QB . 28 . HB# 1 1 275 1 1 1 1 28 SER HA . 28 . HA 1 1 275 1 2 1 1 29 SER H . 29 . HN 1 1 276 1 1 1 1 28 SER QB . 28 . HB# 1 1 276 1 2 1 1 29 SER H . 29 . HN 1 1 277 1 1 1 1 28 SER QB . 28 . HB# 1 1 277 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 278 1 1 1 1 29 SER H . 29 . HN 1 1 278 1 2 1 1 30 HIS H . 30 . HN 1 1 279 1 1 1 1 29 SER HA . 29 . HA 1 1 279 1 2 1 1 30 HIS H . 30 . HN 1 1 280 1 1 1 1 29 SER H . 29 . HN 1 1 280 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 281 1 1 1 1 29 SER QB . 29 . HB# 1 1 281 1 2 1 1 30 HIS H . 30 . HN 1 1 282 1 1 1 1 29 SER QB . 29 . HB# 1 1 282 1 2 1 1 31 TYR QE . 31 . HE# 1 1 283 1 1 1 1 30 HIS H . 30 . HN 1 1 283 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 284 1 1 1 1 30 HIS HA . 30 . HA 1 1 284 1 2 1 1 31 TYR H . 31 . HN 1 1 285 1 1 1 1 30 HIS HA . 30 . HA 1 1 285 1 2 1 1 31 TYR QD . 31 . HD# 1 1 286 1 1 1 1 30 HIS QB . 30 . HB# 1 1 286 1 2 1 1 31 TYR H . 31 . HN 1 1 287 1 1 1 1 30 HIS QB . 30 . HB# 1 1 287 1 2 1 1 40 PRO QD . 40 . HD# 1 1 288 1 1 1 1 30 HIS QB . 30 . HB# 1 1 288 1 2 1 1 40 PRO QG . 40 . HG# 1 1 289 1 1 1 1 30 HIS HE1 . 30 . HE1 1 1 289 1 2 1 1 41 SER HA . 41 . HA 1 1 290 1 1 1 1 30 HIS HE1 . 30 . HE1 1 1 290 1 2 1 1 41 SER QB . 41 . HB# 1 1 291 1 1 1 1 30 HIS HE1 . 30 . HE1 1 1 291 1 2 1 1 42 TYR H . 42 . HN 1 1 292 1 1 1 1 30 HIS HD2 . 30 . HD2 1 1 292 1 2 1 1 43 PRO HA . 43 . HA 1 1 293 1 1 1 1 30 HIS HD2 . 30 . HD2 1 1 293 1 2 1 1 43 PRO QB . 43 . HB# 1 1 294 1 1 1 1 30 HIS HA . 30 . HA 1 1 294 1 2 1 1 44 GLY H . 44 . HN 1 1 295 1 1 1 1 31 TYR H . 31 . HN 1 1 295 1 2 1 1 31 TYR QD . 31 . HD# 1 1 296 1 1 1 1 31 TYR H . 31 . HN 1 1 296 1 2 1 1 32 CYS H . 32 . HN 1 1 297 1 1 1 1 31 TYR HA . 31 . HA 1 1 297 1 2 1 1 32 CYS H . 32 . HN 1 1 298 1 1 1 1 31 TYR QB . 31 . HB# 1 1 298 1 2 1 1 32 CYS H . 32 . HN 1 1 299 1 1 1 1 31 TYR QD . 31 . HD# 1 1 299 1 2 1 1 32 CYS H . 32 . HN 1 1 300 1 1 1 1 32 CYS H . 32 . HN 1 1 300 1 2 1 1 33 THR H . 33 . HN 1 1 301 1 1 1 1 32 CYS HA . 32 . HA 1 1 301 1 2 1 1 33 THR H . 33 . HN 1 1 302 1 1 1 1 32 CYS HA . 32 . HA 1 1 302 1 2 1 1 33 THR MG . 33 . HG2# 1 1 303 1 1 1 1 32 CYS QB . 32 . HB# 1 1 303 1 2 1 1 33 THR H . 33 . HN 1 1 304 1 1 1 1 32 CYS H . 32 . HN 1 1 304 1 2 1 1 34 GLY H . 34 . HN 1 1 305 1 1 1 1 32 CYS HA . 32 . HA 1 1 305 1 2 1 1 34 GLY H . 34 . HN 1 1 306 1 1 1 1 32 CYS QB . 32 . HB# 1 1 306 1 2 1 1 34 GLY H . 34 . HN 1 1 307 1 1 1 1 32 CYS HA . 32 . HA 1 1 307 1 2 1 1 39 CYS HA . 39 . HA 1 1 308 1 1 1 1 32 CYS HA . 32 . HA 1 1 308 1 2 1 1 40 PRO QG . 40 . HG# 1 1 309 1 1 1 1 32 CYS HA . 32 . HA 1 1 309 1 2 1 1 40 PRO QD . 40 . HD# 1 1 310 1 1 1 1 33 THR H . 33 . HN 1 1 310 1 2 1 1 34 GLY H . 34 . HN 1 1 311 1 1 1 1 33 THR H . 33 . HN 1 1 311 1 2 1 1 34 GLY QA . 34 . HA# 1 1 312 1 1 1 1 33 THR HA . 33 . HA 1 1 312 1 2 1 1 34 GLY H . 34 . HN 1 1 313 1 1 1 1 33 THR HB . 33 . HB 1 1 313 1 2 1 1 34 GLY H . 34 . HN 1 1 314 1 1 1 1 33 THR MG . 33 . HG2# 1 1 314 1 2 1 1 34 GLY H . 34 . HN 1 1 315 1 1 1 1 33 THR H . 33 . HN 1 1 315 1 2 1 1 35 ARG H . 35 . HN 1 1 316 1 1 1 1 33 THR HB . 33 . HB 1 1 316 1 2 1 1 35 ARG H . 35 . HN 1 1 317 1 1 1 1 33 THR HG1 . 33 . HG1 1 1 317 1 2 1 1 35 ARG H . 35 . HN 1 1 318 1 1 1 1 33 THR HG1 . 33 . HG1 1 1 318 1 2 1 1 35 ARG QB . 35 . HB# 1 1 319 1 1 1 1 33 THR MG . 33 . HG2# 1 1 319 1 2 1 1 35 ARG H . 35 . HN 1 1 320 1 1 1 1 33 THR H . 33 . HN 1 1 320 1 2 1 1 36 SER H . 36 . HN 1 1 321 1 1 1 1 33 THR HG1 . 33 . HG1 1 1 321 1 2 1 1 36 SER H . 36 . HN 1 1 322 1 1 1 1 33 THR MG . 33 . HG2# 1 1 322 1 2 1 1 36 SER H . 36 . HN 1 1 323 1 1 1 1 33 THR MG . 33 . HG2# 1 1 323 1 2 1 1 36 SER QB . 36 . HB# 1 1 324 1 1 1 1 33 THR H . 33 . HN 1 1 324 1 2 1 1 39 CYS HA . 39 . HA 1 1 325 1 1 1 1 33 THR MG . 33 . HG2# 1 1 325 1 2 1 1 39 CYS HA . 39 . HA 1 1 326 1 1 1 1 33 THR H . 33 . HN 1 1 326 1 2 1 1 40 PRO QG . 40 . HG# 1 1 327 1 1 1 1 33 THR H . 33 . HN 1 1 327 1 2 1 1 40 PRO QD . 40 . HD# 1 1 328 1 1 1 1 33 THR MG . 33 . HG2# 1 1 328 1 2 1 1 40 PRO QG . 40 . HG# 1 1 329 1 1 1 1 33 THR MG . 33 . HG2# 1 1 329 1 2 1 1 40 PRO QD . 40 . HD# 1 1 330 1 1 1 1 33 THR MG . 33 . HG2# 1 1 330 1 2 1 1 42 TYR QE . 42 . HE# 1 1 331 1 1 1 1 34 GLY H . 34 . HN 1 1 331 1 2 1 1 35 ARG H . 35 . HN 1 1 332 1 1 1 1 34 GLY QA . 34 . HA# 1 1 332 1 2 1 1 35 ARG H . 35 . HN 1 1 333 1 1 1 1 34 GLY H . 34 . HN 1 1 333 1 2 1 1 36 SER H . 36 . HN 1 1 334 1 1 1 1 34 GLY QA . 34 . HA# 1 1 334 1 2 1 1 36 SER H . 36 . HN 1 1 335 1 1 1 1 35 ARG H . 35 . HN 1 1 335 1 2 1 1 35 ARG QG . 35 . HG# 1 1 336 1 1 1 1 35 ARG H . 35 . HN 1 1 336 1 2 1 1 36 SER H . 36 . HN 1 1 337 1 1 1 1 35 ARG H . 35 . HN 1 1 337 1 2 1 1 36 SER QB . 36 . HB# 1 1 338 1 1 1 1 35 ARG HA . 35 . HA 1 1 338 1 2 1 1 36 SER H . 36 . HN 1 1 339 1 1 1 1 35 ARG QB . 35 . HB# 1 1 339 1 2 1 1 36 SER H . 36 . HN 1 1 340 1 1 1 1 35 ARG QG . 35 . HG# 1 1 340 1 2 1 1 36 SER H . 36 . HN 1 1 341 1 1 1 1 36 SER H . 36 . HN 1 1 341 1 2 1 1 37 CYS H . 37 . HN 1 1 342 1 1 1 1 36 SER HA . 36 . HA 1 1 342 1 2 1 1 37 CYS H . 37 . HN 1 1 343 1 1 1 1 36 SER QB . 36 . HB# 1 1 343 1 2 1 1 37 CYS H . 37 . HN 1 1 344 1 1 1 1 36 SER H . 36 . HN 1 1 344 1 2 1 1 38 GLU H . 38 . HN 1 1 345 1 1 1 1 36 SER HA . 36 . HA 1 1 345 1 2 1 1 38 GLU H . 38 . HN 1 1 346 1 1 1 1 36 SER QB . 36 . HB# 1 1 346 1 2 1 1 38 GLU H . 38 . HN 1 1 347 1 1 1 1 37 CYS H . 37 . HN 1 1 347 1 2 1 1 38 GLU H . 38 . HN 1 1 348 1 1 1 1 37 CYS HA . 37 . HA 1 1 348 1 2 1 1 38 GLU H . 38 . HN 1 1 349 1 1 1 1 37 CYS QB . 37 . HB# 1 1 349 1 2 1 1 38 GLU H . 38 . HN 1 1 350 1 1 1 1 38 GLU H . 38 . HN 1 1 350 1 2 1 1 38 GLU QG . 38 . HG# 1 1 351 1 1 1 1 38 GLU H . 38 . HN 1 1 351 1 2 1 1 39 CYS H . 39 . HN 1 1 352 1 1 1 1 38 GLU HA . 38 . HA 1 1 352 1 2 1 1 39 CYS H . 39 . HN 1 1 353 1 1 1 1 38 GLU QB . 38 . HB# 1 1 353 1 2 1 1 39 CYS H . 39 . HN 1 1 354 1 1 1 1 38 GLU QG . 38 . HG# 1 1 354 1 2 1 1 39 CYS H . 39 . HN 1 1 355 1 1 1 1 39 CYS HA . 39 . HA 1 1 355 1 2 1 1 40 PRO QB . 40 . HB# 1 1 356 1 1 1 1 39 CYS HA . 39 . HA 1 1 356 1 2 1 1 40 PRO QG . 40 . HG# 1 1 357 1 1 1 1 39 CYS HA . 39 . HA 1 1 357 1 2 1 1 40 PRO QD . 40 . HD# 1 1 358 1 1 1 1 39 CYS QB . 39 . HB# 1 1 358 1 2 1 1 40 PRO QD . 40 . HD# 1 1 359 1 1 1 1 40 PRO HA . 40 . HA 1 1 359 1 2 1 1 41 SER H . 41 . HN 1 1 360 1 1 1 1 40 PRO QB . 40 . HB# 1 1 360 1 2 1 1 41 SER H . 41 . HN 1 1 361 1 1 1 1 40 PRO HA . 40 . HA 1 1 361 1 2 1 1 42 TYR H . 42 . HN 1 1 362 1 1 1 1 40 PRO QB . 40 . HB# 1 1 362 1 2 1 1 42 TYR H . 42 . HN 1 1 363 1 1 1 1 40 PRO QB . 40 . HB# 1 1 363 1 2 1 1 42 TYR QE . 42 . HE# 1 1 364 1 1 1 1 41 SER H . 41 . HN 1 1 364 1 2 1 1 42 TYR H . 42 . HN 1 1 365 1 1 1 1 41 SER HA . 41 . HA 1 1 365 1 2 1 1 42 TYR H . 42 . HN 1 1 366 1 1 1 1 41 SER QB . 41 . HB# 1 1 366 1 2 1 1 42 TYR H . 42 . HN 1 1 367 1 1 1 1 42 TYR H . 42 . HN 1 1 367 1 2 1 1 42 TYR QD . 42 . HD# 1 1 368 1 1 1 1 42 TYR HA . 42 . HA 1 1 368 1 2 1 1 43 PRO QD . 43 . HD# 1 1 369 1 1 1 1 42 TYR QD . 42 . HD# 1 1 369 1 2 1 1 43 PRO QD . 43 . HD# 1 1 370 1 1 1 1 43 PRO HA . 43 . HA 1 1 370 1 2 1 1 44 GLY H . 44 . HN 1 1 371 1 1 1 1 43 PRO QB . 43 . HB# 1 1 371 1 2 1 1 44 GLY H . 44 . HN 1 1 372 1 1 1 1 43 PRO QG . 43 . HG# 1 1 372 1 2 1 1 44 GLY H . 44 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 5.0 0.0 5.0 1 1 2 1 . . . . . 5.0 0.0 5.0 1 1 3 1 . . . . . 5.0 0.0 5.0 1 1 4 1 . . . . . 5.0 0.0 5.0 1 1 5 1 . . . . . 5.0 0.0 5.0 1 1 6 1 . . . . . 5.0 0.0 5.0 1 1 7 1 . . . . . 6.0 0.0 6.0 1 1 8 1 . . . . . 5.0 0.0 5.0 1 1 9 1 . . . . . 3.5 0.0 3.5 1 1 10 1 . . . . . 3.5 0.0 3.5 1 1 11 1 . . . . . 6.0 0.0 6.0 1 1 12 1 . . . . . 5.0 0.0 5.0 1 1 13 1 . . . . . 6.0 0.0 6.0 1 1 14 1 . . . . . 5.0 0.0 5.0 1 1 15 1 . . . . . 2.5 0.0 2.5 1 1 16 1 . . . . . 5.0 0.0 5.0 1 1 17 1 . . . . . 5.0 0.0 5.0 1 1 18 1 . . . . . 6.0 0.0 6.0 1 1 19 1 . . . . . 6.0 0.0 6.0 1 1 20 1 . . . . . 6.0 0.0 6.0 1 1 21 1 . . . . . 5.0 0.0 5.0 1 1 22 1 . . . . . 2.5 0.0 2.5 1 1 23 1 . . . . . 5.0 0.0 5.0 1 1 24 1 . . . . . 5.0 0.0 5.0 1 1 25 1 . . . . . 5.0 0.0 5.0 1 1 26 1 . . . . . 6.0 0.0 6.0 1 1 27 1 . . . . . 6.0 0.0 6.0 1 1 28 1 . . . . . 6.0 0.0 6.0 1 1 29 1 . . . . . 3.5 0.0 3.5 1 1 30 1 . . . . . 5.0 0.0 5.0 1 1 31 1 . . . . . 5.0 0.0 5.0 1 1 32 1 . . . . . 5.0 0.0 5.0 1 1 33 1 . . . . . 5.0 0.0 5.0 1 1 34 1 . . . . . 5.0 0.0 5.0 1 1 35 1 . . . . . 5.0 0.0 5.0 1 1 36 1 . . . . . 5.0 0.0 5.0 1 1 37 1 . . . . . 6.0 0.0 6.0 1 1 38 1 . . . . . 5.0 0.0 5.0 1 1 39 1 . . . . . 6.0 0.0 6.0 1 1 40 1 . . . . . 5.0 0.0 5.0 1 1 41 1 . . . . . 5.0 0.0 5.0 1 1 42 1 . . . . . 5.0 0.0 5.0 1 1 43 1 . . . . . 5.0 0.0 5.0 1 1 44 1 . . . . . 5.0 0.0 5.0 1 1 45 1 . . . . . 5.0 0.0 5.0 1 1 46 1 . . . . . 3.5 0.0 3.5 1 1 47 1 . . . . . 5.0 0.0 5.0 1 1 48 1 . . . . . 6.0 0.0 6.0 1 1 49 1 . . . . . 6.0 0.0 6.0 1 1 50 1 . . . . . 5.0 0.0 5.0 1 1 51 1 . . . . . 5.0 0.0 5.0 1 1 52 1 . . . . . 5.0 0.0 5.0 1 1 53 1 . . . . . 5.0 0.0 5.0 1 1 54 1 . . . . . 5.0 0.0 5.0 1 1 55 1 . . . . . 5.0 0.0 5.0 1 1 56 1 . . . . . 3.5 0.0 3.5 1 1 57 1 . . . . . 6.0 0.0 6.0 1 1 58 1 . . . . . 6.0 0.0 6.0 1 1 59 1 . . . . . 6.0 0.0 6.0 1 1 60 1 . . . . . 6.0 0.0 6.0 1 1 61 1 . . . . . 5.0 0.0 5.0 1 1 62 1 . . . . . 3.5 0.0 3.5 1 1 63 1 . . . . . 5.0 0.0 5.0 1 1 64 1 . . . . . 5.0 0.0 5.0 1 1 65 1 . . . . . 5.0 0.0 5.0 1 1 66 1 . . . . . 6.0 0.0 6.0 1 1 67 1 . . . . . 6.0 0.0 6.0 1 1 68 1 . . . . . 5.0 0.0 5.0 1 1 69 1 . . . . . 5.0 0.0 5.0 1 1 70 1 . . . . . 6.0 0.0 6.0 1 1 71 1 . . . . . 5.0 0.0 5.0 1 1 72 1 . . . . . 5.0 0.0 5.0 1 1 73 1 . . . . . 6.0 0.0 6.0 1 1 74 1 . . . . . 6.0 0.0 6.0 1 1 75 1 . . . . . 5.0 0.0 5.0 1 1 76 1 . . . . . 6.0 0.0 6.0 1 1 77 1 . . . . . 5.0 0.0 5.0 1 1 78 1 . . . . . 3.5 0.0 3.5 1 1 79 1 . . . . . 5.0 0.0 5.0 1 1 80 1 . . . . . 5.0 0.0 5.0 1 1 81 1 . . . . . 6.0 0.0 6.0 1 1 82 1 . . . . . 6.0 0.0 6.0 1 1 83 1 . . . . . 5.0 0.0 5.0 1 1 84 1 . . . . . 5.0 0.0 5.0 1 1 85 1 . . . . . 5.0 0.0 5.0 1 1 86 1 . . . . . 6.0 0.0 6.0 1 1 87 1 . . . . . 6.0 0.0 6.0 1 1 88 1 . . . . . 5.0 0.0 5.0 1 1 89 1 . . . . . 5.0 0.0 5.0 1 1 90 1 . . . . . 5.0 0.0 5.0 1 1 91 1 . . . . . 6.0 0.0 6.0 1 1 92 1 . . . . . 6.0 0.0 6.0 1 1 93 1 . . . . . 5.0 0.0 5.0 1 1 94 1 . . . . . 3.5 0.0 3.5 1 1 95 1 . . . . . 5.0 0.0 5.0 1 1 96 1 . . . . . 5.0 0.0 5.0 1 1 97 1 . . . . . 6.0 0.0 6.0 1 1 98 1 . . . . . 5.0 0.0 5.0 1 1 99 1 . . . . . 5.0 0.0 5.0 1 1 100 1 . . . . . 5.0 0.0 5.0 1 1 101 1 . . . . . 5.0 0.0 5.0 1 1 102 1 . . . . . 5.0 0.0 5.0 1 1 103 1 . . . . . 3.5 0.0 3.5 1 1 104 1 . . . . . 3.5 0.0 3.5 1 1 105 1 . . . . . 5.0 0.0 5.0 1 1 106 1 . . . . . 6.0 0.0 6.0 1 1 107 1 . . . . . 6.0 0.0 6.0 1 1 108 1 . . . . . 3.5 0.0 3.5 1 1 109 1 . . . . . 6.0 0.0 6.0 1 1 110 1 . . . . . 5.0 0.0 5.0 1 1 111 1 . . . . . 5.0 0.0 5.0 1 1 112 1 . . . . . 5.0 0.0 5.0 1 1 113 1 . . . . . 5.0 0.0 5.0 1 1 114 1 . . . . . 2.5 0.0 2.5 1 1 115 1 . . . . . 5.0 0.0 5.0 1 1 116 1 . . . . . 5.0 0.0 5.0 1 1 117 1 . . . . . 6.0 0.0 6.0 1 1 118 1 . . . . . 5.0 0.0 5.0 1 1 119 1 . . . . . 5.0 0.0 5.0 1 1 120 1 . . . . . 2.5 0.0 2.5 1 1 121 1 . . . . . 6.0 0.0 6.0 1 1 122 1 . . . . . 5.0 0.0 5.0 1 1 123 1 . . . . . 5.0 0.0 5.0 1 1 124 1 . . . . . 6.0 0.0 6.0 1 1 125 1 . . . . . 5.0 0.0 5.0 1 1 126 1 . . . . . 6.0 0.0 6.0 1 1 127 1 . . . . . 5.0 0.0 5.0 1 1 128 1 . . . . . 5.0 0.0 5.0 1 1 129 1 . . . . . 6.0 0.0 6.0 1 1 130 1 . . . . . 5.0 0.0 5.0 1 1 131 1 . . . . . 5.0 0.0 5.0 1 1 132 1 . . . . . 5.0 0.0 5.0 1 1 133 1 . . . . . 6.0 0.0 6.0 1 1 134 1 . . . . . 5.0 0.0 5.0 1 1 135 1 . . . . . 5.0 0.0 5.0 1 1 136 1 . . . . . 6.0 0.0 6.0 1 1 137 1 . . . . . 5.0 0.0 5.0 1 1 138 1 . . . . . 5.0 0.0 5.0 1 1 139 1 . . . . . 6.0 0.0 6.0 1 1 140 1 . . . . . 2.5 0.0 2.5 1 1 141 1 . . . . . 6.0 0.0 6.0 1 1 142 1 . . . . . 5.0 0.0 5.0 1 1 143 1 . . . . . 5.0 0.0 5.0 1 1 144 1 . . . . . 5.0 0.0 5.0 1 1 145 1 . . . . . 5.0 0.0 5.0 1 1 146 1 . . . . . 5.0 0.0 5.0 1 1 147 1 . . . . . 6.0 0.0 6.0 1 1 148 1 . . . . . 2.2 0.0 2.2 1 1 149 1 . . . . . 3.5 0.0 3.5 1 1 150 1 . . . . . 5.0 0.0 5.0 1 1 151 1 . . . . . 5.0 0.0 5.0 1 1 152 1 . . . . . 5.0 0.0 5.0 1 1 153 1 . . . . . 6.0 0.0 6.0 1 1 154 1 . . . . . 5.0 0.0 5.0 1 1 155 1 . . . . . 6.0 0.0 6.0 1 1 156 1 . . . . . 5.0 0.0 5.0 1 1 157 1 . . . . . 5.0 0.0 5.0 1 1 158 1 . . . . . 2.5 0.0 2.5 1 1 159 1 . . . . . 5.0 0.0 5.0 1 1 160 1 . . . . . 5.0 0.0 5.0 1 1 161 1 . . . . . 5.0 0.0 5.0 1 1 162 1 . . . . . 6.0 0.0 6.0 1 1 163 1 . . . . . 5.0 0.0 5.0 1 1 164 1 . . . . . 5.0 0.0 5.0 1 1 165 1 . . . . . 6.0 0.0 6.0 1 1 166 1 . . . . . 6.0 0.0 6.0 1 1 167 1 . . . . . 6.0 0.0 6.0 1 1 168 1 . . . . . 6.0 0.0 6.0 1 1 169 1 . . . . . 5.0 0.0 5.0 1 1 170 1 . . . . . 6.0 0.0 6.0 1 1 171 1 . . . . . 5.0 0.0 5.0 1 1 172 1 . . . . . 5.0 0.0 5.0 1 1 173 1 . . . . . 3.5 0.0 3.5 1 1 174 1 . . . . . 5.0 0.0 5.0 1 1 175 1 . . . . . 5.0 0.0 5.0 1 1 176 1 . . . . . 5.0 0.0 5.0 1 1 177 1 . . . . . 6.0 0.0 6.0 1 1 178 1 . . . . . 3.5 0.0 3.5 1 1 179 1 . . . . . 3.5 0.0 3.5 1 1 180 1 . . . . . 6.0 0.0 6.0 1 1 181 1 . . . . . 5.0 0.0 5.0 1 1 182 1 . . . . . 5.0 0.0 5.0 1 1 183 1 . . . . . 5.0 0.0 5.0 1 1 184 1 . . . . . 5.0 0.0 5.0 1 1 185 1 . . . . . 6.0 0.0 6.0 1 1 186 1 . . . . . 5.0 0.0 5.0 1 1 187 1 . . . . . 5.0 0.0 5.0 1 1 188 1 . . . . . 5.0 0.0 5.0 1 1 189 1 . . . . . 5.0 0.0 5.0 1 1 190 1 . . . . . 5.0 0.0 5.0 1 1 191 1 . . . . . 6.0 0.0 6.0 1 1 192 1 . . . . . 2.5 0.0 2.5 1 1 193 1 . . . . . 5.0 0.0 5.0 1 1 194 1 . . . . . 5.0 0.0 5.0 1 1 195 1 . . . . . 5.0 0.0 5.0 1 1 196 1 . . . . . 5.0 0.0 5.0 1 1 197 1 . . . . . 6.0 0.0 6.0 1 1 198 1 . . . . . 6.0 0.0 6.0 1 1 199 1 . . . . . 6.0 0.0 6.0 1 1 200 1 . . . . . 5.0 0.0 5.0 1 1 201 1 . . . . . 6.0 0.0 6.0 1 1 202 1 . . . . . 5.0 0.0 5.0 1 1 203 1 . . . . . 5.0 0.0 5.0 1 1 204 1 . . . . . 5.0 0.0 5.0 1 1 205 1 . . . . . 5.0 0.0 5.0 1 1 206 1 . . . . . 5.0 0.0 5.0 1 1 207 1 . . . . . 5.0 0.0 5.0 1 1 208 1 . . . . . 5.0 0.0 5.0 1 1 209 1 . . . . . 5.0 0.0 5.0 1 1 210 1 . . . . . 3.5 0.0 3.5 1 1 211 1 . . . . . 5.0 0.0 5.0 1 1 212 1 . . . . . 5.0 0.0 5.0 1 1 213 1 . . . . . 5.0 0.0 5.0 1 1 214 1 . . . . . 5.0 0.0 5.0 1 1 215 1 . . . . . 5.0 0.0 5.0 1 1 216 1 . . . . . 6.0 0.0 6.0 1 1 217 1 . . . . . 5.0 0.0 5.0 1 1 218 1 . . . . . 6.0 0.0 6.0 1 1 219 1 . . . . . 5.0 0.0 5.0 1 1 220 1 . . . . . 5.0 0.0 5.0 1 1 221 1 . . . . . 6.0 0.0 6.0 1 1 222 1 . . . . . 5.0 0.0 5.0 1 1 223 1 . . . . . 3.5 0.0 3.5 1 1 224 1 . . . . . 5.0 0.0 5.0 1 1 225 1 . . . . . 6.0 0.0 6.0 1 1 226 1 . . . . . 6.0 0.0 6.0 1 1 227 1 . . . . . 6.0 0.0 6.0 1 1 228 1 . . . . . 5.0 0.0 5.0 1 1 229 1 . . . . . 5.0 0.0 5.0 1 1 230 1 . . . . . 3.5 0.0 3.5 1 1 231 1 . . . . . 5.0 0.0 5.0 1 1 232 1 . . . . . 5.0 0.0 5.0 1 1 233 1 . . . . . 5.0 0.0 5.0 1 1 234 1 . . . . . 6.0 0.0 6.0 1 1 235 1 . . . . . 5.0 0.0 5.0 1 1 236 1 . . . . . 6.0 0.0 6.0 1 1 237 1 . . . . . 5.0 0.0 5.0 1 1 238 1 . . . . . 6.0 0.0 6.0 1 1 239 1 . . . . . 6.0 0.0 6.0 1 1 240 1 . . . . . 5.0 0.0 5.0 1 1 241 1 . . . . . 6.0 0.0 6.0 1 1 242 1 . . . . . 3.5 0.0 3.5 1 1 243 1 . . . . . 6.0 0.0 6.0 1 1 244 1 . . . . . 5.0 0.0 5.0 1 1 245 1 . . . . . 5.0 0.0 5.0 1 1 246 1 . . . . . 6.0 0.0 6.0 1 1 247 1 . . . . . 5.0 0.0 5.0 1 1 248 1 . . . . . 6.0 0.0 6.0 1 1 249 1 . . . . . 6.0 0.0 6.0 1 1 250 1 . . . . . 3.5 0.0 3.5 1 1 251 1 . . . . . 5.0 0.0 5.0 1 1 252 1 . . . . . 5.0 0.0 5.0 1 1 253 1 . . . . . 6.0 0.0 6.0 1 1 254 1 . . . . . 6.0 0.0 6.0 1 1 255 1 . . . . . 6.0 0.0 6.0 1 1 256 1 . . . . . 5.0 0.0 5.0 1 1 257 1 . . . . . 3.5 0.0 3.5 1 1 258 1 . . . . . 5.0 0.0 5.0 1 1 259 1 . . . . . 6.0 0.0 6.0 1 1 260 1 . . . . . 5.0 0.0 5.0 1 1 261 1 . . . . . 3.5 0.0 3.5 1 1 262 1 . . . . . 3.5 0.0 3.5 1 1 263 1 . . . . . 5.0 0.0 5.0 1 1 264 1 . . . . . 6.0 0.0 6.0 1 1 265 1 . . . . . 6.0 0.0 6.0 1 1 266 1 . . . . . 6.0 0.0 6.0 1 1 267 1 . . . . . 5.0 0.0 5.0 1 1 268 1 . . . . . 6.0 0.0 6.0 1 1 269 1 . . . . . 2.5 0.0 2.5 1 1 270 1 . . . . . 3.5 0.0 3.5 1 1 271 1 . . . . . 5.0 0.0 5.0 1 1 272 1 . . . . . 5.0 0.0 5.0 1 1 273 1 . . . . . 5.0 0.0 5.0 1 1 274 1 . . . . . 5.0 0.0 5.0 1 1 275 1 . . . . . 3.5 0.0 3.5 1 1 276 1 . . . . . 5.0 0.0 5.0 1 1 277 1 . . . . . 6.0 0.0 6.0 1 1 278 1 . . . . . 5.0 0.0 5.0 1 1 279 1 . . . . . 3.5 0.0 3.5 1 1 280 1 . . . . . 6.0 0.0 6.0 1 1 281 1 . . . . . 5.0 0.0 5.0 1 1 282 1 . . . . . 6.0 0.0 6.0 1 1 283 1 . . . . . 5.0 0.0 5.0 1 1 284 1 . . . . . 3.5 0.0 3.5 1 1 285 1 . . . . . 5.0 0.0 5.0 1 1 286 1 . . . . . 5.0 0.0 5.0 1 1 287 1 . . . . . 6.0 0.0 6.0 1 1 288 1 . . . . . 6.0 0.0 6.0 1 1 289 1 . . . . . 5.0 0.0 5.0 1 1 290 1 . . . . . 6.0 0.0 6.0 1 1 291 1 . . . . . 6.0 0.0 6.0 1 1 292 1 . . . . . 6.0 0.0 6.0 1 1 293 1 . . . . . 6.0 0.0 6.0 1 1 294 1 . . . . . 6.0 0.0 6.0 1 1 295 1 . . . . . 5.0 0.0 5.0 1 1 296 1 . . . . . 6.0 0.0 6.0 1 1 297 1 . . . . . 2.5 0.0 2.5 1 1 298 1 . . . . . 5.0 0.0 5.0 1 1 299 1 . . . . . 5.0 0.0 5.0 1 1 300 1 . . . . . 5.0 0.0 5.0 1 1 301 1 . . . . . 2.5 0.0 2.5 1 1 302 1 . . . . . 5.0 0.0 5.0 1 1 303 1 . . . . . 5.0 0.0 5.0 1 1 304 1 . . . . . 5.0 0.0 5.0 1 1 305 1 . . . . . 5.0 0.0 5.0 1 1 306 1 . . . . . 5.0 0.0 5.0 1 1 307 1 . . . . . 6.0 0.0 6.0 1 1 308 1 . . . . . 5.0 0.0 5.0 1 1 309 1 . . . . . 5.0 0.0 5.0 1 1 310 1 . . . . . 3.5 0.0 3.5 1 1 311 1 . . . . . 6.0 0.0 6.0 1 1 312 1 . . . . . 5.0 0.0 5.0 1 1 313 1 . . . . . 6.0 0.0 6.0 1 1 314 1 . . . . . 5.0 0.0 5.0 1 1 315 1 . . . . . 5.0 0.0 5.0 1 1 316 1 . . . . . 5.0 0.0 5.0 1 1 317 1 . . . . . 5.0 0.0 5.0 1 1 318 1 . . . . . 5.0 0.0 5.0 1 1 319 1 . . . . . 5.0 0.0 5.0 1 1 320 1 . . . . . 5.0 0.0 5.0 1 1 321 1 . . . . . 5.0 0.0 5.0 1 1 322 1 . . . . . 6.0 0.0 6.0 1 1 323 1 . . . . . 5.0 0.0 5.0 1 1 324 1 . . . . . 6.0 0.0 6.0 1 1 325 1 . . . . . 5.0 0.0 5.0 1 1 326 1 . . . . . 6.0 0.0 6.0 1 1 327 1 . . . . . 5.0 0.0 5.0 1 1 328 1 . . . . . 5.0 0.0 5.0 1 1 329 1 . . . . . 5.0 0.0 5.0 1 1 330 1 . . . . . 6.0 0.0 6.0 1 1 331 1 . . . . . 3.5 0.0 3.5 1 1 332 1 . . . . . 5.0 0.0 5.0 1 1 333 1 . . . . . 5.0 0.0 5.0 1 1 334 1 . . . . . 5.0 0.0 5.0 1 1 335 1 . . . . . 5.0 0.0 5.0 1 1 336 1 . . . . . 2.5 0.0 2.5 1 1 337 1 . . . . . 6.0 0.0 6.0 1 1 338 1 . . . . . 3.5 0.0 3.5 1 1 339 1 . . . . . 5.0 0.0 5.0 1 1 340 1 . . . . . 5.0 0.0 5.0 1 1 341 1 . . . . . 5.0 0.0 5.0 1 1 342 1 . . . . . 2.5 0.0 2.5 1 1 343 1 . . . . . 3.5 0.0 3.5 1 1 344 1 . . . . . 5.0 0.0 5.0 1 1 345 1 . . . . . 5.0 0.0 5.0 1 1 346 1 . . . . . 5.0 0.0 5.0 1 1 347 1 . . . . . 2.5 0.0 2.5 1 1 348 1 . . . . . 5.0 0.0 5.0 1 1 349 1 . . . . . 5.0 0.0 5.0 1 1 350 1 . . . . . 5.0 0.0 5.0 1 1 351 1 . . . . . 5.0 0.0 5.0 1 1 352 1 . . . . . 2.5 0.0 2.5 1 1 353 1 . . . . . 5.0 0.0 5.0 1 1 354 1 . . . . . 5.0 0.0 5.0 1 1 355 1 . . . . . 6.0 0.0 6.0 1 1 356 1 . . . . . 5.0 0.0 5.0 1 1 357 1 . . . . . 3.5 0.0 3.5 1 1 358 1 . . . . . 6.0 0.0 6.0 1 1 359 1 . . . . . 2.5 0.0 2.5 1 1 360 1 . . . . . 5.0 0.0 5.0 1 1 361 1 . . . . . 5.0 0.0 5.0 1 1 362 1 . . . . . 5.0 0.0 5.0 1 1 363 1 . . . . . 5.0 0.0 5.0 1 1 364 1 . . . . . 3.5 0.0 3.5 1 1 365 1 . . . . . 3.5 0.0 3.5 1 1 366 1 . . . . . 5.0 0.0 5.0 1 1 367 1 . . . . . 5.0 0.0 5.0 1 1 368 1 . . . . . 3.5 0.0 3.5 1 1 369 1 . . . . . 6.0 0.0 6.0 1 1 370 1 . . . . . 3.5 0.0 3.5 1 1 371 1 . . . . . 5.0 0.0 5.0 1 1 372 1 . . . . . 6.0 0.0 6.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 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 9 CYS QB . 9 . HB# 1 2 1 1 2 1 1 16 LYS QB . 16 . HB# 1 2 1 1 2 1 1 16 LYS QD . 16 . HD# 1 2 2 1 1 1 1 13 CYS H . 13 . HN 1 2 2 1 2 1 1 14 LYS QB . 14 . HB# 1 2 2 1 2 1 1 16 LYS QD . 16 . HD# 1 2 3 1 1 1 1 23 TRP HZ3 . 23 . HZ3 1 2 3 1 2 1 1 28 SER QB . 28 . HB# 1 2 3 1 2 1 1 44 GLY QA . 44 . HA# 1 2 4 1 1 1 1 23 TRP HH2 . 23 . HH2 1 2 4 1 2 1 1 28 SER QB . 28 . HB# 1 2 4 1 2 1 1 44 GLY QA . 44 . HA# 1 2 5 1 1 1 1 25 THR HA . 25 . HA 1 2 5 1 1 1 1 25 THR HB . 25 . HB 1 2 5 1 2 1 1 26 SER QB . 26 . HB# 1 2 6 1 1 1 1 25 THR HA . 25 . HA 1 2 6 1 1 1 1 25 THR HB . 25 . HB 1 2 6 1 2 1 1 27 VAL H . 27 . HN 1 2 7 1 1 1 1 25 THR HA . 25 . HA 1 2 7 1 1 1 1 25 THR HB . 25 . HB 1 2 7 1 2 1 1 28 SER H . 28 . HN 1 2 8 1 1 1 1 28 SER QB . 28 . HB# 1 2 8 1 1 1 1 44 GLY QA . 44 . HA# 1 2 8 1 2 1 1 31 TYR QD . 31 . HD# 1 2 9 1 1 1 1 28 SER QB . 28 . HB# 1 2 9 1 1 1 1 44 GLY QA . 44 . HA# 1 2 9 1 2 1 1 31 TYR QE . 31 . HE# 1 2 10 1 1 1 1 30 HIS HD2 . 30 . HD2 1 2 10 1 1 1 1 31 TYR QD . 31 . HD# 1 2 10 1 2 1 1 44 GLY H . 44 . HN 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 6.0 0.0 6.0 1 2 2 1 . . . . . 5.0 0.0 5.0 1 2 3 1 . . . . . 5.0 0.0 5.0 1 2 4 1 . . . . . 6.0 0.0 6.0 1 2 5 1 . . . . . 6.0 0.0 6.0 1 2 6 1 . . . . . 5.0 0.0 5.0 1 2 7 1 . . . . . 5.0 0.0 5.0 1 2 8 1 . . . . . 5.0 0.0 5.0 1 2 9 1 . . . . . 5.0 0.0 5.0 1 2 10 1 . . . . . 6.0 0.0 6.0 1 2 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ALA C C -15.776 10.700 1.308 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C -16.404 9.311 1.334 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C -16.952 9.006 2.720 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA H1 H -14.882 8.645 0.121 1.00 . A A . 1 ALA H1 1 1 1 5 1 1 1 ALA H2 H -14.796 8.094 1.742 1.00 . A A . 1 ALA H2 1 1 1 6 1 1 1 ALA H3 H -15.951 7.419 0.668 1.00 . A A . 1 ALA H3 1 1 1 7 1 1 1 ALA HA H -17.227 9.288 0.635 1.00 . A A . 1 ALA HA 1 1 1 8 1 1 1 ALA HB1 H -17.362 9.907 3.151 1.00 . A A . 1 ALA HB1 1 1 1 9 1 1 1 ALA HB2 H -16.156 8.635 3.348 1.00 . A A . 1 ALA HB2 1 1 1 10 1 1 1 ALA HB3 H -17.728 8.259 2.643 1.00 . A A . 1 ALA HB3 1 1 1 11 1 1 1 ALA N N -15.420 8.274 0.930 1.00 . A A . 1 ALA N 1 1 1 12 1 1 1 ALA O O -16.284 11.610 0.653 1.00 . A A . 1 ALA O 1 1 1 13 1 1 2 MET C C -12.478 11.954 1.826 1.00 . A A . 2 MET C 1 1 1 14 1 1 2 MET CA C -13.970 12.136 2.085 1.00 . A A . 2 MET CA 1 1 1 15 1 1 2 MET CB C -14.186 12.795 3.449 1.00 . A A . 2 MET CB 1 1 1 16 1 1 2 MET CE C -17.967 13.218 5.008 1.00 . A A . 2 MET CE 1 1 1 17 1 1 2 MET CG C -15.573 13.391 3.623 1.00 . A A . 2 MET CG 1 1 1 18 1 1 2 MET H H -14.311 10.094 2.527 1.00 . A A . 2 MET H 1 1 1 19 1 1 2 MET HA H -14.382 12.774 1.318 1.00 . A A . 2 MET HA 1 1 1 20 1 1 2 MET HB2 H -14.036 12.056 4.221 1.00 . A A . 2 MET HB2 1 1 1 21 1 1 2 MET HB3 H -13.460 13.585 3.573 1.00 . A A . 2 MET HB3 1 1 1 22 1 1 2 MET HE1 H -18.226 12.402 4.349 1.00 . A A . 2 MET HE1 1 1 1 23 1 1 2 MET HE2 H -18.490 13.103 5.946 1.00 . A A . 2 MET HE2 1 1 1 24 1 1 2 MET HE3 H -18.251 14.154 4.551 1.00 . A A . 2 MET HE3 1 1 1 25 1 1 2 MET HG2 H -15.531 14.443 3.383 1.00 . A A . 2 MET HG2 1 1 1 26 1 1 2 MET HG3 H -16.251 12.895 2.945 1.00 . A A . 2 MET HG3 1 1 1 27 1 1 2 MET N N -14.668 10.857 2.026 1.00 . A A . 2 MET N 1 1 1 28 1 1 2 MET O O -11.979 12.289 0.752 1.00 . A A . 2 MET O 1 1 1 29 1 1 2 MET SD S -16.201 13.209 5.304 1.00 . A A . 2 MET SD 1 1 1 30 1 1 3 ASP C C -10.033 10.218 1.564 1.00 . A A . 3 ASP C 1 1 1 31 1 1 3 ASP CA C -10.336 11.195 2.696 1.00 . A A . 3 ASP CA 1 1 1 32 1 1 3 ASP CB C -9.769 10.660 4.012 1.00 . A A . 3 ASP CB 1 1 1 33 1 1 3 ASP CG C -9.632 11.742 5.065 1.00 . A A . 3 ASP CG 1 1 1 34 1 1 3 ASP H H -12.225 11.174 3.650 1.00 . A A . 3 ASP H 1 1 1 35 1 1 3 ASP HA H -9.868 12.142 2.472 1.00 . A A . 3 ASP HA 1 1 1 36 1 1 3 ASP HB2 H -10.427 9.893 4.395 1.00 . A A . 3 ASP HB2 1 1 1 37 1 1 3 ASP HB3 H -8.794 10.233 3.831 1.00 . A A . 3 ASP HB3 1 1 1 38 1 1 3 ASP N N -11.771 11.421 2.817 1.00 . A A . 3 ASP N 1 1 1 39 1 1 3 ASP O O -10.260 9.015 1.692 1.00 . A A . 3 ASP O 1 1 1 40 1 1 3 ASP OD1 O -8.584 12.422 5.085 1.00 . A A . 3 ASP OD1 1 1 1 41 1 1 3 ASP OD2 O -10.573 11.911 5.869 1.00 . A A . 3 ASP OD2 1 1 1 42 1 1 4 CYS C C -7.891 9.144 -0.458 1.00 . A A . 4 CYS C 1 1 1 43 1 1 4 CYS CA C -9.185 9.917 -0.697 1.00 . A A . 4 CYS CA 1 1 1 44 1 1 4 CYS CB C -9.049 10.785 -1.950 1.00 . A A . 4 CYS CB 1 1 1 45 1 1 4 CYS H H -9.360 11.709 0.415 1.00 . A A . 4 CYS H 1 1 1 46 1 1 4 CYS HA H -9.989 9.212 -0.844 1.00 . A A . 4 CYS HA 1 1 1 47 1 1 4 CYS HB2 H -8.766 11.785 -1.657 1.00 . A A . 4 CYS HB2 1 1 1 48 1 1 4 CYS HB3 H -8.280 10.370 -2.585 1.00 . A A . 4 CYS HB3 1 1 1 49 1 1 4 CYS N N -9.519 10.743 0.457 1.00 . A A . 4 CYS N 1 1 1 50 1 1 4 CYS O O -7.714 8.039 -0.971 1.00 . A A . 4 CYS O 1 1 1 51 1 1 4 CYS SG S -10.576 10.911 -2.937 1.00 . A A . 4 CYS SG 1 1 1 52 1 1 5 THR C C -4.911 8.858 -0.648 1.00 . A A . 5 THR C 1 1 1 53 1 1 5 THR CA C -5.714 9.099 0.627 1.00 . A A . 5 THR CA 1 1 1 54 1 1 5 THR CB C -5.939 7.775 1.359 1.00 . A A . 5 THR CB 1 1 1 55 1 1 5 THR CG2 C -4.856 7.457 2.367 1.00 . A A . 5 THR CG2 1 1 1 56 1 1 5 THR H H -7.189 10.615 0.701 1.00 . A A . 5 THR H 1 1 1 57 1 1 5 THR HA H -5.156 9.765 1.268 1.00 . A A . 5 THR HA 1 1 1 58 1 1 5 THR HB H -5.963 6.974 0.634 1.00 . A A . 5 THR HB 1 1 1 59 1 1 5 THR HG1 H -7.137 8.423 2.766 1.00 . A A . 5 THR HG1 1 1 1 60 1 1 5 THR HG21 H -3.888 7.644 1.927 1.00 . A A . 5 THR HG21 1 1 1 61 1 1 5 THR HG22 H -4.982 8.080 3.240 1.00 . A A . 5 THR HG22 1 1 1 62 1 1 5 THR HG23 H -4.926 6.418 2.654 1.00 . A A . 5 THR HG23 1 1 1 63 1 1 5 THR N N -6.991 9.733 0.322 1.00 . A A . 5 THR N 1 1 1 64 1 1 5 THR O O -5.025 7.804 -1.274 1.00 . A A . 5 THR O 1 1 1 65 1 1 5 THR OG1 O -7.177 7.788 2.048 1.00 . A A . 5 THR OG1 1 1 1 66 1 1 6 THR C C -1.918 9.135 -1.905 1.00 . A A . 6 THR C 1 1 1 67 1 1 6 THR CA C -3.282 9.735 -2.229 1.00 . A A . 6 THR CA 1 1 1 68 1 1 6 THR CB C -3.109 11.109 -2.879 1.00 . A A . 6 THR CB 1 1 1 69 1 1 6 THR CG2 C -3.176 11.068 -4.390 1.00 . A A . 6 THR CG2 1 1 1 70 1 1 6 THR H H -4.056 10.658 -0.488 1.00 . A A . 6 THR H 1 1 1 71 1 1 6 THR HA H -3.793 9.082 -2.921 1.00 . A A . 6 THR HA 1 1 1 72 1 1 6 THR HB H -2.144 11.509 -2.601 1.00 . A A . 6 THR HB 1 1 1 73 1 1 6 THR HG1 H -4.966 11.579 -2.470 1.00 . A A . 6 THR HG1 1 1 1 74 1 1 6 THR HG21 H -3.987 10.425 -4.697 1.00 . A A . 6 THR HG21 1 1 1 75 1 1 6 THR HG22 H -3.343 12.065 -4.770 1.00 . A A . 6 THR HG22 1 1 1 76 1 1 6 THR HG23 H -2.245 10.686 -4.782 1.00 . A A . 6 THR HG23 1 1 1 77 1 1 6 THR N N -4.102 9.841 -1.028 1.00 . A A . 6 THR N 1 1 1 78 1 1 6 THR O O -1.423 9.262 -0.785 1.00 . A A . 6 THR O 1 1 1 79 1 1 6 THR OG1 O -4.108 12.007 -2.429 1.00 . A A . 6 THR OG1 1 1 1 80 1 1 7 GLY C C 0.205 6.661 -3.582 1.00 . A A . 7 GLY C 1 1 1 81 1 1 7 GLY CA C -0.014 7.869 -2.690 1.00 . A A . 7 GLY CA 1 1 1 82 1 1 7 GLY H H -1.758 8.410 -3.763 1.00 . A A . 7 GLY H 1 1 1 83 1 1 7 GLY HA2 H 0.071 7.561 -1.659 1.00 . A A . 7 GLY HA2 1 1 1 84 1 1 7 GLY HA3 H 0.751 8.602 -2.901 1.00 . A A . 7 GLY HA3 1 1 1 85 1 1 7 GLY N N -1.315 8.480 -2.892 1.00 . A A . 7 GLY N 1 1 1 86 1 1 7 GLY O O -0.478 6.503 -4.594 1.00 . A A . 7 GLY O 1 1 1 87 1 1 8 PRO C C 0.419 3.487 -3.832 1.00 . A A . 8 PRO C 1 1 1 88 1 1 8 PRO CA C 1.462 4.585 -4.017 1.00 . A A . 8 PRO CA 1 1 1 89 1 1 8 PRO CB C 2.813 4.136 -3.463 1.00 . A A . 8 PRO CB 1 1 1 90 1 1 8 PRO CD C 2.027 5.896 -2.040 1.00 . A A . 8 PRO CD 1 1 1 91 1 1 8 PRO CG C 2.817 4.613 -2.052 1.00 . A A . 8 PRO CG 1 1 1 92 1 1 8 PRO HA H 1.559 4.814 -5.068 1.00 . A A . 8 PRO HA 1 1 1 93 1 1 8 PRO HB2 H 2.889 3.060 -3.518 1.00 . A A . 8 PRO HB2 1 1 1 94 1 1 8 PRO HB3 H 3.609 4.590 -4.034 1.00 . A A . 8 PRO HB3 1 1 1 95 1 1 8 PRO HD2 H 1.436 5.966 -1.140 1.00 . A A . 8 PRO HD2 1 1 1 96 1 1 8 PRO HD3 H 2.689 6.746 -2.125 1.00 . A A . 8 PRO HD3 1 1 1 97 1 1 8 PRO HG2 H 2.346 3.879 -1.415 1.00 . A A . 8 PRO HG2 1 1 1 98 1 1 8 PRO HG3 H 3.831 4.795 -1.729 1.00 . A A . 8 PRO HG3 1 1 1 99 1 1 8 PRO N N 1.161 5.784 -3.231 1.00 . A A . 8 PRO N 1 1 1 100 1 1 8 PRO O O -0.014 2.859 -4.799 1.00 . A A . 8 PRO O 1 1 1 101 1 1 9 CYS C C -2.355 2.846 -2.098 1.00 . A A . 9 CYS C 1 1 1 102 1 1 9 CYS CA C -0.970 2.232 -2.275 1.00 . A A . 9 CYS CA 1 1 1 103 1 1 9 CYS CB C -0.568 1.470 -1.010 1.00 . A A . 9 CYS CB 1 1 1 104 1 1 9 CYS H H 0.402 3.788 -1.855 1.00 . A A . 9 CYS H 1 1 1 105 1 1 9 CYS HA H -1.000 1.542 -3.105 1.00 . A A . 9 CYS HA 1 1 1 106 1 1 9 CYS HB2 H 0.502 1.541 -0.881 1.00 . A A . 9 CYS HB2 1 1 1 107 1 1 9 CYS HB3 H -1.058 1.918 -0.159 1.00 . A A . 9 CYS HB3 1 1 1 108 1 1 9 CYS N N 0.021 3.257 -2.584 1.00 . A A . 9 CYS N 1 1 1 109 1 1 9 CYS O O -2.943 2.782 -1.018 1.00 . A A . 9 CYS O 1 1 1 110 1 1 9 CYS SG S -1.007 -0.298 -1.038 1.00 . A A . 9 CYS SG 1 1 1 111 1 1 10 CYS C C -4.956 3.788 -4.421 1.00 . A A . 10 CYS C 1 1 1 112 1 1 10 CYS CA C -4.188 4.069 -3.134 1.00 . A A . 10 CYS CA 1 1 1 113 1 1 10 CYS CB C -4.055 5.581 -2.930 1.00 . A A . 10 CYS CB 1 1 1 114 1 1 10 CYS H H -2.353 3.461 -3.998 1.00 . A A . 10 CYS H 1 1 1 115 1 1 10 CYS HA H -4.734 3.649 -2.303 1.00 . A A . 10 CYS HA 1 1 1 116 1 1 10 CYS HB2 H -3.847 6.047 -3.881 1.00 . A A . 10 CYS HB2 1 1 1 117 1 1 10 CYS HB3 H -4.988 5.966 -2.543 1.00 . A A . 10 CYS HB3 1 1 1 118 1 1 10 CYS N N -2.871 3.442 -3.167 1.00 . A A . 10 CYS N 1 1 1 119 1 1 10 CYS O O -4.409 3.898 -5.519 1.00 . A A . 10 CYS O 1 1 1 120 1 1 10 CYS SG S -2.732 6.068 -1.775 1.00 . A A . 10 CYS SG 1 1 1 121 1 1 11 ARG C C -7.550 4.421 -6.095 1.00 . A A . 11 ARG C 1 1 1 122 1 1 11 ARG CA C -7.071 3.133 -5.431 1.00 . A A . 11 ARG CA 1 1 1 123 1 1 11 ARG CB C -8.271 2.284 -5.007 1.00 . A A . 11 ARG CB 1 1 1 124 1 1 11 ARG CD C -9.942 0.523 -5.655 1.00 . A A . 11 ARG CD 1 1 1 125 1 1 11 ARG CG C -8.919 1.530 -6.156 1.00 . A A . 11 ARG CG 1 1 1 126 1 1 11 ARG CZ C -11.354 -1.247 -6.627 1.00 . A A . 11 ARG CZ 1 1 1 127 1 1 11 ARG H H -6.607 3.359 -3.378 1.00 . A A . 11 ARG H 1 1 1 128 1 1 11 ARG HA H -6.479 2.575 -6.141 1.00 . A A . 11 ARG HA 1 1 1 129 1 1 11 ARG HB2 H -7.946 1.564 -4.270 1.00 . A A . 11 ARG HB2 1 1 1 130 1 1 11 ARG HB3 H -9.015 2.929 -4.563 1.00 . A A . 11 ARG HB3 1 1 1 131 1 1 11 ARG HD2 H -9.430 -0.238 -5.084 1.00 . A A . 11 ARG HD2 1 1 1 132 1 1 11 ARG HD3 H -10.649 1.034 -5.019 1.00 . A A . 11 ARG HD3 1 1 1 133 1 1 11 ARG HE H -10.635 0.322 -7.629 1.00 . A A . 11 ARG HE 1 1 1 134 1 1 11 ARG HG2 H -9.413 2.237 -6.805 1.00 . A A . 11 ARG HG2 1 1 1 135 1 1 11 ARG HG3 H -8.152 1.006 -6.708 1.00 . A A . 11 ARG HG3 1 1 1 136 1 1 11 ARG HH11 H -10.945 -1.486 -4.660 1.00 . A A . 11 ARG HH11 1 1 1 137 1 1 11 ARG HH12 H -11.937 -2.717 -5.367 1.00 . A A . 11 ARG HH12 1 1 1 138 1 1 11 ARG HH21 H -11.940 -1.296 -8.560 1.00 . A A . 11 ARG HH21 1 1 1 139 1 1 11 ARG HH22 H -12.501 -2.610 -7.582 1.00 . A A . 11 ARG HH22 1 1 1 140 1 1 11 ARG N N -6.227 3.428 -4.279 1.00 . A A . 11 ARG N 1 1 1 141 1 1 11 ARG NE N -10.665 -0.115 -6.752 1.00 . A A . 11 ARG NE 1 1 1 142 1 1 11 ARG NH1 N -11.417 -1.868 -5.455 1.00 . A A . 11 ARG NH1 1 1 1 143 1 1 11 ARG NH2 N -11.983 -1.760 -7.675 1.00 . A A . 11 ARG NH2 1 1 1 144 1 1 11 ARG O O -8.734 4.756 -6.044 1.00 . A A . 11 ARG O 1 1 1 145 1 1 12 GLN C C -7.307 7.479 -6.393 1.00 . A A . 12 GLN C 1 1 1 146 1 1 12 GLN CA C -6.940 6.393 -7.397 1.00 . A A . 12 GLN CA 1 1 1 147 1 1 12 GLN CB C -8.088 6.189 -8.390 1.00 . A A . 12 GLN CB 1 1 1 148 1 1 12 GLN CD C -9.196 4.554 -9.965 1.00 . A A . 12 GLN CD 1 1 1 149 1 1 12 GLN CG C -7.907 4.976 -9.288 1.00 . A A . 12 GLN CG 1 1 1 150 1 1 12 GLN H H -5.694 4.818 -6.725 1.00 . A A . 12 GLN H 1 1 1 151 1 1 12 GLN HA H -6.064 6.707 -7.937 1.00 . A A . 12 GLN HA 1 1 1 152 1 1 12 GLN HB2 H -9.009 6.068 -7.840 1.00 . A A . 12 GLN HB2 1 1 1 153 1 1 12 GLN HB3 H -8.166 7.065 -9.017 1.00 . A A . 12 GLN HB3 1 1 1 154 1 1 12 GLN HE21 H -8.698 2.639 -9.775 1.00 . A A . 12 GLN HE21 1 1 1 155 1 1 12 GLN HE22 H -10.214 2.947 -10.543 1.00 . A A . 12 GLN HE22 1 1 1 156 1 1 12 GLN HG2 H -7.179 5.214 -10.050 1.00 . A A . 12 GLN HG2 1 1 1 157 1 1 12 GLN HG3 H -7.544 4.153 -8.691 1.00 . A A . 12 GLN HG3 1 1 1 158 1 1 12 GLN N N -6.620 5.139 -6.720 1.00 . A A . 12 GLN N 1 1 1 159 1 1 12 GLN NE2 N -9.389 3.248 -10.109 1.00 . A A . 12 GLN NE2 1 1 1 160 1 1 12 GLN O O -6.580 8.458 -6.225 1.00 . A A . 12 GLN O 1 1 1 161 1 1 12 GLN OE1 O -10.009 5.392 -10.354 1.00 . A A . 12 GLN OE1 1 1 1 162 1 1 13 CYS C C -9.423 7.546 -3.490 1.00 . A A . 13 CYS C 1 1 1 163 1 1 13 CYS CA C -8.911 8.258 -4.738 1.00 . A A . 13 CYS CA 1 1 1 164 1 1 13 CYS CB C -10.017 9.133 -5.332 1.00 . A A . 13 CYS CB 1 1 1 165 1 1 13 CYS H H -8.971 6.497 -5.909 1.00 . A A . 13 CYS H 1 1 1 166 1 1 13 CYS HA H -8.077 8.886 -4.462 1.00 . A A . 13 CYS HA 1 1 1 167 1 1 13 CYS HB2 H -9.966 9.082 -6.409 1.00 . A A . 13 CYS HB2 1 1 1 168 1 1 13 CYS HB3 H -10.976 8.759 -5.005 1.00 . A A . 13 CYS HB3 1 1 1 169 1 1 13 CYS N N -8.440 7.297 -5.728 1.00 . A A . 13 CYS N 1 1 1 170 1 1 13 CYS O O -10.378 7.993 -2.856 1.00 . A A . 13 CYS O 1 1 1 171 1 1 13 CYS SG S -9.914 10.889 -4.856 1.00 . A A . 13 CYS SG 1 1 1 172 1 1 14 LYS C C -8.026 4.777 -1.495 1.00 . A A . 14 LYS C 1 1 1 173 1 1 14 LYS CA C -9.175 5.658 -1.974 1.00 . A A . 14 LYS CA 1 1 1 174 1 1 14 LYS CB C -10.396 4.795 -2.293 1.00 . A A . 14 LYS CB 1 1 1 175 1 1 14 LYS CD C -12.885 4.691 -2.621 1.00 . A A . 14 LYS CD 1 1 1 176 1 1 14 LYS CE C -13.874 5.217 -3.650 1.00 . A A . 14 LYS CE 1 1 1 177 1 1 14 LYS CG C -11.670 5.597 -2.504 1.00 . A A . 14 LYS CG 1 1 1 178 1 1 14 LYS H H -8.029 6.126 -3.691 1.00 . A A . 14 LYS H 1 1 1 179 1 1 14 LYS HA H -9.432 6.352 -1.187 1.00 . A A . 14 LYS HA 1 1 1 180 1 1 14 LYS HB2 H -10.199 4.231 -3.193 1.00 . A A . 14 LYS HB2 1 1 1 181 1 1 14 LYS HB3 H -10.560 4.107 -1.476 1.00 . A A . 14 LYS HB3 1 1 1 182 1 1 14 LYS HD2 H -12.560 3.706 -2.920 1.00 . A A . 14 LYS HD2 1 1 1 183 1 1 14 LYS HD3 H -13.375 4.635 -1.660 1.00 . A A . 14 LYS HD3 1 1 1 184 1 1 14 LYS HE2 H -13.334 5.483 -4.546 1.00 . A A . 14 LYS HE2 1 1 1 185 1 1 14 LYS HE3 H -14.585 4.436 -3.878 1.00 . A A . 14 LYS HE3 1 1 1 186 1 1 14 LYS HG2 H -11.809 6.261 -1.664 1.00 . A A . 14 LYS HG2 1 1 1 187 1 1 14 LYS HG3 H -11.574 6.175 -3.411 1.00 . A A . 14 LYS HG3 1 1 1 188 1 1 14 LYS HZ1 H -14.053 6.893 -2.417 1.00 . A A . 14 LYS HZ1 1 1 1 189 1 1 14 LYS HZ2 H -14.777 7.078 -3.935 1.00 . A A . 14 LYS HZ2 1 1 1 190 1 1 14 LYS HZ3 H -15.524 6.129 -2.751 1.00 . A A . 14 LYS HZ3 1 1 1 191 1 1 14 LYS N N -8.783 6.433 -3.145 1.00 . A A . 14 LYS N 1 1 1 192 1 1 14 LYS NZ N -14.609 6.413 -3.153 1.00 . A A . 14 LYS NZ 1 1 1 193 1 1 14 LYS O O -6.987 4.684 -2.148 1.00 . A A . 14 LYS O 1 1 1 194 1 1 15 LEU C C -7.110 1.952 -0.565 1.00 . A A . 15 LEU C 1 1 1 195 1 1 15 LEU CA C -7.204 3.257 0.219 1.00 . A A . 15 LEU CA 1 1 1 196 1 1 15 LEU CB C -7.517 2.963 1.688 1.00 . A A . 15 LEU CB 1 1 1 197 1 1 15 LEU CD1 C -7.288 3.601 4.101 1.00 . A A . 15 LEU CD1 1 1 1 198 1 1 15 LEU CD2 C -5.259 3.475 2.645 1.00 . A A . 15 LEU CD2 1 1 1 199 1 1 15 LEU CG C -6.742 3.811 2.697 1.00 . A A . 15 LEU CG 1 1 1 200 1 1 15 LEU H H -9.072 4.247 0.124 1.00 . A A . 15 LEU H 1 1 1 201 1 1 15 LEU HA H -6.255 3.769 0.158 1.00 . A A . 15 LEU HA 1 1 1 202 1 1 15 LEU HB2 H -8.573 3.126 1.848 1.00 . A A . 15 LEU HB2 1 1 1 203 1 1 15 LEU HB3 H -7.297 1.924 1.883 1.00 . A A . 15 LEU HB3 1 1 1 204 1 1 15 LEU HD11 H -7.416 2.544 4.283 1.00 . A A . 15 LEU HD11 1 1 1 205 1 1 15 LEU HD12 H -6.594 4.009 4.822 1.00 . A A . 15 LEU HD12 1 1 1 206 1 1 15 LEU HD13 H -8.240 4.101 4.195 1.00 . A A . 15 LEU HD13 1 1 1 207 1 1 15 LEU HD21 H -4.927 3.469 1.617 1.00 . A A . 15 LEU HD21 1 1 1 208 1 1 15 LEU HD22 H -4.702 4.217 3.198 1.00 . A A . 15 LEU HD22 1 1 1 209 1 1 15 LEU HD23 H -5.094 2.502 3.082 1.00 . A A . 15 LEU HD23 1 1 1 210 1 1 15 LEU HG H -6.859 4.855 2.446 1.00 . A A . 15 LEU HG 1 1 1 211 1 1 15 LEU N N -8.222 4.132 -0.350 1.00 . A A . 15 LEU N 1 1 1 212 1 1 15 LEU O O -8.096 1.228 -0.706 1.00 . A A . 15 LEU O 1 1 1 213 1 1 16 LYS C C -5.988 -0.798 -0.988 1.00 . A A . 16 LYS C 1 1 1 214 1 1 16 LYS CA C -5.696 0.436 -1.839 1.00 . A A . 16 LYS CA 1 1 1 215 1 1 16 LYS CB C -4.255 0.389 -2.352 1.00 . A A . 16 LYS CB 1 1 1 216 1 1 16 LYS CD C -4.234 -0.621 -4.653 1.00 . A A . 16 LYS CD 1 1 1 217 1 1 16 LYS CE C -3.219 0.320 -5.283 1.00 . A A . 16 LYS CE 1 1 1 218 1 1 16 LYS CG C -3.942 -0.848 -3.178 1.00 . A A . 16 LYS CG 1 1 1 219 1 1 16 LYS H H -5.169 2.271 -0.924 1.00 . A A . 16 LYS H 1 1 1 220 1 1 16 LYS HA H -6.369 0.449 -2.682 1.00 . A A . 16 LYS HA 1 1 1 221 1 1 16 LYS HB2 H -4.075 1.259 -2.964 1.00 . A A . 16 LYS HB2 1 1 1 222 1 1 16 LYS HB3 H -3.583 0.409 -1.506 1.00 . A A . 16 LYS HB3 1 1 1 223 1 1 16 LYS HD2 H -4.198 -1.569 -5.167 1.00 . A A . 16 LYS HD2 1 1 1 224 1 1 16 LYS HD3 H -5.220 -0.191 -4.752 1.00 . A A . 16 LYS HD3 1 1 1 225 1 1 16 LYS HE2 H -3.598 1.329 -5.225 1.00 . A A . 16 LYS HE2 1 1 1 226 1 1 16 LYS HE3 H -2.293 0.251 -4.732 1.00 . A A . 16 LYS HE3 1 1 1 227 1 1 16 LYS HG2 H -2.896 -1.091 -3.063 1.00 . A A . 16 LYS HG2 1 1 1 228 1 1 16 LYS HG3 H -4.546 -1.670 -2.823 1.00 . A A . 16 LYS HG3 1 1 1 229 1 1 16 LYS HZ1 H -3.094 -1.037 -6.866 1.00 . A A . 16 LYS HZ1 1 1 1 230 1 1 16 LYS HZ2 H -3.616 0.505 -7.325 1.00 . A A . 16 LYS HZ2 1 1 1 231 1 1 16 LYS HZ3 H -1.984 0.236 -6.966 1.00 . A A . 16 LYS HZ3 1 1 1 232 1 1 16 LYS N N -5.918 1.656 -1.071 1.00 . A A . 16 LYS N 1 1 1 233 1 1 16 LYS NZ N -2.960 -0.018 -6.710 1.00 . A A . 16 LYS NZ 1 1 1 234 1 1 16 LYS O O -5.632 -0.846 0.190 1.00 . A A . 16 LYS O 1 1 1 235 1 1 17 PRO C C -5.737 -3.803 -0.384 1.00 . A A . 17 PRO C 1 1 1 236 1 1 17 PRO CA C -6.978 -3.053 -0.853 1.00 . A A . 17 PRO CA 1 1 1 237 1 1 17 PRO CB C -7.745 -3.883 -1.890 1.00 . A A . 17 PRO CB 1 1 1 238 1 1 17 PRO CD C -7.106 -1.852 -2.969 1.00 . A A . 17 PRO CD 1 1 1 239 1 1 17 PRO CG C -7.351 -3.313 -3.210 1.00 . A A . 17 PRO CG 1 1 1 240 1 1 17 PRO HA H -7.617 -2.854 -0.005 1.00 . A A . 17 PRO HA 1 1 1 241 1 1 17 PRO HB2 H -7.459 -4.921 -1.807 1.00 . A A . 17 PRO HB2 1 1 1 242 1 1 17 PRO HB3 H -8.807 -3.783 -1.720 1.00 . A A . 17 PRO HB3 1 1 1 243 1 1 17 PRO HD2 H -6.344 -1.481 -3.639 1.00 . A A . 17 PRO HD2 1 1 1 244 1 1 17 PRO HD3 H -8.021 -1.290 -3.086 1.00 . A A . 17 PRO HD3 1 1 1 245 1 1 17 PRO HG2 H -6.450 -3.792 -3.562 1.00 . A A . 17 PRO HG2 1 1 1 246 1 1 17 PRO HG3 H -8.152 -3.447 -3.922 1.00 . A A . 17 PRO HG3 1 1 1 247 1 1 17 PRO N N -6.643 -1.818 -1.571 1.00 . A A . 17 PRO N 1 1 1 248 1 1 17 PRO O O -4.716 -3.826 -1.071 1.00 . A A . 17 PRO O 1 1 1 249 1 1 18 ALA C C -4.201 -6.214 0.373 1.00 . A A . 18 ALA C 1 1 1 250 1 1 18 ALA CA C -4.717 -5.169 1.357 1.00 . A A . 18 ALA CA 1 1 1 251 1 1 18 ALA CB C -5.135 -5.831 2.661 1.00 . A A . 18 ALA CB 1 1 1 252 1 1 18 ALA H H -6.672 -4.361 1.293 1.00 . A A . 18 ALA H 1 1 1 253 1 1 18 ALA HA H -3.921 -4.471 1.575 1.00 . A A . 18 ALA HA 1 1 1 254 1 1 18 ALA HB1 H -5.904 -5.239 3.135 1.00 . A A . 18 ALA HB1 1 1 1 255 1 1 18 ALA HB2 H -4.281 -5.904 3.318 1.00 . A A . 18 ALA HB2 1 1 1 256 1 1 18 ALA HB3 H -5.517 -6.820 2.456 1.00 . A A . 18 ALA HB3 1 1 1 257 1 1 18 ALA N N -5.832 -4.416 0.792 1.00 . A A . 18 ALA N 1 1 1 258 1 1 18 ALA O O -4.980 -6.862 -0.325 1.00 . A A . 18 ALA O 1 1 1 259 1 1 19 GLY C C -1.519 -6.680 -1.718 1.00 . A A . 19 GLY C 1 1 1 260 1 1 19 GLY CA C -2.284 -7.336 -0.582 1.00 . A A . 19 GLY CA 1 1 1 261 1 1 19 GLY H H -2.310 -5.824 0.900 1.00 . A A . 19 GLY H 1 1 1 262 1 1 19 GLY HA2 H -3.066 -7.953 -1.000 1.00 . A A . 19 GLY HA2 1 1 1 263 1 1 19 GLY HA3 H -1.606 -7.963 -0.023 1.00 . A A . 19 GLY HA3 1 1 1 264 1 1 19 GLY N N -2.882 -6.370 0.321 1.00 . A A . 19 GLY N 1 1 1 265 1 1 19 GLY O O -0.761 -7.343 -2.425 1.00 . A A . 19 GLY O 1 1 1 266 1 1 20 THR C C 0.419 -4.379 -2.587 1.00 . A A . 20 THR C 1 1 1 267 1 1 20 THR CA C -1.038 -4.638 -2.953 1.00 . A A . 20 THR CA 1 1 1 268 1 1 20 THR CB C -1.753 -3.312 -3.217 1.00 . A A . 20 THR CB 1 1 1 269 1 1 20 THR CG2 C -1.424 -2.714 -4.568 1.00 . A A . 20 THR CG2 1 1 1 270 1 1 20 THR H H -2.333 -4.900 -1.300 1.00 . A A . 20 THR H 1 1 1 271 1 1 20 THR HA H -1.071 -5.239 -3.849 1.00 . A A . 20 THR HA 1 1 1 272 1 1 20 THR HB H -1.460 -2.600 -2.460 1.00 . A A . 20 THR HB 1 1 1 273 1 1 20 THR HG1 H -3.455 -3.349 -2.248 1.00 . A A . 20 THR HG1 1 1 1 274 1 1 20 THR HG21 H -0.359 -2.548 -4.638 1.00 . A A . 20 THR HG21 1 1 1 275 1 1 20 THR HG22 H -1.735 -3.392 -5.348 1.00 . A A . 20 THR HG22 1 1 1 276 1 1 20 THR HG23 H -1.943 -1.773 -4.681 1.00 . A A . 20 THR HG23 1 1 1 277 1 1 20 THR N N -1.717 -5.376 -1.895 1.00 . A A . 20 THR N 1 1 1 278 1 1 20 THR O O 0.711 -3.693 -1.608 1.00 . A A . 20 THR O 1 1 1 279 1 1 20 THR OG1 O -3.158 -3.478 -3.152 1.00 . A A . 20 THR OG1 1 1 1 280 1 1 21 THR C C 3.153 -3.292 -3.228 1.00 . A A . 21 THR C 1 1 1 281 1 1 21 THR CA C 2.758 -4.763 -3.138 1.00 . A A . 21 THR CA 1 1 1 282 1 1 21 THR CB C 3.569 -5.585 -4.142 1.00 . A A . 21 THR CB 1 1 1 283 1 1 21 THR CG2 C 4.108 -6.875 -3.562 1.00 . A A . 21 THR CG2 1 1 1 284 1 1 21 THR H H 1.036 -5.470 -4.145 1.00 . A A . 21 THR H 1 1 1 285 1 1 21 THR HA H 2.970 -5.119 -2.141 1.00 . A A . 21 THR HA 1 1 1 286 1 1 21 THR HB H 4.412 -4.997 -4.479 1.00 . A A . 21 THR HB 1 1 1 287 1 1 21 THR HG1 H 2.503 -5.115 -5.717 1.00 . A A . 21 THR HG1 1 1 1 288 1 1 21 THR HG21 H 3.732 -7.001 -2.557 1.00 . A A . 21 THR HG21 1 1 1 289 1 1 21 THR HG22 H 3.789 -7.706 -4.173 1.00 . A A . 21 THR HG22 1 1 1 290 1 1 21 THR HG23 H 5.187 -6.837 -3.541 1.00 . A A . 21 THR HG23 1 1 1 291 1 1 21 THR N N 1.330 -4.933 -3.380 1.00 . A A . 21 THR N 1 1 1 292 1 1 21 THR O O 2.604 -2.539 -4.032 1.00 . A A . 21 THR O 1 1 1 293 1 1 21 THR OG1 O 2.782 -5.919 -5.272 1.00 . A A . 21 THR OG1 1 1 1 294 1 1 22 CYS C C 5.953 -1.411 -1.725 1.00 . A A . 22 CYS C 1 1 1 295 1 1 22 CYS CA C 4.581 -1.511 -2.383 1.00 . A A . 22 CYS CA 1 1 1 296 1 1 22 CYS CB C 3.583 -0.614 -1.647 1.00 . A A . 22 CYS CB 1 1 1 297 1 1 22 CYS H H 4.510 -3.539 -1.781 1.00 . A A . 22 CYS H 1 1 1 298 1 1 22 CYS HA H 4.662 -1.178 -3.407 1.00 . A A . 22 CYS HA 1 1 1 299 1 1 22 CYS HB2 H 4.069 0.314 -1.386 1.00 . A A . 22 CYS HB2 1 1 1 300 1 1 22 CYS HB3 H 2.749 -0.404 -2.302 1.00 . A A . 22 CYS HB3 1 1 1 301 1 1 22 CYS N N 4.110 -2.891 -2.398 1.00 . A A . 22 CYS N 1 1 1 302 1 1 22 CYS O O 6.290 -0.394 -1.119 1.00 . A A . 22 CYS O 1 1 1 303 1 1 22 CYS SG S 2.916 -1.339 -0.114 1.00 . A A . 22 CYS SG 1 1 1 304 1 1 23 TRP C C 8.783 -3.819 -1.604 1.00 . A A . 23 TRP C 1 1 1 305 1 1 23 TRP CA C 8.078 -2.508 -1.265 1.00 . A A . 23 TRP CA 1 1 1 306 1 1 23 TRP CB C 7.999 -2.329 0.253 1.00 . A A . 23 TRP CB 1 1 1 307 1 1 23 TRP CD1 C 9.678 -3.120 2.020 1.00 . A A . 23 TRP CD1 1 1 1 308 1 1 23 TRP CD2 C 10.507 -1.630 0.568 1.00 . A A . 23 TRP CD2 1 1 1 309 1 1 23 TRP CE2 C 11.521 -1.982 1.479 1.00 . A A . 23 TRP CE2 1 1 1 310 1 1 23 TRP CE3 C 10.798 -0.706 -0.439 1.00 . A A . 23 TRP CE3 1 1 1 311 1 1 23 TRP CG C 9.335 -2.370 0.932 1.00 . A A . 23 TRP CG 1 1 1 312 1 1 23 TRP CH2 C 13.059 -0.539 0.416 1.00 . A A . 23 TRP CH2 1 1 1 313 1 1 23 TRP CZ2 C 12.803 -1.441 1.412 1.00 . A A . 23 TRP CZ2 1 1 1 314 1 1 23 TRP CZ3 C 12.070 -0.170 -0.504 1.00 . A A . 23 TRP CZ3 1 1 1 315 1 1 23 TRP H H 6.417 -3.255 -2.343 1.00 . A A . 23 TRP H 1 1 1 316 1 1 23 TRP HA H 8.643 -1.691 -1.687 1.00 . A A . 23 TRP HA 1 1 1 317 1 1 23 TRP HB2 H 7.544 -1.374 0.473 1.00 . A A . 23 TRP HB2 1 1 1 318 1 1 23 TRP HB3 H 7.388 -3.116 0.670 1.00 . A A . 23 TRP HB3 1 1 1 319 1 1 23 TRP HD1 H 9.004 -3.790 2.533 1.00 . A A . 23 TRP HD1 1 1 1 320 1 1 23 TRP HE1 H 11.468 -3.313 3.100 1.00 . A A . 23 TRP HE1 1 1 1 321 1 1 23 TRP HE3 H 10.049 -0.408 -1.158 1.00 . A A . 23 TRP HE3 1 1 1 322 1 1 23 TRP HH2 H 14.039 -0.095 0.328 1.00 . A A . 23 TRP HH2 1 1 1 323 1 1 23 TRP HZ2 H 13.576 -1.716 2.114 1.00 . A A . 23 TRP HZ2 1 1 1 324 1 1 23 TRP HZ3 H 12.313 0.546 -1.276 1.00 . A A . 23 TRP HZ3 1 1 1 325 1 1 23 TRP N N 6.742 -2.475 -1.848 1.00 . A A . 23 TRP N 1 1 1 326 1 1 23 TRP NE1 N 10.990 -2.892 2.356 1.00 . A A . 23 TRP NE1 1 1 1 327 1 1 23 TRP O O 9.046 -4.641 -0.725 1.00 . A A . 23 TRP O 1 1 1 328 1 1 24 ARG C C 11.044 -4.874 -4.091 1.00 . A A . 24 ARG C 1 1 1 329 1 1 24 ARG CA C 9.762 -5.217 -3.341 1.00 . A A . 24 ARG CA 1 1 1 330 1 1 24 ARG CB C 8.833 -6.035 -4.240 1.00 . A A . 24 ARG CB 1 1 1 331 1 1 24 ARG CD C 7.328 -6.074 -6.252 1.00 . A A . 24 ARG CD 1 1 1 332 1 1 24 ARG CG C 8.100 -5.200 -5.277 1.00 . A A . 24 ARG CG 1 1 1 333 1 1 24 ARG CZ C 6.188 -5.860 -8.426 1.00 . A A . 24 ARG CZ 1 1 1 334 1 1 24 ARG H H 8.852 -3.316 -3.538 1.00 . A A . 24 ARG H 1 1 1 335 1 1 24 ARG HA H 10.014 -5.804 -2.470 1.00 . A A . 24 ARG HA 1 1 1 336 1 1 24 ARG HB2 H 9.418 -6.780 -4.758 1.00 . A A . 24 ARG HB2 1 1 1 337 1 1 24 ARG HB3 H 8.098 -6.530 -3.623 1.00 . A A . 24 ARG HB3 1 1 1 338 1 1 24 ARG HD2 H 7.962 -6.892 -6.562 1.00 . A A . 24 ARG HD2 1 1 1 339 1 1 24 ARG HD3 H 6.456 -6.466 -5.751 1.00 . A A . 24 ARG HD3 1 1 1 340 1 1 24 ARG HE H 7.162 -4.388 -7.495 1.00 . A A . 24 ARG HE 1 1 1 341 1 1 24 ARG HG2 H 7.407 -4.543 -4.772 1.00 . A A . 24 ARG HG2 1 1 1 342 1 1 24 ARG HG3 H 8.820 -4.612 -5.826 1.00 . A A . 24 ARG HG3 1 1 1 343 1 1 24 ARG HH11 H 6.075 -7.702 -7.598 1.00 . A A . 24 ARG HH11 1 1 1 344 1 1 24 ARG HH12 H 5.281 -7.525 -9.127 1.00 . A A . 24 ARG HH12 1 1 1 345 1 1 24 ARG HH21 H 6.118 -4.153 -9.506 1.00 . A A . 24 ARG HH21 1 1 1 346 1 1 24 ARG HH22 H 5.306 -5.511 -10.210 1.00 . A A . 24 ARG HH22 1 1 1 347 1 1 24 ARG N N 9.087 -4.007 -2.884 1.00 . A A . 24 ARG N 1 1 1 348 1 1 24 ARG NE N 6.902 -5.331 -7.435 1.00 . A A . 24 ARG NE 1 1 1 349 1 1 24 ARG NH1 N 5.818 -7.134 -8.380 1.00 . A A . 24 ARG NH1 1 1 1 350 1 1 24 ARG NH2 N 5.842 -5.114 -9.466 1.00 . A A . 24 ARG NH2 1 1 1 351 1 1 24 ARG O O 11.003 -4.321 -5.191 1.00 . A A . 24 ARG O 1 1 1 352 1 1 25 THR C C 14.313 -6.208 -4.192 1.00 . A A . 25 THR C 1 1 1 353 1 1 25 THR CA C 13.478 -4.935 -4.102 1.00 . A A . 25 THR CA 1 1 1 354 1 1 25 THR CB C 14.230 -3.872 -3.299 1.00 . A A . 25 THR CB 1 1 1 355 1 1 25 THR CG2 C 13.372 -2.679 -2.935 1.00 . A A . 25 THR CG2 1 1 1 356 1 1 25 THR H H 12.149 -5.645 -2.615 1.00 . A A . 25 THR H 1 1 1 357 1 1 25 THR HA H 13.302 -4.563 -5.100 1.00 . A A . 25 THR HA 1 1 1 358 1 1 25 THR HB H 15.062 -3.513 -3.888 1.00 . A A . 25 THR HB 1 1 1 359 1 1 25 THR HG1 H 15.698 -4.396 -2.114 1.00 . A A . 25 THR HG1 1 1 1 360 1 1 25 THR HG21 H 12.684 -2.471 -3.741 1.00 . A A . 25 THR HG21 1 1 1 361 1 1 25 THR HG22 H 12.817 -2.896 -2.035 1.00 . A A . 25 THR HG22 1 1 1 362 1 1 25 THR HG23 H 14.004 -1.818 -2.770 1.00 . A A . 25 THR HG23 1 1 1 363 1 1 25 THR N N 12.182 -5.207 -3.490 1.00 . A A . 25 THR N 1 1 1 364 1 1 25 THR O O 13.803 -7.312 -3.999 1.00 . A A . 25 THR O 1 1 1 365 1 1 25 THR OG1 O 14.739 -4.418 -2.096 1.00 . A A . 25 THR OG1 1 1 1 366 1 1 26 SER C C 16.527 -8.000 -3.310 1.00 . A A . 26 SER C 1 1 1 367 1 1 26 SER CA C 16.506 -7.186 -4.600 1.00 . A A . 26 SER CA 1 1 1 368 1 1 26 SER CB C 17.919 -6.707 -4.937 1.00 . A A . 26 SER CB 1 1 1 369 1 1 26 SER H H 15.949 -5.144 -4.628 1.00 . A A . 26 SER H 1 1 1 370 1 1 26 SER HA H 16.148 -7.814 -5.402 1.00 . A A . 26 SER HA 1 1 1 371 1 1 26 SER HB2 H 17.862 -5.769 -5.470 1.00 . A A . 26 SER HB2 1 1 1 372 1 1 26 SER HB3 H 18.477 -6.569 -4.023 1.00 . A A . 26 SER HB3 1 1 1 373 1 1 26 SER HG H 18.011 -7.954 -6.446 1.00 . A A . 26 SER HG 1 1 1 374 1 1 26 SER N N 15.600 -6.048 -4.485 1.00 . A A . 26 SER N 1 1 1 375 1 1 26 SER O O 16.739 -9.212 -3.332 1.00 . A A . 26 SER O 1 1 1 376 1 1 26 SER OG O 18.598 -7.650 -5.749 1.00 . A A . 26 SER OG 1 1 1 377 1 1 27 VAL C C 15.088 -7.559 -0.062 1.00 . A A . 27 VAL C 1 1 1 378 1 1 27 VAL CA C 16.297 -7.985 -0.887 1.00 . A A . 27 VAL CA 1 1 1 379 1 1 27 VAL CB C 17.581 -7.679 -0.092 1.00 . A A . 27 VAL CB 1 1 1 380 1 1 27 VAL CG1 C 17.672 -8.566 1.140 1.00 . A A . 27 VAL CG1 1 1 1 381 1 1 27 VAL CG2 C 18.810 -7.851 -0.973 1.00 . A A . 27 VAL CG2 1 1 1 382 1 1 27 VAL H H 16.141 -6.360 -2.233 1.00 . A A . 27 VAL H 1 1 1 383 1 1 27 VAL HA H 16.248 -9.051 -1.055 1.00 . A A . 27 VAL HA 1 1 1 384 1 1 27 VAL HB H 17.540 -6.650 0.235 1.00 . A A . 27 VAL HB 1 1 1 385 1 1 27 VAL HG11 H 17.129 -9.483 0.965 1.00 . A A . 27 VAL HG11 1 1 1 386 1 1 27 VAL HG12 H 18.708 -8.794 1.344 1.00 . A A . 27 VAL HG12 1 1 1 387 1 1 27 VAL HG13 H 17.243 -8.050 1.987 1.00 . A A . 27 VAL HG13 1 1 1 388 1 1 27 VAL HG21 H 18.723 -7.213 -1.840 1.00 . A A . 27 VAL HG21 1 1 1 389 1 1 27 VAL HG22 H 19.694 -7.581 -0.414 1.00 . A A . 27 VAL HG22 1 1 1 390 1 1 27 VAL HG23 H 18.884 -8.881 -1.289 1.00 . A A . 27 VAL HG23 1 1 1 391 1 1 27 VAL N N 16.304 -7.325 -2.186 1.00 . A A . 27 VAL N 1 1 1 392 1 1 27 VAL O O 15.149 -7.502 1.166 1.00 . A A . 27 VAL O 1 1 1 393 1 1 28 SER C C 11.532 -7.302 -0.848 1.00 . A A . 28 SER C 1 1 1 394 1 1 28 SER CA C 12.763 -6.838 -0.075 1.00 . A A . 28 SER CA 1 1 1 395 1 1 28 SER CB C 12.739 -5.316 0.079 1.00 . A A . 28 SER CB 1 1 1 396 1 1 28 SER H H 14.000 -7.324 -1.723 1.00 . A A . 28 SER H 1 1 1 397 1 1 28 SER HA H 12.749 -7.290 0.905 1.00 . A A . 28 SER HA 1 1 1 398 1 1 28 SER HB2 H 13.744 -4.932 -0.007 1.00 . A A . 28 SER HB2 1 1 1 399 1 1 28 SER HB3 H 12.122 -4.887 -0.697 1.00 . A A . 28 SER HB3 1 1 1 400 1 1 28 SER HG H 11.257 -5.022 1.326 1.00 . A A . 28 SER HG 1 1 1 401 1 1 28 SER N N 13.987 -7.260 -0.745 1.00 . A A . 28 SER N 1 1 1 402 1 1 28 SER O O 11.591 -7.514 -2.059 1.00 . A A . 28 SER O 1 1 1 403 1 1 28 SER OG O 12.213 -4.939 1.340 1.00 . A A . 28 SER OG 1 1 1 404 1 1 29 SER C C 8.036 -7.916 0.258 1.00 . A A . 29 SER C 1 1 1 405 1 1 29 SER CA C 9.173 -7.898 -0.758 1.00 . A A . 29 SER CA 1 1 1 406 1 1 29 SER CB C 9.347 -9.290 -1.370 1.00 . A A . 29 SER CB 1 1 1 407 1 1 29 SER H H 10.435 -7.275 0.823 1.00 . A A . 29 SER H 1 1 1 408 1 1 29 SER HA H 8.928 -7.198 -1.543 1.00 . A A . 29 SER HA 1 1 1 409 1 1 29 SER HB2 H 8.445 -9.564 -1.896 1.00 . A A . 29 SER HB2 1 1 1 410 1 1 29 SER HB3 H 10.177 -9.275 -2.062 1.00 . A A . 29 SER HB3 1 1 1 411 1 1 29 SER HG H 9.498 -11.138 -0.740 1.00 . A A . 29 SER HG 1 1 1 412 1 1 29 SER N N 10.419 -7.459 -0.139 1.00 . A A . 29 SER N 1 1 1 413 1 1 29 SER O O 7.791 -8.929 0.912 1.00 . A A . 29 SER O 1 1 1 414 1 1 29 SER OG O 9.604 -10.259 -0.369 1.00 . A A . 29 SER OG 1 1 1 415 1 1 30 HIS C C 4.924 -6.412 0.584 1.00 . A A . 30 HIS C 1 1 1 416 1 1 30 HIS CA C 6.233 -6.673 1.322 1.00 . A A . 30 HIS CA 1 1 1 417 1 1 30 HIS CB C 6.498 -5.548 2.325 1.00 . A A . 30 HIS CB 1 1 1 418 1 1 30 HIS CD2 C 8.422 -6.928 3.386 1.00 . A A . 30 HIS CD2 1 1 1 419 1 1 30 HIS CE1 C 8.994 -5.519 4.965 1.00 . A A . 30 HIS CE1 1 1 1 420 1 1 30 HIS CG C 7.610 -5.850 3.282 1.00 . A A . 30 HIS CG 1 1 1 421 1 1 30 HIS H H 7.589 -6.013 -0.165 1.00 . A A . 30 HIS H 1 1 1 422 1 1 30 HIS HA H 6.152 -7.607 1.856 1.00 . A A . 30 HIS HA 1 1 1 423 1 1 30 HIS HB2 H 6.759 -4.649 1.787 1.00 . A A . 30 HIS HB2 1 1 1 424 1 1 30 HIS HB3 H 5.602 -5.371 2.901 1.00 . A A . 30 HIS HB3 1 1 1 425 1 1 30 HIS HD1 H 7.593 -4.111 4.473 1.00 . A A . 30 HIS HD1 1 1 1 426 1 1 30 HIS HD2 H 8.404 -7.807 2.757 1.00 . A A . 30 HIS HD2 1 1 1 427 1 1 30 HIS HE1 H 9.498 -5.068 5.807 1.00 . A A . 30 HIS HE1 1 1 1 428 1 1 30 HIS HE2 H 9.913 -7.342 4.805 1.00 . A A . 30 HIS HE2 1 1 1 429 1 1 30 HIS N N 7.345 -6.787 0.385 1.00 . A A . 30 HIS N 1 1 1 430 1 1 30 HIS ND1 N 7.994 -4.986 4.286 1.00 . A A . 30 HIS ND1 1 1 1 431 1 1 30 HIS NE2 N 9.272 -6.697 4.439 1.00 . A A . 30 HIS NE2 1 1 1 432 1 1 30 HIS O O 4.894 -6.358 -0.646 1.00 . A A . 30 HIS O 1 1 1 433 1 1 31 TYR C C 1.735 -5.024 1.623 1.00 . A A . 31 TYR C 1 1 1 434 1 1 31 TYR CA C 2.532 -5.997 0.760 1.00 . A A . 31 TYR CA 1 1 1 435 1 1 31 TYR CB C 1.759 -7.307 0.601 1.00 . A A . 31 TYR CB 1 1 1 436 1 1 31 TYR CD1 C 2.131 -8.619 -1.524 1.00 . A A . 31 TYR CD1 1 1 1 437 1 1 31 TYR CD2 C 3.550 -9.067 0.339 1.00 . A A . 31 TYR CD2 1 1 1 438 1 1 31 TYR CE1 C 2.800 -9.572 -2.268 1.00 . A A . 31 TYR CE1 1 1 1 439 1 1 31 TYR CE2 C 4.224 -10.021 -0.399 1.00 . A A . 31 TYR CE2 1 1 1 440 1 1 31 TYR CG C 2.494 -8.350 -0.210 1.00 . A A . 31 TYR CG 1 1 1 441 1 1 31 TYR CZ C 3.845 -10.270 -1.702 1.00 . A A . 31 TYR CZ 1 1 1 442 1 1 31 TYR H H 3.933 -6.306 2.317 1.00 . A A . 31 TYR H 1 1 1 443 1 1 31 TYR HA H 2.682 -5.557 -0.214 1.00 . A A . 31 TYR HA 1 1 1 444 1 1 31 TYR HB2 H 1.564 -7.723 1.578 1.00 . A A . 31 TYR HB2 1 1 1 445 1 1 31 TYR HB3 H 0.819 -7.104 0.108 1.00 . A A . 31 TYR HB3 1 1 1 446 1 1 31 TYR HD1 H 1.312 -8.070 -1.965 1.00 . A A . 31 TYR HD1 1 1 1 447 1 1 31 TYR HD2 H 3.844 -8.870 1.359 1.00 . A A . 31 TYR HD2 1 1 1 448 1 1 31 TYR HE1 H 2.503 -9.766 -3.288 1.00 . A A . 31 TYR HE1 1 1 1 449 1 1 31 TYR HE2 H 5.043 -10.568 0.045 1.00 . A A . 31 TYR HE2 1 1 1 450 1 1 31 TYR HH H 3.938 -11.972 -2.590 1.00 . A A . 31 TYR HH 1 1 1 451 1 1 31 TYR N N 3.845 -6.252 1.342 1.00 . A A . 31 TYR N 1 1 1 452 1 1 31 TYR O O 2.121 -4.719 2.751 1.00 . A A . 31 TYR O 1 1 1 453 1 1 31 TYR OH O 4.514 -11.219 -2.439 1.00 . A A . 31 TYR OH 1 1 1 454 1 1 32 CYS C C -1.230 -4.343 2.688 1.00 . A A . 32 CYS C 1 1 1 455 1 1 32 CYS CA C -0.232 -3.602 1.806 1.00 . A A . 32 CYS CA 1 1 1 456 1 1 32 CYS CB C -0.974 -2.694 0.822 1.00 . A A . 32 CYS CB 1 1 1 457 1 1 32 CYS H H 0.364 -4.820 0.181 1.00 . A A . 32 CYS H 1 1 1 458 1 1 32 CYS HA H 0.403 -2.994 2.433 1.00 . A A . 32 CYS HA 1 1 1 459 1 1 32 CYS HB2 H -0.908 -3.119 -0.168 1.00 . A A . 32 CYS HB2 1 1 1 460 1 1 32 CYS HB3 H -2.013 -2.631 1.113 1.00 . A A . 32 CYS HB3 1 1 1 461 1 1 32 CYS N N 0.620 -4.540 1.084 1.00 . A A . 32 CYS N 1 1 1 462 1 1 32 CYS O O -1.610 -5.477 2.396 1.00 . A A . 32 CYS O 1 1 1 463 1 1 32 CYS SG S -0.318 -0.996 0.739 1.00 . A A . 32 CYS SG 1 1 1 464 1 1 33 THR C C -3.999 -3.683 4.521 1.00 . A A . 33 THR C 1 1 1 465 1 1 33 THR CA C -2.609 -4.293 4.693 1.00 . A A . 33 THR CA 1 1 1 466 1 1 33 THR CB C -2.134 -4.109 6.136 1.00 . A A . 33 THR CB 1 1 1 467 1 1 33 THR CG2 C -1.741 -2.684 6.459 1.00 . A A . 33 THR CG2 1 1 1 468 1 1 33 THR H H -1.314 -2.793 3.948 1.00 . A A . 33 THR H 1 1 1 469 1 1 33 THR HA H -2.664 -5.349 4.475 1.00 . A A . 33 THR HA 1 1 1 470 1 1 33 THR HB H -1.269 -4.736 6.301 1.00 . A A . 33 THR HB 1 1 1 471 1 1 33 THR HG1 H -3.870 -3.868 7.010 1.00 . A A . 33 THR HG1 1 1 1 472 1 1 33 THR HG21 H -2.569 -2.024 6.241 1.00 . A A . 33 THR HG21 1 1 1 473 1 1 33 THR HG22 H -1.488 -2.609 7.507 1.00 . A A . 33 THR HG22 1 1 1 474 1 1 33 THR HG23 H -0.888 -2.401 5.861 1.00 . A A . 33 THR HG23 1 1 1 475 1 1 33 THR N N -1.653 -3.695 3.768 1.00 . A A . 33 THR N 1 1 1 476 1 1 33 THR O O -4.861 -3.830 5.387 1.00 . A A . 33 THR O 1 1 1 477 1 1 33 THR OG1 O -3.145 -4.495 7.050 1.00 . A A . 33 THR OG1 1 1 1 478 1 1 34 GLY C C -5.967 -1.496 4.281 1.00 . A A . 34 GLY C 1 1 1 479 1 1 34 GLY CA C -5.502 -2.380 3.140 1.00 . A A . 34 GLY CA 1 1 1 480 1 1 34 GLY H H -3.492 -2.912 2.741 1.00 . A A . 34 GLY H 1 1 1 481 1 1 34 GLY HA2 H -6.234 -3.157 2.980 1.00 . A A . 34 GLY HA2 1 1 1 482 1 1 34 GLY HA3 H -5.427 -1.782 2.244 1.00 . A A . 34 GLY HA3 1 1 1 483 1 1 34 GLY N N -4.213 -2.998 3.399 1.00 . A A . 34 GLY N 1 1 1 484 1 1 34 GLY O O -7.166 -1.283 4.461 1.00 . A A . 34 GLY O 1 1 1 485 1 1 35 ARG C C -4.865 1.311 5.932 1.00 . A A . 35 ARG C 1 1 1 486 1 1 35 ARG CA C -5.338 -0.116 6.186 1.00 . A A . 35 ARG CA 1 1 1 487 1 1 35 ARG CB C -4.698 -0.657 7.466 1.00 . A A . 35 ARG CB 1 1 1 488 1 1 35 ARG CD C -4.769 -0.735 9.976 1.00 . A A . 35 ARG CD 1 1 1 489 1 1 35 ARG CG C -5.555 -0.457 8.705 1.00 . A A . 35 ARG CG 1 1 1 490 1 1 35 ARG CZ C -5.160 -0.846 12.407 1.00 . A A . 35 ARG CZ 1 1 1 491 1 1 35 ARG H H -4.079 -1.187 4.863 1.00 . A A . 35 ARG H 1 1 1 492 1 1 35 ARG HA H -6.410 -0.111 6.305 1.00 . A A . 35 ARG HA 1 1 1 493 1 1 35 ARG HB2 H -4.519 -1.715 7.345 1.00 . A A . 35 ARG HB2 1 1 1 494 1 1 35 ARG HB3 H -3.754 -0.156 7.622 1.00 . A A . 35 ARG HB3 1 1 1 495 1 1 35 ARG HD2 H -4.355 -1.731 9.918 1.00 . A A . 35 ARG HD2 1 1 1 496 1 1 35 ARG HD3 H -3.966 -0.017 10.052 1.00 . A A . 35 ARG HD3 1 1 1 497 1 1 35 ARG HE H -6.551 -0.412 11.043 1.00 . A A . 35 ARG HE 1 1 1 498 1 1 35 ARG HG2 H -5.906 0.563 8.728 1.00 . A A . 35 ARG HG2 1 1 1 499 1 1 35 ARG HG3 H -6.399 -1.130 8.660 1.00 . A A . 35 ARG HG3 1 1 1 500 1 1 35 ARG HH11 H -3.257 -1.239 11.846 1.00 . A A . 35 ARG HH11 1 1 1 501 1 1 35 ARG HH12 H -3.558 -1.310 13.549 1.00 . A A . 35 ARG HH12 1 1 1 502 1 1 35 ARG HH21 H -6.948 -0.504 13.283 1.00 . A A . 35 ARG HH21 1 1 1 503 1 1 35 ARG HH22 H -5.654 -0.893 14.366 1.00 . A A . 35 ARG HH22 1 1 1 504 1 1 35 ARG N N -5.017 -0.980 5.056 1.00 . A A . 35 ARG N 1 1 1 505 1 1 35 ARG NE N -5.606 -0.640 11.170 1.00 . A A . 35 ARG NE 1 1 1 506 1 1 35 ARG NH1 N -3.887 -1.157 12.617 1.00 . A A . 35 ARG NH1 1 1 1 507 1 1 35 ARG NH2 N -5.988 -0.739 13.436 1.00 . A A . 35 ARG NH2 1 1 1 508 1 1 35 ARG O O -5.506 2.273 6.357 1.00 . A A . 35 ARG O 1 1 1 509 1 1 36 SER C C -2.503 2.748 3.562 1.00 . A A . 36 SER C 1 1 1 510 1 1 36 SER CA C -3.183 2.753 4.927 1.00 . A A . 36 SER CA 1 1 1 511 1 1 36 SER CB C -2.183 3.173 6.006 1.00 . A A . 36 SER CB 1 1 1 512 1 1 36 SER H H -3.275 0.639 4.925 1.00 . A A . 36 SER H 1 1 1 513 1 1 36 SER HA H -3.996 3.463 4.908 1.00 . A A . 36 SER HA 1 1 1 514 1 1 36 SER HB2 H -1.355 2.479 6.016 1.00 . A A . 36 SER HB2 1 1 1 515 1 1 36 SER HB3 H -1.817 4.166 5.789 1.00 . A A . 36 SER HB3 1 1 1 516 1 1 36 SER HG H -2.865 2.278 7.610 1.00 . A A . 36 SER HG 1 1 1 517 1 1 36 SER N N -3.741 1.442 5.237 1.00 . A A . 36 SER N 1 1 1 518 1 1 36 SER O O -2.114 1.696 3.055 1.00 . A A . 36 SER O 1 1 1 519 1 1 36 SER OG O -2.787 3.179 7.288 1.00 . A A . 36 SER OG 1 1 1 520 1 1 37 CYS C C -0.226 3.814 1.764 1.00 . A A . 37 CYS C 1 1 1 521 1 1 37 CYS CA C -1.727 4.067 1.668 1.00 . A A . 37 CYS CA 1 1 1 522 1 1 37 CYS CB C -1.985 5.462 1.098 1.00 . A A . 37 CYS CB 1 1 1 523 1 1 37 CYS H H -2.691 4.734 3.430 1.00 . A A . 37 CYS H 1 1 1 524 1 1 37 CYS HA H -2.163 3.332 1.008 1.00 . A A . 37 CYS HA 1 1 1 525 1 1 37 CYS HB2 H -2.108 6.159 1.914 1.00 . A A . 37 CYS HB2 1 1 1 526 1 1 37 CYS HB3 H -1.137 5.761 0.500 1.00 . A A . 37 CYS HB3 1 1 1 527 1 1 37 CYS N N -2.362 3.932 2.974 1.00 . A A . 37 CYS N 1 1 1 528 1 1 37 CYS O O 0.407 3.398 0.794 1.00 . A A . 37 CYS O 1 1 1 529 1 1 37 CYS SG S -3.470 5.573 0.049 1.00 . A A . 37 CYS SG 1 1 1 530 1 1 38 GLU C C 2.085 2.391 3.364 1.00 . A A . 38 GLU C 1 1 1 531 1 1 38 GLU CA C 1.766 3.869 3.163 1.00 . A A . 38 GLU CA 1 1 1 532 1 1 38 GLU CB C 2.232 4.673 4.378 1.00 . A A . 38 GLU CB 1 1 1 533 1 1 38 GLU CD C 1.707 6.721 5.760 1.00 . A A . 38 GLU CD 1 1 1 534 1 1 38 GLU CG C 1.757 6.117 4.370 1.00 . A A . 38 GLU CG 1 1 1 535 1 1 38 GLU H H -0.218 4.399 3.677 1.00 . A A . 38 GLU H 1 1 1 536 1 1 38 GLU HA H 2.290 4.222 2.287 1.00 . A A . 38 GLU HA 1 1 1 537 1 1 38 GLU HB2 H 1.858 4.199 5.273 1.00 . A A . 38 GLU HB2 1 1 1 538 1 1 38 GLU HB3 H 3.311 4.671 4.404 1.00 . A A . 38 GLU HB3 1 1 1 539 1 1 38 GLU HG2 H 2.434 6.701 3.765 1.00 . A A . 38 GLU HG2 1 1 1 540 1 1 38 GLU HG3 H 0.767 6.155 3.940 1.00 . A A . 38 GLU HG3 1 1 1 541 1 1 38 GLU N N 0.339 4.069 2.941 1.00 . A A . 38 GLU N 1 1 1 542 1 1 38 GLU O O 1.357 1.677 4.053 1.00 . A A . 38 GLU O 1 1 1 543 1 1 38 GLU OE1 O 0.591 7.010 6.241 1.00 . A A . 38 GLU OE1 1 1 1 544 1 1 38 GLU OE2 O 2.782 6.904 6.367 1.00 . A A . 38 GLU OE2 1 1 1 545 1 1 39 CYS C C 4.142 0.254 4.267 1.00 . A A . 39 CYS C 1 1 1 546 1 1 39 CYS CA C 3.595 0.547 2.870 1.00 . A A . 39 CYS CA 1 1 1 547 1 1 39 CYS CB C 4.658 0.226 1.817 1.00 . A A . 39 CYS CB 1 1 1 548 1 1 39 CYS H H 3.718 2.558 2.222 1.00 . A A . 39 CYS H 1 1 1 549 1 1 39 CYS HA H 2.728 -0.073 2.695 1.00 . A A . 39 CYS HA 1 1 1 550 1 1 39 CYS HB2 H 4.570 0.930 1.003 1.00 . A A . 39 CYS HB2 1 1 1 551 1 1 39 CYS HB3 H 5.636 0.321 2.264 1.00 . A A . 39 CYS HB3 1 1 1 552 1 1 39 CYS N N 3.178 1.939 2.757 1.00 . A A . 39 CYS N 1 1 1 553 1 1 39 CYS O O 4.907 1.046 4.818 1.00 . A A . 39 CYS O 1 1 1 554 1 1 39 CYS SG S 4.529 -1.450 1.114 1.00 . A A . 39 CYS SG 1 1 1 555 1 1 40 PRO C C 5.694 -1.655 6.217 1.00 . A A . 40 PRO C 1 1 1 556 1 1 40 PRO CA C 4.218 -1.274 6.201 1.00 . A A . 40 PRO CA 1 1 1 557 1 1 40 PRO CB C 3.349 -2.485 6.543 1.00 . A A . 40 PRO CB 1 1 1 558 1 1 40 PRO CD C 2.846 -1.895 4.282 1.00 . A A . 40 PRO CD 1 1 1 559 1 1 40 PRO CG C 2.968 -3.061 5.224 1.00 . A A . 40 PRO CG 1 1 1 560 1 1 40 PRO HA H 4.043 -0.487 6.920 1.00 . A A . 40 PRO HA 1 1 1 561 1 1 40 PRO HB2 H 3.921 -3.188 7.131 1.00 . A A . 40 PRO HB2 1 1 1 562 1 1 40 PRO HB3 H 2.480 -2.164 7.098 1.00 . A A . 40 PRO HB3 1 1 1 563 1 1 40 PRO HD2 H 3.166 -2.178 3.290 1.00 . A A . 40 PRO HD2 1 1 1 564 1 1 40 PRO HD3 H 1.830 -1.530 4.263 1.00 . A A . 40 PRO HD3 1 1 1 565 1 1 40 PRO HG2 H 3.736 -3.740 4.883 1.00 . A A . 40 PRO HG2 1 1 1 566 1 1 40 PRO HG3 H 2.022 -3.576 5.307 1.00 . A A . 40 PRO HG3 1 1 1 567 1 1 40 PRO N N 3.757 -0.889 4.862 1.00 . A A . 40 PRO N 1 1 1 568 1 1 40 PRO O O 6.280 -1.954 5.176 1.00 . A A . 40 PRO O 1 1 1 569 1 1 41 SER C C 7.860 -3.431 8.016 1.00 . A A . 41 SER C 1 1 1 570 1 1 41 SER CA C 7.699 -1.985 7.556 1.00 . A A . 41 SER CA 1 1 1 571 1 1 41 SER CB C 8.372 -1.042 8.556 1.00 . A A . 41 SER CB 1 1 1 572 1 1 41 SER H H 5.771 -1.393 8.198 1.00 . A A . 41 SER H 1 1 1 573 1 1 41 SER HA H 8.174 -1.872 6.593 1.00 . A A . 41 SER HA 1 1 1 574 1 1 41 SER HB2 H 8.276 -0.025 8.208 1.00 . A A . 41 SER HB2 1 1 1 575 1 1 41 SER HB3 H 7.892 -1.140 9.518 1.00 . A A . 41 SER HB3 1 1 1 576 1 1 41 SER HG H 10.260 -0.536 8.676 1.00 . A A . 41 SER HG 1 1 1 577 1 1 41 SER N N 6.291 -1.641 7.404 1.00 . A A . 41 SER N 1 1 1 578 1 1 41 SER O O 8.758 -3.749 8.795 1.00 . A A . 41 SER O 1 1 1 579 1 1 41 SER OG O 9.748 -1.347 8.699 1.00 . A A . 41 SER OG 1 1 1 580 1 1 42 TYR C C 6.524 -6.586 6.741 1.00 . A A . 42 TYR C 1 1 1 581 1 1 42 TYR CA C 7.028 -5.715 7.888 1.00 . A A . 42 TYR CA 1 1 1 582 1 1 42 TYR CB C 6.191 -5.969 9.143 1.00 . A A . 42 TYR CB 1 1 1 583 1 1 42 TYR CD1 C 3.818 -5.799 8.299 1.00 . A A . 42 TYR CD1 1 1 1 584 1 1 42 TYR CD2 C 4.564 -4.188 9.890 1.00 . A A . 42 TYR CD2 1 1 1 585 1 1 42 TYR CE1 C 2.575 -5.197 8.266 1.00 . A A . 42 TYR CE1 1 1 1 586 1 1 42 TYR CE2 C 3.323 -3.580 9.862 1.00 . A A . 42 TYR CE2 1 1 1 587 1 1 42 TYR CG C 4.832 -5.306 9.110 1.00 . A A . 42 TYR CG 1 1 1 588 1 1 42 TYR CZ C 2.333 -4.088 9.049 1.00 . A A . 42 TYR CZ 1 1 1 589 1 1 42 TYR H H 6.290 -3.989 6.910 1.00 . A A . 42 TYR H 1 1 1 590 1 1 42 TYR HA H 8.056 -5.972 8.094 1.00 . A A . 42 TYR HA 1 1 1 591 1 1 42 TYR HB2 H 6.039 -7.032 9.257 1.00 . A A . 42 TYR HB2 1 1 1 592 1 1 42 TYR HB3 H 6.724 -5.593 10.005 1.00 . A A . 42 TYR HB3 1 1 1 593 1 1 42 TYR HD1 H 4.010 -6.668 7.687 1.00 . A A . 42 TYR HD1 1 1 1 594 1 1 42 TYR HD2 H 5.343 -3.793 10.525 1.00 . A A . 42 TYR HD2 1 1 1 595 1 1 42 TYR HE1 H 1.799 -5.595 7.629 1.00 . A A . 42 TYR HE1 1 1 1 596 1 1 42 TYR HE2 H 3.134 -2.712 10.476 1.00 . A A . 42 TYR HE2 1 1 1 597 1 1 42 TYR HH H 0.592 -3.748 9.792 1.00 . A A . 42 TYR HH 1 1 1 598 1 1 42 TYR N N 6.983 -4.302 7.528 1.00 . A A . 42 TYR N 1 1 1 599 1 1 42 TYR O O 5.683 -6.159 5.949 1.00 . A A . 42 TYR O 1 1 1 600 1 1 42 TYR OH O 1.096 -3.485 9.019 1.00 . A A . 42 TYR OH 1 1 1 601 1 1 43 PRO C C 5.200 -9.257 5.761 1.00 . A A . 43 PRO C 1 1 1 602 1 1 43 PRO CA C 6.629 -8.758 5.578 1.00 . A A . 43 PRO CA 1 1 1 603 1 1 43 PRO CB C 7.622 -9.914 5.724 1.00 . A A . 43 PRO CB 1 1 1 604 1 1 43 PRO CD C 8.040 -8.415 7.538 1.00 . A A . 43 PRO CD 1 1 1 605 1 1 43 PRO CG C 8.049 -9.868 7.150 1.00 . A A . 43 PRO CG 1 1 1 606 1 1 43 PRO HA H 6.731 -8.313 4.599 1.00 . A A . 43 PRO HA 1 1 1 607 1 1 43 PRO HB2 H 7.130 -10.846 5.488 1.00 . A A . 43 PRO HB2 1 1 1 608 1 1 43 PRO HB3 H 8.457 -9.761 5.057 1.00 . A A . 43 PRO HB3 1 1 1 609 1 1 43 PRO HD2 H 7.745 -8.303 8.571 1.00 . A A . 43 PRO HD2 1 1 1 610 1 1 43 PRO HD3 H 9.011 -7.973 7.372 1.00 . A A . 43 PRO HD3 1 1 1 611 1 1 43 PRO HG2 H 7.353 -10.424 7.760 1.00 . A A . 43 PRO HG2 1 1 1 612 1 1 43 PRO HG3 H 9.044 -10.275 7.248 1.00 . A A . 43 PRO HG3 1 1 1 613 1 1 43 PRO N N 7.033 -7.826 6.636 1.00 . A A . 43 PRO N 1 1 1 614 1 1 43 PRO O O 4.615 -9.115 6.835 1.00 . A A . 43 PRO O 1 1 1 615 1 1 44 GLY C C 3.201 -11.679 5.501 1.00 . A A . 44 GLY C 1 1 1 616 1 1 44 GLY CA C 3.287 -10.353 4.771 1.00 . A A . 44 GLY CA 1 1 1 617 1 1 44 GLY H H 5.157 -9.927 3.876 1.00 . A A . 44 GLY H 1 1 1 618 1 1 44 GLY HA2 H 2.914 -10.484 3.765 1.00 . A A . 44 GLY HA2 1 1 1 619 1 1 44 GLY HA3 H 2.666 -9.632 5.282 1.00 . A A . 44 GLY HA3 1 1 1 620 1 1 44 GLY N N 4.643 -9.842 4.706 1.00 . A A . 44 GLY N 1 1 1 621 1 1 44 GLY O O 2.717 -12.659 4.898 1.00 . A A . 44 GLY O 1 1 1 622 1 1 44 GLY OXT O 3.618 -11.736 6.677 1.00 . A A . 44 GLY OXT 1 1 2 623 1 1 1 ALA C C -10.703 12.795 5.614 1.00 . A A . 1 ALA C 1 1 2 624 1 1 1 ALA CA C -10.972 13.982 6.533 1.00 . A A . 1 ALA CA 1 1 2 625 1 1 1 ALA CB C -9.663 14.655 6.921 1.00 . A A . 1 ALA CB 1 1 2 626 1 1 1 ALA H1 H -11.196 12.761 8.173 1.00 . A A . 1 ALA H1 1 1 2 627 1 1 1 ALA H2 H -11.746 14.368 8.399 1.00 . A A . 1 ALA H2 1 1 2 628 1 1 1 ALA H3 H -12.668 13.271 7.454 1.00 . A A . 1 ALA H3 1 1 2 629 1 1 1 ALA HA H -11.575 14.704 6.002 1.00 . A A . 1 ALA HA 1 1 2 630 1 1 1 ALA HB1 H -8.931 13.901 7.171 1.00 . A A . 1 ALA HB1 1 1 2 631 1 1 1 ALA HB2 H -9.303 15.246 6.092 1.00 . A A . 1 ALA HB2 1 1 2 632 1 1 1 ALA HB3 H -9.827 15.295 7.775 1.00 . A A . 1 ALA HB3 1 1 2 633 1 1 1 ALA N N -11.712 13.557 7.749 1.00 . A A . 1 ALA N 1 1 2 634 1 1 1 ALA O O -10.389 11.698 6.076 1.00 . A A . 1 ALA O 1 1 2 635 1 1 2 MET C C -10.292 12.567 1.956 1.00 . A A . 2 MET C 1 1 2 636 1 1 2 MET CA C -10.599 11.971 3.326 1.00 . A A . 2 MET CA 1 1 2 637 1 1 2 MET CB C -11.821 11.054 3.234 1.00 . A A . 2 MET CB 1 1 2 638 1 1 2 MET CE C -11.432 6.989 3.296 1.00 . A A . 2 MET CE 1 1 2 639 1 1 2 MET CG C -11.510 9.684 2.655 1.00 . A A . 2 MET CG 1 1 2 640 1 1 2 MET H H -11.082 13.918 4.003 1.00 . A A . 2 MET H 1 1 2 641 1 1 2 MET HA H -9.749 11.391 3.652 1.00 . A A . 2 MET HA 1 1 2 642 1 1 2 MET HB2 H -12.230 10.919 4.224 1.00 . A A . 2 MET HB2 1 1 2 643 1 1 2 MET HB3 H -12.564 11.526 2.608 1.00 . A A . 2 MET HB3 1 1 2 644 1 1 2 MET HE1 H -12.444 7.118 2.941 1.00 . A A . 2 MET HE1 1 1 2 645 1 1 2 MET HE2 H -10.812 6.623 2.491 1.00 . A A . 2 MET HE2 1 1 2 646 1 1 2 MET HE3 H -11.424 6.278 4.109 1.00 . A A . 2 MET HE3 1 1 2 647 1 1 2 MET HG2 H -12.426 9.250 2.281 1.00 . A A . 2 MET HG2 1 1 2 648 1 1 2 MET HG3 H -10.811 9.802 1.840 1.00 . A A . 2 MET HG3 1 1 2 649 1 1 2 MET N N -10.829 13.022 4.310 1.00 . A A . 2 MET N 1 1 2 650 1 1 2 MET O O -11.200 12.935 1.210 1.00 . A A . 2 MET O 1 1 2 651 1 1 2 MET SD S -10.796 8.561 3.872 1.00 . A A . 2 MET SD 1 1 2 652 1 1 3 ASP C C -8.446 12.107 -0.698 1.00 . A A . 3 ASP C 1 1 2 653 1 1 3 ASP CA C -8.580 13.209 0.349 1.00 . A A . 3 ASP CA 1 1 2 654 1 1 3 ASP CB C -7.249 13.948 0.507 1.00 . A A . 3 ASP CB 1 1 2 655 1 1 3 ASP CG C -6.131 13.034 0.970 1.00 . A A . 3 ASP CG 1 1 2 656 1 1 3 ASP H H -8.329 12.348 2.267 1.00 . A A . 3 ASP H 1 1 2 657 1 1 3 ASP HA H -9.334 13.909 0.023 1.00 . A A . 3 ASP HA 1 1 2 658 1 1 3 ASP HB2 H -6.968 14.376 -0.443 1.00 . A A . 3 ASP HB2 1 1 2 659 1 1 3 ASP HB3 H -7.368 14.739 1.233 1.00 . A A . 3 ASP HB3 1 1 2 660 1 1 3 ASP N N -9.007 12.658 1.630 1.00 . A A . 3 ASP N 1 1 2 661 1 1 3 ASP O O -7.413 11.984 -1.357 1.00 . A A . 3 ASP O 1 1 2 662 1 1 3 ASP OD1 O -6.423 12.061 1.697 1.00 . A A . 3 ASP OD1 1 1 2 663 1 1 3 ASP OD2 O -4.965 13.292 0.606 1.00 . A A . 3 ASP OD2 1 1 2 664 1 1 4 CYS C C -8.506 9.119 -1.435 1.00 . A A . 4 CYS C 1 1 2 665 1 1 4 CYS CA C -9.508 10.211 -1.813 1.00 . A A . 4 CYS CA 1 1 2 666 1 1 4 CYS CB C -9.193 10.737 -3.214 1.00 . A A . 4 CYS CB 1 1 2 667 1 1 4 CYS H H -10.292 11.457 -0.289 1.00 . A A . 4 CYS H 1 1 2 668 1 1 4 CYS HA H -10.499 9.783 -1.816 1.00 . A A . 4 CYS HA 1 1 2 669 1 1 4 CYS HB2 H -8.686 11.685 -3.126 1.00 . A A . 4 CYS HB2 1 1 2 670 1 1 4 CYS HB3 H -8.545 10.035 -3.716 1.00 . A A . 4 CYS HB3 1 1 2 671 1 1 4 CYS N N -9.499 11.307 -0.845 1.00 . A A . 4 CYS N 1 1 2 672 1 1 4 CYS O O -8.249 8.206 -2.220 1.00 . A A . 4 CYS O 1 1 2 673 1 1 4 CYS SG S -10.661 10.990 -4.264 1.00 . A A . 4 CYS SG 1 1 2 674 1 1 5 THR C C -5.782 8.147 -0.718 1.00 . A A . 5 THR C 1 1 2 675 1 1 5 THR CA C -6.972 8.232 0.233 1.00 . A A . 5 THR CA 1 1 2 676 1 1 5 THR CB C -7.630 6.858 0.367 1.00 . A A . 5 THR CB 1 1 2 677 1 1 5 THR CG2 C -7.094 6.048 1.527 1.00 . A A . 5 THR CG2 1 1 2 678 1 1 5 THR H H -8.183 9.962 0.347 1.00 . A A . 5 THR H 1 1 2 679 1 1 5 THR HA H -6.620 8.549 1.203 1.00 . A A . 5 THR HA 1 1 2 680 1 1 5 THR HB H -7.454 6.296 -0.539 1.00 . A A . 5 THR HB 1 1 2 681 1 1 5 THR HG1 H -9.206 7.535 1.313 1.00 . A A . 5 THR HG1 1 1 2 682 1 1 5 THR HG21 H -6.079 6.350 1.738 1.00 . A A . 5 THR HG21 1 1 2 683 1 1 5 THR HG22 H -7.709 6.216 2.398 1.00 . A A . 5 THR HG22 1 1 2 684 1 1 5 THR HG23 H -7.112 4.998 1.271 1.00 . A A . 5 THR HG23 1 1 2 685 1 1 5 THR N N -7.942 9.215 -0.236 1.00 . A A . 5 THR N 1 1 2 686 1 1 5 THR O O -5.782 7.353 -1.659 1.00 . A A . 5 THR O 1 1 2 687 1 1 5 THR OG1 O -9.030 6.988 0.544 1.00 . A A . 5 THR OG1 1 1 2 688 1 1 6 THR C C -2.376 8.418 -0.553 1.00 . A A . 6 THR C 1 1 2 689 1 1 6 THR CA C -3.575 8.989 -1.303 1.00 . A A . 6 THR CA 1 1 2 690 1 1 6 THR CB C -3.271 10.416 -1.765 1.00 . A A . 6 THR CB 1 1 2 691 1 1 6 THR CG2 C -4.056 10.827 -2.992 1.00 . A A . 6 THR CG2 1 1 2 692 1 1 6 THR H H -4.828 9.582 0.296 1.00 . A A . 6 THR H 1 1 2 693 1 1 6 THR HA H -3.767 8.374 -2.170 1.00 . A A . 6 THR HA 1 1 2 694 1 1 6 THR HB H -2.220 10.490 -2.004 1.00 . A A . 6 THR HB 1 1 2 695 1 1 6 THR HG1 H -3.309 12.229 -1.025 1.00 . A A . 6 THR HG1 1 1 2 696 1 1 6 THR HG21 H -4.693 10.012 -3.302 1.00 . A A . 6 THR HG21 1 1 2 697 1 1 6 THR HG22 H -4.662 11.689 -2.759 1.00 . A A . 6 THR HG22 1 1 2 698 1 1 6 THR HG23 H -3.372 11.072 -3.791 1.00 . A A . 6 THR HG23 1 1 2 699 1 1 6 THR N N -4.770 8.971 -0.468 1.00 . A A . 6 THR N 1 1 2 700 1 1 6 THR O O -2.277 8.544 0.668 1.00 . A A . 6 THR O 1 1 2 701 1 1 6 THR OG1 O -3.560 11.347 -0.738 1.00 . A A . 6 THR OG1 1 1 2 702 1 1 7 GLY C C 0.275 6.056 -1.495 1.00 . A A . 7 GLY C 1 1 2 703 1 1 7 GLY CA C -0.287 7.207 -0.682 1.00 . A A . 7 GLY CA 1 1 2 704 1 1 7 GLY H H -1.601 7.721 -2.261 1.00 . A A . 7 GLY H 1 1 2 705 1 1 7 GLY HA2 H -0.545 6.846 0.302 1.00 . A A . 7 GLY HA2 1 1 2 706 1 1 7 GLY HA3 H 0.470 7.971 -0.587 1.00 . A A . 7 GLY HA3 1 1 2 707 1 1 7 GLY N N -1.468 7.790 -1.292 1.00 . A A . 7 GLY N 1 1 2 708 1 1 7 GLY O O -0.100 5.873 -2.653 1.00 . A A . 7 GLY O 1 1 2 709 1 1 8 PRO C C 0.946 2.857 -1.524 1.00 . A A . 8 PRO C 1 1 2 710 1 1 8 PRO CA C 1.798 4.122 -1.602 1.00 . A A . 8 PRO CA 1 1 2 711 1 1 8 PRO CB C 3.101 3.935 -0.833 1.00 . A A . 8 PRO CB 1 1 2 712 1 1 8 PRO CD C 1.700 5.404 0.462 1.00 . A A . 8 PRO CD 1 1 2 713 1 1 8 PRO CG C 2.773 4.346 0.564 1.00 . A A . 8 PRO CG 1 1 2 714 1 1 8 PRO HA H 2.014 4.351 -2.634 1.00 . A A . 8 PRO HA 1 1 2 715 1 1 8 PRO HB2 H 3.406 2.899 -0.881 1.00 . A A . 8 PRO HB2 1 1 2 716 1 1 8 PRO HB3 H 3.869 4.563 -1.258 1.00 . A A . 8 PRO HB3 1 1 2 717 1 1 8 PRO HD2 H 0.920 5.218 1.185 1.00 . A A . 8 PRO HD2 1 1 2 718 1 1 8 PRO HD3 H 2.126 6.386 0.611 1.00 . A A . 8 PRO HD3 1 1 2 719 1 1 8 PRO HG2 H 2.406 3.495 1.118 1.00 . A A . 8 PRO HG2 1 1 2 720 1 1 8 PRO HG3 H 3.653 4.751 1.041 1.00 . A A . 8 PRO HG3 1 1 2 721 1 1 8 PRO N N 1.187 5.258 -0.914 1.00 . A A . 8 PRO N 1 1 2 722 1 1 8 PRO O O 1.462 1.766 -1.279 1.00 . A A . 8 PRO O 1 1 2 723 1 1 9 CYS C C -2.696 2.309 -2.042 1.00 . A A . 9 CYS C 1 1 2 724 1 1 9 CYS CA C -1.276 1.873 -1.693 1.00 . A A . 9 CYS CA 1 1 2 725 1 1 9 CYS CB C -1.254 1.225 -0.308 1.00 . A A . 9 CYS CB 1 1 2 726 1 1 9 CYS H H -0.711 3.898 -1.931 1.00 . A A . 9 CYS H 1 1 2 727 1 1 9 CYS HA H -0.944 1.151 -2.424 1.00 . A A . 9 CYS HA 1 1 2 728 1 1 9 CYS HB2 H -0.229 1.080 -0.002 1.00 . A A . 9 CYS HB2 1 1 2 729 1 1 9 CYS HB3 H -1.744 1.880 0.396 1.00 . A A . 9 CYS HB3 1 1 2 730 1 1 9 CYS N N -0.358 3.007 -1.737 1.00 . A A . 9 CYS N 1 1 2 731 1 1 9 CYS O O -3.667 1.805 -1.477 1.00 . A A . 9 CYS O 1 1 2 732 1 1 9 CYS SG S -2.087 -0.394 -0.232 1.00 . A A . 9 CYS SG 1 1 2 733 1 1 10 CYS C C -4.211 3.731 -4.930 1.00 . A A . 10 CYS C 1 1 2 734 1 1 10 CYS CA C -4.108 3.751 -3.407 1.00 . A A . 10 CYS CA 1 1 2 735 1 1 10 CYS CB C -4.333 5.177 -2.891 1.00 . A A . 10 CYS CB 1 1 2 736 1 1 10 CYS H H -1.996 3.607 -3.390 1.00 . A A . 10 CYS H 1 1 2 737 1 1 10 CYS HA H -4.869 3.103 -2.997 1.00 . A A . 10 CYS HA 1 1 2 738 1 1 10 CYS HB2 H -3.957 5.878 -3.621 1.00 . A A . 10 CYS HB2 1 1 2 739 1 1 10 CYS HB3 H -5.393 5.339 -2.759 1.00 . A A . 10 CYS HB3 1 1 2 740 1 1 10 CYS N N -2.808 3.246 -2.977 1.00 . A A . 10 CYS N 1 1 2 741 1 1 10 CYS O O -3.206 3.856 -5.629 1.00 . A A . 10 CYS O 1 1 2 742 1 1 10 CYS SG S -3.514 5.546 -1.302 1.00 . A A . 10 CYS SG 1 1 2 743 1 1 11 ARG C C -5.933 4.935 -7.426 1.00 . A A . 11 ARG C 1 1 2 744 1 1 11 ARG CA C -5.650 3.535 -6.880 1.00 . A A . 11 ARG CA 1 1 2 745 1 1 11 ARG CB C -6.801 2.582 -7.219 1.00 . A A . 11 ARG CB 1 1 2 746 1 1 11 ARG CD C -7.280 0.120 -7.065 1.00 . A A . 11 ARG CD 1 1 2 747 1 1 11 ARG CG C -6.340 1.186 -7.605 1.00 . A A . 11 ARG CG 1 1 2 748 1 1 11 ARG CZ C -9.640 -0.517 -7.386 1.00 . A A . 11 ARG CZ 1 1 2 749 1 1 11 ARG H H -6.193 3.476 -4.834 1.00 . A A . 11 ARG H 1 1 2 750 1 1 11 ARG HA H -4.747 3.166 -7.339 1.00 . A A . 11 ARG HA 1 1 2 751 1 1 11 ARG HB2 H -7.449 2.500 -6.359 1.00 . A A . 11 ARG HB2 1 1 2 752 1 1 11 ARG HB3 H -7.363 2.993 -8.045 1.00 . A A . 11 ARG HB3 1 1 2 753 1 1 11 ARG HD2 H -6.780 -0.836 -7.103 1.00 . A A . 11 ARG HD2 1 1 2 754 1 1 11 ARG HD3 H -7.522 0.358 -6.039 1.00 . A A . 11 ARG HD3 1 1 2 755 1 1 11 ARG HE H -8.512 0.418 -8.742 1.00 . A A . 11 ARG HE 1 1 2 756 1 1 11 ARG HG2 H -6.310 1.112 -8.682 1.00 . A A . 11 ARG HG2 1 1 2 757 1 1 11 ARG HG3 H -5.352 1.019 -7.203 1.00 . A A . 11 ARG HG3 1 1 2 758 1 1 11 ARG HH11 H -8.875 -1.022 -5.583 1.00 . A A . 11 ARG HH11 1 1 2 759 1 1 11 ARG HH12 H -10.532 -1.457 -5.835 1.00 . A A . 11 ARG HH12 1 1 2 760 1 1 11 ARG HH21 H -10.690 -0.154 -9.074 1.00 . A A . 11 ARG HH21 1 1 2 761 1 1 11 ARG HH22 H -11.563 -0.965 -7.816 1.00 . A A . 11 ARG HH22 1 1 2 762 1 1 11 ARG N N -5.429 3.572 -5.439 1.00 . A A . 11 ARG N 1 1 2 763 1 1 11 ARG NE N -8.517 0.038 -7.838 1.00 . A A . 11 ARG NE 1 1 2 764 1 1 11 ARG NH1 N -9.685 -1.042 -6.168 1.00 . A A . 11 ARG NH1 1 1 2 765 1 1 11 ARG NH2 N -10.719 -0.548 -8.155 1.00 . A A . 11 ARG NH2 1 1 2 766 1 1 11 ARG O O -5.010 5.661 -7.797 1.00 . A A . 11 ARG O 1 1 2 767 1 1 12 GLN C C -8.327 7.426 -6.899 1.00 . A A . 12 GLN C 1 1 2 768 1 1 12 GLN CA C -7.598 6.625 -7.974 1.00 . A A . 12 GLN CA 1 1 2 769 1 1 12 GLN CB C -8.490 6.477 -9.208 1.00 . A A . 12 GLN CB 1 1 2 770 1 1 12 GLN CD C -9.537 7.745 -11.125 1.00 . A A . 12 GLN CD 1 1 2 771 1 1 12 GLN CG C -8.338 7.611 -10.208 1.00 . A A . 12 GLN CG 1 1 2 772 1 1 12 GLN H H -7.901 4.693 -7.165 1.00 . A A . 12 GLN H 1 1 2 773 1 1 12 GLN HA H -6.699 7.154 -8.253 1.00 . A A . 12 GLN HA 1 1 2 774 1 1 12 GLN HB2 H -8.245 5.551 -9.707 1.00 . A A . 12 GLN HB2 1 1 2 775 1 1 12 GLN HB3 H -9.522 6.442 -8.890 1.00 . A A . 12 GLN HB3 1 1 2 776 1 1 12 GLN HE21 H -8.511 8.944 -12.334 1.00 . A A . 12 GLN HE21 1 1 2 777 1 1 12 GLN HE22 H -10.140 8.616 -12.808 1.00 . A A . 12 GLN HE22 1 1 2 778 1 1 12 GLN HG2 H -8.213 8.537 -9.667 1.00 . A A . 12 GLN HG2 1 1 2 779 1 1 12 GLN HG3 H -7.460 7.427 -10.811 1.00 . A A . 12 GLN HG3 1 1 2 780 1 1 12 GLN N N -7.207 5.312 -7.473 1.00 . A A . 12 GLN N 1 1 2 781 1 1 12 GLN NE2 N -9.380 8.512 -12.197 1.00 . A A . 12 GLN NE2 1 1 2 782 1 1 12 GLN O O -8.371 8.655 -6.952 1.00 . A A . 12 GLN O 1 1 2 783 1 1 12 GLN OE1 O -10.593 7.164 -10.874 1.00 . A A . 12 GLN OE1 1 1 2 784 1 1 13 CYS C C -10.131 6.339 -3.834 1.00 . A A . 13 CYS C 1 1 2 785 1 1 13 CYS CA C -9.626 7.371 -4.839 1.00 . A A . 13 CYS CA 1 1 2 786 1 1 13 CYS CB C -10.803 8.176 -5.395 1.00 . A A . 13 CYS CB 1 1 2 787 1 1 13 CYS H H -8.830 5.747 -5.935 1.00 . A A . 13 CYS H 1 1 2 788 1 1 13 CYS HA H -8.946 8.042 -4.338 1.00 . A A . 13 CYS HA 1 1 2 789 1 1 13 CYS HB2 H -10.447 8.825 -6.180 1.00 . A A . 13 CYS HB2 1 1 2 790 1 1 13 CYS HB3 H -11.535 7.494 -5.803 1.00 . A A . 13 CYS HB3 1 1 2 791 1 1 13 CYS N N -8.899 6.723 -5.924 1.00 . A A . 13 CYS N 1 1 2 792 1 1 13 CYS O O -11.223 6.478 -3.282 1.00 . A A . 13 CYS O 1 1 2 793 1 1 13 CYS SG S -11.645 9.217 -4.158 1.00 . A A . 13 CYS SG 1 1 2 794 1 1 14 LYS C C -8.503 3.367 -2.336 1.00 . A A . 14 LYS C 1 1 2 795 1 1 14 LYS CA C -9.701 4.252 -2.662 1.00 . A A . 14 LYS CA 1 1 2 796 1 1 14 LYS CB C -10.836 3.402 -3.237 1.00 . A A . 14 LYS CB 1 1 2 797 1 1 14 LYS CD C -12.962 2.130 -2.820 1.00 . A A . 14 LYS CD 1 1 2 798 1 1 14 LYS CE C -13.756 2.971 -3.806 1.00 . A A . 14 LYS CE 1 1 2 799 1 1 14 LYS CG C -11.831 2.928 -2.191 1.00 . A A . 14 LYS CG 1 1 2 800 1 1 14 LYS H H -8.472 5.245 -4.070 1.00 . A A . 14 LYS H 1 1 2 801 1 1 14 LYS HA H -10.043 4.724 -1.753 1.00 . A A . 14 LYS HA 1 1 2 802 1 1 14 LYS HB2 H -11.369 3.986 -3.973 1.00 . A A . 14 LYS HB2 1 1 2 803 1 1 14 LYS HB3 H -10.411 2.534 -3.719 1.00 . A A . 14 LYS HB3 1 1 2 804 1 1 14 LYS HD2 H -12.544 1.282 -3.341 1.00 . A A . 14 LYS HD2 1 1 2 805 1 1 14 LYS HD3 H -13.624 1.786 -2.039 1.00 . A A . 14 LYS HD3 1 1 2 806 1 1 14 LYS HE2 H -14.081 3.874 -3.310 1.00 . A A . 14 LYS HE2 1 1 2 807 1 1 14 LYS HE3 H -13.117 3.229 -4.637 1.00 . A A . 14 LYS HE3 1 1 2 808 1 1 14 LYS HG2 H -11.317 2.303 -1.476 1.00 . A A . 14 LYS HG2 1 1 2 809 1 1 14 LYS HG3 H -12.246 3.789 -1.687 1.00 . A A . 14 LYS HG3 1 1 2 810 1 1 14 LYS HZ1 H -15.292 1.569 -3.607 1.00 . A A . 14 LYS HZ1 1 1 2 811 1 1 14 LYS HZ2 H -15.714 2.920 -4.533 1.00 . A A . 14 LYS HZ2 1 1 2 812 1 1 14 LYS HZ3 H -14.708 1.726 -5.186 1.00 . A A . 14 LYS HZ3 1 1 2 813 1 1 14 LYS N N -9.331 5.304 -3.600 1.00 . A A . 14 LYS N 1 1 2 814 1 1 14 LYS NZ N -14.951 2.246 -4.319 1.00 . A A . 14 LYS NZ 1 1 2 815 1 1 14 LYS O O -7.625 3.158 -3.173 1.00 . A A . 14 LYS O 1 1 2 816 1 1 15 LEU C C -7.252 0.770 -1.586 1.00 . A A . 15 LEU C 1 1 2 817 1 1 15 LEU CA C -7.388 1.983 -0.671 1.00 . A A . 15 LEU CA 1 1 2 818 1 1 15 LEU CB C -7.628 1.529 0.771 1.00 . A A . 15 LEU CB 1 1 2 819 1 1 15 LEU CD1 C -6.926 2.170 3.092 1.00 . A A . 15 LEU CD1 1 1 2 820 1 1 15 LEU CD2 C -5.621 0.452 1.821 1.00 . A A . 15 LEU CD2 1 1 2 821 1 1 15 LEU CG C -6.443 1.729 1.718 1.00 . A A . 15 LEU CG 1 1 2 822 1 1 15 LEU H H -9.205 3.051 -0.492 1.00 . A A . 15 LEU H 1 1 2 823 1 1 15 LEU HA H -6.473 2.554 -0.712 1.00 . A A . 15 LEU HA 1 1 2 824 1 1 15 LEU HB2 H -8.473 2.078 1.162 1.00 . A A . 15 LEU HB2 1 1 2 825 1 1 15 LEU HB3 H -7.878 0.479 0.761 1.00 . A A . 15 LEU HB3 1 1 2 826 1 1 15 LEU HD11 H -7.917 2.590 3.008 1.00 . A A . 15 LEU HD11 1 1 2 827 1 1 15 LEU HD12 H -6.952 1.317 3.755 1.00 . A A . 15 LEU HD12 1 1 2 828 1 1 15 LEU HD13 H -6.252 2.914 3.489 1.00 . A A . 15 LEU HD13 1 1 2 829 1 1 15 LEU HD21 H -5.950 -0.251 1.070 1.00 . A A . 15 LEU HD21 1 1 2 830 1 1 15 LEU HD22 H -4.578 0.683 1.664 1.00 . A A . 15 LEU HD22 1 1 2 831 1 1 15 LEU HD23 H -5.749 0.018 2.802 1.00 . A A . 15 LEU HD23 1 1 2 832 1 1 15 LEU HG H -5.805 2.508 1.325 1.00 . A A . 15 LEU HG 1 1 2 833 1 1 15 LEU N N -8.476 2.848 -1.113 1.00 . A A . 15 LEU N 1 1 2 834 1 1 15 LEU O O -8.194 -0.005 -1.751 1.00 . A A . 15 LEU O 1 1 2 835 1 1 16 LYS C C -6.036 -1.841 -2.364 1.00 . A A . 16 LYS C 1 1 2 836 1 1 16 LYS CA C -5.815 -0.508 -3.078 1.00 . A A . 16 LYS CA 1 1 2 837 1 1 16 LYS CB C -4.386 -0.433 -3.622 1.00 . A A . 16 LYS CB 1 1 2 838 1 1 16 LYS CD C -3.208 0.531 -5.623 1.00 . A A . 16 LYS CD 1 1 2 839 1 1 16 LYS CE C -2.503 -0.032 -6.847 1.00 . A A . 16 LYS CE 1 1 2 840 1 1 16 LYS CG C -4.315 -0.393 -5.140 1.00 . A A . 16 LYS CG 1 1 2 841 1 1 16 LYS H H -5.360 1.262 -2.009 1.00 . A A . 16 LYS H 1 1 2 842 1 1 16 LYS HA H -6.509 -0.435 -3.903 1.00 . A A . 16 LYS HA 1 1 2 843 1 1 16 LYS HB2 H -3.914 0.459 -3.238 1.00 . A A . 16 LYS HB2 1 1 2 844 1 1 16 LYS HB3 H -3.835 -1.297 -3.280 1.00 . A A . 16 LYS HB3 1 1 2 845 1 1 16 LYS HD2 H -3.637 1.488 -5.876 1.00 . A A . 16 LYS HD2 1 1 2 846 1 1 16 LYS HD3 H -2.486 0.657 -4.828 1.00 . A A . 16 LYS HD3 1 1 2 847 1 1 16 LYS HE2 H -2.826 -1.052 -6.997 1.00 . A A . 16 LYS HE2 1 1 2 848 1 1 16 LYS HE3 H -2.774 0.562 -7.707 1.00 . A A . 16 LYS HE3 1 1 2 849 1 1 16 LYS HG2 H -4.123 -1.390 -5.508 1.00 . A A . 16 LYS HG2 1 1 2 850 1 1 16 LYS HG3 H -5.260 -0.041 -5.525 1.00 . A A . 16 LYS HG3 1 1 2 851 1 1 16 LYS HZ1 H -0.768 0.000 -5.684 1.00 . A A . 16 LYS HZ1 1 1 2 852 1 1 16 LYS HZ2 H -0.606 -0.859 -7.133 1.00 . A A . 16 LYS HZ2 1 1 2 853 1 1 16 LYS HZ3 H -0.626 0.833 -7.150 1.00 . A A . 16 LYS HZ3 1 1 2 854 1 1 16 LYS N N -6.073 0.611 -2.179 1.00 . A A . 16 LYS N 1 1 2 855 1 1 16 LYS NZ N -1.022 -0.013 -6.693 1.00 . A A . 16 LYS NZ 1 1 2 856 1 1 16 LYS O O -5.860 -1.940 -1.150 1.00 . A A . 16 LYS O 1 1 2 857 1 1 17 PRO C C -5.399 -4.852 -1.991 1.00 . A A . 17 PRO C 1 1 2 858 1 1 17 PRO CA C -6.669 -4.218 -2.544 1.00 . A A . 17 PRO CA 1 1 2 859 1 1 17 PRO CB C -7.199 -5.028 -3.731 1.00 . A A . 17 PRO CB 1 1 2 860 1 1 17 PRO CD C -6.658 -2.858 -4.567 1.00 . A A . 17 PRO CD 1 1 2 861 1 1 17 PRO CG C -6.698 -4.313 -4.938 1.00 . A A . 17 PRO CG 1 1 2 862 1 1 17 PRO HA H -7.417 -4.184 -1.765 1.00 . A A . 17 PRO HA 1 1 2 863 1 1 17 PRO HB2 H -6.815 -6.037 -3.682 1.00 . A A . 17 PRO HB2 1 1 2 864 1 1 17 PRO HB3 H -8.278 -5.047 -3.704 1.00 . A A . 17 PRO HB3 1 1 2 865 1 1 17 PRO HD2 H -5.846 -2.360 -5.078 1.00 . A A . 17 PRO HD2 1 1 2 866 1 1 17 PRO HD3 H -7.599 -2.382 -4.798 1.00 . A A . 17 PRO HD3 1 1 2 867 1 1 17 PRO HG2 H -5.708 -4.664 -5.189 1.00 . A A . 17 PRO HG2 1 1 2 868 1 1 17 PRO HG3 H -7.374 -4.470 -5.765 1.00 . A A . 17 PRO HG3 1 1 2 869 1 1 17 PRO N N -6.426 -2.887 -3.112 1.00 . A A . 17 PRO N 1 1 2 870 1 1 17 PRO O O -4.301 -4.612 -2.493 1.00 . A A . 17 PRO O 1 1 2 871 1 1 18 ALA C C -3.588 -7.089 -1.352 1.00 . A A . 18 ALA C 1 1 2 872 1 1 18 ALA CA C -4.427 -6.339 -0.321 1.00 . A A . 18 ALA CA 1 1 2 873 1 1 18 ALA CB C -4.917 -7.294 0.757 1.00 . A A . 18 ALA CB 1 1 2 874 1 1 18 ALA H H -6.461 -5.813 -0.597 1.00 . A A . 18 ALA H 1 1 2 875 1 1 18 ALA HA H -3.812 -5.587 0.150 1.00 . A A . 18 ALA HA 1 1 2 876 1 1 18 ALA HB1 H -4.992 -6.767 1.697 1.00 . A A . 18 ALA HB1 1 1 2 877 1 1 18 ALA HB2 H -4.220 -8.112 0.857 1.00 . A A . 18 ALA HB2 1 1 2 878 1 1 18 ALA HB3 H -5.888 -7.679 0.482 1.00 . A A . 18 ALA HB3 1 1 2 879 1 1 18 ALA N N -5.559 -5.665 -0.951 1.00 . A A . 18 ALA N 1 1 2 880 1 1 18 ALA O O -4.084 -7.466 -2.414 1.00 . A A . 18 ALA O 1 1 2 881 1 1 19 GLY C C -0.637 -7.054 -2.826 1.00 . A A . 19 GLY C 1 1 2 882 1 1 19 GLY CA C -1.429 -7.999 -1.943 1.00 . A A . 19 GLY CA 1 1 2 883 1 1 19 GLY H H -1.975 -6.973 -0.173 1.00 . A A . 19 GLY H 1 1 2 884 1 1 19 GLY HA2 H -2.018 -8.652 -2.570 1.00 . A A . 19 GLY HA2 1 1 2 885 1 1 19 GLY HA3 H -0.739 -8.598 -1.366 1.00 . A A . 19 GLY HA3 1 1 2 886 1 1 19 GLY N N -2.316 -7.298 -1.033 1.00 . A A . 19 GLY N 1 1 2 887 1 1 19 GLY O O 0.404 -7.427 -3.368 1.00 . A A . 19 GLY O 1 1 2 888 1 1 20 THR C C 0.830 -4.355 -3.135 1.00 . A A . 20 THR C 1 1 2 889 1 1 20 THR CA C -0.460 -4.828 -3.796 1.00 . A A . 20 THR CA 1 1 2 890 1 1 20 THR CB C -1.387 -3.636 -4.043 1.00 . A A . 20 THR CB 1 1 2 891 1 1 20 THR CG2 C -0.873 -2.688 -5.104 1.00 . A A . 20 THR CG2 1 1 2 892 1 1 20 THR H H -1.963 -5.588 -2.516 1.00 . A A . 20 THR H 1 1 2 893 1 1 20 THR HA H -0.218 -5.287 -4.743 1.00 . A A . 20 THR HA 1 1 2 894 1 1 20 THR HB H -1.491 -3.079 -3.123 1.00 . A A . 20 THR HB 1 1 2 895 1 1 20 THR HG1 H -3.124 -4.473 -3.697 1.00 . A A . 20 THR HG1 1 1 2 896 1 1 20 THR HG21 H 0.135 -2.386 -4.860 1.00 . A A . 20 THR HG21 1 1 2 897 1 1 20 THR HG22 H -0.879 -3.184 -6.064 1.00 . A A . 20 THR HG22 1 1 2 898 1 1 20 THR HG23 H -1.510 -1.816 -5.146 1.00 . A A . 20 THR HG23 1 1 2 899 1 1 20 THR N N -1.130 -5.827 -2.973 1.00 . A A . 20 THR N 1 1 2 900 1 1 20 THR O O 0.802 -3.702 -2.092 1.00 . A A . 20 THR O 1 1 2 901 1 1 20 THR OG1 O -2.672 -4.076 -4.445 1.00 . A A . 20 THR OG1 1 1 2 902 1 1 21 THR C C 3.554 -2.833 -3.521 1.00 . A A . 21 THR C 1 1 2 903 1 1 21 THR CA C 3.262 -4.299 -3.217 1.00 . A A . 21 THR CA 1 1 2 904 1 1 21 THR CB C 4.365 -5.187 -3.800 1.00 . A A . 21 THR CB 1 1 2 905 1 1 21 THR CG2 C 5.180 -5.899 -2.742 1.00 . A A . 21 THR CG2 1 1 2 906 1 1 21 THR H H 1.919 -5.211 -4.576 1.00 . A A . 21 THR H 1 1 2 907 1 1 21 THR HA H 3.234 -4.432 -2.146 1.00 . A A . 21 THR HA 1 1 2 908 1 1 21 THR HB H 5.041 -4.574 -4.380 1.00 . A A . 21 THR HB 1 1 2 909 1 1 21 THR HG1 H 3.252 -6.761 -4.148 1.00 . A A . 21 THR HG1 1 1 2 910 1 1 21 THR HG21 H 4.540 -6.166 -1.914 1.00 . A A . 21 THR HG21 1 1 2 911 1 1 21 THR HG22 H 5.616 -6.792 -3.163 1.00 . A A . 21 THR HG22 1 1 2 912 1 1 21 THR HG23 H 5.965 -5.245 -2.392 1.00 . A A . 21 THR HG23 1 1 2 913 1 1 21 THR N N 1.961 -4.689 -3.748 1.00 . A A . 21 THR N 1 1 2 914 1 1 21 THR O O 3.325 -2.361 -4.635 1.00 . A A . 21 THR O 1 1 2 915 1 1 21 THR OG1 O 3.818 -6.175 -4.656 1.00 . A A . 21 THR OG1 1 1 2 916 1 1 22 CYS C C 5.895 -0.498 -2.769 1.00 . A A . 22 CYS C 1 1 2 917 1 1 22 CYS CA C 4.386 -0.704 -2.683 1.00 . A A . 22 CYS CA 1 1 2 918 1 1 22 CYS CB C 3.815 0.107 -1.519 1.00 . A A . 22 CYS CB 1 1 2 919 1 1 22 CYS H H 4.222 -2.549 -1.658 1.00 . A A . 22 CYS H 1 1 2 920 1 1 22 CYS HA H 3.935 -0.363 -3.603 1.00 . A A . 22 CYS HA 1 1 2 921 1 1 22 CYS HB2 H 3.993 1.156 -1.699 1.00 . A A . 22 CYS HB2 1 1 2 922 1 1 22 CYS HB3 H 2.750 -0.067 -1.457 1.00 . A A . 22 CYS HB3 1 1 2 923 1 1 22 CYS N N 4.062 -2.117 -2.523 1.00 . A A . 22 CYS N 1 1 2 924 1 1 22 CYS O O 6.370 0.413 -3.446 1.00 . A A . 22 CYS O 1 1 2 925 1 1 22 CYS SG S 4.539 -0.306 0.102 1.00 . A A . 22 CYS SG 1 1 2 926 1 1 23 TRP C C 8.729 -2.653 -2.043 1.00 . A A . 23 TRP C 1 1 2 927 1 1 23 TRP CA C 8.099 -1.264 -2.077 1.00 . A A . 23 TRP CA 1 1 2 928 1 1 23 TRP CB C 8.581 -0.444 -0.879 1.00 . A A . 23 TRP CB 1 1 2 929 1 1 23 TRP CD1 C 9.901 1.510 -1.881 1.00 . A A . 23 TRP CD1 1 1 2 930 1 1 23 TRP CD2 C 11.150 0.050 -0.731 1.00 . A A . 23 TRP CD2 1 1 2 931 1 1 23 TRP CE2 C 11.989 1.066 -1.226 1.00 . A A . 23 TRP CE2 1 1 2 932 1 1 23 TRP CE3 C 11.714 -0.981 0.025 1.00 . A A . 23 TRP CE3 1 1 2 933 1 1 23 TRP CG C 9.818 0.352 -1.161 1.00 . A A . 23 TRP CG 1 1 2 934 1 1 23 TRP CH2 C 13.886 0.059 -0.245 1.00 . A A . 23 TRP CH2 1 1 2 935 1 1 23 TRP CZ2 C 13.361 1.080 -0.988 1.00 . A A . 23 TRP CZ2 1 1 2 936 1 1 23 TRP CZ3 C 13.076 -0.966 0.260 1.00 . A A . 23 TRP CZ3 1 1 2 937 1 1 23 TRP H H 6.207 -2.058 -1.557 1.00 . A A . 23 TRP H 1 1 2 938 1 1 23 TRP HA H 8.402 -0.767 -2.986 1.00 . A A . 23 TRP HA 1 1 2 939 1 1 23 TRP HB2 H 7.802 0.244 -0.585 1.00 . A A . 23 TRP HB2 1 1 2 940 1 1 23 TRP HB3 H 8.793 -1.112 -0.056 1.00 . A A . 23 TRP HB3 1 1 2 941 1 1 23 TRP HD1 H 9.058 2.000 -2.344 1.00 . A A . 23 TRP HD1 1 1 2 942 1 1 23 TRP HE1 H 11.518 2.753 -2.381 1.00 . A A . 23 TRP HE1 1 1 2 943 1 1 23 TRP HE3 H 11.106 -1.780 0.423 1.00 . A A . 23 TRP HE3 1 1 2 944 1 1 23 TRP HH2 H 14.946 0.030 -0.037 1.00 . A A . 23 TRP HH2 1 1 2 945 1 1 23 TRP HZ2 H 13.999 1.863 -1.370 1.00 . A A . 23 TRP HZ2 1 1 2 946 1 1 23 TRP HZ3 H 13.530 -1.755 0.842 1.00 . A A . 23 TRP HZ3 1 1 2 947 1 1 23 TRP N N 6.644 -1.352 -2.078 1.00 . A A . 23 TRP N 1 1 2 948 1 1 23 TRP NE1 N 11.203 1.945 -1.925 1.00 . A A . 23 TRP NE1 1 1 2 949 1 1 23 TRP O O 8.755 -3.308 -1.001 1.00 . A A . 23 TRP O 1 1 2 950 1 1 24 ARG C C 11.071 -4.360 -4.221 1.00 . A A . 24 ARG C 1 1 2 951 1 1 24 ARG CA C 9.864 -4.407 -3.291 1.00 . A A . 24 ARG CA 1 1 2 952 1 1 24 ARG CB C 8.856 -5.442 -3.795 1.00 . A A . 24 ARG CB 1 1 2 953 1 1 24 ARG CD C 7.470 -6.294 -5.709 1.00 . A A . 24 ARG CD 1 1 2 954 1 1 24 ARG CG C 8.354 -5.166 -5.203 1.00 . A A . 24 ARG CG 1 1 2 955 1 1 24 ARG CZ C 7.302 -7.678 -7.741 1.00 . A A . 24 ARG CZ 1 1 2 956 1 1 24 ARG H H 9.183 -2.527 -3.986 1.00 . A A . 24 ARG H 1 1 2 957 1 1 24 ARG HA H 10.196 -4.692 -2.304 1.00 . A A . 24 ARG HA 1 1 2 958 1 1 24 ARG HB2 H 9.324 -6.416 -3.787 1.00 . A A . 24 ARG HB2 1 1 2 959 1 1 24 ARG HB3 H 8.007 -5.455 -3.128 1.00 . A A . 24 ARG HB3 1 1 2 960 1 1 24 ARG HD2 H 7.696 -7.191 -5.151 1.00 . A A . 24 ARG HD2 1 1 2 961 1 1 24 ARG HD3 H 6.436 -6.023 -5.550 1.00 . A A . 24 ARG HD3 1 1 2 962 1 1 24 ARG HE H 8.120 -5.860 -7.660 1.00 . A A . 24 ARG HE 1 1 2 963 1 1 24 ARG HG2 H 7.783 -4.250 -5.198 1.00 . A A . 24 ARG HG2 1 1 2 964 1 1 24 ARG HG3 H 9.202 -5.061 -5.863 1.00 . A A . 24 ARG HG3 1 1 2 965 1 1 24 ARG HH11 H 6.525 -8.531 -6.079 1.00 . A A . 24 ARG HH11 1 1 2 966 1 1 24 ARG HH12 H 6.420 -9.484 -7.521 1.00 . A A . 24 ARG HH12 1 1 2 967 1 1 24 ARG HH21 H 7.982 -7.112 -9.558 1.00 . A A . 24 ARG HH21 1 1 2 968 1 1 24 ARG HH22 H 7.247 -8.679 -9.496 1.00 . A A . 24 ARG HH22 1 1 2 969 1 1 24 ARG N N 9.234 -3.096 -3.189 1.00 . A A . 24 ARG N 1 1 2 970 1 1 24 ARG NE N 7.678 -6.556 -7.131 1.00 . A A . 24 ARG NE 1 1 2 971 1 1 24 ARG NH1 N 6.700 -8.644 -7.057 1.00 . A A . 24 ARG NH1 1 1 2 972 1 1 24 ARG NH2 N 7.529 -7.836 -9.038 1.00 . A A . 24 ARG NH2 1 1 2 973 1 1 24 ARG O O 11.024 -3.744 -5.286 1.00 . A A . 24 ARG O 1 1 2 974 1 1 25 THR C C 13.983 -6.447 -4.613 1.00 . A A . 25 THR C 1 1 2 975 1 1 25 THR CA C 13.373 -5.049 -4.610 1.00 . A A . 25 THR CA 1 1 2 976 1 1 25 THR CB C 14.387 -4.038 -4.071 1.00 . A A . 25 THR CB 1 1 2 977 1 1 25 THR CG2 C 14.081 -2.611 -4.471 1.00 . A A . 25 THR CG2 1 1 2 978 1 1 25 THR H H 12.130 -5.488 -2.954 1.00 . A A . 25 THR H 1 1 2 979 1 1 25 THR HA H 13.115 -4.780 -5.623 1.00 . A A . 25 THR HA 1 1 2 980 1 1 25 THR HB H 15.366 -4.286 -4.454 1.00 . A A . 25 THR HB 1 1 2 981 1 1 25 THR HG1 H 15.293 -3.769 -2.355 1.00 . A A . 25 THR HG1 1 1 2 982 1 1 25 THR HG21 H 13.031 -2.411 -4.314 1.00 . A A . 25 THR HG21 1 1 2 983 1 1 25 THR HG22 H 14.671 -1.934 -3.872 1.00 . A A . 25 THR HG22 1 1 2 984 1 1 25 THR HG23 H 14.321 -2.471 -5.515 1.00 . A A . 25 THR HG23 1 1 2 985 1 1 25 THR N N 12.153 -5.015 -3.812 1.00 . A A . 25 THR N 1 1 2 986 1 1 25 THR O O 15.203 -6.603 -4.564 1.00 . A A . 25 THR O 1 1 2 987 1 1 25 THR OG1 O 14.438 -4.085 -2.656 1.00 . A A . 25 THR OG1 1 1 2 988 1 1 26 SER C C 14.359 -9.172 -3.410 1.00 . A A . 26 SER C 1 1 2 989 1 1 26 SER CA C 13.580 -8.846 -4.681 1.00 . A A . 26 SER CA 1 1 2 990 1 1 26 SER CB C 14.451 -9.111 -5.910 1.00 . A A . 26 SER CB 1 1 2 991 1 1 26 SER H H 12.165 -7.272 -4.708 1.00 . A A . 26 SER H 1 1 2 992 1 1 26 SER HA H 12.707 -9.480 -4.726 1.00 . A A . 26 SER HA 1 1 2 993 1 1 26 SER HB2 H 15.455 -8.762 -5.718 1.00 . A A . 26 SER HB2 1 1 2 994 1 1 26 SER HB3 H 14.471 -10.171 -6.113 1.00 . A A . 26 SER HB3 1 1 2 995 1 1 26 SER HG H 14.674 -8.170 -7.613 1.00 . A A . 26 SER HG 1 1 2 996 1 1 26 SER N N 13.126 -7.461 -4.671 1.00 . A A . 26 SER N 1 1 2 997 1 1 26 SER O O 15.328 -9.930 -3.442 1.00 . A A . 26 SER O 1 1 2 998 1 1 26 SER OG O 13.945 -8.437 -7.049 1.00 . A A . 26 SER OG 1 1 2 999 1 1 27 VAL C C 13.649 -8.509 0.149 1.00 . A A . 27 VAL C 1 1 2 1000 1 1 27 VAL CA C 14.584 -8.824 -1.012 1.00 . A A . 27 VAL CA 1 1 2 1001 1 1 27 VAL CB C 15.861 -7.974 -0.874 1.00 . A A . 27 VAL CB 1 1 2 1002 1 1 27 VAL CG1 C 16.974 -8.537 -1.743 1.00 . A A . 27 VAL CG1 1 1 2 1003 1 1 27 VAL CG2 C 15.577 -6.523 -1.230 1.00 . A A . 27 VAL CG2 1 1 2 1004 1 1 27 VAL H H 13.149 -8.001 -2.333 1.00 . A A . 27 VAL H 1 1 2 1005 1 1 27 VAL HA H 14.862 -9.864 -0.963 1.00 . A A . 27 VAL HA 1 1 2 1006 1 1 27 VAL HB H 16.184 -8.013 0.156 1.00 . A A . 27 VAL HB 1 1 2 1007 1 1 27 VAL HG11 H 17.003 -9.612 -1.640 1.00 . A A . 27 VAL HG11 1 1 2 1008 1 1 27 VAL HG12 H 16.791 -8.279 -2.775 1.00 . A A . 27 VAL HG12 1 1 2 1009 1 1 27 VAL HG13 H 17.920 -8.120 -1.431 1.00 . A A . 27 VAL HG13 1 1 2 1010 1 1 27 VAL HG21 H 15.019 -6.482 -2.154 1.00 . A A . 27 VAL HG21 1 1 2 1011 1 1 27 VAL HG22 H 15.000 -6.064 -0.441 1.00 . A A . 27 VAL HG22 1 1 2 1012 1 1 27 VAL HG23 H 16.510 -5.993 -1.349 1.00 . A A . 27 VAL HG23 1 1 2 1013 1 1 27 VAL N N 13.927 -8.595 -2.294 1.00 . A A . 27 VAL N 1 1 2 1014 1 1 27 VAL O O 13.559 -9.269 1.113 1.00 . A A . 27 VAL O 1 1 2 1015 1 1 28 SER C C 10.700 -6.506 0.480 1.00 . A A . 28 SER C 1 1 2 1016 1 1 28 SER CA C 12.023 -6.961 1.087 1.00 . A A . 28 SER CA 1 1 2 1017 1 1 28 SER CB C 12.632 -5.830 1.918 1.00 . A A . 28 SER CB 1 1 2 1018 1 1 28 SER H H 13.072 -6.823 -0.747 1.00 . A A . 28 SER H 1 1 2 1019 1 1 28 SER HA H 11.838 -7.808 1.730 1.00 . A A . 28 SER HA 1 1 2 1020 1 1 28 SER HB2 H 13.302 -5.252 1.299 1.00 . A A . 28 SER HB2 1 1 2 1021 1 1 28 SER HB3 H 11.842 -5.192 2.287 1.00 . A A . 28 SER HB3 1 1 2 1022 1 1 28 SER HG H 14.293 -6.153 2.905 1.00 . A A . 28 SER HG 1 1 2 1023 1 1 28 SER N N 12.955 -7.383 0.047 1.00 . A A . 28 SER N 1 1 2 1024 1 1 28 SER O O 10.445 -5.309 0.346 1.00 . A A . 28 SER O 1 1 2 1025 1 1 28 SER OG O 13.359 -6.342 3.021 1.00 . A A . 28 SER OG 1 1 2 1026 1 1 29 SER C C 7.611 -6.588 0.561 1.00 . A A . 29 SER C 1 1 2 1027 1 1 29 SER CA C 8.563 -7.168 -0.479 1.00 . A A . 29 SER CA 1 1 2 1028 1 1 29 SER CB C 7.956 -8.429 -1.097 1.00 . A A . 29 SER CB 1 1 2 1029 1 1 29 SER H H 10.120 -8.406 0.246 1.00 . A A . 29 SER H 1 1 2 1030 1 1 29 SER HA H 8.717 -6.436 -1.257 1.00 . A A . 29 SER HA 1 1 2 1031 1 1 29 SER HB2 H 7.803 -9.168 -0.325 1.00 . A A . 29 SER HB2 1 1 2 1032 1 1 29 SER HB3 H 7.008 -8.184 -1.552 1.00 . A A . 29 SER HB3 1 1 2 1033 1 1 29 SER HG H 9.712 -8.992 -1.758 1.00 . A A . 29 SER HG 1 1 2 1034 1 1 29 SER N N 9.861 -7.470 0.114 1.00 . A A . 29 SER N 1 1 2 1035 1 1 29 SER O O 7.507 -7.100 1.676 1.00 . A A . 29 SER O 1 1 2 1036 1 1 29 SER OG O 8.810 -8.975 -2.087 1.00 . A A . 29 SER OG 1 1 2 1037 1 1 30 HIS C C 4.564 -4.879 0.503 1.00 . A A . 30 HIS C 1 1 2 1038 1 1 30 HIS CA C 5.972 -4.867 1.090 1.00 . A A . 30 HIS CA 1 1 2 1039 1 1 30 HIS CB C 6.409 -3.428 1.368 1.00 . A A . 30 HIS CB 1 1 2 1040 1 1 30 HIS CD2 C 8.124 -4.264 3.126 1.00 . A A . 30 HIS CD2 1 1 2 1041 1 1 30 HIS CE1 C 8.749 -2.317 3.915 1.00 . A A . 30 HIS CE1 1 1 2 1042 1 1 30 HIS CG C 7.431 -3.313 2.456 1.00 . A A . 30 HIS CG 1 1 2 1043 1 1 30 HIS H H 7.043 -5.156 -0.713 1.00 . A A . 30 HIS H 1 1 2 1044 1 1 30 HIS HA H 5.966 -5.418 2.019 1.00 . A A . 30 HIS HA 1 1 2 1045 1 1 30 HIS HB2 H 6.833 -3.008 0.469 1.00 . A A . 30 HIS HB2 1 1 2 1046 1 1 30 HIS HB3 H 5.545 -2.847 1.659 1.00 . A A . 30 HIS HB3 1 1 2 1047 1 1 30 HIS HD1 H 7.526 -1.221 2.695 1.00 . A A . 30 HIS HD1 1 1 2 1048 1 1 30 HIS HD2 H 8.051 -5.333 2.979 1.00 . A A . 30 HIS HD2 1 1 2 1049 1 1 30 HIS HE1 H 9.250 -1.555 4.494 1.00 . A A . 30 HIS HE1 1 1 2 1050 1 1 30 HIS HE2 H 9.611 -4.047 4.592 1.00 . A A . 30 HIS HE2 1 1 2 1051 1 1 30 HIS N N 6.917 -5.518 0.189 1.00 . A A . 30 HIS N 1 1 2 1052 1 1 30 HIS ND1 N 7.846 -2.104 2.975 1.00 . A A . 30 HIS ND1 1 1 2 1053 1 1 30 HIS NE2 N 8.935 -3.619 4.026 1.00 . A A . 30 HIS NE2 1 1 2 1054 1 1 30 HIS O O 4.107 -3.885 -0.060 1.00 . A A . 30 HIS O 1 1 2 1055 1 1 31 TYR C C 1.549 -5.286 0.911 1.00 . A A . 31 TYR C 1 1 2 1056 1 1 31 TYR CA C 2.525 -6.153 0.122 1.00 . A A . 31 TYR CA 1 1 2 1057 1 1 31 TYR CB C 2.085 -7.617 0.179 1.00 . A A . 31 TYR CB 1 1 2 1058 1 1 31 TYR CD1 C 3.709 -9.549 0.090 1.00 . A A . 31 TYR CD1 1 1 2 1059 1 1 31 TYR CD2 C 3.160 -8.445 -1.950 1.00 . A A . 31 TYR CD2 1 1 2 1060 1 1 31 TYR CE1 C 4.547 -10.407 -0.595 1.00 . A A . 31 TYR CE1 1 1 2 1061 1 1 31 TYR CE2 C 3.997 -9.300 -2.643 1.00 . A A . 31 TYR CE2 1 1 2 1062 1 1 31 TYR CG C 3.002 -8.554 -0.575 1.00 . A A . 31 TYR CG 1 1 2 1063 1 1 31 TYR CZ C 4.688 -10.279 -1.961 1.00 . A A . 31 TYR CZ 1 1 2 1064 1 1 31 TYR H H 4.299 -6.770 1.097 1.00 . A A . 31 TYR H 1 1 2 1065 1 1 31 TYR HA H 2.527 -5.827 -0.907 1.00 . A A . 31 TYR HA 1 1 2 1066 1 1 31 TYR HB2 H 2.058 -7.938 1.209 1.00 . A A . 31 TYR HB2 1 1 2 1067 1 1 31 TYR HB3 H 1.096 -7.705 -0.247 1.00 . A A . 31 TYR HB3 1 1 2 1068 1 1 31 TYR HD1 H 3.596 -9.647 1.160 1.00 . A A . 31 TYR HD1 1 1 2 1069 1 1 31 TYR HD2 H 2.618 -7.677 -2.482 1.00 . A A . 31 TYR HD2 1 1 2 1070 1 1 31 TYR HE1 H 5.088 -11.174 -0.060 1.00 . A A . 31 TYR HE1 1 1 2 1071 1 1 31 TYR HE2 H 4.107 -9.199 -3.712 1.00 . A A . 31 TYR HE2 1 1 2 1072 1 1 31 TYR HH H 6.146 -10.620 -3.167 1.00 . A A . 31 TYR HH 1 1 2 1073 1 1 31 TYR N N 3.881 -6.011 0.639 1.00 . A A . 31 TYR N 1 1 2 1074 1 1 31 TYR O O 1.832 -4.885 2.040 1.00 . A A . 31 TYR O 1 1 2 1075 1 1 31 TYR OH O 5.522 -11.132 -2.646 1.00 . A A . 31 TYR OH 1 1 2 1076 1 1 32 CYS C C -1.612 -5.051 1.718 1.00 . A A . 32 CYS C 1 1 2 1077 1 1 32 CYS CA C -0.618 -4.181 0.955 1.00 . A A . 32 CYS CA 1 1 2 1078 1 1 32 CYS CB C -1.356 -3.334 -0.083 1.00 . A A . 32 CYS CB 1 1 2 1079 1 1 32 CYS H H 0.231 -5.349 -0.591 1.00 . A A . 32 CYS H 1 1 2 1080 1 1 32 CYS HA H -0.122 -3.526 1.654 1.00 . A A . 32 CYS HA 1 1 2 1081 1 1 32 CYS HB2 H -1.406 -3.881 -1.013 1.00 . A A . 32 CYS HB2 1 1 2 1082 1 1 32 CYS HB3 H -2.360 -3.141 0.269 1.00 . A A . 32 CYS HB3 1 1 2 1083 1 1 32 CYS N N 0.399 -5.000 0.309 1.00 . A A . 32 CYS N 1 1 2 1084 1 1 32 CYS O O -1.956 -6.148 1.279 1.00 . A A . 32 CYS O 1 1 2 1085 1 1 32 CYS SG S -0.569 -1.728 -0.427 1.00 . A A . 32 CYS SG 1 1 2 1086 1 1 33 THR C C -4.457 -4.831 3.409 1.00 . A A . 33 THR C 1 1 2 1087 1 1 33 THR CA C -3.025 -5.288 3.684 1.00 . A A . 33 THR CA 1 1 2 1088 1 1 33 THR CB C -2.698 -5.104 5.167 1.00 . A A . 33 THR CB 1 1 2 1089 1 1 33 THR CG2 C -1.220 -5.213 5.474 1.00 . A A . 33 THR CG2 1 1 2 1090 1 1 33 THR H H -1.758 -3.674 3.159 1.00 . A A . 33 THR H 1 1 2 1091 1 1 33 THR HA H -2.941 -6.335 3.435 1.00 . A A . 33 THR HA 1 1 2 1092 1 1 33 THR HB H -3.210 -5.868 5.735 1.00 . A A . 33 THR HB 1 1 2 1093 1 1 33 THR HG1 H -3.075 -3.804 6.582 1.00 . A A . 33 THR HG1 1 1 2 1094 1 1 33 THR HG21 H -0.679 -5.428 4.564 1.00 . A A . 33 THR HG21 1 1 2 1095 1 1 33 THR HG22 H -0.869 -4.280 5.889 1.00 . A A . 33 THR HG22 1 1 2 1096 1 1 33 THR HG23 H -1.057 -6.008 6.186 1.00 . A A . 33 THR HG23 1 1 2 1097 1 1 33 THR N N -2.070 -4.554 2.862 1.00 . A A . 33 THR N 1 1 2 1098 1 1 33 THR O O -5.383 -5.202 4.131 1.00 . A A . 33 THR O 1 1 2 1099 1 1 33 THR OG1 O -3.140 -3.839 5.625 1.00 . A A . 33 THR OG1 1 1 2 1100 1 1 34 GLY C C -6.688 -2.928 3.203 1.00 . A A . 34 GLY C 1 1 2 1101 1 1 34 GLY CA C -5.960 -3.537 2.019 1.00 . A A . 34 GLY CA 1 1 2 1102 1 1 34 GLY H H -3.864 -3.762 1.820 1.00 . A A . 34 GLY H 1 1 2 1103 1 1 34 GLY HA2 H -6.546 -4.360 1.636 1.00 . A A . 34 GLY HA2 1 1 2 1104 1 1 34 GLY HA3 H -5.865 -2.789 1.246 1.00 . A A . 34 GLY HA3 1 1 2 1105 1 1 34 GLY N N -4.636 -4.026 2.363 1.00 . A A . 34 GLY N 1 1 2 1106 1 1 34 GLY O O -7.918 -2.905 3.239 1.00 . A A . 34 GLY O 1 1 2 1107 1 1 35 ARG C C -6.170 -0.340 5.441 1.00 . A A . 35 ARG C 1 1 2 1108 1 1 35 ARG CA C -6.508 -1.825 5.366 1.00 . A A . 35 ARG CA 1 1 2 1109 1 1 35 ARG CB C -6.009 -2.537 6.625 1.00 . A A . 35 ARG CB 1 1 2 1110 1 1 35 ARG CD C -6.913 -3.865 8.556 1.00 . A A . 35 ARG CD 1 1 2 1111 1 1 35 ARG CG C -6.878 -3.711 7.045 1.00 . A A . 35 ARG CG 1 1 2 1112 1 1 35 ARG CZ C -9.307 -3.811 9.141 1.00 . A A . 35 ARG CZ 1 1 2 1113 1 1 35 ARG H H -4.952 -2.483 4.091 1.00 . A A . 35 ARG H 1 1 2 1114 1 1 35 ARG HA H -7.579 -1.934 5.304 1.00 . A A . 35 ARG HA 1 1 2 1115 1 1 35 ARG HB2 H -5.009 -2.904 6.444 1.00 . A A . 35 ARG HB2 1 1 2 1116 1 1 35 ARG HB3 H -5.981 -1.828 7.439 1.00 . A A . 35 ARG HB3 1 1 2 1117 1 1 35 ARG HD2 H -6.086 -4.488 8.861 1.00 . A A . 35 ARG HD2 1 1 2 1118 1 1 35 ARG HD3 H -6.813 -2.889 9.007 1.00 . A A . 35 ARG HD3 1 1 2 1119 1 1 35 ARG HE H -8.140 -5.427 9.243 1.00 . A A . 35 ARG HE 1 1 2 1120 1 1 35 ARG HG2 H -7.883 -3.548 6.686 1.00 . A A . 35 ARG HG2 1 1 2 1121 1 1 35 ARG HG3 H -6.480 -4.615 6.608 1.00 . A A . 35 ARG HG3 1 1 2 1122 1 1 35 ARG HH11 H -8.556 -2.039 8.521 1.00 . A A . 35 ARG HH11 1 1 2 1123 1 1 35 ARG HH12 H -10.236 -2.028 8.939 1.00 . A A . 35 ARG HH12 1 1 2 1124 1 1 35 ARG HH21 H -10.350 -5.415 9.792 1.00 . A A . 35 ARG HH21 1 1 2 1125 1 1 35 ARG HH22 H -11.255 -3.944 9.661 1.00 . A A . 35 ARG HH22 1 1 2 1126 1 1 35 ARG N N -5.926 -2.435 4.175 1.00 . A A . 35 ARG N 1 1 2 1127 1 1 35 ARG NE N -8.159 -4.474 9.016 1.00 . A A . 35 ARG NE 1 1 2 1128 1 1 35 ARG NH1 N -9.371 -2.520 8.843 1.00 . A A . 35 ARG NH1 1 1 2 1129 1 1 35 ARG NH2 N -10.393 -4.442 9.566 1.00 . A A . 35 ARG NH2 1 1 2 1130 1 1 35 ARG O O -6.985 0.472 5.879 1.00 . A A . 35 ARG O 1 1 2 1131 1 1 36 SER C C -3.715 1.728 3.774 1.00 . A A . 36 SER C 1 1 2 1132 1 1 36 SER CA C -4.517 1.398 5.029 1.00 . A A . 36 SER CA 1 1 2 1133 1 1 36 SER CB C -3.670 1.666 6.274 1.00 . A A . 36 SER CB 1 1 2 1134 1 1 36 SER H H -4.358 -0.683 4.673 1.00 . A A . 36 SER H 1 1 2 1135 1 1 36 SER HA H -5.393 2.027 5.058 1.00 . A A . 36 SER HA 1 1 2 1136 1 1 36 SER HB2 H -4.315 1.749 7.135 1.00 . A A . 36 SER HB2 1 1 2 1137 1 1 36 SER HB3 H -2.978 0.849 6.419 1.00 . A A . 36 SER HB3 1 1 2 1138 1 1 36 SER HG H -3.501 3.617 6.342 1.00 . A A . 36 SER HG 1 1 2 1139 1 1 36 SER N N -4.963 0.010 5.010 1.00 . A A . 36 SER N 1 1 2 1140 1 1 36 SER O O -3.005 0.878 3.237 1.00 . A A . 36 SER O 1 1 2 1141 1 1 36 SER OG O -2.933 2.870 6.140 1.00 . A A . 36 SER OG 1 1 2 1142 1 1 37 CYS C C -1.624 3.572 2.411 1.00 . A A . 37 CYS C 1 1 2 1143 1 1 37 CYS CA C -3.116 3.413 2.123 1.00 . A A . 37 CYS CA 1 1 2 1144 1 1 37 CYS CB C -3.696 4.735 1.614 1.00 . A A . 37 CYS CB 1 1 2 1145 1 1 37 CYS H H -4.411 3.603 3.787 1.00 . A A . 37 CYS H 1 1 2 1146 1 1 37 CYS HA H -3.244 2.659 1.362 1.00 . A A . 37 CYS HA 1 1 2 1147 1 1 37 CYS HB2 H -4.352 5.145 2.367 1.00 . A A . 37 CYS HB2 1 1 2 1148 1 1 37 CYS HB3 H -2.889 5.429 1.430 1.00 . A A . 37 CYS HB3 1 1 2 1149 1 1 37 CYS N N -3.832 2.970 3.314 1.00 . A A . 37 CYS N 1 1 2 1150 1 1 37 CYS O O -0.802 3.567 1.495 1.00 . A A . 37 CYS O 1 1 2 1151 1 1 37 CYS SG S -4.654 4.579 0.071 1.00 . A A . 37 CYS SG 1 1 2 1152 1 1 38 GLU C C 0.738 2.521 4.424 1.00 . A A . 38 GLU C 1 1 2 1153 1 1 38 GLU CA C 0.112 3.872 4.092 1.00 . A A . 38 GLU CA 1 1 2 1154 1 1 38 GLU CB C 0.212 4.805 5.300 1.00 . A A . 38 GLU CB 1 1 2 1155 1 1 38 GLU CD C 1.210 7.073 5.788 1.00 . A A . 38 GLU CD 1 1 2 1156 1 1 38 GLU CG C 0.245 6.279 4.930 1.00 . A A . 38 GLU CG 1 1 2 1157 1 1 38 GLU H H -1.979 3.709 4.376 1.00 . A A . 38 GLU H 1 1 2 1158 1 1 38 GLU HA H 0.649 4.311 3.264 1.00 . A A . 38 GLU HA 1 1 2 1159 1 1 38 GLU HB2 H -0.641 4.636 5.942 1.00 . A A . 38 GLU HB2 1 1 2 1160 1 1 38 GLU HB3 H 1.114 4.572 5.846 1.00 . A A . 38 GLU HB3 1 1 2 1161 1 1 38 GLU HG2 H 0.547 6.371 3.897 1.00 . A A . 38 GLU HG2 1 1 2 1162 1 1 38 GLU HG3 H -0.746 6.690 5.052 1.00 . A A . 38 GLU HG3 1 1 2 1163 1 1 38 GLU N N -1.280 3.713 3.689 1.00 . A A . 38 GLU N 1 1 2 1164 1 1 38 GLU O O 0.321 1.848 5.366 1.00 . A A . 38 GLU O 1 1 2 1165 1 1 38 GLU OE1 O 1.639 8.161 5.348 1.00 . A A . 38 GLU OE1 1 1 2 1166 1 1 38 GLU OE2 O 1.535 6.609 6.901 1.00 . A A . 38 GLU OE2 1 1 2 1167 1 1 39 CYS C C 3.055 0.805 5.245 1.00 . A A . 39 CYS C 1 1 2 1168 1 1 39 CYS CA C 2.425 0.861 3.855 1.00 . A A . 39 CYS CA 1 1 2 1169 1 1 39 CYS CB C 3.499 0.652 2.785 1.00 . A A . 39 CYS CB 1 1 2 1170 1 1 39 CYS H H 2.028 2.713 2.909 1.00 . A A . 39 CYS H 1 1 2 1171 1 1 39 CYS HA H 1.691 0.073 3.773 1.00 . A A . 39 CYS HA 1 1 2 1172 1 1 39 CYS HB2 H 3.822 1.615 2.418 1.00 . A A . 39 CYS HB2 1 1 2 1173 1 1 39 CYS HB3 H 4.342 0.141 3.227 1.00 . A A . 39 CYS HB3 1 1 2 1174 1 1 39 CYS N N 1.741 2.132 3.644 1.00 . A A . 39 CYS N 1 1 2 1175 1 1 39 CYS O O 3.466 1.829 5.791 1.00 . A A . 39 CYS O 1 1 2 1176 1 1 39 CYS SG S 2.942 -0.328 1.354 1.00 . A A . 39 CYS SG 1 1 2 1177 1 1 40 PRO C C 5.235 -0.384 7.172 1.00 . A A . 40 PRO C 1 1 2 1178 1 1 40 PRO CA C 3.723 -0.584 7.170 1.00 . A A . 40 PRO CA 1 1 2 1179 1 1 40 PRO CB C 3.374 -2.033 7.512 1.00 . A A . 40 PRO CB 1 1 2 1180 1 1 40 PRO CD C 2.672 -1.672 5.256 1.00 . A A . 40 PRO CD 1 1 2 1181 1 1 40 PRO CG C 3.228 -2.709 6.193 1.00 . A A . 40 PRO CG 1 1 2 1182 1 1 40 PRO HA H 3.272 0.079 7.894 1.00 . A A . 40 PRO HA 1 1 2 1183 1 1 40 PRO HB2 H 4.172 -2.470 8.095 1.00 . A A . 40 PRO HB2 1 1 2 1184 1 1 40 PRO HB3 H 2.453 -2.063 8.074 1.00 . A A . 40 PRO HB3 1 1 2 1185 1 1 40 PRO HD2 H 3.070 -1.810 4.261 1.00 . A A . 40 PRO HD2 1 1 2 1186 1 1 40 PRO HD3 H 1.594 -1.716 5.242 1.00 . A A . 40 PRO HD3 1 1 2 1187 1 1 40 PRO HG2 H 4.193 -3.049 5.846 1.00 . A A . 40 PRO HG2 1 1 2 1188 1 1 40 PRO HG3 H 2.545 -3.540 6.279 1.00 . A A . 40 PRO HG3 1 1 2 1189 1 1 40 PRO N N 3.139 -0.399 5.838 1.00 . A A . 40 PRO N 1 1 2 1190 1 1 40 PRO O O 5.844 -0.173 6.124 1.00 . A A . 40 PRO O 1 1 2 1191 1 1 41 SER C C 7.945 -1.594 8.888 1.00 . A A . 41 SER C 1 1 2 1192 1 1 41 SER CA C 7.275 -0.281 8.496 1.00 . A A . 41 SER CA 1 1 2 1193 1 1 41 SER CB C 7.583 0.794 9.540 1.00 . A A . 41 SER CB 1 1 2 1194 1 1 41 SER H H 5.294 -0.625 9.156 1.00 . A A . 41 SER H 1 1 2 1195 1 1 41 SER HA H 7.665 0.037 7.540 1.00 . A A . 41 SER HA 1 1 2 1196 1 1 41 SER HB2 H 7.678 0.332 10.511 1.00 . A A . 41 SER HB2 1 1 2 1197 1 1 41 SER HB3 H 8.509 1.287 9.284 1.00 . A A . 41 SER HB3 1 1 2 1198 1 1 41 SER HG H 5.746 1.355 9.928 1.00 . A A . 41 SER HG 1 1 2 1199 1 1 41 SER N N 5.834 -0.453 8.357 1.00 . A A . 41 SER N 1 1 2 1200 1 1 41 SER O O 8.958 -1.601 9.588 1.00 . A A . 41 SER O 1 1 2 1201 1 1 41 SER OG O 6.550 1.762 9.596 1.00 . A A . 41 SER OG 1 1 2 1202 1 1 42 TYR C C 7.703 -4.981 7.566 1.00 . A A . 42 TYR C 1 1 2 1203 1 1 42 TYR CA C 7.914 -4.023 8.736 1.00 . A A . 42 TYR CA 1 1 2 1204 1 1 42 TYR CB C 7.259 -4.588 9.998 1.00 . A A . 42 TYR CB 1 1 2 1205 1 1 42 TYR CD1 C 5.081 -3.403 10.474 1.00 . A A . 42 TYR CD1 1 1 2 1206 1 1 42 TYR CD2 C 4.991 -5.564 9.471 1.00 . A A . 42 TYR CD2 1 1 2 1207 1 1 42 TYR CE1 C 3.701 -3.335 10.460 1.00 . A A . 42 TYR CE1 1 1 2 1208 1 1 42 TYR CE2 C 3.611 -5.503 9.453 1.00 . A A . 42 TYR CE2 1 1 2 1209 1 1 42 TYR CG C 5.749 -4.517 9.981 1.00 . A A . 42 TYR CG 1 1 2 1210 1 1 42 TYR CZ C 2.971 -4.387 9.949 1.00 . A A . 42 TYR CZ 1 1 2 1211 1 1 42 TYR H H 6.567 -2.633 7.879 1.00 . A A . 42 TYR H 1 1 2 1212 1 1 42 TYR HA H 8.974 -3.913 8.910 1.00 . A A . 42 TYR HA 1 1 2 1213 1 1 42 TYR HB2 H 7.541 -5.624 10.108 1.00 . A A . 42 TYR HB2 1 1 2 1214 1 1 42 TYR HB3 H 7.609 -4.032 10.856 1.00 . A A . 42 TYR HB3 1 1 2 1215 1 1 42 TYR HD1 H 5.656 -2.581 10.874 1.00 . A A . 42 TYR HD1 1 1 2 1216 1 1 42 TYR HD2 H 5.496 -6.437 9.084 1.00 . A A . 42 TYR HD2 1 1 2 1217 1 1 42 TYR HE1 H 3.200 -2.460 10.848 1.00 . A A . 42 TYR HE1 1 1 2 1218 1 1 42 TYR HE2 H 3.039 -6.327 9.053 1.00 . A A . 42 TYR HE2 1 1 2 1219 1 1 42 TYR HH H 1.309 -3.795 9.185 1.00 . A A . 42 TYR HH 1 1 2 1220 1 1 42 TYR N N 7.373 -2.703 8.433 1.00 . A A . 42 TYR N 1 1 2 1221 1 1 42 TYR O O 6.803 -4.787 6.749 1.00 . A A . 42 TYR O 1 1 2 1222 1 1 42 TYR OH O 1.597 -4.323 9.934 1.00 . A A . 42 TYR OH 1 1 2 1223 1 1 43 PRO C C 7.188 -7.893 6.523 1.00 . A A . 43 PRO C 1 1 2 1224 1 1 43 PRO CA C 8.434 -7.023 6.394 1.00 . A A . 43 PRO CA 1 1 2 1225 1 1 43 PRO CB C 9.697 -7.869 6.569 1.00 . A A . 43 PRO CB 1 1 2 1226 1 1 43 PRO CD C 9.635 -6.340 8.405 1.00 . A A . 43 PRO CD 1 1 2 1227 1 1 43 PRO CG C 10.051 -7.729 8.009 1.00 . A A . 43 PRO CG 1 1 2 1228 1 1 43 PRO HA H 8.443 -6.552 5.422 1.00 . A A . 43 PRO HA 1 1 2 1229 1 1 43 PRO HB2 H 9.484 -8.896 6.311 1.00 . A A . 43 PRO HB2 1 1 2 1230 1 1 43 PRO HB3 H 10.481 -7.486 5.932 1.00 . A A . 43 PRO HB3 1 1 2 1231 1 1 43 PRO HD2 H 9.288 -6.326 9.427 1.00 . A A . 43 PRO HD2 1 1 2 1232 1 1 43 PRO HD3 H 10.454 -5.649 8.274 1.00 . A A . 43 PRO HD3 1 1 2 1233 1 1 43 PRO HG2 H 9.512 -8.462 8.592 1.00 . A A . 43 PRO HG2 1 1 2 1234 1 1 43 PRO HG3 H 11.115 -7.853 8.139 1.00 . A A . 43 PRO HG3 1 1 2 1235 1 1 43 PRO N N 8.534 -6.033 7.471 1.00 . A A . 43 PRO N 1 1 2 1236 1 1 43 PRO O O 6.402 -7.735 7.457 1.00 . A A . 43 PRO O 1 1 2 1237 1 1 44 GLY C C 6.213 -11.093 6.073 1.00 . A A . 44 GLY C 1 1 2 1238 1 1 44 GLY CA C 5.863 -9.694 5.606 1.00 . A A . 44 GLY CA 1 1 2 1239 1 1 44 GLY H H 7.674 -8.893 4.859 1.00 . A A . 44 GLY H 1 1 2 1240 1 1 44 GLY HA2 H 5.445 -9.753 4.612 1.00 . A A . 44 GLY HA2 1 1 2 1241 1 1 44 GLY HA3 H 5.121 -9.279 6.273 1.00 . A A . 44 GLY HA3 1 1 2 1242 1 1 44 GLY N N 7.015 -8.813 5.579 1.00 . A A . 44 GLY N 1 1 2 1243 1 1 44 GLY O O 5.439 -11.665 6.869 1.00 . A A . 44 GLY O 1 1 2 1244 1 1 44 GLY OXT O 7.262 -11.618 5.642 1.00 . A A . 44 GLY OXT 1 1 3 1245 1 1 1 ALA C C -14.190 10.844 6.313 1.00 . A A . 1 ALA C 1 1 3 1246 1 1 1 ALA CA C -15.059 11.943 6.914 1.00 . A A . 1 ALA CA 1 1 3 1247 1 1 1 ALA CB C -14.402 12.511 8.162 1.00 . A A . 1 ALA CB 1 1 3 1248 1 1 1 ALA H1 H -16.307 10.597 7.842 1.00 . A A . 1 ALA H1 1 1 3 1249 1 1 1 ALA H2 H -16.932 12.189 7.729 1.00 . A A . 1 ALA H2 1 1 3 1250 1 1 1 ALA H3 H -16.883 11.187 6.337 1.00 . A A . 1 ALA H3 1 1 3 1251 1 1 1 ALA HA H -15.158 12.742 6.193 1.00 . A A . 1 ALA HA 1 1 3 1252 1 1 1 ALA HB1 H -15.128 13.079 8.725 1.00 . A A . 1 ALA HB1 1 1 3 1253 1 1 1 ALA HB2 H -14.026 11.703 8.771 1.00 . A A . 1 ALA HB2 1 1 3 1254 1 1 1 ALA HB3 H -13.584 13.157 7.876 1.00 . A A . 1 ALA HB3 1 1 3 1255 1 1 1 ALA N N -16.418 11.433 7.234 1.00 . A A . 1 ALA N 1 1 3 1256 1 1 1 ALA O O -13.742 9.938 7.016 1.00 . A A . 1 ALA O 1 1 3 1257 1 1 2 MET C C -12.145 10.621 3.374 1.00 . A A . 2 MET C 1 1 3 1258 1 1 2 MET CA C -13.138 9.943 4.311 1.00 . A A . 2 MET CA 1 1 3 1259 1 1 2 MET CB C -14.027 8.980 3.521 1.00 . A A . 2 MET CB 1 1 3 1260 1 1 2 MET CE C -16.925 7.018 5.455 1.00 . A A . 2 MET CE 1 1 3 1261 1 1 2 MET CG C -14.511 7.791 4.336 1.00 . A A . 2 MET CG 1 1 3 1262 1 1 2 MET H H -14.339 11.675 4.500 1.00 . A A . 2 MET H 1 1 3 1263 1 1 2 MET HA H -12.589 9.384 5.054 1.00 . A A . 2 MET HA 1 1 3 1264 1 1 2 MET HB2 H -14.892 9.519 3.163 1.00 . A A . 2 MET HB2 1 1 3 1265 1 1 2 MET HB3 H -13.471 8.607 2.675 1.00 . A A . 2 MET HB3 1 1 3 1266 1 1 2 MET HE1 H -16.159 6.920 6.210 1.00 . A A . 2 MET HE1 1 1 3 1267 1 1 2 MET HE2 H -17.544 7.874 5.681 1.00 . A A . 2 MET HE2 1 1 3 1268 1 1 2 MET HE3 H -17.534 6.127 5.442 1.00 . A A . 2 MET HE3 1 1 3 1269 1 1 2 MET HG2 H -13.820 6.973 4.198 1.00 . A A . 2 MET HG2 1 1 3 1270 1 1 2 MET HG3 H -14.531 8.071 5.379 1.00 . A A . 2 MET HG3 1 1 3 1271 1 1 2 MET N N -13.955 10.930 5.007 1.00 . A A . 2 MET N 1 1 3 1272 1 1 2 MET O O -12.517 11.483 2.577 1.00 . A A . 2 MET O 1 1 3 1273 1 1 2 MET SD S -16.158 7.242 3.852 1.00 . A A . 2 MET SD 1 1 3 1274 1 1 3 ASP C C -9.470 9.848 1.497 1.00 . A A . 3 ASP C 1 1 3 1275 1 1 3 ASP CA C -9.833 10.797 2.634 1.00 . A A . 3 ASP CA 1 1 3 1276 1 1 3 ASP CB C -8.590 11.106 3.472 1.00 . A A . 3 ASP CB 1 1 3 1277 1 1 3 ASP CG C -7.858 12.341 2.986 1.00 . A A . 3 ASP CG 1 1 3 1278 1 1 3 ASP H H -10.645 9.536 4.128 1.00 . A A . 3 ASP H 1 1 3 1279 1 1 3 ASP HA H -10.210 11.717 2.213 1.00 . A A . 3 ASP HA 1 1 3 1280 1 1 3 ASP HB2 H -8.886 11.266 4.498 1.00 . A A . 3 ASP HB2 1 1 3 1281 1 1 3 ASP HB3 H -7.913 10.266 3.423 1.00 . A A . 3 ASP HB3 1 1 3 1282 1 1 3 ASP N N -10.880 10.227 3.474 1.00 . A A . 3 ASP N 1 1 3 1283 1 1 3 ASP O O -10.006 8.744 1.401 1.00 . A A . 3 ASP O 1 1 3 1284 1 1 3 ASP OD1 O -6.647 12.239 2.698 1.00 . A A . 3 ASP OD1 1 1 3 1285 1 1 3 ASP OD2 O -8.496 13.411 2.892 1.00 . A A . 3 ASP OD2 1 1 3 1286 1 1 4 CYS C C -6.736 8.893 -0.248 1.00 . A A . 4 CYS C 1 1 3 1287 1 1 4 CYS CA C -8.123 9.476 -0.496 1.00 . A A . 4 CYS CA 1 1 3 1288 1 1 4 CYS CB C -8.114 10.312 -1.776 1.00 . A A . 4 CYS CB 1 1 3 1289 1 1 4 CYS H H -8.166 11.175 0.765 1.00 . A A . 4 CYS H 1 1 3 1290 1 1 4 CYS HA H -8.825 8.664 -0.611 1.00 . A A . 4 CYS HA 1 1 3 1291 1 1 4 CYS HB2 H -7.859 11.332 -1.529 1.00 . A A . 4 CYS HB2 1 1 3 1292 1 1 4 CYS HB3 H -7.372 9.914 -2.452 1.00 . A A . 4 CYS HB3 1 1 3 1293 1 1 4 CYS N N -8.557 10.286 0.636 1.00 . A A . 4 CYS N 1 1 3 1294 1 1 4 CYS O O -6.431 7.782 -0.682 1.00 . A A . 4 CYS O 1 1 3 1295 1 1 4 CYS SG S -9.709 10.340 -2.657 1.00 . A A . 4 CYS SG 1 1 3 1296 1 1 5 THR C C -3.749 8.970 -0.523 1.00 . A A . 5 THR C 1 1 3 1297 1 1 5 THR CA C -4.542 9.210 0.758 1.00 . A A . 5 THR CA 1 1 3 1298 1 1 5 THR CB C -4.577 7.933 1.598 1.00 . A A . 5 THR CB 1 1 3 1299 1 1 5 THR CG2 C -3.407 7.811 2.550 1.00 . A A . 5 THR CG2 1 1 3 1300 1 1 5 THR H H -6.199 10.528 0.771 1.00 . A A . 5 THR H 1 1 3 1301 1 1 5 THR HA H -4.059 9.991 1.326 1.00 . A A . 5 THR HA 1 1 3 1302 1 1 5 THR HB H -4.556 7.079 0.936 1.00 . A A . 5 THR HB 1 1 3 1303 1 1 5 THR HG1 H -5.920 8.720 2.786 1.00 . A A . 5 THR HG1 1 1 3 1304 1 1 5 THR HG21 H -2.484 7.825 1.989 1.00 . A A . 5 THR HG21 1 1 3 1305 1 1 5 THR HG22 H -3.419 8.638 3.244 1.00 . A A . 5 THR HG22 1 1 3 1306 1 1 5 THR HG23 H -3.482 6.882 3.095 1.00 . A A . 5 THR HG23 1 1 3 1307 1 1 5 THR N N -5.898 9.651 0.453 1.00 . A A . 5 THR N 1 1 3 1308 1 1 5 THR O O -3.556 7.829 -0.941 1.00 . A A . 5 THR O 1 1 3 1309 1 1 5 THR OG1 O -5.765 7.871 2.367 1.00 . A A . 5 THR OG1 1 1 3 1310 1 1 6 THR C C -1.212 9.213 -2.146 1.00 . A A . 6 THR C 1 1 3 1311 1 1 6 THR CA C -2.522 9.960 -2.377 1.00 . A A . 6 THR CA 1 1 3 1312 1 1 6 THR CB C -2.235 11.356 -2.931 1.00 . A A . 6 THR CB 1 1 3 1313 1 1 6 THR CG2 C -3.284 11.838 -3.910 1.00 . A A . 6 THR CG2 1 1 3 1314 1 1 6 THR H H -3.480 10.937 -0.762 1.00 . A A . 6 THR H 1 1 3 1315 1 1 6 THR HA H -3.112 9.412 -3.095 1.00 . A A . 6 THR HA 1 1 3 1316 1 1 6 THR HB H -1.285 11.341 -3.446 1.00 . A A . 6 THR HB 1 1 3 1317 1 1 6 THR HG1 H -1.380 12.129 -1.348 1.00 . A A . 6 THR HG1 1 1 3 1318 1 1 6 THR HG21 H -3.922 11.012 -4.189 1.00 . A A . 6 THR HG21 1 1 3 1319 1 1 6 THR HG22 H -3.879 12.612 -3.448 1.00 . A A . 6 THR HG22 1 1 3 1320 1 1 6 THR HG23 H -2.800 12.233 -4.791 1.00 . A A . 6 THR HG23 1 1 3 1321 1 1 6 THR N N -3.293 10.054 -1.143 1.00 . A A . 6 THR N 1 1 3 1322 1 1 6 THR O O -0.360 9.656 -1.375 1.00 . A A . 6 THR O 1 1 3 1323 1 1 6 THR OG1 O -2.157 12.306 -1.883 1.00 . A A . 6 THR OG1 1 1 3 1324 1 1 7 GLY C C 0.152 6.060 -3.567 1.00 . A A . 7 GLY C 1 1 3 1325 1 1 7 GLY CA C 0.150 7.286 -2.673 1.00 . A A . 7 GLY CA 1 1 3 1326 1 1 7 GLY H H -1.771 7.773 -3.418 1.00 . A A . 7 GLY H 1 1 3 1327 1 1 7 GLY HA2 H 0.237 6.968 -1.644 1.00 . A A . 7 GLY HA2 1 1 3 1328 1 1 7 GLY HA3 H 1.001 7.901 -2.922 1.00 . A A . 7 GLY HA3 1 1 3 1329 1 1 7 GLY N N -1.058 8.077 -2.818 1.00 . A A . 7 GLY N 1 1 3 1330 1 1 7 GLY O O -0.795 5.839 -4.322 1.00 . A A . 7 GLY O 1 1 3 1331 1 1 8 PRO C C 0.321 2.949 -3.897 1.00 . A A . 8 PRO C 1 1 3 1332 1 1 8 PRO CA C 1.319 4.022 -4.320 1.00 . A A . 8 PRO CA 1 1 3 1333 1 1 8 PRO CB C 2.752 3.548 -4.069 1.00 . A A . 8 PRO CB 1 1 3 1334 1 1 8 PRO CD C 2.385 5.420 -2.629 1.00 . A A . 8 PRO CD 1 1 3 1335 1 1 8 PRO CG C 3.108 4.106 -2.734 1.00 . A A . 8 PRO CG 1 1 3 1336 1 1 8 PRO HA H 1.187 4.240 -5.370 1.00 . A A . 8 PRO HA 1 1 3 1337 1 1 8 PRO HB2 H 2.782 2.468 -4.067 1.00 . A A . 8 PRO HB2 1 1 3 1338 1 1 8 PRO HB3 H 3.402 3.930 -4.842 1.00 . A A . 8 PRO HB3 1 1 3 1339 1 1 8 PRO HD2 H 2.082 5.603 -1.609 1.00 . A A . 8 PRO HD2 1 1 3 1340 1 1 8 PRO HD3 H 3.010 6.224 -2.989 1.00 . A A . 8 PRO HD3 1 1 3 1341 1 1 8 PRO HG2 H 2.779 3.433 -1.956 1.00 . A A . 8 PRO HG2 1 1 3 1342 1 1 8 PRO HG3 H 4.175 4.259 -2.673 1.00 . A A . 8 PRO HG3 1 1 3 1343 1 1 8 PRO N N 1.211 5.235 -3.503 1.00 . A A . 8 PRO N 1 1 3 1344 1 1 8 PRO O O -0.201 2.209 -4.730 1.00 . A A . 8 PRO O 1 1 3 1345 1 1 9 CYS C C -2.302 2.172 -2.525 1.00 . A A . 9 CYS C 1 1 3 1346 1 1 9 CYS CA C -0.874 1.890 -2.059 1.00 . A A . 9 CYS CA 1 1 3 1347 1 1 9 CYS CB C -0.818 1.887 -0.531 1.00 . A A . 9 CYS CB 1 1 3 1348 1 1 9 CYS H H 0.510 3.490 -1.982 1.00 . A A . 9 CYS H 1 1 3 1349 1 1 9 CYS HA H -0.577 0.918 -2.421 1.00 . A A . 9 CYS HA 1 1 3 1350 1 1 9 CYS HB2 H 0.214 1.826 -0.216 1.00 . A A . 9 CYS HB2 1 1 3 1351 1 1 9 CYS HB3 H -1.247 2.806 -0.162 1.00 . A A . 9 CYS HB3 1 1 3 1352 1 1 9 CYS N N 0.062 2.872 -2.596 1.00 . A A . 9 CYS N 1 1 3 1353 1 1 9 CYS O O -3.179 1.315 -2.413 1.00 . A A . 9 CYS O 1 1 3 1354 1 1 9 CYS SG S -1.715 0.504 0.244 1.00 . A A . 9 CYS SG 1 1 3 1355 1 1 10 CYS C C -3.862 3.881 -5.048 1.00 . A A . 10 CYS C 1 1 3 1356 1 1 10 CYS CA C -3.853 3.759 -3.527 1.00 . A A . 10 CYS CA 1 1 3 1357 1 1 10 CYS CB C -4.284 5.083 -2.893 1.00 . A A . 10 CYS CB 1 1 3 1358 1 1 10 CYS H H -1.796 4.018 -3.111 1.00 . A A . 10 CYS H 1 1 3 1359 1 1 10 CYS HA H -4.550 2.987 -3.236 1.00 . A A . 10 CYS HA 1 1 3 1360 1 1 10 CYS HB2 H -3.570 5.849 -3.157 1.00 . A A . 10 CYS HB2 1 1 3 1361 1 1 10 CYS HB3 H -5.256 5.357 -3.275 1.00 . A A . 10 CYS HB3 1 1 3 1362 1 1 10 CYS N N -2.531 3.374 -3.047 1.00 . A A . 10 CYS N 1 1 3 1363 1 1 10 CYS O O -2.866 4.278 -5.653 1.00 . A A . 10 CYS O 1 1 3 1364 1 1 10 CYS SG S -4.395 5.033 -1.074 1.00 . A A . 10 CYS SG 1 1 3 1365 1 1 11 ARG C C -5.187 5.051 -7.590 1.00 . A A . 11 ARG C 1 1 3 1366 1 1 11 ARG CA C -5.120 3.601 -7.112 1.00 . A A . 11 ARG CA 1 1 3 1367 1 1 11 ARG CB C -6.360 2.827 -7.572 1.00 . A A . 11 ARG CB 1 1 3 1368 1 1 11 ARG CD C -7.059 1.014 -9.164 1.00 . A A . 11 ARG CD 1 1 3 1369 1 1 11 ARG CG C -6.046 1.443 -8.116 1.00 . A A . 11 ARG CG 1 1 3 1370 1 1 11 ARG CZ C -8.062 -1.066 -10.025 1.00 . A A . 11 ARG CZ 1 1 3 1371 1 1 11 ARG H H -5.748 3.221 -5.126 1.00 . A A . 11 ARG H 1 1 3 1372 1 1 11 ARG HA H -4.244 3.141 -7.541 1.00 . A A . 11 ARG HA 1 1 3 1373 1 1 11 ARG HB2 H -7.032 2.717 -6.734 1.00 . A A . 11 ARG HB2 1 1 3 1374 1 1 11 ARG HB3 H -6.856 3.391 -8.348 1.00 . A A . 11 ARG HB3 1 1 3 1375 1 1 11 ARG HD2 H -8.007 1.481 -8.943 1.00 . A A . 11 ARG HD2 1 1 3 1376 1 1 11 ARG HD3 H -6.715 1.341 -10.134 1.00 . A A . 11 ARG HD3 1 1 3 1377 1 1 11 ARG HE H -6.723 -0.968 -8.549 1.00 . A A . 11 ARG HE 1 1 3 1378 1 1 11 ARG HG2 H -5.064 1.457 -8.564 1.00 . A A . 11 ARG HG2 1 1 3 1379 1 1 11 ARG HG3 H -6.062 0.734 -7.301 1.00 . A A . 11 ARG HG3 1 1 3 1380 1 1 11 ARG HH11 H -8.705 0.618 -10.944 1.00 . A A . 11 ARG HH11 1 1 3 1381 1 1 11 ARG HH12 H -9.395 -0.858 -11.532 1.00 . A A . 11 ARG HH12 1 1 3 1382 1 1 11 ARG HH21 H -7.630 -2.910 -9.320 1.00 . A A . 11 ARG HH21 1 1 3 1383 1 1 11 ARG HH22 H -8.785 -2.861 -10.609 1.00 . A A . 11 ARG HH22 1 1 3 1384 1 1 11 ARG N N -4.989 3.533 -5.661 1.00 . A A . 11 ARG N 1 1 3 1385 1 1 11 ARG NE N -7.241 -0.436 -9.189 1.00 . A A . 11 ARG NE 1 1 3 1386 1 1 11 ARG NH1 N -8.779 -0.379 -10.906 1.00 . A A . 11 ARG NH1 1 1 3 1387 1 1 11 ARG NH2 N -8.168 -2.387 -9.981 1.00 . A A . 11 ARG NH2 1 1 3 1388 1 1 11 ARG O O -4.164 5.650 -7.922 1.00 . A A . 11 ARG O 1 1 3 1389 1 1 12 GLN C C -7.150 7.852 -6.939 1.00 . A A . 12 GLN C 1 1 3 1390 1 1 12 GLN CA C -6.582 6.990 -8.063 1.00 . A A . 12 GLN CA 1 1 3 1391 1 1 12 GLN CB C -7.514 7.036 -9.275 1.00 . A A . 12 GLN CB 1 1 3 1392 1 1 12 GLN CD C -8.780 8.791 -10.578 1.00 . A A . 12 GLN CD 1 1 3 1393 1 1 12 GLN CG C -7.431 8.337 -10.057 1.00 . A A . 12 GLN CG 1 1 3 1394 1 1 12 GLN H H -7.173 5.087 -7.349 1.00 . A A . 12 GLN H 1 1 3 1395 1 1 12 GLN HA H -5.618 7.382 -8.348 1.00 . A A . 12 GLN HA 1 1 3 1396 1 1 12 GLN HB2 H -7.260 6.224 -9.941 1.00 . A A . 12 GLN HB2 1 1 3 1397 1 1 12 GLN HB3 H -8.532 6.908 -8.938 1.00 . A A . 12 GLN HB3 1 1 3 1398 1 1 12 GLN HE21 H -8.040 10.586 -11.004 1.00 . A A . 12 GLN HE21 1 1 3 1399 1 1 12 GLN HE22 H -9.712 10.357 -11.373 1.00 . A A . 12 GLN HE22 1 1 3 1400 1 1 12 GLN HG2 H -7.035 9.106 -9.410 1.00 . A A . 12 GLN HG2 1 1 3 1401 1 1 12 GLN HG3 H -6.766 8.196 -10.896 1.00 . A A . 12 GLN HG3 1 1 3 1402 1 1 12 GLN N N -6.393 5.612 -7.624 1.00 . A A . 12 GLN N 1 1 3 1403 1 1 12 GLN NE2 N -8.851 10.037 -11.031 1.00 . A A . 12 GLN NE2 1 1 3 1404 1 1 12 GLN O O -6.999 9.074 -6.947 1.00 . A A . 12 GLN O 1 1 3 1405 1 1 12 GLN OE1 O -9.748 8.031 -10.573 1.00 . A A . 12 GLN OE1 1 1 3 1406 1 1 13 CYS C C -9.093 6.962 -3.892 1.00 . A A . 13 CYS C 1 1 3 1407 1 1 13 CYS CA C -8.396 7.927 -4.848 1.00 . A A . 13 CYS CA 1 1 3 1408 1 1 13 CYS CB C -9.393 8.976 -5.349 1.00 . A A . 13 CYS CB 1 1 3 1409 1 1 13 CYS H H -7.896 6.238 -6.021 1.00 . A A . 13 CYS H 1 1 3 1410 1 1 13 CYS HA H -7.599 8.426 -4.318 1.00 . A A . 13 CYS HA 1 1 3 1411 1 1 13 CYS HB2 H -9.279 9.088 -6.417 1.00 . A A . 13 CYS HB2 1 1 3 1412 1 1 13 CYS HB3 H -10.397 8.642 -5.132 1.00 . A A . 13 CYS HB3 1 1 3 1413 1 1 13 CYS N N -7.806 7.212 -5.974 1.00 . A A . 13 CYS N 1 1 3 1414 1 1 13 CYS O O -10.142 7.279 -3.332 1.00 . A A . 13 CYS O 1 1 3 1415 1 1 13 CYS SG S -9.182 10.623 -4.597 1.00 . A A . 13 CYS SG 1 1 3 1416 1 1 14 LYS C C -8.042 3.706 -2.484 1.00 . A A . 14 LYS C 1 1 3 1417 1 1 14 LYS CA C -9.073 4.777 -2.822 1.00 . A A . 14 LYS CA 1 1 3 1418 1 1 14 LYS CB C -10.302 4.134 -3.466 1.00 . A A . 14 LYS CB 1 1 3 1419 1 1 14 LYS CD C -11.076 2.120 -2.179 1.00 . A A . 14 LYS CD 1 1 3 1420 1 1 14 LYS CE C -12.370 1.417 -1.802 1.00 . A A . 14 LYS CE 1 1 3 1421 1 1 14 LYS CG C -11.305 3.596 -2.459 1.00 . A A . 14 LYS CG 1 1 3 1422 1 1 14 LYS H H -7.669 5.586 -4.183 1.00 . A A . 14 LYS H 1 1 3 1423 1 1 14 LYS HA H -9.372 5.272 -1.910 1.00 . A A . 14 LYS HA 1 1 3 1424 1 1 14 LYS HB2 H -10.800 4.871 -4.079 1.00 . A A . 14 LYS HB2 1 1 3 1425 1 1 14 LYS HB3 H -9.979 3.316 -4.093 1.00 . A A . 14 LYS HB3 1 1 3 1426 1 1 14 LYS HD2 H -10.670 1.654 -3.064 1.00 . A A . 14 LYS HD2 1 1 3 1427 1 1 14 LYS HD3 H -10.374 2.023 -1.364 1.00 . A A . 14 LYS HD3 1 1 3 1428 1 1 14 LYS HE2 H -12.138 0.415 -1.472 1.00 . A A . 14 LYS HE2 1 1 3 1429 1 1 14 LYS HE3 H -12.839 1.962 -0.996 1.00 . A A . 14 LYS HE3 1 1 3 1430 1 1 14 LYS HG2 H -11.205 4.147 -1.536 1.00 . A A . 14 LYS HG2 1 1 3 1431 1 1 14 LYS HG3 H -12.302 3.728 -2.853 1.00 . A A . 14 LYS HG3 1 1 3 1432 1 1 14 LYS HZ1 H -12.804 1.073 -3.817 1.00 . A A . 14 LYS HZ1 1 1 3 1433 1 1 14 LYS HZ2 H -14.050 0.630 -2.762 1.00 . A A . 14 LYS HZ2 1 1 3 1434 1 1 14 LYS HZ3 H -13.771 2.263 -3.101 1.00 . A A . 14 LYS HZ3 1 1 3 1435 1 1 14 LYS N N -8.504 5.784 -3.710 1.00 . A A . 14 LYS N 1 1 3 1436 1 1 14 LYS NZ N -13.315 1.340 -2.951 1.00 . A A . 14 LYS NZ 1 1 3 1437 1 1 14 LYS O O -7.211 3.345 -3.318 1.00 . A A . 14 LYS O 1 1 3 1438 1 1 15 LEU C C -7.254 0.939 -1.709 1.00 . A A . 15 LEU C 1 1 3 1439 1 1 15 LEU CA C -7.176 2.169 -0.808 1.00 . A A . 15 LEU CA 1 1 3 1440 1 1 15 LEU CB C -7.478 1.779 0.641 1.00 . A A . 15 LEU CB 1 1 3 1441 1 1 15 LEU CD1 C -7.054 2.452 3.017 1.00 . A A . 15 LEU CD1 1 1 3 1442 1 1 15 LEU CD2 C -5.329 1.145 1.762 1.00 . A A . 15 LEU CD2 1 1 3 1443 1 1 15 LEU CG C -6.419 2.202 1.659 1.00 . A A . 15 LEU CG 1 1 3 1444 1 1 15 LEU H H -8.789 3.528 -0.638 1.00 . A A . 15 LEU H 1 1 3 1445 1 1 15 LEU HA H -6.177 2.575 -0.861 1.00 . A A . 15 LEU HA 1 1 3 1446 1 1 15 LEU HB2 H -8.419 2.230 0.923 1.00 . A A . 15 LEU HB2 1 1 3 1447 1 1 15 LEU HB3 H -7.584 0.705 0.692 1.00 . A A . 15 LEU HB3 1 1 3 1448 1 1 15 LEU HD11 H -7.889 3.129 2.906 1.00 . A A . 15 LEU HD11 1 1 3 1449 1 1 15 LEU HD12 H -7.403 1.516 3.429 1.00 . A A . 15 LEU HD12 1 1 3 1450 1 1 15 LEU HD13 H -6.324 2.888 3.682 1.00 . A A . 15 LEU HD13 1 1 3 1451 1 1 15 LEU HD21 H -5.721 0.192 1.438 1.00 . A A . 15 LEU HD21 1 1 3 1452 1 1 15 LEU HD22 H -4.496 1.424 1.135 1.00 . A A . 15 LEU HD22 1 1 3 1453 1 1 15 LEU HD23 H -4.998 1.068 2.787 1.00 . A A . 15 LEU HD23 1 1 3 1454 1 1 15 LEU HG H -5.961 3.124 1.330 1.00 . A A . 15 LEU HG 1 1 3 1455 1 1 15 LEU N N -8.103 3.200 -1.257 1.00 . A A . 15 LEU N 1 1 3 1456 1 1 15 LEU O O -8.295 0.289 -1.797 1.00 . A A . 15 LEU O 1 1 3 1457 1 1 16 LYS C C -6.443 -1.809 -2.521 1.00 . A A . 16 LYS C 1 1 3 1458 1 1 16 LYS CA C -6.093 -0.524 -3.268 1.00 . A A . 16 LYS CA 1 1 3 1459 1 1 16 LYS CB C -4.702 -0.647 -3.894 1.00 . A A . 16 LYS CB 1 1 3 1460 1 1 16 LYS CD C -2.860 0.621 -5.040 1.00 . A A . 16 LYS CD 1 1 3 1461 1 1 16 LYS CE C -2.387 -0.111 -6.286 1.00 . A A . 16 LYS CE 1 1 3 1462 1 1 16 LYS CG C -4.362 0.485 -4.850 1.00 . A A . 16 LYS CG 1 1 3 1463 1 1 16 LYS H H -5.348 1.184 -2.263 1.00 . A A . 16 LYS H 1 1 3 1464 1 1 16 LYS HA H -6.819 -0.367 -4.052 1.00 . A A . 16 LYS HA 1 1 3 1465 1 1 16 LYS HB2 H -3.965 -0.659 -3.105 1.00 . A A . 16 LYS HB2 1 1 3 1466 1 1 16 LYS HB3 H -4.647 -1.578 -4.439 1.00 . A A . 16 LYS HB3 1 1 3 1467 1 1 16 LYS HD2 H -2.612 1.667 -5.134 1.00 . A A . 16 LYS HD2 1 1 3 1468 1 1 16 LYS HD3 H -2.359 0.206 -4.178 1.00 . A A . 16 LYS HD3 1 1 3 1469 1 1 16 LYS HE2 H -1.320 -0.260 -6.217 1.00 . A A . 16 LYS HE2 1 1 3 1470 1 1 16 LYS HE3 H -2.881 -1.071 -6.333 1.00 . A A . 16 LYS HE3 1 1 3 1471 1 1 16 LYS HG2 H -4.819 0.284 -5.807 1.00 . A A . 16 LYS HG2 1 1 3 1472 1 1 16 LYS HG3 H -4.751 1.410 -4.449 1.00 . A A . 16 LYS HG3 1 1 3 1473 1 1 16 LYS HZ1 H -3.480 1.308 -7.360 1.00 . A A . 16 LYS HZ1 1 1 3 1474 1 1 16 LYS HZ2 H -1.857 1.199 -7.823 1.00 . A A . 16 LYS HZ2 1 1 3 1475 1 1 16 LYS HZ3 H -2.952 -0.001 -8.294 1.00 . A A . 16 LYS HZ3 1 1 3 1476 1 1 16 LYS N N -6.147 0.627 -2.375 1.00 . A A . 16 LYS N 1 1 3 1477 1 1 16 LYS NZ N -2.690 0.652 -7.528 1.00 . A A . 16 LYS NZ 1 1 3 1478 1 1 16 LYS O O -6.311 -1.881 -1.299 1.00 . A A . 16 LYS O 1 1 3 1479 1 1 17 PRO C C -6.163 -4.692 -1.754 1.00 . A A . 17 PRO C 1 1 3 1480 1 1 17 PRO CA C -7.266 -4.130 -2.646 1.00 . A A . 17 PRO CA 1 1 3 1481 1 1 17 PRO CB C -7.489 -5.039 -3.856 1.00 . A A . 17 PRO CB 1 1 3 1482 1 1 17 PRO CD C -7.084 -2.844 -4.711 1.00 . A A . 17 PRO CD 1 1 3 1483 1 1 17 PRO CG C -7.851 -4.112 -4.964 1.00 . A A . 17 PRO CG 1 1 3 1484 1 1 17 PRO HA H -8.181 -4.052 -2.077 1.00 . A A . 17 PRO HA 1 1 3 1485 1 1 17 PRO HB2 H -6.581 -5.582 -4.075 1.00 . A A . 17 PRO HB2 1 1 3 1486 1 1 17 PRO HB3 H -8.288 -5.734 -3.647 1.00 . A A . 17 PRO HB3 1 1 3 1487 1 1 17 PRO HD2 H -6.133 -2.870 -5.222 1.00 . A A . 17 PRO HD2 1 1 3 1488 1 1 17 PRO HD3 H -7.659 -1.986 -5.024 1.00 . A A . 17 PRO HD3 1 1 3 1489 1 1 17 PRO HG2 H -7.563 -4.542 -5.912 1.00 . A A . 17 PRO HG2 1 1 3 1490 1 1 17 PRO HG3 H -8.913 -3.917 -4.947 1.00 . A A . 17 PRO HG3 1 1 3 1491 1 1 17 PRO N N -6.896 -2.845 -3.248 1.00 . A A . 17 PRO N 1 1 3 1492 1 1 17 PRO O O -4.977 -4.532 -2.041 1.00 . A A . 17 PRO O 1 1 3 1493 1 1 18 ALA C C -4.685 -6.925 -0.444 1.00 . A A . 18 ALA C 1 1 3 1494 1 1 18 ALA CA C -5.612 -5.941 0.263 1.00 . A A . 18 ALA CA 1 1 3 1495 1 1 18 ALA CB C -6.349 -6.631 1.401 1.00 . A A . 18 ALA CB 1 1 3 1496 1 1 18 ALA H H -7.524 -5.447 -0.499 1.00 . A A . 18 ALA H 1 1 3 1497 1 1 18 ALA HA H -5.018 -5.141 0.683 1.00 . A A . 18 ALA HA 1 1 3 1498 1 1 18 ALA HB1 H -6.668 -5.894 2.123 1.00 . A A . 18 ALA HB1 1 1 3 1499 1 1 18 ALA HB2 H -5.690 -7.341 1.878 1.00 . A A . 18 ALA HB2 1 1 3 1500 1 1 18 ALA HB3 H -7.212 -7.148 1.009 1.00 . A A . 18 ALA HB3 1 1 3 1501 1 1 18 ALA N N -6.564 -5.352 -0.672 1.00 . A A . 18 ALA N 1 1 3 1502 1 1 18 ALA O O -5.115 -7.992 -0.882 1.00 . A A . 18 ALA O 1 1 3 1503 1 1 19 GLY C C -1.569 -6.668 -2.196 1.00 . A A . 19 GLY C 1 1 3 1504 1 1 19 GLY CA C -2.445 -7.417 -1.208 1.00 . A A . 19 GLY CA 1 1 3 1505 1 1 19 GLY H H -3.129 -5.694 -0.184 1.00 . A A . 19 GLY H 1 1 3 1506 1 1 19 GLY HA2 H -2.974 -8.198 -1.734 1.00 . A A . 19 GLY HA2 1 1 3 1507 1 1 19 GLY HA3 H -1.815 -7.868 -0.456 1.00 . A A . 19 GLY HA3 1 1 3 1508 1 1 19 GLY N N -3.413 -6.557 -0.552 1.00 . A A . 19 GLY N 1 1 3 1509 1 1 19 GLY O O -0.604 -7.224 -2.721 1.00 . A A . 19 GLY O 1 1 3 1510 1 1 20 THR C C 0.236 -4.248 -2.806 1.00 . A A . 20 THR C 1 1 3 1511 1 1 20 THR CA C -1.134 -4.588 -3.383 1.00 . A A . 20 THR CA 1 1 3 1512 1 1 20 THR CB C -1.894 -3.302 -3.713 1.00 . A A . 20 THR CB 1 1 3 1513 1 1 20 THR CG2 C -1.222 -2.466 -4.780 1.00 . A A . 20 THR CG2 1 1 3 1514 1 1 20 THR H H -2.680 -5.014 -2.004 1.00 . A A . 20 THR H 1 1 3 1515 1 1 20 THR HA H -0.998 -5.158 -4.290 1.00 . A A . 20 THR HA 1 1 3 1516 1 1 20 THR HB H -1.968 -2.700 -2.818 1.00 . A A . 20 THR HB 1 1 3 1517 1 1 20 THR HG1 H -3.832 -3.424 -3.453 1.00 . A A . 20 THR HG1 1 1 3 1518 1 1 20 THR HG21 H -0.196 -2.783 -4.892 1.00 . A A . 20 THR HG21 1 1 3 1519 1 1 20 THR HG22 H -1.742 -2.592 -5.717 1.00 . A A . 20 THR HG22 1 1 3 1520 1 1 20 THR HG23 H -1.248 -1.426 -4.491 1.00 . A A . 20 THR HG23 1 1 3 1521 1 1 20 THR N N -1.902 -5.405 -2.451 1.00 . A A . 20 THR N 1 1 3 1522 1 1 20 THR O O 0.345 -3.487 -1.845 1.00 . A A . 20 THR O 1 1 3 1523 1 1 20 THR OG1 O -3.206 -3.596 -4.160 1.00 . A A . 20 THR OG1 1 1 3 1524 1 1 21 THR C C 3.125 -3.195 -3.381 1.00 . A A . 21 THR C 1 1 3 1525 1 1 21 THR CA C 2.643 -4.575 -2.944 1.00 . A A . 21 THR CA 1 1 3 1526 1 1 21 THR CB C 3.587 -5.655 -3.483 1.00 . A A . 21 THR CB 1 1 3 1527 1 1 21 THR CG2 C 4.258 -6.461 -2.391 1.00 . A A . 21 THR CG2 1 1 3 1528 1 1 21 THR H H 1.129 -5.415 -4.162 1.00 . A A . 21 THR H 1 1 3 1529 1 1 21 THR HA H 2.643 -4.617 -1.865 1.00 . A A . 21 THR HA 1 1 3 1530 1 1 21 THR HB H 4.363 -5.184 -4.068 1.00 . A A . 21 THR HB 1 1 3 1531 1 1 21 THR HG1 H 2.262 -7.064 -3.793 1.00 . A A . 21 THR HG1 1 1 3 1532 1 1 21 THR HG21 H 3.593 -6.543 -1.544 1.00 . A A . 21 THR HG21 1 1 3 1533 1 1 21 THR HG22 H 4.490 -7.448 -2.763 1.00 . A A . 21 THR HG22 1 1 3 1534 1 1 21 THR HG23 H 5.169 -5.967 -2.087 1.00 . A A . 21 THR HG23 1 1 3 1535 1 1 21 THR N N 1.280 -4.818 -3.400 1.00 . A A . 21 THR N 1 1 3 1536 1 1 21 THR O O 2.787 -2.724 -4.467 1.00 . A A . 21 THR O 1 1 3 1537 1 1 21 THR OG1 O 2.890 -6.563 -4.318 1.00 . A A . 21 THR OG1 1 1 3 1538 1 1 22 CYS C C 5.884 -1.311 -3.316 1.00 . A A . 22 CYS C 1 1 3 1539 1 1 22 CYS CA C 4.443 -1.225 -2.826 1.00 . A A . 22 CYS CA 1 1 3 1540 1 1 22 CYS CB C 4.366 -0.332 -1.586 1.00 . A A . 22 CYS CB 1 1 3 1541 1 1 22 CYS H H 4.149 -2.979 -1.678 1.00 . A A . 22 CYS H 1 1 3 1542 1 1 22 CYS HA H 3.834 -0.795 -3.607 1.00 . A A . 22 CYS HA 1 1 3 1543 1 1 22 CYS HB2 H 4.569 -0.928 -0.709 1.00 . A A . 22 CYS HB2 1 1 3 1544 1 1 22 CYS HB3 H 5.110 0.447 -1.667 1.00 . A A . 22 CYS HB3 1 1 3 1545 1 1 22 CYS N N 3.915 -2.551 -2.528 1.00 . A A . 22 CYS N 1 1 3 1546 1 1 22 CYS O O 6.157 -1.151 -4.506 1.00 . A A . 22 CYS O 1 1 3 1547 1 1 22 CYS SG S 2.747 0.469 -1.347 1.00 . A A . 22 CYS SG 1 1 3 1548 1 1 23 TRP C C 8.698 -3.115 -2.617 1.00 . A A . 23 TRP C 1 1 3 1549 1 1 23 TRP CA C 8.219 -1.671 -2.729 1.00 . A A . 23 TRP CA 1 1 3 1550 1 1 23 TRP CB C 9.053 -0.773 -1.814 1.00 . A A . 23 TRP CB 1 1 3 1551 1 1 23 TRP CD1 C 10.983 -0.570 -3.487 1.00 . A A . 23 TRP CD1 1 1 3 1552 1 1 23 TRP CD2 C 11.631 -0.712 -1.349 1.00 . A A . 23 TRP CD2 1 1 3 1553 1 1 23 TRP CE2 C 12.778 -0.606 -2.159 1.00 . A A . 23 TRP CE2 1 1 3 1554 1 1 23 TRP CE3 C 11.792 -0.813 0.036 1.00 . A A . 23 TRP CE3 1 1 3 1555 1 1 23 TRP CG C 10.493 -0.687 -2.218 1.00 . A A . 23 TRP CG 1 1 3 1556 1 1 23 TRP CH2 C 14.193 -0.698 -0.271 1.00 . A A . 23 TRP CH2 1 1 3 1557 1 1 23 TRP CZ2 C 14.066 -0.598 -1.630 1.00 . A A . 23 TRP CZ2 1 1 3 1558 1 1 23 TRP CZ3 C 13.071 -0.805 0.560 1.00 . A A . 23 TRP CZ3 1 1 3 1559 1 1 23 TRP H H 6.526 -1.682 -1.459 1.00 . A A . 23 TRP H 1 1 3 1560 1 1 23 TRP HA H 8.342 -1.343 -3.751 1.00 . A A . 23 TRP HA 1 1 3 1561 1 1 23 TRP HB2 H 8.643 0.226 -1.830 1.00 . A A . 23 TRP HB2 1 1 3 1562 1 1 23 TRP HB3 H 9.011 -1.159 -0.806 1.00 . A A . 23 TRP HB3 1 1 3 1563 1 1 23 TRP HD1 H 10.369 -0.525 -4.375 1.00 . A A . 23 TRP HD1 1 1 3 1564 1 1 23 TRP HE1 H 12.938 -0.437 -4.244 1.00 . A A . 23 TRP HE1 1 1 3 1565 1 1 23 TRP HE3 H 10.939 -0.896 0.693 1.00 . A A . 23 TRP HE3 1 1 3 1566 1 1 23 TRP HH2 H 15.173 -0.696 0.182 1.00 . A A . 23 TRP HH2 1 1 3 1567 1 1 23 TRP HZ2 H 14.941 -0.515 -2.257 1.00 . A A . 23 TRP HZ2 1 1 3 1568 1 1 23 TRP HZ3 H 13.215 -0.882 1.628 1.00 . A A . 23 TRP HZ3 1 1 3 1569 1 1 23 TRP N N 6.805 -1.564 -2.391 1.00 . A A . 23 TRP N 1 1 3 1570 1 1 23 TRP NE1 N 12.356 -0.520 -3.460 1.00 . A A . 23 TRP NE1 1 1 3 1571 1 1 23 TRP O O 9.321 -3.498 -1.627 1.00 . A A . 23 TRP O 1 1 3 1572 1 1 24 ARG C C 10.287 -5.453 -3.967 1.00 . A A . 24 ARG C 1 1 3 1573 1 1 24 ARG CA C 8.801 -5.315 -3.654 1.00 . A A . 24 ARG CA 1 1 3 1574 1 1 24 ARG CB C 7.976 -6.091 -4.683 1.00 . A A . 24 ARG CB 1 1 3 1575 1 1 24 ARG CD C 6.838 -5.702 -6.889 1.00 . A A . 24 ARG CD 1 1 3 1576 1 1 24 ARG CG C 8.133 -5.572 -6.103 1.00 . A A . 24 ARG CG 1 1 3 1577 1 1 24 ARG CZ C 6.170 -5.904 -9.252 1.00 . A A . 24 ARG CZ 1 1 3 1578 1 1 24 ARG H H 7.901 -3.550 -4.399 1.00 . A A . 24 ARG H 1 1 3 1579 1 1 24 ARG HA H 8.612 -5.724 -2.672 1.00 . A A . 24 ARG HA 1 1 3 1580 1 1 24 ARG HB2 H 8.282 -7.126 -4.665 1.00 . A A . 24 ARG HB2 1 1 3 1581 1 1 24 ARG HB3 H 6.933 -6.027 -4.412 1.00 . A A . 24 ARG HB3 1 1 3 1582 1 1 24 ARG HD2 H 6.237 -6.479 -6.441 1.00 . A A . 24 ARG HD2 1 1 3 1583 1 1 24 ARG HD3 H 6.307 -4.763 -6.840 1.00 . A A . 24 ARG HD3 1 1 3 1584 1 1 24 ARG HE H 7.967 -6.382 -8.527 1.00 . A A . 24 ARG HE 1 1 3 1585 1 1 24 ARG HG2 H 8.417 -4.531 -6.067 1.00 . A A . 24 ARG HG2 1 1 3 1586 1 1 24 ARG HG3 H 8.905 -6.141 -6.600 1.00 . A A . 24 ARG HG3 1 1 3 1587 1 1 24 ARG HH11 H 4.724 -5.192 -8.030 1.00 . A A . 24 ARG HH11 1 1 3 1588 1 1 24 ARG HH12 H 4.279 -5.343 -9.697 1.00 . A A . 24 ARG HH12 1 1 3 1589 1 1 24 ARG HH21 H 7.384 -6.581 -10.719 1.00 . A A . 24 ARG HH21 1 1 3 1590 1 1 24 ARG HH22 H 5.789 -6.132 -11.224 1.00 . A A . 24 ARG HH22 1 1 3 1591 1 1 24 ARG N N 8.401 -3.913 -3.638 1.00 . A A . 24 ARG N 1 1 3 1592 1 1 24 ARG NE N 7.080 -6.038 -8.290 1.00 . A A . 24 ARG NE 1 1 3 1593 1 1 24 ARG NH1 N 4.958 -5.441 -8.969 1.00 . A A . 24 ARG NH1 1 1 3 1594 1 1 24 ARG NH2 N 6.472 -6.232 -10.501 1.00 . A A . 24 ARG NH2 1 1 3 1595 1 1 24 ARG O O 10.772 -4.926 -4.968 1.00 . A A . 24 ARG O 1 1 3 1596 1 1 25 THR C C 12.866 -7.727 -2.731 1.00 . A A . 25 THR C 1 1 3 1597 1 1 25 THR CA C 12.436 -6.374 -3.290 1.00 . A A . 25 THR CA 1 1 3 1598 1 1 25 THR CB C 13.227 -5.255 -2.611 1.00 . A A . 25 THR CB 1 1 3 1599 1 1 25 THR CG2 C 14.476 -4.860 -3.369 1.00 . A A . 25 THR CG2 1 1 3 1600 1 1 25 THR H H 10.561 -6.562 -2.326 1.00 . A A . 25 THR H 1 1 3 1601 1 1 25 THR HA H 12.639 -6.355 -4.350 1.00 . A A . 25 THR HA 1 1 3 1602 1 1 25 THR HB H 13.528 -5.586 -1.627 1.00 . A A . 25 THR HB 1 1 3 1603 1 1 25 THR HG1 H 12.721 -3.598 -1.697 1.00 . A A . 25 THR HG1 1 1 3 1604 1 1 25 THR HG21 H 14.386 -5.172 -4.399 1.00 . A A . 25 THR HG21 1 1 3 1605 1 1 25 THR HG22 H 14.600 -3.788 -3.327 1.00 . A A . 25 THR HG22 1 1 3 1606 1 1 25 THR HG23 H 15.335 -5.340 -2.922 1.00 . A A . 25 THR HG23 1 1 3 1607 1 1 25 THR N N 11.004 -6.166 -3.105 1.00 . A A . 25 THR N 1 1 3 1608 1 1 25 THR O O 12.038 -8.508 -2.264 1.00 . A A . 25 THR O 1 1 3 1609 1 1 25 THR OG1 O 12.429 -4.094 -2.465 1.00 . A A . 25 THR OG1 1 1 3 1610 1 1 26 SER C C 14.979 -9.173 -0.785 1.00 . A A . 26 SER C 1 1 3 1611 1 1 26 SER CA C 14.706 -9.255 -2.283 1.00 . A A . 26 SER CA 1 1 3 1612 1 1 26 SER CB C 15.993 -9.615 -3.028 1.00 . A A . 26 SER CB 1 1 3 1613 1 1 26 SER H H 14.777 -7.334 -3.168 1.00 . A A . 26 SER H 1 1 3 1614 1 1 26 SER HA H 13.971 -10.026 -2.461 1.00 . A A . 26 SER HA 1 1 3 1615 1 1 26 SER HB2 H 16.743 -8.864 -2.829 1.00 . A A . 26 SER HB2 1 1 3 1616 1 1 26 SER HB3 H 16.347 -10.577 -2.687 1.00 . A A . 26 SER HB3 1 1 3 1617 1 1 26 SER HG H 16.244 -10.431 -4.791 1.00 . A A . 26 SER HG 1 1 3 1618 1 1 26 SER N N 14.166 -7.997 -2.784 1.00 . A A . 26 SER N 1 1 3 1619 1 1 26 SER O O 14.875 -10.169 -0.069 1.00 . A A . 26 SER O 1 1 3 1620 1 1 26 SER OG O 15.772 -9.679 -4.427 1.00 . A A . 26 SER OG 1 1 3 1621 1 1 27 VAL C C 14.374 -7.294 1.845 1.00 . A A . 27 VAL C 1 1 3 1622 1 1 27 VAL CA C 15.615 -7.766 1.096 1.00 . A A . 27 VAL CA 1 1 3 1623 1 1 27 VAL CB C 16.742 -6.734 1.292 1.00 . A A . 27 VAL CB 1 1 3 1624 1 1 27 VAL CG1 C 17.164 -6.673 2.752 1.00 . A A . 27 VAL CG1 1 1 3 1625 1 1 27 VAL CG2 C 17.928 -7.064 0.399 1.00 . A A . 27 VAL CG2 1 1 3 1626 1 1 27 VAL H H 15.394 -7.223 -0.937 1.00 . A A . 27 VAL H 1 1 3 1627 1 1 27 VAL HA H 15.940 -8.707 1.516 1.00 . A A . 27 VAL HA 1 1 3 1628 1 1 27 VAL HB H 16.365 -5.762 1.009 1.00 . A A . 27 VAL HB 1 1 3 1629 1 1 27 VAL HG11 H 16.999 -7.635 3.215 1.00 . A A . 27 VAL HG11 1 1 3 1630 1 1 27 VAL HG12 H 18.212 -6.419 2.813 1.00 . A A . 27 VAL HG12 1 1 3 1631 1 1 27 VAL HG13 H 16.580 -5.922 3.264 1.00 . A A . 27 VAL HG13 1 1 3 1632 1 1 27 VAL HG21 H 17.933 -8.121 0.182 1.00 . A A . 27 VAL HG21 1 1 3 1633 1 1 27 VAL HG22 H 17.851 -6.507 -0.523 1.00 . A A . 27 VAL HG22 1 1 3 1634 1 1 27 VAL HG23 H 18.845 -6.796 0.905 1.00 . A A . 27 VAL HG23 1 1 3 1635 1 1 27 VAL N N 15.328 -7.979 -0.317 1.00 . A A . 27 VAL N 1 1 3 1636 1 1 27 VAL O O 14.190 -7.604 3.022 1.00 . A A . 27 VAL O 1 1 3 1637 1 1 28 SER C C 11.141 -6.084 0.762 1.00 . A A . 28 SER C 1 1 3 1638 1 1 28 SER CA C 12.298 -6.025 1.753 1.00 . A A . 28 SER CA 1 1 3 1639 1 1 28 SER CB C 12.505 -4.586 2.229 1.00 . A A . 28 SER CB 1 1 3 1640 1 1 28 SER H H 13.725 -6.327 0.219 1.00 . A A . 28 SER H 1 1 3 1641 1 1 28 SER HA H 12.060 -6.645 2.605 1.00 . A A . 28 SER HA 1 1 3 1642 1 1 28 SER HB2 H 13.396 -4.534 2.836 1.00 . A A . 28 SER HB2 1 1 3 1643 1 1 28 SER HB3 H 12.616 -3.938 1.371 1.00 . A A . 28 SER HB3 1 1 3 1644 1 1 28 SER HG H 11.721 -3.719 3.801 1.00 . A A . 28 SER HG 1 1 3 1645 1 1 28 SER N N 13.524 -6.541 1.154 1.00 . A A . 28 SER N 1 1 3 1646 1 1 28 SER O O 11.351 -6.168 -0.448 1.00 . A A . 28 SER O 1 1 3 1647 1 1 28 SER OG O 11.402 -4.139 2.999 1.00 . A A . 28 SER OG 1 1 3 1648 1 1 29 SER C C 7.475 -5.781 1.258 1.00 . A A . 29 SER C 1 1 3 1649 1 1 29 SER CA C 8.728 -6.088 0.444 1.00 . A A . 29 SER CA 1 1 3 1650 1 1 29 SER CB C 8.598 -7.462 -0.215 1.00 . A A . 29 SER CB 1 1 3 1651 1 1 29 SER H H 9.816 -5.972 2.256 1.00 . A A . 29 SER H 1 1 3 1652 1 1 29 SER HA H 8.835 -5.338 -0.326 1.00 . A A . 29 SER HA 1 1 3 1653 1 1 29 SER HB2 H 8.884 -8.226 0.492 1.00 . A A . 29 SER HB2 1 1 3 1654 1 1 29 SER HB3 H 7.573 -7.618 -0.519 1.00 . A A . 29 SER HB3 1 1 3 1655 1 1 29 SER HG H 9.049 -8.182 -1.980 1.00 . A A . 29 SER HG 1 1 3 1656 1 1 29 SER N N 9.919 -6.039 1.283 1.00 . A A . 29 SER N 1 1 3 1657 1 1 29 SER O O 7.000 -6.620 2.023 1.00 . A A . 29 SER O 1 1 3 1658 1 1 29 SER OG O 9.433 -7.562 -1.356 1.00 . A A . 29 SER OG 1 1 3 1659 1 1 30 HIS C C 4.491 -4.683 1.122 1.00 . A A . 30 HIS C 1 1 3 1660 1 1 30 HIS CA C 5.748 -4.156 1.807 1.00 . A A . 30 HIS CA 1 1 3 1661 1 1 30 HIS CB C 5.690 -2.631 1.902 1.00 . A A . 30 HIS CB 1 1 3 1662 1 1 30 HIS CD2 C 8.152 -2.570 2.717 1.00 . A A . 30 HIS CD2 1 1 3 1663 1 1 30 HIS CE1 C 8.415 -0.394 2.782 1.00 . A A . 30 HIS CE1 1 1 3 1664 1 1 30 HIS CG C 6.984 -2.008 2.324 1.00 . A A . 30 HIS CG 1 1 3 1665 1 1 30 HIS H H 7.371 -3.949 0.464 1.00 . A A . 30 HIS H 1 1 3 1666 1 1 30 HIS HA H 5.800 -4.568 2.804 1.00 . A A . 30 HIS HA 1 1 3 1667 1 1 30 HIS HB2 H 5.428 -2.227 0.935 1.00 . A A . 30 HIS HB2 1 1 3 1668 1 1 30 HIS HB3 H 4.935 -2.350 2.621 1.00 . A A . 30 HIS HB3 1 1 3 1669 1 1 30 HIS HD1 H 6.518 0.040 2.149 1.00 . A A . 30 HIS HD1 1 1 3 1670 1 1 30 HIS HD2 H 8.360 -3.628 2.796 1.00 . A A . 30 HIS HD2 1 1 3 1671 1 1 30 HIS HE1 H 8.850 0.585 2.917 1.00 . A A . 30 HIS HE1 1 1 3 1672 1 1 30 HIS HE2 H 9.972 -1.651 3.219 1.00 . A A . 30 HIS HE2 1 1 3 1673 1 1 30 HIS N N 6.946 -4.574 1.088 1.00 . A A . 30 HIS N 1 1 3 1674 1 1 30 HIS ND1 N 7.182 -0.644 2.376 1.00 . A A . 30 HIS ND1 1 1 3 1675 1 1 30 HIS NE2 N 9.023 -1.546 2.995 1.00 . A A . 30 HIS NE2 1 1 3 1676 1 1 30 HIS O O 4.569 -5.381 0.112 1.00 . A A . 30 HIS O 1 1 3 1677 1 1 31 TYR C C 0.920 -3.886 1.596 1.00 . A A . 31 TYR C 1 1 3 1678 1 1 31 TYR CA C 2.059 -4.783 1.122 1.00 . A A . 31 TYR CA 1 1 3 1679 1 1 31 TYR CB C 1.778 -6.234 1.517 1.00 . A A . 31 TYR CB 1 1 3 1680 1 1 31 TYR CD1 C 3.522 -7.855 0.676 1.00 . A A . 31 TYR CD1 1 1 3 1681 1 1 31 TYR CD2 C 1.527 -7.586 -0.601 1.00 . A A . 31 TYR CD2 1 1 3 1682 1 1 31 TYR CE1 C 3.989 -8.779 -0.240 1.00 . A A . 31 TYR CE1 1 1 3 1683 1 1 31 TYR CE2 C 1.987 -8.509 -1.521 1.00 . A A . 31 TYR CE2 1 1 3 1684 1 1 31 TYR CG C 2.285 -7.244 0.512 1.00 . A A . 31 TYR CG 1 1 3 1685 1 1 31 TYR CZ C 3.218 -9.102 -1.336 1.00 . A A . 31 TYR CZ 1 1 3 1686 1 1 31 TYR H H 3.336 -3.785 2.485 1.00 . A A . 31 TYR H 1 1 3 1687 1 1 31 TYR HA H 2.128 -4.718 0.047 1.00 . A A . 31 TYR HA 1 1 3 1688 1 1 31 TYR HB2 H 2.255 -6.441 2.463 1.00 . A A . 31 TYR HB2 1 1 3 1689 1 1 31 TYR HB3 H 0.712 -6.372 1.618 1.00 . A A . 31 TYR HB3 1 1 3 1690 1 1 31 TYR HD1 H 4.124 -7.600 1.536 1.00 . A A . 31 TYR HD1 1 1 3 1691 1 1 31 TYR HD2 H 0.564 -7.119 -0.743 1.00 . A A . 31 TYR HD2 1 1 3 1692 1 1 31 TYR HE1 H 4.953 -9.243 -0.095 1.00 . A A . 31 TYR HE1 1 1 3 1693 1 1 31 TYR HE2 H 1.382 -8.761 -2.380 1.00 . A A . 31 TYR HE2 1 1 3 1694 1 1 31 TYR HH H 4.003 -9.563 -3.030 1.00 . A A . 31 TYR HH 1 1 3 1695 1 1 31 TYR N N 3.333 -4.344 1.680 1.00 . A A . 31 TYR N 1 1 3 1696 1 1 31 TYR O O 1.057 -3.162 2.583 1.00 . A A . 31 TYR O 1 1 3 1697 1 1 31 TYR OH O 3.679 -10.021 -2.251 1.00 . A A . 31 TYR OH 1 1 3 1698 1 1 32 CYS C C -2.412 -3.977 1.955 1.00 . A A . 32 CYS C 1 1 3 1699 1 1 32 CYS CA C -1.365 -3.133 1.237 1.00 . A A . 32 CYS CA 1 1 3 1700 1 1 32 CYS CB C -1.973 -2.506 -0.018 1.00 . A A . 32 CYS CB 1 1 3 1701 1 1 32 CYS H H -0.253 -4.536 0.113 1.00 . A A . 32 CYS H 1 1 3 1702 1 1 32 CYS HA H -1.037 -2.347 1.900 1.00 . A A . 32 CYS HA 1 1 3 1703 1 1 32 CYS HB2 H -2.063 -3.264 -0.782 1.00 . A A . 32 CYS HB2 1 1 3 1704 1 1 32 CYS HB3 H -2.955 -2.124 0.219 1.00 . A A . 32 CYS HB3 1 1 3 1705 1 1 32 CYS N N -0.203 -3.939 0.888 1.00 . A A . 32 CYS N 1 1 3 1706 1 1 32 CYS O O -2.882 -4.983 1.425 1.00 . A A . 32 CYS O 1 1 3 1707 1 1 32 CYS SG S -0.995 -1.135 -0.713 1.00 . A A . 32 CYS SG 1 1 3 1708 1 1 33 THR C C -5.159 -3.683 3.751 1.00 . A A . 33 THR C 1 1 3 1709 1 1 33 THR CA C -3.768 -4.279 3.951 1.00 . A A . 33 THR CA 1 1 3 1710 1 1 33 THR CB C -3.394 -4.245 5.434 1.00 . A A . 33 THR CB 1 1 3 1711 1 1 33 THR CG2 C -1.930 -4.530 5.688 1.00 . A A . 33 THR CG2 1 1 3 1712 1 1 33 THR H H -2.364 -2.750 3.532 1.00 . A A . 33 THR H 1 1 3 1713 1 1 33 THR HA H -3.778 -5.305 3.615 1.00 . A A . 33 THR HA 1 1 3 1714 1 1 33 THR HB H -3.973 -4.992 5.957 1.00 . A A . 33 THR HB 1 1 3 1715 1 1 33 THR HG1 H -3.103 -2.317 5.622 1.00 . A A . 33 THR HG1 1 1 3 1716 1 1 33 THR HG21 H -1.511 -5.045 4.836 1.00 . A A . 33 THR HG21 1 1 3 1717 1 1 33 THR HG22 H -1.403 -3.600 5.841 1.00 . A A . 33 THR HG22 1 1 3 1718 1 1 33 THR HG23 H -1.831 -5.149 6.567 1.00 . A A . 33 THR HG23 1 1 3 1719 1 1 33 THR N N -2.774 -3.560 3.163 1.00 . A A . 33 THR N 1 1 3 1720 1 1 33 THR O O -6.046 -3.863 4.584 1.00 . A A . 33 THR O 1 1 3 1721 1 1 33 THR OG1 O -3.689 -2.978 5.996 1.00 . A A . 33 THR OG1 1 1 3 1722 1 1 34 GLY C C -7.180 -1.567 3.523 1.00 . A A . 34 GLY C 1 1 3 1723 1 1 34 GLY CA C -6.630 -2.361 2.352 1.00 . A A . 34 GLY CA 1 1 3 1724 1 1 34 GLY H H -4.600 -2.861 2.009 1.00 . A A . 34 GLY H 1 1 3 1725 1 1 34 GLY HA2 H -7.335 -3.139 2.098 1.00 . A A . 34 GLY HA2 1 1 3 1726 1 1 34 GLY HA3 H -6.521 -1.701 1.505 1.00 . A A . 34 GLY HA3 1 1 3 1727 1 1 34 GLY N N -5.343 -2.972 2.640 1.00 . A A . 34 GLY N 1 1 3 1728 1 1 34 GLY O O -8.393 -1.403 3.655 1.00 . A A . 34 GLY O 1 1 3 1729 1 1 35 ARG C C -6.078 1.099 5.506 1.00 . A A . 35 ARG C 1 1 3 1730 1 1 35 ARG CA C -6.691 -0.297 5.542 1.00 . A A . 35 ARG CA 1 1 3 1731 1 1 35 ARG CB C -6.278 -1.014 6.829 1.00 . A A . 35 ARG CB 1 1 3 1732 1 1 35 ARG CD C -7.199 -2.255 8.810 1.00 . A A . 35 ARG CD 1 1 3 1733 1 1 35 ARG CG C -7.296 -2.035 7.310 1.00 . A A . 35 ARG CG 1 1 3 1734 1 1 35 ARG CZ C -8.732 -2.470 10.728 1.00 . A A . 35 ARG CZ 1 1 3 1735 1 1 35 ARG H H -5.333 -1.241 4.219 1.00 . A A . 35 ARG H 1 1 3 1736 1 1 35 ARG HA H -7.764 -0.204 5.521 1.00 . A A . 35 ARG HA 1 1 3 1737 1 1 35 ARG HB2 H -5.341 -1.524 6.659 1.00 . A A . 35 ARG HB2 1 1 3 1738 1 1 35 ARG HB3 H -6.141 -0.279 7.609 1.00 . A A . 35 ARG HB3 1 1 3 1739 1 1 35 ARG HD2 H -6.569 -3.112 8.996 1.00 . A A . 35 ARG HD2 1 1 3 1740 1 1 35 ARG HD3 H -6.755 -1.379 9.261 1.00 . A A . 35 ARG HD3 1 1 3 1741 1 1 35 ARG HE H -9.259 -2.669 8.813 1.00 . A A . 35 ARG HE 1 1 3 1742 1 1 35 ARG HG2 H -8.288 -1.680 7.072 1.00 . A A . 35 ARG HG2 1 1 3 1743 1 1 35 ARG HG3 H -7.117 -2.973 6.805 1.00 . A A . 35 ARG HG3 1 1 3 1744 1 1 35 ARG HH11 H -6.816 -2.060 11.229 1.00 . A A . 35 ARG HH11 1 1 3 1745 1 1 35 ARG HH12 H -7.914 -2.217 12.559 1.00 . A A . 35 ARG HH12 1 1 3 1746 1 1 35 ARG HH21 H -10.705 -2.875 10.561 1.00 . A A . 35 ARG HH21 1 1 3 1747 1 1 35 ARG HH22 H -10.122 -2.679 12.180 1.00 . A A . 35 ARG HH22 1 1 3 1748 1 1 35 ARG N N -6.286 -1.076 4.377 1.00 . A A . 35 ARG N 1 1 3 1749 1 1 35 ARG NE N -8.508 -2.489 9.416 1.00 . A A . 35 ARG NE 1 1 3 1750 1 1 35 ARG NH1 N -7.739 -2.229 11.574 1.00 . A A . 35 ARG NH1 1 1 3 1751 1 1 35 ARG NH2 N -9.953 -2.693 11.194 1.00 . A A . 35 ARG NH2 1 1 3 1752 1 1 35 ARG O O -6.740 2.088 5.821 1.00 . A A . 35 ARG O 1 1 3 1753 1 1 36 SER C C -3.214 2.490 3.800 1.00 . A A . 36 SER C 1 1 3 1754 1 1 36 SER CA C -4.104 2.442 5.037 1.00 . A A . 36 SER CA 1 1 3 1755 1 1 36 SER CB C -3.262 2.662 6.295 1.00 . A A . 36 SER CB 1 1 3 1756 1 1 36 SER H H -4.340 0.345 4.879 1.00 . A A . 36 SER H 1 1 3 1757 1 1 36 SER HA H -4.842 3.227 4.967 1.00 . A A . 36 SER HA 1 1 3 1758 1 1 36 SER HB2 H -2.921 1.707 6.668 1.00 . A A . 36 SER HB2 1 1 3 1759 1 1 36 SER HB3 H -2.409 3.278 6.051 1.00 . A A . 36 SER HB3 1 1 3 1760 1 1 36 SER HG H -4.073 4.244 7.118 1.00 . A A . 36 SER HG 1 1 3 1761 1 1 36 SER N N -4.811 1.169 5.118 1.00 . A A . 36 SER N 1 1 3 1762 1 1 36 SER O O -2.648 1.476 3.392 1.00 . A A . 36 SER O 1 1 3 1763 1 1 36 SER OG O -4.015 3.304 7.309 1.00 . A A . 36 SER OG 1 1 3 1764 1 1 37 CYS C C -0.785 3.768 2.366 1.00 . A A . 37 CYS C 1 1 3 1765 1 1 37 CYS CA C -2.269 3.850 2.019 1.00 . A A . 37 CYS CA 1 1 3 1766 1 1 37 CYS CB C -2.577 5.192 1.353 1.00 . A A . 37 CYS CB 1 1 3 1767 1 1 37 CYS H H -3.567 4.447 3.581 1.00 . A A . 37 CYS H 1 1 3 1768 1 1 37 CYS HA H -2.509 3.054 1.330 1.00 . A A . 37 CYS HA 1 1 3 1769 1 1 37 CYS HB2 H -3.581 5.492 1.613 1.00 . A A . 37 CYS HB2 1 1 3 1770 1 1 37 CYS HB3 H -1.880 5.934 1.715 1.00 . A A . 37 CYS HB3 1 1 3 1771 1 1 37 CYS N N -3.093 3.674 3.208 1.00 . A A . 37 CYS N 1 1 3 1772 1 1 37 CYS O O 0.052 3.517 1.499 1.00 . A A . 37 CYS O 1 1 3 1773 1 1 37 CYS SG S -2.462 5.164 -0.466 1.00 . A A . 37 CYS SG 1 1 3 1774 1 1 38 GLU C C 1.412 2.486 4.168 1.00 . A A . 38 GLU C 1 1 3 1775 1 1 38 GLU CA C 0.920 3.928 4.096 1.00 . A A . 38 GLU CA 1 1 3 1776 1 1 38 GLU CB C 1.053 4.594 5.467 1.00 . A A . 38 GLU CB 1 1 3 1777 1 1 38 GLU CD C 2.642 6.458 4.850 1.00 . A A . 38 GLU CD 1 1 3 1778 1 1 38 GLU CG C 2.414 5.227 5.706 1.00 . A A . 38 GLU CG 1 1 3 1779 1 1 38 GLU H H -1.173 4.176 4.286 1.00 . A A . 38 GLU H 1 1 3 1780 1 1 38 GLU HA H 1.525 4.468 3.383 1.00 . A A . 38 GLU HA 1 1 3 1781 1 1 38 GLU HB2 H 0.301 5.364 5.554 1.00 . A A . 38 GLU HB2 1 1 3 1782 1 1 38 GLU HB3 H 0.886 3.851 6.232 1.00 . A A . 38 GLU HB3 1 1 3 1783 1 1 38 GLU HG2 H 2.486 5.512 6.745 1.00 . A A . 38 GLU HG2 1 1 3 1784 1 1 38 GLU HG3 H 3.180 4.500 5.478 1.00 . A A . 38 GLU HG3 1 1 3 1785 1 1 38 GLU N N -0.464 3.981 3.639 1.00 . A A . 38 GLU N 1 1 3 1786 1 1 38 GLU O O 1.263 1.819 5.191 1.00 . A A . 38 GLU O 1 1 3 1787 1 1 38 GLU OE1 O 3.809 6.723 4.491 1.00 . A A . 38 GLU OE1 1 1 3 1788 1 1 38 GLU OE2 O 1.655 7.156 4.539 1.00 . A A . 38 GLU OE2 1 1 3 1789 1 1 39 CYS C C 3.511 0.384 4.137 1.00 . A A . 39 CYS C 1 1 3 1790 1 1 39 CYS CA C 2.513 0.647 3.009 1.00 . A A . 39 CYS CA 1 1 3 1791 1 1 39 CYS CB C 3.181 0.398 1.655 1.00 . A A . 39 CYS CB 1 1 3 1792 1 1 39 CYS H H 2.087 2.592 2.288 1.00 . A A . 39 CYS H 1 1 3 1793 1 1 39 CYS HA H 1.677 -0.027 3.115 1.00 . A A . 39 CYS HA 1 1 3 1794 1 1 39 CYS HB2 H 3.554 1.334 1.268 1.00 . A A . 39 CYS HB2 1 1 3 1795 1 1 39 CYS HB3 H 4.008 -0.284 1.790 1.00 . A A . 39 CYS HB3 1 1 3 1796 1 1 39 CYS N N 1.999 2.011 3.073 1.00 . A A . 39 CYS N 1 1 3 1797 1 1 39 CYS O O 4.625 0.908 4.123 1.00 . A A . 39 CYS O 1 1 3 1798 1 1 39 CYS SG S 2.072 -0.317 0.399 1.00 . A A . 39 CYS SG 1 1 3 1799 1 1 40 PRO C C 5.366 -1.265 5.819 1.00 . A A . 40 PRO C 1 1 3 1800 1 1 40 PRO CA C 3.999 -0.759 6.268 1.00 . A A . 40 PRO CA 1 1 3 1801 1 1 40 PRO CB C 3.236 -1.863 7.003 1.00 . A A . 40 PRO CB 1 1 3 1802 1 1 40 PRO CD C 1.817 -1.107 5.237 1.00 . A A . 40 PRO CD 1 1 3 1803 1 1 40 PRO CG C 1.809 -1.643 6.642 1.00 . A A . 40 PRO CG 1 1 3 1804 1 1 40 PRO HA H 4.129 0.091 6.922 1.00 . A A . 40 PRO HA 1 1 3 1805 1 1 40 PRO HB2 H 3.585 -2.829 6.669 1.00 . A A . 40 PRO HB2 1 1 3 1806 1 1 40 PRO HB3 H 3.393 -1.765 8.067 1.00 . A A . 40 PRO HB3 1 1 3 1807 1 1 40 PRO HD2 H 1.741 -1.915 4.525 1.00 . A A . 40 PRO HD2 1 1 3 1808 1 1 40 PRO HD3 H 1.010 -0.402 5.097 1.00 . A A . 40 PRO HD3 1 1 3 1809 1 1 40 PRO HG2 H 1.271 -2.578 6.683 1.00 . A A . 40 PRO HG2 1 1 3 1810 1 1 40 PRO HG3 H 1.366 -0.923 7.314 1.00 . A A . 40 PRO HG3 1 1 3 1811 1 1 40 PRO N N 3.126 -0.435 5.135 1.00 . A A . 40 PRO N 1 1 3 1812 1 1 40 PRO O O 5.585 -1.524 4.636 1.00 . A A . 40 PRO O 1 1 3 1813 1 1 41 SER C C 7.889 -3.226 7.142 1.00 . A A . 41 SER C 1 1 3 1814 1 1 41 SER CA C 7.629 -1.878 6.476 1.00 . A A . 41 SER CA 1 1 3 1815 1 1 41 SER CB C 8.667 -0.855 6.941 1.00 . A A . 41 SER CB 1 1 3 1816 1 1 41 SER H H 6.047 -1.180 7.697 1.00 . A A . 41 SER H 1 1 3 1817 1 1 41 SER HA H 7.709 -1.999 5.405 1.00 . A A . 41 SER HA 1 1 3 1818 1 1 41 SER HB2 H 8.415 0.117 6.543 1.00 . A A . 41 SER HB2 1 1 3 1819 1 1 41 SER HB3 H 8.670 -0.813 8.020 1.00 . A A . 41 SER HB3 1 1 3 1820 1 1 41 SER HG H 10.546 -1.314 7.251 1.00 . A A . 41 SER HG 1 1 3 1821 1 1 41 SER N N 6.282 -1.403 6.772 1.00 . A A . 41 SER N 1 1 3 1822 1 1 41 SER O O 8.672 -3.324 8.087 1.00 . A A . 41 SER O 1 1 3 1823 1 1 41 SER OG O 9.965 -1.207 6.494 1.00 . A A . 41 SER OG 1 1 3 1824 1 1 42 TYR C C 7.875 -6.577 6.117 1.00 . A A . 42 TYR C 1 1 3 1825 1 1 42 TYR CA C 7.383 -5.607 7.189 1.00 . A A . 42 TYR CA 1 1 3 1826 1 1 42 TYR CB C 6.058 -6.102 7.772 1.00 . A A . 42 TYR CB 1 1 3 1827 1 1 42 TYR CD1 C 6.491 -5.110 10.053 1.00 . A A . 42 TYR CD1 1 1 3 1828 1 1 42 TYR CD2 C 4.318 -4.854 9.108 1.00 . A A . 42 TYR CD2 1 1 3 1829 1 1 42 TYR CE1 C 6.089 -4.416 11.178 1.00 . A A . 42 TYR CE1 1 1 3 1830 1 1 42 TYR CE2 C 3.908 -4.157 10.230 1.00 . A A . 42 TYR CE2 1 1 3 1831 1 1 42 TYR CG C 5.614 -5.341 9.001 1.00 . A A . 42 TYR CG 1 1 3 1832 1 1 42 TYR CZ C 4.797 -3.941 11.261 1.00 . A A . 42 TYR CZ 1 1 3 1833 1 1 42 TYR H H 6.615 -4.124 5.889 1.00 . A A . 42 TYR H 1 1 3 1834 1 1 42 TYR HA H 8.118 -5.560 7.979 1.00 . A A . 42 TYR HA 1 1 3 1835 1 1 42 TYR HB2 H 5.285 -6.004 7.024 1.00 . A A . 42 TYR HB2 1 1 3 1836 1 1 42 TYR HB3 H 6.159 -7.143 8.043 1.00 . A A . 42 TYR HB3 1 1 3 1837 1 1 42 TYR HD1 H 7.503 -5.483 9.984 1.00 . A A . 42 TYR HD1 1 1 3 1838 1 1 42 TYR HD2 H 3.623 -5.025 8.299 1.00 . A A . 42 TYR HD2 1 1 3 1839 1 1 42 TYR HE1 H 6.786 -4.246 11.985 1.00 . A A . 42 TYR HE1 1 1 3 1840 1 1 42 TYR HE2 H 2.896 -3.786 10.295 1.00 . A A . 42 TYR HE2 1 1 3 1841 1 1 42 TYR HH H 4.141 -3.869 13.067 1.00 . A A . 42 TYR HH 1 1 3 1842 1 1 42 TYR N N 7.225 -4.264 6.643 1.00 . A A . 42 TYR N 1 1 3 1843 1 1 42 TYR O O 7.076 -7.232 5.447 1.00 . A A . 42 TYR O 1 1 3 1844 1 1 42 TYR OH O 4.393 -3.249 12.379 1.00 . A A . 42 TYR OH 1 1 3 1845 1 1 43 PRO C C 9.277 -9.006 5.063 1.00 . A A . 43 PRO C 1 1 3 1846 1 1 43 PRO CA C 9.799 -7.578 4.943 1.00 . A A . 43 PRO CA 1 1 3 1847 1 1 43 PRO CB C 11.294 -7.526 5.266 1.00 . A A . 43 PRO CB 1 1 3 1848 1 1 43 PRO CD C 10.227 -5.937 6.697 1.00 . A A . 43 PRO CD 1 1 3 1849 1 1 43 PRO CG C 11.493 -6.209 5.932 1.00 . A A . 43 PRO CG 1 1 3 1850 1 1 43 PRO HA H 9.632 -7.218 3.939 1.00 . A A . 43 PRO HA 1 1 3 1851 1 1 43 PRO HB2 H 11.552 -8.345 5.922 1.00 . A A . 43 PRO HB2 1 1 3 1852 1 1 43 PRO HB3 H 11.865 -7.596 4.352 1.00 . A A . 43 PRO HB3 1 1 3 1853 1 1 43 PRO HD2 H 10.309 -6.312 7.707 1.00 . A A . 43 PRO HD2 1 1 3 1854 1 1 43 PRO HD3 H 10.009 -4.880 6.702 1.00 . A A . 43 PRO HD3 1 1 3 1855 1 1 43 PRO HG2 H 12.335 -6.262 6.606 1.00 . A A . 43 PRO HG2 1 1 3 1856 1 1 43 PRO HG3 H 11.653 -5.442 5.189 1.00 . A A . 43 PRO HG3 1 1 3 1857 1 1 43 PRO N N 9.203 -6.682 5.940 1.00 . A A . 43 PRO N 1 1 3 1858 1 1 43 PRO O O 9.492 -9.673 6.075 1.00 . A A . 43 PRO O 1 1 3 1859 1 1 44 GLY C C 8.073 -11.459 2.660 1.00 . A A . 44 GLY C 1 1 3 1860 1 1 44 GLY CA C 8.049 -10.815 4.032 1.00 . A A . 44 GLY CA 1 1 3 1861 1 1 44 GLY H H 8.451 -8.891 3.244 1.00 . A A . 44 GLY H 1 1 3 1862 1 1 44 GLY HA2 H 7.028 -10.778 4.383 1.00 . A A . 44 GLY HA2 1 1 3 1863 1 1 44 GLY HA3 H 8.630 -11.420 4.712 1.00 . A A . 44 GLY HA3 1 1 3 1864 1 1 44 GLY N N 8.591 -9.468 4.023 1.00 . A A . 44 GLY N 1 1 3 1865 1 1 44 GLY O O 9.030 -11.201 1.900 1.00 . A A . 44 GLY O 1 1 3 1866 1 1 44 GLY OXT O 7.135 -12.221 2.346 1.00 . A A . 44 GLY OXT 1 1 4 1867 1 1 1 ALA C C -14.781 9.830 3.812 1.00 . A A . 1 ALA C 1 1 4 1868 1 1 1 ALA CA C -14.455 9.415 5.243 1.00 . A A . 1 ALA CA 1 1 4 1869 1 1 1 ALA CB C -13.654 8.122 5.248 1.00 . A A . 1 ALA CB 1 1 4 1870 1 1 1 ALA H1 H -16.320 10.056 5.827 1.00 . A A . 1 ALA H1 1 1 4 1871 1 1 1 ALA H2 H -16.131 8.351 5.781 1.00 . A A . 1 ALA H2 1 1 4 1872 1 1 1 ALA H3 H -15.422 9.262 7.052 1.00 . A A . 1 ALA H3 1 1 4 1873 1 1 1 ALA HA H -13.849 10.185 5.699 1.00 . A A . 1 ALA HA 1 1 4 1874 1 1 1 ALA HB1 H -14.268 7.317 4.870 1.00 . A A . 1 ALA HB1 1 1 4 1875 1 1 1 ALA HB2 H -13.344 7.894 6.257 1.00 . A A . 1 ALA HB2 1 1 4 1876 1 1 1 ALA HB3 H -12.783 8.235 4.620 1.00 . A A . 1 ALA HB3 1 1 4 1877 1 1 1 ALA N N -15.693 9.257 6.048 1.00 . A A . 1 ALA N 1 1 4 1878 1 1 1 ALA O O -15.617 9.213 3.152 1.00 . A A . 1 ALA O 1 1 4 1879 1 1 2 MET C C -13.014 11.754 1.324 1.00 . A A . 2 MET C 1 1 4 1880 1 1 2 MET CA C -14.335 11.375 1.986 1.00 . A A . 2 MET CA 1 1 4 1881 1 1 2 MET CB C -15.272 12.584 2.010 1.00 . A A . 2 MET CB 1 1 4 1882 1 1 2 MET CE C -19.235 12.237 3.115 1.00 . A A . 2 MET CE 1 1 4 1883 1 1 2 MET CG C -16.743 12.216 1.902 1.00 . A A . 2 MET CG 1 1 4 1884 1 1 2 MET H H -13.462 11.329 3.913 1.00 . A A . 2 MET H 1 1 4 1885 1 1 2 MET HA H -14.797 10.585 1.413 1.00 . A A . 2 MET HA 1 1 4 1886 1 1 2 MET HB2 H -15.125 13.121 2.935 1.00 . A A . 2 MET HB2 1 1 4 1887 1 1 2 MET HB3 H -15.025 13.233 1.183 1.00 . A A . 2 MET HB3 1 1 4 1888 1 1 2 MET HE1 H -19.347 11.594 2.255 1.00 . A A . 2 MET HE1 1 1 4 1889 1 1 2 MET HE2 H -19.103 11.632 4.001 1.00 . A A . 2 MET HE2 1 1 4 1890 1 1 2 MET HE3 H -20.117 12.849 3.225 1.00 . A A . 2 MET HE3 1 1 4 1891 1 1 2 MET HG2 H -17.045 12.292 0.868 1.00 . A A . 2 MET HG2 1 1 4 1892 1 1 2 MET HG3 H -16.870 11.197 2.238 1.00 . A A . 2 MET HG3 1 1 4 1893 1 1 2 MET N N -14.116 10.878 3.339 1.00 . A A . 2 MET N 1 1 4 1894 1 1 2 MET O O -12.960 12.670 0.504 1.00 . A A . 2 MET O 1 1 4 1895 1 1 2 MET SD S -17.802 13.288 2.892 1.00 . A A . 2 MET SD 1 1 4 1896 1 1 3 ASP C C -10.263 10.257 0.084 1.00 . A A . 3 ASP C 1 1 4 1897 1 1 3 ASP CA C -10.630 11.306 1.129 1.00 . A A . 3 ASP CA 1 1 4 1898 1 1 3 ASP CB C -9.578 11.325 2.240 1.00 . A A . 3 ASP CB 1 1 4 1899 1 1 3 ASP CG C -8.359 12.146 1.868 1.00 . A A . 3 ASP CG 1 1 4 1900 1 1 3 ASP H H -12.058 10.326 2.346 1.00 . A A . 3 ASP H 1 1 4 1901 1 1 3 ASP HA H -10.657 12.275 0.655 1.00 . A A . 3 ASP HA 1 1 4 1902 1 1 3 ASP HB2 H -10.014 11.746 3.133 1.00 . A A . 3 ASP HB2 1 1 4 1903 1 1 3 ASP HB3 H -9.260 10.313 2.443 1.00 . A A . 3 ASP HB3 1 1 4 1904 1 1 3 ASP N N -11.951 11.044 1.688 1.00 . A A . 3 ASP N 1 1 4 1905 1 1 3 ASP O O -10.894 9.203 0.000 1.00 . A A . 3 ASP O 1 1 4 1906 1 1 3 ASP OD1 O -8.491 13.383 1.749 1.00 . A A . 3 ASP OD1 1 1 4 1907 1 1 3 ASP OD2 O -7.273 11.554 1.697 1.00 . A A . 3 ASP OD2 1 1 4 1908 1 1 4 CYS C C -7.529 8.891 -1.310 1.00 . A A . 4 CYS C 1 1 4 1909 1 1 4 CYS CA C -8.790 9.636 -1.751 1.00 . A A . 4 CYS CA 1 1 4 1910 1 1 4 CYS CB C -8.558 10.403 -3.066 1.00 . A A . 4 CYS CB 1 1 4 1911 1 1 4 CYS H H -8.777 11.409 -0.596 1.00 . A A . 4 CYS H 1 1 4 1912 1 1 4 CYS HA H -9.576 8.911 -1.908 1.00 . A A . 4 CYS HA 1 1 4 1913 1 1 4 CYS HB2 H -9.063 9.884 -3.865 1.00 . A A . 4 CYS HB2 1 1 4 1914 1 1 4 CYS HB3 H -8.984 11.392 -2.969 1.00 . A A . 4 CYS HB3 1 1 4 1915 1 1 4 CYS N N -9.240 10.553 -0.711 1.00 . A A . 4 CYS N 1 1 4 1916 1 1 4 CYS O O -7.262 7.780 -1.767 1.00 . A A . 4 CYS O 1 1 4 1917 1 1 4 CYS SG S -6.812 10.602 -3.564 1.00 . A A . 4 CYS SG 1 1 4 1918 1 1 5 THR C C -4.495 8.769 -1.024 1.00 . A A . 5 THR C 1 1 4 1919 1 1 5 THR CA C -5.532 8.903 0.086 1.00 . A A . 5 THR CA 1 1 4 1920 1 1 5 THR CB C -5.825 7.530 0.696 1.00 . A A . 5 THR CB 1 1 4 1921 1 1 5 THR CG2 C -5.005 7.238 1.934 1.00 . A A . 5 THR CG2 1 1 4 1922 1 1 5 THR H H -7.026 10.393 -0.087 1.00 . A A . 5 THR H 1 1 4 1923 1 1 5 THR HA H -5.135 9.549 0.855 1.00 . A A . 5 THR HA 1 1 4 1924 1 1 5 THR HB H -5.602 6.767 -0.036 1.00 . A A . 5 THR HB 1 1 4 1925 1 1 5 THR HG1 H -7.382 6.519 1.320 1.00 . A A . 5 THR HG1 1 1 4 1926 1 1 5 THR HG21 H -4.032 7.695 1.837 1.00 . A A . 5 THR HG21 1 1 4 1927 1 1 5 THR HG22 H -5.507 7.641 2.801 1.00 . A A . 5 THR HG22 1 1 4 1928 1 1 5 THR HG23 H -4.892 6.170 2.047 1.00 . A A . 5 THR HG23 1 1 4 1929 1 1 5 THR N N -6.760 9.510 -0.417 1.00 . A A . 5 THR N 1 1 4 1930 1 1 5 THR O O -4.617 7.914 -1.902 1.00 . A A . 5 THR O 1 1 4 1931 1 1 5 THR OG1 O -7.192 7.421 1.050 1.00 . A A . 5 THR OG1 1 1 4 1932 1 1 6 THR C C -1.134 8.998 -1.401 1.00 . A A . 6 THR C 1 1 4 1933 1 1 6 THR CA C -2.413 9.594 -1.980 1.00 . A A . 6 THR CA 1 1 4 1934 1 1 6 THR CB C -2.142 11.007 -2.500 1.00 . A A . 6 THR CB 1 1 4 1935 1 1 6 THR CG2 C -2.958 11.360 -3.725 1.00 . A A . 6 THR CG2 1 1 4 1936 1 1 6 THR H H -3.431 10.276 -0.254 1.00 . A A . 6 THR H 1 1 4 1937 1 1 6 THR HA H -2.745 8.976 -2.800 1.00 . A A . 6 THR HA 1 1 4 1938 1 1 6 THR HB H -1.097 11.088 -2.765 1.00 . A A . 6 THR HB 1 1 4 1939 1 1 6 THR HG1 H -1.893 12.756 -1.656 1.00 . A A . 6 THR HG1 1 1 4 1940 1 1 6 THR HG21 H -3.063 10.487 -4.352 1.00 . A A . 6 THR HG21 1 1 4 1941 1 1 6 THR HG22 H -3.935 11.704 -3.419 1.00 . A A . 6 THR HG22 1 1 4 1942 1 1 6 THR HG23 H -2.458 12.142 -4.277 1.00 . A A . 6 THR HG23 1 1 4 1943 1 1 6 THR N N -3.473 9.618 -0.979 1.00 . A A . 6 THR N 1 1 4 1944 1 1 6 THR O O -0.843 9.161 -0.216 1.00 . A A . 6 THR O 1 1 4 1945 1 1 6 THR OG1 O -2.424 11.971 -1.502 1.00 . A A . 6 THR OG1 1 1 4 1946 1 1 7 GLY C C 1.231 6.461 -2.599 1.00 . A A . 7 GLY C 1 1 4 1947 1 1 7 GLY CA C 0.862 7.694 -1.794 1.00 . A A . 7 GLY CA 1 1 4 1948 1 1 7 GLY H H -0.657 8.206 -3.177 1.00 . A A . 7 GLY H 1 1 4 1949 1 1 7 GLY HA2 H 0.756 7.414 -0.756 1.00 . A A . 7 GLY HA2 1 1 4 1950 1 1 7 GLY HA3 H 1.660 8.417 -1.879 1.00 . A A . 7 GLY HA3 1 1 4 1951 1 1 7 GLY N N -0.374 8.305 -2.244 1.00 . A A . 7 GLY N 1 1 4 1952 1 1 7 GLY O O 0.835 6.334 -3.758 1.00 . A A . 7 GLY O 1 1 4 1953 1 1 8 PRO C C 1.313 3.256 -2.760 1.00 . A A . 8 PRO C 1 1 4 1954 1 1 8 PRO CA C 2.421 4.303 -2.689 1.00 . A A . 8 PRO CA 1 1 4 1955 1 1 8 PRO CB C 3.572 3.804 -1.817 1.00 . A A . 8 PRO CB 1 1 4 1956 1 1 8 PRO CD C 2.522 5.604 -0.629 1.00 . A A . 8 PRO CD 1 1 4 1957 1 1 8 PRO CG C 3.249 4.296 -0.449 1.00 . A A . 8 PRO CG 1 1 4 1958 1 1 8 PRO HA H 2.784 4.509 -3.685 1.00 . A A . 8 PRO HA 1 1 4 1959 1 1 8 PRO HB2 H 3.611 2.724 -1.851 1.00 . A A . 8 PRO HB2 1 1 4 1960 1 1 8 PRO HB3 H 4.504 4.215 -2.174 1.00 . A A . 8 PRO HB3 1 1 4 1961 1 1 8 PRO HD2 H 1.715 5.687 0.084 1.00 . A A . 8 PRO HD2 1 1 4 1962 1 1 8 PRO HD3 H 3.207 6.433 -0.522 1.00 . A A . 8 PRO HD3 1 1 4 1963 1 1 8 PRO HG2 H 2.616 3.583 0.058 1.00 . A A . 8 PRO HG2 1 1 4 1964 1 1 8 PRO HG3 H 4.161 4.450 0.109 1.00 . A A . 8 PRO HG3 1 1 4 1965 1 1 8 PRO N N 1.999 5.529 -2.008 1.00 . A A . 8 PRO N 1 1 4 1966 1 1 8 PRO O O 1.088 2.648 -3.806 1.00 . A A . 8 PRO O 1 1 4 1967 1 1 9 CYS C C -1.809 2.723 -1.827 1.00 . A A . 9 CYS C 1 1 4 1968 1 1 9 CYS CA C -0.453 2.066 -1.581 1.00 . A A . 9 CYS CA 1 1 4 1969 1 1 9 CYS CB C -0.452 1.360 -0.224 1.00 . A A . 9 CYS CB 1 1 4 1970 1 1 9 CYS H H 0.853 3.558 -0.837 1.00 . A A . 9 CYS H 1 1 4 1971 1 1 9 CYS HA H -0.277 1.334 -2.355 1.00 . A A . 9 CYS HA 1 1 4 1972 1 1 9 CYS HB2 H 0.556 1.341 0.162 1.00 . A A . 9 CYS HB2 1 1 4 1973 1 1 9 CYS HB3 H -1.082 1.910 0.460 1.00 . A A . 9 CYS HB3 1 1 4 1974 1 1 9 CYS N N 0.626 3.046 -1.641 1.00 . A A . 9 CYS N 1 1 4 1975 1 1 9 CYS O O -2.724 2.612 -1.011 1.00 . A A . 9 CYS O 1 1 4 1976 1 1 9 CYS SG S -1.056 -0.357 -0.278 1.00 . A A . 9 CYS SG 1 1 4 1977 1 1 10 CYS C C -3.502 3.876 -4.792 1.00 . A A . 10 CYS C 1 1 4 1978 1 1 10 CYS CA C -3.174 4.081 -3.317 1.00 . A A . 10 CYS CA 1 1 4 1979 1 1 10 CYS CB C -3.079 5.579 -3.016 1.00 . A A . 10 CYS CB 1 1 4 1980 1 1 10 CYS H H -1.166 3.458 -3.569 1.00 . A A . 10 CYS H 1 1 4 1981 1 1 10 CYS HA H -3.966 3.653 -2.721 1.00 . A A . 10 CYS HA 1 1 4 1982 1 1 10 CYS HB2 H -2.602 6.075 -3.847 1.00 . A A . 10 CYS HB2 1 1 4 1983 1 1 10 CYS HB3 H -4.077 5.976 -2.893 1.00 . A A . 10 CYS HB3 1 1 4 1984 1 1 10 CYS N N -1.930 3.407 -2.960 1.00 . A A . 10 CYS N 1 1 4 1985 1 1 10 CYS O O -2.836 4.427 -5.668 1.00 . A A . 10 CYS O 1 1 4 1986 1 1 10 CYS SG S -2.132 5.986 -1.514 1.00 . A A . 10 CYS SG 1 1 4 1987 1 1 11 ARG C C -5.643 4.042 -7.027 1.00 . A A . 11 ARG C 1 1 4 1988 1 1 11 ARG CA C -4.955 2.819 -6.431 1.00 . A A . 11 ARG CA 1 1 4 1989 1 1 11 ARG CB C -5.898 1.615 -6.475 1.00 . A A . 11 ARG CB 1 1 4 1990 1 1 11 ARG CD C -7.022 -0.157 -7.857 1.00 . A A . 11 ARG CD 1 1 4 1991 1 1 11 ARG CG C -6.074 1.031 -7.867 1.00 . A A . 11 ARG CG 1 1 4 1992 1 1 11 ARG CZ C -7.423 -0.527 -10.260 1.00 . A A . 11 ARG CZ 1 1 4 1993 1 1 11 ARG H H -5.033 2.679 -4.320 1.00 . A A . 11 ARG H 1 1 4 1994 1 1 11 ARG HA H -4.072 2.597 -7.011 1.00 . A A . 11 ARG HA 1 1 4 1995 1 1 11 ARG HB2 H -5.506 0.842 -5.831 1.00 . A A . 11 ARG HB2 1 1 4 1996 1 1 11 ARG HB3 H -6.868 1.919 -6.110 1.00 . A A . 11 ARG HB3 1 1 4 1997 1 1 11 ARG HD2 H -6.771 -0.795 -7.022 1.00 . A A . 11 ARG HD2 1 1 4 1998 1 1 11 ARG HD3 H -8.033 0.206 -7.740 1.00 . A A . 11 ARG HD3 1 1 4 1999 1 1 11 ARG HE H -6.495 -1.810 -9.044 1.00 . A A . 11 ARG HE 1 1 4 2000 1 1 11 ARG HG2 H -6.475 1.793 -8.519 1.00 . A A . 11 ARG HG2 1 1 4 2001 1 1 11 ARG HG3 H -5.111 0.709 -8.236 1.00 . A A . 11 ARG HG3 1 1 4 2002 1 1 11 ARG HH11 H -8.122 1.235 -9.555 1.00 . A A . 11 ARG HH11 1 1 4 2003 1 1 11 ARG HH12 H -8.391 0.951 -11.242 1.00 . A A . 11 ARG HH12 1 1 4 2004 1 1 11 ARG HH21 H -6.848 -2.185 -11.262 1.00 . A A . 11 ARG HH21 1 1 4 2005 1 1 11 ARG HH22 H -7.668 -0.991 -12.211 1.00 . A A . 11 ARG HH22 1 1 4 2006 1 1 11 ARG N N -4.537 3.086 -5.060 1.00 . A A . 11 ARG N 1 1 4 2007 1 1 11 ARG NE N -6.937 -0.936 -9.090 1.00 . A A . 11 ARG NE 1 1 4 2008 1 1 11 ARG NH1 N -8.028 0.649 -10.360 1.00 . A A . 11 ARG NH1 1 1 4 2009 1 1 11 ARG NH2 N -7.303 -1.298 -11.332 1.00 . A A . 11 ARG NH2 1 1 4 2010 1 1 11 ARG O O -6.823 4.285 -6.778 1.00 . A A . 11 ARG O 1 1 4 2011 1 1 12 GLN C C -5.663 7.108 -7.393 1.00 . A A . 12 GLN C 1 1 4 2012 1 1 12 GLN CA C -5.429 6.021 -8.436 1.00 . A A . 12 GLN CA 1 1 4 2013 1 1 12 GLN CB C -6.735 5.713 -9.174 1.00 . A A . 12 GLN CB 1 1 4 2014 1 1 12 GLN CD C -7.624 4.468 -11.184 1.00 . A A . 12 GLN CD 1 1 4 2015 1 1 12 GLN CG C -6.682 4.436 -9.996 1.00 . A A . 12 GLN CG 1 1 4 2016 1 1 12 GLN H H -3.958 4.572 -7.966 1.00 . A A . 12 GLN H 1 1 4 2017 1 1 12 GLN HA H -4.701 6.376 -9.144 1.00 . A A . 12 GLN HA 1 1 4 2018 1 1 12 GLN HB2 H -7.530 5.617 -8.449 1.00 . A A . 12 GLN HB2 1 1 4 2019 1 1 12 GLN HB3 H -6.962 6.534 -9.837 1.00 . A A . 12 GLN HB3 1 1 4 2020 1 1 12 GLN HE21 H -6.749 6.120 -11.864 1.00 . A A . 12 GLN HE21 1 1 4 2021 1 1 12 GLN HE22 H -8.055 5.513 -12.820 1.00 . A A . 12 GLN HE22 1 1 4 2022 1 1 12 GLN HG2 H -5.674 4.298 -10.359 1.00 . A A . 12 GLN HG2 1 1 4 2023 1 1 12 GLN HG3 H -6.952 3.604 -9.363 1.00 . A A . 12 GLN HG3 1 1 4 2024 1 1 12 GLN N N -4.894 4.815 -7.810 1.00 . A A . 12 GLN N 1 1 4 2025 1 1 12 GLN NE2 N -7.459 5.468 -12.043 1.00 . A A . 12 GLN NE2 1 1 4 2026 1 1 12 GLN O O -5.007 8.149 -7.405 1.00 . A A . 12 GLN O 1 1 4 2027 1 1 12 GLN OE1 O -8.489 3.604 -11.328 1.00 . A A . 12 GLN OE1 1 1 4 2028 1 1 13 CYS C C -7.773 7.122 -4.354 1.00 . A A . 13 CYS C 1 1 4 2029 1 1 13 CYS CA C -6.926 7.795 -5.431 1.00 . A A . 13 CYS CA 1 1 4 2030 1 1 13 CYS CB C -7.662 9.009 -6.006 1.00 . A A . 13 CYS CB 1 1 4 2031 1 1 13 CYS H H -7.081 6.000 -6.538 1.00 . A A . 13 CYS H 1 1 4 2032 1 1 13 CYS HA H -5.999 8.125 -4.986 1.00 . A A . 13 CYS HA 1 1 4 2033 1 1 13 CYS HB2 H -7.689 8.927 -7.082 1.00 . A A . 13 CYS HB2 1 1 4 2034 1 1 13 CYS HB3 H -8.673 9.025 -5.626 1.00 . A A . 13 CYS HB3 1 1 4 2035 1 1 13 CYS N N -6.600 6.851 -6.491 1.00 . A A . 13 CYS N 1 1 4 2036 1 1 13 CYS O O -8.740 7.698 -3.856 1.00 . A A . 13 CYS O 1 1 4 2037 1 1 13 CYS SG S -6.889 10.608 -5.593 1.00 . A A . 13 CYS SG 1 1 4 2038 1 1 14 LYS C C -7.216 4.093 -2.344 1.00 . A A . 14 LYS C 1 1 4 2039 1 1 14 LYS CA C -8.121 5.141 -2.983 1.00 . A A . 14 LYS CA 1 1 4 2040 1 1 14 LYS CB C -9.350 4.466 -3.594 1.00 . A A . 14 LYS CB 1 1 4 2041 1 1 14 LYS CD C -11.851 4.310 -3.402 1.00 . A A . 14 LYS CD 1 1 4 2042 1 1 14 LYS CE C -12.024 2.965 -4.088 1.00 . A A . 14 LYS CE 1 1 4 2043 1 1 14 LYS CG C -10.535 4.385 -2.645 1.00 . A A . 14 LYS CG 1 1 4 2044 1 1 14 LYS H H -6.620 5.491 -4.433 1.00 . A A . 14 LYS H 1 1 4 2045 1 1 14 LYS HA H -8.443 5.834 -2.221 1.00 . A A . 14 LYS HA 1 1 4 2046 1 1 14 LYS HB2 H -9.655 5.022 -4.469 1.00 . A A . 14 LYS HB2 1 1 4 2047 1 1 14 LYS HB3 H -9.085 3.462 -3.892 1.00 . A A . 14 LYS HB3 1 1 4 2048 1 1 14 LYS HD2 H -12.664 4.456 -2.706 1.00 . A A . 14 LYS HD2 1 1 4 2049 1 1 14 LYS HD3 H -11.870 5.091 -4.149 1.00 . A A . 14 LYS HD3 1 1 4 2050 1 1 14 LYS HE2 H -11.051 2.517 -4.226 1.00 . A A . 14 LYS HE2 1 1 4 2051 1 1 14 LYS HE3 H -12.626 2.328 -3.456 1.00 . A A . 14 LYS HE3 1 1 4 2052 1 1 14 LYS HG2 H -10.433 3.501 -2.033 1.00 . A A . 14 LYS HG2 1 1 4 2053 1 1 14 LYS HG3 H -10.540 5.262 -2.016 1.00 . A A . 14 LYS HG3 1 1 4 2054 1 1 14 LYS HZ1 H -13.368 3.885 -5.396 1.00 . A A . 14 LYS HZ1 1 1 4 2055 1 1 14 LYS HZ2 H -11.978 3.285 -6.151 1.00 . A A . 14 LYS HZ2 1 1 4 2056 1 1 14 LYS HZ3 H -13.194 2.222 -5.650 1.00 . A A . 14 LYS HZ3 1 1 4 2057 1 1 14 LYS N N -7.400 5.897 -4.000 1.00 . A A . 14 LYS N 1 1 4 2058 1 1 14 LYS NZ N -12.687 3.098 -5.414 1.00 . A A . 14 LYS NZ 1 1 4 2059 1 1 14 LYS O O -6.222 3.673 -2.936 1.00 . A A . 14 LYS O 1 1 4 2060 1 1 15 LEU C C -6.714 1.370 -1.199 1.00 . A A . 15 LEU C 1 1 4 2061 1 1 15 LEU CA C -6.783 2.676 -0.413 1.00 . A A . 15 LEU CA 1 1 4 2062 1 1 15 LEU CB C -7.387 2.424 0.971 1.00 . A A . 15 LEU CB 1 1 4 2063 1 1 15 LEU CD1 C -5.492 1.149 2.004 1.00 . A A . 15 LEU CD1 1 1 4 2064 1 1 15 LEU CD2 C -5.533 3.646 2.133 1.00 . A A . 15 LEU CD2 1 1 4 2065 1 1 15 LEU CG C -6.377 2.380 2.119 1.00 . A A . 15 LEU CG 1 1 4 2066 1 1 15 LEU H H -8.369 4.047 -0.711 1.00 . A A . 15 LEU H 1 1 4 2067 1 1 15 LEU HA H -5.783 3.063 -0.294 1.00 . A A . 15 LEU HA 1 1 4 2068 1 1 15 LEU HB2 H -8.101 3.208 1.176 1.00 . A A . 15 LEU HB2 1 1 4 2069 1 1 15 LEU HB3 H -7.912 1.481 0.947 1.00 . A A . 15 LEU HB3 1 1 4 2070 1 1 15 LEU HD11 H -6.109 0.263 1.987 1.00 . A A . 15 LEU HD11 1 1 4 2071 1 1 15 LEU HD12 H -4.915 1.203 1.093 1.00 . A A . 15 LEU HD12 1 1 4 2072 1 1 15 LEU HD13 H -4.824 1.106 2.851 1.00 . A A . 15 LEU HD13 1 1 4 2073 1 1 15 LEU HD21 H -6.052 4.431 1.604 1.00 . A A . 15 LEU HD21 1 1 4 2074 1 1 15 LEU HD22 H -5.362 3.953 3.154 1.00 . A A . 15 LEU HD22 1 1 4 2075 1 1 15 LEU HD23 H -4.586 3.453 1.652 1.00 . A A . 15 LEU HD23 1 1 4 2076 1 1 15 LEU HG H -6.910 2.322 3.057 1.00 . A A . 15 LEU HG 1 1 4 2077 1 1 15 LEU N N -7.566 3.675 -1.132 1.00 . A A . 15 LEU N 1 1 4 2078 1 1 15 LEU O O -7.738 0.745 -1.475 1.00 . A A . 15 LEU O 1 1 4 2079 1 1 16 LYS C C -5.840 -1.472 -1.543 1.00 . A A . 16 LYS C 1 1 4 2080 1 1 16 LYS CA C -5.296 -0.268 -2.310 1.00 . A A . 16 LYS CA 1 1 4 2081 1 1 16 LYS CB C -3.810 -0.468 -2.609 1.00 . A A . 16 LYS CB 1 1 4 2082 1 1 16 LYS CD C -3.273 -0.856 -5.034 1.00 . A A . 16 LYS CD 1 1 4 2083 1 1 16 LYS CE C -2.253 -0.447 -6.084 1.00 . A A . 16 LYS CE 1 1 4 2084 1 1 16 LYS CG C -3.360 0.169 -3.914 1.00 . A A . 16 LYS CG 1 1 4 2085 1 1 16 LYS H H -4.721 1.505 -1.306 1.00 . A A . 16 LYS H 1 1 4 2086 1 1 16 LYS HA H -5.833 -0.179 -3.243 1.00 . A A . 16 LYS HA 1 1 4 2087 1 1 16 LYS HB2 H -3.232 -0.037 -1.805 1.00 . A A . 16 LYS HB2 1 1 4 2088 1 1 16 LYS HB3 H -3.604 -1.527 -2.660 1.00 . A A . 16 LYS HB3 1 1 4 2089 1 1 16 LYS HD2 H -2.982 -1.808 -4.616 1.00 . A A . 16 LYS HD2 1 1 4 2090 1 1 16 LYS HD3 H -4.242 -0.947 -5.502 1.00 . A A . 16 LYS HD3 1 1 4 2091 1 1 16 LYS HE2 H -2.386 -1.067 -6.958 1.00 . A A . 16 LYS HE2 1 1 4 2092 1 1 16 LYS HE3 H -2.422 0.587 -6.349 1.00 . A A . 16 LYS HE3 1 1 4 2093 1 1 16 LYS HG2 H -4.071 0.932 -4.194 1.00 . A A . 16 LYS HG2 1 1 4 2094 1 1 16 LYS HG3 H -2.387 0.615 -3.769 1.00 . A A . 16 LYS HG3 1 1 4 2095 1 1 16 LYS HZ1 H -0.794 -1.406 -4.937 1.00 . A A . 16 LYS HZ1 1 1 4 2096 1 1 16 LYS HZ2 H -0.211 -0.765 -6.390 1.00 . A A . 16 LYS HZ2 1 1 4 2097 1 1 16 LYS HZ3 H -0.557 0.262 -5.092 1.00 . A A . 16 LYS HZ3 1 1 4 2098 1 1 16 LYS N N -5.500 0.964 -1.556 1.00 . A A . 16 LYS N 1 1 4 2099 1 1 16 LYS NZ N -0.856 -0.600 -5.592 1.00 . A A . 16 LYS NZ 1 1 4 2100 1 1 16 LYS O O -6.010 -1.417 -0.326 1.00 . A A . 16 LYS O 1 1 4 2101 1 1 17 PRO C C -5.642 -4.451 -0.686 1.00 . A A . 17 PRO C 1 1 4 2102 1 1 17 PRO CA C -6.647 -3.801 -1.630 1.00 . A A . 17 PRO CA 1 1 4 2103 1 1 17 PRO CB C -6.931 -4.720 -2.822 1.00 . A A . 17 PRO CB 1 1 4 2104 1 1 17 PRO CD C -5.947 -2.731 -3.706 1.00 . A A . 17 PRO CD 1 1 4 2105 1 1 17 PRO CG C -6.053 -4.215 -3.914 1.00 . A A . 17 PRO CG 1 1 4 2106 1 1 17 PRO HA H -7.565 -3.607 -1.095 1.00 . A A . 17 PRO HA 1 1 4 2107 1 1 17 PRO HB2 H -6.688 -5.739 -2.559 1.00 . A A . 17 PRO HB2 1 1 4 2108 1 1 17 PRO HB3 H -7.974 -4.651 -3.092 1.00 . A A . 17 PRO HB3 1 1 4 2109 1 1 17 PRO HD2 H -4.976 -2.374 -4.019 1.00 . A A . 17 PRO HD2 1 1 4 2110 1 1 17 PRO HD3 H -6.731 -2.217 -4.243 1.00 . A A . 17 PRO HD3 1 1 4 2111 1 1 17 PRO HG2 H -5.078 -4.674 -3.844 1.00 . A A . 17 PRO HG2 1 1 4 2112 1 1 17 PRO HG3 H -6.500 -4.427 -4.874 1.00 . A A . 17 PRO HG3 1 1 4 2113 1 1 17 PRO N N -6.120 -2.580 -2.251 1.00 . A A . 17 PRO N 1 1 4 2114 1 1 17 PRO O O -4.436 -4.431 -0.937 1.00 . A A . 17 PRO O 1 1 4 2115 1 1 18 ALA C C -4.506 -6.827 0.748 1.00 . A A . 18 ALA C 1 1 4 2116 1 1 18 ALA CA C -5.293 -5.685 1.382 1.00 . A A . 18 ALA CA 1 1 4 2117 1 1 18 ALA CB C -6.128 -6.200 2.545 1.00 . A A . 18 ALA CB 1 1 4 2118 1 1 18 ALA H H -7.115 -5.010 0.543 1.00 . A A . 18 ALA H 1 1 4 2119 1 1 18 ALA HA H -4.598 -4.951 1.765 1.00 . A A . 18 ALA HA 1 1 4 2120 1 1 18 ALA HB1 H -6.382 -5.377 3.197 1.00 . A A . 18 ALA HB1 1 1 4 2121 1 1 18 ALA HB2 H -5.561 -6.935 3.097 1.00 . A A . 18 ALA HB2 1 1 4 2122 1 1 18 ALA HB3 H -7.032 -6.652 2.166 1.00 . A A . 18 ALA HB3 1 1 4 2123 1 1 18 ALA N N -6.146 -5.028 0.400 1.00 . A A . 18 ALA N 1 1 4 2124 1 1 18 ALA O O -4.897 -7.363 -0.289 1.00 . A A . 18 ALA O 1 1 4 2125 1 1 19 GLY C C -1.947 -7.929 -0.483 1.00 . A A . 19 GLY C 1 1 4 2126 1 1 19 GLY CA C -2.569 -8.268 0.858 1.00 . A A . 19 GLY CA 1 1 4 2127 1 1 19 GLY H H -3.131 -6.729 2.199 1.00 . A A . 19 GLY H 1 1 4 2128 1 1 19 GLY HA2 H -3.179 -9.152 0.745 1.00 . A A . 19 GLY HA2 1 1 4 2129 1 1 19 GLY HA3 H -1.780 -8.476 1.566 1.00 . A A . 19 GLY HA3 1 1 4 2130 1 1 19 GLY N N -3.394 -7.193 1.376 1.00 . A A . 19 GLY N 1 1 4 2131 1 1 19 GLY O O -1.580 -8.821 -1.247 1.00 . A A . 19 GLY O 1 1 4 2132 1 1 20 THR C C 0.061 -5.432 -1.780 1.00 . A A . 20 THR C 1 1 4 2133 1 1 20 THR CA C -1.244 -6.182 -2.027 1.00 . A A . 20 THR CA 1 1 4 2134 1 1 20 THR CB C -2.231 -5.282 -2.774 1.00 . A A . 20 THR CB 1 1 4 2135 1 1 20 THR CG2 C -1.710 -4.802 -4.111 1.00 . A A . 20 THR CG2 1 1 4 2136 1 1 20 THR H H -2.137 -5.971 -0.120 1.00 . A A . 20 THR H 1 1 4 2137 1 1 20 THR HA H -1.037 -7.053 -2.630 1.00 . A A . 20 THR HA 1 1 4 2138 1 1 20 THR HB H -2.438 -4.412 -2.168 1.00 . A A . 20 THR HB 1 1 4 2139 1 1 20 THR HG1 H -3.930 -6.053 -2.181 1.00 . A A . 20 THR HG1 1 1 4 2140 1 1 20 THR HG21 H -0.649 -4.613 -4.038 1.00 . A A . 20 THR HG21 1 1 4 2141 1 1 20 THR HG22 H -1.889 -5.559 -4.860 1.00 . A A . 20 THR HG22 1 1 4 2142 1 1 20 THR HG23 H -2.220 -3.892 -4.390 1.00 . A A . 20 THR HG23 1 1 4 2143 1 1 20 THR N N -1.827 -6.636 -0.770 1.00 . A A . 20 THR N 1 1 4 2144 1 1 20 THR O O 0.113 -4.509 -0.968 1.00 . A A . 20 THR O 1 1 4 2145 1 1 20 THR OG1 O -3.451 -5.963 -3.007 1.00 . A A . 20 THR OG1 1 1 4 2146 1 1 21 THR C C 2.343 -3.718 -2.686 1.00 . A A . 21 THR C 1 1 4 2147 1 1 21 THR CA C 2.418 -5.202 -2.340 1.00 . A A . 21 THR CA 1 1 4 2148 1 1 21 THR CB C 3.451 -5.898 -3.232 1.00 . A A . 21 THR CB 1 1 4 2149 1 1 21 THR CG2 C 4.485 -6.677 -2.449 1.00 . A A . 21 THR CG2 1 1 4 2150 1 1 21 THR H H 1.008 -6.578 -3.117 1.00 . A A . 21 THR H 1 1 4 2151 1 1 21 THR HA H 2.720 -5.303 -1.309 1.00 . A A . 21 THR HA 1 1 4 2152 1 1 21 THR HB H 3.972 -5.151 -3.814 1.00 . A A . 21 THR HB 1 1 4 2153 1 1 21 THR HG1 H 2.941 -6.490 -5.027 1.00 . A A . 21 THR HG1 1 1 4 2154 1 1 21 THR HG21 H 3.988 -7.362 -1.778 1.00 . A A . 21 THR HG21 1 1 4 2155 1 1 21 THR HG22 H 5.110 -7.234 -3.133 1.00 . A A . 21 THR HG22 1 1 4 2156 1 1 21 THR HG23 H 5.096 -5.993 -1.879 1.00 . A A . 21 THR HG23 1 1 4 2157 1 1 21 THR N N 1.112 -5.836 -2.485 1.00 . A A . 21 THR N 1 1 4 2158 1 1 21 THR O O 1.604 -3.316 -3.585 1.00 . A A . 21 THR O 1 1 4 2159 1 1 21 THR OG1 O 2.821 -6.798 -4.126 1.00 . A A . 21 THR OG1 1 1 4 2160 1 1 22 CYS C C 4.557 -0.975 -2.440 1.00 . A A . 22 CYS C 1 1 4 2161 1 1 22 CYS CA C 3.134 -1.469 -2.196 1.00 . A A . 22 CYS CA 1 1 4 2162 1 1 22 CYS CB C 2.523 -0.732 -1.004 1.00 . A A . 22 CYS CB 1 1 4 2163 1 1 22 CYS H H 3.680 -3.289 -1.263 1.00 . A A . 22 CYS H 1 1 4 2164 1 1 22 CYS HA H 2.541 -1.265 -3.074 1.00 . A A . 22 CYS HA 1 1 4 2165 1 1 22 CYS HB2 H 2.657 0.331 -1.139 1.00 . A A . 22 CYS HB2 1 1 4 2166 1 1 22 CYS HB3 H 1.467 -0.953 -0.957 1.00 . A A . 22 CYS HB3 1 1 4 2167 1 1 22 CYS N N 3.113 -2.909 -1.966 1.00 . A A . 22 CYS N 1 1 4 2168 1 1 22 CYS O O 4.799 -0.169 -3.338 1.00 . A A . 22 CYS O 1 1 4 2169 1 1 22 CYS SG S 3.255 -1.180 0.602 1.00 . A A . 22 CYS SG 1 1 4 2170 1 1 23 TRP C C 7.754 -2.258 -2.192 1.00 . A A . 23 TRP C 1 1 4 2171 1 1 23 TRP CA C 6.894 -1.073 -1.765 1.00 . A A . 23 TRP CA 1 1 4 2172 1 1 23 TRP CB C 7.411 -0.503 -0.443 1.00 . A A . 23 TRP CB 1 1 4 2173 1 1 23 TRP CD1 C 9.138 1.084 -1.472 1.00 . A A . 23 TRP CD1 1 1 4 2174 1 1 23 TRP CD2 C 9.903 -0.107 0.262 1.00 . A A . 23 TRP CD2 1 1 4 2175 1 1 23 TRP CE2 C 10.942 0.719 -0.208 1.00 . A A . 23 TRP CE2 1 1 4 2176 1 1 23 TRP CE3 C 10.151 -0.948 1.351 1.00 . A A . 23 TRP CE3 1 1 4 2177 1 1 23 TRP CG C 8.758 0.142 -0.560 1.00 . A A . 23 TRP CG 1 1 4 2178 1 1 23 TRP CH2 C 12.422 -0.106 1.438 1.00 . A A . 23 TRP CH2 1 1 4 2179 1 1 23 TRP CZ2 C 12.208 0.727 0.374 1.00 . A A . 23 TRP CZ2 1 1 4 2180 1 1 23 TRP CZ3 C 11.408 -0.938 1.927 1.00 . A A . 23 TRP CZ3 1 1 4 2181 1 1 23 TRP H H 5.241 -2.105 -0.938 1.00 . A A . 23 TRP H 1 1 4 2182 1 1 23 TRP HA H 6.955 -0.308 -2.525 1.00 . A A . 23 TRP HA 1 1 4 2183 1 1 23 TRP HB2 H 6.715 0.240 -0.082 1.00 . A A . 23 TRP HB2 1 1 4 2184 1 1 23 TRP HB3 H 7.485 -1.302 0.281 1.00 . A A . 23 TRP HB3 1 1 4 2185 1 1 23 TRP HD1 H 8.492 1.485 -2.239 1.00 . A A . 23 TRP HD1 1 1 4 2186 1 1 23 TRP HE1 H 10.953 2.094 -1.792 1.00 . A A . 23 TRP HE1 1 1 4 2187 1 1 23 TRP HE3 H 9.382 -1.597 1.742 1.00 . A A . 23 TRP HE3 1 1 4 2188 1 1 23 TRP HH2 H 13.389 -0.132 1.918 1.00 . A A . 23 TRP HH2 1 1 4 2189 1 1 23 TRP HZ2 H 13.000 1.364 0.009 1.00 . A A . 23 TRP HZ2 1 1 4 2190 1 1 23 TRP HZ3 H 11.618 -1.582 2.769 1.00 . A A . 23 TRP HZ3 1 1 4 2191 1 1 23 TRP N N 5.495 -1.465 -1.635 1.00 . A A . 23 TRP N 1 1 4 2192 1 1 23 TRP NE1 N 10.451 1.436 -1.267 1.00 . A A . 23 TRP NE1 1 1 4 2193 1 1 23 TRP O O 8.351 -2.937 -1.357 1.00 . A A . 23 TRP O 1 1 4 2194 1 1 24 ARG C C 10.088 -3.375 -3.800 1.00 . A A . 24 ARG C 1 1 4 2195 1 1 24 ARG CA C 8.599 -3.604 -4.036 1.00 . A A . 24 ARG CA 1 1 4 2196 1 1 24 ARG CB C 8.326 -3.771 -5.532 1.00 . A A . 24 ARG CB 1 1 4 2197 1 1 24 ARG CD C 5.830 -4.028 -5.659 1.00 . A A . 24 ARG CD 1 1 4 2198 1 1 24 ARG CG C 7.175 -4.714 -5.839 1.00 . A A . 24 ARG CG 1 1 4 2199 1 1 24 ARG CZ C 4.505 -2.302 -6.815 1.00 . A A . 24 ARG CZ 1 1 4 2200 1 1 24 ARG H H 7.313 -1.924 -4.114 1.00 . A A . 24 ARG H 1 1 4 2201 1 1 24 ARG HA H 8.300 -4.506 -3.522 1.00 . A A . 24 ARG HA 1 1 4 2202 1 1 24 ARG HB2 H 8.094 -2.804 -5.953 1.00 . A A . 24 ARG HB2 1 1 4 2203 1 1 24 ARG HB3 H 9.216 -4.157 -6.007 1.00 . A A . 24 ARG HB3 1 1 4 2204 1 1 24 ARG HD2 H 5.073 -4.783 -5.506 1.00 . A A . 24 ARG HD2 1 1 4 2205 1 1 24 ARG HD3 H 5.880 -3.388 -4.791 1.00 . A A . 24 ARG HD3 1 1 4 2206 1 1 24 ARG HE H 5.965 -3.375 -7.652 1.00 . A A . 24 ARG HE 1 1 4 2207 1 1 24 ARG HG2 H 7.261 -5.051 -6.861 1.00 . A A . 24 ARG HG2 1 1 4 2208 1 1 24 ARG HG3 H 7.229 -5.562 -5.172 1.00 . A A . 24 ARG HG3 1 1 4 2209 1 1 24 ARG HH11 H 4.005 -2.583 -4.876 1.00 . A A . 24 ARG HH11 1 1 4 2210 1 1 24 ARG HH12 H 3.088 -1.374 -5.711 1.00 . A A . 24 ARG HH12 1 1 4 2211 1 1 24 ARG HH21 H 4.760 -1.785 -8.752 1.00 . A A . 24 ARG HH21 1 1 4 2212 1 1 24 ARG HH22 H 3.517 -0.922 -7.912 1.00 . A A . 24 ARG HH22 1 1 4 2213 1 1 24 ARG N N 7.812 -2.501 -3.498 1.00 . A A . 24 ARG N 1 1 4 2214 1 1 24 ARG NE N 5.467 -3.222 -6.822 1.00 . A A . 24 ARG NE 1 1 4 2215 1 1 24 ARG NH1 N 3.809 -2.067 -5.709 1.00 . A A . 24 ARG NH1 1 1 4 2216 1 1 24 ARG NH2 N 4.239 -1.613 -7.917 1.00 . A A . 24 ARG NH2 1 1 4 2217 1 1 24 ARG O O 10.510 -2.271 -3.459 1.00 . A A . 24 ARG O 1 1 4 2218 1 1 25 THR C C 13.038 -5.477 -4.516 1.00 . A A . 25 THR C 1 1 4 2219 1 1 25 THR CA C 12.323 -4.340 -3.793 1.00 . A A . 25 THR CA 1 1 4 2220 1 1 25 THR CB C 12.663 -4.376 -2.302 1.00 . A A . 25 THR CB 1 1 4 2221 1 1 25 THR CG2 C 13.840 -3.498 -1.936 1.00 . A A . 25 THR CG2 1 1 4 2222 1 1 25 THR H H 10.484 -5.281 -4.257 1.00 . A A . 25 THR H 1 1 4 2223 1 1 25 THR HA H 12.656 -3.400 -4.207 1.00 . A A . 25 THR HA 1 1 4 2224 1 1 25 THR HB H 12.907 -5.390 -2.023 1.00 . A A . 25 THR HB 1 1 4 2225 1 1 25 THR HG1 H 11.780 -4.006 -0.593 1.00 . A A . 25 THR HG1 1 1 4 2226 1 1 25 THR HG21 H 14.341 -3.173 -2.836 1.00 . A A . 25 THR HG21 1 1 4 2227 1 1 25 THR HG22 H 13.490 -2.636 -1.388 1.00 . A A . 25 THR HG22 1 1 4 2228 1 1 25 THR HG23 H 14.530 -4.059 -1.323 1.00 . A A . 25 THR HG23 1 1 4 2229 1 1 25 THR N N 10.880 -4.427 -3.985 1.00 . A A . 25 THR N 1 1 4 2230 1 1 25 THR O O 12.408 -6.283 -5.202 1.00 . A A . 25 THR O 1 1 4 2231 1 1 25 THR OG1 O 11.556 -3.955 -1.525 1.00 . A A . 25 THR OG1 1 1 4 2232 1 1 26 SER C C 14.974 -7.913 -4.292 1.00 . A A . 26 SER C 1 1 4 2233 1 1 26 SER CA C 15.157 -6.573 -4.998 1.00 . A A . 26 SER CA 1 1 4 2234 1 1 26 SER CB C 16.635 -6.181 -4.995 1.00 . A A . 26 SER CB 1 1 4 2235 1 1 26 SER H H 14.801 -4.864 -3.801 1.00 . A A . 26 SER H 1 1 4 2236 1 1 26 SER HA H 14.821 -6.670 -6.019 1.00 . A A . 26 SER HA 1 1 4 2237 1 1 26 SER HB2 H 16.836 -5.547 -4.144 1.00 . A A . 26 SER HB2 1 1 4 2238 1 1 26 SER HB3 H 17.242 -7.072 -4.931 1.00 . A A . 26 SER HB3 1 1 4 2239 1 1 26 SER HG H 16.913 -6.069 -6.931 1.00 . A A . 26 SER HG 1 1 4 2240 1 1 26 SER N N 14.356 -5.535 -4.359 1.00 . A A . 26 SER N 1 1 4 2241 1 1 26 SER O O 15.048 -8.971 -4.917 1.00 . A A . 26 SER O 1 1 4 2242 1 1 26 SER OG O 16.979 -5.478 -6.177 1.00 . A A . 26 SER OG 1 1 4 2243 1 1 27 VAL C C 13.808 -8.760 -0.891 1.00 . A A . 27 VAL C 1 1 4 2244 1 1 27 VAL CA C 14.541 -9.069 -2.195 1.00 . A A . 27 VAL CA 1 1 4 2245 1 1 27 VAL CB C 15.886 -9.752 -1.876 1.00 . A A . 27 VAL CB 1 1 4 2246 1 1 27 VAL CG1 C 16.769 -8.837 -1.040 1.00 . A A . 27 VAL CG1 1 1 4 2247 1 1 27 VAL CG2 C 15.659 -11.082 -1.169 1.00 . A A . 27 VAL CG2 1 1 4 2248 1 1 27 VAL H H 14.687 -6.987 -2.543 1.00 . A A . 27 VAL H 1 1 4 2249 1 1 27 VAL HA H 13.942 -9.754 -2.777 1.00 . A A . 27 VAL HA 1 1 4 2250 1 1 27 VAL HB H 16.395 -9.949 -2.809 1.00 . A A . 27 VAL HB 1 1 4 2251 1 1 27 VAL HG11 H 16.640 -7.816 -1.366 1.00 . A A . 27 VAL HG11 1 1 4 2252 1 1 27 VAL HG12 H 16.492 -8.921 0.000 1.00 . A A . 27 VAL HG12 1 1 4 2253 1 1 27 VAL HG13 H 17.803 -9.126 -1.161 1.00 . A A . 27 VAL HG13 1 1 4 2254 1 1 27 VAL HG21 H 14.645 -11.125 -0.800 1.00 . A A . 27 VAL HG21 1 1 4 2255 1 1 27 VAL HG22 H 15.822 -11.891 -1.865 1.00 . A A . 27 VAL HG22 1 1 4 2256 1 1 27 VAL HG23 H 16.347 -11.174 -0.342 1.00 . A A . 27 VAL HG23 1 1 4 2257 1 1 27 VAL N N 14.734 -7.860 -2.986 1.00 . A A . 27 VAL N 1 1 4 2258 1 1 27 VAL O O 14.243 -9.160 0.190 1.00 . A A . 27 VAL O 1 1 4 2259 1 1 28 SER C C 10.430 -7.523 -0.201 1.00 . A A . 28 SER C 1 1 4 2260 1 1 28 SER CA C 11.901 -7.680 0.168 1.00 . A A . 28 SER CA 1 1 4 2261 1 1 28 SER CB C 12.429 -6.383 0.785 1.00 . A A . 28 SER CB 1 1 4 2262 1 1 28 SER H H 12.398 -7.753 -1.889 1.00 . A A . 28 SER H 1 1 4 2263 1 1 28 SER HA H 11.993 -8.474 0.890 1.00 . A A . 28 SER HA 1 1 4 2264 1 1 28 SER HB2 H 12.899 -5.787 0.017 1.00 . A A . 28 SER HB2 1 1 4 2265 1 1 28 SER HB3 H 11.606 -5.831 1.216 1.00 . A A . 28 SER HB3 1 1 4 2266 1 1 28 SER HG H 13.050 -6.329 2.642 1.00 . A A . 28 SER HG 1 1 4 2267 1 1 28 SER N N 12.694 -8.044 -1.001 1.00 . A A . 28 SER N 1 1 4 2268 1 1 28 SER O O 9.616 -8.409 0.058 1.00 . A A . 28 SER O 1 1 4 2269 1 1 28 SER OG O 13.380 -6.651 1.800 1.00 . A A . 28 SER OG 1 1 4 2270 1 1 29 SER C C 7.791 -6.110 -0.007 1.00 . A A . 29 SER C 1 1 4 2271 1 1 29 SER CA C 8.726 -6.111 -1.212 1.00 . A A . 29 SER CA 1 1 4 2272 1 1 29 SER CB C 8.255 -7.145 -2.236 1.00 . A A . 29 SER CB 1 1 4 2273 1 1 29 SER H H 10.794 -5.724 -0.983 1.00 . A A . 29 SER H 1 1 4 2274 1 1 29 SER HA H 8.707 -5.132 -1.668 1.00 . A A . 29 SER HA 1 1 4 2275 1 1 29 SER HB2 H 8.655 -8.114 -1.976 1.00 . A A . 29 SER HB2 1 1 4 2276 1 1 29 SER HB3 H 7.176 -7.188 -2.231 1.00 . A A . 29 SER HB3 1 1 4 2277 1 1 29 SER HG H 8.552 -7.554 -4.129 1.00 . A A . 29 SER HG 1 1 4 2278 1 1 29 SER N N 10.098 -6.390 -0.806 1.00 . A A . 29 SER N 1 1 4 2279 1 1 29 SER O O 7.530 -7.154 0.590 1.00 . A A . 29 SER O 1 1 4 2280 1 1 29 SER OG O 8.693 -6.808 -3.541 1.00 . A A . 29 SER OG 1 1 4 2281 1 1 30 HIS C C 4.937 -5.012 1.051 1.00 . A A . 30 HIS C 1 1 4 2282 1 1 30 HIS CA C 6.384 -4.793 1.480 1.00 . A A . 30 HIS CA 1 1 4 2283 1 1 30 HIS CB C 6.536 -3.411 2.117 1.00 . A A . 30 HIS CB 1 1 4 2284 1 1 30 HIS CD2 C 8.953 -3.986 2.861 1.00 . A A . 30 HIS CD2 1 1 4 2285 1 1 30 HIS CE1 C 9.310 -2.253 4.156 1.00 . A A . 30 HIS CE1 1 1 4 2286 1 1 30 HIS CG C 7.834 -3.224 2.839 1.00 . A A . 30 HIS CG 1 1 4 2287 1 1 30 HIS H H 7.535 -4.133 -0.169 1.00 . A A . 30 HIS H 1 1 4 2288 1 1 30 HIS HA H 6.649 -5.546 2.208 1.00 . A A . 30 HIS HA 1 1 4 2289 1 1 30 HIS HB2 H 6.474 -2.658 1.345 1.00 . A A . 30 HIS HB2 1 1 4 2290 1 1 30 HIS HB3 H 5.735 -3.259 2.826 1.00 . A A . 30 HIS HB3 1 1 4 2291 1 1 30 HIS HD1 H 7.470 -1.412 3.852 1.00 . A A . 30 HIS HD1 1 1 4 2292 1 1 30 HIS HD2 H 9.108 -4.913 2.328 1.00 . A A . 30 HIS HD2 1 1 4 2293 1 1 30 HIS HE1 H 9.782 -1.553 4.831 1.00 . A A . 30 HIS HE1 1 1 4 2294 1 1 30 HIS HE2 H 10.785 -3.636 3.828 1.00 . A A . 30 HIS HE2 1 1 4 2295 1 1 30 HIS N N 7.290 -4.930 0.346 1.00 . A A . 30 HIS N 1 1 4 2296 1 1 30 HIS ND1 N 8.090 -2.146 3.661 1.00 . A A . 30 HIS ND1 1 1 4 2297 1 1 30 HIS NE2 N 9.855 -3.360 3.687 1.00 . A A . 30 HIS NE2 1 1 4 2298 1 1 30 HIS O O 4.570 -4.739 -0.092 1.00 . A A . 30 HIS O 1 1 4 2299 1 1 31 TYR C C 1.821 -4.753 2.412 1.00 . A A . 31 TYR C 1 1 4 2300 1 1 31 TYR CA C 2.712 -5.761 1.693 1.00 . A A . 31 TYR CA 1 1 4 2301 1 1 31 TYR CB C 2.336 -7.183 2.115 1.00 . A A . 31 TYR CB 1 1 4 2302 1 1 31 TYR CD1 C 3.582 -9.149 1.137 1.00 . A A . 31 TYR CD1 1 1 4 2303 1 1 31 TYR CD2 C 1.746 -8.256 -0.094 1.00 . A A . 31 TYR CD2 1 1 4 2304 1 1 31 TYR CE1 C 3.789 -10.094 0.149 1.00 . A A . 31 TYR CE1 1 1 4 2305 1 1 31 TYR CE2 C 1.946 -9.198 -1.085 1.00 . A A . 31 TYR CE2 1 1 4 2306 1 1 31 TYR CG C 2.559 -8.215 1.032 1.00 . A A . 31 TYR CG 1 1 4 2307 1 1 31 TYR CZ C 2.969 -10.114 -0.959 1.00 . A A . 31 TYR CZ 1 1 4 2308 1 1 31 TYR H H 4.471 -5.703 2.868 1.00 . A A . 31 TYR H 1 1 4 2309 1 1 31 TYR HA H 2.563 -5.660 0.629 1.00 . A A . 31 TYR HA 1 1 4 2310 1 1 31 TYR HB2 H 2.930 -7.467 2.970 1.00 . A A . 31 TYR HB2 1 1 4 2311 1 1 31 TYR HB3 H 1.290 -7.206 2.386 1.00 . A A . 31 TYR HB3 1 1 4 2312 1 1 31 TYR HD1 H 4.223 -9.131 2.006 1.00 . A A . 31 TYR HD1 1 1 4 2313 1 1 31 TYR HD2 H 0.946 -7.536 -0.190 1.00 . A A . 31 TYR HD2 1 1 4 2314 1 1 31 TYR HE1 H 4.590 -10.812 0.249 1.00 . A A . 31 TYR HE1 1 1 4 2315 1 1 31 TYR HE2 H 1.304 -9.213 -1.953 1.00 . A A . 31 TYR HE2 1 1 4 2316 1 1 31 TYR HH H 2.873 -11.911 -1.634 1.00 . A A . 31 TYR HH 1 1 4 2317 1 1 31 TYR N N 4.120 -5.506 1.975 1.00 . A A . 31 TYR N 1 1 4 2318 1 1 31 TYR O O 2.256 -4.084 3.349 1.00 . A A . 31 TYR O 1 1 4 2319 1 1 31 TYR OH O 3.172 -11.053 -1.943 1.00 . A A . 31 TYR OH 1 1 4 2320 1 1 32 CYS C C -1.485 -4.477 3.298 1.00 . A A . 32 CYS C 1 1 4 2321 1 1 32 CYS CA C -0.377 -3.723 2.570 1.00 . A A . 32 CYS CA 1 1 4 2322 1 1 32 CYS CB C -0.981 -2.811 1.502 1.00 . A A . 32 CYS CB 1 1 4 2323 1 1 32 CYS H H 0.286 -5.210 1.216 1.00 . A A . 32 CYS H 1 1 4 2324 1 1 32 CYS HA H 0.159 -3.118 3.286 1.00 . A A . 32 CYS HA 1 1 4 2325 1 1 32 CYS HB2 H -1.019 -3.344 0.564 1.00 . A A . 32 CYS HB2 1 1 4 2326 1 1 32 CYS HB3 H -1.985 -2.540 1.797 1.00 . A A . 32 CYS HB3 1 1 4 2327 1 1 32 CYS N N 0.574 -4.650 1.967 1.00 . A A . 32 CYS N 1 1 4 2328 1 1 32 CYS O O -1.613 -5.694 3.165 1.00 . A A . 32 CYS O 1 1 4 2329 1 1 32 CYS SG S -0.048 -1.271 1.227 1.00 . A A . 32 CYS SG 1 1 4 2330 1 1 33 THR C C -4.729 -3.770 4.380 1.00 . A A . 33 THR C 1 1 4 2331 1 1 33 THR CA C -3.383 -4.345 4.817 1.00 . A A . 33 THR CA 1 1 4 2332 1 1 33 THR CB C -3.186 -4.119 6.318 1.00 . A A . 33 THR CB 1 1 4 2333 1 1 33 THR CG2 C -1.755 -4.310 6.773 1.00 . A A . 33 THR CG2 1 1 4 2334 1 1 33 THR H H -2.132 -2.779 4.133 1.00 . A A . 33 THR H 1 1 4 2335 1 1 33 THR HA H -3.378 -5.406 4.620 1.00 . A A . 33 THR HA 1 1 4 2336 1 1 33 THR HB H -3.802 -4.823 6.861 1.00 . A A . 33 THR HB 1 1 4 2337 1 1 33 THR HG1 H -3.570 -2.726 7.640 1.00 . A A . 33 THR HG1 1 1 4 2338 1 1 33 THR HG21 H -1.358 -5.217 6.341 1.00 . A A . 33 THR HG21 1 1 4 2339 1 1 33 THR HG22 H -1.160 -3.468 6.451 1.00 . A A . 33 THR HG22 1 1 4 2340 1 1 33 THR HG23 H -1.725 -4.381 7.850 1.00 . A A . 33 THR HG23 1 1 4 2341 1 1 33 THR N N -2.284 -3.745 4.067 1.00 . A A . 33 THR N 1 1 4 2342 1 1 33 THR O O -5.732 -3.918 5.078 1.00 . A A . 33 THR O 1 1 4 2343 1 1 33 THR OG1 O -3.582 -2.809 6.684 1.00 . A A . 33 THR OG1 1 1 4 2344 1 1 34 GLY C C -6.660 -1.634 3.734 1.00 . A A . 34 GLY C 1 1 4 2345 1 1 34 GLY CA C -5.978 -2.530 2.717 1.00 . A A . 34 GLY CA 1 1 4 2346 1 1 34 GLY H H -3.921 -3.025 2.704 1.00 . A A . 34 GLY H 1 1 4 2347 1 1 34 GLY HA2 H -6.655 -3.326 2.445 1.00 . A A . 34 GLY HA2 1 1 4 2348 1 1 34 GLY HA3 H -5.753 -1.948 1.836 1.00 . A A . 34 GLY HA3 1 1 4 2349 1 1 34 GLY N N -4.748 -3.114 3.221 1.00 . A A . 34 GLY N 1 1 4 2350 1 1 34 GLY O O -7.874 -1.433 3.678 1.00 . A A . 34 GLY O 1 1 4 2351 1 1 35 ARG C C -5.846 1.191 5.575 1.00 . A A . 35 ARG C 1 1 4 2352 1 1 35 ARG CA C -6.418 -0.218 5.699 1.00 . A A . 35 ARG CA 1 1 4 2353 1 1 35 ARG CB C -6.111 -0.784 7.087 1.00 . A A . 35 ARG CB 1 1 4 2354 1 1 35 ARG CD C -8.253 -1.063 8.371 1.00 . A A . 35 ARG CD 1 1 4 2355 1 1 35 ARG CG C -7.001 -0.222 8.183 1.00 . A A . 35 ARG CG 1 1 4 2356 1 1 35 ARG CZ C -9.509 0.228 10.052 1.00 . A A . 35 ARG CZ 1 1 4 2357 1 1 35 ARG H H -4.920 -1.293 4.659 1.00 . A A . 35 ARG H 1 1 4 2358 1 1 35 ARG HA H -7.488 -0.171 5.569 1.00 . A A . 35 ARG HA 1 1 4 2359 1 1 35 ARG HB2 H -6.240 -1.856 7.063 1.00 . A A . 35 ARG HB2 1 1 4 2360 1 1 35 ARG HB3 H -5.084 -0.559 7.336 1.00 . A A . 35 ARG HB3 1 1 4 2361 1 1 35 ARG HD2 H -8.503 -1.528 7.429 1.00 . A A . 35 ARG HD2 1 1 4 2362 1 1 35 ARG HD3 H -8.050 -1.828 9.106 1.00 . A A . 35 ARG HD3 1 1 4 2363 1 1 35 ARG HE H -10.100 -0.080 8.171 1.00 . A A . 35 ARG HE 1 1 4 2364 1 1 35 ARG HG2 H -6.448 -0.206 9.110 1.00 . A A . 35 ARG HG2 1 1 4 2365 1 1 35 ARG HG3 H -7.291 0.785 7.918 1.00 . A A . 35 ARG HG3 1 1 4 2366 1 1 35 ARG HH11 H -7.761 -0.540 10.720 1.00 . A A . 35 ARG HH11 1 1 4 2367 1 1 35 ARG HH12 H -8.663 0.372 11.883 1.00 . A A . 35 ARG HH12 1 1 4 2368 1 1 35 ARG HH21 H -11.288 1.120 9.699 1.00 . A A . 35 ARG HH21 1 1 4 2369 1 1 35 ARG HH22 H -10.665 1.314 11.304 1.00 . A A . 35 ARG HH22 1 1 4 2370 1 1 35 ARG N N -5.880 -1.095 4.665 1.00 . A A . 35 ARG N 1 1 4 2371 1 1 35 ARG NE N -9.389 -0.262 8.821 1.00 . A A . 35 ARG NE 1 1 4 2372 1 1 35 ARG NH1 N -8.567 0.001 10.959 1.00 . A A . 35 ARG NH1 1 1 4 2373 1 1 35 ARG NH2 N -10.575 0.946 10.379 1.00 . A A . 35 ARG NH2 1 1 4 2374 1 1 35 ARG O O -6.538 2.176 5.831 1.00 . A A . 35 ARG O 1 1 4 2375 1 1 36 SER C C -3.037 2.585 3.781 1.00 . A A . 36 SER C 1 1 4 2376 1 1 36 SER CA C -3.918 2.569 5.026 1.00 . A A . 36 SER CA 1 1 4 2377 1 1 36 SER CB C -3.076 2.884 6.264 1.00 . A A . 36 SER CB 1 1 4 2378 1 1 36 SER H H -4.080 0.459 4.993 1.00 . A A . 36 SER H 1 1 4 2379 1 1 36 SER HA H -4.683 3.323 4.921 1.00 . A A . 36 SER HA 1 1 4 2380 1 1 36 SER HB2 H -2.754 1.961 6.722 1.00 . A A . 36 SER HB2 1 1 4 2381 1 1 36 SER HB3 H -2.212 3.462 5.971 1.00 . A A . 36 SER HB3 1 1 4 2382 1 1 36 SER HG H -3.329 4.411 7.465 1.00 . A A . 36 SER HG 1 1 4 2383 1 1 36 SER N N -4.581 1.279 5.182 1.00 . A A . 36 SER N 1 1 4 2384 1 1 36 SER O O -2.556 1.545 3.333 1.00 . A A . 36 SER O 1 1 4 2385 1 1 36 SER OG O -3.822 3.627 7.213 1.00 . A A . 36 SER OG 1 1 4 2386 1 1 37 CYS C C -0.527 3.723 2.362 1.00 . A A . 37 CYS C 1 1 4 2387 1 1 37 CYS CA C -2.004 3.936 2.037 1.00 . A A . 37 CYS CA 1 1 4 2388 1 1 37 CYS CB C -2.211 5.328 1.438 1.00 . A A . 37 CYS CB 1 1 4 2389 1 1 37 CYS H H -3.239 4.569 3.634 1.00 . A A . 37 CYS H 1 1 4 2390 1 1 37 CYS HA H -2.313 3.194 1.315 1.00 . A A . 37 CYS HA 1 1 4 2391 1 1 37 CYS HB2 H -2.631 5.977 2.192 1.00 . A A . 37 CYS HB2 1 1 4 2392 1 1 37 CYS HB3 H -1.257 5.723 1.122 1.00 . A A . 37 CYS HB3 1 1 4 2393 1 1 37 CYS N N -2.829 3.776 3.229 1.00 . A A . 37 CYS N 1 1 4 2394 1 1 37 CYS O O 0.267 3.381 1.486 1.00 . A A . 37 CYS O 1 1 4 2395 1 1 37 CYS SG S -3.327 5.357 0.000 1.00 . A A . 37 CYS SG 1 1 4 2396 1 1 38 GLU C C 1.551 2.294 4.278 1.00 . A A . 38 GLU C 1 1 4 2397 1 1 38 GLU CA C 1.216 3.766 4.060 1.00 . A A . 38 GLU CA 1 1 4 2398 1 1 38 GLU CB C 1.462 4.552 5.350 1.00 . A A . 38 GLU CB 1 1 4 2399 1 1 38 GLU CD C 3.874 4.221 6.025 1.00 . A A . 38 GLU CD 1 1 4 2400 1 1 38 GLU CG C 2.849 5.168 5.431 1.00 . A A . 38 GLU CG 1 1 4 2401 1 1 38 GLU H H -0.843 4.207 4.277 1.00 . A A . 38 GLU H 1 1 4 2402 1 1 38 GLU HA H 1.857 4.157 3.284 1.00 . A A . 38 GLU HA 1 1 4 2403 1 1 38 GLU HB2 H 0.734 5.347 5.418 1.00 . A A . 38 GLU HB2 1 1 4 2404 1 1 38 GLU HB3 H 1.337 3.888 6.192 1.00 . A A . 38 GLU HB3 1 1 4 2405 1 1 38 GLU HG2 H 3.168 5.440 4.436 1.00 . A A . 38 GLU HG2 1 1 4 2406 1 1 38 GLU HG3 H 2.800 6.054 6.047 1.00 . A A . 38 GLU HG3 1 1 4 2407 1 1 38 GLU N N -0.166 3.932 3.624 1.00 . A A . 38 GLU N 1 1 4 2408 1 1 38 GLU O O 0.664 1.472 4.508 1.00 . A A . 38 GLU O 1 1 4 2409 1 1 38 GLU OE1 O 3.647 3.732 7.152 1.00 . A A . 38 GLU OE1 1 1 4 2410 1 1 38 GLU OE2 O 4.902 3.968 5.363 1.00 . A A . 38 GLU OE2 1 1 4 2411 1 1 39 CYS C C 4.133 0.483 5.668 1.00 . A A . 39 CYS C 1 1 4 2412 1 1 39 CYS CA C 3.298 0.599 4.394 1.00 . A A . 39 CYS CA 1 1 4 2413 1 1 39 CYS CB C 4.121 0.145 3.187 1.00 . A A . 39 CYS CB 1 1 4 2414 1 1 39 CYS H H 3.496 2.673 4.019 1.00 . A A . 39 CYS H 1 1 4 2415 1 1 39 CYS HA H 2.428 -0.034 4.484 1.00 . A A . 39 CYS HA 1 1 4 2416 1 1 39 CYS HB2 H 5.101 0.595 3.239 1.00 . A A . 39 CYS HB2 1 1 4 2417 1 1 39 CYS HB3 H 4.222 -0.930 3.213 1.00 . A A . 39 CYS HB3 1 1 4 2418 1 1 39 CYS N N 2.838 1.971 4.204 1.00 . A A . 39 CYS N 1 1 4 2419 1 1 39 CYS O O 5.334 0.756 5.657 1.00 . A A . 39 CYS O 1 1 4 2420 1 1 39 CYS SG S 3.394 0.594 1.578 1.00 . A A . 39 CYS SG 1 1 4 2421 1 1 40 PRO C C 5.215 -1.204 8.068 1.00 . A A . 40 PRO C 1 1 4 2422 1 1 40 PRO CA C 4.206 -0.062 8.073 1.00 . A A . 40 PRO CA 1 1 4 2423 1 1 40 PRO CB C 3.076 -0.344 9.067 1.00 . A A . 40 PRO CB 1 1 4 2424 1 1 40 PRO CD C 2.078 -0.261 6.898 1.00 . A A . 40 PRO CD 1 1 4 2425 1 1 40 PRO CG C 1.980 -0.925 8.243 1.00 . A A . 40 PRO CG 1 1 4 2426 1 1 40 PRO HA H 4.710 0.853 8.347 1.00 . A A . 40 PRO HA 1 1 4 2427 1 1 40 PRO HB2 H 3.420 -1.041 9.817 1.00 . A A . 40 PRO HB2 1 1 4 2428 1 1 40 PRO HB3 H 2.769 0.577 9.539 1.00 . A A . 40 PRO HB3 1 1 4 2429 1 1 40 PRO HD2 H 1.784 -0.947 6.117 1.00 . A A . 40 PRO HD2 1 1 4 2430 1 1 40 PRO HD3 H 1.466 0.629 6.871 1.00 . A A . 40 PRO HD3 1 1 4 2431 1 1 40 PRO HG2 H 2.120 -1.992 8.146 1.00 . A A . 40 PRO HG2 1 1 4 2432 1 1 40 PRO HG3 H 1.025 -0.710 8.699 1.00 . A A . 40 PRO HG3 1 1 4 2433 1 1 40 PRO N N 3.508 0.080 6.790 1.00 . A A . 40 PRO N 1 1 4 2434 1 1 40 PRO O O 5.049 -2.199 8.775 1.00 . A A . 40 PRO O 1 1 4 2435 1 1 41 SER C C 6.746 -3.467 7.080 1.00 . A A . 41 SER C 1 1 4 2436 1 1 41 SER CA C 7.321 -2.054 7.164 1.00 . A A . 41 SER CA 1 1 4 2437 1 1 41 SER CB C 8.270 -1.951 8.359 1.00 . A A . 41 SER CB 1 1 4 2438 1 1 41 SER H H 6.337 -0.226 6.738 1.00 . A A . 41 SER H 1 1 4 2439 1 1 41 SER HA H 7.878 -1.854 6.260 1.00 . A A . 41 SER HA 1 1 4 2440 1 1 41 SER HB2 H 8.258 -0.940 8.739 1.00 . A A . 41 SER HB2 1 1 4 2441 1 1 41 SER HB3 H 7.944 -2.630 9.134 1.00 . A A . 41 SER HB3 1 1 4 2442 1 1 41 SER HG H 9.749 -3.218 8.148 1.00 . A A . 41 SER HG 1 1 4 2443 1 1 41 SER N N 6.266 -1.047 7.269 1.00 . A A . 41 SER N 1 1 4 2444 1 1 41 SER O O 7.365 -4.426 7.539 1.00 . A A . 41 SER O 1 1 4 2445 1 1 41 SER OG O 9.597 -2.283 7.989 1.00 . A A . 41 SER OG 1 1 4 2446 1 1 42 TYR C C 5.774 -5.846 5.543 1.00 . A A . 42 TYR C 1 1 4 2447 1 1 42 TYR CA C 4.906 -4.884 6.354 1.00 . A A . 42 TYR CA 1 1 4 2448 1 1 42 TYR CB C 3.540 -4.719 5.684 1.00 . A A . 42 TYR CB 1 1 4 2449 1 1 42 TYR CD1 C 2.104 -4.707 7.761 1.00 . A A . 42 TYR CD1 1 1 4 2450 1 1 42 TYR CD2 C 1.594 -6.285 6.048 1.00 . A A . 42 TYR CD2 1 1 4 2451 1 1 42 TYR CE1 C 1.055 -5.187 8.522 1.00 . A A . 42 TYR CE1 1 1 4 2452 1 1 42 TYR CE2 C 0.542 -6.771 6.803 1.00 . A A . 42 TYR CE2 1 1 4 2453 1 1 42 TYR CG C 2.391 -5.247 6.513 1.00 . A A . 42 TYR CG 1 1 4 2454 1 1 42 TYR CZ C 0.278 -6.218 8.039 1.00 . A A . 42 TYR CZ 1 1 4 2455 1 1 42 TYR H H 5.113 -2.787 6.147 1.00 . A A . 42 TYR H 1 1 4 2456 1 1 42 TYR HA H 4.763 -5.289 7.344 1.00 . A A . 42 TYR HA 1 1 4 2457 1 1 42 TYR HB2 H 3.361 -3.670 5.500 1.00 . A A . 42 TYR HB2 1 1 4 2458 1 1 42 TYR HB3 H 3.541 -5.249 4.742 1.00 . A A . 42 TYR HB3 1 1 4 2459 1 1 42 TYR HD1 H 2.715 -3.899 8.136 1.00 . A A . 42 TYR HD1 1 1 4 2460 1 1 42 TYR HD2 H 1.804 -6.716 5.081 1.00 . A A . 42 TYR HD2 1 1 4 2461 1 1 42 TYR HE1 H 0.848 -4.754 9.489 1.00 . A A . 42 TYR HE1 1 1 4 2462 1 1 42 TYR HE2 H -0.066 -7.578 6.425 1.00 . A A . 42 TYR HE2 1 1 4 2463 1 1 42 TYR HH H -1.593 -6.330 8.469 1.00 . A A . 42 TYR HH 1 1 4 2464 1 1 42 TYR N N 5.559 -3.587 6.494 1.00 . A A . 42 TYR N 1 1 4 2465 1 1 42 TYR O O 5.951 -5.665 4.338 1.00 . A A . 42 TYR O 1 1 4 2466 1 1 42 TYR OH O -0.768 -6.699 8.793 1.00 . A A . 42 TYR OH 1 1 4 2467 1 1 43 PRO C C 6.508 -8.463 4.277 1.00 . A A . 43 PRO C 1 1 4 2468 1 1 43 PRO CA C 7.179 -7.873 5.513 1.00 . A A . 43 PRO CA 1 1 4 2469 1 1 43 PRO CB C 7.388 -8.956 6.575 1.00 . A A . 43 PRO CB 1 1 4 2470 1 1 43 PRO CD C 6.174 -7.188 7.627 1.00 . A A . 43 PRO CD 1 1 4 2471 1 1 43 PRO CG C 7.207 -8.251 7.874 1.00 . A A . 43 PRO CG 1 1 4 2472 1 1 43 PRO HA H 8.132 -7.448 5.236 1.00 . A A . 43 PRO HA 1 1 4 2473 1 1 43 PRO HB2 H 6.655 -9.739 6.443 1.00 . A A . 43 PRO HB2 1 1 4 2474 1 1 43 PRO HB3 H 8.382 -9.366 6.484 1.00 . A A . 43 PRO HB3 1 1 4 2475 1 1 43 PRO HD2 H 5.184 -7.567 7.838 1.00 . A A . 43 PRO HD2 1 1 4 2476 1 1 43 PRO HD3 H 6.380 -6.314 8.227 1.00 . A A . 43 PRO HD3 1 1 4 2477 1 1 43 PRO HG2 H 6.858 -8.947 8.624 1.00 . A A . 43 PRO HG2 1 1 4 2478 1 1 43 PRO HG3 H 8.140 -7.803 8.182 1.00 . A A . 43 PRO HG3 1 1 4 2479 1 1 43 PRO N N 6.329 -6.888 6.191 1.00 . A A . 43 PRO N 1 1 4 2480 1 1 43 PRO O O 5.407 -8.058 3.903 1.00 . A A . 43 PRO O 1 1 4 2481 1 1 44 GLY C C 7.502 -11.183 1.950 1.00 . A A . 44 GLY C 1 1 4 2482 1 1 44 GLY CA C 6.633 -10.050 2.458 1.00 . A A . 44 GLY CA 1 1 4 2483 1 1 44 GLY H H 8.053 -9.702 3.990 1.00 . A A . 44 GLY H 1 1 4 2484 1 1 44 GLY HA2 H 6.539 -9.306 1.681 1.00 . A A . 44 GLY HA2 1 1 4 2485 1 1 44 GLY HA3 H 5.652 -10.439 2.690 1.00 . A A . 44 GLY HA3 1 1 4 2486 1 1 44 GLY N N 7.179 -9.421 3.646 1.00 . A A . 44 GLY N 1 1 4 2487 1 1 44 GLY O O 7.993 -11.088 0.806 1.00 . A A . 44 GLY O 1 1 4 2488 1 1 44 GLY OXT O 7.692 -12.166 2.697 1.00 . A A . 44 GLY OXT 1 1 5 2489 1 1 1 ALA C C -10.847 15.047 3.870 1.00 . A A . 1 ALA C 1 1 5 2490 1 1 1 ALA CA C -11.114 16.255 4.762 1.00 . A A . 1 ALA CA 1 1 5 2491 1 1 1 ALA CB C -9.806 16.943 5.123 1.00 . A A . 1 ALA CB 1 1 5 2492 1 1 1 ALA H1 H -11.429 14.968 6.334 1.00 . A A . 1 ALA H1 1 1 5 2493 1 1 1 ALA H2 H -11.726 16.620 6.691 1.00 . A A . 1 ALA H2 1 1 5 2494 1 1 1 ALA H3 H -12.845 15.735 5.742 1.00 . A A . 1 ALA H3 1 1 5 2495 1 1 1 ALA HA H -11.724 16.962 4.218 1.00 . A A . 1 ALA HA 1 1 5 2496 1 1 1 ALA HB1 H -9.281 16.353 5.860 1.00 . A A . 1 ALA HB1 1 1 5 2497 1 1 1 ALA HB2 H -9.194 17.041 4.238 1.00 . A A . 1 ALA HB2 1 1 5 2498 1 1 1 ALA HB3 H -10.014 17.923 5.527 1.00 . A A . 1 ALA HB3 1 1 5 2499 1 1 1 ALA N N -11.844 15.859 5.993 1.00 . A A . 1 ALA N 1 1 5 2500 1 1 1 ALA O O -9.833 14.988 3.176 1.00 . A A . 1 ALA O 1 1 5 2501 1 1 2 MET C C -11.898 13.175 1.616 1.00 . A A . 2 MET C 1 1 5 2502 1 1 2 MET CA C -11.629 12.879 3.088 1.00 . A A . 2 MET CA 1 1 5 2503 1 1 2 MET CB C -12.589 11.797 3.586 1.00 . A A . 2 MET CB 1 1 5 2504 1 1 2 MET CE C -11.013 8.771 5.076 1.00 . A A . 2 MET CE 1 1 5 2505 1 1 2 MET CG C -12.235 11.256 4.962 1.00 . A A . 2 MET CG 1 1 5 2506 1 1 2 MET H H -12.553 14.192 4.468 1.00 . A A . 2 MET H 1 1 5 2507 1 1 2 MET HA H -10.615 12.524 3.192 1.00 . A A . 2 MET HA 1 1 5 2508 1 1 2 MET HB2 H -13.586 12.210 3.631 1.00 . A A . 2 MET HB2 1 1 5 2509 1 1 2 MET HB3 H -12.580 10.975 2.887 1.00 . A A . 2 MET HB3 1 1 5 2510 1 1 2 MET HE1 H -10.461 9.196 4.251 1.00 . A A . 2 MET HE1 1 1 5 2511 1 1 2 MET HE2 H -10.488 8.968 6.000 1.00 . A A . 2 MET HE2 1 1 5 2512 1 1 2 MET HE3 H -11.107 7.705 4.936 1.00 . A A . 2 MET HE3 1 1 5 2513 1 1 2 MET HG2 H -11.174 11.381 5.121 1.00 . A A . 2 MET HG2 1 1 5 2514 1 1 2 MET HG3 H -12.778 11.820 5.706 1.00 . A A . 2 MET HG3 1 1 5 2515 1 1 2 MET N N -11.765 14.087 3.894 1.00 . A A . 2 MET N 1 1 5 2516 1 1 2 MET O O -12.632 14.105 1.283 1.00 . A A . 2 MET O 1 1 5 2517 1 1 2 MET SD S -12.643 9.510 5.148 1.00 . A A . 2 MET SD 1 1 5 2518 1 1 3 ASP C C -10.746 11.459 -1.473 1.00 . A A . 3 ASP C 1 1 5 2519 1 1 3 ASP CA C -11.473 12.553 -0.698 1.00 . A A . 3 ASP CA 1 1 5 2520 1 1 3 ASP CB C -10.958 13.927 -1.131 1.00 . A A . 3 ASP CB 1 1 5 2521 1 1 3 ASP CG C -11.708 14.474 -2.331 1.00 . A A . 3 ASP CG 1 1 5 2522 1 1 3 ASP H H -10.725 11.652 1.065 1.00 . A A . 3 ASP H 1 1 5 2523 1 1 3 ASP HA H -12.529 12.490 -0.914 1.00 . A A . 3 ASP HA 1 1 5 2524 1 1 3 ASP HB2 H -11.073 14.622 -0.312 1.00 . A A . 3 ASP HB2 1 1 5 2525 1 1 3 ASP HB3 H -9.912 13.849 -1.388 1.00 . A A . 3 ASP HB3 1 1 5 2526 1 1 3 ASP N N -11.298 12.377 0.739 1.00 . A A . 3 ASP N 1 1 5 2527 1 1 3 ASP O O -11.350 10.748 -2.276 1.00 . A A . 3 ASP O 1 1 5 2528 1 1 3 ASP OD1 O -12.619 15.305 -2.133 1.00 . A A . 3 ASP OD1 1 1 5 2529 1 1 3 ASP OD2 O -11.383 14.071 -3.467 1.00 . A A . 3 ASP OD2 1 1 5 2530 1 1 4 CYS C C -7.428 9.939 -1.056 1.00 . A A . 4 CYS C 1 1 5 2531 1 1 4 CYS CA C -8.638 10.321 -1.902 1.00 . A A . 4 CYS CA 1 1 5 2532 1 1 4 CYS CB C -8.178 10.836 -3.266 1.00 . A A . 4 CYS CB 1 1 5 2533 1 1 4 CYS H H -9.022 11.926 -0.576 1.00 . A A . 4 CYS H 1 1 5 2534 1 1 4 CYS HA H -9.252 9.445 -2.046 1.00 . A A . 4 CYS HA 1 1 5 2535 1 1 4 CYS HB2 H -7.814 11.847 -3.158 1.00 . A A . 4 CYS HB2 1 1 5 2536 1 1 4 CYS HB3 H -7.378 10.207 -3.628 1.00 . A A . 4 CYS HB3 1 1 5 2537 1 1 4 CYS N N -9.447 11.329 -1.227 1.00 . A A . 4 CYS N 1 1 5 2538 1 1 4 CYS O O -6.507 10.736 -0.874 1.00 . A A . 4 CYS O 1 1 5 2539 1 1 4 CYS SG S -9.488 10.853 -4.532 1.00 . A A . 4 CYS SG 1 1 5 2540 1 1 5 THR C C -5.102 7.951 -0.568 1.00 . A A . 5 THR C 1 1 5 2541 1 1 5 THR CA C -6.340 8.222 0.282 1.00 . A A . 5 THR CA 1 1 5 2542 1 1 5 THR CB C -6.761 6.950 1.019 1.00 . A A . 5 THR CB 1 1 5 2543 1 1 5 THR CG2 C -8.006 7.131 1.861 1.00 . A A . 5 THR CG2 1 1 5 2544 1 1 5 THR H H -8.198 8.125 -0.725 1.00 . A A . 5 THR H 1 1 5 2545 1 1 5 THR HA H -6.103 8.986 1.008 1.00 . A A . 5 THR HA 1 1 5 2546 1 1 5 THR HB H -5.960 6.644 1.676 1.00 . A A . 5 THR HB 1 1 5 2547 1 1 5 THR HG1 H -6.227 5.737 -0.424 1.00 . A A . 5 THR HG1 1 1 5 2548 1 1 5 THR HG21 H -7.969 8.091 2.355 1.00 . A A . 5 THR HG21 1 1 5 2549 1 1 5 THR HG22 H -8.879 7.086 1.227 1.00 . A A . 5 THR HG22 1 1 5 2550 1 1 5 THR HG23 H -8.058 6.346 2.601 1.00 . A A . 5 THR HG23 1 1 5 2551 1 1 5 THR N N -7.436 8.714 -0.543 1.00 . A A . 5 THR N 1 1 5 2552 1 1 5 THR O O -5.051 6.971 -1.311 1.00 . A A . 5 THR O 1 1 5 2553 1 1 5 THR OG1 O -7.013 5.899 0.103 1.00 . A A . 5 THR OG1 1 1 5 2554 1 1 6 THR C C -1.832 7.898 -0.426 1.00 . A A . 6 THR C 1 1 5 2555 1 1 6 THR CA C -2.873 8.684 -1.217 1.00 . A A . 6 THR CA 1 1 5 2556 1 1 6 THR CB C -2.317 10.060 -1.588 1.00 . A A . 6 THR CB 1 1 5 2557 1 1 6 THR CG2 C -1.666 10.093 -2.954 1.00 . A A . 6 THR CG2 1 1 5 2558 1 1 6 THR H H -4.211 9.590 0.152 1.00 . A A . 6 THR H 1 1 5 2559 1 1 6 THR HA H -3.103 8.143 -2.122 1.00 . A A . 6 THR HA 1 1 5 2560 1 1 6 THR HB H -1.571 10.344 -0.860 1.00 . A A . 6 THR HB 1 1 5 2561 1 1 6 THR HG1 H -4.063 10.750 -2.145 1.00 . A A . 6 THR HG1 1 1 5 2562 1 1 6 THR HG21 H -2.365 9.732 -3.694 1.00 . A A . 6 THR HG21 1 1 5 2563 1 1 6 THR HG22 H -1.381 11.107 -3.193 1.00 . A A . 6 THR HG22 1 1 5 2564 1 1 6 THR HG23 H -0.789 9.463 -2.950 1.00 . A A . 6 THR HG23 1 1 5 2565 1 1 6 THR N N -4.109 8.828 -0.456 1.00 . A A . 6 THR N 1 1 5 2566 1 1 6 THR O O -1.863 7.869 0.804 1.00 . A A . 6 THR O 1 1 5 2567 1 1 6 THR OG1 O -3.343 11.036 -1.577 1.00 . A A . 6 THR OG1 1 1 5 2568 1 1 7 GLY C C 0.466 5.217 -1.258 1.00 . A A . 7 GLY C 1 1 5 2569 1 1 7 GLY CA C 0.129 6.485 -0.495 1.00 . A A . 7 GLY CA 1 1 5 2570 1 1 7 GLY H H -0.936 7.323 -2.121 1.00 . A A . 7 GLY H 1 1 5 2571 1 1 7 GLY HA2 H -0.203 6.217 0.497 1.00 . A A . 7 GLY HA2 1 1 5 2572 1 1 7 GLY HA3 H 1.019 7.091 -0.414 1.00 . A A . 7 GLY HA3 1 1 5 2573 1 1 7 GLY N N -0.910 7.263 -1.143 1.00 . A A . 7 GLY N 1 1 5 2574 1 1 7 GLY O O 0.006 5.029 -2.385 1.00 . A A . 7 GLY O 1 1 5 2575 1 1 8 PRO C C 0.508 2.076 -1.411 1.00 . A A . 8 PRO C 1 1 5 2576 1 1 8 PRO CA C 1.666 3.064 -1.313 1.00 . A A . 8 PRO CA 1 1 5 2577 1 1 8 PRO CB C 2.761 2.518 -0.395 1.00 . A A . 8 PRO CB 1 1 5 2578 1 1 8 PRO CD C 1.871 4.463 0.675 1.00 . A A . 8 PRO CD 1 1 5 2579 1 1 8 PRO CG C 2.465 3.107 0.940 1.00 . A A . 8 PRO CG 1 1 5 2580 1 1 8 PRO HA H 2.073 3.237 -2.299 1.00 . A A . 8 PRO HA 1 1 5 2581 1 1 8 PRO HB2 H 2.709 1.439 -0.372 1.00 . A A . 8 PRO HB2 1 1 5 2582 1 1 8 PRO HB3 H 3.729 2.830 -0.758 1.00 . A A . 8 PRO HB3 1 1 5 2583 1 1 8 PRO HD2 H 1.114 4.694 1.410 1.00 . A A . 8 PRO HD2 1 1 5 2584 1 1 8 PRO HD3 H 2.642 5.219 0.675 1.00 . A A . 8 PRO HD3 1 1 5 2585 1 1 8 PRO HG2 H 1.757 2.484 1.467 1.00 . A A . 8 PRO HG2 1 1 5 2586 1 1 8 PRO HG3 H 3.378 3.203 1.509 1.00 . A A . 8 PRO HG3 1 1 5 2587 1 1 8 PRO N N 1.275 4.321 -0.667 1.00 . A A . 8 PRO N 1 1 5 2588 1 1 8 PRO O O 0.364 1.371 -2.409 1.00 . A A . 8 PRO O 1 1 5 2589 1 1 9 CYS C C -2.694 1.796 -0.944 1.00 . A A . 9 CYS C 1 1 5 2590 1 1 9 CYS CA C -1.461 1.128 -0.339 1.00 . A A . 9 CYS CA 1 1 5 2591 1 1 9 CYS CB C -1.748 0.683 1.098 1.00 . A A . 9 CYS CB 1 1 5 2592 1 1 9 CYS H H -0.149 2.617 0.399 1.00 . A A . 9 CYS H 1 1 5 2593 1 1 9 CYS HA H -1.212 0.260 -0.931 1.00 . A A . 9 CYS HA 1 1 5 2594 1 1 9 CYS HB2 H -1.281 1.375 1.781 1.00 . A A . 9 CYS HB2 1 1 5 2595 1 1 9 CYS HB3 H -2.815 0.687 1.264 1.00 . A A . 9 CYS HB3 1 1 5 2596 1 1 9 CYS N N -0.315 2.030 -0.368 1.00 . A A . 9 CYS N 1 1 5 2597 1 1 9 CYS O O -3.755 1.854 -0.321 1.00 . A A . 9 CYS O 1 1 5 2598 1 1 9 CYS SG S -1.132 -0.985 1.495 1.00 . A A . 9 CYS SG 1 1 5 2599 1 1 10 CYS C C -3.188 3.463 -4.230 1.00 . A A . 10 CYS C 1 1 5 2600 1 1 10 CYS CA C -3.641 2.966 -2.861 1.00 . A A . 10 CYS CA 1 1 5 2601 1 1 10 CYS CB C -4.181 4.136 -2.032 1.00 . A A . 10 CYS CB 1 1 5 2602 1 1 10 CYS H H -1.675 2.223 -2.609 1.00 . A A . 10 CYS H 1 1 5 2603 1 1 10 CYS HA H -4.431 2.242 -3.000 1.00 . A A . 10 CYS HA 1 1 5 2604 1 1 10 CYS HB2 H -4.605 4.872 -2.698 1.00 . A A . 10 CYS HB2 1 1 5 2605 1 1 10 CYS HB3 H -4.953 3.771 -1.370 1.00 . A A . 10 CYS HB3 1 1 5 2606 1 1 10 CYS N N -2.545 2.300 -2.165 1.00 . A A . 10 CYS N 1 1 5 2607 1 1 10 CYS O O -2.185 4.168 -4.344 1.00 . A A . 10 CYS O 1 1 5 2608 1 1 10 CYS SG S -2.927 4.979 -1.009 1.00 . A A . 10 CYS SG 1 1 5 2609 1 1 11 ARG C C -3.633 5.013 -6.772 1.00 . A A . 11 ARG C 1 1 5 2610 1 1 11 ARG CA C -3.597 3.491 -6.628 1.00 . A A . 11 ARG CA 1 1 5 2611 1 1 11 ARG CB C -4.553 2.828 -7.627 1.00 . A A . 11 ARG CB 1 1 5 2612 1 1 11 ARG CD C -3.049 2.780 -9.640 1.00 . A A . 11 ARG CD 1 1 5 2613 1 1 11 ARG CG C -4.359 3.292 -9.062 1.00 . A A . 11 ARG CG 1 1 5 2614 1 1 11 ARG CZ C -2.315 1.633 -11.693 1.00 . A A . 11 ARG CZ 1 1 5 2615 1 1 11 ARG H H -4.714 2.521 -5.114 1.00 . A A . 11 ARG H 1 1 5 2616 1 1 11 ARG HA H -2.594 3.153 -6.832 1.00 . A A . 11 ARG HA 1 1 5 2617 1 1 11 ARG HB2 H -4.402 1.759 -7.595 1.00 . A A . 11 ARG HB2 1 1 5 2618 1 1 11 ARG HB3 H -5.570 3.046 -7.335 1.00 . A A . 11 ARG HB3 1 1 5 2619 1 1 11 ARG HD2 H -2.302 3.555 -9.545 1.00 . A A . 11 ARG HD2 1 1 5 2620 1 1 11 ARG HD3 H -2.738 1.911 -9.079 1.00 . A A . 11 ARG HD3 1 1 5 2621 1 1 11 ARG HE H -3.947 2.773 -11.540 1.00 . A A . 11 ARG HE 1 1 5 2622 1 1 11 ARG HG2 H -5.175 2.921 -9.664 1.00 . A A . 11 ARG HG2 1 1 5 2623 1 1 11 ARG HG3 H -4.355 4.372 -9.083 1.00 . A A . 11 ARG HG3 1 1 5 2624 1 1 11 ARG HH11 H -1.112 1.341 -10.094 1.00 . A A . 11 ARG HH11 1 1 5 2625 1 1 11 ARG HH12 H -0.618 0.545 -11.551 1.00 . A A . 11 ARG HH12 1 1 5 2626 1 1 11 ARG HH21 H -3.299 1.726 -13.456 1.00 . A A . 11 ARG HH21 1 1 5 2627 1 1 11 ARG HH22 H -1.859 0.764 -13.460 1.00 . A A . 11 ARG HH22 1 1 5 2628 1 1 11 ARG N N -3.929 3.086 -5.267 1.00 . A A . 11 ARG N 1 1 5 2629 1 1 11 ARG NE N -3.178 2.416 -11.049 1.00 . A A . 11 ARG NE 1 1 5 2630 1 1 11 ARG NH1 N -1.262 1.132 -11.061 1.00 . A A . 11 ARG NH1 1 1 5 2631 1 1 11 ARG NH2 N -2.507 1.351 -12.975 1.00 . A A . 11 ARG NH2 1 1 5 2632 1 1 11 ARG O O -2.616 5.682 -6.589 1.00 . A A . 11 ARG O 1 1 5 2633 1 1 12 GLN C C -6.033 7.556 -6.348 1.00 . A A . 12 GLN C 1 1 5 2634 1 1 12 GLN CA C -4.951 6.997 -7.270 1.00 . A A . 12 GLN CA 1 1 5 2635 1 1 12 GLN CB C -5.288 7.328 -8.725 1.00 . A A . 12 GLN CB 1 1 5 2636 1 1 12 GLN CD C -4.632 8.718 -10.729 1.00 . A A . 12 GLN CD 1 1 5 2637 1 1 12 GLN CG C -4.658 8.621 -9.217 1.00 . A A . 12 GLN CG 1 1 5 2638 1 1 12 GLN H H -5.578 4.977 -7.239 1.00 . A A . 12 GLN H 1 1 5 2639 1 1 12 GLN HA H -4.009 7.459 -7.017 1.00 . A A . 12 GLN HA 1 1 5 2640 1 1 12 GLN HB2 H -4.941 6.522 -9.355 1.00 . A A . 12 GLN HB2 1 1 5 2641 1 1 12 GLN HB3 H -6.360 7.415 -8.824 1.00 . A A . 12 GLN HB3 1 1 5 2642 1 1 12 GLN HE21 H -6.470 9.477 -10.737 1.00 . A A . 12 GLN HE21 1 1 5 2643 1 1 12 GLN HE22 H -5.731 9.283 -12.287 1.00 . A A . 12 GLN HE22 1 1 5 2644 1 1 12 GLN HG2 H -5.225 9.453 -8.828 1.00 . A A . 12 GLN HG2 1 1 5 2645 1 1 12 GLN HG3 H -3.644 8.675 -8.849 1.00 . A A . 12 GLN HG3 1 1 5 2646 1 1 12 GLN N N -4.801 5.556 -7.102 1.00 . A A . 12 GLN N 1 1 5 2647 1 1 12 GLN NE2 N -5.721 9.209 -11.310 1.00 . A A . 12 GLN NE2 1 1 5 2648 1 1 12 GLN O O -6.068 8.756 -6.078 1.00 . A A . 12 GLN O 1 1 5 2649 1 1 12 GLN OE1 O -3.644 8.357 -11.369 1.00 . A A . 12 GLN OE1 1 1 5 2650 1 1 13 CYS C C -8.823 5.907 -4.518 1.00 . A A . 13 CYS C 1 1 5 2651 1 1 13 CYS CA C -7.997 7.103 -4.982 1.00 . A A . 13 CYS CA 1 1 5 2652 1 1 13 CYS CB C -8.900 8.114 -5.692 1.00 . A A . 13 CYS CB 1 1 5 2653 1 1 13 CYS H H -6.844 5.739 -6.117 1.00 . A A . 13 CYS H 1 1 5 2654 1 1 13 CYS HA H -7.552 7.575 -4.119 1.00 . A A . 13 CYS HA 1 1 5 2655 1 1 13 CYS HB2 H -8.288 8.887 -6.131 1.00 . A A . 13 CYS HB2 1 1 5 2656 1 1 13 CYS HB3 H -9.447 7.608 -6.475 1.00 . A A . 13 CYS HB3 1 1 5 2657 1 1 13 CYS N N -6.917 6.683 -5.869 1.00 . A A . 13 CYS N 1 1 5 2658 1 1 13 CYS O O -10.040 6.008 -4.360 1.00 . A A . 13 CYS O 1 1 5 2659 1 1 13 CYS SG S -10.114 8.923 -4.601 1.00 . A A . 13 CYS SG 1 1 5 2660 1 1 14 LYS C C -7.900 2.687 -3.040 1.00 . A A . 14 LYS C 1 1 5 2661 1 1 14 LYS CA C -8.840 3.568 -3.854 1.00 . A A . 14 LYS CA 1 1 5 2662 1 1 14 LYS CB C -9.380 2.788 -5.055 1.00 . A A . 14 LYS CB 1 1 5 2663 1 1 14 LYS CD C -11.058 3.073 -6.903 1.00 . A A . 14 LYS CD 1 1 5 2664 1 1 14 LYS CE C -12.529 2.870 -7.226 1.00 . A A . 14 LYS CE 1 1 5 2665 1 1 14 LYS CG C -10.820 3.127 -5.402 1.00 . A A . 14 LYS CG 1 1 5 2666 1 1 14 LYS H H -7.189 4.753 -4.442 1.00 . A A . 14 LYS H 1 1 5 2667 1 1 14 LYS HA H -9.667 3.866 -3.228 1.00 . A A . 14 LYS HA 1 1 5 2668 1 1 14 LYS HB2 H -8.764 3.003 -5.915 1.00 . A A . 14 LYS HB2 1 1 5 2669 1 1 14 LYS HB3 H -9.324 1.731 -4.838 1.00 . A A . 14 LYS HB3 1 1 5 2670 1 1 14 LYS HD2 H -10.728 4.002 -7.343 1.00 . A A . 14 LYS HD2 1 1 5 2671 1 1 14 LYS HD3 H -10.490 2.253 -7.318 1.00 . A A . 14 LYS HD3 1 1 5 2672 1 1 14 LYS HE2 H -12.996 2.346 -6.406 1.00 . A A . 14 LYS HE2 1 1 5 2673 1 1 14 LYS HE3 H -12.995 3.837 -7.347 1.00 . A A . 14 LYS HE3 1 1 5 2674 1 1 14 LYS HG2 H -11.474 2.416 -4.919 1.00 . A A . 14 LYS HG2 1 1 5 2675 1 1 14 LYS HG3 H -11.041 4.123 -5.047 1.00 . A A . 14 LYS HG3 1 1 5 2676 1 1 14 LYS HZ1 H -11.974 1.362 -8.561 1.00 . A A . 14 LYS HZ1 1 1 5 2677 1 1 14 LYS HZ2 H -13.645 1.605 -8.459 1.00 . A A . 14 LYS HZ2 1 1 5 2678 1 1 14 LYS HZ3 H -12.679 2.708 -9.304 1.00 . A A . 14 LYS HZ3 1 1 5 2679 1 1 14 LYS N N -8.159 4.776 -4.300 1.00 . A A . 14 LYS N 1 1 5 2680 1 1 14 LYS NZ N -12.720 2.081 -8.475 1.00 . A A . 14 LYS NZ 1 1 5 2681 1 1 14 LYS O O -6.823 2.315 -3.506 1.00 . A A . 14 LYS O 1 1 5 2682 1 1 15 LEU C C -7.082 0.235 -1.659 1.00 . A A . 15 LEU C 1 1 5 2683 1 1 15 LEU CA C -7.508 1.513 -0.943 1.00 . A A . 15 LEU CA 1 1 5 2684 1 1 15 LEU CB C -8.290 1.166 0.326 1.00 . A A . 15 LEU CB 1 1 5 2685 1 1 15 LEU CD1 C -9.049 1.823 2.623 1.00 . A A . 15 LEU CD1 1 1 5 2686 1 1 15 LEU CD2 C -6.626 1.964 2.021 1.00 . A A . 15 LEU CD2 1 1 5 2687 1 1 15 LEU CG C -8.052 2.104 1.510 1.00 . A A . 15 LEU CG 1 1 5 2688 1 1 15 LEU H H -9.183 2.679 -1.506 1.00 . A A . 15 LEU H 1 1 5 2689 1 1 15 LEU HA H -6.625 2.070 -0.670 1.00 . A A . 15 LEU HA 1 1 5 2690 1 1 15 LEU HB2 H -9.344 1.180 0.088 1.00 . A A . 15 LEU HB2 1 1 5 2691 1 1 15 LEU HB3 H -8.020 0.166 0.629 1.00 . A A . 15 LEU HB3 1 1 5 2692 1 1 15 LEU HD11 H -10.053 1.963 2.250 1.00 . A A . 15 LEU HD11 1 1 5 2693 1 1 15 LEU HD12 H -8.930 0.805 2.963 1.00 . A A . 15 LEU HD12 1 1 5 2694 1 1 15 LEU HD13 H -8.872 2.500 3.445 1.00 . A A . 15 LEU HD13 1 1 5 2695 1 1 15 LEU HD21 H -5.936 2.070 1.197 1.00 . A A . 15 LEU HD21 1 1 5 2696 1 1 15 LEU HD22 H -6.429 2.730 2.755 1.00 . A A . 15 LEU HD22 1 1 5 2697 1 1 15 LEU HD23 H -6.500 0.991 2.473 1.00 . A A . 15 LEU HD23 1 1 5 2698 1 1 15 LEU HG H -8.193 3.125 1.186 1.00 . A A . 15 LEU HG 1 1 5 2699 1 1 15 LEU N N -8.314 2.353 -1.821 1.00 . A A . 15 LEU N 1 1 5 2700 1 1 15 LEU O O -7.907 -0.631 -1.948 1.00 . A A . 15 LEU O 1 1 5 2701 1 1 16 LYS C C -5.760 -2.337 -1.994 1.00 . A A . 16 LYS C 1 1 5 2702 1 1 16 LYS CA C -5.251 -1.045 -2.633 1.00 . A A . 16 LYS CA 1 1 5 2703 1 1 16 LYS CB C -3.721 -1.019 -2.610 1.00 . A A . 16 LYS CB 1 1 5 2704 1 1 16 LYS CD C -1.651 -0.797 -4.018 1.00 . A A . 16 LYS CD 1 1 5 2705 1 1 16 LYS CE C -1.067 -0.255 -5.312 1.00 . A A . 16 LYS CE 1 1 5 2706 1 1 16 LYS CG C -3.106 -0.388 -3.849 1.00 . A A . 16 LYS CG 1 1 5 2707 1 1 16 LYS H H -5.179 0.851 -1.692 1.00 . A A . 16 LYS H 1 1 5 2708 1 1 16 LYS HA H -5.587 -1.005 -3.658 1.00 . A A . 16 LYS HA 1 1 5 2709 1 1 16 LYS HB2 H -3.395 -0.458 -1.747 1.00 . A A . 16 LYS HB2 1 1 5 2710 1 1 16 LYS HB3 H -3.356 -2.032 -2.530 1.00 . A A . 16 LYS HB3 1 1 5 2711 1 1 16 LYS HD2 H -1.080 -0.411 -3.187 1.00 . A A . 16 LYS HD2 1 1 5 2712 1 1 16 LYS HD3 H -1.590 -1.876 -4.029 1.00 . A A . 16 LYS HD3 1 1 5 2713 1 1 16 LYS HE2 H -1.839 -0.253 -6.068 1.00 . A A . 16 LYS HE2 1 1 5 2714 1 1 16 LYS HE3 H -0.728 0.756 -5.143 1.00 . A A . 16 LYS HE3 1 1 5 2715 1 1 16 LYS HG2 H -3.662 -0.707 -4.718 1.00 . A A . 16 LYS HG2 1 1 5 2716 1 1 16 LYS HG3 H -3.160 0.687 -3.758 1.00 . A A . 16 LYS HG3 1 1 5 2717 1 1 16 LYS HZ1 H -0.200 -2.077 -5.851 1.00 . A A . 16 LYS HZ1 1 1 5 2718 1 1 16 LYS HZ2 H 0.379 -0.756 -6.734 1.00 . A A . 16 LYS HZ2 1 1 5 2719 1 1 16 LYS HZ3 H 0.881 -0.989 -5.136 1.00 . A A . 16 LYS HZ3 1 1 5 2720 1 1 16 LYS N N -5.787 0.126 -1.946 1.00 . A A . 16 LYS N 1 1 5 2721 1 1 16 LYS NZ N 0.078 -1.077 -5.792 1.00 . A A . 16 LYS NZ 1 1 5 2722 1 1 16 LYS O O -5.996 -2.390 -0.787 1.00 . A A . 16 LYS O 1 1 5 2723 1 1 17 PRO C C -5.426 -5.367 -1.366 1.00 . A A . 17 PRO C 1 1 5 2724 1 1 17 PRO CA C -6.422 -4.692 -2.303 1.00 . A A . 17 PRO CA 1 1 5 2725 1 1 17 PRO CB C -6.603 -5.522 -3.578 1.00 . A A . 17 PRO CB 1 1 5 2726 1 1 17 PRO CD C -5.681 -3.423 -4.250 1.00 . A A . 17 PRO CD 1 1 5 2727 1 1 17 PRO CG C -5.700 -4.889 -4.579 1.00 . A A . 17 PRO CG 1 1 5 2728 1 1 17 PRO HA H -7.372 -4.589 -1.800 1.00 . A A . 17 PRO HA 1 1 5 2729 1 1 17 PRO HB2 H -6.322 -6.547 -3.385 1.00 . A A . 17 PRO HB2 1 1 5 2730 1 1 17 PRO HB3 H -7.634 -5.479 -3.895 1.00 . A A . 17 PRO HB3 1 1 5 2731 1 1 17 PRO HD2 H -4.715 -2.997 -4.479 1.00 . A A . 17 PRO HD2 1 1 5 2732 1 1 17 PRO HD3 H -6.461 -2.905 -4.787 1.00 . A A . 17 PRO HD3 1 1 5 2733 1 1 17 PRO HG2 H -4.707 -5.305 -4.493 1.00 . A A . 17 PRO HG2 1 1 5 2734 1 1 17 PRO HG3 H -6.088 -5.045 -5.574 1.00 . A A . 17 PRO HG3 1 1 5 2735 1 1 17 PRO N N -5.937 -3.399 -2.799 1.00 . A A . 17 PRO N 1 1 5 2736 1 1 17 PRO O O -4.228 -5.414 -1.647 1.00 . A A . 17 PRO O 1 1 5 2737 1 1 18 ALA C C -4.321 -7.720 0.086 1.00 . A A . 18 ALA C 1 1 5 2738 1 1 18 ALA CA C -5.086 -6.566 0.727 1.00 . A A . 18 ALA CA 1 1 5 2739 1 1 18 ALA CB C -5.928 -7.070 1.889 1.00 . A A . 18 ALA CB 1 1 5 2740 1 1 18 ALA H H -6.893 -5.822 -0.086 1.00 . A A . 18 ALA H 1 1 5 2741 1 1 18 ALA HA H -4.377 -5.846 1.111 1.00 . A A . 18 ALA HA 1 1 5 2742 1 1 18 ALA HB1 H -6.846 -6.503 1.941 1.00 . A A . 18 ALA HB1 1 1 5 2743 1 1 18 ALA HB2 H -6.157 -8.115 1.742 1.00 . A A . 18 ALA HB2 1 1 5 2744 1 1 18 ALA HB3 H -5.378 -6.949 2.811 1.00 . A A . 18 ALA HB3 1 1 5 2745 1 1 18 ALA N N -5.930 -5.890 -0.253 1.00 . A A . 18 ALA N 1 1 5 2746 1 1 18 ALA O O -4.919 -8.662 -0.433 1.00 . A A . 18 ALA O 1 1 5 2747 1 1 19 GLY C C -1.385 -8.191 -1.662 1.00 . A A . 19 GLY C 1 1 5 2748 1 1 19 GLY CA C -2.169 -8.677 -0.457 1.00 . A A . 19 GLY CA 1 1 5 2749 1 1 19 GLY H H -2.576 -6.861 0.550 1.00 . A A . 19 GLY H 1 1 5 2750 1 1 19 GLY HA2 H -2.802 -9.498 -0.761 1.00 . A A . 19 GLY HA2 1 1 5 2751 1 1 19 GLY HA3 H -1.474 -9.030 0.291 1.00 . A A . 19 GLY HA3 1 1 5 2752 1 1 19 GLY N N -2.996 -7.637 0.125 1.00 . A A . 19 GLY N 1 1 5 2753 1 1 19 GLY O O -0.899 -8.994 -2.459 1.00 . A A . 19 GLY O 1 1 5 2754 1 1 20 THR C C 0.726 -5.572 -2.419 1.00 . A A . 20 THR C 1 1 5 2755 1 1 20 THR CA C -0.531 -6.283 -2.911 1.00 . A A . 20 THR CA 1 1 5 2756 1 1 20 THR CB C -1.426 -5.299 -3.667 1.00 . A A . 20 THR CB 1 1 5 2757 1 1 20 THR CG2 C -0.742 -4.656 -4.854 1.00 . A A . 20 THR CG2 1 1 5 2758 1 1 20 THR H H -1.669 -6.284 -1.129 1.00 . A A . 20 THR H 1 1 5 2759 1 1 20 THR HA H -0.242 -7.080 -3.579 1.00 . A A . 20 THR HA 1 1 5 2760 1 1 20 THR HB H -1.728 -4.512 -2.992 1.00 . A A . 20 THR HB 1 1 5 2761 1 1 20 THR HG1 H -2.341 -6.710 -4.671 1.00 . A A . 20 THR HG1 1 1 5 2762 1 1 20 THR HG21 H 0.271 -4.392 -4.587 1.00 . A A . 20 THR HG21 1 1 5 2763 1 1 20 THR HG22 H -0.728 -5.350 -5.682 1.00 . A A . 20 THR HG22 1 1 5 2764 1 1 20 THR HG23 H -1.282 -3.765 -5.141 1.00 . A A . 20 THR HG23 1 1 5 2765 1 1 20 THR N N -1.261 -6.874 -1.796 1.00 . A A . 20 THR N 1 1 5 2766 1 1 20 THR O O 0.646 -4.572 -1.706 1.00 . A A . 20 THR O 1 1 5 2767 1 1 20 THR OG1 O -2.592 -5.948 -4.144 1.00 . A A . 20 THR OG1 1 1 5 2768 1 1 21 THR C C 3.292 -4.085 -2.922 1.00 . A A . 21 THR C 1 1 5 2769 1 1 21 THR CA C 3.158 -5.512 -2.397 1.00 . A A . 21 THR CA 1 1 5 2770 1 1 21 THR CB C 4.324 -6.369 -2.901 1.00 . A A . 21 THR CB 1 1 5 2771 1 1 21 THR CG2 C 5.181 -6.926 -1.784 1.00 . A A . 21 THR CG2 1 1 5 2772 1 1 21 THR H H 1.884 -6.896 -3.369 1.00 . A A . 21 THR H 1 1 5 2773 1 1 21 THR HA H 3.182 -5.488 -1.318 1.00 . A A . 21 THR HA 1 1 5 2774 1 1 21 THR HB H 4.959 -5.764 -3.532 1.00 . A A . 21 THR HB 1 1 5 2775 1 1 21 THR HG1 H 4.440 -7.613 -4.409 1.00 . A A . 21 THR HG1 1 1 5 2776 1 1 21 THR HG21 H 4.839 -6.533 -0.838 1.00 . A A . 21 THR HG21 1 1 5 2777 1 1 21 THR HG22 H 5.105 -8.003 -1.775 1.00 . A A . 21 THR HG22 1 1 5 2778 1 1 21 THR HG23 H 6.210 -6.639 -1.942 1.00 . A A . 21 THR HG23 1 1 5 2779 1 1 21 THR N N 1.885 -6.096 -2.802 1.00 . A A . 21 THR N 1 1 5 2780 1 1 21 THR O O 2.980 -3.807 -4.080 1.00 . A A . 21 THR O 1 1 5 2781 1 1 21 THR OG1 O 3.852 -7.464 -3.666 1.00 . A A . 21 THR OG1 1 1 5 2782 1 1 22 CYS C C 5.415 -1.440 -2.561 1.00 . A A . 22 CYS C 1 1 5 2783 1 1 22 CYS CA C 3.935 -1.788 -2.439 1.00 . A A . 22 CYS CA 1 1 5 2784 1 1 22 CYS CB C 3.267 -0.873 -1.410 1.00 . A A . 22 CYS CB 1 1 5 2785 1 1 22 CYS H H 3.991 -3.469 -1.153 1.00 . A A . 22 CYS H 1 1 5 2786 1 1 22 CYS HA H 3.463 -1.641 -3.398 1.00 . A A . 22 CYS HA 1 1 5 2787 1 1 22 CYS HB2 H 3.325 0.148 -1.757 1.00 . A A . 22 CYS HB2 1 1 5 2788 1 1 22 CYS HB3 H 2.229 -1.155 -1.310 1.00 . A A . 22 CYS HB3 1 1 5 2789 1 1 22 CYS N N 3.759 -3.186 -2.062 1.00 . A A . 22 CYS N 1 1 5 2790 1 1 22 CYS O O 5.821 -0.720 -3.473 1.00 . A A . 22 CYS O 1 1 5 2791 1 1 22 CYS SG S 4.023 -0.938 0.247 1.00 . A A . 22 CYS SG 1 1 5 2792 1 1 23 TRP C C 8.430 -2.976 -1.950 1.00 . A A . 23 TRP C 1 1 5 2793 1 1 23 TRP CA C 7.653 -1.701 -1.638 1.00 . A A . 23 TRP CA 1 1 5 2794 1 1 23 TRP CB C 8.091 -1.132 -0.285 1.00 . A A . 23 TRP CB 1 1 5 2795 1 1 23 TRP CD1 C 10.375 -1.291 0.866 1.00 . A A . 23 TRP CD1 1 1 5 2796 1 1 23 TRP CD2 C 10.423 -0.276 -1.130 1.00 . A A . 23 TRP CD2 1 1 5 2797 1 1 23 TRP CE2 C 11.730 -0.300 -0.606 1.00 . A A . 23 TRP CE2 1 1 5 2798 1 1 23 TRP CE3 C 10.210 0.313 -2.379 1.00 . A A . 23 TRP CE3 1 1 5 2799 1 1 23 TRP CG C 9.571 -0.917 -0.172 1.00 . A A . 23 TRP CG 1 1 5 2800 1 1 23 TRP CH2 C 12.578 0.813 -2.508 1.00 . A A . 23 TRP CH2 1 1 5 2801 1 1 23 TRP CZ2 C 12.816 0.243 -1.287 1.00 . A A . 23 TRP CZ2 1 1 5 2802 1 1 23 TRP CZ3 C 11.290 0.852 -3.054 1.00 . A A . 23 TRP CZ3 1 1 5 2803 1 1 23 TRP H H 5.834 -2.522 -0.933 1.00 . A A . 23 TRP H 1 1 5 2804 1 1 23 TRP HA H 7.857 -0.972 -2.408 1.00 . A A . 23 TRP HA 1 1 5 2805 1 1 23 TRP HB2 H 7.605 -0.181 -0.128 1.00 . A A . 23 TRP HB2 1 1 5 2806 1 1 23 TRP HB3 H 7.793 -1.816 0.497 1.00 . A A . 23 TRP HB3 1 1 5 2807 1 1 23 TRP HD1 H 10.026 -1.801 1.752 1.00 . A A . 23 TRP HD1 1 1 5 2808 1 1 23 TRP HE1 H 12.437 -1.084 1.208 1.00 . A A . 23 TRP HE1 1 1 5 2809 1 1 23 TRP HE3 H 9.225 0.354 -2.818 1.00 . A A . 23 TRP HE3 1 1 5 2810 1 1 23 TRP HH2 H 13.391 1.247 -3.070 1.00 . A A . 23 TRP HH2 1 1 5 2811 1 1 23 TRP HZ2 H 13.816 0.221 -0.880 1.00 . A A . 23 TRP HZ2 1 1 5 2812 1 1 23 TRP HZ3 H 11.144 1.312 -4.021 1.00 . A A . 23 TRP HZ3 1 1 5 2813 1 1 23 TRP N N 6.217 -1.956 -1.635 1.00 . A A . 23 TRP N 1 1 5 2814 1 1 23 TRP NE1 N 11.674 -0.924 0.613 1.00 . A A . 23 TRP NE1 1 1 5 2815 1 1 23 TRP O O 8.911 -3.660 -1.046 1.00 . A A . 23 TRP O 1 1 5 2816 1 1 24 ARG C C 9.918 -4.262 -5.031 1.00 . A A . 24 ARG C 1 1 5 2817 1 1 24 ARG CA C 9.265 -4.484 -3.670 1.00 . A A . 24 ARG CA 1 1 5 2818 1 1 24 ARG CB C 8.314 -5.681 -3.736 1.00 . A A . 24 ARG CB 1 1 5 2819 1 1 24 ARG CD C 8.213 -7.879 -4.952 1.00 . A A . 24 ARG CD 1 1 5 2820 1 1 24 ARG CG C 9.016 -7.002 -4.004 1.00 . A A . 24 ARG CG 1 1 5 2821 1 1 24 ARG CZ C 8.629 -9.690 -6.570 1.00 . A A . 24 ARG CZ 1 1 5 2822 1 1 24 ARG H H 8.142 -2.706 -3.910 1.00 . A A . 24 ARG H 1 1 5 2823 1 1 24 ARG HA H 10.037 -4.689 -2.943 1.00 . A A . 24 ARG HA 1 1 5 2824 1 1 24 ARG HB2 H 7.789 -5.761 -2.795 1.00 . A A . 24 ARG HB2 1 1 5 2825 1 1 24 ARG HB3 H 7.596 -5.512 -4.525 1.00 . A A . 24 ARG HB3 1 1 5 2826 1 1 24 ARG HD2 H 7.576 -8.527 -4.369 1.00 . A A . 24 ARG HD2 1 1 5 2827 1 1 24 ARG HD3 H 7.603 -7.245 -5.578 1.00 . A A . 24 ARG HD3 1 1 5 2828 1 1 24 ARG HE H 10.033 -8.501 -5.798 1.00 . A A . 24 ARG HE 1 1 5 2829 1 1 24 ARG HG2 H 9.981 -6.803 -4.446 1.00 . A A . 24 ARG HG2 1 1 5 2830 1 1 24 ARG HG3 H 9.148 -7.525 -3.068 1.00 . A A . 24 ARG HG3 1 1 5 2831 1 1 24 ARG HH11 H 6.689 -9.466 -6.043 1.00 . A A . 24 ARG HH11 1 1 5 2832 1 1 24 ARG HH12 H 7.007 -10.733 -7.179 1.00 . A A . 24 ARG HH12 1 1 5 2833 1 1 24 ARG HH21 H 10.455 -10.166 -7.294 1.00 . A A . 24 ARG HH21 1 1 5 2834 1 1 24 ARG HH22 H 9.145 -11.131 -7.889 1.00 . A A . 24 ARG HH22 1 1 5 2835 1 1 24 ARG N N 8.547 -3.291 -3.236 1.00 . A A . 24 ARG N 1 1 5 2836 1 1 24 ARG NE N 9.074 -8.699 -5.801 1.00 . A A . 24 ARG NE 1 1 5 2837 1 1 24 ARG NH1 N 7.335 -9.987 -6.599 1.00 . A A . 24 ARG NH1 1 1 5 2838 1 1 24 ARG NH2 N 9.479 -10.386 -7.312 1.00 . A A . 24 ARG NH2 1 1 5 2839 1 1 24 ARG O O 9.424 -4.739 -6.053 1.00 . A A . 24 ARG O 1 1 5 2840 1 1 25 THR C C 12.516 -4.479 -6.751 1.00 . A A . 25 THR C 1 1 5 2841 1 1 25 THR CA C 11.751 -3.250 -6.272 1.00 . A A . 25 THR CA 1 1 5 2842 1 1 25 THR CB C 12.716 -2.082 -6.066 1.00 . A A . 25 THR CB 1 1 5 2843 1 1 25 THR CG2 C 13.625 -2.261 -4.869 1.00 . A A . 25 THR CG2 1 1 5 2844 1 1 25 THR H H 11.375 -3.182 -4.189 1.00 . A A . 25 THR H 1 1 5 2845 1 1 25 THR HA H 11.025 -2.977 -7.023 1.00 . A A . 25 THR HA 1 1 5 2846 1 1 25 THR HB H 12.144 -1.178 -5.914 1.00 . A A . 25 THR HB 1 1 5 2847 1 1 25 THR HG1 H 14.143 -2.643 -7.284 1.00 . A A . 25 THR HG1 1 1 5 2848 1 1 25 THR HG21 H 14.045 -3.256 -4.882 1.00 . A A . 25 THR HG21 1 1 5 2849 1 1 25 THR HG22 H 14.422 -1.533 -4.910 1.00 . A A . 25 THR HG22 1 1 5 2850 1 1 25 THR HG23 H 13.057 -2.122 -3.961 1.00 . A A . 25 THR HG23 1 1 5 2851 1 1 25 THR N N 11.030 -3.535 -5.036 1.00 . A A . 25 THR N 1 1 5 2852 1 1 25 THR O O 12.671 -4.696 -7.953 1.00 . A A . 25 THR O 1 1 5 2853 1 1 25 THR OG1 O 13.537 -1.903 -7.206 1.00 . A A . 25 THR OG1 1 1 5 2854 1 1 26 SER C C 14.108 -7.256 -4.863 1.00 . A A . 26 SER C 1 1 5 2855 1 1 26 SER CA C 13.740 -6.488 -6.128 1.00 . A A . 26 SER CA 1 1 5 2856 1 1 26 SER CB C 15.007 -6.135 -6.910 1.00 . A A . 26 SER CB 1 1 5 2857 1 1 26 SER H H 12.834 -5.053 -4.863 1.00 . A A . 26 SER H 1 1 5 2858 1 1 26 SER HA H 13.111 -7.112 -6.741 1.00 . A A . 26 SER HA 1 1 5 2859 1 1 26 SER HB2 H 14.835 -5.236 -7.482 1.00 . A A . 26 SER HB2 1 1 5 2860 1 1 26 SER HB3 H 15.821 -5.973 -6.219 1.00 . A A . 26 SER HB3 1 1 5 2861 1 1 26 SER HG H 16.138 -6.918 -8.305 1.00 . A A . 26 SER HG 1 1 5 2862 1 1 26 SER N N 12.991 -5.280 -5.803 1.00 . A A . 26 SER N 1 1 5 2863 1 1 26 SER O O 14.047 -8.485 -4.829 1.00 . A A . 26 SER O 1 1 5 2864 1 1 26 SER OG O 15.365 -7.179 -7.800 1.00 . A A . 26 SER OG 1 1 5 2865 1 1 27 VAL C C 13.842 -6.807 -1.468 1.00 . A A . 27 VAL C 1 1 5 2866 1 1 27 VAL CA C 14.865 -7.127 -2.554 1.00 . A A . 27 VAL CA 1 1 5 2867 1 1 27 VAL CB C 16.258 -6.650 -2.096 1.00 . A A . 27 VAL CB 1 1 5 2868 1 1 27 VAL CG1 C 16.266 -5.144 -1.882 1.00 . A A . 27 VAL CG1 1 1 5 2869 1 1 27 VAL CG2 C 16.685 -7.379 -0.830 1.00 . A A . 27 VAL CG2 1 1 5 2870 1 1 27 VAL H H 14.514 -5.546 -3.916 1.00 . A A . 27 VAL H 1 1 5 2871 1 1 27 VAL HA H 14.903 -8.198 -2.694 1.00 . A A . 27 VAL HA 1 1 5 2872 1 1 27 VAL HB H 16.969 -6.882 -2.875 1.00 . A A . 27 VAL HB 1 1 5 2873 1 1 27 VAL HG11 H 15.490 -4.875 -1.180 1.00 . A A . 27 VAL HG11 1 1 5 2874 1 1 27 VAL HG12 H 17.226 -4.842 -1.489 1.00 . A A . 27 VAL HG12 1 1 5 2875 1 1 27 VAL HG13 H 16.089 -4.645 -2.823 1.00 . A A . 27 VAL HG13 1 1 5 2876 1 1 27 VAL HG21 H 15.927 -7.257 -0.071 1.00 . A A . 27 VAL HG21 1 1 5 2877 1 1 27 VAL HG22 H 16.812 -8.430 -1.046 1.00 . A A . 27 VAL HG22 1 1 5 2878 1 1 27 VAL HG23 H 17.619 -6.969 -0.476 1.00 . A A . 27 VAL HG23 1 1 5 2879 1 1 27 VAL N N 14.488 -6.521 -3.825 1.00 . A A . 27 VAL N 1 1 5 2880 1 1 27 VAL O O 13.616 -7.606 -0.559 1.00 . A A . 27 VAL O 1 1 5 2881 1 1 28 SER C C 10.921 -5.974 -0.787 1.00 . A A . 28 SER C 1 1 5 2882 1 1 28 SER CA C 12.226 -5.208 -0.598 1.00 . A A . 28 SER CA 1 1 5 2883 1 1 28 SER CB C 11.972 -3.705 -0.722 1.00 . A A . 28 SER CB 1 1 5 2884 1 1 28 SER H H 13.448 -5.041 -2.317 1.00 . A A . 28 SER H 1 1 5 2885 1 1 28 SER HA H 12.613 -5.418 0.388 1.00 . A A . 28 SER HA 1 1 5 2886 1 1 28 SER HB2 H 11.843 -3.449 -1.764 1.00 . A A . 28 SER HB2 1 1 5 2887 1 1 28 SER HB3 H 11.078 -3.447 -0.175 1.00 . A A . 28 SER HB3 1 1 5 2888 1 1 28 SER HG H 13.409 -2.383 -0.885 1.00 . A A . 28 SER HG 1 1 5 2889 1 1 28 SER N N 13.226 -5.634 -1.570 1.00 . A A . 28 SER N 1 1 5 2890 1 1 28 SER O O 10.774 -6.743 -1.737 1.00 . A A . 28 SER O 1 1 5 2891 1 1 28 SER OG O 13.058 -2.959 -0.201 1.00 . A A . 28 SER OG 1 1 5 2892 1 1 29 SER C C 7.760 -5.946 1.168 1.00 . A A . 29 SER C 1 1 5 2893 1 1 29 SER CA C 8.684 -6.430 0.055 1.00 . A A . 29 SER CA 1 1 5 2894 1 1 29 SER CB C 8.866 -7.946 0.152 1.00 . A A . 29 SER CB 1 1 5 2895 1 1 29 SER H H 10.154 -5.135 0.857 1.00 . A A . 29 SER H 1 1 5 2896 1 1 29 SER HA H 8.236 -6.191 -0.897 1.00 . A A . 29 SER HA 1 1 5 2897 1 1 29 SER HB2 H 9.858 -8.209 -0.185 1.00 . A A . 29 SER HB2 1 1 5 2898 1 1 29 SER HB3 H 8.741 -8.257 1.179 1.00 . A A . 29 SER HB3 1 1 5 2899 1 1 29 SER HG H 8.262 -8.728 -1.540 1.00 . A A . 29 SER HG 1 1 5 2900 1 1 29 SER N N 9.977 -5.760 0.123 1.00 . A A . 29 SER N 1 1 5 2901 1 1 29 SER O O 8.104 -6.014 2.348 1.00 . A A . 29 SER O 1 1 5 2902 1 1 29 SER OG O 7.917 -8.627 -0.650 1.00 . A A . 29 SER OG 1 1 5 2903 1 1 30 HIS C C 4.188 -5.143 1.230 1.00 . A A . 30 HIS C 1 1 5 2904 1 1 30 HIS CA C 5.610 -4.962 1.750 1.00 . A A . 30 HIS CA 1 1 5 2905 1 1 30 HIS CB C 5.870 -3.486 2.056 1.00 . A A . 30 HIS CB 1 1 5 2906 1 1 30 HIS CD2 C 8.347 -3.319 2.808 1.00 . A A . 30 HIS CD2 1 1 5 2907 1 1 30 HIS CE1 C 8.008 -2.804 4.912 1.00 . A A . 30 HIS CE1 1 1 5 2908 1 1 30 HIS CG C 7.008 -3.263 3.003 1.00 . A A . 30 HIS CG 1 1 5 2909 1 1 30 HIS H H 6.367 -5.431 -0.171 1.00 . A A . 30 HIS H 1 1 5 2910 1 1 30 HIS HA H 5.724 -5.535 2.659 1.00 . A A . 30 HIS HA 1 1 5 2911 1 1 30 HIS HB2 H 6.098 -2.970 1.136 1.00 . A A . 30 HIS HB2 1 1 5 2912 1 1 30 HIS HB3 H 4.982 -3.055 2.494 1.00 . A A . 30 HIS HB3 1 1 5 2913 1 1 30 HIS HD1 H 5.966 -2.824 4.782 1.00 . A A . 30 HIS HD1 1 1 5 2914 1 1 30 HIS HD2 H 8.851 -3.548 1.880 1.00 . A A . 30 HIS HD2 1 1 5 2915 1 1 30 HIS HE1 H 8.177 -2.553 5.949 1.00 . A A . 30 HIS HE1 1 1 5 2916 1 1 30 HIS HE2 H 9.907 -2.911 4.153 1.00 . A A . 30 HIS HE2 1 1 5 2917 1 1 30 HIS N N 6.585 -5.458 0.784 1.00 . A A . 30 HIS N 1 1 5 2918 1 1 30 HIS ND1 N 6.829 -2.939 4.332 1.00 . A A . 30 HIS ND1 1 1 5 2919 1 1 30 HIS NE2 N 8.945 -3.030 4.010 1.00 . A A . 30 HIS NE2 1 1 5 2920 1 1 30 HIS O O 3.664 -4.288 0.516 1.00 . A A . 30 HIS O 1 1 5 2921 1 1 31 TYR C C 1.220 -5.553 1.755 1.00 . A A . 31 TYR C 1 1 5 2922 1 1 31 TYR CA C 2.206 -6.555 1.163 1.00 . A A . 31 TYR CA 1 1 5 2923 1 1 31 TYR CB C 1.815 -7.976 1.572 1.00 . A A . 31 TYR CB 1 1 5 2924 1 1 31 TYR CD1 C 3.599 -9.053 0.147 1.00 . A A . 31 TYR CD1 1 1 5 2925 1 1 31 TYR CD2 C 1.421 -10.024 0.149 1.00 . A A . 31 TYR CD2 1 1 5 2926 1 1 31 TYR CE1 C 4.034 -10.022 -0.737 1.00 . A A . 31 TYR CE1 1 1 5 2927 1 1 31 TYR CE2 C 1.849 -10.996 -0.735 1.00 . A A . 31 TYR CE2 1 1 5 2928 1 1 31 TYR CG C 2.287 -9.038 0.605 1.00 . A A . 31 TYR CG 1 1 5 2929 1 1 31 TYR CZ C 3.156 -10.991 -1.175 1.00 . A A . 31 TYR CZ 1 1 5 2930 1 1 31 TYR H H 4.038 -6.905 2.163 1.00 . A A . 31 TYR H 1 1 5 2931 1 1 31 TYR HA H 2.175 -6.479 0.086 1.00 . A A . 31 TYR HA 1 1 5 2932 1 1 31 TYR HB2 H 2.243 -8.195 2.539 1.00 . A A . 31 TYR HB2 1 1 5 2933 1 1 31 TYR HB3 H 0.738 -8.041 1.638 1.00 . A A . 31 TYR HB3 1 1 5 2934 1 1 31 TYR HD1 H 4.284 -8.293 0.492 1.00 . A A . 31 TYR HD1 1 1 5 2935 1 1 31 TYR HD2 H 0.398 -10.025 0.495 1.00 . A A . 31 TYR HD2 1 1 5 2936 1 1 31 TYR HE1 H 5.058 -10.017 -1.082 1.00 . A A . 31 TYR HE1 1 1 5 2937 1 1 31 TYR HE2 H 1.161 -11.755 -1.078 1.00 . A A . 31 TYR HE2 1 1 5 2938 1 1 31 TYR HH H 4.116 -11.549 -2.744 1.00 . A A . 31 TYR HH 1 1 5 2939 1 1 31 TYR N N 3.568 -6.262 1.593 1.00 . A A . 31 TYR N 1 1 5 2940 1 1 31 TYR O O 1.437 -5.024 2.845 1.00 . A A . 31 TYR O 1 1 5 2941 1 1 31 TYR OH O 3.586 -11.957 -2.056 1.00 . A A . 31 TYR OH 1 1 5 2942 1 1 32 CYS C C -1.903 -5.059 2.376 1.00 . A A . 32 CYS C 1 1 5 2943 1 1 32 CYS CA C -0.883 -4.361 1.483 1.00 . A A . 32 CYS CA 1 1 5 2944 1 1 32 CYS CB C -1.589 -3.726 0.283 1.00 . A A . 32 CYS CB 1 1 5 2945 1 1 32 CYS H H 0.019 -5.751 0.169 1.00 . A A . 32 CYS H 1 1 5 2946 1 1 32 CYS HA H -0.393 -3.586 2.052 1.00 . A A . 32 CYS HA 1 1 5 2947 1 1 32 CYS HB2 H -0.853 -3.466 -0.462 1.00 . A A . 32 CYS HB2 1 1 5 2948 1 1 32 CYS HB3 H -2.281 -4.442 -0.137 1.00 . A A . 32 CYS HB3 1 1 5 2949 1 1 32 CYS N N 0.136 -5.298 1.030 1.00 . A A . 32 CYS N 1 1 5 2950 1 1 32 CYS O O -2.256 -6.215 2.146 1.00 . A A . 32 CYS O 1 1 5 2951 1 1 32 CYS SG S -2.526 -2.217 0.684 1.00 . A A . 32 CYS SG 1 1 5 2952 1 1 33 THR C C -4.779 -4.549 3.897 1.00 . A A . 33 THR C 1 1 5 2953 1 1 33 THR CA C -3.355 -4.903 4.322 1.00 . A A . 33 THR CA 1 1 5 2954 1 1 33 THR CB C -3.093 -4.389 5.739 1.00 . A A . 33 THR CB 1 1 5 2955 1 1 33 THR CG2 C -1.632 -4.430 6.128 1.00 . A A . 33 THR CG2 1 1 5 2956 1 1 33 THR H H -2.055 -3.432 3.528 1.00 . A A . 33 THR H 1 1 5 2957 1 1 33 THR HA H -3.247 -5.977 4.314 1.00 . A A . 33 THR HA 1 1 5 2958 1 1 33 THR HB H -3.639 -5.004 6.440 1.00 . A A . 33 THR HB 1 1 5 2959 1 1 33 THR HG1 H -4.498 -3.031 5.863 1.00 . A A . 33 THR HG1 1 1 5 2960 1 1 33 THR HG21 H -1.047 -4.789 5.293 1.00 . A A . 33 THR HG21 1 1 5 2961 1 1 33 THR HG22 H -1.303 -3.436 6.396 1.00 . A A . 33 THR HG22 1 1 5 2962 1 1 33 THR HG23 H -1.501 -5.092 6.971 1.00 . A A . 33 THR HG23 1 1 5 2963 1 1 33 THR N N -2.374 -4.349 3.396 1.00 . A A . 33 THR N 1 1 5 2964 1 1 33 THR O O -5.736 -4.826 4.620 1.00 . A A . 33 THR O 1 1 5 2965 1 1 33 THR OG1 O -3.539 -3.052 5.878 1.00 . A A . 33 THR OG1 1 1 5 2966 1 1 34 GLY C C -7.078 -2.862 3.273 1.00 . A A . 34 GLY C 1 1 5 2967 1 1 34 GLY CA C -6.228 -3.558 2.224 1.00 . A A . 34 GLY CA 1 1 5 2968 1 1 34 GLY H H -4.118 -3.741 2.185 1.00 . A A . 34 GLY H 1 1 5 2969 1 1 34 GLY HA2 H -6.743 -4.447 1.892 1.00 . A A . 34 GLY HA2 1 1 5 2970 1 1 34 GLY HA3 H -6.102 -2.893 1.383 1.00 . A A . 34 GLY HA3 1 1 5 2971 1 1 34 GLY N N -4.915 -3.936 2.721 1.00 . A A . 34 GLY N 1 1 5 2972 1 1 34 GLY O O -8.185 -3.306 3.575 1.00 . A A . 34 GLY O 1 1 5 2973 1 1 35 ARG C C -6.831 0.435 4.885 1.00 . A A . 35 ARG C 1 1 5 2974 1 1 35 ARG CA C -7.282 -1.020 4.849 1.00 . A A . 35 ARG CA 1 1 5 2975 1 1 35 ARG CB C -7.081 -1.662 6.223 1.00 . A A . 35 ARG CB 1 1 5 2976 1 1 35 ARG CD C -7.921 -3.375 7.858 1.00 . A A . 35 ARG CD 1 1 5 2977 1 1 35 ARG CG C -7.825 -2.976 6.395 1.00 . A A . 35 ARG CG 1 1 5 2978 1 1 35 ARG CZ C -10.313 -2.986 8.304 1.00 . A A . 35 ARG CZ 1 1 5 2979 1 1 35 ARG H H -5.672 -1.466 3.548 1.00 . A A . 35 ARG H 1 1 5 2980 1 1 35 ARG HA H -8.329 -1.050 4.599 1.00 . A A . 35 ARG HA 1 1 5 2981 1 1 35 ARG HB2 H -6.028 -1.848 6.370 1.00 . A A . 35 ARG HB2 1 1 5 2982 1 1 35 ARG HB3 H -7.427 -0.976 6.982 1.00 . A A . 35 ARG HB3 1 1 5 2983 1 1 35 ARG HD2 H -8.064 -4.443 7.919 1.00 . A A . 35 ARG HD2 1 1 5 2984 1 1 35 ARG HD3 H -6.998 -3.107 8.352 1.00 . A A . 35 ARG HD3 1 1 5 2985 1 1 35 ARG HE H -8.811 -2.021 9.197 1.00 . A A . 35 ARG HE 1 1 5 2986 1 1 35 ARG HG2 H -8.823 -2.870 5.995 1.00 . A A . 35 ARG HG2 1 1 5 2987 1 1 35 ARG HG3 H -7.299 -3.750 5.854 1.00 . A A . 35 ARG HG3 1 1 5 2988 1 1 35 ARG HH11 H -9.940 -4.408 6.914 1.00 . A A . 35 ARG HH11 1 1 5 2989 1 1 35 ARG HH12 H -11.614 -4.115 7.246 1.00 . A A . 35 ARG HH12 1 1 5 2990 1 1 35 ARG HH21 H -11.013 -1.635 9.635 1.00 . A A . 35 ARG HH21 1 1 5 2991 1 1 35 ARG HH22 H -12.224 -2.541 8.790 1.00 . A A . 35 ARG HH22 1 1 5 2992 1 1 35 ARG N N -6.559 -1.771 3.829 1.00 . A A . 35 ARG N 1 1 5 2993 1 1 35 ARG NE N -9.032 -2.710 8.535 1.00 . A A . 35 ARG NE 1 1 5 2994 1 1 35 ARG NH1 N -10.650 -3.912 7.415 1.00 . A A . 35 ARG NH1 1 1 5 2995 1 1 35 ARG NH2 N -11.261 -2.334 8.964 1.00 . A A . 35 ARG NH2 1 1 5 2996 1 1 35 ARG O O -7.652 1.350 4.939 1.00 . A A . 35 ARG O 1 1 5 2997 1 1 36 SER C C -3.812 2.124 3.891 1.00 . A A . 36 SER C 1 1 5 2998 1 1 36 SER CA C -4.957 1.986 4.889 1.00 . A A . 36 SER CA 1 1 5 2999 1 1 36 SER CB C -4.461 2.318 6.298 1.00 . A A . 36 SER CB 1 1 5 3000 1 1 36 SER H H -4.919 -0.130 4.816 1.00 . A A . 36 SER H 1 1 5 3001 1 1 36 SER HA H -5.739 2.680 4.620 1.00 . A A . 36 SER HA 1 1 5 3002 1 1 36 SER HB2 H -5.293 2.292 6.986 1.00 . A A . 36 SER HB2 1 1 5 3003 1 1 36 SER HB3 H -3.723 1.589 6.598 1.00 . A A . 36 SER HB3 1 1 5 3004 1 1 36 SER HG H -2.970 3.538 6.655 1.00 . A A . 36 SER HG 1 1 5 3005 1 1 36 SER N N -5.521 0.641 4.857 1.00 . A A . 36 SER N 1 1 5 3006 1 1 36 SER O O -3.201 1.133 3.491 1.00 . A A . 36 SER O 1 1 5 3007 1 1 36 SER OG O -3.875 3.608 6.342 1.00 . A A . 36 SER OG 1 1 5 3008 1 1 37 CYS C C -1.086 3.421 3.191 1.00 . A A . 37 CYS C 1 1 5 3009 1 1 37 CYS CA C -2.452 3.628 2.543 1.00 . A A . 37 CYS CA 1 1 5 3010 1 1 37 CYS CB C -2.562 5.055 2.004 1.00 . A A . 37 CYS CB 1 1 5 3011 1 1 37 CYS H H -4.047 4.110 3.849 1.00 . A A . 37 CYS H 1 1 5 3012 1 1 37 CYS HA H -2.557 2.935 1.723 1.00 . A A . 37 CYS HA 1 1 5 3013 1 1 37 CYS HB2 H -2.768 5.727 2.824 1.00 . A A . 37 CYS HB2 1 1 5 3014 1 1 37 CYS HB3 H -1.624 5.331 1.547 1.00 . A A . 37 CYS HB3 1 1 5 3015 1 1 37 CYS N N -3.525 3.360 3.494 1.00 . A A . 37 CYS N 1 1 5 3016 1 1 37 CYS O O -0.104 3.127 2.509 1.00 . A A . 37 CYS O 1 1 5 3017 1 1 37 CYS SG S -3.874 5.280 0.761 1.00 . A A . 37 CYS SG 1 1 5 3018 1 1 38 GLU C C 0.687 1.953 5.188 1.00 . A A . 38 GLU C 1 1 5 3019 1 1 38 GLU CA C 0.218 3.404 5.245 1.00 . A A . 38 GLU CA 1 1 5 3020 1 1 38 GLU CB C 0.040 3.838 6.701 1.00 . A A . 38 GLU CB 1 1 5 3021 1 1 38 GLU CD C 2.125 3.544 8.096 1.00 . A A . 38 GLU CD 1 1 5 3022 1 1 38 GLU CG C 1.272 4.505 7.292 1.00 . A A . 38 GLU CG 1 1 5 3023 1 1 38 GLU H H -1.845 3.810 5.000 1.00 . A A . 38 GLU H 1 1 5 3024 1 1 38 GLU HA H 0.965 4.030 4.781 1.00 . A A . 38 GLU HA 1 1 5 3025 1 1 38 GLU HB2 H -0.783 4.535 6.759 1.00 . A A . 38 GLU HB2 1 1 5 3026 1 1 38 GLU HB3 H -0.193 2.969 7.298 1.00 . A A . 38 GLU HB3 1 1 5 3027 1 1 38 GLU HG2 H 1.869 4.906 6.487 1.00 . A A . 38 GLU HG2 1 1 5 3028 1 1 38 GLU HG3 H 0.954 5.309 7.939 1.00 . A A . 38 GLU HG3 1 1 5 3029 1 1 38 GLU N N -1.029 3.575 4.510 1.00 . A A . 38 GLU N 1 1 5 3030 1 1 38 GLU O O 0.276 1.126 6.002 1.00 . A A . 38 GLU O 1 1 5 3031 1 1 38 GLU OE1 O 3.364 3.706 8.095 1.00 . A A . 38 GLU OE1 1 1 5 3032 1 1 38 GLU OE2 O 1.556 2.629 8.727 1.00 . A A . 38 GLU OE2 1 1 5 3033 1 1 39 CYS C C 2.802 -0.157 5.321 1.00 . A A . 39 CYS C 1 1 5 3034 1 1 39 CYS CA C 2.074 0.302 4.059 1.00 . A A . 39 CYS CA 1 1 5 3035 1 1 39 CYS CB C 3.019 0.241 2.856 1.00 . A A . 39 CYS CB 1 1 5 3036 1 1 39 CYS H H 1.839 2.356 3.605 1.00 . A A . 39 CYS H 1 1 5 3037 1 1 39 CYS HA H 1.238 -0.358 3.881 1.00 . A A . 39 CYS HA 1 1 5 3038 1 1 39 CYS HB2 H 3.139 1.236 2.453 1.00 . A A . 39 CYS HB2 1 1 5 3039 1 1 39 CYS HB3 H 3.981 -0.129 3.179 1.00 . A A . 39 CYS HB3 1 1 5 3040 1 1 39 CYS N N 1.549 1.653 4.222 1.00 . A A . 39 CYS N 1 1 5 3041 1 1 39 CYS O O 3.267 0.664 6.112 1.00 . A A . 39 CYS O 1 1 5 3042 1 1 39 CYS SG S 2.435 -0.835 1.507 1.00 . A A . 39 CYS SG 1 1 5 3043 1 1 40 PRO C C 4.986 -1.477 6.892 1.00 . A A . 40 PRO C 1 1 5 3044 1 1 40 PRO CA C 3.584 -2.047 6.700 1.00 . A A . 40 PRO CA 1 1 5 3045 1 1 40 PRO CB C 3.654 -3.542 6.384 1.00 . A A . 40 PRO CB 1 1 5 3046 1 1 40 PRO CD C 2.382 -2.530 4.633 1.00 . A A . 40 PRO CD 1 1 5 3047 1 1 40 PRO CG C 2.522 -3.785 5.448 1.00 . A A . 40 PRO CG 1 1 5 3048 1 1 40 PRO HA H 3.008 -1.892 7.600 1.00 . A A . 40 PRO HA 1 1 5 3049 1 1 40 PRO HB2 H 4.604 -3.772 5.925 1.00 . A A . 40 PRO HB2 1 1 5 3050 1 1 40 PRO HB3 H 3.541 -4.111 7.295 1.00 . A A . 40 PRO HB3 1 1 5 3051 1 1 40 PRO HD2 H 2.971 -2.598 3.730 1.00 . A A . 40 PRO HD2 1 1 5 3052 1 1 40 PRO HD3 H 1.344 -2.347 4.396 1.00 . A A . 40 PRO HD3 1 1 5 3053 1 1 40 PRO HG2 H 2.748 -4.625 4.808 1.00 . A A . 40 PRO HG2 1 1 5 3054 1 1 40 PRO HG3 H 1.616 -3.972 6.007 1.00 . A A . 40 PRO HG3 1 1 5 3055 1 1 40 PRO N N 2.909 -1.481 5.527 1.00 . A A . 40 PRO N 1 1 5 3056 1 1 40 PRO O O 5.663 -1.129 5.925 1.00 . A A . 40 PRO O 1 1 5 3057 1 1 41 SER C C 7.799 -1.944 8.343 1.00 . A A . 41 SER C 1 1 5 3058 1 1 41 SER CA C 6.736 -0.858 8.466 1.00 . A A . 41 SER CA 1 1 5 3059 1 1 41 SER CB C 6.747 -0.275 9.881 1.00 . A A . 41 SER CB 1 1 5 3060 1 1 41 SER H H 4.828 -1.679 8.875 1.00 . A A . 41 SER H 1 1 5 3061 1 1 41 SER HA H 6.958 -0.071 7.761 1.00 . A A . 41 SER HA 1 1 5 3062 1 1 41 SER HB2 H 7.732 0.106 10.103 1.00 . A A . 41 SER HB2 1 1 5 3063 1 1 41 SER HB3 H 6.028 0.528 9.943 1.00 . A A . 41 SER HB3 1 1 5 3064 1 1 41 SER HG H 7.217 -1.661 11.183 1.00 . A A . 41 SER HG 1 1 5 3065 1 1 41 SER N N 5.414 -1.385 8.147 1.00 . A A . 41 SER N 1 1 5 3066 1 1 41 SER O O 8.948 -1.666 7.999 1.00 . A A . 41 SER O 1 1 5 3067 1 1 41 SER OG O 6.413 -1.262 10.842 1.00 . A A . 41 SER OG 1 1 5 3068 1 1 42 TYR C C 8.064 -5.142 7.292 1.00 . A A . 42 TYR C 1 1 5 3069 1 1 42 TYR CA C 8.329 -4.311 8.546 1.00 . A A . 42 TYR CA 1 1 5 3070 1 1 42 TYR CB C 8.200 -5.190 9.791 1.00 . A A . 42 TYR CB 1 1 5 3071 1 1 42 TYR CD1 C 6.291 -6.751 9.251 1.00 . A A . 42 TYR CD1 1 1 5 3072 1 1 42 TYR CD2 C 5.988 -5.170 11.009 1.00 . A A . 42 TYR CD2 1 1 5 3073 1 1 42 TYR CE1 C 5.012 -7.232 9.458 1.00 . A A . 42 TYR CE1 1 1 5 3074 1 1 42 TYR CE2 C 4.709 -5.646 11.223 1.00 . A A . 42 TYR CE2 1 1 5 3075 1 1 42 TYR CG C 6.800 -5.714 10.021 1.00 . A A . 42 TYR CG 1 1 5 3076 1 1 42 TYR CZ C 4.225 -6.676 10.445 1.00 . A A . 42 TYR CZ 1 1 5 3077 1 1 42 TYR H H 6.480 -3.341 8.894 1.00 . A A . 42 TYR H 1 1 5 3078 1 1 42 TYR HA H 9.333 -3.917 8.497 1.00 . A A . 42 TYR HA 1 1 5 3079 1 1 42 TYR HB2 H 8.859 -6.040 9.693 1.00 . A A . 42 TYR HB2 1 1 5 3080 1 1 42 TYR HB3 H 8.488 -4.616 10.660 1.00 . A A . 42 TYR HB3 1 1 5 3081 1 1 42 TYR HD1 H 6.909 -7.185 8.479 1.00 . A A . 42 TYR HD1 1 1 5 3082 1 1 42 TYR HD2 H 6.370 -4.362 11.616 1.00 . A A . 42 TYR HD2 1 1 5 3083 1 1 42 TYR HE1 H 4.633 -8.040 8.849 1.00 . A A . 42 TYR HE1 1 1 5 3084 1 1 42 TYR HE2 H 4.093 -5.210 11.995 1.00 . A A . 42 TYR HE2 1 1 5 3085 1 1 42 TYR HH H 2.356 -6.417 10.815 1.00 . A A . 42 TYR HH 1 1 5 3086 1 1 42 TYR N N 7.409 -3.182 8.626 1.00 . A A . 42 TYR N 1 1 5 3087 1 1 42 TYR O O 6.937 -5.199 6.802 1.00 . A A . 42 TYR O 1 1 5 3088 1 1 42 TYR OH O 2.951 -7.153 10.654 1.00 . A A . 42 TYR OH 1 1 5 3089 1 1 43 PRO C C 7.857 -7.654 5.671 1.00 . A A . 43 PRO C 1 1 5 3090 1 1 43 PRO CA C 8.981 -6.631 5.553 1.00 . A A . 43 PRO CA 1 1 5 3091 1 1 43 PRO CB C 10.337 -7.334 5.463 1.00 . A A . 43 PRO CB 1 1 5 3092 1 1 43 PRO CD C 10.486 -5.786 7.278 1.00 . A A . 43 PRO CD 1 1 5 3093 1 1 43 PRO CG C 11.281 -6.430 6.176 1.00 . A A . 43 PRO CG 1 1 5 3094 1 1 43 PRO HA H 8.825 -6.027 4.671 1.00 . A A . 43 PRO HA 1 1 5 3095 1 1 43 PRO HB2 H 10.276 -8.301 5.942 1.00 . A A . 43 PRO HB2 1 1 5 3096 1 1 43 PRO HB3 H 10.614 -7.456 4.427 1.00 . A A . 43 PRO HB3 1 1 5 3097 1 1 43 PRO HD2 H 10.560 -6.367 8.186 1.00 . A A . 43 PRO HD2 1 1 5 3098 1 1 43 PRO HD3 H 10.824 -4.775 7.445 1.00 . A A . 43 PRO HD3 1 1 5 3099 1 1 43 PRO HG2 H 12.098 -7.004 6.589 1.00 . A A . 43 PRO HG2 1 1 5 3100 1 1 43 PRO HG3 H 11.655 -5.679 5.496 1.00 . A A . 43 PRO HG3 1 1 5 3101 1 1 43 PRO N N 9.106 -5.800 6.756 1.00 . A A . 43 PRO N 1 1 5 3102 1 1 43 PRO O O 7.800 -8.421 6.632 1.00 . A A . 43 PRO O 1 1 5 3103 1 1 44 GLY C C 4.787 -8.213 5.710 1.00 . A A . 44 GLY C 1 1 5 3104 1 1 44 GLY CA C 5.852 -8.593 4.701 1.00 . A A . 44 GLY CA 1 1 5 3105 1 1 44 GLY H H 7.059 -7.025 3.947 1.00 . A A . 44 GLY H 1 1 5 3106 1 1 44 GLY HA2 H 6.226 -9.577 4.941 1.00 . A A . 44 GLY HA2 1 1 5 3107 1 1 44 GLY HA3 H 5.407 -8.619 3.717 1.00 . A A . 44 GLY HA3 1 1 5 3108 1 1 44 GLY N N 6.963 -7.660 4.688 1.00 . A A . 44 GLY N 1 1 5 3109 1 1 44 GLY O O 4.754 -7.036 6.125 1.00 . A A . 44 GLY O 1 1 5 3110 1 1 44 GLY OXT O 3.985 -9.094 6.086 1.00 . A A . 44 GLY OXT 1 1 6 3111 1 1 1 ALA C C -13.401 11.554 5.187 1.00 . A A . 1 ALA C 1 1 6 3112 1 1 1 ALA CA C -14.760 12.245 5.218 1.00 . A A . 1 ALA CA 1 1 6 3113 1 1 1 ALA CB C -14.648 13.597 5.906 1.00 . A A . 1 ALA CB 1 1 6 3114 1 1 1 ALA H1 H -15.711 10.443 5.503 1.00 . A A . 1 ALA H1 1 1 6 3115 1 1 1 ALA H2 H -15.546 11.396 6.919 1.00 . A A . 1 ALA H2 1 1 6 3116 1 1 1 ALA H3 H -16.707 11.823 5.729 1.00 . A A . 1 ALA H3 1 1 6 3117 1 1 1 ALA HA H -15.089 12.412 4.203 1.00 . A A . 1 ALA HA 1 1 6 3118 1 1 1 ALA HB1 H -14.903 13.492 6.950 1.00 . A A . 1 ALA HB1 1 1 6 3119 1 1 1 ALA HB2 H -15.326 14.296 5.439 1.00 . A A . 1 ALA HB2 1 1 6 3120 1 1 1 ALA HB3 H -13.636 13.964 5.817 1.00 . A A . 1 ALA HB3 1 1 6 3121 1 1 1 ALA N N -15.772 11.401 5.904 1.00 . A A . 1 ALA N 1 1 6 3122 1 1 1 ALA O O -12.519 11.862 5.988 1.00 . A A . 1 ALA O 1 1 6 3123 1 1 2 MET C C -11.072 10.553 3.101 1.00 . A A . 2 MET C 1 1 6 3124 1 1 2 MET CA C -11.988 9.884 4.121 1.00 . A A . 2 MET CA 1 1 6 3125 1 1 2 MET CB C -12.264 8.438 3.704 1.00 . A A . 2 MET CB 1 1 6 3126 1 1 2 MET CE C -11.857 5.297 3.978 1.00 . A A . 2 MET CE 1 1 6 3127 1 1 2 MET CG C -13.100 7.664 4.710 1.00 . A A . 2 MET CG 1 1 6 3128 1 1 2 MET H H -13.981 10.418 3.646 1.00 . A A . 2 MET H 1 1 6 3129 1 1 2 MET HA H -11.497 9.885 5.082 1.00 . A A . 2 MET HA 1 1 6 3130 1 1 2 MET HB2 H -12.788 8.441 2.760 1.00 . A A . 2 MET HB2 1 1 6 3131 1 1 2 MET HB3 H -11.321 7.925 3.581 1.00 . A A . 2 MET HB3 1 1 6 3132 1 1 2 MET HE1 H -11.143 5.924 4.493 1.00 . A A . 2 MET HE1 1 1 6 3133 1 1 2 MET HE2 H -11.843 4.307 4.409 1.00 . A A . 2 MET HE2 1 1 6 3134 1 1 2 MET HE3 H -11.597 5.239 2.932 1.00 . A A . 2 MET HE3 1 1 6 3135 1 1 2 MET HG2 H -12.549 7.593 5.637 1.00 . A A . 2 MET HG2 1 1 6 3136 1 1 2 MET HG3 H -14.021 8.201 4.881 1.00 . A A . 2 MET HG3 1 1 6 3137 1 1 2 MET N N -13.240 10.619 4.256 1.00 . A A . 2 MET N 1 1 6 3138 1 1 2 MET O O -9.864 10.659 3.312 1.00 . A A . 2 MET O 1 1 6 3139 1 1 2 MET SD S -13.497 5.998 4.147 1.00 . A A . 2 MET SD 1 1 6 3140 1 1 3 ASP C C -9.825 10.729 0.378 1.00 . A A . 3 ASP C 1 1 6 3141 1 1 3 ASP CA C -10.891 11.662 0.942 1.00 . A A . 3 ASP CA 1 1 6 3142 1 1 3 ASP CB C -10.238 12.937 1.479 1.00 . A A . 3 ASP CB 1 1 6 3143 1 1 3 ASP CG C -11.252 13.917 2.034 1.00 . A A . 3 ASP CG 1 1 6 3144 1 1 3 ASP H H -12.622 10.889 1.884 1.00 . A A . 3 ASP H 1 1 6 3145 1 1 3 ASP HA H -11.577 11.926 0.151 1.00 . A A . 3 ASP HA 1 1 6 3146 1 1 3 ASP HB2 H -9.549 12.675 2.269 1.00 . A A . 3 ASP HB2 1 1 6 3147 1 1 3 ASP HB3 H -9.696 13.420 0.679 1.00 . A A . 3 ASP HB3 1 1 6 3148 1 1 3 ASP N N -11.655 11.003 1.995 1.00 . A A . 3 ASP N 1 1 6 3149 1 1 3 ASP O O -9.478 9.722 0.995 1.00 . A A . 3 ASP O 1 1 6 3150 1 1 3 ASP OD1 O -11.515 13.873 3.254 1.00 . A A . 3 ASP OD1 1 1 6 3151 1 1 3 ASP OD2 O -11.783 14.730 1.248 1.00 . A A . 3 ASP OD2 1 1 6 3152 1 1 4 CYS C C -7.010 10.224 -0.607 1.00 . A A . 4 CYS C 1 1 6 3153 1 1 4 CYS CA C -8.283 10.262 -1.446 1.00 . A A . 4 CYS CA 1 1 6 3154 1 1 4 CYS CB C -7.971 10.815 -2.838 1.00 . A A . 4 CYS CB 1 1 6 3155 1 1 4 CYS H H -9.627 11.885 -1.242 1.00 . A A . 4 CYS H 1 1 6 3156 1 1 4 CYS HA H -8.665 9.257 -1.546 1.00 . A A . 4 CYS HA 1 1 6 3157 1 1 4 CYS HB2 H -7.571 11.813 -2.739 1.00 . A A . 4 CYS HB2 1 1 6 3158 1 1 4 CYS HB3 H -7.233 10.183 -3.310 1.00 . A A . 4 CYS HB3 1 1 6 3159 1 1 4 CYS N N -9.310 11.070 -0.799 1.00 . A A . 4 CYS N 1 1 6 3160 1 1 4 CYS O O -6.291 11.218 -0.505 1.00 . A A . 4 CYS O 1 1 6 3161 1 1 4 CYS SG S -9.415 10.905 -3.944 1.00 . A A . 4 CYS SG 1 1 6 3162 1 1 5 THR C C -4.309 8.703 -0.050 1.00 . A A . 5 THR C 1 1 6 3163 1 1 5 THR CA C -5.548 8.900 0.818 1.00 . A A . 5 THR CA 1 1 6 3164 1 1 5 THR CB C -5.724 7.707 1.760 1.00 . A A . 5 THR CB 1 1 6 3165 1 1 5 THR CG2 C -4.788 7.742 2.950 1.00 . A A . 5 THR CG2 1 1 6 3166 1 1 5 THR H H -7.346 8.312 -0.131 1.00 . A A . 5 THR H 1 1 6 3167 1 1 5 THR HA H -5.423 9.796 1.406 1.00 . A A . 5 THR HA 1 1 6 3168 1 1 5 THR HB H -5.529 6.797 1.212 1.00 . A A . 5 THR HB 1 1 6 3169 1 1 5 THR HG1 H -7.284 8.502 2.637 1.00 . A A . 5 THR HG1 1 1 6 3170 1 1 5 THR HG21 H -3.769 7.829 2.603 1.00 . A A . 5 THR HG21 1 1 6 3171 1 1 5 THR HG22 H -5.031 8.589 3.574 1.00 . A A . 5 THR HG22 1 1 6 3172 1 1 5 THR HG23 H -4.898 6.831 3.520 1.00 . A A . 5 THR HG23 1 1 6 3173 1 1 5 THR N N -6.736 9.069 -0.010 1.00 . A A . 5 THR N 1 1 6 3174 1 1 5 THR O O -3.732 7.617 -0.092 1.00 . A A . 5 THR O 1 1 6 3175 1 1 5 THR OG1 O -7.049 7.652 2.258 1.00 . A A . 5 THR OG1 1 1 6 3176 1 1 6 THR C C -1.541 9.084 -0.910 1.00 . A A . 6 THR C 1 1 6 3177 1 1 6 THR CA C -2.737 9.714 -1.619 1.00 . A A . 6 THR CA 1 1 6 3178 1 1 6 THR CB C -2.376 11.120 -2.100 1.00 . A A . 6 THR CB 1 1 6 3179 1 1 6 THR CG2 C -3.065 11.506 -3.391 1.00 . A A . 6 THR CG2 1 1 6 3180 1 1 6 THR H H -4.410 10.602 -0.670 1.00 . A A . 6 THR H 1 1 6 3181 1 1 6 THR HA H -2.991 9.107 -2.475 1.00 . A A . 6 THR HA 1 1 6 3182 1 1 6 THR HB H -1.309 11.170 -2.266 1.00 . A A . 6 THR HB 1 1 6 3183 1 1 6 THR HG1 H -1.999 12.178 -0.494 1.00 . A A . 6 THR HG1 1 1 6 3184 1 1 6 THR HG21 H -3.654 10.674 -3.747 1.00 . A A . 6 THR HG21 1 1 6 3185 1 1 6 THR HG22 H -3.709 12.355 -3.215 1.00 . A A . 6 THR HG22 1 1 6 3186 1 1 6 THR HG23 H -2.322 11.765 -4.131 1.00 . A A . 6 THR HG23 1 1 6 3187 1 1 6 THR N N -3.906 9.764 -0.745 1.00 . A A . 6 THR N 1 1 6 3188 1 1 6 THR O O -1.041 9.618 0.080 1.00 . A A . 6 THR O 1 1 6 3189 1 1 6 THR OG1 O -2.719 12.088 -1.124 1.00 . A A . 6 THR OG1 1 1 6 3190 1 1 7 GLY C C 0.503 6.078 -1.667 1.00 . A A . 7 GLY C 1 1 6 3191 1 1 7 GLY CA C 0.042 7.258 -0.832 1.00 . A A . 7 GLY CA 1 1 6 3192 1 1 7 GLY H H -1.531 7.568 -2.215 1.00 . A A . 7 GLY H 1 1 6 3193 1 1 7 GLY HA2 H -0.239 6.904 0.149 1.00 . A A . 7 GLY HA2 1 1 6 3194 1 1 7 GLY HA3 H 0.860 7.956 -0.732 1.00 . A A . 7 GLY HA3 1 1 6 3195 1 1 7 GLY N N -1.090 7.945 -1.425 1.00 . A A . 7 GLY N 1 1 6 3196 1 1 7 GLY O O -0.081 5.790 -2.712 1.00 . A A . 7 GLY O 1 1 6 3197 1 1 8 PRO C C 1.131 3.019 -1.923 1.00 . A A . 8 PRO C 1 1 6 3198 1 1 8 PRO CA C 2.085 4.209 -1.954 1.00 . A A . 8 PRO CA 1 1 6 3199 1 1 8 PRO CB C 3.378 3.878 -1.206 1.00 . A A . 8 PRO CB 1 1 6 3200 1 1 8 PRO CD C 2.313 5.640 0.008 1.00 . A A . 8 PRO CD 1 1 6 3201 1 1 8 PRO CG C 3.171 4.415 0.167 1.00 . A A . 8 PRO CG 1 1 6 3202 1 1 8 PRO HA H 2.313 4.457 -2.981 1.00 . A A . 8 PRO HA 1 1 6 3203 1 1 8 PRO HB2 H 3.527 2.808 -1.195 1.00 . A A . 8 PRO HB2 1 1 6 3204 1 1 8 PRO HB3 H 4.213 4.358 -1.695 1.00 . A A . 8 PRO HB3 1 1 6 3205 1 1 8 PRO HD2 H 1.648 5.747 0.852 1.00 . A A . 8 PRO HD2 1 1 6 3206 1 1 8 PRO HD3 H 2.929 6.520 -0.103 1.00 . A A . 8 PRO HD3 1 1 6 3207 1 1 8 PRO HG2 H 2.666 3.680 0.776 1.00 . A A . 8 PRO HG2 1 1 6 3208 1 1 8 PRO HG3 H 4.122 4.678 0.606 1.00 . A A . 8 PRO HG3 1 1 6 3209 1 1 8 PRO N N 1.556 5.368 -1.228 1.00 . A A . 8 PRO N 1 1 6 3210 1 1 8 PRO O O 1.160 2.164 -2.808 1.00 . A A . 8 PRO O 1 1 6 3211 1 1 9 CYS C C -2.063 2.315 -1.222 1.00 . A A . 9 CYS C 1 1 6 3212 1 1 9 CYS CA C -0.676 1.882 -0.752 1.00 . A A . 9 CYS CA 1 1 6 3213 1 1 9 CYS CB C -0.735 1.418 0.705 1.00 . A A . 9 CYS CB 1 1 6 3214 1 1 9 CYS H H 0.310 3.679 -0.222 1.00 . A A . 9 CYS H 1 1 6 3215 1 1 9 CYS HA H -0.341 1.061 -1.368 1.00 . A A . 9 CYS HA 1 1 6 3216 1 1 9 CYS HB2 H -0.216 2.134 1.324 1.00 . A A . 9 CYS HB2 1 1 6 3217 1 1 9 CYS HB3 H -1.767 1.361 1.018 1.00 . A A . 9 CYS HB3 1 1 6 3218 1 1 9 CYS N N 0.286 2.969 -0.897 1.00 . A A . 9 CYS N 1 1 6 3219 1 1 9 CYS O O -3.078 1.831 -0.721 1.00 . A A . 9 CYS O 1 1 6 3220 1 1 9 CYS SG S 0.023 -0.213 0.996 1.00 . A A . 9 CYS SG 1 1 6 3221 1 1 10 CYS C C -3.382 3.604 -4.247 1.00 . A A . 10 CYS C 1 1 6 3222 1 1 10 CYS CA C -3.359 3.724 -2.727 1.00 . A A . 10 CYS CA 1 1 6 3223 1 1 10 CYS CB C -3.574 5.183 -2.315 1.00 . A A . 10 CYS CB 1 1 6 3224 1 1 10 CYS H H -1.255 3.574 -2.548 1.00 . A A . 10 CYS H 1 1 6 3225 1 1 10 CYS HA H -4.156 3.121 -2.317 1.00 . A A . 10 CYS HA 1 1 6 3226 1 1 10 CYS HB2 H -2.787 5.476 -1.637 1.00 . A A . 10 CYS HB2 1 1 6 3227 1 1 10 CYS HB3 H -3.535 5.808 -3.195 1.00 . A A . 10 CYS HB3 1 1 6 3228 1 1 10 CYS N N -2.097 3.227 -2.188 1.00 . A A . 10 CYS N 1 1 6 3229 1 1 10 CYS O O -2.336 3.504 -4.889 1.00 . A A . 10 CYS O 1 1 6 3230 1 1 10 CYS SG S -5.165 5.497 -1.483 1.00 . A A . 10 CYS SG 1 1 6 3231 1 1 11 ARG C C -5.457 4.741 -6.816 1.00 . A A . 11 ARG C 1 1 6 3232 1 1 11 ARG CA C -4.743 3.512 -6.263 1.00 . A A . 11 ARG CA 1 1 6 3233 1 1 11 ARG CB C -5.525 2.246 -6.621 1.00 . A A . 11 ARG CB 1 1 6 3234 1 1 11 ARG CD C -5.377 -0.224 -7.061 1.00 . A A . 11 ARG CD 1 1 6 3235 1 1 11 ARG CG C -4.646 1.108 -7.113 1.00 . A A . 11 ARG CG 1 1 6 3236 1 1 11 ARG CZ C -5.587 -0.787 -9.451 1.00 . A A . 11 ARG CZ 1 1 6 3237 1 1 11 ARG H H -5.379 3.700 -4.253 1.00 . A A . 11 ARG H 1 1 6 3238 1 1 11 ARG HA H -3.759 3.454 -6.703 1.00 . A A . 11 ARG HA 1 1 6 3239 1 1 11 ARG HB2 H -6.058 1.907 -5.745 1.00 . A A . 11 ARG HB2 1 1 6 3240 1 1 11 ARG HB3 H -6.238 2.482 -7.397 1.00 . A A . 11 ARG HB3 1 1 6 3241 1 1 11 ARG HD2 H -4.652 -1.013 -6.931 1.00 . A A . 11 ARG HD2 1 1 6 3242 1 1 11 ARG HD3 H -6.054 -0.215 -6.219 1.00 . A A . 11 ARG HD3 1 1 6 3243 1 1 11 ARG HE H -7.117 -0.412 -8.225 1.00 . A A . 11 ARG HE 1 1 6 3244 1 1 11 ARG HG2 H -4.353 1.306 -8.133 1.00 . A A . 11 ARG HG2 1 1 6 3245 1 1 11 ARG HG3 H -3.766 1.050 -6.489 1.00 . A A . 11 ARG HG3 1 1 6 3246 1 1 11 ARG HH11 H -3.683 -0.723 -8.769 1.00 . A A . 11 ARG HH11 1 1 6 3247 1 1 11 ARG HH12 H -3.858 -1.117 -10.446 1.00 . A A . 11 ARG HH12 1 1 6 3248 1 1 11 ARG HH21 H -7.348 -0.931 -10.431 1.00 . A A . 11 ARG HH21 1 1 6 3249 1 1 11 ARG HH22 H -5.938 -1.235 -11.390 1.00 . A A . 11 ARG HH22 1 1 6 3250 1 1 11 ARG N N -4.582 3.616 -4.818 1.00 . A A . 11 ARG N 1 1 6 3251 1 1 11 ARG NE N -6.140 -0.477 -8.281 1.00 . A A . 11 ARG NE 1 1 6 3252 1 1 11 ARG NH1 N -4.268 -0.883 -9.564 1.00 . A A . 11 ARG NH1 1 1 6 3253 1 1 11 ARG NH2 N -6.354 -1.002 -10.511 1.00 . A A . 11 ARG NH2 1 1 6 3254 1 1 11 ARG O O -6.662 4.712 -7.064 1.00 . A A . 11 ARG O 1 1 6 3255 1 1 12 GLN C C -6.161 7.736 -6.489 1.00 . A A . 12 GLN C 1 1 6 3256 1 1 12 GLN CA C -5.264 7.068 -7.523 1.00 . A A . 12 GLN CA 1 1 6 3257 1 1 12 GLN CB C -6.053 6.808 -8.809 1.00 . A A . 12 GLN CB 1 1 6 3258 1 1 12 GLN CD C -7.311 8.887 -9.497 1.00 . A A . 12 GLN CD 1 1 6 3259 1 1 12 GLN CG C -6.103 8.005 -9.744 1.00 . A A . 12 GLN CG 1 1 6 3260 1 1 12 GLN H H -3.751 5.784 -6.783 1.00 . A A . 12 GLN H 1 1 6 3261 1 1 12 GLN HA H -4.444 7.729 -7.744 1.00 . A A . 12 GLN HA 1 1 6 3262 1 1 12 GLN HB2 H -5.596 5.984 -9.338 1.00 . A A . 12 GLN HB2 1 1 6 3263 1 1 12 GLN HB3 H -7.066 6.539 -8.548 1.00 . A A . 12 GLN HB3 1 1 6 3264 1 1 12 GLN HE21 H -8.148 8.259 -11.187 1.00 . A A . 12 GLN HE21 1 1 6 3265 1 1 12 GLN HE22 H -9.063 9.408 -10.278 1.00 . A A . 12 GLN HE22 1 1 6 3266 1 1 12 GLN HG2 H -5.210 8.595 -9.602 1.00 . A A . 12 GLN HG2 1 1 6 3267 1 1 12 GLN HG3 H -6.139 7.648 -10.763 1.00 . A A . 12 GLN HG3 1 1 6 3268 1 1 12 GLN N N -4.705 5.823 -7.002 1.00 . A A . 12 GLN N 1 1 6 3269 1 1 12 GLN NE2 N -8.271 8.847 -10.413 1.00 . A A . 12 GLN NE2 1 1 6 3270 1 1 12 GLN O O -5.871 8.835 -6.014 1.00 . A A . 12 GLN O 1 1 6 3271 1 1 12 GLN OE1 O -7.380 9.597 -8.493 1.00 . A A . 12 GLN OE1 1 1 6 3272 1 1 13 CYS C C -8.962 6.449 -4.490 1.00 . A A . 13 CYS C 1 1 6 3273 1 1 13 CYS CA C -8.197 7.584 -5.166 1.00 . A A . 13 CYS CA 1 1 6 3274 1 1 13 CYS CB C -9.178 8.547 -5.838 1.00 . A A . 13 CYS CB 1 1 6 3275 1 1 13 CYS H H -7.421 6.195 -6.560 1.00 . A A . 13 CYS H 1 1 6 3276 1 1 13 CYS HA H -7.636 8.121 -4.416 1.00 . A A . 13 CYS HA 1 1 6 3277 1 1 13 CYS HB2 H -9.265 8.289 -6.882 1.00 . A A . 13 CYS HB2 1 1 6 3278 1 1 13 CYS HB3 H -10.146 8.449 -5.367 1.00 . A A . 13 CYS HB3 1 1 6 3279 1 1 13 CYS N N -7.250 7.064 -6.145 1.00 . A A . 13 CYS N 1 1 6 3280 1 1 13 CYS O O -10.096 6.631 -4.047 1.00 . A A . 13 CYS O 1 1 6 3281 1 1 13 CYS SG S -8.687 10.298 -5.739 1.00 . A A . 13 CYS SG 1 1 6 3282 1 1 14 LYS C C -7.911 3.222 -3.142 1.00 . A A . 14 LYS C 1 1 6 3283 1 1 14 LYS CA C -8.960 4.119 -3.790 1.00 . A A . 14 LYS CA 1 1 6 3284 1 1 14 LYS CB C -9.758 3.325 -4.825 1.00 . A A . 14 LYS CB 1 1 6 3285 1 1 14 LYS CD C -11.307 1.393 -5.253 1.00 . A A . 14 LYS CD 1 1 6 3286 1 1 14 LYS CE C -11.756 0.085 -4.623 1.00 . A A . 14 LYS CE 1 1 6 3287 1 1 14 LYS CG C -10.751 2.351 -4.212 1.00 . A A . 14 LYS CG 1 1 6 3288 1 1 14 LYS H H -7.431 5.192 -4.783 1.00 . A A . 14 LYS H 1 1 6 3289 1 1 14 LYS HA H -9.633 4.475 -3.025 1.00 . A A . 14 LYS HA 1 1 6 3290 1 1 14 LYS HB2 H -10.305 4.017 -5.449 1.00 . A A . 14 LYS HB2 1 1 6 3291 1 1 14 LYS HB3 H -9.070 2.765 -5.441 1.00 . A A . 14 LYS HB3 1 1 6 3292 1 1 14 LYS HD2 H -12.153 1.856 -5.738 1.00 . A A . 14 LYS HD2 1 1 6 3293 1 1 14 LYS HD3 H -10.539 1.186 -5.984 1.00 . A A . 14 LYS HD3 1 1 6 3294 1 1 14 LYS HE2 H -11.048 -0.193 -3.857 1.00 . A A . 14 LYS HE2 1 1 6 3295 1 1 14 LYS HE3 H -12.729 0.230 -4.178 1.00 . A A . 14 LYS HE3 1 1 6 3296 1 1 14 LYS HG2 H -10.252 1.780 -3.443 1.00 . A A . 14 LYS HG2 1 1 6 3297 1 1 14 LYS HG3 H -11.566 2.909 -3.777 1.00 . A A . 14 LYS HG3 1 1 6 3298 1 1 14 LYS HZ1 H -12.262 -0.662 -6.508 1.00 . A A . 14 LYS HZ1 1 1 6 3299 1 1 14 LYS HZ2 H -10.890 -1.384 -5.831 1.00 . A A . 14 LYS HZ2 1 1 6 3300 1 1 14 LYS HZ3 H -12.430 -1.788 -5.257 1.00 . A A . 14 LYS HZ3 1 1 6 3301 1 1 14 LYS N N -8.335 5.279 -4.413 1.00 . A A . 14 LYS N 1 1 6 3302 1 1 14 LYS NZ N -11.840 -1.014 -5.625 1.00 . A A . 14 LYS NZ 1 1 6 3303 1 1 14 LYS O O -6.837 3.003 -3.702 1.00 . A A . 14 LYS O 1 1 6 3304 1 1 15 LEU C C -6.874 0.658 -2.105 1.00 . A A . 15 LEU C 1 1 6 3305 1 1 15 LEU CA C -7.313 1.831 -1.235 1.00 . A A . 15 LEU CA 1 1 6 3306 1 1 15 LEU CB C -7.973 1.313 0.044 1.00 . A A . 15 LEU CB 1 1 6 3307 1 1 15 LEU CD1 C -9.007 2.059 2.202 1.00 . A A . 15 LEU CD1 1 1 6 3308 1 1 15 LEU CD2 C -6.519 1.917 1.992 1.00 . A A . 15 LEU CD2 1 1 6 3309 1 1 15 LEU CG C -7.820 2.221 1.265 1.00 . A A . 15 LEU CG 1 1 6 3310 1 1 15 LEU H H -9.100 2.917 -1.565 1.00 . A A . 15 LEU H 1 1 6 3311 1 1 15 LEU HA H -6.443 2.411 -0.970 1.00 . A A . 15 LEU HA 1 1 6 3312 1 1 15 LEU HB2 H -9.028 1.180 -0.150 1.00 . A A . 15 LEU HB2 1 1 6 3313 1 1 15 LEU HB3 H -7.543 0.352 0.282 1.00 . A A . 15 LEU HB3 1 1 6 3314 1 1 15 LEU HD11 H -9.279 1.016 2.262 1.00 . A A . 15 LEU HD11 1 1 6 3315 1 1 15 LEU HD12 H -8.741 2.419 3.185 1.00 . A A . 15 LEU HD12 1 1 6 3316 1 1 15 LEU HD13 H -9.843 2.629 1.824 1.00 . A A . 15 LEU HD13 1 1 6 3317 1 1 15 LEU HD21 H -5.693 2.000 1.301 1.00 . A A . 15 LEU HD21 1 1 6 3318 1 1 15 LEU HD22 H -6.385 2.621 2.800 1.00 . A A . 15 LEU HD22 1 1 6 3319 1 1 15 LEU HD23 H -6.555 0.914 2.390 1.00 . A A . 15 LEU HD23 1 1 6 3320 1 1 15 LEU HG H -7.790 3.250 0.939 1.00 . A A . 15 LEU HG 1 1 6 3321 1 1 15 LEU N N -8.229 2.705 -1.960 1.00 . A A . 15 LEU N 1 1 6 3322 1 1 15 LEU O O -7.702 -0.110 -2.594 1.00 . A A . 15 LEU O 1 1 6 3323 1 1 16 LYS C C -5.461 -1.914 -2.576 1.00 . A A . 16 LYS C 1 1 6 3324 1 1 16 LYS CA C -5.014 -0.552 -3.105 1.00 . A A . 16 LYS CA 1 1 6 3325 1 1 16 LYS CB C -3.485 -0.473 -3.123 1.00 . A A . 16 LYS CB 1 1 6 3326 1 1 16 LYS CD C -1.696 0.221 -4.747 1.00 . A A . 16 LYS CD 1 1 6 3327 1 1 16 LYS CE C -1.306 0.245 -6.216 1.00 . A A . 16 LYS CE 1 1 6 3328 1 1 16 LYS CG C -2.881 -0.699 -4.500 1.00 . A A . 16 LYS CG 1 1 6 3329 1 1 16 LYS H H -4.955 1.172 -1.877 1.00 . A A . 16 LYS H 1 1 6 3330 1 1 16 LYS HA H -5.384 -0.429 -4.112 1.00 . A A . 16 LYS HA 1 1 6 3331 1 1 16 LYS HB2 H -3.183 0.505 -2.777 1.00 . A A . 16 LYS HB2 1 1 6 3332 1 1 16 LYS HB3 H -3.088 -1.220 -2.452 1.00 . A A . 16 LYS HB3 1 1 6 3333 1 1 16 LYS HD2 H -1.958 1.222 -4.438 1.00 . A A . 16 LYS HD2 1 1 6 3334 1 1 16 LYS HD3 H -0.854 -0.128 -4.166 1.00 . A A . 16 LYS HD3 1 1 6 3335 1 1 16 LYS HE2 H -1.673 -0.654 -6.687 1.00 . A A . 16 LYS HE2 1 1 6 3336 1 1 16 LYS HE3 H -1.761 1.107 -6.681 1.00 . A A . 16 LYS HE3 1 1 6 3337 1 1 16 LYS HG2 H -2.549 -1.723 -4.573 1.00 . A A . 16 LYS HG2 1 1 6 3338 1 1 16 LYS HG3 H -3.635 -0.508 -5.249 1.00 . A A . 16 LYS HG3 1 1 6 3339 1 1 16 LYS HZ1 H 0.639 -0.397 -5.805 1.00 . A A . 16 LYS HZ1 1 1 6 3340 1 1 16 LYS HZ2 H 0.417 0.143 -7.393 1.00 . A A . 16 LYS HZ2 1 1 6 3341 1 1 16 LYS HZ3 H 0.518 1.260 -6.127 1.00 . A A . 16 LYS HZ3 1 1 6 3342 1 1 16 LYS N N -5.565 0.527 -2.293 1.00 . A A . 16 LYS N 1 1 6 3343 1 1 16 LYS NZ N 0.170 0.318 -6.398 1.00 . A A . 16 LYS NZ 1 1 6 3344 1 1 16 LYS O O -5.723 -2.069 -1.383 1.00 . A A . 16 LYS O 1 1 6 3345 1 1 17 PRO C C -5.174 -4.815 -1.893 1.00 . A A . 17 PRO C 1 1 6 3346 1 1 17 PRO CA C -5.973 -4.274 -3.074 1.00 . A A . 17 PRO CA 1 1 6 3347 1 1 17 PRO CB C -5.698 -5.103 -4.330 1.00 . A A . 17 PRO CB 1 1 6 3348 1 1 17 PRO CD C -5.260 -2.824 -4.902 1.00 . A A . 17 PRO CD 1 1 6 3349 1 1 17 PRO CG C -5.772 -4.127 -5.452 1.00 . A A . 17 PRO CG 1 1 6 3350 1 1 17 PRO HA H -7.027 -4.309 -2.840 1.00 . A A . 17 PRO HA 1 1 6 3351 1 1 17 PRO HB2 H -4.718 -5.553 -4.260 1.00 . A A . 17 PRO HB2 1 1 6 3352 1 1 17 PRO HB3 H -6.448 -5.874 -4.428 1.00 . A A . 17 PRO HB3 1 1 6 3353 1 1 17 PRO HD2 H -4.198 -2.734 -5.074 1.00 . A A . 17 PRO HD2 1 1 6 3354 1 1 17 PRO HD3 H -5.788 -1.993 -5.347 1.00 . A A . 17 PRO HD3 1 1 6 3355 1 1 17 PRO HG2 H -5.150 -4.459 -6.270 1.00 . A A . 17 PRO HG2 1 1 6 3356 1 1 17 PRO HG3 H -6.796 -4.019 -5.778 1.00 . A A . 17 PRO HG3 1 1 6 3357 1 1 17 PRO N N -5.554 -2.922 -3.460 1.00 . A A . 17 PRO N 1 1 6 3358 1 1 17 PRO O O -3.949 -4.701 -1.854 1.00 . A A . 17 PRO O 1 1 6 3359 1 1 18 ALA C C -4.219 -7.038 -0.132 1.00 . A A . 18 ALA C 1 1 6 3360 1 1 18 ALA CA C -5.235 -5.968 0.251 1.00 . A A . 18 ALA CA 1 1 6 3361 1 1 18 ALA CB C -6.280 -6.545 1.194 1.00 . A A . 18 ALA CB 1 1 6 3362 1 1 18 ALA H H -6.851 -5.468 -1.020 1.00 . A A . 18 ALA H 1 1 6 3363 1 1 18 ALA HA H -4.723 -5.166 0.766 1.00 . A A . 18 ALA HA 1 1 6 3364 1 1 18 ALA HB1 H -7.223 -6.043 1.037 1.00 . A A . 18 ALA HB1 1 1 6 3365 1 1 18 ALA HB2 H -6.397 -7.601 0.999 1.00 . A A . 18 ALA HB2 1 1 6 3366 1 1 18 ALA HB3 H -5.961 -6.401 2.216 1.00 . A A . 18 ALA HB3 1 1 6 3367 1 1 18 ALA N N -5.877 -5.407 -0.931 1.00 . A A . 18 ALA N 1 1 6 3368 1 1 18 ALA O O -4.575 -8.073 -0.695 1.00 . A A . 18 ALA O 1 1 6 3369 1 1 19 GLY C C -1.096 -7.323 -1.357 1.00 . A A . 19 GLY C 1 1 6 3370 1 1 19 GLY CA C -1.904 -7.734 -0.142 1.00 . A A . 19 GLY CA 1 1 6 3371 1 1 19 GLY H H -2.727 -5.941 0.627 1.00 . A A . 19 GLY H 1 1 6 3372 1 1 19 GLY HA2 H -2.354 -8.698 -0.331 1.00 . A A . 19 GLY HA2 1 1 6 3373 1 1 19 GLY HA3 H -1.241 -7.820 0.706 1.00 . A A . 19 GLY HA3 1 1 6 3374 1 1 19 GLY N N -2.952 -6.783 0.178 1.00 . A A . 19 GLY N 1 1 6 3375 1 1 19 GLY O O -0.517 -8.168 -2.040 1.00 . A A . 19 GLY O 1 1 6 3376 1 1 20 THR C C 0.901 -4.701 -2.305 1.00 . A A . 20 THR C 1 1 6 3377 1 1 20 THR CA C -0.311 -5.502 -2.768 1.00 . A A . 20 THR CA 1 1 6 3378 1 1 20 THR CB C -1.214 -4.626 -3.638 1.00 . A A . 20 THR CB 1 1 6 3379 1 1 20 THR CG2 C -0.515 -4.078 -4.863 1.00 . A A . 20 THR CG2 1 1 6 3380 1 1 20 THR H H -1.537 -5.397 -1.046 1.00 . A A . 20 THR H 1 1 6 3381 1 1 20 THR HA H 0.030 -6.343 -3.353 1.00 . A A . 20 THR HA 1 1 6 3382 1 1 20 THR HB H -1.558 -3.787 -3.051 1.00 . A A . 20 THR HB 1 1 6 3383 1 1 20 THR HG1 H -2.900 -4.788 -4.621 1.00 . A A . 20 THR HG1 1 1 6 3384 1 1 20 THR HG21 H 0.553 -4.199 -4.752 1.00 . A A . 20 THR HG21 1 1 6 3385 1 1 20 THR HG22 H -0.849 -4.615 -5.739 1.00 . A A . 20 THR HG22 1 1 6 3386 1 1 20 THR HG23 H -0.749 -3.029 -4.973 1.00 . A A . 20 THR HG23 1 1 6 3387 1 1 20 THR N N -1.056 -6.022 -1.628 1.00 . A A . 20 THR N 1 1 6 3388 1 1 20 THR O O 0.762 -3.622 -1.731 1.00 . A A . 20 THR O 1 1 6 3389 1 1 20 THR OG1 O -2.346 -5.355 -4.079 1.00 . A A . 20 THR OG1 1 1 6 3390 1 1 21 THR C C 3.390 -3.154 -2.721 1.00 . A A . 21 THR C 1 1 6 3391 1 1 21 THR CA C 3.330 -4.575 -2.168 1.00 . A A . 21 THR CA 1 1 6 3392 1 1 21 THR CB C 4.535 -5.377 -2.660 1.00 . A A . 21 THR CB 1 1 6 3393 1 1 21 THR CG2 C 4.409 -5.819 -4.102 1.00 . A A . 21 THR CG2 1 1 6 3394 1 1 21 THR H H 2.135 -6.101 -3.020 1.00 . A A . 21 THR H 1 1 6 3395 1 1 21 THR HA H 3.355 -4.530 -1.090 1.00 . A A . 21 THR HA 1 1 6 3396 1 1 21 THR HB H 4.636 -6.263 -2.051 1.00 . A A . 21 THR HB 1 1 6 3397 1 1 21 THR HG1 H 5.719 -3.909 -3.192 1.00 . A A . 21 THR HG1 1 1 6 3398 1 1 21 THR HG21 H 3.417 -5.589 -4.463 1.00 . A A . 21 THR HG21 1 1 6 3399 1 1 21 THR HG22 H 5.140 -5.300 -4.703 1.00 . A A . 21 THR HG22 1 1 6 3400 1 1 21 THR HG23 H 4.578 -6.884 -4.168 1.00 . A A . 21 THR HG23 1 1 6 3401 1 1 21 THR N N 2.090 -5.237 -2.559 1.00 . A A . 21 THR N 1 1 6 3402 1 1 21 THR O O 2.754 -2.840 -3.727 1.00 . A A . 21 THR O 1 1 6 3403 1 1 21 THR OG1 O 5.726 -4.618 -2.544 1.00 . A A . 21 THR OG1 1 1 6 3404 1 1 22 CYS C C 5.677 -0.666 -3.091 1.00 . A A . 22 CYS C 1 1 6 3405 1 1 22 CYS CA C 4.302 -0.910 -2.478 1.00 . A A . 22 CYS CA 1 1 6 3406 1 1 22 CYS CB C 4.086 0.032 -1.292 1.00 . A A . 22 CYS CB 1 1 6 3407 1 1 22 CYS H H 4.641 -2.607 -1.259 1.00 . A A . 22 CYS H 1 1 6 3408 1 1 22 CYS HA H 3.548 -0.712 -3.225 1.00 . A A . 22 CYS HA 1 1 6 3409 1 1 22 CYS HB2 H 4.358 1.035 -1.584 1.00 . A A . 22 CYS HB2 1 1 6 3410 1 1 22 CYS HB3 H 3.042 0.015 -1.014 1.00 . A A . 22 CYS HB3 1 1 6 3411 1 1 22 CYS N N 4.159 -2.298 -2.055 1.00 . A A . 22 CYS N 1 1 6 3412 1 1 22 CYS O O 5.806 0.045 -4.088 1.00 . A A . 22 CYS O 1 1 6 3413 1 1 22 CYS SG S 5.061 -0.397 0.187 1.00 . A A . 22 CYS SG 1 1 6 3414 1 1 23 TRP C C 8.482 -2.304 -3.825 1.00 . A A . 23 TRP C 1 1 6 3415 1 1 23 TRP CA C 8.068 -1.106 -2.977 1.00 . A A . 23 TRP CA 1 1 6 3416 1 1 23 TRP CB C 9.035 -0.931 -1.803 1.00 . A A . 23 TRP CB 1 1 6 3417 1 1 23 TRP CD1 C 10.907 -0.242 -3.412 1.00 . A A . 23 TRP CD1 1 1 6 3418 1 1 23 TRP CD2 C 11.630 -1.088 -1.469 1.00 . A A . 23 TRP CD2 1 1 6 3419 1 1 23 TRP CE2 C 12.748 -0.752 -2.256 1.00 . A A . 23 TRP CE2 1 1 6 3420 1 1 23 TRP CE3 C 11.839 -1.638 -0.201 1.00 . A A . 23 TRP CE3 1 1 6 3421 1 1 23 TRP CG C 10.462 -0.754 -2.227 1.00 . A A . 23 TRP CG 1 1 6 3422 1 1 23 TRP CH2 C 14.229 -1.488 -0.570 1.00 . A A . 23 TRP CH2 1 1 6 3423 1 1 23 TRP CZ2 C 14.054 -0.948 -1.815 1.00 . A A . 23 TRP CZ2 1 1 6 3424 1 1 23 TRP CZ3 C 13.136 -1.832 0.235 1.00 . A A . 23 TRP CZ3 1 1 6 3425 1 1 23 TRP H H 6.537 -1.814 -1.698 1.00 . A A . 23 TRP H 1 1 6 3426 1 1 23 TRP HA H 8.101 -0.222 -3.591 1.00 . A A . 23 TRP HA 1 1 6 3427 1 1 23 TRP HB2 H 8.747 -0.059 -1.236 1.00 . A A . 23 TRP HB2 1 1 6 3428 1 1 23 TRP HB3 H 8.981 -1.802 -1.167 1.00 . A A . 23 TRP HB3 1 1 6 3429 1 1 23 TRP HD1 H 10.262 0.104 -4.206 1.00 . A A . 23 TRP HD1 1 1 6 3430 1 1 23 TRP HE1 H 12.836 0.082 -4.179 1.00 . A A . 23 TRP HE1 1 1 6 3431 1 1 23 TRP HE3 H 11.009 -1.909 0.434 1.00 . A A . 23 TRP HE3 1 1 6 3432 1 1 23 TRP HH2 H 15.225 -1.658 -0.189 1.00 . A A . 23 TRP HH2 1 1 6 3433 1 1 23 TRP HZ2 H 14.908 -0.688 -2.424 1.00 . A A . 23 TRP HZ2 1 1 6 3434 1 1 23 TRP HZ3 H 13.317 -2.256 1.211 1.00 . A A . 23 TRP HZ3 1 1 6 3435 1 1 23 TRP N N 6.703 -1.260 -2.489 1.00 . A A . 23 TRP N 1 1 6 3436 1 1 23 TRP NE1 N 12.281 -0.238 -3.437 1.00 . A A . 23 TRP NE1 1 1 6 3437 1 1 23 TRP O O 8.555 -2.215 -5.051 1.00 . A A . 23 TRP O 1 1 6 3438 1 1 24 ARG C C 10.421 -4.409 -4.674 1.00 . A A . 24 ARG C 1 1 6 3439 1 1 24 ARG CA C 9.157 -4.642 -3.852 1.00 . A A . 24 ARG CA 1 1 6 3440 1 1 24 ARG CB C 8.030 -5.140 -4.758 1.00 . A A . 24 ARG CB 1 1 6 3441 1 1 24 ARG CD C 7.307 -7.121 -6.125 1.00 . A A . 24 ARG CD 1 1 6 3442 1 1 24 ARG CG C 7.920 -6.655 -4.815 1.00 . A A . 24 ARG CG 1 1 6 3443 1 1 24 ARG CZ C 8.066 -8.325 -8.137 1.00 . A A . 24 ARG CZ 1 1 6 3444 1 1 24 ARG H H 8.672 -3.426 -2.188 1.00 . A A . 24 ARG H 1 1 6 3445 1 1 24 ARG HA H 9.362 -5.391 -3.103 1.00 . A A . 24 ARG HA 1 1 6 3446 1 1 24 ARG HB2 H 7.092 -4.746 -4.396 1.00 . A A . 24 ARG HB2 1 1 6 3447 1 1 24 ARG HB3 H 8.201 -4.776 -5.760 1.00 . A A . 24 ARG HB3 1 1 6 3448 1 1 24 ARG HD2 H 6.639 -7.945 -5.923 1.00 . A A . 24 ARG HD2 1 1 6 3449 1 1 24 ARG HD3 H 6.747 -6.304 -6.557 1.00 . A A . 24 ARG HD3 1 1 6 3450 1 1 24 ARG HE H 9.244 -7.263 -6.927 1.00 . A A . 24 ARG HE 1 1 6 3451 1 1 24 ARG HG2 H 8.907 -7.082 -4.719 1.00 . A A . 24 ARG HG2 1 1 6 3452 1 1 24 ARG HG3 H 7.299 -6.992 -3.997 1.00 . A A . 24 ARG HG3 1 1 6 3453 1 1 24 ARG HH11 H 6.083 -8.482 -7.765 1.00 . A A . 24 ARG HH11 1 1 6 3454 1 1 24 ARG HH12 H 6.643 -9.320 -9.173 1.00 . A A . 24 ARG HH12 1 1 6 3455 1 1 24 ARG HH21 H 9.981 -8.364 -8.779 1.00 . A A . 24 ARG HH21 1 1 6 3456 1 1 24 ARG HH22 H 8.855 -9.253 -9.749 1.00 . A A . 24 ARG HH22 1 1 6 3457 1 1 24 ARG N N 8.750 -3.421 -3.163 1.00 . A A . 24 ARG N 1 1 6 3458 1 1 24 ARG NE N 8.322 -7.557 -7.081 1.00 . A A . 24 ARG NE 1 1 6 3459 1 1 24 ARG NH1 N 6.829 -8.743 -8.378 1.00 . A A . 24 ARG NH1 1 1 6 3460 1 1 24 ARG NH2 N 9.048 -8.676 -8.955 1.00 . A A . 24 ARG NH2 1 1 6 3461 1 1 24 ARG O O 10.377 -3.790 -5.737 1.00 . A A . 24 ARG O 1 1 6 3462 1 1 25 THR C C 13.337 -6.102 -5.364 1.00 . A A . 25 THR C 1 1 6 3463 1 1 25 THR CA C 12.823 -4.757 -4.864 1.00 . A A . 25 THR CA 1 1 6 3464 1 1 25 THR CB C 13.855 -4.117 -3.933 1.00 . A A . 25 THR CB 1 1 6 3465 1 1 25 THR CG2 C 14.807 -3.183 -4.648 1.00 . A A . 25 THR CG2 1 1 6 3466 1 1 25 THR H H 11.518 -5.394 -3.323 1.00 . A A . 25 THR H 1 1 6 3467 1 1 25 THR HA H 12.666 -4.108 -5.711 1.00 . A A . 25 THR HA 1 1 6 3468 1 1 25 THR HB H 14.442 -4.899 -3.473 1.00 . A A . 25 THR HB 1 1 6 3469 1 1 25 THR HG1 H 13.688 -3.503 -2.081 1.00 . A A . 25 THR HG1 1 1 6 3470 1 1 25 THR HG21 H 14.702 -3.309 -5.715 1.00 . A A . 25 THR HG21 1 1 6 3471 1 1 25 THR HG22 H 14.578 -2.162 -4.381 1.00 . A A . 25 THR HG22 1 1 6 3472 1 1 25 THR HG23 H 15.822 -3.412 -4.357 1.00 . A A . 25 THR HG23 1 1 6 3473 1 1 25 THR N N 11.546 -4.910 -4.175 1.00 . A A . 25 THR N 1 1 6 3474 1 1 25 THR O O 13.936 -6.190 -6.435 1.00 . A A . 25 THR O 1 1 6 3475 1 1 25 THR OG1 O 13.216 -3.378 -2.908 1.00 . A A . 25 THR OG1 1 1 6 3476 1 1 26 SER C C 13.104 -9.506 -3.888 1.00 . A A . 26 SER C 1 1 6 3477 1 1 26 SER CA C 13.534 -8.492 -4.942 1.00 . A A . 26 SER CA 1 1 6 3478 1 1 26 SER CB C 15.054 -8.530 -5.112 1.00 . A A . 26 SER CB 1 1 6 3479 1 1 26 SER H H 12.614 -7.013 -3.739 1.00 . A A . 26 SER H 1 1 6 3480 1 1 26 SER HA H 13.069 -8.749 -5.880 1.00 . A A . 26 SER HA 1 1 6 3481 1 1 26 SER HB2 H 15.397 -9.551 -5.038 1.00 . A A . 26 SER HB2 1 1 6 3482 1 1 26 SER HB3 H 15.316 -8.132 -6.082 1.00 . A A . 26 SER HB3 1 1 6 3483 1 1 26 SER HG H 15.891 -6.884 -4.458 1.00 . A A . 26 SER HG 1 1 6 3484 1 1 26 SER N N 13.097 -7.148 -4.580 1.00 . A A . 26 SER N 1 1 6 3485 1 1 26 SER O O 12.702 -10.623 -4.213 1.00 . A A . 26 SER O 1 1 6 3486 1 1 26 SER OG O 15.699 -7.759 -4.113 1.00 . A A . 26 SER OG 1 1 6 3487 1 1 27 VAL C C 12.383 -9.164 -0.301 1.00 . A A . 27 VAL C 1 1 6 3488 1 1 27 VAL CA C 12.813 -9.979 -1.519 1.00 . A A . 27 VAL CA 1 1 6 3489 1 1 27 VAL CB C 13.970 -10.919 -1.123 1.00 . A A . 27 VAL CB 1 1 6 3490 1 1 27 VAL CG1 C 15.165 -10.121 -0.624 1.00 . A A . 27 VAL CG1 1 1 6 3491 1 1 27 VAL CG2 C 13.511 -11.921 -0.075 1.00 . A A . 27 VAL CG2 1 1 6 3492 1 1 27 VAL H H 13.520 -8.205 -2.431 1.00 . A A . 27 VAL H 1 1 6 3493 1 1 27 VAL HA H 11.980 -10.585 -1.845 1.00 . A A . 27 VAL HA 1 1 6 3494 1 1 27 VAL HB H 14.276 -11.467 -2.003 1.00 . A A . 27 VAL HB 1 1 6 3495 1 1 27 VAL HG11 H 15.168 -9.146 -1.089 1.00 . A A . 27 VAL HG11 1 1 6 3496 1 1 27 VAL HG12 H 15.100 -10.008 0.449 1.00 . A A . 27 VAL HG12 1 1 6 3497 1 1 27 VAL HG13 H 16.077 -10.643 -0.875 1.00 . A A . 27 VAL HG13 1 1 6 3498 1 1 27 VAL HG21 H 12.450 -12.091 -0.179 1.00 . A A . 27 VAL HG21 1 1 6 3499 1 1 27 VAL HG22 H 14.040 -12.853 -0.212 1.00 . A A . 27 VAL HG22 1 1 6 3500 1 1 27 VAL HG23 H 13.718 -11.531 0.911 1.00 . A A . 27 VAL HG23 1 1 6 3501 1 1 27 VAL N N 13.192 -9.107 -2.624 1.00 . A A . 27 VAL N 1 1 6 3502 1 1 27 VAL O O 12.785 -9.450 0.827 1.00 . A A . 27 VAL O 1 1 6 3503 1 1 28 SER C C 9.622 -6.892 0.301 1.00 . A A . 28 SER C 1 1 6 3504 1 1 28 SER CA C 11.076 -7.289 0.536 1.00 . A A . 28 SER CA 1 1 6 3505 1 1 28 SER CB C 11.947 -6.036 0.651 1.00 . A A . 28 SER CB 1 1 6 3506 1 1 28 SER H H 11.276 -7.967 -1.459 1.00 . A A . 28 SER H 1 1 6 3507 1 1 28 SER HA H 11.140 -7.846 1.459 1.00 . A A . 28 SER HA 1 1 6 3508 1 1 28 SER HB2 H 12.917 -6.234 0.221 1.00 . A A . 28 SER HB2 1 1 6 3509 1 1 28 SER HB3 H 11.476 -5.223 0.117 1.00 . A A . 28 SER HB3 1 1 6 3510 1 1 28 SER HG H 12.735 -4.922 2.056 1.00 . A A . 28 SER HG 1 1 6 3511 1 1 28 SER N N 11.562 -8.146 -0.539 1.00 . A A . 28 SER N 1 1 6 3512 1 1 28 SER O O 9.205 -5.788 0.651 1.00 . A A . 28 SER O 1 1 6 3513 1 1 28 SER OG O 12.117 -5.655 2.005 1.00 . A A . 28 SER OG 1 1 6 3514 1 1 29 SER C C 6.648 -7.419 0.714 1.00 . A A . 29 SER C 1 1 6 3515 1 1 29 SER CA C 7.448 -7.544 -0.578 1.00 . A A . 29 SER CA 1 1 6 3516 1 1 29 SER CB C 6.869 -8.665 -1.444 1.00 . A A . 29 SER CB 1 1 6 3517 1 1 29 SER H H 9.246 -8.661 -0.551 1.00 . A A . 29 SER H 1 1 6 3518 1 1 29 SER HA H 7.383 -6.613 -1.120 1.00 . A A . 29 SER HA 1 1 6 3519 1 1 29 SER HB2 H 6.807 -9.572 -0.861 1.00 . A A . 29 SER HB2 1 1 6 3520 1 1 29 SER HB3 H 5.882 -8.384 -1.779 1.00 . A A . 29 SER HB3 1 1 6 3521 1 1 29 SER HG H 7.438 -9.745 -2.976 1.00 . A A . 29 SER HG 1 1 6 3522 1 1 29 SER N N 8.856 -7.799 -0.295 1.00 . A A . 29 SER N 1 1 6 3523 1 1 29 SER O O 6.065 -8.392 1.192 1.00 . A A . 29 SER O 1 1 6 3524 1 1 29 SER OG O 7.685 -8.908 -2.577 1.00 . A A . 29 SER OG 1 1 6 3525 1 1 30 HIS C C 4.411 -6.261 2.341 1.00 . A A . 30 HIS C 1 1 6 3526 1 1 30 HIS CA C 5.897 -5.963 2.514 1.00 . A A . 30 HIS CA 1 1 6 3527 1 1 30 HIS CB C 6.089 -4.511 2.956 1.00 . A A . 30 HIS CB 1 1 6 3528 1 1 30 HIS CD2 C 8.643 -4.904 3.190 1.00 . A A . 30 HIS CD2 1 1 6 3529 1 1 30 HIS CE1 C 9.201 -2.933 3.970 1.00 . A A . 30 HIS CE1 1 1 6 3530 1 1 30 HIS CG C 7.509 -4.169 3.285 1.00 . A A . 30 HIS CG 1 1 6 3531 1 1 30 HIS H H 7.111 -5.479 0.848 1.00 . A A . 30 HIS H 1 1 6 3532 1 1 30 HIS HA H 6.297 -6.617 3.273 1.00 . A A . 30 HIS HA 1 1 6 3533 1 1 30 HIS HB2 H 5.765 -3.854 2.163 1.00 . A A . 30 HIS HB2 1 1 6 3534 1 1 30 HIS HB3 H 5.490 -4.328 3.836 1.00 . A A . 30 HIS HB3 1 1 6 3535 1 1 30 HIS HD1 H 7.296 -2.184 3.958 1.00 . A A . 30 HIS HD1 1 1 6 3536 1 1 30 HIS HD2 H 8.718 -5.924 2.839 1.00 . A A . 30 HIS HD2 1 1 6 3537 1 1 30 HIS HE1 H 9.779 -2.104 4.349 1.00 . A A . 30 HIS HE1 1 1 6 3538 1 1 30 HIS HE2 H 10.605 -4.406 3.746 1.00 . A A . 30 HIS HE2 1 1 6 3539 1 1 30 HIS N N 6.626 -6.215 1.276 1.00 . A A . 30 HIS N 1 1 6 3540 1 1 30 HIS ND1 N 7.893 -2.939 3.778 1.00 . A A . 30 HIS ND1 1 1 6 3541 1 1 30 HIS NE2 N 9.678 -4.113 3.622 1.00 . A A . 30 HIS NE2 1 1 6 3542 1 1 30 HIS O O 3.746 -6.710 3.274 1.00 . A A . 30 HIS O 1 1 6 3543 1 1 31 TYR C C 1.589 -5.375 1.704 1.00 . A A . 31 TYR C 1 1 6 3544 1 1 31 TYR CA C 2.492 -6.249 0.838 1.00 . A A . 31 TYR CA 1 1 6 3545 1 1 31 TYR CB C 2.145 -7.725 1.046 1.00 . A A . 31 TYR CB 1 1 6 3546 1 1 31 TYR CD1 C 2.188 -8.339 -1.402 1.00 . A A . 31 TYR CD1 1 1 6 3547 1 1 31 TYR CD2 C 3.373 -9.731 0.128 1.00 . A A . 31 TYR CD2 1 1 6 3548 1 1 31 TYR CE1 C 2.580 -9.151 -2.450 1.00 . A A . 31 TYR CE1 1 1 6 3549 1 1 31 TYR CE2 C 3.770 -10.547 -0.914 1.00 . A A . 31 TYR CE2 1 1 6 3550 1 1 31 TYR CG C 2.577 -8.615 -0.097 1.00 . A A . 31 TYR CG 1 1 6 3551 1 1 31 TYR CZ C 3.371 -10.252 -2.201 1.00 . A A . 31 TYR CZ 1 1 6 3552 1 1 31 TYR H H 4.483 -5.652 0.438 1.00 . A A . 31 TYR H 1 1 6 3553 1 1 31 TYR HA H 2.329 -5.994 -0.199 1.00 . A A . 31 TYR HA 1 1 6 3554 1 1 31 TYR HB2 H 2.631 -8.079 1.943 1.00 . A A . 31 TYR HB2 1 1 6 3555 1 1 31 TYR HB3 H 1.076 -7.823 1.159 1.00 . A A . 31 TYR HB3 1 1 6 3556 1 1 31 TYR HD1 H 1.569 -7.475 -1.594 1.00 . A A . 31 TYR HD1 1 1 6 3557 1 1 31 TYR HD2 H 3.683 -9.959 1.137 1.00 . A A . 31 TYR HD2 1 1 6 3558 1 1 31 TYR HE1 H 2.268 -8.920 -3.458 1.00 . A A . 31 TYR HE1 1 1 6 3559 1 1 31 TYR HE2 H 4.389 -11.410 -0.719 1.00 . A A . 31 TYR HE2 1 1 6 3560 1 1 31 TYR HH H 3.577 -11.978 -3.023 1.00 . A A . 31 TYR HH 1 1 6 3561 1 1 31 TYR N N 3.899 -6.008 1.140 1.00 . A A . 31 TYR N 1 1 6 3562 1 1 31 TYR O O 1.813 -5.231 2.905 1.00 . A A . 31 TYR O 1 1 6 3563 1 1 31 TYR OH O 3.764 -11.062 -3.242 1.00 . A A . 31 TYR OH 1 1 6 3564 1 1 32 CYS C C -1.371 -4.761 2.593 1.00 . A A . 32 CYS C 1 1 6 3565 1 1 32 CYS CA C -0.369 -3.932 1.797 1.00 . A A . 32 CYS CA 1 1 6 3566 1 1 32 CYS CB C -1.109 -3.022 0.815 1.00 . A A . 32 CYS CB 1 1 6 3567 1 1 32 CYS H H 0.442 -4.945 0.124 1.00 . A A . 32 CYS H 1 1 6 3568 1 1 32 CYS HA H 0.199 -3.321 2.482 1.00 . A A . 32 CYS HA 1 1 6 3569 1 1 32 CYS HB2 H -0.484 -2.856 -0.050 1.00 . A A . 32 CYS HB2 1 1 6 3570 1 1 32 CYS HB3 H -2.022 -3.508 0.504 1.00 . A A . 32 CYS HB3 1 1 6 3571 1 1 32 CYS N N 0.568 -4.792 1.084 1.00 . A A . 32 CYS N 1 1 6 3572 1 1 32 CYS O O -1.420 -5.985 2.467 1.00 . A A . 32 CYS O 1 1 6 3573 1 1 32 CYS SG S -1.551 -1.393 1.499 1.00 . A A . 32 CYS SG 1 1 6 3574 1 1 33 THR C C -4.588 -4.380 3.801 1.00 . A A . 33 THR C 1 1 6 3575 1 1 33 THR CA C -3.171 -4.760 4.233 1.00 . A A . 33 THR CA 1 1 6 3576 1 1 33 THR CB C -2.966 -4.408 5.707 1.00 . A A . 33 THR CB 1 1 6 3577 1 1 33 THR CG2 C -2.772 -2.926 5.944 1.00 . A A . 33 THR CG2 1 1 6 3578 1 1 33 THR H H -2.081 -3.112 3.472 1.00 . A A . 33 THR H 1 1 6 3579 1 1 33 THR HA H -3.042 -5.824 4.106 1.00 . A A . 33 THR HA 1 1 6 3580 1 1 33 THR HB H -2.086 -4.919 6.069 1.00 . A A . 33 THR HB 1 1 6 3581 1 1 33 THR HG1 H -4.835 -4.277 6.280 1.00 . A A . 33 THR HG1 1 1 6 3582 1 1 33 THR HG21 H -3.309 -2.368 5.191 1.00 . A A . 33 THR HG21 1 1 6 3583 1 1 33 THR HG22 H -3.148 -2.665 6.922 1.00 . A A . 33 THR HG22 1 1 6 3584 1 1 33 THR HG23 H -1.720 -2.687 5.888 1.00 . A A . 33 THR HG23 1 1 6 3585 1 1 33 THR N N -2.169 -4.087 3.414 1.00 . A A . 33 THR N 1 1 6 3586 1 1 33 THR O O -5.558 -4.691 4.492 1.00 . A A . 33 THR O 1 1 6 3587 1 1 33 THR OG1 O -4.075 -4.827 6.483 1.00 . A A . 33 THR OG1 1 1 6 3588 1 1 34 GLY C C -6.789 -2.485 3.175 1.00 . A A . 34 GLY C 1 1 6 3589 1 1 34 GLY CA C -6.007 -3.302 2.164 1.00 . A A . 34 GLY CA 1 1 6 3590 1 1 34 GLY H H -3.898 -3.485 2.146 1.00 . A A . 34 GLY H 1 1 6 3591 1 1 34 GLY HA2 H -6.575 -4.186 1.916 1.00 . A A . 34 GLY HA2 1 1 6 3592 1 1 34 GLY HA3 H -5.872 -2.713 1.269 1.00 . A A . 34 GLY HA3 1 1 6 3593 1 1 34 GLY N N -4.703 -3.707 2.658 1.00 . A A . 34 GLY N 1 1 6 3594 1 1 34 GLY O O -8.019 -2.451 3.136 1.00 . A A . 34 GLY O 1 1 6 3595 1 1 35 ARG C C -6.460 0.477 4.846 1.00 . A A . 35 ARG C 1 1 6 3596 1 1 35 ARG CA C -6.712 -1.003 5.105 1.00 . A A . 35 ARG CA 1 1 6 3597 1 1 35 ARG CB C -6.193 -1.386 6.492 1.00 . A A . 35 ARG CB 1 1 6 3598 1 1 35 ARG CD C -6.997 -2.343 8.672 1.00 . A A . 35 ARG CD 1 1 6 3599 1 1 35 ARG CG C -6.998 -2.490 7.159 1.00 . A A . 35 ARG CG 1 1 6 3600 1 1 35 ARG CZ C -8.087 -4.391 9.503 1.00 . A A . 35 ARG CZ 1 1 6 3601 1 1 35 ARG H H -5.098 -1.888 4.061 1.00 . A A . 35 ARG H 1 1 6 3602 1 1 35 ARG HA H -7.772 -1.185 5.064 1.00 . A A . 35 ARG HA 1 1 6 3603 1 1 35 ARG HB2 H -5.170 -1.720 6.401 1.00 . A A . 35 ARG HB2 1 1 6 3604 1 1 35 ARG HB3 H -6.223 -0.514 7.128 1.00 . A A . 35 ARG HB3 1 1 6 3605 1 1 35 ARG HD2 H -6.114 -1.797 8.967 1.00 . A A . 35 ARG HD2 1 1 6 3606 1 1 35 ARG HD3 H -7.877 -1.791 8.968 1.00 . A A . 35 ARG HD3 1 1 6 3607 1 1 35 ARG HE H -6.148 -3.965 9.704 1.00 . A A . 35 ARG HE 1 1 6 3608 1 1 35 ARG HG2 H -8.017 -2.444 6.804 1.00 . A A . 35 ARG HG2 1 1 6 3609 1 1 35 ARG HG3 H -6.566 -3.445 6.898 1.00 . A A . 35 ARG HG3 1 1 6 3610 1 1 35 ARG HH11 H -9.330 -3.103 8.560 1.00 . A A . 35 ARG HH11 1 1 6 3611 1 1 35 ARG HH12 H -10.072 -4.551 9.153 1.00 . A A . 35 ARG HH12 1 1 6 3612 1 1 35 ARG HH21 H -7.122 -5.870 10.484 1.00 . A A . 35 ARG HH21 1 1 6 3613 1 1 35 ARG HH22 H -8.819 -6.122 10.246 1.00 . A A . 35 ARG HH22 1 1 6 3614 1 1 35 ARG N N -6.075 -1.824 4.081 1.00 . A A . 35 ARG N 1 1 6 3615 1 1 35 ARG NE N -7.000 -3.639 9.347 1.00 . A A . 35 ARG NE 1 1 6 3616 1 1 35 ARG NH1 N -9.259 -3.981 9.033 1.00 . A A . 35 ARG NH1 1 1 6 3617 1 1 35 ARG NH2 N -8.002 -5.557 10.129 1.00 . A A . 35 ARG NH2 1 1 6 3618 1 1 35 ARG O O -7.378 1.228 4.515 1.00 . A A . 35 ARG O 1 1 6 3619 1 1 36 SER C C -3.983 2.408 3.513 1.00 . A A . 36 SER C 1 1 6 3620 1 1 36 SER CA C -4.822 2.273 4.780 1.00 . A A . 36 SER CA 1 1 6 3621 1 1 36 SER CB C -4.038 2.801 5.983 1.00 . A A . 36 SER CB 1 1 6 3622 1 1 36 SER H H -4.527 0.233 5.261 1.00 . A A . 36 SER H 1 1 6 3623 1 1 36 SER HA H -5.723 2.856 4.664 1.00 . A A . 36 SER HA 1 1 6 3624 1 1 36 SER HB2 H -4.501 2.452 6.893 1.00 . A A . 36 SER HB2 1 1 6 3625 1 1 36 SER HB3 H -3.021 2.439 5.935 1.00 . A A . 36 SER HB3 1 1 6 3626 1 1 36 SER HG H -4.760 4.544 6.513 1.00 . A A . 36 SER HG 1 1 6 3627 1 1 36 SER N N -5.209 0.884 4.998 1.00 . A A . 36 SER N 1 1 6 3628 1 1 36 SER O O -3.600 1.410 2.903 1.00 . A A . 36 SER O 1 1 6 3629 1 1 36 SER OG O -4.018 4.218 5.997 1.00 . A A . 36 SER OG 1 1 6 3630 1 1 37 CYS C C -1.494 4.359 2.300 1.00 . A A . 37 CYS C 1 1 6 3631 1 1 37 CYS CA C -2.905 3.906 1.931 1.00 . A A . 37 CYS CA 1 1 6 3632 1 1 37 CYS CB C -3.585 4.964 1.060 1.00 . A A . 37 CYS CB 1 1 6 3633 1 1 37 CYS H H -4.031 4.402 3.653 1.00 . A A . 37 CYS H 1 1 6 3634 1 1 37 CYS HA H -2.837 2.985 1.373 1.00 . A A . 37 CYS HA 1 1 6 3635 1 1 37 CYS HB2 H -3.878 5.797 1.681 1.00 . A A . 37 CYS HB2 1 1 6 3636 1 1 37 CYS HB3 H -2.886 5.307 0.312 1.00 . A A . 37 CYS HB3 1 1 6 3637 1 1 37 CYS N N -3.700 3.646 3.124 1.00 . A A . 37 CYS N 1 1 6 3638 1 1 37 CYS O O -0.787 4.948 1.483 1.00 . A A . 37 CYS O 1 1 6 3639 1 1 37 CYS SG S -5.074 4.362 0.198 1.00 . A A . 37 CYS SG 1 1 6 3640 1 1 38 GLU C C 1.083 3.206 4.272 1.00 . A A . 38 GLU C 1 1 6 3641 1 1 38 GLU CA C 0.237 4.447 4.012 1.00 . A A . 38 GLU CA 1 1 6 3642 1 1 38 GLU CB C 0.128 5.283 5.288 1.00 . A A . 38 GLU CB 1 1 6 3643 1 1 38 GLU CD C 2.622 5.408 5.666 1.00 . A A . 38 GLU CD 1 1 6 3644 1 1 38 GLU CG C 1.328 6.185 5.529 1.00 . A A . 38 GLU CG 1 1 6 3645 1 1 38 GLU H H -1.698 3.601 4.141 1.00 . A A . 38 GLU H 1 1 6 3646 1 1 38 GLU HA H 0.712 5.039 3.243 1.00 . A A . 38 GLU HA 1 1 6 3647 1 1 38 GLU HB2 H -0.754 5.903 5.225 1.00 . A A . 38 GLU HB2 1 1 6 3648 1 1 38 GLU HB3 H 0.030 4.618 6.133 1.00 . A A . 38 GLU HB3 1 1 6 3649 1 1 38 GLU HG2 H 1.421 6.867 4.697 1.00 . A A . 38 GLU HG2 1 1 6 3650 1 1 38 GLU HG3 H 1.163 6.746 6.437 1.00 . A A . 38 GLU HG3 1 1 6 3651 1 1 38 GLU N N -1.090 4.075 3.536 1.00 . A A . 38 GLU N 1 1 6 3652 1 1 38 GLU O O 1.175 2.731 5.404 1.00 . A A . 38 GLU O 1 1 6 3653 1 1 38 GLU OE1 O 3.051 5.166 6.814 1.00 . A A . 38 GLU OE1 1 1 6 3654 1 1 38 GLU OE2 O 3.208 5.042 4.625 1.00 . A A . 38 GLU OE2 1 1 6 3655 1 1 39 CYS C C 3.534 1.618 4.476 1.00 . A A . 39 CYS C 1 1 6 3656 1 1 39 CYS CA C 2.538 1.493 3.321 1.00 . A A . 39 CYS CA 1 1 6 3657 1 1 39 CYS CB C 3.292 1.263 2.010 1.00 . A A . 39 CYS CB 1 1 6 3658 1 1 39 CYS H H 1.583 3.108 2.339 1.00 . A A . 39 CYS H 1 1 6 3659 1 1 39 CYS HA H 1.892 0.648 3.504 1.00 . A A . 39 CYS HA 1 1 6 3660 1 1 39 CYS HB2 H 2.695 1.631 1.190 1.00 . A A . 39 CYS HB2 1 1 6 3661 1 1 39 CYS HB3 H 4.226 1.806 2.040 1.00 . A A . 39 CYS HB3 1 1 6 3662 1 1 39 CYS N N 1.699 2.684 3.215 1.00 . A A . 39 CYS N 1 1 6 3663 1 1 39 CYS O O 4.517 2.352 4.378 1.00 . A A . 39 CYS O 1 1 6 3664 1 1 39 CYS SG S 3.678 -0.486 1.670 1.00 . A A . 39 CYS SG 1 1 6 3665 1 1 40 PRO C C 5.518 0.264 6.492 1.00 . A A . 40 PRO C 1 1 6 3666 1 1 40 PRO CA C 4.178 0.940 6.758 1.00 . A A . 40 PRO CA 1 1 6 3667 1 1 40 PRO CB C 3.394 0.172 7.824 1.00 . A A . 40 PRO CB 1 1 6 3668 1 1 40 PRO CD C 2.145 -0.003 5.796 1.00 . A A . 40 PRO CD 1 1 6 3669 1 1 40 PRO CG C 2.504 -0.741 7.056 1.00 . A A . 40 PRO CG 1 1 6 3670 1 1 40 PRO HA H 4.348 1.953 7.091 1.00 . A A . 40 PRO HA 1 1 6 3671 1 1 40 PRO HB2 H 4.080 -0.379 8.452 1.00 . A A . 40 PRO HB2 1 1 6 3672 1 1 40 PRO HB3 H 2.824 0.864 8.426 1.00 . A A . 40 PRO HB3 1 1 6 3673 1 1 40 PRO HD2 H 2.043 -0.693 4.971 1.00 . A A . 40 PRO HD2 1 1 6 3674 1 1 40 PRO HD3 H 1.233 0.558 5.935 1.00 . A A . 40 PRO HD3 1 1 6 3675 1 1 40 PRO HG2 H 3.030 -1.654 6.819 1.00 . A A . 40 PRO HG2 1 1 6 3676 1 1 40 PRO HG3 H 1.615 -0.957 7.630 1.00 . A A . 40 PRO HG3 1 1 6 3677 1 1 40 PRO N N 3.293 0.900 5.589 1.00 . A A . 40 PRO N 1 1 6 3678 1 1 40 PRO O O 5.751 -0.272 5.408 1.00 . A A . 40 PRO O 1 1 6 3679 1 1 41 SER C C 7.711 -1.741 7.913 1.00 . A A . 41 SER C 1 1 6 3680 1 1 41 SER CA C 7.715 -0.317 7.363 1.00 . A A . 41 SER CA 1 1 6 3681 1 1 41 SER CB C 8.761 0.525 8.096 1.00 . A A . 41 SER CB 1 1 6 3682 1 1 41 SER H H 6.153 0.736 8.328 1.00 . A A . 41 SER H 1 1 6 3683 1 1 41 SER HA H 7.966 -0.351 6.313 1.00 . A A . 41 SER HA 1 1 6 3684 1 1 41 SER HB2 H 8.674 0.359 9.159 1.00 . A A . 41 SER HB2 1 1 6 3685 1 1 41 SER HB3 H 9.749 0.235 7.767 1.00 . A A . 41 SER HB3 1 1 6 3686 1 1 41 SER HG H 8.783 2.411 8.625 1.00 . A A . 41 SER HG 1 1 6 3687 1 1 41 SER N N 6.397 0.293 7.488 1.00 . A A . 41 SER N 1 1 6 3688 1 1 41 SER O O 8.612 -2.134 8.654 1.00 . A A . 41 SER O 1 1 6 3689 1 1 41 SER OG O 8.580 1.906 7.835 1.00 . A A . 41 SER OG 1 1 6 3690 1 1 42 TYR C C 7.391 -4.827 7.124 1.00 . A A . 42 TYR C 1 1 6 3691 1 1 42 TYR CA C 6.568 -3.888 8.002 1.00 . A A . 42 TYR CA 1 1 6 3692 1 1 42 TYR CB C 5.101 -4.321 7.997 1.00 . A A . 42 TYR CB 1 1 6 3693 1 1 42 TYR CD1 C 4.477 -2.703 9.832 1.00 . A A . 42 TYR CD1 1 1 6 3694 1 1 42 TYR CD2 C 3.541 -4.894 9.897 1.00 . A A . 42 TYR CD2 1 1 6 3695 1 1 42 TYR CE1 C 3.801 -2.375 10.992 1.00 . A A . 42 TYR CE1 1 1 6 3696 1 1 42 TYR CE2 C 2.861 -4.573 11.057 1.00 . A A . 42 TYR CE2 1 1 6 3697 1 1 42 TYR CG C 4.359 -3.966 9.266 1.00 . A A . 42 TYR CG 1 1 6 3698 1 1 42 TYR CZ C 2.994 -3.313 11.600 1.00 . A A . 42 TYR CZ 1 1 6 3699 1 1 42 TYR H H 6.003 -2.139 6.954 1.00 . A A . 42 TYR H 1 1 6 3700 1 1 42 TYR HA H 6.945 -3.937 9.013 1.00 . A A . 42 TYR HA 1 1 6 3701 1 1 42 TYR HB2 H 4.595 -3.841 7.172 1.00 . A A . 42 TYR HB2 1 1 6 3702 1 1 42 TYR HB3 H 5.050 -5.392 7.870 1.00 . A A . 42 TYR HB3 1 1 6 3703 1 1 42 TYR HD1 H 5.110 -1.970 9.353 1.00 . A A . 42 TYR HD1 1 1 6 3704 1 1 42 TYR HD2 H 3.439 -5.881 9.470 1.00 . A A . 42 TYR HD2 1 1 6 3705 1 1 42 TYR HE1 H 3.906 -1.387 11.416 1.00 . A A . 42 TYR HE1 1 1 6 3706 1 1 42 TYR HE2 H 2.229 -5.309 11.533 1.00 . A A . 42 TYR HE2 1 1 6 3707 1 1 42 TYR HH H 1.441 -3.377 12.731 1.00 . A A . 42 TYR HH 1 1 6 3708 1 1 42 TYR N N 6.690 -2.508 7.546 1.00 . A A . 42 TYR N 1 1 6 3709 1 1 42 TYR O O 7.756 -4.479 6.001 1.00 . A A . 42 TYR O 1 1 6 3710 1 1 42 TYR OH O 2.319 -2.990 12.754 1.00 . A A . 42 TYR OH 1 1 6 3711 1 1 43 PRO C C 7.706 -7.606 5.700 1.00 . A A . 43 PRO C 1 1 6 3712 1 1 43 PRO CA C 8.478 -7.027 6.881 1.00 . A A . 43 PRO CA 1 1 6 3713 1 1 43 PRO CB C 8.760 -8.114 7.920 1.00 . A A . 43 PRO CB 1 1 6 3714 1 1 43 PRO CD C 7.299 -6.532 8.958 1.00 . A A . 43 PRO CD 1 1 6 3715 1 1 43 PRO CG C 7.648 -7.994 8.904 1.00 . A A . 43 PRO CG 1 1 6 3716 1 1 43 PRO HA H 9.411 -6.610 6.530 1.00 . A A . 43 PRO HA 1 1 6 3717 1 1 43 PRO HB2 H 8.762 -9.082 7.441 1.00 . A A . 43 PRO HB2 1 1 6 3718 1 1 43 PRO HB3 H 9.718 -7.933 8.385 1.00 . A A . 43 PRO HB3 1 1 6 3719 1 1 43 PRO HD2 H 6.238 -6.404 9.118 1.00 . A A . 43 PRO HD2 1 1 6 3720 1 1 43 PRO HD3 H 7.862 -6.038 9.736 1.00 . A A . 43 PRO HD3 1 1 6 3721 1 1 43 PRO HG2 H 6.798 -8.571 8.569 1.00 . A A . 43 PRO HG2 1 1 6 3722 1 1 43 PRO HG3 H 7.977 -8.337 9.874 1.00 . A A . 43 PRO HG3 1 1 6 3723 1 1 43 PRO N N 7.695 -6.036 7.626 1.00 . A A . 43 PRO N 1 1 6 3724 1 1 43 PRO O O 6.541 -7.272 5.484 1.00 . A A . 43 PRO O 1 1 6 3725 1 1 44 GLY C C 8.625 -10.077 3.081 1.00 . A A . 44 GLY C 1 1 6 3726 1 1 44 GLY CA C 7.722 -9.087 3.790 1.00 . A A . 44 GLY CA 1 1 6 3727 1 1 44 GLY H H 9.290 -8.703 5.160 1.00 . A A . 44 GLY H 1 1 6 3728 1 1 44 GLY HA2 H 7.441 -8.310 3.093 1.00 . A A . 44 GLY HA2 1 1 6 3729 1 1 44 GLY HA3 H 6.831 -9.600 4.119 1.00 . A A . 44 GLY HA3 1 1 6 3730 1 1 44 GLY N N 8.363 -8.475 4.939 1.00 . A A . 44 GLY N 1 1 6 3731 1 1 44 GLY O O 8.110 -11.102 2.588 1.00 . A A . 44 GLY O 1 1 6 3732 1 1 44 GLY OXT O 9.847 -9.827 3.018 1.00 . A A . 44 GLY OXT 1 1 7 3733 1 1 1 ALA C C -12.378 15.400 0.970 1.00 . A A . 1 ALA C 1 1 7 3734 1 1 1 ALA CA C -12.496 16.016 2.360 1.00 . A A . 1 ALA CA 1 1 7 3735 1 1 1 ALA CB C -13.679 15.415 3.104 1.00 . A A . 1 ALA CB 1 1 7 3736 1 1 1 ALA H1 H -11.904 17.845 1.628 1.00 . A A . 1 ALA H1 1 1 7 3737 1 1 1 ALA H2 H -13.590 17.701 1.918 1.00 . A A . 1 ALA H2 1 1 7 3738 1 1 1 ALA H3 H -12.507 17.877 3.235 1.00 . A A . 1 ALA H3 1 1 7 3739 1 1 1 ALA HA H -11.599 15.791 2.918 1.00 . A A . 1 ALA HA 1 1 7 3740 1 1 1 ALA HB1 H -14.580 15.564 2.528 1.00 . A A . 1 ALA HB1 1 1 7 3741 1 1 1 ALA HB2 H -13.514 14.357 3.247 1.00 . A A . 1 ALA HB2 1 1 7 3742 1 1 1 ALA HB3 H -13.782 15.896 4.065 1.00 . A A . 1 ALA HB3 1 1 7 3743 1 1 1 ALA N N -12.637 17.493 2.278 1.00 . A A . 1 ALA N 1 1 7 3744 1 1 1 ALA O O -13.188 15.677 0.086 1.00 . A A . 1 ALA O 1 1 7 3745 1 1 2 MET C C -11.632 12.462 -0.465 1.00 . A A . 2 MET C 1 1 7 3746 1 1 2 MET CA C -11.139 13.905 -0.498 1.00 . A A . 2 MET CA 1 1 7 3747 1 1 2 MET CB C -9.652 13.940 -0.859 1.00 . A A . 2 MET CB 1 1 7 3748 1 1 2 MET CE C -7.257 16.184 -2.979 1.00 . A A . 2 MET CE 1 1 7 3749 1 1 2 MET CG C -9.120 15.341 -1.108 1.00 . A A . 2 MET CG 1 1 7 3750 1 1 2 MET H H -10.751 14.380 1.528 1.00 . A A . 2 MET H 1 1 7 3751 1 1 2 MET HA H -11.695 14.446 -1.249 1.00 . A A . 2 MET HA 1 1 7 3752 1 1 2 MET HB2 H -9.087 13.501 -0.050 1.00 . A A . 2 MET HB2 1 1 7 3753 1 1 2 MET HB3 H -9.497 13.355 -1.753 1.00 . A A . 2 MET HB3 1 1 7 3754 1 1 2 MET HE1 H -7.939 15.703 -3.665 1.00 . A A . 2 MET HE1 1 1 7 3755 1 1 2 MET HE2 H -7.531 17.222 -2.866 1.00 . A A . 2 MET HE2 1 1 7 3756 1 1 2 MET HE3 H -6.251 16.117 -3.366 1.00 . A A . 2 MET HE3 1 1 7 3757 1 1 2 MET HG2 H -9.611 15.750 -1.978 1.00 . A A . 2 MET HG2 1 1 7 3758 1 1 2 MET HG3 H -9.345 15.955 -0.248 1.00 . A A . 2 MET HG3 1 1 7 3759 1 1 2 MET N N -11.363 14.561 0.785 1.00 . A A . 2 MET N 1 1 7 3760 1 1 2 MET O O -12.173 11.958 -1.449 1.00 . A A . 2 MET O 1 1 7 3761 1 1 2 MET SD S -7.338 15.368 -1.387 1.00 . A A . 2 MET SD 1 1 7 3762 1 1 3 ASP C C -11.165 9.512 -0.171 1.00 . A A . 3 ASP C 1 1 7 3763 1 1 3 ASP CA C -11.867 10.418 0.835 1.00 . A A . 3 ASP CA 1 1 7 3764 1 1 3 ASP CB C -13.384 10.306 0.668 1.00 . A A . 3 ASP CB 1 1 7 3765 1 1 3 ASP CG C -14.139 11.208 1.623 1.00 . A A . 3 ASP CG 1 1 7 3766 1 1 3 ASP H H -11.005 12.259 1.423 1.00 . A A . 3 ASP H 1 1 7 3767 1 1 3 ASP HA H -11.600 10.103 1.833 1.00 . A A . 3 ASP HA 1 1 7 3768 1 1 3 ASP HB2 H -13.650 10.580 -0.342 1.00 . A A . 3 ASP HB2 1 1 7 3769 1 1 3 ASP HB3 H -13.685 9.285 0.851 1.00 . A A . 3 ASP HB3 1 1 7 3770 1 1 3 ASP N N -11.442 11.803 0.674 1.00 . A A . 3 ASP N 1 1 7 3771 1 1 3 ASP O O -11.724 8.509 -0.614 1.00 . A A . 3 ASP O 1 1 7 3772 1 1 3 ASP OD1 O -14.406 12.372 1.256 1.00 . A A . 3 ASP OD1 1 1 7 3773 1 1 3 ASP OD2 O -14.465 10.751 2.739 1.00 . A A . 3 ASP OD2 1 1 7 3774 1 1 4 CYS C C -8.032 8.324 -0.785 1.00 . A A . 4 CYS C 1 1 7 3775 1 1 4 CYS CA C -9.156 9.091 -1.481 1.00 . A A . 4 CYS CA 1 1 7 3776 1 1 4 CYS CB C -8.572 10.004 -2.561 1.00 . A A . 4 CYS CB 1 1 7 3777 1 1 4 CYS H H -9.544 10.682 -0.138 1.00 . A A . 4 CYS H 1 1 7 3778 1 1 4 CYS HA H -9.822 8.381 -1.947 1.00 . A A . 4 CYS HA 1 1 7 3779 1 1 4 CYS HB2 H -8.500 11.009 -2.173 1.00 . A A . 4 CYS HB2 1 1 7 3780 1 1 4 CYS HB3 H -7.585 9.653 -2.824 1.00 . A A . 4 CYS HB3 1 1 7 3781 1 1 4 CYS N N -9.936 9.872 -0.526 1.00 . A A . 4 CYS N 1 1 7 3782 1 1 4 CYS O O -7.394 7.464 -1.392 1.00 . A A . 4 CYS O 1 1 7 3783 1 1 4 CYS SG S -9.561 10.073 -4.090 1.00 . A A . 4 CYS SG 1 1 7 3784 1 1 5 THR C C -5.457 7.833 0.456 1.00 . A A . 5 THR C 1 1 7 3785 1 1 5 THR CA C -6.741 7.984 1.269 1.00 . A A . 5 THR CA 1 1 7 3786 1 1 5 THR CB C -7.216 6.614 1.765 1.00 . A A . 5 THR CB 1 1 7 3787 1 1 5 THR CG2 C -7.826 5.751 0.681 1.00 . A A . 5 THR CG2 1 1 7 3788 1 1 5 THR H H -8.332 9.337 0.918 1.00 . A A . 5 THR H 1 1 7 3789 1 1 5 THR HA H -6.532 8.608 2.125 1.00 . A A . 5 THR HA 1 1 7 3790 1 1 5 THR HB H -7.966 6.762 2.529 1.00 . A A . 5 THR HB 1 1 7 3791 1 1 5 THR HG1 H -6.055 6.120 3.262 1.00 . A A . 5 THR HG1 1 1 7 3792 1 1 5 THR HG21 H -7.125 5.645 -0.133 1.00 . A A . 5 THR HG21 1 1 7 3793 1 1 5 THR HG22 H -8.058 4.777 1.085 1.00 . A A . 5 THR HG22 1 1 7 3794 1 1 5 THR HG23 H -8.731 6.215 0.318 1.00 . A A . 5 THR HG23 1 1 7 3795 1 1 5 THR N N -7.791 8.642 0.489 1.00 . A A . 5 THR N 1 1 7 3796 1 1 5 THR O O -5.245 6.819 -0.208 1.00 . A A . 5 THR O 1 1 7 3797 1 1 5 THR OG1 O -6.142 5.889 2.335 1.00 . A A . 5 THR OG1 1 1 7 3798 1 1 6 THR C C -2.295 8.005 0.517 1.00 . A A . 6 THR C 1 1 7 3799 1 1 6 THR CA C -3.342 8.835 -0.218 1.00 . A A . 6 THR CA 1 1 7 3800 1 1 6 THR CB C -2.828 10.261 -0.421 1.00 . A A . 6 THR CB 1 1 7 3801 1 1 6 THR CG2 C -3.352 10.912 -1.683 1.00 . A A . 6 THR CG2 1 1 7 3802 1 1 6 THR H H -4.830 9.633 1.059 1.00 . A A . 6 THR H 1 1 7 3803 1 1 6 THR HA H -3.525 8.388 -1.184 1.00 . A A . 6 THR HA 1 1 7 3804 1 1 6 THR HB H -1.750 10.239 -0.483 1.00 . A A . 6 THR HB 1 1 7 3805 1 1 6 THR HG1 H -2.519 11.754 0.808 1.00 . A A . 6 THR HG1 1 1 7 3806 1 1 6 THR HG21 H -3.759 10.155 -2.336 1.00 . A A . 6 THR HG21 1 1 7 3807 1 1 6 THR HG22 H -4.126 11.621 -1.427 1.00 . A A . 6 THR HG22 1 1 7 3808 1 1 6 THR HG23 H -2.545 11.425 -2.184 1.00 . A A . 6 THR HG23 1 1 7 3809 1 1 6 THR N N -4.604 8.851 0.513 1.00 . A A . 6 THR N 1 1 7 3810 1 1 6 THR O O -2.454 7.689 1.697 1.00 . A A . 6 THR O 1 1 7 3811 1 1 6 THR OG1 O -3.194 11.086 0.672 1.00 . A A . 6 THR OG1 1 1 7 3812 1 1 7 GLY C C 0.384 5.814 -0.536 1.00 . A A . 7 GLY C 1 1 7 3813 1 1 7 GLY CA C -0.166 6.864 0.412 1.00 . A A . 7 GLY CA 1 1 7 3814 1 1 7 GLY H H -1.153 7.935 -1.124 1.00 . A A . 7 GLY H 1 1 7 3815 1 1 7 GLY HA2 H -0.554 6.371 1.291 1.00 . A A . 7 GLY HA2 1 1 7 3816 1 1 7 GLY HA3 H 0.637 7.523 0.707 1.00 . A A . 7 GLY HA3 1 1 7 3817 1 1 7 GLY N N -1.224 7.654 -0.188 1.00 . A A . 7 GLY N 1 1 7 3818 1 1 7 GLY O O -0.110 5.666 -1.653 1.00 . A A . 7 GLY O 1 1 7 3819 1 1 8 PRO C C 1.124 2.801 -1.106 1.00 . A A . 8 PRO C 1 1 7 3820 1 1 8 PRO CA C 2.026 4.022 -0.947 1.00 . A A . 8 PRO CA 1 1 7 3821 1 1 8 PRO CB C 3.294 3.652 -0.177 1.00 . A A . 8 PRO CB 1 1 7 3822 1 1 8 PRO CD C 2.071 5.174 1.203 1.00 . A A . 8 PRO CD 1 1 7 3823 1 1 8 PRO CG C 2.982 3.977 1.242 1.00 . A A . 8 PRO CG 1 1 7 3824 1 1 8 PRO HA H 2.291 4.401 -1.923 1.00 . A A . 8 PRO HA 1 1 7 3825 1 1 8 PRO HB2 H 3.503 2.599 -0.306 1.00 . A A . 8 PRO HB2 1 1 7 3826 1 1 8 PRO HB3 H 4.125 4.237 -0.542 1.00 . A A . 8 PRO HB3 1 1 7 3827 1 1 8 PRO HD2 H 1.344 5.121 2.000 1.00 . A A . 8 PRO HD2 1 1 7 3828 1 1 8 PRO HD3 H 2.643 6.087 1.273 1.00 . A A . 8 PRO HD3 1 1 7 3829 1 1 8 PRO HG2 H 2.483 3.141 1.710 1.00 . A A . 8 PRO HG2 1 1 7 3830 1 1 8 PRO HG3 H 3.892 4.217 1.773 1.00 . A A . 8 PRO HG3 1 1 7 3831 1 1 8 PRO N N 1.416 5.064 -0.115 1.00 . A A . 8 PRO N 1 1 7 3832 1 1 8 PRO O O 1.229 2.064 -2.086 1.00 . A A . 8 PRO O 1 1 7 3833 1 1 9 CYS C C -2.016 1.857 -0.791 1.00 . A A . 9 CYS C 1 1 7 3834 1 1 9 CYS CA C -0.679 1.459 -0.170 1.00 . A A . 9 CYS CA 1 1 7 3835 1 1 9 CYS CB C -0.891 0.909 1.244 1.00 . A A . 9 CYS CB 1 1 7 3836 1 1 9 CYS H H 0.203 3.214 0.621 1.00 . A A . 9 CYS H 1 1 7 3837 1 1 9 CYS HA H -0.229 0.690 -0.780 1.00 . A A . 9 CYS HA 1 1 7 3838 1 1 9 CYS HB2 H -0.465 1.598 1.958 1.00 . A A . 9 CYS HB2 1 1 7 3839 1 1 9 CYS HB3 H -1.950 0.813 1.434 1.00 . A A . 9 CYS HB3 1 1 7 3840 1 1 9 CYS N N 0.239 2.593 -0.136 1.00 . A A . 9 CYS N 1 1 7 3841 1 1 9 CYS O O -3.081 1.531 -0.266 1.00 . A A . 9 CYS O 1 1 7 3842 1 1 9 CYS SG S -0.128 -0.721 1.529 1.00 . A A . 9 CYS SG 1 1 7 3843 1 1 10 CYS C C -3.132 2.557 -4.072 1.00 . A A . 10 CYS C 1 1 7 3844 1 1 10 CYS CA C -3.158 3.002 -2.613 1.00 . A A . 10 CYS CA 1 1 7 3845 1 1 10 CYS CB C -3.294 4.524 -2.536 1.00 . A A . 10 CYS CB 1 1 7 3846 1 1 10 CYS H H -1.076 2.789 -2.290 1.00 . A A . 10 CYS H 1 1 7 3847 1 1 10 CYS HA H -4.008 2.548 -2.125 1.00 . A A . 10 CYS HA 1 1 7 3848 1 1 10 CYS HB2 H -2.629 4.974 -3.258 1.00 . A A . 10 CYS HB2 1 1 7 3849 1 1 10 CYS HB3 H -4.311 4.799 -2.773 1.00 . A A . 10 CYS HB3 1 1 7 3850 1 1 10 CYS N N -1.953 2.562 -1.917 1.00 . A A . 10 CYS N 1 1 7 3851 1 1 10 CYS O O -2.082 2.192 -4.601 1.00 . A A . 10 CYS O 1 1 7 3852 1 1 10 CYS SG S -2.894 5.230 -0.904 1.00 . A A . 10 CYS SG 1 1 7 3853 1 1 11 ARG C C -4.244 3.394 -7.040 1.00 . A A . 11 ARG C 1 1 7 3854 1 1 11 ARG CA C -4.402 2.193 -6.116 1.00 . A A . 11 ARG CA 1 1 7 3855 1 1 11 ARG CB C -5.747 1.511 -6.372 1.00 . A A . 11 ARG CB 1 1 7 3856 1 1 11 ARG CD C -6.642 -0.736 -7.052 1.00 . A A . 11 ARG CD 1 1 7 3857 1 1 11 ARG CG C -5.675 0.387 -7.392 1.00 . A A . 11 ARG CG 1 1 7 3858 1 1 11 ARG CZ C -8.104 -0.910 -9.028 1.00 . A A . 11 ARG CZ 1 1 7 3859 1 1 11 ARG H H -5.096 2.893 -4.242 1.00 . A A . 11 ARG H 1 1 7 3860 1 1 11 ARG HA H -3.611 1.495 -6.322 1.00 . A A . 11 ARG HA 1 1 7 3861 1 1 11 ARG HB2 H -6.113 1.102 -5.442 1.00 . A A . 11 ARG HB2 1 1 7 3862 1 1 11 ARG HB3 H -6.449 2.249 -6.730 1.00 . A A . 11 ARG HB3 1 1 7 3863 1 1 11 ARG HD2 H -6.194 -1.677 -7.334 1.00 . A A . 11 ARG HD2 1 1 7 3864 1 1 11 ARG HD3 H -6.821 -0.729 -5.987 1.00 . A A . 11 ARG HD3 1 1 7 3865 1 1 11 ARG HE H -8.675 -0.236 -7.238 1.00 . A A . 11 ARG HE 1 1 7 3866 1 1 11 ARG HG2 H -5.925 0.780 -8.366 1.00 . A A . 11 ARG HG2 1 1 7 3867 1 1 11 ARG HG3 H -4.670 -0.008 -7.408 1.00 . A A . 11 ARG HG3 1 1 7 3868 1 1 11 ARG HH11 H -6.201 -1.519 -9.338 1.00 . A A . 11 ARG HH11 1 1 7 3869 1 1 11 ARG HH12 H -7.249 -1.631 -10.711 1.00 . A A . 11 ARG HH12 1 1 7 3870 1 1 11 ARG HH21 H -10.055 -0.383 -9.043 1.00 . A A . 11 ARG HH21 1 1 7 3871 1 1 11 ARG HH22 H -9.437 -0.986 -10.545 1.00 . A A . 11 ARG HH22 1 1 7 3872 1 1 11 ARG N N -4.293 2.592 -4.717 1.00 . A A . 11 ARG N 1 1 7 3873 1 1 11 ARG NE N -7.918 -0.591 -7.749 1.00 . A A . 11 ARG NE 1 1 7 3874 1 1 11 ARG NH1 N -7.102 -1.393 -9.751 1.00 . A A . 11 ARG NH1 1 1 7 3875 1 1 11 ARG NH2 N -9.297 -0.746 -9.584 1.00 . A A . 11 ARG NH2 1 1 7 3876 1 1 11 ARG O O -3.766 3.267 -8.167 1.00 . A A . 11 ARG O 1 1 7 3877 1 1 12 GLN C C -5.309 6.912 -6.574 1.00 . A A . 12 GLN C 1 1 7 3878 1 1 12 GLN CA C -4.567 5.802 -7.309 1.00 . A A . 12 GLN CA 1 1 7 3879 1 1 12 GLN CB C -5.156 5.622 -8.714 1.00 . A A . 12 GLN CB 1 1 7 3880 1 1 12 GLN CD C -6.636 7.518 -9.487 1.00 . A A . 12 GLN CD 1 1 7 3881 1 1 12 GLN CG C -5.246 6.914 -9.511 1.00 . A A . 12 GLN CG 1 1 7 3882 1 1 12 GLN H H -5.018 4.583 -5.640 1.00 . A A . 12 GLN H 1 1 7 3883 1 1 12 GLN HA H -3.525 6.072 -7.392 1.00 . A A . 12 GLN HA 1 1 7 3884 1 1 12 GLN HB2 H -4.538 4.931 -9.266 1.00 . A A . 12 GLN HB2 1 1 7 3885 1 1 12 GLN HB3 H -6.150 5.210 -8.624 1.00 . A A . 12 GLN HB3 1 1 7 3886 1 1 12 GLN HE21 H -5.882 9.330 -9.809 1.00 . A A . 12 GLN HE21 1 1 7 3887 1 1 12 GLN HE22 H -7.602 9.248 -9.660 1.00 . A A . 12 GLN HE22 1 1 7 3888 1 1 12 GLN HG2 H -4.553 7.629 -9.093 1.00 . A A . 12 GLN HG2 1 1 7 3889 1 1 12 GLN HG3 H -4.975 6.709 -10.536 1.00 . A A . 12 GLN HG3 1 1 7 3890 1 1 12 GLN N N -4.650 4.558 -6.548 1.00 . A A . 12 GLN N 1 1 7 3891 1 1 12 GLN NE2 N -6.715 8.831 -9.671 1.00 . A A . 12 GLN NE2 1 1 7 3892 1 1 12 GLN O O -4.954 8.087 -6.675 1.00 . A A . 12 GLN O 1 1 7 3893 1 1 12 GLN OE1 O -7.629 6.813 -9.306 1.00 . A A . 12 GLN OE1 1 1 7 3894 1 1 13 CYS C C -8.001 6.762 -4.038 1.00 . A A . 13 CYS C 1 1 7 3895 1 1 13 CYS CA C -7.142 7.479 -5.074 1.00 . A A . 13 CYS CA 1 1 7 3896 1 1 13 CYS CB C -8.030 8.295 -6.016 1.00 . A A . 13 CYS CB 1 1 7 3897 1 1 13 CYS H H -6.571 5.571 -5.795 1.00 . A A . 13 CYS H 1 1 7 3898 1 1 13 CYS HA H -6.465 8.147 -4.563 1.00 . A A . 13 CYS HA 1 1 7 3899 1 1 13 CYS HB2 H -7.626 8.242 -7.015 1.00 . A A . 13 CYS HB2 1 1 7 3900 1 1 13 CYS HB3 H -9.026 7.875 -6.013 1.00 . A A . 13 CYS HB3 1 1 7 3901 1 1 13 CYS N N -6.342 6.525 -5.833 1.00 . A A . 13 CYS N 1 1 7 3902 1 1 13 CYS O O -9.100 7.210 -3.711 1.00 . A A . 13 CYS O 1 1 7 3903 1 1 13 CYS SG S -8.169 10.056 -5.568 1.00 . A A . 13 CYS SG 1 1 7 3904 1 1 14 LYS C C -7.337 3.746 -1.974 1.00 . A A . 14 LYS C 1 1 7 3905 1 1 14 LYS CA C -8.214 4.865 -2.528 1.00 . A A . 14 LYS CA 1 1 7 3906 1 1 14 LYS CB C -9.490 4.277 -3.133 1.00 . A A . 14 LYS CB 1 1 7 3907 1 1 14 LYS CD C -11.973 4.299 -2.746 1.00 . A A . 14 LYS CD 1 1 7 3908 1 1 14 LYS CE C -13.225 5.161 -2.713 1.00 . A A . 14 LYS CE 1 1 7 3909 1 1 14 LYS CG C -10.720 5.143 -2.918 1.00 . A A . 14 LYS CG 1 1 7 3910 1 1 14 LYS H H -6.612 5.338 -3.827 1.00 . A A . 14 LYS H 1 1 7 3911 1 1 14 LYS HA H -8.482 5.528 -1.719 1.00 . A A . 14 LYS HA 1 1 7 3912 1 1 14 LYS HB2 H -9.346 4.152 -4.196 1.00 . A A . 14 LYS HB2 1 1 7 3913 1 1 14 LYS HB3 H -9.675 3.310 -2.688 1.00 . A A . 14 LYS HB3 1 1 7 3914 1 1 14 LYS HD2 H -12.046 3.608 -3.572 1.00 . A A . 14 LYS HD2 1 1 7 3915 1 1 14 LYS HD3 H -11.900 3.749 -1.819 1.00 . A A . 14 LYS HD3 1 1 7 3916 1 1 14 LYS HE2 H -13.934 4.717 -2.029 1.00 . A A . 14 LYS HE2 1 1 7 3917 1 1 14 LYS HE3 H -12.958 6.147 -2.363 1.00 . A A . 14 LYS HE3 1 1 7 3918 1 1 14 LYS HG2 H -10.577 5.741 -2.030 1.00 . A A . 14 LYS HG2 1 1 7 3919 1 1 14 LYS HG3 H -10.847 5.790 -3.774 1.00 . A A . 14 LYS HG3 1 1 7 3920 1 1 14 LYS HZ1 H -13.124 5.300 -4.795 1.00 . A A . 14 LYS HZ1 1 1 7 3921 1 1 14 LYS HZ2 H -14.480 4.462 -4.229 1.00 . A A . 14 LYS HZ2 1 1 7 3922 1 1 14 LYS HZ3 H -14.418 6.149 -4.114 1.00 . A A . 14 LYS HZ3 1 1 7 3923 1 1 14 LYS N N -7.493 5.645 -3.526 1.00 . A A . 14 LYS N 1 1 7 3924 1 1 14 LYS NZ N -13.856 5.276 -4.056 1.00 . A A . 14 LYS NZ 1 1 7 3925 1 1 14 LYS O O -6.234 3.506 -2.467 1.00 . A A . 14 LYS O 1 1 7 3926 1 1 15 LEU C C -6.807 0.867 -1.337 1.00 . A A . 15 LEU C 1 1 7 3927 1 1 15 LEU CA C -7.100 1.971 -0.325 1.00 . A A . 15 LEU CA 1 1 7 3928 1 1 15 LEU CB C -7.895 1.404 0.854 1.00 . A A . 15 LEU CB 1 1 7 3929 1 1 15 LEU CD1 C -8.007 1.305 3.357 1.00 . A A . 15 LEU CD1 1 1 7 3930 1 1 15 LEU CD2 C -6.359 -0.117 2.122 1.00 . A A . 15 LEU CD2 1 1 7 3931 1 1 15 LEU CG C -7.094 1.215 2.143 1.00 . A A . 15 LEU CG 1 1 7 3932 1 1 15 LEU H H -8.719 3.305 -0.601 1.00 . A A . 15 LEU H 1 1 7 3933 1 1 15 LEU HA H -6.164 2.366 0.040 1.00 . A A . 15 LEU HA 1 1 7 3934 1 1 15 LEU HB2 H -8.717 2.074 1.061 1.00 . A A . 15 LEU HB2 1 1 7 3935 1 1 15 LEU HB3 H -8.298 0.446 0.565 1.00 . A A . 15 LEU HB3 1 1 7 3936 1 1 15 LEU HD11 H -8.935 1.781 3.076 1.00 . A A . 15 LEU HD11 1 1 7 3937 1 1 15 LEU HD12 H -8.210 0.311 3.729 1.00 . A A . 15 LEU HD12 1 1 7 3938 1 1 15 LEU HD13 H -7.524 1.886 4.128 1.00 . A A . 15 LEU HD13 1 1 7 3939 1 1 15 LEU HD21 H -5.744 -0.175 1.236 1.00 . A A . 15 LEU HD21 1 1 7 3940 1 1 15 LEU HD22 H -5.735 -0.198 3.000 1.00 . A A . 15 LEU HD22 1 1 7 3941 1 1 15 LEU HD23 H -7.077 -0.924 2.115 1.00 . A A . 15 LEU HD23 1 1 7 3942 1 1 15 LEU HG H -6.358 2.003 2.221 1.00 . A A . 15 LEU HG 1 1 7 3943 1 1 15 LEU N N -7.835 3.065 -0.948 1.00 . A A . 15 LEU N 1 1 7 3944 1 1 15 LEU O O -7.656 0.522 -2.158 1.00 . A A . 15 LEU O 1 1 7 3945 1 1 16 LYS C C -5.691 -2.106 -1.678 1.00 . A A . 16 LYS C 1 1 7 3946 1 1 16 LYS CA C -5.196 -0.751 -2.178 1.00 . A A . 16 LYS CA 1 1 7 3947 1 1 16 LYS CB C -3.673 -0.773 -2.326 1.00 . A A . 16 LYS CB 1 1 7 3948 1 1 16 LYS CD C -1.803 -0.747 -4.004 1.00 . A A . 16 LYS CD 1 1 7 3949 1 1 16 LYS CE C -1.566 -0.663 -5.503 1.00 . A A . 16 LYS CE 1 1 7 3950 1 1 16 LYS CG C -3.200 -1.255 -3.688 1.00 . A A . 16 LYS CG 1 1 7 3951 1 1 16 LYS H H -4.966 0.632 -0.592 1.00 . A A . 16 LYS H 1 1 7 3952 1 1 16 LYS HA H -5.640 -0.550 -3.142 1.00 . A A . 16 LYS HA 1 1 7 3953 1 1 16 LYS HB2 H -3.294 0.225 -2.170 1.00 . A A . 16 LYS HB2 1 1 7 3954 1 1 16 LYS HB3 H -3.260 -1.428 -1.573 1.00 . A A . 16 LYS HB3 1 1 7 3955 1 1 16 LYS HD2 H -1.682 0.237 -3.575 1.00 . A A . 16 LYS HD2 1 1 7 3956 1 1 16 LYS HD3 H -1.079 -1.422 -3.571 1.00 . A A . 16 LYS HD3 1 1 7 3957 1 1 16 LYS HE2 H -2.220 -1.365 -5.998 1.00 . A A . 16 LYS HE2 1 1 7 3958 1 1 16 LYS HE3 H -1.798 0.339 -5.835 1.00 . A A . 16 LYS HE3 1 1 7 3959 1 1 16 LYS HG2 H -3.189 -2.334 -3.694 1.00 . A A . 16 LYS HG2 1 1 7 3960 1 1 16 LYS HG3 H -3.884 -0.895 -4.443 1.00 . A A . 16 LYS HG3 1 1 7 3961 1 1 16 LYS HZ1 H 0.468 -0.797 -5.050 1.00 . A A . 16 LYS HZ1 1 1 7 3962 1 1 16 LYS HZ2 H -0.073 -1.980 -6.133 1.00 . A A . 16 LYS HZ2 1 1 7 3963 1 1 16 LYS HZ3 H 0.151 -0.388 -6.660 1.00 . A A . 16 LYS HZ3 1 1 7 3964 1 1 16 LYS N N -5.600 0.315 -1.270 1.00 . A A . 16 LYS N 1 1 7 3965 1 1 16 LYS NZ N -0.156 -0.979 -5.861 1.00 . A A . 16 LYS NZ 1 1 7 3966 1 1 16 LYS O O -5.758 -2.344 -0.472 1.00 . A A . 16 LYS O 1 1 7 3967 1 1 17 PRO C C -5.597 -5.078 -1.287 1.00 . A A . 17 PRO C 1 1 7 3968 1 1 17 PRO CA C -6.538 -4.352 -2.242 1.00 . A A . 17 PRO CA 1 1 7 3969 1 1 17 PRO CB C -6.602 -5.083 -3.585 1.00 . A A . 17 PRO CB 1 1 7 3970 1 1 17 PRO CD C -6.000 -2.820 -4.062 1.00 . A A . 17 PRO CD 1 1 7 3971 1 1 17 PRO CG C -6.758 -4.002 -4.598 1.00 . A A . 17 PRO CG 1 1 7 3972 1 1 17 PRO HA H -7.525 -4.306 -1.806 1.00 . A A . 17 PRO HA 1 1 7 3973 1 1 17 PRO HB2 H -5.690 -5.641 -3.739 1.00 . A A . 17 PRO HB2 1 1 7 3974 1 1 17 PRO HB3 H -7.448 -5.754 -3.593 1.00 . A A . 17 PRO HB3 1 1 7 3975 1 1 17 PRO HD2 H -4.981 -2.832 -4.420 1.00 . A A . 17 PRO HD2 1 1 7 3976 1 1 17 PRO HD3 H -6.489 -1.899 -4.342 1.00 . A A . 17 PRO HD3 1 1 7 3977 1 1 17 PRO HG2 H -6.339 -4.320 -5.541 1.00 . A A . 17 PRO HG2 1 1 7 3978 1 1 17 PRO HG3 H -7.803 -3.755 -4.714 1.00 . A A . 17 PRO HG3 1 1 7 3979 1 1 17 PRO N N -6.047 -3.018 -2.601 1.00 . A A . 17 PRO N 1 1 7 3980 1 1 17 PRO O O -4.376 -4.974 -1.404 1.00 . A A . 17 PRO O 1 1 7 3981 1 1 18 ALA C C -4.472 -7.568 -0.057 1.00 . A A . 18 ALA C 1 1 7 3982 1 1 18 ALA CA C -5.386 -6.560 0.632 1.00 . A A . 18 ALA CA 1 1 7 3983 1 1 18 ALA CB C -6.301 -7.265 1.622 1.00 . A A . 18 ALA CB 1 1 7 3984 1 1 18 ALA H H -7.151 -5.860 -0.301 1.00 . A A . 18 ALA H 1 1 7 3985 1 1 18 ALA HA H -4.778 -5.854 1.180 1.00 . A A . 18 ALA HA 1 1 7 3986 1 1 18 ALA HB1 H -7.254 -6.757 1.656 1.00 . A A . 18 ALA HB1 1 1 7 3987 1 1 18 ALA HB2 H -6.450 -8.288 1.309 1.00 . A A . 18 ALA HB2 1 1 7 3988 1 1 18 ALA HB3 H -5.850 -7.251 2.603 1.00 . A A . 18 ALA HB3 1 1 7 3989 1 1 18 ALA N N -6.173 -5.815 -0.342 1.00 . A A . 18 ALA N 1 1 7 3990 1 1 18 ALA O O -4.936 -8.571 -0.600 1.00 . A A . 18 ALA O 1 1 7 3991 1 1 19 GLY C C -1.507 -7.546 -1.839 1.00 . A A . 19 GLY C 1 1 7 3992 1 1 19 GLY CA C -2.213 -8.185 -0.658 1.00 . A A . 19 GLY CA 1 1 7 3993 1 1 19 GLY H H -2.861 -6.480 0.416 1.00 . A A . 19 GLY H 1 1 7 3994 1 1 19 GLY HA2 H -2.730 -9.071 -0.998 1.00 . A A . 19 GLY HA2 1 1 7 3995 1 1 19 GLY HA3 H -1.474 -8.473 0.076 1.00 . A A . 19 GLY HA3 1 1 7 3996 1 1 19 GLY N N -3.172 -7.294 -0.032 1.00 . A A . 19 GLY N 1 1 7 3997 1 1 19 GLY O O -1.007 -8.243 -2.721 1.00 . A A . 19 GLY O 1 1 7 3998 1 1 20 THR C C 0.490 -4.859 -2.457 1.00 . A A . 20 THR C 1 1 7 3999 1 1 20 THR CA C -0.815 -5.487 -2.937 1.00 . A A . 20 THR CA 1 1 7 4000 1 1 20 THR CB C -1.746 -4.403 -3.482 1.00 . A A . 20 THR CB 1 1 7 4001 1 1 20 THR CG2 C -1.227 -3.746 -4.743 1.00 . A A . 20 THR CG2 1 1 7 4002 1 1 20 THR H H -1.881 -5.716 -1.124 1.00 . A A . 20 THR H 1 1 7 4003 1 1 20 THR HA H -0.594 -6.190 -3.726 1.00 . A A . 20 THR HA 1 1 7 4004 1 1 20 THR HB H -1.863 -3.633 -2.733 1.00 . A A . 20 THR HB 1 1 7 4005 1 1 20 THR HG1 H -3.593 -4.246 -4.113 1.00 . A A . 20 THR HG1 1 1 7 4006 1 1 20 THR HG21 H -0.862 -4.505 -5.420 1.00 . A A . 20 THR HG21 1 1 7 4007 1 1 20 THR HG22 H -2.025 -3.195 -5.217 1.00 . A A . 20 THR HG22 1 1 7 4008 1 1 20 THR HG23 H -0.422 -3.071 -4.492 1.00 . A A . 20 THR HG23 1 1 7 4009 1 1 20 THR N N -1.466 -6.217 -1.856 1.00 . A A . 20 THR N 1 1 7 4010 1 1 20 THR O O 0.487 -3.977 -1.599 1.00 . A A . 20 THR O 1 1 7 4011 1 1 20 THR OG1 O -3.024 -4.940 -3.772 1.00 . A A . 20 THR OG1 1 1 7 4012 1 1 21 THR C C 3.006 -3.304 -2.897 1.00 . A A . 21 THR C 1 1 7 4013 1 1 21 THR CA C 2.916 -4.806 -2.642 1.00 . A A . 21 THR CA 1 1 7 4014 1 1 21 THR CB C 4.017 -5.537 -3.418 1.00 . A A . 21 THR CB 1 1 7 4015 1 1 21 THR CG2 C 5.078 -6.140 -2.522 1.00 . A A . 21 THR CG2 1 1 7 4016 1 1 21 THR H H 1.542 -6.026 -3.693 1.00 . A A . 21 THR H 1 1 7 4017 1 1 21 THR HA H 3.053 -4.987 -1.587 1.00 . A A . 21 THR HA 1 1 7 4018 1 1 21 THR HB H 4.504 -4.836 -4.081 1.00 . A A . 21 THR HB 1 1 7 4019 1 1 21 THR HG1 H 3.112 -7.262 -3.625 1.00 . A A . 21 THR HG1 1 1 7 4020 1 1 21 THR HG21 H 4.604 -6.693 -1.725 1.00 . A A . 21 THR HG21 1 1 7 4021 1 1 21 THR HG22 H 5.702 -6.805 -3.101 1.00 . A A . 21 THR HG22 1 1 7 4022 1 1 21 THR HG23 H 5.684 -5.351 -2.102 1.00 . A A . 21 THR HG23 1 1 7 4023 1 1 21 THR N N 1.604 -5.321 -3.016 1.00 . A A . 21 THR N 1 1 7 4024 1 1 21 THR O O 2.368 -2.780 -3.810 1.00 . A A . 21 THR O 1 1 7 4025 1 1 21 THR OG1 O 3.472 -6.584 -4.201 1.00 . A A . 21 THR OG1 1 1 7 4026 1 1 22 CYS C C 5.041 -0.855 -3.264 1.00 . A A . 22 CYS C 1 1 7 4027 1 1 22 CYS CA C 3.977 -1.177 -2.220 1.00 . A A . 22 CYS CA 1 1 7 4028 1 1 22 CYS CB C 4.364 -0.561 -0.874 1.00 . A A . 22 CYS CB 1 1 7 4029 1 1 22 CYS H H 4.285 -3.094 -1.375 1.00 . A A . 22 CYS H 1 1 7 4030 1 1 22 CYS HA H 3.036 -0.758 -2.541 1.00 . A A . 22 CYS HA 1 1 7 4031 1 1 22 CYS HB2 H 5.129 -1.168 -0.414 1.00 . A A . 22 CYS HB2 1 1 7 4032 1 1 22 CYS HB3 H 4.753 0.433 -1.041 1.00 . A A . 22 CYS HB3 1 1 7 4033 1 1 22 CYS N N 3.803 -2.619 -2.084 1.00 . A A . 22 CYS N 1 1 7 4034 1 1 22 CYS O O 4.847 0.016 -4.113 1.00 . A A . 22 CYS O 1 1 7 4035 1 1 22 CYS SG S 2.983 -0.426 0.306 1.00 . A A . 22 CYS SG 1 1 7 4036 1 1 23 TRP C C 8.109 -2.609 -4.272 1.00 . A A . 23 TRP C 1 1 7 4037 1 1 23 TRP CA C 7.259 -1.350 -4.135 1.00 . A A . 23 TRP CA 1 1 7 4038 1 1 23 TRP CB C 8.132 -0.179 -3.679 1.00 . A A . 23 TRP CB 1 1 7 4039 1 1 23 TRP CD1 C 9.102 0.545 -5.937 1.00 . A A . 23 TRP CD1 1 1 7 4040 1 1 23 TRP CD2 C 10.642 0.105 -4.373 1.00 . A A . 23 TRP CD2 1 1 7 4041 1 1 23 TRP CE2 C 11.301 0.489 -5.557 1.00 . A A . 23 TRP CE2 1 1 7 4042 1 1 23 TRP CE3 C 11.409 -0.220 -3.251 1.00 . A A . 23 TRP CE3 1 1 7 4043 1 1 23 TRP CG C 9.235 0.148 -4.638 1.00 . A A . 23 TRP CG 1 1 7 4044 1 1 23 TRP CH2 C 13.414 0.233 -4.534 1.00 . A A . 23 TRP CH2 1 1 7 4045 1 1 23 TRP CZ2 C 12.689 0.556 -5.648 1.00 . A A . 23 TRP CZ2 1 1 7 4046 1 1 23 TRP CZ3 C 12.787 -0.152 -3.343 1.00 . A A . 23 TRP CZ3 1 1 7 4047 1 1 23 TRP H H 6.259 -2.241 -2.496 1.00 . A A . 23 TRP H 1 1 7 4048 1 1 23 TRP HA H 6.829 -1.113 -5.097 1.00 . A A . 23 TRP HA 1 1 7 4049 1 1 23 TRP HB2 H 7.515 0.700 -3.569 1.00 . A A . 23 TRP HB2 1 1 7 4050 1 1 23 TRP HB3 H 8.578 -0.422 -2.725 1.00 . A A . 23 TRP HB3 1 1 7 4051 1 1 23 TRP HD1 H 8.154 0.673 -6.439 1.00 . A A . 23 TRP HD1 1 1 7 4052 1 1 23 TRP HE1 H 10.506 1.042 -7.418 1.00 . A A . 23 TRP HE1 1 1 7 4053 1 1 23 TRP HE3 H 10.943 -0.519 -2.323 1.00 . A A . 23 TRP HE3 1 1 7 4054 1 1 23 TRP HH2 H 14.493 0.271 -4.561 1.00 . A A . 23 TRP HH2 1 1 7 4055 1 1 23 TRP HZ2 H 13.188 0.852 -6.559 1.00 . A A . 23 TRP HZ2 1 1 7 4056 1 1 23 TRP HZ3 H 13.395 -0.400 -2.486 1.00 . A A . 23 TRP HZ3 1 1 7 4057 1 1 23 TRP N N 6.164 -1.561 -3.195 1.00 . A A . 23 TRP N 1 1 7 4058 1 1 23 TRP NE1 N 10.339 0.752 -6.497 1.00 . A A . 23 TRP NE1 1 1 7 4059 1 1 23 TRP O O 9.166 -2.727 -3.654 1.00 . A A . 23 TRP O 1 1 7 4060 1 1 24 ARG C C 9.647 -4.558 -6.081 1.00 . A A . 24 ARG C 1 1 7 4061 1 1 24 ARG CA C 8.355 -4.799 -5.306 1.00 . A A . 24 ARG CA 1 1 7 4062 1 1 24 ARG CB C 7.471 -5.792 -6.063 1.00 . A A . 24 ARG CB 1 1 7 4063 1 1 24 ARG CD C 6.792 -8.211 -6.036 1.00 . A A . 24 ARG CD 1 1 7 4064 1 1 24 ARG CG C 7.951 -7.231 -5.966 1.00 . A A . 24 ARG CG 1 1 7 4065 1 1 24 ARG CZ C 6.425 -10.606 -5.589 1.00 . A A . 24 ARG CZ 1 1 7 4066 1 1 24 ARG H H 6.790 -3.396 -5.553 1.00 . A A . 24 ARG H 1 1 7 4067 1 1 24 ARG HA H 8.601 -5.213 -4.340 1.00 . A A . 24 ARG HA 1 1 7 4068 1 1 24 ARG HB2 H 6.469 -5.742 -5.662 1.00 . A A . 24 ARG HB2 1 1 7 4069 1 1 24 ARG HB3 H 7.447 -5.513 -7.106 1.00 . A A . 24 ARG HB3 1 1 7 4070 1 1 24 ARG HD2 H 5.936 -7.773 -5.544 1.00 . A A . 24 ARG HD2 1 1 7 4071 1 1 24 ARG HD3 H 6.554 -8.394 -7.073 1.00 . A A . 24 ARG HD3 1 1 7 4072 1 1 24 ARG HE H 7.873 -9.500 -4.776 1.00 . A A . 24 ARG HE 1 1 7 4073 1 1 24 ARG HG2 H 8.628 -7.430 -6.783 1.00 . A A . 24 ARG HG2 1 1 7 4074 1 1 24 ARG HG3 H 8.469 -7.365 -5.027 1.00 . A A . 24 ARG HG3 1 1 7 4075 1 1 24 ARG HH11 H 5.111 -9.786 -6.889 1.00 . A A . 24 ARG HH11 1 1 7 4076 1 1 24 ARG HH12 H 4.874 -11.469 -6.558 1.00 . A A . 24 ARG HH12 1 1 7 4077 1 1 24 ARG HH21 H 7.564 -11.714 -4.340 1.00 . A A . 24 ARG HH21 1 1 7 4078 1 1 24 ARG HH22 H 6.267 -12.564 -5.110 1.00 . A A . 24 ARG HH22 1 1 7 4079 1 1 24 ARG N N 7.639 -3.548 -5.087 1.00 . A A . 24 ARG N 1 1 7 4080 1 1 24 ARG NE N 7.110 -9.482 -5.390 1.00 . A A . 24 ARG NE 1 1 7 4081 1 1 24 ARG NH1 N 5.385 -10.621 -6.413 1.00 . A A . 24 ARG NH1 1 1 7 4082 1 1 24 ARG NH2 N 6.781 -11.719 -4.962 1.00 . A A . 24 ARG NH2 1 1 7 4083 1 1 24 ARG O O 9.657 -3.845 -7.084 1.00 . A A . 24 ARG O 1 1 7 4084 1 1 25 THR C C 12.999 -6.094 -5.796 1.00 . A A . 25 THR C 1 1 7 4085 1 1 25 THR CA C 12.033 -5.008 -6.256 1.00 . A A . 25 THR CA 1 1 7 4086 1 1 25 THR CB C 12.619 -3.627 -5.958 1.00 . A A . 25 THR CB 1 1 7 4087 1 1 25 THR CG2 C 12.876 -3.392 -4.485 1.00 . A A . 25 THR CG2 1 1 7 4088 1 1 25 THR H H 10.664 -5.713 -4.804 1.00 . A A . 25 THR H 1 1 7 4089 1 1 25 THR HA H 11.884 -5.103 -7.321 1.00 . A A . 25 THR HA 1 1 7 4090 1 1 25 THR HB H 11.926 -2.872 -6.298 1.00 . A A . 25 THR HB 1 1 7 4091 1 1 25 THR HG1 H 13.750 -3.728 -7.554 1.00 . A A . 25 THR HG1 1 1 7 4092 1 1 25 THR HG21 H 13.405 -4.238 -4.072 1.00 . A A . 25 THR HG21 1 1 7 4093 1 1 25 THR HG22 H 13.471 -2.499 -4.361 1.00 . A A . 25 THR HG22 1 1 7 4094 1 1 25 THR HG23 H 11.934 -3.270 -3.971 1.00 . A A . 25 THR HG23 1 1 7 4095 1 1 25 THR N N 10.735 -5.157 -5.608 1.00 . A A . 25 THR N 1 1 7 4096 1 1 25 THR O O 14.203 -5.861 -5.687 1.00 . A A . 25 THR O 1 1 7 4097 1 1 25 THR OG1 O 13.846 -3.445 -6.642 1.00 . A A . 25 THR OG1 1 1 7 4098 1 1 26 SER C C 13.614 -8.288 -3.595 1.00 . A A . 26 SER C 1 1 7 4099 1 1 26 SER CA C 13.266 -8.417 -5.073 1.00 . A A . 26 SER CA 1 1 7 4100 1 1 26 SER CB C 14.547 -8.543 -5.903 1.00 . A A . 26 SER CB 1 1 7 4101 1 1 26 SER H H 11.496 -7.399 -5.630 1.00 . A A . 26 SER H 1 1 7 4102 1 1 26 SER HA H 12.676 -9.308 -5.207 1.00 . A A . 26 SER HA 1 1 7 4103 1 1 26 SER HB2 H 14.352 -8.218 -6.914 1.00 . A A . 26 SER HB2 1 1 7 4104 1 1 26 SER HB3 H 15.317 -7.922 -5.468 1.00 . A A . 26 SER HB3 1 1 7 4105 1 1 26 SER HG H 15.803 -9.936 -6.467 1.00 . A A . 26 SER HG 1 1 7 4106 1 1 26 SER N N 12.461 -7.282 -5.525 1.00 . A A . 26 SER N 1 1 7 4107 1 1 26 SER O O 13.316 -9.175 -2.795 1.00 . A A . 26 SER O 1 1 7 4108 1 1 26 SER OG O 15.005 -9.883 -5.936 1.00 . A A . 26 SER OG 1 1 7 4109 1 1 27 VAL C C 13.464 -6.393 -1.045 1.00 . A A . 27 VAL C 1 1 7 4110 1 1 27 VAL CA C 14.637 -6.925 -1.860 1.00 . A A . 27 VAL CA 1 1 7 4111 1 1 27 VAL CB C 15.800 -5.920 -1.781 1.00 . A A . 27 VAL CB 1 1 7 4112 1 1 27 VAL CG1 C 17.074 -6.530 -2.346 1.00 . A A . 27 VAL CG1 1 1 7 4113 1 1 27 VAL CG2 C 15.445 -4.634 -2.513 1.00 . A A . 27 VAL CG2 1 1 7 4114 1 1 27 VAL H H 14.452 -6.513 -3.927 1.00 . A A . 27 VAL H 1 1 7 4115 1 1 27 VAL HA H 14.966 -7.860 -1.431 1.00 . A A . 27 VAL HA 1 1 7 4116 1 1 27 VAL HB H 15.973 -5.681 -0.742 1.00 . A A . 27 VAL HB 1 1 7 4117 1 1 27 VAL HG11 H 17.110 -7.580 -2.099 1.00 . A A . 27 VAL HG11 1 1 7 4118 1 1 27 VAL HG12 H 17.084 -6.412 -3.419 1.00 . A A . 27 VAL HG12 1 1 7 4119 1 1 27 VAL HG13 H 17.932 -6.030 -1.920 1.00 . A A . 27 VAL HG13 1 1 7 4120 1 1 27 VAL HG21 H 14.456 -4.314 -2.220 1.00 . A A . 27 VAL HG21 1 1 7 4121 1 1 27 VAL HG22 H 16.162 -3.867 -2.260 1.00 . A A . 27 VAL HG22 1 1 7 4122 1 1 27 VAL HG23 H 15.466 -4.809 -3.578 1.00 . A A . 27 VAL HG23 1 1 7 4123 1 1 27 VAL N N 14.245 -7.178 -3.241 1.00 . A A . 27 VAL N 1 1 7 4124 1 1 27 VAL O O 13.359 -6.653 0.154 1.00 . A A . 27 VAL O 1 1 7 4125 1 1 28 SER C C 10.141 -5.796 -1.465 1.00 . A A . 28 SER C 1 1 7 4126 1 1 28 SER CA C 11.416 -5.076 -1.038 1.00 . A A . 28 SER CA 1 1 7 4127 1 1 28 SER CB C 11.303 -3.583 -1.352 1.00 . A A . 28 SER CB 1 1 7 4128 1 1 28 SER H H 12.720 -5.474 -2.657 1.00 . A A . 28 SER H 1 1 7 4129 1 1 28 SER HA H 11.547 -5.202 0.026 1.00 . A A . 28 SER HA 1 1 7 4130 1 1 28 SER HB2 H 12.290 -3.148 -1.384 1.00 . A A . 28 SER HB2 1 1 7 4131 1 1 28 SER HB3 H 10.822 -3.455 -2.311 1.00 . A A . 28 SER HB3 1 1 7 4132 1 1 28 SER HG H 10.427 -1.992 -0.619 1.00 . A A . 28 SER HG 1 1 7 4133 1 1 28 SER N N 12.583 -5.646 -1.702 1.00 . A A . 28 SER N 1 1 7 4134 1 1 28 SER O O 10.023 -6.246 -2.605 1.00 . A A . 28 SER O 1 1 7 4135 1 1 28 SER OG O 10.540 -2.911 -0.365 1.00 . A A . 28 SER OG 1 1 7 4136 1 1 29 SER C C 6.954 -6.405 0.342 1.00 . A A . 29 SER C 1 1 7 4137 1 1 29 SER CA C 7.923 -6.565 -0.825 1.00 . A A . 29 SER CA 1 1 7 4138 1 1 29 SER CB C 8.154 -8.050 -1.111 1.00 . A A . 29 SER CB 1 1 7 4139 1 1 29 SER H H 9.343 -5.521 0.347 1.00 . A A . 29 SER H 1 1 7 4140 1 1 29 SER HA H 7.493 -6.102 -1.700 1.00 . A A . 29 SER HA 1 1 7 4141 1 1 29 SER HB2 H 9.015 -8.391 -0.555 1.00 . A A . 29 SER HB2 1 1 7 4142 1 1 29 SER HB3 H 7.284 -8.613 -0.808 1.00 . A A . 29 SER HB3 1 1 7 4143 1 1 29 SER HG H 8.752 -9.152 -2.616 1.00 . A A . 29 SER HG 1 1 7 4144 1 1 29 SER N N 9.190 -5.900 -0.543 1.00 . A A . 29 SER N 1 1 7 4145 1 1 29 SER O O 6.788 -7.316 1.154 1.00 . A A . 29 SER O 1 1 7 4146 1 1 29 SER OG O 8.386 -8.274 -2.491 1.00 . A A . 29 SER OG 1 1 7 4147 1 1 30 HIS C C 3.931 -4.995 0.962 1.00 . A A . 30 HIS C 1 1 7 4148 1 1 30 HIS CA C 5.363 -4.963 1.488 1.00 . A A . 30 HIS CA 1 1 7 4149 1 1 30 HIS CB C 5.656 -3.600 2.118 1.00 . A A . 30 HIS CB 1 1 7 4150 1 1 30 HIS CD2 C 8.240 -3.713 2.313 1.00 . A A . 30 HIS CD2 1 1 7 4151 1 1 30 HIS CE1 C 8.421 -3.245 4.447 1.00 . A A . 30 HIS CE1 1 1 7 4152 1 1 30 HIS CG C 6.989 -3.529 2.796 1.00 . A A . 30 HIS CG 1 1 7 4153 1 1 30 HIS H H 6.490 -4.555 -0.257 1.00 . A A . 30 HIS H 1 1 7 4154 1 1 30 HIS HA H 5.475 -5.729 2.240 1.00 . A A . 30 HIS HA 1 1 7 4155 1 1 30 HIS HB2 H 5.634 -2.843 1.349 1.00 . A A . 30 HIS HB2 1 1 7 4156 1 1 30 HIS HB3 H 4.895 -3.381 2.853 1.00 . A A . 30 HIS HB3 1 1 7 4157 1 1 30 HIS HD1 H 6.410 -3.052 4.766 1.00 . A A . 30 HIS HD1 1 1 7 4158 1 1 30 HIS HD2 H 8.504 -3.958 1.293 1.00 . A A . 30 HIS HD2 1 1 7 4159 1 1 30 HIS HE1 H 8.836 -3.051 5.425 1.00 . A A . 30 HIS HE1 1 1 7 4160 1 1 30 HIS HE2 H 10.089 -3.517 3.289 1.00 . A A . 30 HIS HE2 1 1 7 4161 1 1 30 HIS N N 6.316 -5.242 0.420 1.00 . A A . 30 HIS N 1 1 7 4162 1 1 30 HIS ND1 N 7.137 -3.237 4.136 1.00 . A A . 30 HIS ND1 1 1 7 4163 1 1 30 HIS NE2 N 9.111 -3.532 3.358 1.00 . A A . 30 HIS NE2 1 1 7 4164 1 1 30 HIS O O 3.443 -4.015 0.400 1.00 . A A . 30 HIS O 1 1 7 4165 1 1 31 TYR C C 0.926 -5.503 1.578 1.00 . A A . 31 TYR C 1 1 7 4166 1 1 31 TYR CA C 1.888 -6.290 0.693 1.00 . A A . 31 TYR CA 1 1 7 4167 1 1 31 TYR CB C 1.499 -7.769 0.689 1.00 . A A . 31 TYR CB 1 1 7 4168 1 1 31 TYR CD1 C 3.402 -9.385 0.309 1.00 . A A . 31 TYR CD1 1 1 7 4169 1 1 31 TYR CD2 C 2.146 -8.660 -1.583 1.00 . A A . 31 TYR CD2 1 1 7 4170 1 1 31 TYR CE1 C 4.196 -10.164 -0.511 1.00 . A A . 31 TYR CE1 1 1 7 4171 1 1 31 TYR CE2 C 2.935 -9.438 -2.410 1.00 . A A . 31 TYR CE2 1 1 7 4172 1 1 31 TYR CG C 2.365 -8.621 -0.212 1.00 . A A . 31 TYR CG 1 1 7 4173 1 1 31 TYR CZ C 3.959 -10.187 -1.869 1.00 . A A . 31 TYR CZ 1 1 7 4174 1 1 31 TYR H H 3.707 -6.876 1.604 1.00 . A A . 31 TYR H 1 1 7 4175 1 1 31 TYR HA H 1.825 -5.908 -0.314 1.00 . A A . 31 TYR HA 1 1 7 4176 1 1 31 TYR HB2 H 1.582 -8.159 1.692 1.00 . A A . 31 TYR HB2 1 1 7 4177 1 1 31 TYR HB3 H 0.477 -7.865 0.354 1.00 . A A . 31 TYR HB3 1 1 7 4178 1 1 31 TYR HD1 H 3.585 -9.365 1.373 1.00 . A A . 31 TYR HD1 1 1 7 4179 1 1 31 TYR HD2 H 1.344 -8.072 -2.004 1.00 . A A . 31 TYR HD2 1 1 7 4180 1 1 31 TYR HE1 H 4.997 -10.751 -0.087 1.00 . A A . 31 TYR HE1 1 1 7 4181 1 1 31 TYR HE2 H 2.749 -9.455 -3.473 1.00 . A A . 31 TYR HE2 1 1 7 4182 1 1 31 TYR HH H 4.220 -11.675 -3.058 1.00 . A A . 31 TYR HH 1 1 7 4183 1 1 31 TYR N N 3.264 -6.129 1.149 1.00 . A A . 31 TYR N 1 1 7 4184 1 1 31 TYR O O 1.051 -5.505 2.803 1.00 . A A . 31 TYR O 1 1 7 4185 1 1 31 TYR OH O 4.746 -10.962 -2.689 1.00 . A A . 31 TYR OH 1 1 7 4186 1 1 32 CYS C C -1.991 -4.945 2.429 1.00 . A A . 32 CYS C 1 1 7 4187 1 1 32 CYS CA C -1.017 -4.042 1.681 1.00 . A A . 32 CYS CA 1 1 7 4188 1 1 32 CYS CB C -1.784 -3.130 0.721 1.00 . A A . 32 CYS CB 1 1 7 4189 1 1 32 CYS H H -0.083 -4.870 -0.028 1.00 . A A . 32 CYS H 1 1 7 4190 1 1 32 CYS HA H -0.487 -3.432 2.397 1.00 . A A . 32 CYS HA 1 1 7 4191 1 1 32 CYS HB2 H -2.205 -3.728 -0.073 1.00 . A A . 32 CYS HB2 1 1 7 4192 1 1 32 CYS HB3 H -2.583 -2.644 1.261 1.00 . A A . 32 CYS HB3 1 1 7 4193 1 1 32 CYS N N -0.034 -4.832 0.950 1.00 . A A . 32 CYS N 1 1 7 4194 1 1 32 CYS O O -2.197 -6.099 2.053 1.00 . A A . 32 CYS O 1 1 7 4195 1 1 32 CYS SG S -0.761 -1.832 -0.047 1.00 . A A . 32 CYS SG 1 1 7 4196 1 1 33 THR C C -4.979 -4.763 3.973 1.00 . A A . 33 THR C 1 1 7 4197 1 1 33 THR CA C -3.542 -5.172 4.290 1.00 . A A . 33 THR CA 1 1 7 4198 1 1 33 THR CB C -3.261 -4.971 5.780 1.00 . A A . 33 THR CB 1 1 7 4199 1 1 33 THR CG2 C -1.789 -5.042 6.126 1.00 . A A . 33 THR CG2 1 1 7 4200 1 1 33 THR H H -2.384 -3.487 3.739 1.00 . A A . 33 THR H 1 1 7 4201 1 1 33 THR HA H -3.417 -6.217 4.048 1.00 . A A . 33 THR HA 1 1 7 4202 1 1 33 THR HB H -3.769 -5.744 6.339 1.00 . A A . 33 THR HB 1 1 7 4203 1 1 33 THR HG1 H -3.228 -3.013 5.812 1.00 . A A . 33 THR HG1 1 1 7 4204 1 1 33 THR HG21 H -1.302 -5.760 5.483 1.00 . A A . 33 THR HG21 1 1 7 4205 1 1 33 THR HG22 H -1.339 -4.070 5.985 1.00 . A A . 33 THR HG22 1 1 7 4206 1 1 33 THR HG23 H -1.676 -5.345 7.156 1.00 . A A . 33 THR HG23 1 1 7 4207 1 1 33 THR N N -2.589 -4.413 3.489 1.00 . A A . 33 THR N 1 1 7 4208 1 1 33 THR O O -5.903 -5.088 4.718 1.00 . A A . 33 THR O 1 1 7 4209 1 1 33 THR OG1 O -3.745 -3.714 6.216 1.00 . A A . 33 THR OG1 1 1 7 4210 1 1 34 GLY C C -7.243 -2.928 3.601 1.00 . A A . 34 GLY C 1 1 7 4211 1 1 34 GLY CA C -6.493 -3.611 2.472 1.00 . A A . 34 GLY CA 1 1 7 4212 1 1 34 GLY H H -4.392 -3.819 2.304 1.00 . A A . 34 GLY H 1 1 7 4213 1 1 34 GLY HA2 H -7.061 -4.471 2.148 1.00 . A A . 34 GLY HA2 1 1 7 4214 1 1 34 GLY HA3 H -6.403 -2.921 1.646 1.00 . A A . 34 GLY HA3 1 1 7 4215 1 1 34 GLY N N -5.164 -4.049 2.863 1.00 . A A . 34 GLY N 1 1 7 4216 1 1 34 GLY O O -8.474 -2.925 3.625 1.00 . A A . 34 GLY O 1 1 7 4217 1 1 35 ARG C C -6.731 -0.182 5.682 1.00 . A A . 35 ARG C 1 1 7 4218 1 1 35 ARG CA C -7.105 -1.660 5.675 1.00 . A A . 35 ARG CA 1 1 7 4219 1 1 35 ARG CB C -6.665 -2.314 6.987 1.00 . A A . 35 ARG CB 1 1 7 4220 1 1 35 ARG CD C -8.639 -3.545 7.936 1.00 . A A . 35 ARG CD 1 1 7 4221 1 1 35 ARG CG C -7.746 -2.321 8.055 1.00 . A A . 35 ARG CG 1 1 7 4222 1 1 35 ARG CZ C -7.322 -5.327 9.015 1.00 . A A . 35 ARG CZ 1 1 7 4223 1 1 35 ARG H H -5.524 -2.384 4.466 1.00 . A A . 35 ARG H 1 1 7 4224 1 1 35 ARG HA H -8.176 -1.746 5.583 1.00 . A A . 35 ARG HA 1 1 7 4225 1 1 35 ARG HB2 H -6.380 -3.337 6.787 1.00 . A A . 35 ARG HB2 1 1 7 4226 1 1 35 ARG HB3 H -5.810 -1.780 7.373 1.00 . A A . 35 ARG HB3 1 1 7 4227 1 1 35 ARG HD2 H -9.320 -3.561 8.775 1.00 . A A . 35 ARG HD2 1 1 7 4228 1 1 35 ARG HD3 H -9.203 -3.476 7.017 1.00 . A A . 35 ARG HD3 1 1 7 4229 1 1 35 ARG HE H -7.754 -5.242 7.068 1.00 . A A . 35 ARG HE 1 1 7 4230 1 1 35 ARG HG2 H -7.277 -2.324 9.028 1.00 . A A . 35 ARG HG2 1 1 7 4231 1 1 35 ARG HG3 H -8.351 -1.433 7.947 1.00 . A A . 35 ARG HG3 1 1 7 4232 1 1 35 ARG HH11 H -7.972 -3.885 10.276 1.00 . A A . 35 ARG HH11 1 1 7 4233 1 1 35 ARG HH12 H -7.043 -5.149 11.009 1.00 . A A . 35 ARG HH12 1 1 7 4234 1 1 35 ARG HH21 H -6.532 -6.906 8.031 1.00 . A A . 35 ARG HH21 1 1 7 4235 1 1 35 ARG HH22 H -6.225 -6.864 9.735 1.00 . A A . 35 ARG HH22 1 1 7 4236 1 1 35 ARG N N -6.501 -2.348 4.539 1.00 . A A . 35 ARG N 1 1 7 4237 1 1 35 ARG NE N -7.869 -4.787 7.928 1.00 . A A . 35 ARG NE 1 1 7 4238 1 1 35 ARG NH1 N -7.457 -4.738 10.197 1.00 . A A . 35 ARG NH1 1 1 7 4239 1 1 35 ARG NH2 N -6.637 -6.458 8.919 1.00 . A A . 35 ARG NH2 1 1 7 4240 1 1 35 ARG O O -7.551 0.675 6.013 1.00 . A A . 35 ARG O 1 1 7 4241 1 1 36 SER C C -4.091 1.705 4.075 1.00 . A A . 36 SER C 1 1 7 4242 1 1 36 SER CA C -5.004 1.484 5.277 1.00 . A A . 36 SER CA 1 1 7 4243 1 1 36 SER CB C -4.256 1.818 6.568 1.00 . A A . 36 SER CB 1 1 7 4244 1 1 36 SER H H -4.884 -0.618 5.062 1.00 . A A . 36 SER H 1 1 7 4245 1 1 36 SER HA H -5.860 2.136 5.188 1.00 . A A . 36 SER HA 1 1 7 4246 1 1 36 SER HB2 H -3.785 0.924 6.951 1.00 . A A . 36 SER HB2 1 1 7 4247 1 1 36 SER HB3 H -3.500 2.562 6.362 1.00 . A A . 36 SER HB3 1 1 7 4248 1 1 36 SER HG H -4.851 3.200 7.823 1.00 . A A . 36 SER HG 1 1 7 4249 1 1 36 SER N N -5.489 0.109 5.314 1.00 . A A . 36 SER N 1 1 7 4250 1 1 36 SER O O -3.738 0.760 3.369 1.00 . A A . 36 SER O 1 1 7 4251 1 1 36 SER OG O -5.139 2.325 7.554 1.00 . A A . 36 SER OG 1 1 7 4252 1 1 37 CYS C C -1.404 3.535 3.211 1.00 . A A . 37 CYS C 1 1 7 4253 1 1 37 CYS CA C -2.836 3.300 2.735 1.00 . A A . 37 CYS CA 1 1 7 4254 1 1 37 CYS CB C -3.359 4.544 2.013 1.00 . A A . 37 CYS CB 1 1 7 4255 1 1 37 CYS H H -4.022 3.668 4.449 1.00 . A A . 37 CYS H 1 1 7 4256 1 1 37 CYS HA H -2.840 2.469 2.046 1.00 . A A . 37 CYS HA 1 1 7 4257 1 1 37 CYS HB2 H -4.122 5.008 2.620 1.00 . A A . 37 CYS HB2 1 1 7 4258 1 1 37 CYS HB3 H -2.546 5.241 1.872 1.00 . A A . 37 CYS HB3 1 1 7 4259 1 1 37 CYS N N -3.710 2.958 3.850 1.00 . A A . 37 CYS N 1 1 7 4260 1 1 37 CYS O O -0.590 4.117 2.494 1.00 . A A . 37 CYS O 1 1 7 4261 1 1 37 CYS SG S -4.087 4.202 0.378 1.00 . A A . 37 CYS SG 1 1 7 4262 1 1 38 GLU C C 0.949 1.898 5.087 1.00 . A A . 38 GLU C 1 1 7 4263 1 1 38 GLU CA C 0.234 3.241 4.989 1.00 . A A . 38 GLU CA 1 1 7 4264 1 1 38 GLU CB C 0.149 3.889 6.373 1.00 . A A . 38 GLU CB 1 1 7 4265 1 1 38 GLU CD C 1.358 6.084 6.054 1.00 . A A . 38 GLU CD 1 1 7 4266 1 1 38 GLU CG C 1.367 4.726 6.728 1.00 . A A . 38 GLU CG 1 1 7 4267 1 1 38 GLU H H -1.790 2.623 4.950 1.00 . A A . 38 GLU H 1 1 7 4268 1 1 38 GLU HA H 0.796 3.888 4.332 1.00 . A A . 38 GLU HA 1 1 7 4269 1 1 38 GLU HB2 H -0.722 4.527 6.406 1.00 . A A . 38 GLU HB2 1 1 7 4270 1 1 38 GLU HB3 H 0.043 3.112 7.115 1.00 . A A . 38 GLU HB3 1 1 7 4271 1 1 38 GLU HG2 H 1.387 4.873 7.798 1.00 . A A . 38 GLU HG2 1 1 7 4272 1 1 38 GLU HG3 H 2.255 4.194 6.421 1.00 . A A . 38 GLU HG3 1 1 7 4273 1 1 38 GLU N N -1.101 3.079 4.424 1.00 . A A . 38 GLU N 1 1 7 4274 1 1 38 GLU O O 0.615 1.066 5.931 1.00 . A A . 38 GLU O 1 1 7 4275 1 1 38 GLU OE1 O 0.411 6.861 6.297 1.00 . A A . 38 GLU OE1 1 1 7 4276 1 1 38 GLU OE2 O 2.298 6.371 5.283 1.00 . A A . 38 GLU OE2 1 1 7 4277 1 1 39 CYS C C 3.369 0.209 5.557 1.00 . A A . 39 CYS C 1 1 7 4278 1 1 39 CYS CA C 2.697 0.449 4.207 1.00 . A A . 39 CYS CA 1 1 7 4279 1 1 39 CYS CB C 3.750 0.484 3.097 1.00 . A A . 39 CYS CB 1 1 7 4280 1 1 39 CYS H H 2.153 2.393 3.570 1.00 . A A . 39 CYS H 1 1 7 4281 1 1 39 CYS HA H 2.009 -0.360 4.011 1.00 . A A . 39 CYS HA 1 1 7 4282 1 1 39 CYS HB2 H 3.546 1.320 2.444 1.00 . A A . 39 CYS HB2 1 1 7 4283 1 1 39 CYS HB3 H 4.727 0.610 3.540 1.00 . A A . 39 CYS HB3 1 1 7 4284 1 1 39 CYS N N 1.934 1.692 4.218 1.00 . A A . 39 CYS N 1 1 7 4285 1 1 39 CYS O O 3.749 1.155 6.247 1.00 . A A . 39 CYS O 1 1 7 4286 1 1 39 CYS SG S 3.796 -1.020 2.069 1.00 . A A . 39 CYS SG 1 1 7 4287 1 1 40 PRO C C 5.520 -0.768 7.405 1.00 . A A . 40 PRO C 1 1 7 4288 1 1 40 PRO CA C 4.155 -1.425 7.229 1.00 . A A . 40 PRO CA 1 1 7 4289 1 1 40 PRO CB C 4.300 -2.946 7.141 1.00 . A A . 40 PRO CB 1 1 7 4290 1 1 40 PRO CD C 3.101 -2.257 5.193 1.00 . A A . 40 PRO CD 1 1 7 4291 1 1 40 PRO CG C 3.237 -3.374 6.190 1.00 . A A . 40 PRO CG 1 1 7 4292 1 1 40 PRO HA H 3.523 -1.169 8.067 1.00 . A A . 40 PRO HA 1 1 7 4293 1 1 40 PRO HB2 H 5.285 -3.195 6.773 1.00 . A A . 40 PRO HB2 1 1 7 4294 1 1 40 PRO HB3 H 4.154 -3.382 8.118 1.00 . A A . 40 PRO HB3 1 1 7 4295 1 1 40 PRO HD2 H 3.750 -2.425 4.347 1.00 . A A . 40 PRO HD2 1 1 7 4296 1 1 40 PRO HD3 H 2.074 -2.162 4.870 1.00 . A A . 40 PRO HD3 1 1 7 4297 1 1 40 PRO HG2 H 3.534 -4.286 5.693 1.00 . A A . 40 PRO HG2 1 1 7 4298 1 1 40 PRO HG3 H 2.307 -3.519 6.719 1.00 . A A . 40 PRO HG3 1 1 7 4299 1 1 40 PRO N N 3.525 -1.067 5.954 1.00 . A A . 40 PRO N 1 1 7 4300 1 1 40 PRO O O 6.005 -0.074 6.512 1.00 . A A . 40 PRO O 1 1 7 4301 1 1 41 SER C C 8.540 -1.472 8.703 1.00 . A A . 41 SER C 1 1 7 4302 1 1 41 SER CA C 7.444 -0.423 8.855 1.00 . A A . 41 SER CA 1 1 7 4303 1 1 41 SER CB C 7.467 0.155 10.271 1.00 . A A . 41 SER CB 1 1 7 4304 1 1 41 SER H H 5.696 -1.555 9.235 1.00 . A A . 41 SER H 1 1 7 4305 1 1 41 SER HA H 7.624 0.373 8.148 1.00 . A A . 41 SER HA 1 1 7 4306 1 1 41 SER HB2 H 6.695 0.905 10.364 1.00 . A A . 41 SER HB2 1 1 7 4307 1 1 41 SER HB3 H 7.287 -0.637 10.983 1.00 . A A . 41 SER HB3 1 1 7 4308 1 1 41 SER HG H 9.382 0.067 10.672 1.00 . A A . 41 SER HG 1 1 7 4309 1 1 41 SER N N 6.134 -0.993 8.562 1.00 . A A . 41 SER N 1 1 7 4310 1 1 41 SER O O 9.669 -1.155 8.329 1.00 . A A . 41 SER O 1 1 7 4311 1 1 41 SER OG O 8.719 0.752 10.559 1.00 . A A . 41 SER OG 1 1 7 4312 1 1 42 TYR C C 8.984 -4.569 7.574 1.00 . A A . 42 TYR C 1 1 7 4313 1 1 42 TYR CA C 9.155 -3.819 8.893 1.00 . A A . 42 TYR CA 1 1 7 4314 1 1 42 TYR CB C 8.985 -4.785 10.067 1.00 . A A . 42 TYR CB 1 1 7 4315 1 1 42 TYR CD1 C 6.803 -4.577 11.321 1.00 . A A . 42 TYR CD1 1 1 7 4316 1 1 42 TYR CD2 C 6.938 -6.172 9.555 1.00 . A A . 42 TYR CD2 1 1 7 4317 1 1 42 TYR CE1 C 5.490 -4.940 11.555 1.00 . A A . 42 TYR CE1 1 1 7 4318 1 1 42 TYR CE2 C 5.626 -6.540 9.782 1.00 . A A . 42 TYR CE2 1 1 7 4319 1 1 42 TYR CG C 7.548 -5.185 10.319 1.00 . A A . 42 TYR CG 1 1 7 4320 1 1 42 TYR CZ C 4.907 -5.922 10.783 1.00 . A A . 42 TYR CZ 1 1 7 4321 1 1 42 TYR H H 7.284 -2.913 9.290 1.00 . A A . 42 TYR H 1 1 7 4322 1 1 42 TYR HA H 10.149 -3.397 8.927 1.00 . A A . 42 TYR HA 1 1 7 4323 1 1 42 TYR HB2 H 9.549 -5.684 9.870 1.00 . A A . 42 TYR HB2 1 1 7 4324 1 1 42 TYR HB3 H 9.363 -4.319 10.965 1.00 . A A . 42 TYR HB3 1 1 7 4325 1 1 42 TYR HD1 H 7.263 -3.808 11.924 1.00 . A A . 42 TYR HD1 1 1 7 4326 1 1 42 TYR HD2 H 7.504 -6.655 8.772 1.00 . A A . 42 TYR HD2 1 1 7 4327 1 1 42 TYR HE1 H 4.928 -4.455 12.338 1.00 . A A . 42 TYR HE1 1 1 7 4328 1 1 42 TYR HE2 H 5.169 -7.309 9.177 1.00 . A A . 42 TYR HE2 1 1 7 4329 1 1 42 TYR HH H 3.100 -6.217 10.195 1.00 . A A . 42 TYR HH 1 1 7 4330 1 1 42 TYR N N 8.200 -2.723 8.997 1.00 . A A . 42 TYR N 1 1 7 4331 1 1 42 TYR O O 7.943 -4.469 6.925 1.00 . A A . 42 TYR O 1 1 7 4332 1 1 42 TYR OH O 3.600 -6.286 11.012 1.00 . A A . 42 TYR OH 1 1 7 4333 1 1 43 PRO C C 8.727 -6.981 5.813 1.00 . A A . 43 PRO C 1 1 7 4334 1 1 43 PRO CA C 9.968 -6.100 5.910 1.00 . A A . 43 PRO CA 1 1 7 4335 1 1 43 PRO CB C 11.231 -6.962 5.978 1.00 . A A . 43 PRO CB 1 1 7 4336 1 1 43 PRO CD C 11.289 -5.506 7.873 1.00 . A A . 43 PRO CD 1 1 7 4337 1 1 43 PRO CG C 12.158 -6.205 6.865 1.00 . A A . 43 PRO CG 1 1 7 4338 1 1 43 PRO HA H 10.016 -5.453 5.046 1.00 . A A . 43 PRO HA 1 1 7 4339 1 1 43 PRO HB2 H 10.987 -7.929 6.393 1.00 . A A . 43 PRO HB2 1 1 7 4340 1 1 43 PRO HB3 H 11.643 -7.081 4.988 1.00 . A A . 43 PRO HB3 1 1 7 4341 1 1 43 PRO HD2 H 11.159 -6.122 8.751 1.00 . A A . 43 PRO HD2 1 1 7 4342 1 1 43 PRO HD3 H 11.714 -4.550 8.140 1.00 . A A . 43 PRO HD3 1 1 7 4343 1 1 43 PRO HG2 H 12.832 -6.889 7.360 1.00 . A A . 43 PRO HG2 1 1 7 4344 1 1 43 PRO HG3 H 12.714 -5.484 6.285 1.00 . A A . 43 PRO HG3 1 1 7 4345 1 1 43 PRO N N 10.010 -5.332 7.159 1.00 . A A . 43 PRO N 1 1 7 4346 1 1 43 PRO O O 8.259 -7.524 6.814 1.00 . A A . 43 PRO O 1 1 7 4347 1 1 44 GLY C C 7.230 -9.378 4.803 1.00 . A A . 44 GLY C 1 1 7 4348 1 1 44 GLY CA C 7.015 -7.933 4.398 1.00 . A A . 44 GLY CA 1 1 7 4349 1 1 44 GLY H H 8.612 -6.660 3.841 1.00 . A A . 44 GLY H 1 1 7 4350 1 1 44 GLY HA2 H 6.745 -7.900 3.352 1.00 . A A . 44 GLY HA2 1 1 7 4351 1 1 44 GLY HA3 H 6.203 -7.524 4.981 1.00 . A A . 44 GLY HA3 1 1 7 4352 1 1 44 GLY N N 8.197 -7.117 4.602 1.00 . A A . 44 GLY N 1 1 7 4353 1 1 44 GLY O O 8.250 -9.664 5.464 1.00 . A A . 44 GLY O 1 1 7 4354 1 1 44 GLY OXT O 6.377 -10.224 4.459 1.00 . A A . 44 GLY OXT 1 1 8 4355 1 1 1 ALA C C -15.209 12.794 -1.373 1.00 . A A . 1 ALA C 1 1 8 4356 1 1 1 ALA CA C -15.044 13.535 -2.695 1.00 . A A . 1 ALA CA 1 1 8 4357 1 1 1 ALA CB C -15.850 12.849 -3.788 1.00 . A A . 1 ALA CB 1 1 8 4358 1 1 1 ALA H1 H -13.058 13.787 -2.224 1.00 . A A . 1 ALA H1 1 1 8 4359 1 1 1 ALA H2 H -13.353 12.712 -3.528 1.00 . A A . 1 ALA H2 1 1 8 4360 1 1 1 ALA H3 H -13.512 14.405 -3.756 1.00 . A A . 1 ALA H3 1 1 8 4361 1 1 1 ALA HA H -15.423 14.540 -2.581 1.00 . A A . 1 ALA HA 1 1 8 4362 1 1 1 ALA HB1 H -15.915 13.498 -4.649 1.00 . A A . 1 ALA HB1 1 1 8 4363 1 1 1 ALA HB2 H -16.843 12.634 -3.422 1.00 . A A . 1 ALA HB2 1 1 8 4364 1 1 1 ALA HB3 H -15.363 11.927 -4.069 1.00 . A A . 1 ALA HB3 1 1 8 4365 1 1 1 ALA N N -13.613 13.617 -3.086 1.00 . A A . 1 ALA N 1 1 8 4366 1 1 1 ALA O O -15.460 11.589 -1.352 1.00 . A A . 1 ALA O 1 1 8 4367 1 1 2 MET C C -14.162 11.835 1.271 1.00 . A A . 2 MET C 1 1 8 4368 1 1 2 MET CA C -15.198 12.934 1.057 1.00 . A A . 2 MET CA 1 1 8 4369 1 1 2 MET CB C -16.606 12.367 1.248 1.00 . A A . 2 MET CB 1 1 8 4370 1 1 2 MET CE C -19.537 13.124 2.668 1.00 . A A . 2 MET CE 1 1 8 4371 1 1 2 MET CG C -16.962 12.098 2.701 1.00 . A A . 2 MET CG 1 1 8 4372 1 1 2 MET H H -14.865 14.478 -0.352 1.00 . A A . 2 MET H 1 1 8 4373 1 1 2 MET HA H -15.033 13.715 1.784 1.00 . A A . 2 MET HA 1 1 8 4374 1 1 2 MET HB2 H -17.322 13.071 0.849 1.00 . A A . 2 MET HB2 1 1 8 4375 1 1 2 MET HB3 H -16.685 11.439 0.702 1.00 . A A . 2 MET HB3 1 1 8 4376 1 1 2 MET HE1 H -18.900 13.809 2.129 1.00 . A A . 2 MET HE1 1 1 8 4377 1 1 2 MET HE2 H -20.439 12.949 2.102 1.00 . A A . 2 MET HE2 1 1 8 4378 1 1 2 MET HE3 H -19.790 13.548 3.629 1.00 . A A . 2 MET HE3 1 1 8 4379 1 1 2 MET HG2 H -16.314 11.322 3.078 1.00 . A A . 2 MET HG2 1 1 8 4380 1 1 2 MET HG3 H -16.805 13.003 3.269 1.00 . A A . 2 MET HG3 1 1 8 4381 1 1 2 MET N N -15.065 13.522 -0.271 1.00 . A A . 2 MET N 1 1 8 4382 1 1 2 MET O O -14.435 10.657 1.038 1.00 . A A . 2 MET O 1 1 8 4383 1 1 2 MET SD S -18.674 11.573 2.911 1.00 . A A . 2 MET SD 1 1 8 4384 1 1 3 ASP C C -11.524 10.534 0.683 1.00 . A A . 3 ASP C 1 1 8 4385 1 1 3 ASP CA C -11.896 11.277 1.962 1.00 . A A . 3 ASP CA 1 1 8 4386 1 1 3 ASP CB C -12.308 10.277 3.045 1.00 . A A . 3 ASP CB 1 1 8 4387 1 1 3 ASP CG C -11.116 9.710 3.791 1.00 . A A . 3 ASP CG 1 1 8 4388 1 1 3 ASP H H -12.817 13.181 1.883 1.00 . A A . 3 ASP H 1 1 8 4389 1 1 3 ASP HA H -11.036 11.832 2.306 1.00 . A A . 3 ASP HA 1 1 8 4390 1 1 3 ASP HB2 H -12.952 10.772 3.757 1.00 . A A . 3 ASP HB2 1 1 8 4391 1 1 3 ASP HB3 H -12.845 9.460 2.586 1.00 . A A . 3 ASP HB3 1 1 8 4392 1 1 3 ASP N N -12.973 12.228 1.716 1.00 . A A . 3 ASP N 1 1 8 4393 1 1 3 ASP O O -12.290 10.514 -0.280 1.00 . A A . 3 ASP O 1 1 8 4394 1 1 3 ASP OD1 O -10.813 10.211 4.894 1.00 . A A . 3 ASP OD1 1 1 8 4395 1 1 3 ASP OD2 O -10.487 8.763 3.272 1.00 . A A . 3 ASP OD2 1 1 8 4396 1 1 4 CYS C C -8.520 8.523 -0.187 1.00 . A A . 4 CYS C 1 1 8 4397 1 1 4 CYS CA C -9.868 9.178 -0.478 1.00 . A A . 4 CYS CA 1 1 8 4398 1 1 4 CYS CB C -9.783 10.106 -1.704 1.00 . A A . 4 CYS CB 1 1 8 4399 1 1 4 CYS H H -9.778 9.975 1.481 1.00 . A A . 4 CYS H 1 1 8 4400 1 1 4 CYS HA H -10.588 8.400 -0.682 1.00 . A A . 4 CYS HA 1 1 8 4401 1 1 4 CYS HB2 H -10.211 9.600 -2.554 1.00 . A A . 4 CYS HB2 1 1 8 4402 1 1 4 CYS HB3 H -10.358 10.998 -1.503 1.00 . A A . 4 CYS HB3 1 1 8 4403 1 1 4 CYS N N -10.343 9.924 0.682 1.00 . A A . 4 CYS N 1 1 8 4404 1 1 4 CYS O O -8.264 7.392 -0.600 1.00 . A A . 4 CYS O 1 1 8 4405 1 1 4 CYS SG S -8.097 10.630 -2.173 1.00 . A A . 4 CYS SG 1 1 8 4406 1 1 5 THR C C -5.475 8.565 -0.365 1.00 . A A . 5 THR C 1 1 8 4407 1 1 5 THR CA C -6.339 8.735 0.880 1.00 . A A . 5 THR CA 1 1 8 4408 1 1 5 THR CB C -6.457 7.401 1.620 1.00 . A A . 5 THR CB 1 1 8 4409 1 1 5 THR CG2 C -5.440 7.240 2.729 1.00 . A A . 5 THR CG2 1 1 8 4410 1 1 5 THR H H -7.926 10.136 0.830 1.00 . A A . 5 THR H 1 1 8 4411 1 1 5 THR HA H -5.871 9.457 1.532 1.00 . A A . 5 THR HA 1 1 8 4412 1 1 5 THR HB H -6.309 6.595 0.916 1.00 . A A . 5 THR HB 1 1 8 4413 1 1 5 THR HG1 H -7.855 7.903 2.897 1.00 . A A . 5 THR HG1 1 1 8 4414 1 1 5 THR HG21 H -4.550 7.803 2.486 1.00 . A A . 5 THR HG21 1 1 8 4415 1 1 5 THR HG22 H -5.856 7.607 3.656 1.00 . A A . 5 THR HG22 1 1 8 4416 1 1 5 THR HG23 H -5.186 6.196 2.836 1.00 . A A . 5 THR HG23 1 1 8 4417 1 1 5 THR N N -7.662 9.242 0.529 1.00 . A A . 5 THR N 1 1 8 4418 1 1 5 THR O O -5.714 7.676 -1.182 1.00 . A A . 5 THR O 1 1 8 4419 1 1 5 THR OG1 O -7.744 7.258 2.195 1.00 . A A . 5 THR OG1 1 1 8 4420 1 1 6 THR C C -2.153 9.016 -1.213 1.00 . A A . 6 THR C 1 1 8 4421 1 1 6 THR CA C -3.571 9.371 -1.651 1.00 . A A . 6 THR CA 1 1 8 4422 1 1 6 THR CB C -3.569 10.712 -2.390 1.00 . A A . 6 THR CB 1 1 8 4423 1 1 6 THR CG2 C -3.661 10.565 -3.894 1.00 . A A . 6 THR CG2 1 1 8 4424 1 1 6 THR H H -4.332 10.113 0.181 1.00 . A A . 6 THR H 1 1 8 4425 1 1 6 THR HA H -3.931 8.603 -2.318 1.00 . A A . 6 THR HA 1 1 8 4426 1 1 6 THR HB H -2.651 11.236 -2.166 1.00 . A A . 6 THR HB 1 1 8 4427 1 1 6 THR HG1 H -5.456 10.992 -1.948 1.00 . A A . 6 THR HG1 1 1 8 4428 1 1 6 THR HG21 H -3.090 9.704 -4.207 1.00 . A A . 6 THR HG21 1 1 8 4429 1 1 6 THR HG22 H -4.695 10.434 -4.180 1.00 . A A . 6 THR HG22 1 1 8 4430 1 1 6 THR HG23 H -3.266 11.451 -4.367 1.00 . A A . 6 THR HG23 1 1 8 4431 1 1 6 THR N N -4.471 9.425 -0.504 1.00 . A A . 6 THR N 1 1 8 4432 1 1 6 THR O O -1.599 9.634 -0.304 1.00 . A A . 6 THR O 1 1 8 4433 1 1 6 THR OG1 O -4.655 11.520 -1.971 1.00 . A A . 6 THR OG1 1 1 8 4434 1 1 7 GLY C C 0.215 6.375 -2.323 1.00 . A A . 7 GLY C 1 1 8 4435 1 1 7 GLY CA C -0.224 7.595 -1.534 1.00 . A A . 7 GLY CA 1 1 8 4436 1 1 7 GLY H H -2.062 7.560 -2.584 1.00 . A A . 7 GLY H 1 1 8 4437 1 1 7 GLY HA2 H -0.181 7.363 -0.481 1.00 . A A . 7 GLY HA2 1 1 8 4438 1 1 7 GLY HA3 H 0.457 8.408 -1.741 1.00 . A A . 7 GLY HA3 1 1 8 4439 1 1 7 GLY N N -1.571 8.016 -1.868 1.00 . A A . 7 GLY N 1 1 8 4440 1 1 7 GLY O O -0.454 5.978 -3.277 1.00 . A A . 7 GLY O 1 1 8 4441 1 1 8 PRO C C 1.016 3.327 -2.372 1.00 . A A . 8 PRO C 1 1 8 4442 1 1 8 PRO CA C 1.863 4.568 -2.635 1.00 . A A . 8 PRO CA 1 1 8 4443 1 1 8 PRO CB C 3.262 4.396 -2.042 1.00 . A A . 8 PRO CB 1 1 8 4444 1 1 8 PRO CD C 2.207 6.160 -0.819 1.00 . A A . 8 PRO CD 1 1 8 4445 1 1 8 PRO CG C 3.178 5.017 -0.691 1.00 . A A . 8 PRO CG 1 1 8 4446 1 1 8 PRO HA H 1.938 4.732 -3.700 1.00 . A A . 8 PRO HA 1 1 8 4447 1 1 8 PRO HB2 H 3.503 3.345 -1.980 1.00 . A A . 8 PRO HB2 1 1 8 4448 1 1 8 PRO HB3 H 3.985 4.902 -2.664 1.00 . A A . 8 PRO HB3 1 1 8 4449 1 1 8 PRO HD2 H 1.630 6.268 0.088 1.00 . A A . 8 PRO HD2 1 1 8 4450 1 1 8 PRO HD3 H 2.731 7.076 -1.046 1.00 . A A . 8 PRO HD3 1 1 8 4451 1 1 8 PRO HG2 H 2.813 4.294 0.024 1.00 . A A . 8 PRO HG2 1 1 8 4452 1 1 8 PRO HG3 H 4.149 5.383 -0.393 1.00 . A A . 8 PRO HG3 1 1 8 4453 1 1 8 PRO N N 1.345 5.754 -1.946 1.00 . A A . 8 PRO N 1 1 8 4454 1 1 8 PRO O O 0.979 2.405 -3.188 1.00 . A A . 8 PRO O 1 1 8 4455 1 1 9 CYS C C -1.976 2.454 -1.170 1.00 . A A . 9 CYS C 1 1 8 4456 1 1 9 CYS CA C -0.505 2.177 -0.859 1.00 . A A . 9 CYS CA 1 1 8 4457 1 1 9 CYS CB C -0.336 1.857 0.627 1.00 . A A . 9 CYS CB 1 1 8 4458 1 1 9 CYS H H 0.410 4.071 -0.618 1.00 . A A . 9 CYS H 1 1 8 4459 1 1 9 CYS HA H -0.184 1.323 -1.438 1.00 . A A . 9 CYS HA 1 1 8 4460 1 1 9 CYS HB2 H 0.716 1.759 0.849 1.00 . A A . 9 CYS HB2 1 1 8 4461 1 1 9 CYS HB3 H -0.747 2.667 1.211 1.00 . A A . 9 CYS HB3 1 1 8 4462 1 1 9 CYS N N 0.340 3.308 -1.228 1.00 . A A . 9 CYS N 1 1 8 4463 1 1 9 CYS O O -2.857 1.700 -0.757 1.00 . A A . 9 CYS O 1 1 8 4464 1 1 9 CYS SG S -1.158 0.319 1.158 1.00 . A A . 9 CYS SG 1 1 8 4465 1 1 10 CYS C C -3.803 3.841 -3.771 1.00 . A A . 10 CYS C 1 1 8 4466 1 1 10 CYS CA C -3.605 3.899 -2.260 1.00 . A A . 10 CYS CA 1 1 8 4467 1 1 10 CYS CB C -3.936 5.301 -1.747 1.00 . A A . 10 CYS CB 1 1 8 4468 1 1 10 CYS H H -1.500 4.102 -2.204 1.00 . A A . 10 CYS H 1 1 8 4469 1 1 10 CYS HA H -4.271 3.189 -1.794 1.00 . A A . 10 CYS HA 1 1 8 4470 1 1 10 CYS HB2 H -3.167 5.986 -2.070 1.00 . A A . 10 CYS HB2 1 1 8 4471 1 1 10 CYS HB3 H -4.885 5.613 -2.159 1.00 . A A . 10 CYS HB3 1 1 8 4472 1 1 10 CYS N N -2.239 3.536 -1.900 1.00 . A A . 10 CYS N 1 1 8 4473 1 1 10 CYS O O -2.905 4.186 -4.539 1.00 . A A . 10 CYS O 1 1 8 4474 1 1 10 CYS SG S -4.054 5.420 0.067 1.00 . A A . 10 CYS SG 1 1 8 4475 1 1 11 ARG C C -6.046 4.545 -6.090 1.00 . A A . 11 ARG C 1 1 8 4476 1 1 11 ARG CA C -5.303 3.302 -5.610 1.00 . A A . 11 ARG CA 1 1 8 4477 1 1 11 ARG CB C -6.147 2.055 -5.878 1.00 . A A . 11 ARG CB 1 1 8 4478 1 1 11 ARG CD C -6.843 0.294 -7.530 1.00 . A A . 11 ARG CD 1 1 8 4479 1 1 11 ARG CG C -6.197 1.658 -7.344 1.00 . A A . 11 ARG CG 1 1 8 4480 1 1 11 ARG CZ C -6.048 -0.390 -9.760 1.00 . A A . 11 ARG CZ 1 1 8 4481 1 1 11 ARG H H -5.662 3.145 -3.530 1.00 . A A . 11 ARG H 1 1 8 4482 1 1 11 ARG HA H -4.373 3.221 -6.153 1.00 . A A . 11 ARG HA 1 1 8 4483 1 1 11 ARG HB2 H -5.735 1.229 -5.318 1.00 . A A . 11 ARG HB2 1 1 8 4484 1 1 11 ARG HB3 H -7.157 2.238 -5.542 1.00 . A A . 11 ARG HB3 1 1 8 4485 1 1 11 ARG HD2 H -6.209 -0.455 -7.080 1.00 . A A . 11 ARG HD2 1 1 8 4486 1 1 11 ARG HD3 H -7.804 0.295 -7.037 1.00 . A A . 11 ARG HD3 1 1 8 4487 1 1 11 ARG HE H -7.946 0.015 -9.297 1.00 . A A . 11 ARG HE 1 1 8 4488 1 1 11 ARG HG2 H -6.772 2.393 -7.887 1.00 . A A . 11 ARG HG2 1 1 8 4489 1 1 11 ARG HG3 H -5.190 1.625 -7.733 1.00 . A A . 11 ARG HG3 1 1 8 4490 1 1 11 ARG HH11 H -4.596 -0.255 -8.358 1.00 . A A . 11 ARG HH11 1 1 8 4491 1 1 11 ARG HH12 H -4.063 -0.734 -9.934 1.00 . A A . 11 ARG HH12 1 1 8 4492 1 1 11 ARG HH21 H -7.247 -0.616 -11.371 1.00 . A A . 11 ARG HH21 1 1 8 4493 1 1 11 ARG HH22 H -5.567 -0.939 -11.645 1.00 . A A . 11 ARG HH22 1 1 8 4494 1 1 11 ARG N N -4.986 3.404 -4.191 1.00 . A A . 11 ARG N 1 1 8 4495 1 1 11 ARG NE N -7.035 -0.033 -8.941 1.00 . A A . 11 ARG NE 1 1 8 4496 1 1 11 ARG NH1 N -4.800 -0.466 -9.313 1.00 . A A . 11 ARG NH1 1 1 8 4497 1 1 11 ARG NH2 N -6.309 -0.671 -11.029 1.00 . A A . 11 ARG NH2 1 1 8 4498 1 1 11 ARG O O -7.256 4.668 -5.903 1.00 . A A . 11 ARG O 1 1 8 4499 1 1 12 GLN C C -6.327 7.611 -6.070 1.00 . A A . 12 GLN C 1 1 8 4500 1 1 12 GLN CA C -5.896 6.704 -7.216 1.00 . A A . 12 GLN CA 1 1 8 4501 1 1 12 GLN CB C -7.093 6.400 -8.122 1.00 . A A . 12 GLN CB 1 1 8 4502 1 1 12 GLN CD C -7.979 6.706 -10.467 1.00 . A A . 12 GLN CD 1 1 8 4503 1 1 12 GLN CG C -7.193 7.322 -9.327 1.00 . A A . 12 GLN CG 1 1 8 4504 1 1 12 GLN H H -4.351 5.309 -6.826 1.00 . A A . 12 GLN H 1 1 8 4505 1 1 12 GLN HA H -5.143 7.212 -7.792 1.00 . A A . 12 GLN HA 1 1 8 4506 1 1 12 GLN HB2 H -7.011 5.384 -8.479 1.00 . A A . 12 GLN HB2 1 1 8 4507 1 1 12 GLN HB3 H -8.001 6.498 -7.545 1.00 . A A . 12 GLN HB3 1 1 8 4508 1 1 12 GLN HE21 H -6.323 5.884 -11.198 1.00 . A A . 12 GLN HE21 1 1 8 4509 1 1 12 GLN HE22 H -7.772 5.571 -12.086 1.00 . A A . 12 GLN HE22 1 1 8 4510 1 1 12 GLN HG2 H -7.681 8.236 -9.025 1.00 . A A . 12 GLN HG2 1 1 8 4511 1 1 12 GLN HG3 H -6.195 7.546 -9.676 1.00 . A A . 12 GLN HG3 1 1 8 4512 1 1 12 GLN N N -5.311 5.466 -6.709 1.00 . A A . 12 GLN N 1 1 8 4513 1 1 12 GLN NE2 N -7.288 5.980 -11.339 1.00 . A A . 12 GLN NE2 1 1 8 4514 1 1 12 GLN O O -5.744 8.673 -5.850 1.00 . A A . 12 GLN O 1 1 8 4515 1 1 12 GLN OE1 O -9.194 6.881 -10.564 1.00 . A A . 12 GLN OE1 1 1 8 4516 1 1 13 CYS C C -8.663 7.054 -3.275 1.00 . A A . 13 CYS C 1 1 8 4517 1 1 13 CYS CA C -7.867 7.951 -4.219 1.00 . A A . 13 CYS CA 1 1 8 4518 1 1 13 CYS CB C -8.744 9.102 -4.720 1.00 . A A . 13 CYS CB 1 1 8 4519 1 1 13 CYS H H -7.770 6.330 -5.574 1.00 . A A . 13 CYS H 1 1 8 4520 1 1 13 CYS HA H -7.024 8.359 -3.682 1.00 . A A . 13 CYS HA 1 1 8 4521 1 1 13 CYS HB2 H -8.758 9.088 -5.799 1.00 . A A . 13 CYS HB2 1 1 8 4522 1 1 13 CYS HB3 H -9.750 8.969 -4.351 1.00 . A A . 13 CYS HB3 1 1 8 4523 1 1 13 CYS N N -7.351 7.184 -5.345 1.00 . A A . 13 CYS N 1 1 8 4524 1 1 13 CYS O O -9.678 7.467 -2.716 1.00 . A A . 13 CYS O 1 1 8 4525 1 1 13 CYS SG S -8.174 10.754 -4.198 1.00 . A A . 13 CYS SG 1 1 8 4526 1 1 14 LYS C C -7.864 3.862 -1.659 1.00 . A A . 14 LYS C 1 1 8 4527 1 1 14 LYS CA C -8.861 4.867 -2.226 1.00 . A A . 14 LYS CA 1 1 8 4528 1 1 14 LYS CB C -9.968 4.133 -2.985 1.00 . A A . 14 LYS CB 1 1 8 4529 1 1 14 LYS CD C -12.287 3.244 -2.606 1.00 . A A . 14 LYS CD 1 1 8 4530 1 1 14 LYS CE C -13.032 2.025 -2.087 1.00 . A A . 14 LYS CE 1 1 8 4531 1 1 14 LYS CG C -10.857 3.283 -2.092 1.00 . A A . 14 LYS CG 1 1 8 4532 1 1 14 LYS H H -7.380 5.549 -3.575 1.00 . A A . 14 LYS H 1 1 8 4533 1 1 14 LYS HA H -9.301 5.418 -1.409 1.00 . A A . 14 LYS HA 1 1 8 4534 1 1 14 LYS HB2 H -10.588 4.861 -3.486 1.00 . A A . 14 LYS HB2 1 1 8 4535 1 1 14 LYS HB3 H -9.515 3.488 -3.724 1.00 . A A . 14 LYS HB3 1 1 8 4536 1 1 14 LYS HD2 H -12.802 4.134 -2.278 1.00 . A A . 14 LYS HD2 1 1 8 4537 1 1 14 LYS HD3 H -12.270 3.212 -3.686 1.00 . A A . 14 LYS HD3 1 1 8 4538 1 1 14 LYS HE2 H -12.686 1.805 -1.088 1.00 . A A . 14 LYS HE2 1 1 8 4539 1 1 14 LYS HE3 H -14.088 2.249 -2.059 1.00 . A A . 14 LYS HE3 1 1 8 4540 1 1 14 LYS HG2 H -10.468 2.277 -2.064 1.00 . A A . 14 LYS HG2 1 1 8 4541 1 1 14 LYS HG3 H -10.854 3.700 -1.095 1.00 . A A . 14 LYS HG3 1 1 8 4542 1 1 14 LYS HZ1 H -13.004 1.067 -3.943 1.00 . A A . 14 LYS HZ1 1 1 8 4543 1 1 14 LYS HZ2 H -11.828 0.505 -2.865 1.00 . A A . 14 LYS HZ2 1 1 8 4544 1 1 14 LYS HZ3 H -13.446 0.059 -2.657 1.00 . A A . 14 LYS HZ3 1 1 8 4545 1 1 14 LYS N N -8.194 5.822 -3.102 1.00 . A A . 14 LYS N 1 1 8 4546 1 1 14 LYS NZ N -12.812 0.830 -2.948 1.00 . A A . 14 LYS NZ 1 1 8 4547 1 1 14 LYS O O -6.905 3.478 -2.330 1.00 . A A . 14 LYS O 1 1 8 4548 1 1 15 LEU C C -7.121 1.187 -0.576 1.00 . A A . 15 LEU C 1 1 8 4549 1 1 15 LEU CA C -7.219 2.476 0.235 1.00 . A A . 15 LEU CA 1 1 8 4550 1 1 15 LEU CB C -7.727 2.172 1.647 1.00 . A A . 15 LEU CB 1 1 8 4551 1 1 15 LEU CD1 C -7.425 2.895 4.029 1.00 . A A . 15 LEU CD1 1 1 8 4552 1 1 15 LEU CD2 C -5.901 1.174 3.045 1.00 . A A . 15 LEU CD2 1 1 8 4553 1 1 15 LEU CG C -6.716 2.428 2.767 1.00 . A A . 15 LEU CG 1 1 8 4554 1 1 15 LEU H H -8.877 3.779 0.062 1.00 . A A . 15 LEU H 1 1 8 4555 1 1 15 LEU HA H -6.236 2.918 0.303 1.00 . A A . 15 LEU HA 1 1 8 4556 1 1 15 LEU HB2 H -8.599 2.782 1.831 1.00 . A A . 15 LEU HB2 1 1 8 4557 1 1 15 LEU HB3 H -8.020 1.133 1.689 1.00 . A A . 15 LEU HB3 1 1 8 4558 1 1 15 LEU HD11 H -8.392 3.301 3.770 1.00 . A A . 15 LEU HD11 1 1 8 4559 1 1 15 LEU HD12 H -7.553 2.059 4.701 1.00 . A A . 15 LEU HD12 1 1 8 4560 1 1 15 LEU HD13 H -6.833 3.658 4.513 1.00 . A A . 15 LEU HD13 1 1 8 4561 1 1 15 LEU HD21 H -5.918 0.534 2.175 1.00 . A A . 15 LEU HD21 1 1 8 4562 1 1 15 LEU HD22 H -4.882 1.449 3.270 1.00 . A A . 15 LEU HD22 1 1 8 4563 1 1 15 LEU HD23 H -6.326 0.647 3.887 1.00 . A A . 15 LEU HD23 1 1 8 4564 1 1 15 LEU HG H -6.036 3.208 2.458 1.00 . A A . 15 LEU HG 1 1 8 4565 1 1 15 LEU N N -8.097 3.438 -0.421 1.00 . A A . 15 LEU N 1 1 8 4566 1 1 15 LEU O O -8.129 0.533 -0.844 1.00 . A A . 15 LEU O 1 1 8 4567 1 1 16 LYS C C -6.208 -1.612 -1.020 1.00 . A A . 16 LYS C 1 1 8 4568 1 1 16 LYS CA C -5.674 -0.381 -1.749 1.00 . A A . 16 LYS CA 1 1 8 4569 1 1 16 LYS CB C -4.182 -0.553 -2.037 1.00 . A A . 16 LYS CB 1 1 8 4570 1 1 16 LYS CD C -2.183 0.144 -3.392 1.00 . A A . 16 LYS CD 1 1 8 4571 1 1 16 LYS CE C -1.683 1.016 -4.532 1.00 . A A . 16 LYS CE 1 1 8 4572 1 1 16 LYS CG C -3.657 0.387 -3.111 1.00 . A A . 16 LYS CG 1 1 8 4573 1 1 16 LYS H H -5.138 1.392 -0.723 1.00 . A A . 16 LYS H 1 1 8 4574 1 1 16 LYS HA H -6.202 -0.274 -2.684 1.00 . A A . 16 LYS HA 1 1 8 4575 1 1 16 LYS HB2 H -3.628 -0.372 -1.128 1.00 . A A . 16 LYS HB2 1 1 8 4576 1 1 16 LYS HB3 H -4.004 -1.568 -2.360 1.00 . A A . 16 LYS HB3 1 1 8 4577 1 1 16 LYS HD2 H -1.615 0.371 -2.503 1.00 . A A . 16 LYS HD2 1 1 8 4578 1 1 16 LYS HD3 H -2.044 -0.894 -3.656 1.00 . A A . 16 LYS HD3 1 1 8 4579 1 1 16 LYS HE2 H -2.526 1.312 -5.139 1.00 . A A . 16 LYS HE2 1 1 8 4580 1 1 16 LYS HE3 H -1.213 1.895 -4.116 1.00 . A A . 16 LYS HE3 1 1 8 4581 1 1 16 LYS HG2 H -4.218 0.228 -4.020 1.00 . A A . 16 LYS HG2 1 1 8 4582 1 1 16 LYS HG3 H -3.789 1.406 -2.778 1.00 . A A . 16 LYS HG3 1 1 8 4583 1 1 16 LYS HZ1 H -0.138 -0.361 -4.813 1.00 . A A . 16 LYS HZ1 1 1 8 4584 1 1 16 LYS HZ2 H -1.193 -0.237 -6.130 1.00 . A A . 16 LYS HZ2 1 1 8 4585 1 1 16 LYS HZ3 H -0.055 0.980 -5.841 1.00 . A A . 16 LYS HZ3 1 1 8 4586 1 1 16 LYS N N -5.902 0.829 -0.966 1.00 . A A . 16 LYS N 1 1 8 4587 1 1 16 LYS NZ N -0.698 0.299 -5.389 1.00 . A A . 16 LYS NZ 1 1 8 4588 1 1 16 LYS O O -6.342 -1.609 0.204 1.00 . A A . 16 LYS O 1 1 8 4589 1 1 17 PRO C C -6.014 -4.633 -0.309 1.00 . A A . 17 PRO C 1 1 8 4590 1 1 17 PRO CA C -7.043 -3.927 -1.184 1.00 . A A . 17 PRO CA 1 1 8 4591 1 1 17 PRO CB C -7.383 -4.784 -2.406 1.00 . A A . 17 PRO CB 1 1 8 4592 1 1 17 PRO CD C -6.391 -2.773 -3.231 1.00 . A A . 17 PRO CD 1 1 8 4593 1 1 17 PRO CG C -6.530 -4.244 -3.502 1.00 . A A . 17 PRO CG 1 1 8 4594 1 1 17 PRO HA H -7.938 -3.747 -0.607 1.00 . A A . 17 PRO HA 1 1 8 4595 1 1 17 PRO HB2 H -7.151 -5.819 -2.198 1.00 . A A . 17 PRO HB2 1 1 8 4596 1 1 17 PRO HB3 H -8.433 -4.685 -2.639 1.00 . A A . 17 PRO HB3 1 1 8 4597 1 1 17 PRO HD2 H -5.423 -2.419 -3.555 1.00 . A A . 17 PRO HD2 1 1 8 4598 1 1 17 PRO HD3 H -7.180 -2.222 -3.722 1.00 . A A . 17 PRO HD3 1 1 8 4599 1 1 17 PRO HG2 H -5.562 -4.723 -3.484 1.00 . A A . 17 PRO HG2 1 1 8 4600 1 1 17 PRO HG3 H -7.012 -4.406 -4.456 1.00 . A A . 17 PRO HG3 1 1 8 4601 1 1 17 PRO N N -6.521 -2.685 -1.766 1.00 . A A . 17 PRO N 1 1 8 4602 1 1 17 PRO O O -4.817 -4.606 -0.594 1.00 . A A . 17 PRO O 1 1 8 4603 1 1 18 ALA C C -4.955 -7.173 0.988 1.00 . A A . 18 ALA C 1 1 8 4604 1 1 18 ALA CA C -5.612 -5.982 1.676 1.00 . A A . 18 ALA CA 1 1 8 4605 1 1 18 ALA CB C -6.390 -6.440 2.900 1.00 . A A . 18 ALA CB 1 1 8 4606 1 1 18 ALA H H -7.454 -5.251 0.932 1.00 . A A . 18 ALA H 1 1 8 4607 1 1 18 ALA HA H -4.842 -5.298 2.003 1.00 . A A . 18 ALA HA 1 1 8 4608 1 1 18 ALA HB1 H -6.847 -5.585 3.377 1.00 . A A . 18 ALA HB1 1 1 8 4609 1 1 18 ALA HB2 H -5.718 -6.923 3.594 1.00 . A A . 18 ALA HB2 1 1 8 4610 1 1 18 ALA HB3 H -7.158 -7.136 2.599 1.00 . A A . 18 ALA HB3 1 1 8 4611 1 1 18 ALA N N -6.490 -5.266 0.758 1.00 . A A . 18 ALA N 1 1 8 4612 1 1 18 ALA O O -5.631 -8.118 0.580 1.00 . A A . 18 ALA O 1 1 8 4613 1 1 19 GLY C C -2.237 -7.775 -1.068 1.00 . A A . 19 GLY C 1 1 8 4614 1 1 19 GLY CA C -2.905 -8.204 0.225 1.00 . A A . 19 GLY CA 1 1 8 4615 1 1 19 GLY H H -3.147 -6.344 1.209 1.00 . A A . 19 GLY H 1 1 8 4616 1 1 19 GLY HA2 H -3.593 -9.009 0.011 1.00 . A A . 19 GLY HA2 1 1 8 4617 1 1 19 GLY HA3 H -2.148 -8.564 0.905 1.00 . A A . 19 GLY HA3 1 1 8 4618 1 1 19 GLY N N -3.633 -7.122 0.863 1.00 . A A . 19 GLY N 1 1 8 4619 1 1 19 GLY O O -1.936 -8.608 -1.924 1.00 . A A . 19 GLY O 1 1 8 4620 1 1 20 THR C C 0.111 -5.649 -2.153 1.00 . A A . 20 THR C 1 1 8 4621 1 1 20 THR CA C -1.364 -5.941 -2.410 1.00 . A A . 20 THR CA 1 1 8 4622 1 1 20 THR CB C -2.076 -4.667 -2.868 1.00 . A A . 20 THR CB 1 1 8 4623 1 1 20 THR CG2 C -1.840 -4.340 -4.327 1.00 . A A . 20 THR CG2 1 1 8 4624 1 1 20 THR H H -2.262 -5.859 -0.496 1.00 . A A . 20 THR H 1 1 8 4625 1 1 20 THR HA H -1.441 -6.686 -3.187 1.00 . A A . 20 THR HA 1 1 8 4626 1 1 20 THR HB H -1.717 -3.835 -2.280 1.00 . A A . 20 THR HB 1 1 8 4627 1 1 20 THR HG1 H -3.784 -5.610 -3.039 1.00 . A A . 20 THR HG1 1 1 8 4628 1 1 20 THR HG21 H -1.868 -5.250 -4.909 1.00 . A A . 20 THR HG21 1 1 8 4629 1 1 20 THR HG22 H -2.609 -3.667 -4.674 1.00 . A A . 20 THR HG22 1 1 8 4630 1 1 20 THR HG23 H -0.873 -3.871 -4.439 1.00 . A A . 20 THR HG23 1 1 8 4631 1 1 20 THR N N -2.002 -6.474 -1.212 1.00 . A A . 20 THR N 1 1 8 4632 1 1 20 THR O O 0.571 -5.681 -1.012 1.00 . A A . 20 THR O 1 1 8 4633 1 1 20 THR OG1 O -3.475 -4.778 -2.675 1.00 . A A . 20 THR OG1 1 1 8 4634 1 1 21 THR C C 2.497 -3.586 -2.822 1.00 . A A . 21 THR C 1 1 8 4635 1 1 21 THR CA C 2.272 -5.067 -3.109 1.00 . A A . 21 THR CA 1 1 8 4636 1 1 21 THR CB C 3.003 -5.469 -4.392 1.00 . A A . 21 THR CB 1 1 8 4637 1 1 21 THR CG2 C 3.798 -6.748 -4.249 1.00 . A A . 21 THR CG2 1 1 8 4638 1 1 21 THR H H 0.426 -5.354 -4.106 1.00 . A A . 21 THR H 1 1 8 4639 1 1 21 THR HA H 2.665 -5.644 -2.286 1.00 . A A . 21 THR HA 1 1 8 4640 1 1 21 THR HB H 3.691 -4.682 -4.667 1.00 . A A . 21 THR HB 1 1 8 4641 1 1 21 THR HG1 H 1.942 -4.811 -5.902 1.00 . A A . 21 THR HG1 1 1 8 4642 1 1 21 THR HG21 H 3.315 -7.393 -3.530 1.00 . A A . 21 THR HG21 1 1 8 4643 1 1 21 THR HG22 H 3.849 -7.249 -5.205 1.00 . A A . 21 THR HG22 1 1 8 4644 1 1 21 THR HG23 H 4.796 -6.515 -3.911 1.00 . A A . 21 THR HG23 1 1 8 4645 1 1 21 THR N N 0.848 -5.364 -3.221 1.00 . A A . 21 THR N 1 1 8 4646 1 1 21 THR O O 1.568 -2.781 -2.890 1.00 . A A . 21 THR O 1 1 8 4647 1 1 21 THR OG1 O 2.087 -5.650 -5.458 1.00 . A A . 21 THR OG1 1 1 8 4648 1 1 22 CYS C C 5.545 -1.570 -2.547 1.00 . A A . 22 CYS C 1 1 8 4649 1 1 22 CYS CA C 4.086 -1.850 -2.202 1.00 . A A . 22 CYS CA 1 1 8 4650 1 1 22 CYS CB C 3.830 -1.544 -0.725 1.00 . A A . 22 CYS CB 1 1 8 4651 1 1 22 CYS H H 4.435 -3.921 -2.462 1.00 . A A . 22 CYS H 1 1 8 4652 1 1 22 CYS HA H 3.458 -1.213 -2.807 1.00 . A A . 22 CYS HA 1 1 8 4653 1 1 22 CYS HB2 H 2.789 -1.722 -0.504 1.00 . A A . 22 CYS HB2 1 1 8 4654 1 1 22 CYS HB3 H 4.438 -2.200 -0.120 1.00 . A A . 22 CYS HB3 1 1 8 4655 1 1 22 CYS N N 3.738 -3.234 -2.500 1.00 . A A . 22 CYS N 1 1 8 4656 1 1 22 CYS O O 5.862 -0.565 -3.183 1.00 . A A . 22 CYS O 1 1 8 4657 1 1 22 CYS SG S 4.213 0.171 -0.243 1.00 . A A . 22 CYS SG 1 1 8 4658 1 1 23 TRP C C 8.446 -3.605 -2.945 1.00 . A A . 23 TRP C 1 1 8 4659 1 1 23 TRP CA C 7.857 -2.315 -2.386 1.00 . A A . 23 TRP CA 1 1 8 4660 1 1 23 TRP CB C 8.594 -1.917 -1.106 1.00 . A A . 23 TRP CB 1 1 8 4661 1 1 23 TRP CD1 C 9.655 0.312 -1.794 1.00 . A A . 23 TRP CD1 1 1 8 4662 1 1 23 TRP CD2 C 11.127 -1.247 -1.152 1.00 . A A . 23 TRP CD2 1 1 8 4663 1 1 23 TRP CE2 C 11.833 -0.080 -1.501 1.00 . A A . 23 TRP CE2 1 1 8 4664 1 1 23 TRP CE3 C 11.846 -2.364 -0.716 1.00 . A A . 23 TRP CE3 1 1 8 4665 1 1 23 TRP CG C 9.735 -0.975 -1.346 1.00 . A A . 23 TRP CG 1 1 8 4666 1 1 23 TRP CH2 C 13.899 -1.107 -0.997 1.00 . A A . 23 TRP CH2 1 1 8 4667 1 1 23 TRP CZ2 C 13.221 0.001 -1.428 1.00 . A A . 23 TRP CZ2 1 1 8 4668 1 1 23 TRP CZ3 C 13.224 -2.282 -0.643 1.00 . A A . 23 TRP CZ3 1 1 8 4669 1 1 23 TRP H H 6.118 -3.246 -1.619 1.00 . A A . 23 TRP H 1 1 8 4670 1 1 23 TRP HA H 7.977 -1.531 -3.118 1.00 . A A . 23 TRP HA 1 1 8 4671 1 1 23 TRP HB2 H 7.900 -1.435 -0.434 1.00 . A A . 23 TRP HB2 1 1 8 4672 1 1 23 TRP HB3 H 8.988 -2.805 -0.634 1.00 . A A . 23 TRP HB3 1 1 8 4673 1 1 23 TRP HD1 H 8.730 0.816 -2.035 1.00 . A A . 23 TRP HD1 1 1 8 4674 1 1 23 TRP HE1 H 11.116 1.768 -2.187 1.00 . A A . 23 TRP HE1 1 1 8 4675 1 1 23 TRP HE3 H 11.343 -3.278 -0.438 1.00 . A A . 23 TRP HE3 1 1 8 4676 1 1 23 TRP HH2 H 14.977 -1.089 -0.926 1.00 . A A . 23 TRP HH2 1 1 8 4677 1 1 23 TRP HZ2 H 13.757 0.899 -1.696 1.00 . A A . 23 TRP HZ2 1 1 8 4678 1 1 23 TRP HZ3 H 13.796 -3.135 -0.309 1.00 . A A . 23 TRP HZ3 1 1 8 4679 1 1 23 TRP N N 6.431 -2.465 -2.122 1.00 . A A . 23 TRP N 1 1 8 4680 1 1 23 TRP NE1 N 10.912 0.857 -1.890 1.00 . A A . 23 TRP NE1 1 1 8 4681 1 1 23 TRP O O 8.873 -4.482 -2.193 1.00 . A A . 23 TRP O 1 1 8 4682 1 1 24 ARG C C 10.473 -4.701 -5.292 1.00 . A A . 24 ARG C 1 1 8 4683 1 1 24 ARG CA C 9.005 -4.899 -4.930 1.00 . A A . 24 ARG CA 1 1 8 4684 1 1 24 ARG CB C 8.195 -5.218 -6.189 1.00 . A A . 24 ARG CB 1 1 8 4685 1 1 24 ARG CD C 5.876 -5.495 -7.115 1.00 . A A . 24 ARG CD 1 1 8 4686 1 1 24 ARG CG C 6.772 -5.666 -5.899 1.00 . A A . 24 ARG CG 1 1 8 4687 1 1 24 ARG CZ C 5.197 -6.782 -9.104 1.00 . A A . 24 ARG CZ 1 1 8 4688 1 1 24 ARG H H 8.113 -2.982 -4.816 1.00 . A A . 24 ARG H 1 1 8 4689 1 1 24 ARG HA H 8.925 -5.727 -4.242 1.00 . A A . 24 ARG HA 1 1 8 4690 1 1 24 ARG HB2 H 8.152 -4.335 -6.809 1.00 . A A . 24 ARG HB2 1 1 8 4691 1 1 24 ARG HB3 H 8.694 -6.006 -6.733 1.00 . A A . 24 ARG HB3 1 1 8 4692 1 1 24 ARG HD2 H 4.878 -5.257 -6.780 1.00 . A A . 24 ARG HD2 1 1 8 4693 1 1 24 ARG HD3 H 6.257 -4.681 -7.715 1.00 . A A . 24 ARG HD3 1 1 8 4694 1 1 24 ARG HE H 6.284 -7.501 -7.592 1.00 . A A . 24 ARG HE 1 1 8 4695 1 1 24 ARG HG2 H 6.784 -6.709 -5.617 1.00 . A A . 24 ARG HG2 1 1 8 4696 1 1 24 ARG HG3 H 6.377 -5.076 -5.085 1.00 . A A . 24 ARG HG3 1 1 8 4697 1 1 24 ARG HH11 H 4.559 -4.863 -9.090 1.00 . A A . 24 ARG HH11 1 1 8 4698 1 1 24 ARG HH12 H 4.095 -5.789 -10.477 1.00 . A A . 24 ARG HH12 1 1 8 4699 1 1 24 ARG HH21 H 5.675 -8.721 -9.417 1.00 . A A . 24 ARG HH21 1 1 8 4700 1 1 24 ARG HH22 H 4.728 -7.979 -10.663 1.00 . A A . 24 ARG HH22 1 1 8 4701 1 1 24 ARG N N 8.467 -3.715 -4.270 1.00 . A A . 24 ARG N 1 1 8 4702 1 1 24 ARG NE N 5.826 -6.705 -7.933 1.00 . A A . 24 ARG NE 1 1 8 4703 1 1 24 ARG NH1 N 4.565 -5.724 -9.597 1.00 . A A . 24 ARG NH1 1 1 8 4704 1 1 24 ARG NH2 N 5.200 -7.921 -9.783 1.00 . A A . 24 ARG NH2 1 1 8 4705 1 1 24 ARG O O 10.860 -3.650 -5.804 1.00 . A A . 24 ARG O 1 1 8 4706 1 1 25 THR C C 13.360 -7.027 -5.172 1.00 . A A . 25 THR C 1 1 8 4707 1 1 25 THR CA C 12.712 -5.654 -5.321 1.00 . A A . 25 THR CA 1 1 8 4708 1 1 25 THR CB C 13.403 -4.648 -4.399 1.00 . A A . 25 THR CB 1 1 8 4709 1 1 25 THR CG2 C 13.444 -3.246 -4.967 1.00 . A A . 25 THR CG2 1 1 8 4710 1 1 25 THR H H 10.918 -6.528 -4.615 1.00 . A A . 25 THR H 1 1 8 4711 1 1 25 THR HA H 12.823 -5.326 -6.344 1.00 . A A . 25 THR HA 1 1 8 4712 1 1 25 THR HB H 14.422 -4.968 -4.234 1.00 . A A . 25 THR HB 1 1 8 4713 1 1 25 THR HG1 H 11.873 -4.205 -3.259 1.00 . A A . 25 THR HG1 1 1 8 4714 1 1 25 THR HG21 H 13.347 -3.290 -6.042 1.00 . A A . 25 THR HG21 1 1 8 4715 1 1 25 THR HG22 H 12.630 -2.667 -4.556 1.00 . A A . 25 THR HG22 1 1 8 4716 1 1 25 THR HG23 H 14.383 -2.780 -4.708 1.00 . A A . 25 THR HG23 1 1 8 4717 1 1 25 THR N N 11.286 -5.717 -5.023 1.00 . A A . 25 THR N 1 1 8 4718 1 1 25 THR O O 12.683 -8.017 -4.896 1.00 . A A . 25 THR O 1 1 8 4719 1 1 25 THR OG1 O 12.747 -4.585 -3.145 1.00 . A A . 25 THR OG1 1 1 8 4720 1 1 26 SER C C 16.067 -8.452 -3.868 1.00 . A A . 26 SER C 1 1 8 4721 1 1 26 SER CA C 15.415 -8.329 -5.241 1.00 . A A . 26 SER CA 1 1 8 4722 1 1 26 SER CB C 16.481 -8.418 -6.335 1.00 . A A . 26 SER CB 1 1 8 4723 1 1 26 SER H H 15.160 -6.254 -5.574 1.00 . A A . 26 SER H 1 1 8 4724 1 1 26 SER HA H 14.714 -9.141 -5.367 1.00 . A A . 26 SER HA 1 1 8 4725 1 1 26 SER HB2 H 17.240 -7.671 -6.156 1.00 . A A . 26 SER HB2 1 1 8 4726 1 1 26 SER HB3 H 16.931 -9.399 -6.318 1.00 . A A . 26 SER HB3 1 1 8 4727 1 1 26 SER HG H 16.558 -8.428 -8.292 1.00 . A A . 26 SER HG 1 1 8 4728 1 1 26 SER N N 14.675 -7.078 -5.356 1.00 . A A . 26 SER N 1 1 8 4729 1 1 26 SER O O 17.169 -8.986 -3.739 1.00 . A A . 26 SER O 1 1 8 4730 1 1 26 SER OG O 15.917 -8.196 -7.616 1.00 . A A . 26 SER OG 1 1 8 4731 1 1 27 VAL C C 14.756 -8.039 -0.467 1.00 . A A . 27 VAL C 1 1 8 4732 1 1 27 VAL CA C 15.893 -8.008 -1.482 1.00 . A A . 27 VAL CA 1 1 8 4733 1 1 27 VAL CB C 16.806 -6.806 -1.175 1.00 . A A . 27 VAL CB 1 1 8 4734 1 1 27 VAL CG1 C 17.488 -6.983 0.173 1.00 . A A . 27 VAL CG1 1 1 8 4735 1 1 27 VAL CG2 C 17.834 -6.621 -2.281 1.00 . A A . 27 VAL CG2 1 1 8 4736 1 1 27 VAL H H 14.507 -7.541 -3.012 1.00 . A A . 27 VAL H 1 1 8 4737 1 1 27 VAL HA H 16.474 -8.910 -1.381 1.00 . A A . 27 VAL HA 1 1 8 4738 1 1 27 VAL HB H 16.194 -5.917 -1.130 1.00 . A A . 27 VAL HB 1 1 8 4739 1 1 27 VAL HG11 H 17.880 -7.986 0.249 1.00 . A A . 27 VAL HG11 1 1 8 4740 1 1 27 VAL HG12 H 18.296 -6.272 0.263 1.00 . A A . 27 VAL HG12 1 1 8 4741 1 1 27 VAL HG13 H 16.772 -6.815 0.963 1.00 . A A . 27 VAL HG13 1 1 8 4742 1 1 27 VAL HG21 H 18.342 -7.557 -2.461 1.00 . A A . 27 VAL HG21 1 1 8 4743 1 1 27 VAL HG22 H 17.336 -6.302 -3.185 1.00 . A A . 27 VAL HG22 1 1 8 4744 1 1 27 VAL HG23 H 18.553 -5.872 -1.983 1.00 . A A . 27 VAL HG23 1 1 8 4745 1 1 27 VAL N N 15.380 -7.954 -2.845 1.00 . A A . 27 VAL N 1 1 8 4746 1 1 27 VAL O O 14.769 -8.834 0.473 1.00 . A A . 27 VAL O 1 1 8 4747 1 1 28 SER C C 11.322 -7.073 -0.562 1.00 . A A . 28 SER C 1 1 8 4748 1 1 28 SER CA C 12.626 -7.092 0.228 1.00 . A A . 28 SER CA 1 1 8 4749 1 1 28 SER CB C 12.721 -5.844 1.107 1.00 . A A . 28 SER CB 1 1 8 4750 1 1 28 SER H H 13.825 -6.564 -1.434 1.00 . A A . 28 SER H 1 1 8 4751 1 1 28 SER HA H 12.638 -7.968 0.859 1.00 . A A . 28 SER HA 1 1 8 4752 1 1 28 SER HB2 H 13.030 -5.003 0.504 1.00 . A A . 28 SER HB2 1 1 8 4753 1 1 28 SER HB3 H 11.754 -5.639 1.543 1.00 . A A . 28 SER HB3 1 1 8 4754 1 1 28 SER HG H 13.313 -5.656 2.966 1.00 . A A . 28 SER HG 1 1 8 4755 1 1 28 SER N N 13.775 -7.169 -0.667 1.00 . A A . 28 SER N 1 1 8 4756 1 1 28 SER O O 11.327 -6.927 -1.784 1.00 . A A . 28 SER O 1 1 8 4757 1 1 28 SER OG O 13.662 -6.025 2.151 1.00 . A A . 28 SER OG 1 1 8 4758 1 1 29 SER C C 7.824 -6.712 0.468 1.00 . A A . 29 SER C 1 1 8 4759 1 1 29 SER CA C 8.893 -7.223 -0.492 1.00 . A A . 29 SER CA 1 1 8 4760 1 1 29 SER CB C 8.535 -8.631 -0.970 1.00 . A A . 29 SER CB 1 1 8 4761 1 1 29 SER H H 10.266 -7.336 1.116 1.00 . A A . 29 SER H 1 1 8 4762 1 1 29 SER HA H 8.939 -6.563 -1.345 1.00 . A A . 29 SER HA 1 1 8 4763 1 1 29 SER HB2 H 9.428 -9.129 -1.317 1.00 . A A . 29 SER HB2 1 1 8 4764 1 1 29 SER HB3 H 8.108 -9.190 -0.150 1.00 . A A . 29 SER HB3 1 1 8 4765 1 1 29 SER HG H 7.683 -9.378 -2.568 1.00 . A A . 29 SER HG 1 1 8 4766 1 1 29 SER N N 10.206 -7.223 0.144 1.00 . A A . 29 SER N 1 1 8 4767 1 1 29 SER O O 7.288 -7.470 1.277 1.00 . A A . 29 SER O 1 1 8 4768 1 1 29 SER OG O 7.597 -8.587 -2.031 1.00 . A A . 29 SER OG 1 1 8 4769 1 1 30 HIS C C 5.106 -5.092 0.712 1.00 . A A . 30 HIS C 1 1 8 4770 1 1 30 HIS CA C 6.511 -4.810 1.233 1.00 . A A . 30 HIS CA 1 1 8 4771 1 1 30 HIS CB C 6.740 -3.301 1.326 1.00 . A A . 30 HIS CB 1 1 8 4772 1 1 30 HIS CD2 C 9.293 -3.362 1.784 1.00 . A A . 30 HIS CD2 1 1 8 4773 1 1 30 HIS CE1 C 9.361 -1.894 3.411 1.00 . A A . 30 HIS CE1 1 1 8 4774 1 1 30 HIS CG C 8.027 -2.931 1.997 1.00 . A A . 30 HIS CG 1 1 8 4775 1 1 30 HIS H H 7.979 -4.869 -0.292 1.00 . A A . 30 HIS H 1 1 8 4776 1 1 30 HIS HA H 6.610 -5.242 2.218 1.00 . A A . 30 HIS HA 1 1 8 4777 1 1 30 HIS HB2 H 6.754 -2.884 0.330 1.00 . A A . 30 HIS HB2 1 1 8 4778 1 1 30 HIS HB3 H 5.932 -2.855 1.887 1.00 . A A . 30 HIS HB3 1 1 8 4779 1 1 30 HIS HD1 H 7.350 -1.521 3.409 1.00 . A A . 30 HIS HD1 1 1 8 4780 1 1 30 HIS HD2 H 9.608 -4.089 1.049 1.00 . A A . 30 HIS HD2 1 1 8 4781 1 1 30 HIS HE1 H 9.722 -1.247 4.198 1.00 . A A . 30 HIS HE1 1 1 8 4782 1 1 30 HIS HE2 H 11.081 -2.747 2.697 1.00 . A A . 30 HIS HE2 1 1 8 4783 1 1 30 HIS N N 7.517 -5.423 0.373 1.00 . A A . 30 HIS N 1 1 8 4784 1 1 30 HIS ND1 N 8.104 -2.013 3.023 1.00 . A A . 30 HIS ND1 1 1 8 4785 1 1 30 HIS NE2 N 10.102 -2.702 2.676 1.00 . A A . 30 HIS NE2 1 1 8 4786 1 1 30 HIS O O 4.856 -5.031 -0.492 1.00 . A A . 30 HIS O 1 1 8 4787 1 1 31 TYR C C 1.848 -4.746 1.970 1.00 . A A . 31 TYR C 1 1 8 4788 1 1 31 TYR CA C 2.811 -5.691 1.259 1.00 . A A . 31 TYR CA 1 1 8 4789 1 1 31 TYR CB C 2.465 -7.142 1.601 1.00 . A A . 31 TYR CB 1 1 8 4790 1 1 31 TYR CD1 C 4.186 -8.709 0.623 1.00 . A A . 31 TYR CD1 1 1 8 4791 1 1 31 TYR CD2 C 2.091 -8.500 -0.494 1.00 . A A . 31 TYR CD2 1 1 8 4792 1 1 31 TYR CE1 C 4.608 -9.618 -0.329 1.00 . A A . 31 TYR CE1 1 1 8 4793 1 1 31 TYR CE2 C 2.506 -9.409 -1.450 1.00 . A A . 31 TYR CE2 1 1 8 4794 1 1 31 TYR CG C 2.923 -8.136 0.557 1.00 . A A . 31 TYR CG 1 1 8 4795 1 1 31 TYR CZ C 3.765 -9.964 -1.363 1.00 . A A . 31 TYR CZ 1 1 8 4796 1 1 31 TYR H H 4.452 -5.433 2.570 1.00 . A A . 31 TYR H 1 1 8 4797 1 1 31 TYR HA H 2.714 -5.549 0.193 1.00 . A A . 31 TYR HA 1 1 8 4798 1 1 31 TYR HB2 H 2.934 -7.405 2.537 1.00 . A A . 31 TYR HB2 1 1 8 4799 1 1 31 TYR HB3 H 1.394 -7.235 1.702 1.00 . A A . 31 TYR HB3 1 1 8 4800 1 1 31 TYR HD1 H 4.845 -8.436 1.435 1.00 . A A . 31 TYR HD1 1 1 8 4801 1 1 31 TYR HD2 H 1.106 -8.063 -0.561 1.00 . A A . 31 TYR HD2 1 1 8 4802 1 1 31 TYR HE1 H 5.594 -10.053 -0.260 1.00 . A A . 31 TYR HE1 1 1 8 4803 1 1 31 TYR HE2 H 1.845 -9.680 -2.260 1.00 . A A . 31 TYR HE2 1 1 8 4804 1 1 31 TYR HH H 4.006 -10.517 -3.188 1.00 . A A . 31 TYR HH 1 1 8 4805 1 1 31 TYR N N 4.192 -5.400 1.626 1.00 . A A . 31 TYR N 1 1 8 4806 1 1 31 TYR O O 2.100 -4.319 3.097 1.00 . A A . 31 TYR O 1 1 8 4807 1 1 31 TYR OH O 4.181 -10.869 -2.312 1.00 . A A . 31 TYR OH 1 1 8 4808 1 1 32 CYS C C -1.336 -4.318 2.609 1.00 . A A . 32 CYS C 1 1 8 4809 1 1 32 CYS CA C -0.258 -3.529 1.873 1.00 . A A . 32 CYS CA 1 1 8 4810 1 1 32 CYS CB C -0.894 -2.678 0.773 1.00 . A A . 32 CYS CB 1 1 8 4811 1 1 32 CYS H H 0.598 -4.796 0.410 1.00 . A A . 32 CYS H 1 1 8 4812 1 1 32 CYS HA H 0.240 -2.879 2.577 1.00 . A A . 32 CYS HA 1 1 8 4813 1 1 32 CYS HB2 H -0.949 -3.259 -0.135 1.00 . A A . 32 CYS HB2 1 1 8 4814 1 1 32 CYS HB3 H -1.892 -2.399 1.077 1.00 . A A . 32 CYS HB3 1 1 8 4815 1 1 32 CYS N N 0.744 -4.424 1.305 1.00 . A A . 32 CYS N 1 1 8 4816 1 1 32 CYS O O -1.849 -5.313 2.098 1.00 . A A . 32 CYS O 1 1 8 4817 1 1 32 CYS SG S 0.020 -1.148 0.395 1.00 . A A . 32 CYS SG 1 1 8 4818 1 1 33 THR C C -4.076 -3.931 4.371 1.00 . A A . 33 THR C 1 1 8 4819 1 1 33 THR CA C -2.693 -4.532 4.618 1.00 . A A . 33 THR CA 1 1 8 4820 1 1 33 THR CB C -2.340 -4.433 6.104 1.00 . A A . 33 THR CB 1 1 8 4821 1 1 33 THR CG2 C -1.977 -3.030 6.540 1.00 . A A . 33 THR CG2 1 1 8 4822 1 1 33 THR H H -1.230 -3.069 4.167 1.00 . A A . 33 THR H 1 1 8 4823 1 1 33 THR HA H -2.711 -5.573 4.333 1.00 . A A . 33 THR HA 1 1 8 4824 1 1 33 THR HB H -1.493 -5.072 6.305 1.00 . A A . 33 THR HB 1 1 8 4825 1 1 33 THR HG1 H -4.140 -4.228 6.850 1.00 . A A . 33 THR HG1 1 1 8 4826 1 1 33 THR HG21 H -2.639 -2.322 6.065 1.00 . A A . 33 THR HG21 1 1 8 4827 1 1 33 THR HG22 H -2.075 -2.950 7.613 1.00 . A A . 33 THR HG22 1 1 8 4828 1 1 33 THR HG23 H -0.957 -2.817 6.255 1.00 . A A . 33 THR HG23 1 1 8 4829 1 1 33 THR N N -1.675 -3.867 3.812 1.00 . A A . 33 THR N 1 1 8 4830 1 1 33 THR O O -5.018 -4.199 5.117 1.00 . A A . 33 THR O 1 1 8 4831 1 1 33 THR OG1 O -3.424 -4.866 6.906 1.00 . A A . 33 THR OG1 1 1 8 4832 1 1 34 GLY C C -6.109 -1.820 4.201 1.00 . A A . 34 GLY C 1 1 8 4833 1 1 34 GLY CA C -5.469 -2.498 3.003 1.00 . A A . 34 GLY CA 1 1 8 4834 1 1 34 GLY H H -3.413 -2.940 2.760 1.00 . A A . 34 GLY H 1 1 8 4835 1 1 34 GLY HA2 H -6.142 -3.257 2.632 1.00 . A A . 34 GLY HA2 1 1 8 4836 1 1 34 GLY HA3 H -5.314 -1.762 2.229 1.00 . A A . 34 GLY HA3 1 1 8 4837 1 1 34 GLY N N -4.195 -3.119 3.323 1.00 . A A . 34 GLY N 1 1 8 4838 1 1 34 GLY O O -7.331 -1.688 4.267 1.00 . A A . 34 GLY O 1 1 8 4839 1 1 35 ARG C C -5.566 0.781 6.263 1.00 . A A . 35 ARG C 1 1 8 4840 1 1 35 ARG CA C -5.775 -0.727 6.350 1.00 . A A . 35 ARG CA 1 1 8 4841 1 1 35 ARG CB C -5.072 -1.280 7.590 1.00 . A A . 35 ARG CB 1 1 8 4842 1 1 35 ARG CD C -5.193 -1.805 10.045 1.00 . A A . 35 ARG CD 1 1 8 4843 1 1 35 ARG CG C -5.962 -1.333 8.821 1.00 . A A . 35 ARG CG 1 1 8 4844 1 1 35 ARG CZ C -6.879 -1.900 11.840 1.00 . A A . 35 ARG CZ 1 1 8 4845 1 1 35 ARG H H -4.317 -1.528 5.040 1.00 . A A . 35 ARG H 1 1 8 4846 1 1 35 ARG HA H -6.832 -0.926 6.427 1.00 . A A . 35 ARG HA 1 1 8 4847 1 1 35 ARG HB2 H -4.728 -2.282 7.378 1.00 . A A . 35 ARG HB2 1 1 8 4848 1 1 35 ARG HB3 H -4.220 -0.657 7.815 1.00 . A A . 35 ARG HB3 1 1 8 4849 1 1 35 ARG HD2 H -4.406 -2.471 9.724 1.00 . A A . 35 ARG HD2 1 1 8 4850 1 1 35 ARG HD3 H -4.760 -0.946 10.535 1.00 . A A . 35 ARG HD3 1 1 8 4851 1 1 35 ARG HE H -6.012 -3.489 10.999 1.00 . A A . 35 ARG HE 1 1 8 4852 1 1 35 ARG HG2 H -6.353 -0.345 9.013 1.00 . A A . 35 ARG HG2 1 1 8 4853 1 1 35 ARG HG3 H -6.778 -2.015 8.634 1.00 . A A . 35 ARG HG3 1 1 8 4854 1 1 35 ARG HH11 H -6.401 -0.029 11.238 1.00 . A A . 35 ARG HH11 1 1 8 4855 1 1 35 ARG HH12 H -7.583 -0.124 12.499 1.00 . A A . 35 ARG HH12 1 1 8 4856 1 1 35 ARG HH21 H -7.568 -3.615 12.657 1.00 . A A . 35 ARG HH21 1 1 8 4857 1 1 35 ARG HH22 H -8.246 -2.159 13.305 1.00 . A A . 35 ARG HH22 1 1 8 4858 1 1 35 ARG N N -5.282 -1.392 5.149 1.00 . A A . 35 ARG N 1 1 8 4859 1 1 35 ARG NE N -6.053 -2.510 10.993 1.00 . A A . 35 ARG NE 1 1 8 4860 1 1 35 ARG NH1 N -6.961 -0.576 11.860 1.00 . A A . 35 ARG NH1 1 1 8 4861 1 1 35 ARG NH2 N -7.626 -2.617 12.669 1.00 . A A . 35 ARG NH2 1 1 8 4862 1 1 35 ARG O O -6.389 1.561 6.742 1.00 . A A . 35 ARG O 1 1 8 4863 1 1 36 SER C C -3.115 2.814 4.391 1.00 . A A . 36 SER C 1 1 8 4864 1 1 36 SER CA C -4.140 2.600 5.500 1.00 . A A . 36 SER CA 1 1 8 4865 1 1 36 SER CB C -3.609 3.167 6.818 1.00 . A A . 36 SER CB 1 1 8 4866 1 1 36 SER H H -3.842 0.515 5.288 1.00 . A A . 36 SER H 1 1 8 4867 1 1 36 SER HA H -5.050 3.118 5.236 1.00 . A A . 36 SER HA 1 1 8 4868 1 1 36 SER HB2 H -2.777 2.567 7.156 1.00 . A A . 36 SER HB2 1 1 8 4869 1 1 36 SER HB3 H -3.280 4.184 6.663 1.00 . A A . 36 SER HB3 1 1 8 4870 1 1 36 SER HG H -4.463 3.884 8.429 1.00 . A A . 36 SER HG 1 1 8 4871 1 1 36 SER N N -4.459 1.185 5.649 1.00 . A A . 36 SER N 1 1 8 4872 1 1 36 SER O O -2.503 1.862 3.907 1.00 . A A . 36 SER O 1 1 8 4873 1 1 36 SER OG O -4.613 3.158 7.818 1.00 . A A . 36 SER OG 1 1 8 4874 1 1 37 CYS C C -0.544 4.261 3.440 1.00 . A A . 37 CYS C 1 1 8 4875 1 1 37 CYS CA C -1.980 4.406 2.943 1.00 . A A . 37 CYS CA 1 1 8 4876 1 1 37 CYS CB C -2.220 5.834 2.446 1.00 . A A . 37 CYS CB 1 1 8 4877 1 1 37 CYS H H -3.449 4.785 4.419 1.00 . A A . 37 CYS H 1 1 8 4878 1 1 37 CYS HA H -2.136 3.720 2.124 1.00 . A A . 37 CYS HA 1 1 8 4879 1 1 37 CYS HB2 H -3.185 6.169 2.792 1.00 . A A . 37 CYS HB2 1 1 8 4880 1 1 37 CYS HB3 H -1.454 6.481 2.848 1.00 . A A . 37 CYS HB3 1 1 8 4881 1 1 37 CYS N N -2.932 4.069 3.995 1.00 . A A . 37 CYS N 1 1 8 4882 1 1 37 CYS O O 0.364 3.966 2.664 1.00 . A A . 37 CYS O 1 1 8 4883 1 1 37 CYS SG S -2.194 6.003 0.633 1.00 . A A . 37 CYS SG 1 1 8 4884 1 1 38 GLU C C 1.567 2.975 5.113 1.00 . A A . 38 GLU C 1 1 8 4885 1 1 38 GLU CA C 0.978 4.363 5.338 1.00 . A A . 38 GLU CA 1 1 8 4886 1 1 38 GLU CB C 0.907 4.664 6.836 1.00 . A A . 38 GLU CB 1 1 8 4887 1 1 38 GLU CD C 3.401 4.580 7.234 1.00 . A A . 38 GLU CD 1 1 8 4888 1 1 38 GLU CG C 2.129 5.395 7.368 1.00 . A A . 38 GLU CG 1 1 8 4889 1 1 38 GLU H H -1.112 4.704 5.306 1.00 . A A . 38 GLU H 1 1 8 4890 1 1 38 GLU HA H 1.616 5.093 4.863 1.00 . A A . 38 GLU HA 1 1 8 4891 1 1 38 GLU HB2 H 0.037 5.274 7.029 1.00 . A A . 38 GLU HB2 1 1 8 4892 1 1 38 GLU HB3 H 0.810 3.733 7.374 1.00 . A A . 38 GLU HB3 1 1 8 4893 1 1 38 GLU HG2 H 2.251 6.315 6.816 1.00 . A A . 38 GLU HG2 1 1 8 4894 1 1 38 GLU HG3 H 1.972 5.621 8.412 1.00 . A A . 38 GLU HG3 1 1 8 4895 1 1 38 GLU N N -0.348 4.471 4.738 1.00 . A A . 38 GLU N 1 1 8 4896 1 1 38 GLU O O 1.369 2.067 5.921 1.00 . A A . 38 GLU O 1 1 8 4897 1 1 38 GLU OE1 O 3.975 4.200 8.276 1.00 . A A . 38 GLU OE1 1 1 8 4898 1 1 38 GLU OE2 O 3.821 4.320 6.086 1.00 . A A . 38 GLU OE2 1 1 8 4899 1 1 39 CYS C C 3.872 1.094 4.783 1.00 . A A . 39 CYS C 1 1 8 4900 1 1 39 CYS CA C 2.913 1.539 3.678 1.00 . A A . 39 CYS CA 1 1 8 4901 1 1 39 CYS CB C 3.665 1.647 2.350 1.00 . A A . 39 CYS CB 1 1 8 4902 1 1 39 CYS H H 2.415 3.579 3.407 1.00 . A A . 39 CYS H 1 1 8 4903 1 1 39 CYS HA H 2.127 0.807 3.577 1.00 . A A . 39 CYS HA 1 1 8 4904 1 1 39 CYS HB2 H 2.984 1.991 1.587 1.00 . A A . 39 CYS HB2 1 1 8 4905 1 1 39 CYS HB3 H 4.468 2.361 2.457 1.00 . A A . 39 CYS HB3 1 1 8 4906 1 1 39 CYS N N 2.293 2.817 4.011 1.00 . A A . 39 CYS N 1 1 8 4907 1 1 39 CYS O O 4.935 1.686 4.965 1.00 . A A . 39 CYS O 1 1 8 4908 1 1 39 CYS SG S 4.390 0.077 1.777 1.00 . A A . 39 CYS SG 1 1 8 4909 1 1 40 PRO C C 5.619 -1.144 6.108 1.00 . A A . 40 PRO C 1 1 8 4910 1 1 40 PRO CA C 4.351 -0.474 6.625 1.00 . A A . 40 PRO CA 1 1 8 4911 1 1 40 PRO CB C 3.451 -1.497 7.321 1.00 . A A . 40 PRO CB 1 1 8 4912 1 1 40 PRO CD C 2.260 -0.731 5.397 1.00 . A A . 40 PRO CD 1 1 8 4913 1 1 40 PRO CG C 2.492 -1.934 6.269 1.00 . A A . 40 PRO CG 1 1 8 4914 1 1 40 PRO HA H 4.618 0.308 7.322 1.00 . A A . 40 PRO HA 1 1 8 4915 1 1 40 PRO HB2 H 4.049 -2.323 7.678 1.00 . A A . 40 PRO HB2 1 1 8 4916 1 1 40 PRO HB3 H 2.941 -1.029 8.149 1.00 . A A . 40 PRO HB3 1 1 8 4917 1 1 40 PRO HD2 H 2.108 -1.033 4.371 1.00 . A A . 40 PRO HD2 1 1 8 4918 1 1 40 PRO HD3 H 1.414 -0.163 5.754 1.00 . A A . 40 PRO HD3 1 1 8 4919 1 1 40 PRO HG2 H 2.921 -2.739 5.692 1.00 . A A . 40 PRO HG2 1 1 8 4920 1 1 40 PRO HG3 H 1.565 -2.249 6.725 1.00 . A A . 40 PRO HG3 1 1 8 4921 1 1 40 PRO N N 3.510 0.040 5.539 1.00 . A A . 40 PRO N 1 1 8 4922 1 1 40 PRO O O 5.767 -1.371 4.907 1.00 . A A . 40 PRO O 1 1 8 4923 1 1 41 SER C C 7.873 -3.504 7.257 1.00 . A A . 41 SER C 1 1 8 4924 1 1 41 SER CA C 7.788 -2.104 6.658 1.00 . A A . 41 SER CA 1 1 8 4925 1 1 41 SER CB C 8.974 -1.259 7.129 1.00 . A A . 41 SER CB 1 1 8 4926 1 1 41 SER H H 6.356 -1.252 7.963 1.00 . A A . 41 SER H 1 1 8 4927 1 1 41 SER HA H 7.820 -2.183 5.582 1.00 . A A . 41 SER HA 1 1 8 4928 1 1 41 SER HB2 H 8.980 -0.321 6.594 1.00 . A A . 41 SER HB2 1 1 8 4929 1 1 41 SER HB3 H 8.879 -1.069 8.188 1.00 . A A . 41 SER HB3 1 1 8 4930 1 1 41 SER HG H 10.722 -1.933 7.700 1.00 . A A . 41 SER HG 1 1 8 4931 1 1 41 SER N N 6.531 -1.458 7.022 1.00 . A A . 41 SER N 1 1 8 4932 1 1 41 SER O O 8.660 -3.754 8.170 1.00 . A A . 41 SER O 1 1 8 4933 1 1 41 SER OG O 10.201 -1.927 6.894 1.00 . A A . 41 SER OG 1 1 8 4934 1 1 42 TYR C C 7.510 -6.755 6.133 1.00 . A A . 42 TYR C 1 1 8 4935 1 1 42 TYR CA C 7.039 -5.791 7.219 1.00 . A A . 42 TYR CA 1 1 8 4936 1 1 42 TYR CB C 5.632 -6.173 7.681 1.00 . A A . 42 TYR CB 1 1 8 4937 1 1 42 TYR CD1 C 4.070 -4.836 9.146 1.00 . A A . 42 TYR CD1 1 1 8 4938 1 1 42 TYR CD2 C 6.053 -5.722 10.129 1.00 . A A . 42 TYR CD2 1 1 8 4939 1 1 42 TYR CE1 C 3.712 -4.280 10.359 1.00 . A A . 42 TYR CE1 1 1 8 4940 1 1 42 TYR CE2 C 5.702 -5.169 11.346 1.00 . A A . 42 TYR CE2 1 1 8 4941 1 1 42 TYR CG C 5.244 -5.566 9.010 1.00 . A A . 42 TYR CG 1 1 8 4942 1 1 42 TYR CZ C 4.531 -4.449 11.456 1.00 . A A . 42 TYR CZ 1 1 8 4943 1 1 42 TYR H H 6.452 -4.155 6.010 1.00 . A A . 42 TYR H 1 1 8 4944 1 1 42 TYR HA H 7.714 -5.857 8.059 1.00 . A A . 42 TYR HA 1 1 8 4945 1 1 42 TYR HB2 H 4.916 -5.841 6.944 1.00 . A A . 42 TYR HB2 1 1 8 4946 1 1 42 TYR HB3 H 5.571 -7.248 7.775 1.00 . A A . 42 TYR HB3 1 1 8 4947 1 1 42 TYR HD1 H 3.430 -4.706 8.286 1.00 . A A . 42 TYR HD1 1 1 8 4948 1 1 42 TYR HD2 H 6.969 -6.287 10.039 1.00 . A A . 42 TYR HD2 1 1 8 4949 1 1 42 TYR HE1 H 2.795 -3.716 10.445 1.00 . A A . 42 TYR HE1 1 1 8 4950 1 1 42 TYR HE2 H 6.344 -5.302 12.204 1.00 . A A . 42 TYR HE2 1 1 8 4951 1 1 42 TYR HH H 4.875 -3.306 12.963 1.00 . A A . 42 TYR HH 1 1 8 4952 1 1 42 TYR N N 7.057 -4.415 6.736 1.00 . A A . 42 TYR N 1 1 8 4953 1 1 42 TYR O O 6.700 -7.310 5.390 1.00 . A A . 42 TYR O 1 1 8 4954 1 1 42 TYR OH O 4.178 -3.896 12.665 1.00 . A A . 42 TYR OH 1 1 8 4955 1 1 43 PRO C C 8.765 -9.253 5.051 1.00 . A A . 43 PRO C 1 1 8 4956 1 1 43 PRO CA C 9.409 -7.871 5.024 1.00 . A A . 43 PRO CA 1 1 8 4957 1 1 43 PRO CB C 10.882 -7.960 5.429 1.00 . A A . 43 PRO CB 1 1 8 4958 1 1 43 PRO CD C 9.869 -6.347 6.873 1.00 . A A . 43 PRO CD 1 1 8 4959 1 1 43 PRO CG C 11.150 -6.693 6.166 1.00 . A A . 43 PRO CG 1 1 8 4960 1 1 43 PRO HA H 9.331 -7.458 4.029 1.00 . A A . 43 PRO HA 1 1 8 4961 1 1 43 PRO HB2 H 11.033 -8.824 6.060 1.00 . A A . 43 PRO HB2 1 1 8 4962 1 1 43 PRO HB3 H 11.498 -8.039 4.546 1.00 . A A . 43 PRO HB3 1 1 8 4963 1 1 43 PRO HD2 H 9.860 -6.771 7.866 1.00 . A A . 43 PRO HD2 1 1 8 4964 1 1 43 PRO HD3 H 9.739 -5.276 6.916 1.00 . A A . 43 PRO HD3 1 1 8 4965 1 1 43 PRO HG2 H 11.944 -6.846 6.882 1.00 . A A . 43 PRO HG2 1 1 8 4966 1 1 43 PRO HG3 H 11.416 -5.912 5.469 1.00 . A A . 43 PRO HG3 1 1 8 4967 1 1 43 PRO N N 8.833 -6.968 6.026 1.00 . A A . 43 PRO N 1 1 8 4968 1 1 43 PRO O O 8.918 -10.001 6.016 1.00 . A A . 43 PRO O 1 1 8 4969 1 1 44 GLY C C 5.910 -10.797 4.237 1.00 . A A . 44 GLY C 1 1 8 4970 1 1 44 GLY CA C 7.387 -10.877 3.907 1.00 . A A . 44 GLY CA 1 1 8 4971 1 1 44 GLY H H 7.957 -8.948 3.246 1.00 . A A . 44 GLY H 1 1 8 4972 1 1 44 GLY HA2 H 7.864 -11.553 4.602 1.00 . A A . 44 GLY HA2 1 1 8 4973 1 1 44 GLY HA3 H 7.501 -11.266 2.907 1.00 . A A . 44 GLY HA3 1 1 8 4974 1 1 44 GLY N N 8.044 -9.585 3.985 1.00 . A A . 44 GLY N 1 1 8 4975 1 1 44 GLY O O 5.420 -9.679 4.503 1.00 . A A . 44 GLY O 1 1 8 4976 1 1 44 GLY OXT O 5.242 -11.853 4.230 1.00 . A A . 44 GLY OXT 1 1 9 4977 1 1 1 ALA C C -9.614 13.497 6.727 1.00 . A A . 1 ALA C 1 1 9 4978 1 1 1 ALA CA C -9.544 12.686 8.016 1.00 . A A . 1 ALA CA 1 1 9 4979 1 1 1 ALA CB C -8.100 12.336 8.342 1.00 . A A . 1 ALA CB 1 1 9 4980 1 1 1 ALA H1 H -11.225 11.685 7.382 1.00 . A A . 1 ALA H1 1 1 9 4981 1 1 1 ALA H2 H -9.796 10.735 7.416 1.00 . A A . 1 ALA H2 1 1 9 4982 1 1 1 ALA H3 H -10.590 11.139 8.880 1.00 . A A . 1 ALA H3 1 1 9 4983 1 1 1 ALA HA H -9.934 13.285 8.826 1.00 . A A . 1 ALA HA 1 1 9 4984 1 1 1 ALA HB1 H -8.061 11.359 8.800 1.00 . A A . 1 ALA HB1 1 1 9 4985 1 1 1 ALA HB2 H -7.517 12.331 7.432 1.00 . A A . 1 ALA HB2 1 1 9 4986 1 1 1 ALA HB3 H -7.697 13.070 9.024 1.00 . A A . 1 ALA HB3 1 1 9 4987 1 1 1 ALA N N -10.363 11.450 7.914 1.00 . A A . 1 ALA N 1 1 9 4988 1 1 1 ALA O O -9.893 14.695 6.750 1.00 . A A . 1 ALA O 1 1 9 4989 1 1 2 MET C C -10.194 12.673 3.297 1.00 . A A . 2 MET C 1 1 9 4990 1 1 2 MET CA C -9.393 13.494 4.303 1.00 . A A . 2 MET CA 1 1 9 4991 1 1 2 MET CB C -7.972 13.715 3.783 1.00 . A A . 2 MET CB 1 1 9 4992 1 1 2 MET CE C -5.252 16.244 5.589 1.00 . A A . 2 MET CE 1 1 9 4993 1 1 2 MET CG C -7.348 15.018 4.254 1.00 . A A . 2 MET CG 1 1 9 4994 1 1 2 MET H H -9.143 11.880 5.649 1.00 . A A . 2 MET H 1 1 9 4995 1 1 2 MET HA H -9.874 14.452 4.430 1.00 . A A . 2 MET HA 1 1 9 4996 1 1 2 MET HB2 H -7.348 12.900 4.117 1.00 . A A . 2 MET HB2 1 1 9 4997 1 1 2 MET HB3 H -7.993 13.721 2.703 1.00 . A A . 2 MET HB3 1 1 9 4998 1 1 2 MET HE1 H -6.193 16.638 5.943 1.00 . A A . 2 MET HE1 1 1 9 4999 1 1 2 MET HE2 H -4.677 15.877 6.427 1.00 . A A . 2 MET HE2 1 1 9 5000 1 1 2 MET HE3 H -4.700 17.026 5.089 1.00 . A A . 2 MET HE3 1 1 9 5001 1 1 2 MET HG2 H -7.569 15.790 3.531 1.00 . A A . 2 MET HG2 1 1 9 5002 1 1 2 MET HG3 H -7.780 15.285 5.207 1.00 . A A . 2 MET HG3 1 1 9 5003 1 1 2 MET N N -9.359 12.834 5.603 1.00 . A A . 2 MET N 1 1 9 5004 1 1 2 MET O O -10.656 11.574 3.606 1.00 . A A . 2 MET O 1 1 9 5005 1 1 2 MET SD S -5.558 14.903 4.443 1.00 . A A . 2 MET SD 1 1 9 5006 1 1 3 ASP C C -10.160 11.726 0.146 1.00 . A A . 3 ASP C 1 1 9 5007 1 1 3 ASP CA C -11.097 12.530 1.042 1.00 . A A . 3 ASP CA 1 1 9 5008 1 1 3 ASP CB C -11.880 13.541 0.203 1.00 . A A . 3 ASP CB 1 1 9 5009 1 1 3 ASP CG C -13.006 14.191 0.983 1.00 . A A . 3 ASP CG 1 1 9 5010 1 1 3 ASP H H -9.960 14.091 1.908 1.00 . A A . 3 ASP H 1 1 9 5011 1 1 3 ASP HA H -11.793 11.853 1.515 1.00 . A A . 3 ASP HA 1 1 9 5012 1 1 3 ASP HB2 H -11.208 14.316 -0.136 1.00 . A A . 3 ASP HB2 1 1 9 5013 1 1 3 ASP HB3 H -12.304 13.038 -0.654 1.00 . A A . 3 ASP HB3 1 1 9 5014 1 1 3 ASP N N -10.353 13.213 2.093 1.00 . A A . 3 ASP N 1 1 9 5015 1 1 3 ASP O O -9.297 12.287 -0.529 1.00 . A A . 3 ASP O 1 1 9 5016 1 1 3 ASP OD1 O -14.161 13.736 0.849 1.00 . A A . 3 ASP OD1 1 1 9 5017 1 1 3 ASP OD2 O -12.732 15.155 1.728 1.00 . A A . 3 ASP OD2 1 1 9 5018 1 1 4 CYS C C -8.043 9.617 -0.249 1.00 . A A . 4 CYS C 1 1 9 5019 1 1 4 CYS CA C -9.507 9.526 -0.668 1.00 . A A . 4 CYS CA 1 1 9 5020 1 1 4 CYS CB C -9.650 9.878 -2.150 1.00 . A A . 4 CYS CB 1 1 9 5021 1 1 4 CYS H H -11.041 10.020 0.704 1.00 . A A . 4 CYS H 1 1 9 5022 1 1 4 CYS HA H -9.850 8.514 -0.514 1.00 . A A . 4 CYS HA 1 1 9 5023 1 1 4 CYS HB2 H -9.929 10.917 -2.240 1.00 . A A . 4 CYS HB2 1 1 9 5024 1 1 4 CYS HB3 H -8.702 9.721 -2.644 1.00 . A A . 4 CYS HB3 1 1 9 5025 1 1 4 CYS N N -10.336 10.408 0.145 1.00 . A A . 4 CYS N 1 1 9 5026 1 1 4 CYS O O -7.415 10.668 -0.374 1.00 . A A . 4 CYS O 1 1 9 5027 1 1 4 CYS SG S -10.905 8.892 -3.030 1.00 . A A . 4 CYS SG 1 1 9 5028 1 1 5 THR C C -5.167 8.474 -0.510 1.00 . A A . 5 THR C 1 1 9 5029 1 1 5 THR CA C -6.115 8.460 0.685 1.00 . A A . 5 THR CA 1 1 9 5030 1 1 5 THR CB C -5.868 7.211 1.533 1.00 . A A . 5 THR CB 1 1 9 5031 1 1 5 THR CG2 C -6.073 5.920 0.771 1.00 . A A . 5 THR CG2 1 1 9 5032 1 1 5 THR H H -8.057 7.701 0.322 1.00 . A A . 5 THR H 1 1 9 5033 1 1 5 THR HA H -5.927 9.336 1.288 1.00 . A A . 5 THR HA 1 1 9 5034 1 1 5 THR HB H -6.553 7.215 2.368 1.00 . A A . 5 THR HB 1 1 9 5035 1 1 5 THR HG1 H -3.926 7.071 1.321 1.00 . A A . 5 THR HG1 1 1 9 5036 1 1 5 THR HG21 H -5.592 5.990 -0.193 1.00 . A A . 5 THR HG21 1 1 9 5037 1 1 5 THR HG22 H -5.644 5.100 1.329 1.00 . A A . 5 THR HG22 1 1 9 5038 1 1 5 THR HG23 H -7.131 5.747 0.634 1.00 . A A . 5 THR HG23 1 1 9 5039 1 1 5 THR N N -7.505 8.507 0.247 1.00 . A A . 5 THR N 1 1 9 5040 1 1 5 THR O O -5.570 8.187 -1.638 1.00 . A A . 5 THR O 1 1 9 5041 1 1 5 THR OG1 O -4.546 7.204 2.042 1.00 . A A . 5 THR OG1 1 1 9 5042 1 1 6 THR C C -1.723 7.946 -0.984 1.00 . A A . 6 THR C 1 1 9 5043 1 1 6 THR CA C -2.900 8.860 -1.310 1.00 . A A . 6 THR CA 1 1 9 5044 1 1 6 THR CB C -2.408 10.295 -1.505 1.00 . A A . 6 THR CB 1 1 9 5045 1 1 6 THR CG2 C -3.424 11.189 -2.181 1.00 . A A . 6 THR CG2 1 1 9 5046 1 1 6 THR H H -3.646 9.027 0.664 1.00 . A A . 6 THR H 1 1 9 5047 1 1 6 THR HA H -3.361 8.520 -2.225 1.00 . A A . 6 THR HA 1 1 9 5048 1 1 6 THR HB H -1.520 10.279 -2.121 1.00 . A A . 6 THR HB 1 1 9 5049 1 1 6 THR HG1 H -2.858 10.919 0.296 1.00 . A A . 6 THR HG1 1 1 9 5050 1 1 6 THR HG21 H -4.396 11.028 -1.738 1.00 . A A . 6 THR HG21 1 1 9 5051 1 1 6 THR HG22 H -3.137 12.222 -2.052 1.00 . A A . 6 THR HG22 1 1 9 5052 1 1 6 THR HG23 H -3.465 10.956 -3.234 1.00 . A A . 6 THR HG23 1 1 9 5053 1 1 6 THR N N -3.906 8.809 -0.255 1.00 . A A . 6 THR N 1 1 9 5054 1 1 6 THR O O -1.462 7.645 0.181 1.00 . A A . 6 THR O 1 1 9 5055 1 1 6 THR OG1 O -2.076 10.884 -0.260 1.00 . A A . 6 THR OG1 1 1 9 5056 1 1 7 GLY C C 0.198 5.529 -2.863 1.00 . A A . 7 GLY C 1 1 9 5057 1 1 7 GLY CA C 0.125 6.633 -1.823 1.00 . A A . 7 GLY CA 1 1 9 5058 1 1 7 GLY H H -1.271 7.781 -2.927 1.00 . A A . 7 GLY H 1 1 9 5059 1 1 7 GLY HA2 H 0.058 6.186 -0.843 1.00 . A A . 7 GLY HA2 1 1 9 5060 1 1 7 GLY HA3 H 1.029 7.222 -1.877 1.00 . A A . 7 GLY HA3 1 1 9 5061 1 1 7 GLY N N -1.016 7.508 -2.020 1.00 . A A . 7 GLY N 1 1 9 5062 1 1 7 GLY O O -0.653 5.450 -3.748 1.00 . A A . 7 GLY O 1 1 9 5063 1 1 8 PRO C C 0.498 2.358 -3.432 1.00 . A A . 8 PRO C 1 1 9 5064 1 1 8 PRO CA C 1.396 3.556 -3.733 1.00 . A A . 8 PRO CA 1 1 9 5065 1 1 8 PRO CB C 2.864 3.180 -3.542 1.00 . A A . 8 PRO CB 1 1 9 5066 1 1 8 PRO CD C 2.286 4.683 -1.763 1.00 . A A . 8 PRO CD 1 1 9 5067 1 1 8 PRO CG C 3.147 3.496 -2.114 1.00 . A A . 8 PRO CG 1 1 9 5068 1 1 8 PRO HA H 1.235 3.880 -4.750 1.00 . A A . 8 PRO HA 1 1 9 5069 1 1 8 PRO HB2 H 2.999 2.129 -3.751 1.00 . A A . 8 PRO HB2 1 1 9 5070 1 1 8 PRO HB3 H 3.479 3.768 -4.206 1.00 . A A . 8 PRO HB3 1 1 9 5071 1 1 8 PRO HD2 H 1.873 4.568 -0.772 1.00 . A A . 8 PRO HD2 1 1 9 5072 1 1 8 PRO HD3 H 2.859 5.596 -1.830 1.00 . A A . 8 PRO HD3 1 1 9 5073 1 1 8 PRO HG2 H 2.889 2.651 -1.494 1.00 . A A . 8 PRO HG2 1 1 9 5074 1 1 8 PRO HG3 H 4.192 3.744 -1.994 1.00 . A A . 8 PRO HG3 1 1 9 5075 1 1 8 PRO N N 1.219 4.657 -2.783 1.00 . A A . 8 PRO N 1 1 9 5076 1 1 8 PRO O O 0.325 1.478 -4.275 1.00 . A A . 8 PRO O 1 1 9 5077 1 1 9 CYS C C -2.406 1.542 -2.092 1.00 . A A . 9 CYS C 1 1 9 5078 1 1 9 CYS CA C -0.935 1.220 -1.827 1.00 . A A . 9 CYS CA 1 1 9 5079 1 1 9 CYS CB C -0.725 0.897 -0.346 1.00 . A A . 9 CYS CB 1 1 9 5080 1 1 9 CYS H H 0.113 3.046 -1.592 1.00 . A A . 9 CYS H 1 1 9 5081 1 1 9 CYS HA H -0.660 0.356 -2.413 1.00 . A A . 9 CYS HA 1 1 9 5082 1 1 9 CYS HB2 H 0.330 0.772 -0.160 1.00 . A A . 9 CYS HB2 1 1 9 5083 1 1 9 CYS HB3 H -1.094 1.718 0.248 1.00 . A A . 9 CYS HB3 1 1 9 5084 1 1 9 CYS N N -0.065 2.322 -2.227 1.00 . A A . 9 CYS N 1 1 9 5085 1 1 9 CYS O O -3.299 0.904 -1.534 1.00 . A A . 9 CYS O 1 1 9 5086 1 1 9 CYS SG S -1.567 -0.620 0.215 1.00 . A A . 9 CYS SG 1 1 9 5087 1 1 10 CYS C C -4.143 3.201 -4.786 1.00 . A A . 10 CYS C 1 1 9 5088 1 1 10 CYS CA C -4.020 2.916 -3.293 1.00 . A A . 10 CYS CA 1 1 9 5089 1 1 10 CYS CB C -4.454 4.145 -2.486 1.00 . A A . 10 CYS CB 1 1 9 5090 1 1 10 CYS H H -1.907 2.995 -3.373 1.00 . A A . 10 CYS H 1 1 9 5091 1 1 10 CYS HA H -4.669 2.088 -3.045 1.00 . A A . 10 CYS HA 1 1 9 5092 1 1 10 CYS HB2 H -5.249 4.648 -3.015 1.00 . A A . 10 CYS HB2 1 1 9 5093 1 1 10 CYS HB3 H -4.821 3.821 -1.524 1.00 . A A . 10 CYS HB3 1 1 9 5094 1 1 10 CYS N N -2.655 2.526 -2.952 1.00 . A A . 10 CYS N 1 1 9 5095 1 1 10 CYS O O -3.139 3.332 -5.487 1.00 . A A . 10 CYS O 1 1 9 5096 1 1 10 CYS SG S -3.132 5.364 -2.194 1.00 . A A . 10 CYS SG 1 1 9 5097 1 1 11 ARG C C -5.779 5.056 -6.939 1.00 . A A . 11 ARG C 1 1 9 5098 1 1 11 ARG CA C -5.629 3.559 -6.681 1.00 . A A . 11 ARG CA 1 1 9 5099 1 1 11 ARG CB C -6.886 2.819 -7.143 1.00 . A A . 11 ARG CB 1 1 9 5100 1 1 11 ARG CD C -7.154 3.348 -9.585 1.00 . A A . 11 ARG CD 1 1 9 5101 1 1 11 ARG CG C -6.789 2.284 -8.562 1.00 . A A . 11 ARG CG 1 1 9 5102 1 1 11 ARG CZ C -5.970 4.794 -11.190 1.00 . A A . 11 ARG CZ 1 1 9 5103 1 1 11 ARG H H -6.138 3.177 -4.661 1.00 . A A . 11 ARG H 1 1 9 5104 1 1 11 ARG HA H -4.781 3.194 -7.241 1.00 . A A . 11 ARG HA 1 1 9 5105 1 1 11 ARG HB2 H -7.064 1.987 -6.479 1.00 . A A . 11 ARG HB2 1 1 9 5106 1 1 11 ARG HB3 H -7.726 3.495 -7.093 1.00 . A A . 11 ARG HB3 1 1 9 5107 1 1 11 ARG HD2 H -7.654 2.873 -10.416 1.00 . A A . 11 ARG HD2 1 1 9 5108 1 1 11 ARG HD3 H -7.824 4.058 -9.122 1.00 . A A . 11 ARG HD3 1 1 9 5109 1 1 11 ARG HE H -5.151 3.981 -9.562 1.00 . A A . 11 ARG HE 1 1 9 5110 1 1 11 ARG HG2 H -5.776 1.957 -8.745 1.00 . A A . 11 ARG HG2 1 1 9 5111 1 1 11 ARG HG3 H -7.464 1.448 -8.668 1.00 . A A . 11 ARG HG3 1 1 9 5112 1 1 11 ARG HH11 H -7.914 4.461 -11.638 1.00 . A A . 11 ARG HH11 1 1 9 5113 1 1 11 ARG HH12 H -7.059 5.475 -12.751 1.00 . A A . 11 ARG HH12 1 1 9 5114 1 1 11 ARG HH21 H -4.024 5.314 -11.025 1.00 . A A . 11 ARG HH21 1 1 9 5115 1 1 11 ARG HH22 H -4.850 5.959 -12.404 1.00 . A A . 11 ARG HH22 1 1 9 5116 1 1 11 ARG N N -5.378 3.293 -5.268 1.00 . A A . 11 ARG N 1 1 9 5117 1 1 11 ARG NE N -5.978 4.057 -10.082 1.00 . A A . 11 ARG NE 1 1 9 5118 1 1 11 ARG NH1 N -7.072 4.920 -11.920 1.00 . A A . 11 ARG NH1 1 1 9 5119 1 1 11 ARG NH2 N -4.857 5.406 -11.571 1.00 . A A . 11 ARG NH2 1 1 9 5120 1 1 11 ARG O O -6.700 5.486 -7.634 1.00 . A A . 11 ARG O 1 1 9 5121 1 1 12 GLN C C -6.080 7.928 -5.819 1.00 . A A . 12 GLN C 1 1 9 5122 1 1 12 GLN CA C -4.893 7.297 -6.546 1.00 . A A . 12 GLN CA 1 1 9 5123 1 1 12 GLN CB C -4.951 7.657 -8.031 1.00 . A A . 12 GLN CB 1 1 9 5124 1 1 12 GLN CD C -2.515 7.095 -8.389 1.00 . A A . 12 GLN CD 1 1 9 5125 1 1 12 GLN CG C -3.937 6.908 -8.880 1.00 . A A . 12 GLN CG 1 1 9 5126 1 1 12 GLN H H -4.156 5.442 -5.836 1.00 . A A . 12 GLN H 1 1 9 5127 1 1 12 GLN HA H -3.980 7.694 -6.128 1.00 . A A . 12 GLN HA 1 1 9 5128 1 1 12 GLN HB2 H -5.939 7.429 -8.403 1.00 . A A . 12 GLN HB2 1 1 9 5129 1 1 12 GLN HB3 H -4.770 8.715 -8.140 1.00 . A A . 12 GLN HB3 1 1 9 5130 1 1 12 GLN HE21 H -2.710 9.071 -8.499 1.00 . A A . 12 GLN HE21 1 1 9 5131 1 1 12 GLN HE22 H -1.174 8.498 -7.952 1.00 . A A . 12 GLN HE22 1 1 9 5132 1 1 12 GLN HG2 H -4.173 5.855 -8.856 1.00 . A A . 12 GLN HG2 1 1 9 5133 1 1 12 GLN HG3 H -4.001 7.269 -9.896 1.00 . A A . 12 GLN HG3 1 1 9 5134 1 1 12 GLN N N -4.867 5.845 -6.377 1.00 . A A . 12 GLN N 1 1 9 5135 1 1 12 GLN NE2 N -2.090 8.348 -8.268 1.00 . A A . 12 GLN NE2 1 1 9 5136 1 1 12 GLN O O -6.345 9.120 -5.970 1.00 . A A . 12 GLN O 1 1 9 5137 1 1 12 GLN OE1 O -1.806 6.125 -8.120 1.00 . A A . 12 GLN OE1 1 1 9 5138 1 1 13 CYS C C -8.149 6.823 -3.005 1.00 . A A . 13 CYS C 1 1 9 5139 1 1 13 CYS CA C -7.947 7.620 -4.290 1.00 . A A . 13 CYS CA 1 1 9 5140 1 1 13 CYS CB C -9.207 7.547 -5.155 1.00 . A A . 13 CYS CB 1 1 9 5141 1 1 13 CYS H H -6.539 6.188 -4.948 1.00 . A A . 13 CYS H 1 1 9 5142 1 1 13 CYS HA H -7.758 8.652 -4.033 1.00 . A A . 13 CYS HA 1 1 9 5143 1 1 13 CYS HB2 H -8.918 7.487 -6.194 1.00 . A A . 13 CYS HB2 1 1 9 5144 1 1 13 CYS HB3 H -9.765 6.661 -4.890 1.00 . A A . 13 CYS HB3 1 1 9 5145 1 1 13 CYS N N -6.793 7.128 -5.032 1.00 . A A . 13 CYS N 1 1 9 5146 1 1 13 CYS O O -8.359 7.396 -1.936 1.00 . A A . 13 CYS O 1 1 9 5147 1 1 13 CYS SG S -10.318 8.979 -4.972 1.00 . A A . 13 CYS SG 1 1 9 5148 1 1 14 LYS C C -7.335 3.423 -2.049 1.00 . A A . 14 LYS C 1 1 9 5149 1 1 14 LYS CA C -8.260 4.631 -1.960 1.00 . A A . 14 LYS CA 1 1 9 5150 1 1 14 LYS CB C -9.715 4.169 -1.859 1.00 . A A . 14 LYS CB 1 1 9 5151 1 1 14 LYS CD C -10.701 5.115 0.249 1.00 . A A . 14 LYS CD 1 1 9 5152 1 1 14 LYS CE C -11.893 4.293 0.710 1.00 . A A . 14 LYS CE 1 1 9 5153 1 1 14 LYS CG C -10.645 5.214 -1.267 1.00 . A A . 14 LYS CG 1 1 9 5154 1 1 14 LYS H H -7.913 5.099 -3.994 1.00 . A A . 14 LYS H 1 1 9 5155 1 1 14 LYS HA H -8.009 5.198 -1.077 1.00 . A A . 14 LYS HA 1 1 9 5156 1 1 14 LYS HB2 H -10.071 3.920 -2.848 1.00 . A A . 14 LYS HB2 1 1 9 5157 1 1 14 LYS HB3 H -9.758 3.286 -1.238 1.00 . A A . 14 LYS HB3 1 1 9 5158 1 1 14 LYS HD2 H -9.795 4.646 0.603 1.00 . A A . 14 LYS HD2 1 1 9 5159 1 1 14 LYS HD3 H -10.779 6.110 0.663 1.00 . A A . 14 LYS HD3 1 1 9 5160 1 1 14 LYS HE2 H -11.784 4.083 1.764 1.00 . A A . 14 LYS HE2 1 1 9 5161 1 1 14 LYS HE3 H -12.794 4.867 0.550 1.00 . A A . 14 LYS HE3 1 1 9 5162 1 1 14 LYS HG2 H -10.289 6.196 -1.540 1.00 . A A . 14 LYS HG2 1 1 9 5163 1 1 14 LYS HG3 H -11.638 5.065 -1.665 1.00 . A A . 14 LYS HG3 1 1 9 5164 1 1 14 LYS HZ1 H -12.108 3.188 -1.049 1.00 . A A . 14 LYS HZ1 1 1 9 5165 1 1 14 LYS HZ2 H -11.145 2.434 0.120 1.00 . A A . 14 LYS HZ2 1 1 9 5166 1 1 14 LYS HZ3 H -12.826 2.468 0.303 1.00 . A A . 14 LYS HZ3 1 1 9 5167 1 1 14 LYS N N -8.084 5.500 -3.116 1.00 . A A . 14 LYS N 1 1 9 5168 1 1 14 LYS NZ N -12.001 3.006 -0.031 1.00 . A A . 14 LYS NZ 1 1 9 5169 1 1 14 LYS O O -6.881 3.057 -3.133 1.00 . A A . 14 LYS O 1 1 9 5170 1 1 15 LEU C C -6.511 0.651 -1.959 1.00 . A A . 15 LEU C 1 1 9 5171 1 1 15 LEU CA C -6.184 1.640 -0.843 1.00 . A A . 15 LEU CA 1 1 9 5172 1 1 15 LEU CB C -6.288 0.945 0.523 1.00 . A A . 15 LEU CB 1 1 9 5173 1 1 15 LEU CD1 C -8.101 2.039 1.883 1.00 . A A . 15 LEU CD1 1 1 9 5174 1 1 15 LEU CD2 C -8.720 0.497 0.012 1.00 . A A . 15 LEU CD2 1 1 9 5175 1 1 15 LEU CG C -7.703 0.794 1.105 1.00 . A A . 15 LEU CG 1 1 9 5176 1 1 15 LEU H H -7.450 3.154 -0.073 1.00 . A A . 15 LEU H 1 1 9 5177 1 1 15 LEU HA H -5.170 1.985 -0.979 1.00 . A A . 15 LEU HA 1 1 9 5178 1 1 15 LEU HB2 H -5.860 -0.042 0.429 1.00 . A A . 15 LEU HB2 1 1 9 5179 1 1 15 LEU HB3 H -5.694 1.506 1.229 1.00 . A A . 15 LEU HB3 1 1 9 5180 1 1 15 LEU HD11 H -7.222 2.634 2.085 1.00 . A A . 15 LEU HD11 1 1 9 5181 1 1 15 LEU HD12 H -8.801 2.619 1.301 1.00 . A A . 15 LEU HD12 1 1 9 5182 1 1 15 LEU HD13 H -8.561 1.749 2.816 1.00 . A A . 15 LEU HD13 1 1 9 5183 1 1 15 LEU HD21 H -8.371 -0.330 -0.589 1.00 . A A . 15 LEU HD21 1 1 9 5184 1 1 15 LEU HD22 H -9.667 0.240 0.462 1.00 . A A . 15 LEU HD22 1 1 9 5185 1 1 15 LEU HD23 H -8.843 1.369 -0.613 1.00 . A A . 15 LEU HD23 1 1 9 5186 1 1 15 LEU HG H -7.706 -0.037 1.795 1.00 . A A . 15 LEU HG 1 1 9 5187 1 1 15 LEU N N -7.059 2.810 -0.901 1.00 . A A . 15 LEU N 1 1 9 5188 1 1 15 LEU O O -7.633 0.617 -2.465 1.00 . A A . 15 LEU O 1 1 9 5189 1 1 16 LYS C C -6.193 -2.460 -2.822 1.00 . A A . 16 LYS C 1 1 9 5190 1 1 16 LYS CA C -5.710 -1.132 -3.400 1.00 . A A . 16 LYS CA 1 1 9 5191 1 1 16 LYS CB C -4.403 -1.338 -4.171 1.00 . A A . 16 LYS CB 1 1 9 5192 1 1 16 LYS CD C -3.000 -0.163 -5.893 1.00 . A A . 16 LYS CD 1 1 9 5193 1 1 16 LYS CE C -2.862 0.073 -7.388 1.00 . A A . 16 LYS CE 1 1 9 5194 1 1 16 LYS CG C -4.389 -0.665 -5.534 1.00 . A A . 16 LYS CG 1 1 9 5195 1 1 16 LYS H H -4.649 -0.073 -1.907 1.00 . A A . 16 LYS H 1 1 9 5196 1 1 16 LYS HA H -6.462 -0.750 -4.077 1.00 . A A . 16 LYS HA 1 1 9 5197 1 1 16 LYS HB2 H -3.588 -0.936 -3.587 1.00 . A A . 16 LYS HB2 1 1 9 5198 1 1 16 LYS HB3 H -4.244 -2.396 -4.314 1.00 . A A . 16 LYS HB3 1 1 9 5199 1 1 16 LYS HD2 H -2.818 0.766 -5.373 1.00 . A A . 16 LYS HD2 1 1 9 5200 1 1 16 LYS HD3 H -2.271 -0.899 -5.585 1.00 . A A . 16 LYS HD3 1 1 9 5201 1 1 16 LYS HE2 H -3.636 0.756 -7.704 1.00 . A A . 16 LYS HE2 1 1 9 5202 1 1 16 LYS HE3 H -1.895 0.512 -7.582 1.00 . A A . 16 LYS HE3 1 1 9 5203 1 1 16 LYS HG2 H -4.707 -1.378 -6.280 1.00 . A A . 16 LYS HG2 1 1 9 5204 1 1 16 LYS HG3 H -5.072 0.172 -5.518 1.00 . A A . 16 LYS HG3 1 1 9 5205 1 1 16 LYS HZ1 H -2.733 -2.004 -7.566 1.00 . A A . 16 LYS HZ1 1 1 9 5206 1 1 16 LYS HZ2 H -3.963 -1.312 -8.499 1.00 . A A . 16 LYS HZ2 1 1 9 5207 1 1 16 LYS HZ3 H -2.349 -1.170 -8.986 1.00 . A A . 16 LYS HZ3 1 1 9 5208 1 1 16 LYS N N -5.524 -0.148 -2.343 1.00 . A A . 16 LYS N 1 1 9 5209 1 1 16 LYS NZ N -2.985 -1.191 -8.164 1.00 . A A . 16 LYS NZ 1 1 9 5210 1 1 16 LYS O O -6.236 -2.636 -1.604 1.00 . A A . 16 LYS O 1 1 9 5211 1 1 17 PRO C C -6.099 -5.391 -2.253 1.00 . A A . 17 PRO C 1 1 9 5212 1 1 17 PRO CA C -7.044 -4.733 -3.254 1.00 . A A . 17 PRO CA 1 1 9 5213 1 1 17 PRO CB C -7.095 -5.540 -4.553 1.00 . A A . 17 PRO CB 1 1 9 5214 1 1 17 PRO CD C -6.544 -3.294 -5.160 1.00 . A A . 17 PRO CD 1 1 9 5215 1 1 17 PRO CG C -7.279 -4.521 -5.623 1.00 . A A . 17 PRO CG 1 1 9 5216 1 1 17 PRO HA H -8.033 -4.671 -2.826 1.00 . A A . 17 PRO HA 1 1 9 5217 1 1 17 PRO HB2 H -6.169 -6.083 -4.678 1.00 . A A . 17 PRO HB2 1 1 9 5218 1 1 17 PRO HB3 H -7.923 -6.231 -4.519 1.00 . A A . 17 PRO HB3 1 1 9 5219 1 1 17 PRO HD2 H -5.531 -3.298 -5.533 1.00 . A A . 17 PRO HD2 1 1 9 5220 1 1 17 PRO HD3 H -7.062 -2.401 -5.478 1.00 . A A . 17 PRO HD3 1 1 9 5221 1 1 17 PRO HG2 H -6.859 -4.882 -6.550 1.00 . A A . 17 PRO HG2 1 1 9 5222 1 1 17 PRO HG3 H -8.330 -4.304 -5.746 1.00 . A A . 17 PRO HG3 1 1 9 5223 1 1 17 PRO N N -6.564 -3.417 -3.690 1.00 . A A . 17 PRO N 1 1 9 5224 1 1 17 PRO O O -4.888 -5.440 -2.469 1.00 . A A . 17 PRO O 1 1 9 5225 1 1 18 ALA C C -5.000 -7.657 -0.710 1.00 . A A . 18 ALA C 1 1 9 5226 1 1 18 ALA CA C -5.868 -6.550 -0.122 1.00 . A A . 18 ALA CA 1 1 9 5227 1 1 18 ALA CB C -6.778 -7.110 0.961 1.00 . A A . 18 ALA CB 1 1 9 5228 1 1 18 ALA H H -7.631 -5.823 -1.043 1.00 . A A . 18 ALA H 1 1 9 5229 1 1 18 ALA HA H -5.228 -5.805 0.329 1.00 . A A . 18 ALA HA 1 1 9 5230 1 1 18 ALA HB1 H -7.707 -6.560 0.971 1.00 . A A . 18 ALA HB1 1 1 9 5231 1 1 18 ALA HB2 H -6.978 -8.152 0.760 1.00 . A A . 18 ALA HB2 1 1 9 5232 1 1 18 ALA HB3 H -6.294 -7.015 1.922 1.00 . A A . 18 ALA HB3 1 1 9 5233 1 1 18 ALA N N -6.660 -5.894 -1.158 1.00 . A A . 18 ALA N 1 1 9 5234 1 1 18 ALA O O -5.502 -8.706 -1.113 1.00 . A A . 18 ALA O 1 1 9 5235 1 1 19 GLY C C -1.731 -7.785 -2.216 1.00 . A A . 19 GLY C 1 1 9 5236 1 1 19 GLY CA C -2.776 -8.399 -1.303 1.00 . A A . 19 GLY CA 1 1 9 5237 1 1 19 GLY H H -3.351 -6.560 -0.426 1.00 . A A . 19 GLY H 1 1 9 5238 1 1 19 GLY HA2 H -3.341 -9.130 -1.862 1.00 . A A . 19 GLY HA2 1 1 9 5239 1 1 19 GLY HA3 H -2.275 -8.896 -0.485 1.00 . A A . 19 GLY HA3 1 1 9 5240 1 1 19 GLY N N -3.694 -7.415 -0.760 1.00 . A A . 19 GLY N 1 1 9 5241 1 1 19 GLY O O -0.765 -8.447 -2.595 1.00 . A A . 19 GLY O 1 1 9 5242 1 1 20 THR C C 0.409 -5.781 -2.827 1.00 . A A . 20 THR C 1 1 9 5243 1 1 20 THR CA C -0.984 -5.819 -3.444 1.00 . A A . 20 THR CA 1 1 9 5244 1 1 20 THR CB C -1.472 -4.395 -3.717 1.00 . A A . 20 THR CB 1 1 9 5245 1 1 20 THR CG2 C -1.202 -3.930 -5.132 1.00 . A A . 20 THR CG2 1 1 9 5246 1 1 20 THR H H -2.707 -6.038 -2.238 1.00 . A A . 20 THR H 1 1 9 5247 1 1 20 THR HA H -0.934 -6.357 -4.378 1.00 . A A . 20 THR HA 1 1 9 5248 1 1 20 THR HB H -0.967 -3.716 -3.044 1.00 . A A . 20 THR HB 1 1 9 5249 1 1 20 THR HG1 H -3.330 -4.924 -4.041 1.00 . A A . 20 THR HG1 1 1 9 5250 1 1 20 THR HG21 H -1.183 -4.784 -5.793 1.00 . A A . 20 THR HG21 1 1 9 5251 1 1 20 THR HG22 H -1.982 -3.251 -5.443 1.00 . A A . 20 THR HG22 1 1 9 5252 1 1 20 THR HG23 H -0.249 -3.425 -5.169 1.00 . A A . 20 THR HG23 1 1 9 5253 1 1 20 THR N N -1.920 -6.516 -2.571 1.00 . A A . 20 THR N 1 1 9 5254 1 1 20 THR O O 0.608 -6.214 -1.692 1.00 . A A . 20 THR O 1 1 9 5255 1 1 20 THR OG1 O -2.866 -4.290 -3.489 1.00 . A A . 20 THR OG1 1 1 9 5256 1 1 21 THR C C 3.142 -3.716 -2.872 1.00 . A A . 21 THR C 1 1 9 5257 1 1 21 THR CA C 2.745 -5.169 -3.110 1.00 . A A . 21 THR CA 1 1 9 5258 1 1 21 THR CB C 3.700 -5.816 -4.117 1.00 . A A . 21 THR CB 1 1 9 5259 1 1 21 THR CG2 C 4.298 -7.114 -3.621 1.00 . A A . 21 THR CG2 1 1 9 5260 1 1 21 THR H H 1.146 -4.937 -4.479 1.00 . A A . 21 THR H 1 1 9 5261 1 1 21 THR HA H 2.809 -5.703 -2.174 1.00 . A A . 21 THR HA 1 1 9 5262 1 1 21 THR HB H 4.514 -5.134 -4.319 1.00 . A A . 21 THR HB 1 1 9 5263 1 1 21 THR HG1 H 2.378 -6.774 -5.200 1.00 . A A . 21 THR HG1 1 1 9 5264 1 1 21 THR HG21 H 3.513 -7.748 -3.236 1.00 . A A . 21 THR HG21 1 1 9 5265 1 1 21 THR HG22 H 4.798 -7.615 -4.436 1.00 . A A . 21 THR HG22 1 1 9 5266 1 1 21 THR HG23 H 5.009 -6.905 -2.835 1.00 . A A . 21 THR HG23 1 1 9 5267 1 1 21 THR N N 1.369 -5.263 -3.582 1.00 . A A . 21 THR N 1 1 9 5268 1 1 21 THR O O 2.585 -2.802 -3.480 1.00 . A A . 21 THR O 1 1 9 5269 1 1 21 THR OG1 O 3.036 -6.089 -5.339 1.00 . A A . 21 THR OG1 1 1 9 5270 1 1 22 CYS C C 6.092 -2.067 -1.846 1.00 . A A . 22 CYS C 1 1 9 5271 1 1 22 CYS CA C 4.581 -2.169 -1.664 1.00 . A A . 22 CYS CA 1 1 9 5272 1 1 22 CYS CB C 4.202 -1.801 -0.228 1.00 . A A . 22 CYS CB 1 1 9 5273 1 1 22 CYS H H 4.513 -4.280 -1.531 1.00 . A A . 22 CYS H 1 1 9 5274 1 1 22 CYS HA H 4.101 -1.479 -2.341 1.00 . A A . 22 CYS HA 1 1 9 5275 1 1 22 CYS HB2 H 3.139 -1.932 -0.099 1.00 . A A . 22 CYS HB2 1 1 9 5276 1 1 22 CYS HB3 H 4.726 -2.456 0.453 1.00 . A A . 22 CYS HB3 1 1 9 5277 1 1 22 CYS N N 4.108 -3.511 -1.983 1.00 . A A . 22 CYS N 1 1 9 5278 1 1 22 CYS O O 6.858 -2.310 -0.913 1.00 . A A . 22 CYS O 1 1 9 5279 1 1 22 CYS SG S 4.606 -0.084 0.232 1.00 . A A . 22 CYS SG 1 1 9 5280 1 1 23 TRP C C 8.653 -2.906 -3.206 1.00 . A A . 23 TRP C 1 1 9 5281 1 1 23 TRP CA C 7.933 -1.570 -3.360 1.00 . A A . 23 TRP CA 1 1 9 5282 1 1 23 TRP CB C 8.577 -0.523 -2.449 1.00 . A A . 23 TRP CB 1 1 9 5283 1 1 23 TRP CD1 C 9.928 0.432 -4.405 1.00 . A A . 23 TRP CD1 1 1 9 5284 1 1 23 TRP CD2 C 10.895 0.699 -2.404 1.00 . A A . 23 TRP CD2 1 1 9 5285 1 1 23 TRP CE2 C 11.732 1.262 -3.385 1.00 . A A . 23 TRP CE2 1 1 9 5286 1 1 23 TRP CE3 C 11.296 0.749 -1.066 1.00 . A A . 23 TRP CE3 1 1 9 5287 1 1 23 TRP CG C 9.745 0.173 -3.077 1.00 . A A . 23 TRP CG 1 1 9 5288 1 1 23 TRP CH2 C 13.314 1.902 -1.752 1.00 . A A . 23 TRP CH2 1 1 9 5289 1 1 23 TRP CZ2 C 12.946 1.867 -3.070 1.00 . A A . 23 TRP CZ2 1 1 9 5290 1 1 23 TRP CZ3 C 12.502 1.349 -0.754 1.00 . A A . 23 TRP CZ3 1 1 9 5291 1 1 23 TRP H H 5.854 -1.525 -3.756 1.00 . A A . 23 TRP H 1 1 9 5292 1 1 23 TRP HA H 8.021 -1.245 -4.386 1.00 . A A . 23 TRP HA 1 1 9 5293 1 1 23 TRP HB2 H 7.841 0.225 -2.195 1.00 . A A . 23 TRP HB2 1 1 9 5294 1 1 23 TRP HB3 H 8.921 -1.005 -1.545 1.00 . A A . 23 TRP HB3 1 1 9 5295 1 1 23 TRP HD1 H 9.229 0.156 -5.181 1.00 . A A . 23 TRP HD1 1 1 9 5296 1 1 23 TRP HE1 H 11.475 1.380 -5.464 1.00 . A A . 23 TRP HE1 1 1 9 5297 1 1 23 TRP HE3 H 10.683 0.328 -0.282 1.00 . A A . 23 TRP HE3 1 1 9 5298 1 1 23 TRP HH2 H 14.248 2.361 -1.463 1.00 . A A . 23 TRP HH2 1 1 9 5299 1 1 23 TRP HZ2 H 13.584 2.298 -3.827 1.00 . A A . 23 TRP HZ2 1 1 9 5300 1 1 23 TRP HZ3 H 12.829 1.397 0.274 1.00 . A A . 23 TRP HZ3 1 1 9 5301 1 1 23 TRP N N 6.514 -1.705 -3.054 1.00 . A A . 23 TRP N 1 1 9 5302 1 1 23 TRP NE1 N 11.120 1.087 -4.598 1.00 . A A . 23 TRP NE1 1 1 9 5303 1 1 23 TRP O O 8.704 -3.473 -2.114 1.00 . A A . 23 TRP O 1 1 9 5304 1 1 24 ARG C C 11.110 -4.639 -5.253 1.00 . A A . 24 ARG C 1 1 9 5305 1 1 24 ARG CA C 9.924 -4.674 -4.293 1.00 . A A . 24 ARG CA 1 1 9 5306 1 1 24 ARG CB C 8.983 -5.820 -4.670 1.00 . A A . 24 ARG CB 1 1 9 5307 1 1 24 ARG CD C 7.381 -7.597 -3.901 1.00 . A A . 24 ARG CD 1 1 9 5308 1 1 24 ARG CG C 8.290 -6.455 -3.475 1.00 . A A . 24 ARG CG 1 1 9 5309 1 1 24 ARG CZ C 7.590 -9.964 -4.553 1.00 . A A . 24 ARG CZ 1 1 9 5310 1 1 24 ARG H H 9.132 -2.906 -5.147 1.00 . A A . 24 ARG H 1 1 9 5311 1 1 24 ARG HA H 10.292 -4.837 -3.291 1.00 . A A . 24 ARG HA 1 1 9 5312 1 1 24 ARG HB2 H 8.224 -5.441 -5.339 1.00 . A A . 24 ARG HB2 1 1 9 5313 1 1 24 ARG HB3 H 9.550 -6.585 -5.179 1.00 . A A . 24 ARG HB3 1 1 9 5314 1 1 24 ARG HD2 H 6.747 -7.864 -3.069 1.00 . A A . 24 ARG HD2 1 1 9 5315 1 1 24 ARG HD3 H 6.769 -7.264 -4.726 1.00 . A A . 24 ARG HD3 1 1 9 5316 1 1 24 ARG HE H 9.108 -8.674 -4.425 1.00 . A A . 24 ARG HE 1 1 9 5317 1 1 24 ARG HG2 H 9.040 -6.839 -2.799 1.00 . A A . 24 ARG HG2 1 1 9 5318 1 1 24 ARG HG3 H 7.699 -5.704 -2.972 1.00 . A A . 24 ARG HG3 1 1 9 5319 1 1 24 ARG HH11 H 5.701 -9.374 -4.135 1.00 . A A . 24 ARG HH11 1 1 9 5320 1 1 24 ARG HH12 H 5.875 -11.034 -4.596 1.00 . A A . 24 ARG HH12 1 1 9 5321 1 1 24 ARG HH21 H 9.339 -10.857 -5.032 1.00 . A A . 24 ARG HH21 1 1 9 5322 1 1 24 ARG HH22 H 7.940 -11.876 -5.105 1.00 . A A . 24 ARG HH22 1 1 9 5323 1 1 24 ARG N N 9.207 -3.404 -4.306 1.00 . A A . 24 ARG N 1 1 9 5324 1 1 24 ARG NE N 8.139 -8.774 -4.317 1.00 . A A . 24 ARG NE 1 1 9 5325 1 1 24 ARG NH1 N 6.281 -10.138 -4.417 1.00 . A A . 24 ARG NH1 1 1 9 5326 1 1 24 ARG NH2 N 8.352 -10.982 -4.928 1.00 . A A . 24 ARG NH2 1 1 9 5327 1 1 24 ARG O O 10.968 -4.927 -6.441 1.00 . A A . 24 ARG O 1 1 9 5328 1 1 25 THR C C 14.279 -5.512 -5.456 1.00 . A A . 25 THR C 1 1 9 5329 1 1 25 THR CA C 13.488 -4.211 -5.539 1.00 . A A . 25 THR CA 1 1 9 5330 1 1 25 THR CB C 14.362 -3.040 -5.086 1.00 . A A . 25 THR CB 1 1 9 5331 1 1 25 THR CG2 C 14.805 -3.147 -3.643 1.00 . A A . 25 THR CG2 1 1 9 5332 1 1 25 THR H H 12.328 -4.065 -3.775 1.00 . A A . 25 THR H 1 1 9 5333 1 1 25 THR HA H 13.191 -4.050 -6.564 1.00 . A A . 25 THR HA 1 1 9 5334 1 1 25 THR HB H 13.800 -2.123 -5.192 1.00 . A A . 25 THR HB 1 1 9 5335 1 1 25 THR HG1 H 15.391 -2.283 -6.571 1.00 . A A . 25 THR HG1 1 1 9 5336 1 1 25 THR HG21 H 15.329 -4.079 -3.496 1.00 . A A . 25 THR HG21 1 1 9 5337 1 1 25 THR HG22 H 15.462 -2.323 -3.406 1.00 . A A . 25 THR HG22 1 1 9 5338 1 1 25 THR HG23 H 13.939 -3.115 -2.998 1.00 . A A . 25 THR HG23 1 1 9 5339 1 1 25 THR N N 12.278 -4.283 -4.729 1.00 . A A . 25 THR N 1 1 9 5340 1 1 25 THR O O 14.875 -5.952 -6.438 1.00 . A A . 25 THR O 1 1 9 5341 1 1 25 THR OG1 O 15.526 -2.943 -5.887 1.00 . A A . 25 THR OG1 1 1 9 5342 1 1 26 SER C C 14.802 -7.873 -2.633 1.00 . A A . 26 SER C 1 1 9 5343 1 1 26 SER CA C 14.993 -7.375 -4.061 1.00 . A A . 26 SER CA 1 1 9 5344 1 1 26 SER CB C 16.484 -7.193 -4.353 1.00 . A A . 26 SER CB 1 1 9 5345 1 1 26 SER H H 13.782 -5.721 -3.532 1.00 . A A . 26 SER H 1 1 9 5346 1 1 26 SER HA H 14.589 -8.107 -4.741 1.00 . A A . 26 SER HA 1 1 9 5347 1 1 26 SER HB2 H 16.780 -6.188 -4.094 1.00 . A A . 26 SER HB2 1 1 9 5348 1 1 26 SER HB3 H 17.053 -7.899 -3.766 1.00 . A A . 26 SER HB3 1 1 9 5349 1 1 26 SER HG H 16.562 -8.321 -5.954 1.00 . A A . 26 SER HG 1 1 9 5350 1 1 26 SER N N 14.277 -6.122 -4.276 1.00 . A A . 26 SER N 1 1 9 5351 1 1 26 SER O O 14.649 -9.072 -2.397 1.00 . A A . 26 SER O 1 1 9 5352 1 1 26 SER OG O 16.765 -7.411 -5.725 1.00 . A A . 26 SER OG 1 1 9 5353 1 1 27 VAL C C 13.328 -6.730 0.268 1.00 . A A . 27 VAL C 1 1 9 5354 1 1 27 VAL CA C 14.640 -7.286 -0.277 1.00 . A A . 27 VAL CA 1 1 9 5355 1 1 27 VAL CB C 15.810 -6.755 0.576 1.00 . A A . 27 VAL CB 1 1 9 5356 1 1 27 VAL CG1 C 15.874 -5.236 0.516 1.00 . A A . 27 VAL CG1 1 1 9 5357 1 1 27 VAL CG2 C 15.686 -7.235 2.015 1.00 . A A . 27 VAL CG2 1 1 9 5358 1 1 27 VAL H H 14.939 -6.007 -1.937 1.00 . A A . 27 VAL H 1 1 9 5359 1 1 27 VAL HA H 14.623 -8.363 -0.195 1.00 . A A . 27 VAL HA 1 1 9 5360 1 1 27 VAL HB H 16.731 -7.146 0.168 1.00 . A A . 27 VAL HB 1 1 9 5361 1 1 27 VAL HG11 H 15.863 -4.916 -0.516 1.00 . A A . 27 VAL HG11 1 1 9 5362 1 1 27 VAL HG12 H 15.022 -4.819 1.031 1.00 . A A . 27 VAL HG12 1 1 9 5363 1 1 27 VAL HG13 H 16.783 -4.895 0.988 1.00 . A A . 27 VAL HG13 1 1 9 5364 1 1 27 VAL HG21 H 14.659 -7.501 2.220 1.00 . A A . 27 VAL HG21 1 1 9 5365 1 1 27 VAL HG22 H 16.317 -8.099 2.162 1.00 . A A . 27 VAL HG22 1 1 9 5366 1 1 27 VAL HG23 H 15.994 -6.447 2.686 1.00 . A A . 27 VAL HG23 1 1 9 5367 1 1 27 VAL N N 14.812 -6.945 -1.684 1.00 . A A . 27 VAL N 1 1 9 5368 1 1 27 VAL O O 12.685 -7.347 1.117 1.00 . A A . 27 VAL O 1 1 9 5369 1 1 28 SER C C 10.487 -5.757 -0.183 1.00 . A A . 28 SER C 1 1 9 5370 1 1 28 SER CA C 11.701 -4.921 0.209 1.00 . A A . 28 SER CA 1 1 9 5371 1 1 28 SER CB C 11.586 -3.521 -0.396 1.00 . A A . 28 SER CB 1 1 9 5372 1 1 28 SER H H 13.491 -5.118 -0.902 1.00 . A A . 28 SER H 1 1 9 5373 1 1 28 SER HA H 11.733 -4.837 1.285 1.00 . A A . 28 SER HA 1 1 9 5374 1 1 28 SER HB2 H 10.991 -3.567 -1.295 1.00 . A A . 28 SER HB2 1 1 9 5375 1 1 28 SER HB3 H 11.111 -2.861 0.316 1.00 . A A . 28 SER HB3 1 1 9 5376 1 1 28 SER HG H 13.185 -2.463 0.009 1.00 . A A . 28 SER HG 1 1 9 5377 1 1 28 SER N N 12.936 -5.561 -0.227 1.00 . A A . 28 SER N 1 1 9 5378 1 1 28 SER O O 9.836 -5.490 -1.193 1.00 . A A . 28 SER O 1 1 9 5379 1 1 28 SER OG O 12.863 -2.999 -0.720 1.00 . A A . 28 SER OG 1 1 9 5380 1 1 29 SER C C 7.854 -7.256 1.220 1.00 . A A . 29 SER C 1 1 9 5381 1 1 29 SER CA C 9.052 -7.647 0.361 1.00 . A A . 29 SER CA 1 1 9 5382 1 1 29 SER CB C 9.432 -9.104 0.628 1.00 . A A . 29 SER CB 1 1 9 5383 1 1 29 SER H H 10.744 -6.934 1.414 1.00 . A A . 29 SER H 1 1 9 5384 1 1 29 SER HA H 8.784 -7.539 -0.679 1.00 . A A . 29 SER HA 1 1 9 5385 1 1 29 SER HB2 H 8.535 -9.699 0.710 1.00 . A A . 29 SER HB2 1 1 9 5386 1 1 29 SER HB3 H 10.034 -9.472 -0.190 1.00 . A A . 29 SER HB3 1 1 9 5387 1 1 29 SER HG H 10.725 -10.010 1.788 1.00 . A A . 29 SER HG 1 1 9 5388 1 1 29 SER N N 10.188 -6.771 0.623 1.00 . A A . 29 SER N 1 1 9 5389 1 1 29 SER O O 7.586 -7.877 2.249 1.00 . A A . 29 SER O 1 1 9 5390 1 1 29 SER OG O 10.172 -9.226 1.830 1.00 . A A . 29 SER OG 1 1 9 5391 1 1 30 HIS C C 4.679 -6.171 0.820 1.00 . A A . 30 HIS C 1 1 9 5392 1 1 30 HIS CA C 5.966 -5.750 1.522 1.00 . A A . 30 HIS CA 1 1 9 5393 1 1 30 HIS CB C 6.008 -4.228 1.663 1.00 . A A . 30 HIS CB 1 1 9 5394 1 1 30 HIS CD2 C 8.362 -4.107 2.747 1.00 . A A . 30 HIS CD2 1 1 9 5395 1 1 30 HIS CE1 C 7.950 -2.551 4.236 1.00 . A A . 30 HIS CE1 1 1 9 5396 1 1 30 HIS CG C 7.065 -3.744 2.607 1.00 . A A . 30 HIS CG 1 1 9 5397 1 1 30 HIS H H 7.399 -5.769 -0.036 1.00 . A A . 30 HIS H 1 1 9 5398 1 1 30 HIS HA H 5.987 -6.195 2.505 1.00 . A A . 30 HIS HA 1 1 9 5399 1 1 30 HIS HB2 H 6.201 -3.788 0.696 1.00 . A A . 30 HIS HB2 1 1 9 5400 1 1 30 HIS HB3 H 5.052 -3.880 2.027 1.00 . A A . 30 HIS HB3 1 1 9 5401 1 1 30 HIS HD1 H 5.989 -2.302 3.705 1.00 . A A . 30 HIS HD1 1 1 9 5402 1 1 30 HIS HD2 H 8.885 -4.853 2.166 1.00 . A A . 30 HIS HD2 1 1 9 5403 1 1 30 HIS HE1 H 8.070 -1.841 5.041 1.00 . A A . 30 HIS HE1 1 1 9 5404 1 1 30 HIS HE2 H 9.831 -3.335 4.034 1.00 . A A . 30 HIS HE2 1 1 9 5405 1 1 30 HIS N N 7.136 -6.223 0.791 1.00 . A A . 30 HIS N 1 1 9 5406 1 1 30 HIS ND1 N 6.838 -2.768 3.555 1.00 . A A . 30 HIS ND1 1 1 9 5407 1 1 30 HIS NE2 N 8.888 -3.352 3.766 1.00 . A A . 30 HIS NE2 1 1 9 5408 1 1 30 HIS O O 4.713 -6.850 -0.207 1.00 . A A . 30 HIS O 1 1 9 5409 1 1 31 TYR C C 1.183 -5.097 1.246 1.00 . A A . 31 TYR C 1 1 9 5410 1 1 31 TYR CA C 2.246 -6.100 0.808 1.00 . A A . 31 TYR CA 1 1 9 5411 1 1 31 TYR CB C 1.831 -7.513 1.223 1.00 . A A . 31 TYR CB 1 1 9 5412 1 1 31 TYR CD1 C 3.734 -9.156 0.983 1.00 . A A . 31 TYR CD1 1 1 9 5413 1 1 31 TYR CD2 C 2.087 -9.081 -0.739 1.00 . A A . 31 TYR CD2 1 1 9 5414 1 1 31 TYR CE1 C 4.406 -10.153 0.303 1.00 . A A . 31 TYR CE1 1 1 9 5415 1 1 31 TYR CE2 C 2.754 -10.079 -1.425 1.00 . A A . 31 TYR CE2 1 1 9 5416 1 1 31 TYR CG C 2.564 -8.604 0.475 1.00 . A A . 31 TYR CG 1 1 9 5417 1 1 31 TYR CZ C 3.913 -10.610 -0.900 1.00 . A A . 31 TYR CZ 1 1 9 5418 1 1 31 TYR H H 3.582 -5.226 2.198 1.00 . A A . 31 TYR H 1 1 9 5419 1 1 31 TYR HA H 2.338 -6.063 -0.267 1.00 . A A . 31 TYR HA 1 1 9 5420 1 1 31 TYR HB2 H 2.029 -7.643 2.276 1.00 . A A . 31 TYR HB2 1 1 9 5421 1 1 31 TYR HB3 H 0.774 -7.638 1.042 1.00 . A A . 31 TYR HB3 1 1 9 5422 1 1 31 TYR HD1 H 4.118 -8.795 1.926 1.00 . A A . 31 TYR HD1 1 1 9 5423 1 1 31 TYR HD2 H 1.179 -8.662 -1.148 1.00 . A A . 31 TYR HD2 1 1 9 5424 1 1 31 TYR HE1 H 5.314 -10.569 0.714 1.00 . A A . 31 TYR HE1 1 1 9 5425 1 1 31 TYR HE2 H 2.367 -10.437 -2.368 1.00 . A A . 31 TYR HE2 1 1 9 5426 1 1 31 TYR HH H 5.457 -11.296 -1.817 1.00 . A A . 31 TYR HH 1 1 9 5427 1 1 31 TYR N N 3.544 -5.765 1.380 1.00 . A A . 31 TYR N 1 1 9 5428 1 1 31 TYR O O 1.393 -4.323 2.180 1.00 . A A . 31 TYR O 1 1 9 5429 1 1 31 TYR OH O 4.579 -11.603 -1.581 1.00 . A A . 31 TYR OH 1 1 9 5430 1 1 32 CYS C C -2.157 -4.940 1.640 1.00 . A A . 32 CYS C 1 1 9 5431 1 1 32 CYS CA C -1.053 -4.211 0.883 1.00 . A A . 32 CYS CA 1 1 9 5432 1 1 32 CYS CB C -1.618 -3.591 -0.396 1.00 . A A . 32 CYS CB 1 1 9 5433 1 1 32 CYS H H -0.067 -5.756 -0.169 1.00 . A A . 32 CYS H 1 1 9 5434 1 1 32 CYS HA H -0.661 -3.425 1.510 1.00 . A A . 32 CYS HA 1 1 9 5435 1 1 32 CYS HB2 H -1.550 -4.311 -1.197 1.00 . A A . 32 CYS HB2 1 1 9 5436 1 1 32 CYS HB3 H -2.656 -3.336 -0.236 1.00 . A A . 32 CYS HB3 1 1 9 5437 1 1 32 CYS N N 0.042 -5.117 0.565 1.00 . A A . 32 CYS N 1 1 9 5438 1 1 32 CYS O O -2.710 -5.927 1.155 1.00 . A A . 32 CYS O 1 1 9 5439 1 1 32 CYS SG S -0.753 -2.080 -0.935 1.00 . A A . 32 CYS SG 1 1 9 5440 1 1 33 THR C C -4.908 -4.753 3.103 1.00 . A A . 33 THR C 1 1 9 5441 1 1 33 THR CA C -3.514 -5.048 3.659 1.00 . A A . 33 THR CA 1 1 9 5442 1 1 33 THR CB C -3.408 -4.540 5.098 1.00 . A A . 33 THR CB 1 1 9 5443 1 1 33 THR CG2 C -3.220 -3.041 5.193 1.00 . A A . 33 THR CG2 1 1 9 5444 1 1 33 THR H H -1.997 -3.656 3.162 1.00 . A A . 33 THR H 1 1 9 5445 1 1 33 THR HA H -3.360 -6.117 3.654 1.00 . A A . 33 THR HA 1 1 9 5446 1 1 33 THR HB H -2.559 -5.010 5.573 1.00 . A A . 33 THR HB 1 1 9 5447 1 1 33 THR HG1 H -5.310 -4.347 5.527 1.00 . A A . 33 THR HG1 1 1 9 5448 1 1 33 THR HG21 H -3.883 -2.550 4.497 1.00 . A A . 33 THR HG21 1 1 9 5449 1 1 33 THR HG22 H -3.444 -2.713 6.197 1.00 . A A . 33 THR HG22 1 1 9 5450 1 1 33 THR HG23 H -2.197 -2.791 4.953 1.00 . A A . 33 THR HG23 1 1 9 5451 1 1 33 THR N N -2.474 -4.445 2.832 1.00 . A A . 33 THR N 1 1 9 5452 1 1 33 THR O O -5.904 -5.281 3.598 1.00 . A A . 33 THR O 1 1 9 5453 1 1 33 THR OG1 O -4.571 -4.875 5.836 1.00 . A A . 33 THR OG1 1 1 9 5454 1 1 34 GLY C C -7.177 -2.838 2.432 1.00 . A A . 34 GLY C 1 1 9 5455 1 1 34 GLY CA C -6.254 -3.572 1.476 1.00 . A A . 34 GLY CA 1 1 9 5456 1 1 34 GLY H H -4.152 -3.520 1.715 1.00 . A A . 34 GLY H 1 1 9 5457 1 1 34 GLY HA2 H -6.739 -4.482 1.154 1.00 . A A . 34 GLY HA2 1 1 9 5458 1 1 34 GLY HA3 H -6.079 -2.947 0.613 1.00 . A A . 34 GLY HA3 1 1 9 5459 1 1 34 GLY N N -4.975 -3.911 2.074 1.00 . A A . 34 GLY N 1 1 9 5460 1 1 34 GLY O O -8.389 -2.798 2.223 1.00 . A A . 34 GLY O 1 1 9 5461 1 1 35 ARG C C -7.036 -0.033 4.452 1.00 . A A . 35 ARG C 1 1 9 5462 1 1 35 ARG CA C -7.392 -1.518 4.467 1.00 . A A . 35 ARG CA 1 1 9 5463 1 1 35 ARG CB C -7.170 -2.098 5.867 1.00 . A A . 35 ARG CB 1 1 9 5464 1 1 35 ARG CD C -5.774 -0.846 7.544 1.00 . A A . 35 ARG CD 1 1 9 5465 1 1 35 ARG CG C -5.770 -1.861 6.413 1.00 . A A . 35 ARG CG 1 1 9 5466 1 1 35 ARG CZ C -4.152 0.416 8.904 1.00 . A A . 35 ARG CZ 1 1 9 5467 1 1 35 ARG H H -5.635 -2.318 3.596 1.00 . A A . 35 ARG H 1 1 9 5468 1 1 35 ARG HA H -8.434 -1.627 4.205 1.00 . A A . 35 ARG HA 1 1 9 5469 1 1 35 ARG HB2 H -7.879 -1.648 6.546 1.00 . A A . 35 ARG HB2 1 1 9 5470 1 1 35 ARG HB3 H -7.345 -3.163 5.834 1.00 . A A . 35 ARG HB3 1 1 9 5471 1 1 35 ARG HD2 H -6.331 0.024 7.228 1.00 . A A . 35 ARG HD2 1 1 9 5472 1 1 35 ARG HD3 H -6.255 -1.287 8.405 1.00 . A A . 35 ARG HD3 1 1 9 5473 1 1 35 ARG HE H -3.678 -0.809 7.401 1.00 . A A . 35 ARG HE 1 1 9 5474 1 1 35 ARG HG2 H -5.376 -2.796 6.784 1.00 . A A . 35 ARG HG2 1 1 9 5475 1 1 35 ARG HG3 H -5.141 -1.495 5.615 1.00 . A A . 35 ARG HG3 1 1 9 5476 1 1 35 ARG HH11 H -6.085 0.706 9.423 1.00 . A A . 35 ARG HH11 1 1 9 5477 1 1 35 ARG HH12 H -4.924 1.582 10.363 1.00 . A A . 35 ARG HH12 1 1 9 5478 1 1 35 ARG HH21 H -2.150 0.341 8.637 1.00 . A A . 35 ARG HH21 1 1 9 5479 1 1 35 ARG HH22 H -2.690 1.375 9.917 1.00 . A A . 35 ARG HH22 1 1 9 5480 1 1 35 ARG N N -6.606 -2.254 3.482 1.00 . A A . 35 ARG N 1 1 9 5481 1 1 35 ARG NE N -4.423 -0.434 7.915 1.00 . A A . 35 ARG NE 1 1 9 5482 1 1 35 ARG NH1 N -5.135 0.945 9.622 1.00 . A A . 35 ARG NH1 1 1 9 5483 1 1 35 ARG NH2 N -2.894 0.737 9.175 1.00 . A A . 35 ARG NH2 1 1 9 5484 1 1 35 ARG O O -7.879 0.820 4.731 1.00 . A A . 35 ARG O 1 1 9 5485 1 1 36 SER C C -4.112 1.768 3.141 1.00 . A A . 36 SER C 1 1 9 5486 1 1 36 SER CA C -5.313 1.646 4.072 1.00 . A A . 36 SER CA 1 1 9 5487 1 1 36 SER CB C -4.941 2.136 5.472 1.00 . A A . 36 SER CB 1 1 9 5488 1 1 36 SER H H -5.159 -0.458 3.914 1.00 . A A . 36 SER H 1 1 9 5489 1 1 36 SER HA H -6.117 2.256 3.687 1.00 . A A . 36 SER HA 1 1 9 5490 1 1 36 SER HB2 H -4.606 1.299 6.067 1.00 . A A . 36 SER HB2 1 1 9 5491 1 1 36 SER HB3 H -4.148 2.865 5.397 1.00 . A A . 36 SER HB3 1 1 9 5492 1 1 36 SER HG H -5.848 3.650 6.323 1.00 . A A . 36 SER HG 1 1 9 5493 1 1 36 SER N N -5.783 0.266 4.125 1.00 . A A . 36 SER N 1 1 9 5494 1 1 36 SER O O -3.318 0.836 3.014 1.00 . A A . 36 SER O 1 1 9 5495 1 1 36 SER OG O -6.053 2.735 6.115 1.00 . A A . 36 SER OG 1 1 9 5496 1 1 37 CYS C C -1.565 3.363 2.330 1.00 . A A . 37 CYS C 1 1 9 5497 1 1 37 CYS CA C -2.874 3.151 1.572 1.00 . A A . 37 CYS CA 1 1 9 5498 1 1 37 CYS CB C -3.158 4.359 0.677 1.00 . A A . 37 CYS CB 1 1 9 5499 1 1 37 CYS H H -4.646 3.628 2.630 1.00 . A A . 37 CYS H 1 1 9 5500 1 1 37 CYS HA H -2.776 2.274 0.951 1.00 . A A . 37 CYS HA 1 1 9 5501 1 1 37 CYS HB2 H -4.157 4.276 0.277 1.00 . A A . 37 CYS HB2 1 1 9 5502 1 1 37 CYS HB3 H -3.085 5.261 1.267 1.00 . A A . 37 CYS HB3 1 1 9 5503 1 1 37 CYS N N -3.983 2.920 2.490 1.00 . A A . 37 CYS N 1 1 9 5504 1 1 37 CYS O O -0.481 3.215 1.765 1.00 . A A . 37 CYS O 1 1 9 5505 1 1 37 CYS SG S -2.008 4.520 -0.729 1.00 . A A . 37 CYS SG 1 1 9 5506 1 1 38 GLU C C 0.400 2.700 4.469 1.00 . A A . 38 GLU C 1 1 9 5507 1 1 38 GLU CA C -0.491 3.938 4.437 1.00 . A A . 38 GLU CA 1 1 9 5508 1 1 38 GLU CB C -0.907 4.318 5.860 1.00 . A A . 38 GLU CB 1 1 9 5509 1 1 38 GLU CD C -0.778 6.333 7.378 1.00 . A A . 38 GLU CD 1 1 9 5510 1 1 38 GLU CG C -1.215 5.797 6.029 1.00 . A A . 38 GLU CG 1 1 9 5511 1 1 38 GLU H H -2.560 3.813 4.007 1.00 . A A . 38 GLU H 1 1 9 5512 1 1 38 GLU HA H 0.064 4.756 4.003 1.00 . A A . 38 GLU HA 1 1 9 5513 1 1 38 GLU HB2 H -1.789 3.755 6.127 1.00 . A A . 38 GLU HB2 1 1 9 5514 1 1 38 GLU HB3 H -0.106 4.060 6.537 1.00 . A A . 38 GLU HB3 1 1 9 5515 1 1 38 GLU HG2 H -0.702 6.349 5.256 1.00 . A A . 38 GLU HG2 1 1 9 5516 1 1 38 GLU HG3 H -2.281 5.942 5.927 1.00 . A A . 38 GLU HG3 1 1 9 5517 1 1 38 GLU N N -1.670 3.709 3.610 1.00 . A A . 38 GLU N 1 1 9 5518 1 1 38 GLU O O 0.248 1.835 5.332 1.00 . A A . 38 GLU O 1 1 9 5519 1 1 38 GLU OE1 O 0.290 6.975 7.443 1.00 . A A . 38 GLU OE1 1 1 9 5520 1 1 38 GLU OE2 O -1.506 6.110 8.369 1.00 . A A . 38 GLU OE2 1 1 9 5521 1 1 39 CYS C C 3.023 1.318 4.746 1.00 . A A . 39 CYS C 1 1 9 5522 1 1 39 CYS CA C 2.247 1.490 3.439 1.00 . A A . 39 CYS CA 1 1 9 5523 1 1 39 CYS CB C 3.223 1.684 2.274 1.00 . A A . 39 CYS CB 1 1 9 5524 1 1 39 CYS H H 1.402 3.343 2.862 1.00 . A A . 39 CYS H 1 1 9 5525 1 1 39 CYS HA H 1.660 0.602 3.259 1.00 . A A . 39 CYS HA 1 1 9 5526 1 1 39 CYS HB2 H 3.222 2.724 1.984 1.00 . A A . 39 CYS HB2 1 1 9 5527 1 1 39 CYS HB3 H 4.216 1.405 2.595 1.00 . A A . 39 CYS HB3 1 1 9 5528 1 1 39 CYS N N 1.331 2.622 3.522 1.00 . A A . 39 CYS N 1 1 9 5529 1 1 39 CYS O O 3.888 2.130 5.072 1.00 . A A . 39 CYS O 1 1 9 5530 1 1 39 CYS SG S 2.820 0.698 0.796 1.00 . A A . 39 CYS SG 1 1 9 5531 1 1 40 PRO C C 4.922 -0.009 6.647 1.00 . A A . 40 PRO C 1 1 9 5532 1 1 40 PRO CA C 3.403 -0.012 6.788 1.00 . A A . 40 PRO CA 1 1 9 5533 1 1 40 PRO CB C 2.906 -1.406 7.175 1.00 . A A . 40 PRO CB 1 1 9 5534 1 1 40 PRO CD C 1.707 -0.770 5.208 1.00 . A A . 40 PRO CD 1 1 9 5535 1 1 40 PRO CG C 1.588 -1.540 6.494 1.00 . A A . 40 PRO CG 1 1 9 5536 1 1 40 PRO HA H 3.113 0.700 7.547 1.00 . A A . 40 PRO HA 1 1 9 5537 1 1 40 PRO HB2 H 3.608 -2.151 6.829 1.00 . A A . 40 PRO HB2 1 1 9 5538 1 1 40 PRO HB3 H 2.803 -1.471 8.247 1.00 . A A . 40 PRO HB3 1 1 9 5539 1 1 40 PRO HD2 H 2.040 -1.417 4.410 1.00 . A A . 40 PRO HD2 1 1 9 5540 1 1 40 PRO HD3 H 0.763 -0.311 4.955 1.00 . A A . 40 PRO HD3 1 1 9 5541 1 1 40 PRO HG2 H 1.384 -2.581 6.290 1.00 . A A . 40 PRO HG2 1 1 9 5542 1 1 40 PRO HG3 H 0.810 -1.118 7.112 1.00 . A A . 40 PRO HG3 1 1 9 5543 1 1 40 PRO N N 2.724 0.254 5.515 1.00 . A A . 40 PRO N 1 1 9 5544 1 1 40 PRO O O 5.452 0.094 5.540 1.00 . A A . 40 PRO O 1 1 9 5545 1 1 41 SER C C 7.608 -1.562 7.762 1.00 . A A . 41 SER C 1 1 9 5546 1 1 41 SER CA C 7.074 -0.133 7.776 1.00 . A A . 41 SER CA 1 1 9 5547 1 1 41 SER CB C 7.609 0.611 9.000 1.00 . A A . 41 SER CB 1 1 9 5548 1 1 41 SER H H 5.137 -0.201 8.625 1.00 . A A . 41 SER H 1 1 9 5549 1 1 41 SER HA H 7.410 0.373 6.883 1.00 . A A . 41 SER HA 1 1 9 5550 1 1 41 SER HB2 H 6.951 0.440 9.839 1.00 . A A . 41 SER HB2 1 1 9 5551 1 1 41 SER HB3 H 8.597 0.246 9.238 1.00 . A A . 41 SER HB3 1 1 9 5552 1 1 41 SER HG H 7.966 2.455 9.557 1.00 . A A . 41 SER HG 1 1 9 5553 1 1 41 SER N N 5.616 -0.123 7.774 1.00 . A A . 41 SER N 1 1 9 5554 1 1 41 SER O O 8.672 -1.832 7.205 1.00 . A A . 41 SER O 1 1 9 5555 1 1 41 SER OG O 7.684 2.006 8.757 1.00 . A A . 41 SER OG 1 1 9 5556 1 1 42 TYR C C 7.051 -4.557 7.086 1.00 . A A . 42 TYR C 1 1 9 5557 1 1 42 TYR CA C 7.260 -3.875 8.436 1.00 . A A . 42 TYR CA 1 1 9 5558 1 1 42 TYR CB C 6.466 -4.607 9.519 1.00 . A A . 42 TYR CB 1 1 9 5559 1 1 42 TYR CD1 C 4.198 -5.034 8.496 1.00 . A A . 42 TYR CD1 1 1 9 5560 1 1 42 TYR CD2 C 4.343 -3.494 10.310 1.00 . A A . 42 TYR CD2 1 1 9 5561 1 1 42 TYR CE1 C 2.834 -4.823 8.420 1.00 . A A . 42 TYR CE1 1 1 9 5562 1 1 42 TYR CE2 C 2.979 -3.279 10.241 1.00 . A A . 42 TYR CE2 1 1 9 5563 1 1 42 TYR CG C 4.974 -4.374 9.440 1.00 . A A . 42 TYR CG 1 1 9 5564 1 1 42 TYR CZ C 2.230 -3.945 9.295 1.00 . A A . 42 TYR CZ 1 1 9 5565 1 1 42 TYR H H 6.023 -2.196 8.803 1.00 . A A . 42 TYR H 1 1 9 5566 1 1 42 TYR HA H 8.310 -3.910 8.685 1.00 . A A . 42 TYR HA 1 1 9 5567 1 1 42 TYR HB2 H 6.641 -5.669 9.428 1.00 . A A . 42 TYR HB2 1 1 9 5568 1 1 42 TYR HB3 H 6.804 -4.274 10.490 1.00 . A A . 42 TYR HB3 1 1 9 5569 1 1 42 TYR HD1 H 4.674 -5.721 7.812 1.00 . A A . 42 TYR HD1 1 1 9 5570 1 1 42 TYR HD2 H 4.932 -2.973 11.050 1.00 . A A . 42 TYR HD2 1 1 9 5571 1 1 42 TYR HE1 H 2.248 -5.346 7.679 1.00 . A A . 42 TYR HE1 1 1 9 5572 1 1 42 TYR HE2 H 2.506 -2.591 10.926 1.00 . A A . 42 TYR HE2 1 1 9 5573 1 1 42 TYR HH H 0.633 -3.488 8.326 1.00 . A A . 42 TYR HH 1 1 9 5574 1 1 42 TYR N N 6.862 -2.473 8.378 1.00 . A A . 42 TYR N 1 1 9 5575 1 1 42 TYR O O 6.152 -4.191 6.329 1.00 . A A . 42 TYR O 1 1 9 5576 1 1 42 TYR OH O 0.872 -3.733 9.223 1.00 . A A . 42 TYR OH 1 1 9 5577 1 1 43 PRO C C 6.541 -7.179 5.438 1.00 . A A . 43 PRO C 1 1 9 5578 1 1 43 PRO CA C 7.783 -6.298 5.501 1.00 . A A . 43 PRO CA 1 1 9 5579 1 1 43 PRO CB C 9.049 -7.157 5.488 1.00 . A A . 43 PRO CB 1 1 9 5580 1 1 43 PRO CD C 8.982 -6.065 7.613 1.00 . A A . 43 PRO CD 1 1 9 5581 1 1 43 PRO CG C 9.401 -7.334 6.924 1.00 . A A . 43 PRO CG 1 1 9 5582 1 1 43 PRO HA H 7.790 -5.628 4.654 1.00 . A A . 43 PRO HA 1 1 9 5583 1 1 43 PRO HB2 H 8.840 -8.103 5.011 1.00 . A A . 43 PRO HB2 1 1 9 5584 1 1 43 PRO HB3 H 9.832 -6.642 4.951 1.00 . A A . 43 PRO HB3 1 1 9 5585 1 1 43 PRO HD2 H 8.633 -6.276 8.613 1.00 . A A . 43 PRO HD2 1 1 9 5586 1 1 43 PRO HD3 H 9.800 -5.360 7.638 1.00 . A A . 43 PRO HD3 1 1 9 5587 1 1 43 PRO HG2 H 8.865 -8.178 7.332 1.00 . A A . 43 PRO HG2 1 1 9 5588 1 1 43 PRO HG3 H 10.467 -7.480 7.026 1.00 . A A . 43 PRO HG3 1 1 9 5589 1 1 43 PRO N N 7.882 -5.564 6.767 1.00 . A A . 43 PRO N 1 1 9 5590 1 1 43 PRO O O 6.024 -7.465 4.357 1.00 . A A . 43 PRO O 1 1 9 5591 1 1 44 GLY C C 4.859 -9.330 7.892 1.00 . A A . 44 GLY C 1 1 9 5592 1 1 44 GLY CA C 4.887 -8.452 6.657 1.00 . A A . 44 GLY CA 1 1 9 5593 1 1 44 GLY H H 6.518 -7.347 7.431 1.00 . A A . 44 GLY H 1 1 9 5594 1 1 44 GLY HA2 H 4.868 -9.082 5.780 1.00 . A A . 44 GLY HA2 1 1 9 5595 1 1 44 GLY HA3 H 4.007 -7.825 6.655 1.00 . A A . 44 GLY HA3 1 1 9 5596 1 1 44 GLY N N 6.065 -7.607 6.602 1.00 . A A . 44 GLY N 1 1 9 5597 1 1 44 GLY O O 3.951 -10.182 7.996 1.00 . A A . 44 GLY O 1 1 9 5598 1 1 44 GLY OXT O 5.746 -9.168 8.756 1.00 . A A . 44 GLY OXT 1 1 10 5599 1 1 1 ALA C C -13.794 14.205 3.801 1.00 . A A . 1 ALA C 1 1 10 5600 1 1 1 ALA CA C -15.165 14.615 4.329 1.00 . A A . 1 ALA CA 1 1 10 5601 1 1 1 ALA CB C -16.181 14.637 3.197 1.00 . A A . 1 ALA CB 1 1 10 5602 1 1 1 ALA H1 H -14.776 16.634 4.289 1.00 . A A . 1 ALA H1 1 1 10 5603 1 1 1 ALA H2 H -16.063 16.173 5.327 1.00 . A A . 1 ALA H2 1 1 10 5604 1 1 1 ALA H3 H -14.440 15.870 5.789 1.00 . A A . 1 ALA H3 1 1 10 5605 1 1 1 ALA HA H -15.490 13.885 5.056 1.00 . A A . 1 ALA HA 1 1 10 5606 1 1 1 ALA HB1 H -17.109 15.059 3.554 1.00 . A A . 1 ALA HB1 1 1 10 5607 1 1 1 ALA HB2 H -16.354 13.629 2.848 1.00 . A A . 1 ALA HB2 1 1 10 5608 1 1 1 ALA HB3 H -15.801 15.238 2.384 1.00 . A A . 1 ALA HB3 1 1 10 5609 1 1 1 ALA N N -15.106 15.942 4.993 1.00 . A A . 1 ALA N 1 1 10 5610 1 1 1 ALA O O -13.148 14.958 3.072 1.00 . A A . 1 ALA O 1 1 10 5611 1 1 2 MET C C -12.234 11.385 2.707 1.00 . A A . 2 MET C 1 1 10 5612 1 1 2 MET CA C -12.062 12.497 3.737 1.00 . A A . 2 MET CA 1 1 10 5613 1 1 2 MET CB C -11.264 11.979 4.935 1.00 . A A . 2 MET CB 1 1 10 5614 1 1 2 MET CE C -7.357 13.351 4.599 1.00 . A A . 2 MET CE 1 1 10 5615 1 1 2 MET CG C -9.761 11.977 4.710 1.00 . A A . 2 MET CG 1 1 10 5616 1 1 2 MET H H -13.917 12.453 4.755 1.00 . A A . 2 MET H 1 1 10 5617 1 1 2 MET HA H -11.520 13.313 3.282 1.00 . A A . 2 MET HA 1 1 10 5618 1 1 2 MET HB2 H -11.477 12.602 5.791 1.00 . A A . 2 MET HB2 1 1 10 5619 1 1 2 MET HB3 H -11.576 10.967 5.150 1.00 . A A . 2 MET HB3 1 1 10 5620 1 1 2 MET HE1 H -7.488 13.023 3.578 1.00 . A A . 2 MET HE1 1 1 10 5621 1 1 2 MET HE2 H -6.902 14.331 4.606 1.00 . A A . 2 MET HE2 1 1 10 5622 1 1 2 MET HE3 H -6.720 12.654 5.122 1.00 . A A . 2 MET HE3 1 1 10 5623 1 1 2 MET HG2 H -9.343 11.093 5.170 1.00 . A A . 2 MET HG2 1 1 10 5624 1 1 2 MET HG3 H -9.570 11.953 3.648 1.00 . A A . 2 MET HG3 1 1 10 5625 1 1 2 MET N N -13.356 13.007 4.173 1.00 . A A . 2 MET N 1 1 10 5626 1 1 2 MET O O -12.139 10.202 3.034 1.00 . A A . 2 MET O 1 1 10 5627 1 1 2 MET SD S -8.952 13.428 5.411 1.00 . A A . 2 MET SD 1 1 10 5628 1 1 3 ASP C C -11.353 10.532 -0.331 1.00 . A A . 3 ASP C 1 1 10 5629 1 1 3 ASP CA C -12.672 10.809 0.383 1.00 . A A . 3 ASP CA 1 1 10 5630 1 1 3 ASP CB C -13.709 11.325 -0.617 1.00 . A A . 3 ASP CB 1 1 10 5631 1 1 3 ASP CG C -14.972 11.816 0.061 1.00 . A A . 3 ASP CG 1 1 10 5632 1 1 3 ASP H H -12.551 12.731 1.263 1.00 . A A . 3 ASP H 1 1 10 5633 1 1 3 ASP HA H -13.032 9.890 0.819 1.00 . A A . 3 ASP HA 1 1 10 5634 1 1 3 ASP HB2 H -13.283 12.143 -1.179 1.00 . A A . 3 ASP HB2 1 1 10 5635 1 1 3 ASP HB3 H -13.973 10.527 -1.296 1.00 . A A . 3 ASP HB3 1 1 10 5636 1 1 3 ASP N N -12.487 11.773 1.462 1.00 . A A . 3 ASP N 1 1 10 5637 1 1 3 ASP O O -10.551 11.440 -0.548 1.00 . A A . 3 ASP O 1 1 10 5638 1 1 3 ASP OD1 O -16.062 11.304 -0.271 1.00 . A A . 3 ASP OD1 1 1 10 5639 1 1 3 ASP OD2 O -14.872 12.713 0.925 1.00 . A A . 3 ASP OD2 1 1 10 5640 1 1 4 CYS C C -8.690 9.108 -0.503 1.00 . A A . 4 CYS C 1 1 10 5641 1 1 4 CYS CA C -9.914 8.873 -1.384 1.00 . A A . 4 CYS CA 1 1 10 5642 1 1 4 CYS CB C -9.770 9.644 -2.699 1.00 . A A . 4 CYS CB 1 1 10 5643 1 1 4 CYS H H -11.814 8.593 -0.492 1.00 . A A . 4 CYS H 1 1 10 5644 1 1 4 CYS HA H -9.987 7.818 -1.602 1.00 . A A . 4 CYS HA 1 1 10 5645 1 1 4 CYS HB2 H -10.548 10.389 -2.758 1.00 . A A . 4 CYS HB2 1 1 10 5646 1 1 4 CYS HB3 H -8.808 10.133 -2.719 1.00 . A A . 4 CYS HB3 1 1 10 5647 1 1 4 CYS N N -11.136 9.272 -0.693 1.00 . A A . 4 CYS N 1 1 10 5648 1 1 4 CYS O O -8.440 10.227 -0.055 1.00 . A A . 4 CYS O 1 1 10 5649 1 1 4 CYS SG S -9.891 8.605 -4.190 1.00 . A A . 4 CYS SG 1 1 10 5650 1 1 5 THR C C -5.521 8.519 -0.280 1.00 . A A . 5 THR C 1 1 10 5651 1 1 5 THR CA C -6.730 8.132 0.563 1.00 . A A . 5 THR CA 1 1 10 5652 1 1 5 THR CB C -6.471 6.799 1.266 1.00 . A A . 5 THR CB 1 1 10 5653 1 1 5 THR CG2 C -7.388 6.555 2.444 1.00 . A A . 5 THR CG2 1 1 10 5654 1 1 5 THR H H -8.181 7.181 -0.649 1.00 . A A . 5 THR H 1 1 10 5655 1 1 5 THR HA H -6.892 8.896 1.308 1.00 . A A . 5 THR HA 1 1 10 5656 1 1 5 THR HB H -5.453 6.788 1.630 1.00 . A A . 5 THR HB 1 1 10 5657 1 1 5 THR HG1 H -6.193 5.923 -0.464 1.00 . A A . 5 THR HG1 1 1 10 5658 1 1 5 THR HG21 H -7.959 7.449 2.647 1.00 . A A . 5 THR HG21 1 1 10 5659 1 1 5 THR HG22 H -8.061 5.742 2.214 1.00 . A A . 5 THR HG22 1 1 10 5660 1 1 5 THR HG23 H -6.799 6.300 3.312 1.00 . A A . 5 THR HG23 1 1 10 5661 1 1 5 THR N N -7.930 8.045 -0.261 1.00 . A A . 5 THR N 1 1 10 5662 1 1 5 THR O O -5.608 8.607 -1.505 1.00 . A A . 5 THR O 1 1 10 5663 1 1 5 THR OG1 O -6.632 5.717 0.365 1.00 . A A . 5 THR OG1 1 1 10 5664 1 1 6 THR C C -1.958 8.417 0.287 1.00 . A A . 6 THR C 1 1 10 5665 1 1 6 THR CA C -3.166 9.132 -0.309 1.00 . A A . 6 THR CA 1 1 10 5666 1 1 6 THR CB C -2.964 10.648 -0.242 1.00 . A A . 6 THR CB 1 1 10 5667 1 1 6 THR CG2 C -2.602 11.262 -1.578 1.00 . A A . 6 THR CG2 1 1 10 5668 1 1 6 THR H H -4.387 8.669 1.359 1.00 . A A . 6 THR H 1 1 10 5669 1 1 6 THR HA H -3.267 8.838 -1.344 1.00 . A A . 6 THR HA 1 1 10 5670 1 1 6 THR HB H -2.162 10.866 0.449 1.00 . A A . 6 THR HB 1 1 10 5671 1 1 6 THR HG1 H -4.850 11.152 -0.407 1.00 . A A . 6 THR HG1 1 1 10 5672 1 1 6 THR HG21 H -3.346 10.992 -2.312 1.00 . A A . 6 THR HG21 1 1 10 5673 1 1 6 THR HG22 H -2.564 12.337 -1.481 1.00 . A A . 6 THR HG22 1 1 10 5674 1 1 6 THR HG23 H -1.636 10.894 -1.893 1.00 . A A . 6 THR HG23 1 1 10 5675 1 1 6 THR N N -4.393 8.752 0.382 1.00 . A A . 6 THR N 1 1 10 5676 1 1 6 THR O O -1.825 8.311 1.507 1.00 . A A . 6 THR O 1 1 10 5677 1 1 6 THR OG1 O -4.137 11.293 0.221 1.00 . A A . 6 THR OG1 1 1 10 5678 1 1 7 GLY C C 0.574 6.171 -1.110 1.00 . A A . 7 GLY C 1 1 10 5679 1 1 7 GLY CA C 0.110 7.230 -0.126 1.00 . A A . 7 GLY CA 1 1 10 5680 1 1 7 GLY H H -1.237 8.044 -1.542 1.00 . A A . 7 GLY H 1 1 10 5681 1 1 7 GLY HA2 H -0.103 6.758 0.821 1.00 . A A . 7 GLY HA2 1 1 10 5682 1 1 7 GLY HA3 H 0.904 7.949 0.013 1.00 . A A . 7 GLY HA3 1 1 10 5683 1 1 7 GLY N N -1.078 7.928 -0.582 1.00 . A A . 7 GLY N 1 1 10 5684 1 1 7 GLY O O -0.163 5.808 -2.026 1.00 . A A . 7 GLY O 1 1 10 5685 1 1 8 PRO C C 1.769 3.249 -1.585 1.00 . A A . 8 PRO C 1 1 10 5686 1 1 8 PRO CA C 2.359 4.634 -1.840 1.00 . A A . 8 PRO CA 1 1 10 5687 1 1 8 PRO CB C 3.850 4.651 -1.502 1.00 . A A . 8 PRO CB 1 1 10 5688 1 1 8 PRO CD C 2.756 6.037 0.116 1.00 . A A . 8 PRO CD 1 1 10 5689 1 1 8 PRO CG C 3.906 5.084 -0.078 1.00 . A A . 8 PRO CG 1 1 10 5690 1 1 8 PRO HA H 2.220 4.897 -2.878 1.00 . A A . 8 PRO HA 1 1 10 5691 1 1 8 PRO HB2 H 4.263 3.662 -1.633 1.00 . A A . 8 PRO HB2 1 1 10 5692 1 1 8 PRO HB3 H 4.361 5.350 -2.147 1.00 . A A . 8 PRO HB3 1 1 10 5693 1 1 8 PRO HD2 H 2.316 5.902 1.092 1.00 . A A . 8 PRO HD2 1 1 10 5694 1 1 8 PRO HD3 H 3.087 7.057 -0.012 1.00 . A A . 8 PRO HD3 1 1 10 5695 1 1 8 PRO HG2 H 3.796 4.227 0.570 1.00 . A A . 8 PRO HG2 1 1 10 5696 1 1 8 PRO HG3 H 4.843 5.584 0.116 1.00 . A A . 8 PRO HG3 1 1 10 5697 1 1 8 PRO N N 1.805 5.657 -0.947 1.00 . A A . 8 PRO N 1 1 10 5698 1 1 8 PRO O O 2.489 2.311 -1.241 1.00 . A A . 8 PRO O 1 1 10 5699 1 1 9 CYS C C -1.720 1.984 -1.841 1.00 . A A . 9 CYS C 1 1 10 5700 1 1 9 CYS CA C -0.227 1.854 -1.552 1.00 . A A . 9 CYS CA 1 1 10 5701 1 1 9 CYS CB C -0.012 1.360 -0.120 1.00 . A A . 9 CYS CB 1 1 10 5702 1 1 9 CYS H H -0.063 3.909 -2.037 1.00 . A A . 9 CYS H 1 1 10 5703 1 1 9 CYS HA H 0.198 1.136 -2.237 1.00 . A A . 9 CYS HA 1 1 10 5704 1 1 9 CYS HB2 H 0.913 1.769 0.258 1.00 . A A . 9 CYS HB2 1 1 10 5705 1 1 9 CYS HB3 H -0.830 1.702 0.498 1.00 . A A . 9 CYS HB3 1 1 10 5706 1 1 9 CYS N N 0.457 3.127 -1.759 1.00 . A A . 9 CYS N 1 1 10 5707 1 1 9 CYS O O -2.556 1.472 -1.096 1.00 . A A . 9 CYS O 1 1 10 5708 1 1 9 CYS SG S 0.082 -0.453 0.036 1.00 . A A . 9 CYS SG 1 1 10 5709 1 1 10 CYS C C -3.532 3.429 -4.736 1.00 . A A . 10 CYS C 1 1 10 5710 1 1 10 CYS CA C -3.438 2.870 -3.319 1.00 . A A . 10 CYS CA 1 1 10 5711 1 1 10 CYS CB C -4.145 3.813 -2.338 1.00 . A A . 10 CYS CB 1 1 10 5712 1 1 10 CYS H H -1.336 3.056 -3.484 1.00 . A A . 10 CYS H 1 1 10 5713 1 1 10 CYS HA H -3.928 1.908 -3.293 1.00 . A A . 10 CYS HA 1 1 10 5714 1 1 10 CYS HB2 H -4.963 4.299 -2.847 1.00 . A A . 10 CYS HB2 1 1 10 5715 1 1 10 CYS HB3 H -4.535 3.232 -1.515 1.00 . A A . 10 CYS HB3 1 1 10 5716 1 1 10 CYS N N -2.047 2.672 -2.930 1.00 . A A . 10 CYS N 1 1 10 5717 1 1 10 CYS O O -2.854 4.397 -5.078 1.00 . A A . 10 CYS O 1 1 10 5718 1 1 10 CYS SG S -3.080 5.118 -1.640 1.00 . A A . 10 CYS SG 1 1 10 5719 1 1 11 ARG C C -5.063 4.693 -6.969 1.00 . A A . 11 ARG C 1 1 10 5720 1 1 11 ARG CA C -4.566 3.254 -6.933 1.00 . A A . 11 ARG CA 1 1 10 5721 1 1 11 ARG CB C -5.556 2.339 -7.657 1.00 . A A . 11 ARG CB 1 1 10 5722 1 1 11 ARG CD C -6.450 1.708 -9.919 1.00 . A A . 11 ARG CD 1 1 10 5723 1 1 11 ARG CG C -5.222 2.121 -9.123 1.00 . A A . 11 ARG CG 1 1 10 5724 1 1 11 ARG CZ C -5.593 1.755 -12.229 1.00 . A A . 11 ARG CZ 1 1 10 5725 1 1 11 ARG H H -4.897 2.050 -5.224 1.00 . A A . 11 ARG H 1 1 10 5726 1 1 11 ARG HA H -3.608 3.203 -7.430 1.00 . A A . 11 ARG HA 1 1 10 5727 1 1 11 ARG HB2 H -5.565 1.378 -7.165 1.00 . A A . 11 ARG HB2 1 1 10 5728 1 1 11 ARG HB3 H -6.542 2.775 -7.595 1.00 . A A . 11 ARG HB3 1 1 10 5729 1 1 11 ARG HD2 H -6.498 0.630 -9.947 1.00 . A A . 11 ARG HD2 1 1 10 5730 1 1 11 ARG HD3 H -7.329 2.094 -9.424 1.00 . A A . 11 ARG HD3 1 1 10 5731 1 1 11 ARG HE H -7.031 2.942 -11.518 1.00 . A A . 11 ARG HE 1 1 10 5732 1 1 11 ARG HG2 H -4.832 3.040 -9.535 1.00 . A A . 11 ARG HG2 1 1 10 5733 1 1 11 ARG HG3 H -4.475 1.344 -9.201 1.00 . A A . 11 ARG HG3 1 1 10 5734 1 1 11 ARG HH11 H -4.713 0.378 -11.036 1.00 . A A . 11 ARG HH11 1 1 10 5735 1 1 11 ARG HH12 H -4.129 0.430 -12.665 1.00 . A A . 11 ARG HH12 1 1 10 5736 1 1 11 ARG HH21 H -6.263 3.013 -13.661 1.00 . A A . 11 ARG HH21 1 1 10 5737 1 1 11 ARG HH22 H -5.008 1.927 -14.155 1.00 . A A . 11 ARG HH22 1 1 10 5738 1 1 11 ARG N N -4.381 2.814 -5.555 1.00 . A A . 11 ARG N 1 1 10 5739 1 1 11 ARG NE N -6.413 2.218 -11.287 1.00 . A A . 11 ARG NE 1 1 10 5740 1 1 11 ARG NH1 N -4.742 0.774 -11.953 1.00 . A A . 11 ARG NH1 1 1 10 5741 1 1 11 ARG NH2 N -5.624 2.274 -13.448 1.00 . A A . 11 ARG NH2 1 1 10 5742 1 1 11 ARG O O -6.220 4.967 -6.650 1.00 . A A . 11 ARG O 1 1 10 5743 1 1 12 GLN C C -4.772 7.569 -6.005 1.00 . A A . 12 GLN C 1 1 10 5744 1 1 12 GLN CA C -4.528 7.028 -7.408 1.00 . A A . 12 GLN CA 1 1 10 5745 1 1 12 GLN CB C -5.769 7.243 -8.282 1.00 . A A . 12 GLN CB 1 1 10 5746 1 1 12 GLN CD C -6.275 7.283 -10.756 1.00 . A A . 12 GLN CD 1 1 10 5747 1 1 12 GLN CG C -5.461 7.883 -9.626 1.00 . A A . 12 GLN CG 1 1 10 5748 1 1 12 GLN H H -3.270 5.334 -7.580 1.00 . A A . 12 GLN H 1 1 10 5749 1 1 12 GLN HA H -3.696 7.555 -7.843 1.00 . A A . 12 GLN HA 1 1 10 5750 1 1 12 GLN HB2 H -6.238 6.287 -8.462 1.00 . A A . 12 GLN HB2 1 1 10 5751 1 1 12 GLN HB3 H -6.463 7.881 -7.754 1.00 . A A . 12 GLN HB3 1 1 10 5752 1 1 12 GLN HE21 H -7.900 7.268 -9.611 1.00 . A A . 12 GLN HE21 1 1 10 5753 1 1 12 GLN HE22 H -8.106 6.659 -11.215 1.00 . A A . 12 GLN HE22 1 1 10 5754 1 1 12 GLN HG2 H -5.680 8.938 -9.566 1.00 . A A . 12 GLN HG2 1 1 10 5755 1 1 12 GLN HG3 H -4.413 7.745 -9.844 1.00 . A A . 12 GLN HG3 1 1 10 5756 1 1 12 GLN N N -4.180 5.613 -7.347 1.00 . A A . 12 GLN N 1 1 10 5757 1 1 12 GLN NE2 N -7.557 7.046 -10.502 1.00 . A A . 12 GLN NE2 1 1 10 5758 1 1 12 GLN O O -3.952 8.309 -5.460 1.00 . A A . 12 GLN O 1 1 10 5759 1 1 12 GLN OE1 O -5.758 7.037 -11.846 1.00 . A A . 12 GLN OE1 1 1 10 5760 1 1 13 CYS C C -7.230 6.629 -3.442 1.00 . A A . 13 CYS C 1 1 10 5761 1 1 13 CYS CA C -6.259 7.616 -4.084 1.00 . A A . 13 CYS CA 1 1 10 5762 1 1 13 CYS CB C -6.882 9.011 -4.128 1.00 . A A . 13 CYS CB 1 1 10 5763 1 1 13 CYS H H -6.507 6.593 -5.913 1.00 . A A . 13 CYS H 1 1 10 5764 1 1 13 CYS HA H -5.356 7.652 -3.495 1.00 . A A . 13 CYS HA 1 1 10 5765 1 1 13 CYS HB2 H -7.242 9.265 -3.144 1.00 . A A . 13 CYS HB2 1 1 10 5766 1 1 13 CYS HB3 H -6.127 9.724 -4.425 1.00 . A A . 13 CYS HB3 1 1 10 5767 1 1 13 CYS N N -5.900 7.186 -5.426 1.00 . A A . 13 CYS N 1 1 10 5768 1 1 13 CYS O O -8.054 7.007 -2.611 1.00 . A A . 13 CYS O 1 1 10 5769 1 1 13 CYS SG S -8.278 9.163 -5.290 1.00 . A A . 13 CYS SG 1 1 10 5770 1 1 14 LYS C C -7.185 3.162 -2.737 1.00 . A A . 14 LYS C 1 1 10 5771 1 1 14 LYS CA C -8.000 4.323 -3.296 1.00 . A A . 14 LYS CA 1 1 10 5772 1 1 14 LYS CB C -8.954 3.817 -4.379 1.00 . A A . 14 LYS CB 1 1 10 5773 1 1 14 LYS CD C -11.064 2.525 -4.821 1.00 . A A . 14 LYS CD 1 1 10 5774 1 1 14 LYS CE C -12.564 2.765 -4.779 1.00 . A A . 14 LYS CE 1 1 10 5775 1 1 14 LYS CG C -10.327 3.433 -3.851 1.00 . A A . 14 LYS CG 1 1 10 5776 1 1 14 LYS H H -6.452 5.117 -4.501 1.00 . A A . 14 LYS H 1 1 10 5777 1 1 14 LYS HA H -8.579 4.759 -2.495 1.00 . A A . 14 LYS HA 1 1 10 5778 1 1 14 LYS HB2 H -9.082 4.591 -5.121 1.00 . A A . 14 LYS HB2 1 1 10 5779 1 1 14 LYS HB3 H -8.518 2.948 -4.850 1.00 . A A . 14 LYS HB3 1 1 10 5780 1 1 14 LYS HD2 H -10.707 2.718 -5.822 1.00 . A A . 14 LYS HD2 1 1 10 5781 1 1 14 LYS HD3 H -10.864 1.496 -4.558 1.00 . A A . 14 LYS HD3 1 1 10 5782 1 1 14 LYS HE2 H -12.844 3.034 -3.771 1.00 . A A . 14 LYS HE2 1 1 10 5783 1 1 14 LYS HE3 H -12.805 3.578 -5.448 1.00 . A A . 14 LYS HE3 1 1 10 5784 1 1 14 LYS HG2 H -10.208 2.917 -2.910 1.00 . A A . 14 LYS HG2 1 1 10 5785 1 1 14 LYS HG3 H -10.908 4.332 -3.700 1.00 . A A . 14 LYS HG3 1 1 10 5786 1 1 14 LYS HZ1 H -12.838 1.063 -5.959 1.00 . A A . 14 LYS HZ1 1 1 10 5787 1 1 14 LYS HZ2 H -13.430 0.905 -4.383 1.00 . A A . 14 LYS HZ2 1 1 10 5788 1 1 14 LYS HZ3 H -14.280 1.829 -5.516 1.00 . A A . 14 LYS HZ3 1 1 10 5789 1 1 14 LYS N N -7.128 5.361 -3.834 1.00 . A A . 14 LYS N 1 1 10 5790 1 1 14 LYS NZ N -13.332 1.556 -5.188 1.00 . A A . 14 LYS NZ 1 1 10 5791 1 1 14 LYS O O -6.323 2.611 -3.421 1.00 . A A . 14 LYS O 1 1 10 5792 1 1 15 LEU C C -6.622 0.492 -1.745 1.00 . A A . 15 LEU C 1 1 10 5793 1 1 15 LEU CA C -6.763 1.701 -0.825 1.00 . A A . 15 LEU CA 1 1 10 5794 1 1 15 LEU CB C -7.503 1.295 0.451 1.00 . A A . 15 LEU CB 1 1 10 5795 1 1 15 LEU CD1 C -8.266 1.896 2.761 1.00 . A A . 15 LEU CD1 1 1 10 5796 1 1 15 LEU CD2 C -5.845 2.073 2.161 1.00 . A A . 15 LEU CD2 1 1 10 5797 1 1 15 LEU CG C -7.273 2.211 1.653 1.00 . A A . 15 LEU CG 1 1 10 5798 1 1 15 LEU H H -8.165 3.278 -0.999 1.00 . A A . 15 LEU H 1 1 10 5799 1 1 15 LEU HA H -5.778 2.052 -0.560 1.00 . A A . 15 LEU HA 1 1 10 5800 1 1 15 LEU HB2 H -8.562 1.276 0.236 1.00 . A A . 15 LEU HB2 1 1 10 5801 1 1 15 LEU HB3 H -7.190 0.298 0.722 1.00 . A A . 15 LEU HB3 1 1 10 5802 1 1 15 LEU HD11 H -9.272 1.965 2.372 1.00 . A A . 15 LEU HD11 1 1 10 5803 1 1 15 LEU HD12 H -8.090 0.897 3.129 1.00 . A A . 15 LEU HD12 1 1 10 5804 1 1 15 LEU HD13 H -8.143 2.604 3.567 1.00 . A A . 15 LEU HD13 1 1 10 5805 1 1 15 LEU HD21 H -5.163 2.079 1.323 1.00 . A A . 15 LEU HD21 1 1 10 5806 1 1 15 LEU HD22 H -5.616 2.898 2.818 1.00 . A A . 15 LEU HD22 1 1 10 5807 1 1 15 LEU HD23 H -5.743 1.143 2.700 1.00 . A A . 15 LEU HD23 1 1 10 5808 1 1 15 LEU HG H -7.424 3.237 1.351 1.00 . A A . 15 LEU HG 1 1 10 5809 1 1 15 LEU N N -7.466 2.797 -1.489 1.00 . A A . 15 LEU N 1 1 10 5810 1 1 15 LEU O O -7.615 -0.111 -2.151 1.00 . A A . 15 LEU O 1 1 10 5811 1 1 16 LYS C C -5.705 -2.276 -2.351 1.00 . A A . 16 LYS C 1 1 10 5812 1 1 16 LYS CA C -5.110 -0.996 -2.937 1.00 . A A . 16 LYS CA 1 1 10 5813 1 1 16 LYS CB C -3.602 -1.162 -3.142 1.00 . A A . 16 LYS CB 1 1 10 5814 1 1 16 LYS CD C -1.827 -0.214 -4.649 1.00 . A A . 16 LYS CD 1 1 10 5815 1 1 16 LYS CE C -1.635 0.465 -5.995 1.00 . A A . 16 LYS CE 1 1 10 5816 1 1 16 LYS CG C -3.156 -0.948 -4.580 1.00 . A A . 16 LYS CG 1 1 10 5817 1 1 16 LYS H H -4.628 0.661 -1.711 1.00 . A A . 16 LYS H 1 1 10 5818 1 1 16 LYS HA H -5.575 -0.800 -3.892 1.00 . A A . 16 LYS HA 1 1 10 5819 1 1 16 LYS HB2 H -3.086 -0.448 -2.517 1.00 . A A . 16 LYS HB2 1 1 10 5820 1 1 16 LYS HB3 H -3.315 -2.160 -2.844 1.00 . A A . 16 LYS HB3 1 1 10 5821 1 1 16 LYS HD2 H -1.799 0.536 -3.872 1.00 . A A . 16 LYS HD2 1 1 10 5822 1 1 16 LYS HD3 H -1.027 -0.923 -4.495 1.00 . A A . 16 LYS HD3 1 1 10 5823 1 1 16 LYS HE2 H -2.325 1.292 -6.068 1.00 . A A . 16 LYS HE2 1 1 10 5824 1 1 16 LYS HE3 H -0.622 0.837 -6.055 1.00 . A A . 16 LYS HE3 1 1 10 5825 1 1 16 LYS HG2 H -3.050 -1.908 -5.060 1.00 . A A . 16 LYS HG2 1 1 10 5826 1 1 16 LYS HG3 H -3.906 -0.366 -5.095 1.00 . A A . 16 LYS HG3 1 1 10 5827 1 1 16 LYS HZ1 H -1.231 -1.282 -7.065 1.00 . A A . 16 LYS HZ1 1 1 10 5828 1 1 16 LYS HZ2 H -2.857 -0.815 -7.103 1.00 . A A . 16 LYS HZ2 1 1 10 5829 1 1 16 LYS HZ3 H -1.716 0.017 -8.033 1.00 . A A . 16 LYS HZ3 1 1 10 5830 1 1 16 LYS N N -5.380 0.142 -2.068 1.00 . A A . 16 LYS N 1 1 10 5831 1 1 16 LYS NZ N -1.877 -0.469 -7.128 1.00 . A A . 16 LYS NZ 1 1 10 5832 1 1 16 LYS O O -5.914 -2.375 -1.142 1.00 . A A . 16 LYS O 1 1 10 5833 1 1 17 PRO C C -5.677 -5.258 -1.737 1.00 . A A . 17 PRO C 1 1 10 5834 1 1 17 PRO CA C -6.560 -4.552 -2.761 1.00 . A A . 17 PRO CA 1 1 10 5835 1 1 17 PRO CB C -6.654 -5.381 -4.050 1.00 . A A . 17 PRO CB 1 1 10 5836 1 1 17 PRO CD C -5.770 -3.247 -4.657 1.00 . A A . 17 PRO CD 1 1 10 5837 1 1 17 PRO CG C -5.749 -4.702 -5.022 1.00 . A A . 17 PRO CG 1 1 10 5838 1 1 17 PRO HA H -7.548 -4.416 -2.346 1.00 . A A . 17 PRO HA 1 1 10 5839 1 1 17 PRO HB2 H -6.332 -6.393 -3.852 1.00 . A A . 17 PRO HB2 1 1 10 5840 1 1 17 PRO HB3 H -7.675 -5.386 -4.401 1.00 . A A . 17 PRO HB3 1 1 10 5841 1 1 17 PRO HD2 H -4.825 -2.782 -4.899 1.00 . A A . 17 PRO HD2 1 1 10 5842 1 1 17 PRO HD3 H -6.581 -2.741 -5.159 1.00 . A A . 17 PRO HD3 1 1 10 5843 1 1 17 PRO HG2 H -4.749 -5.098 -4.930 1.00 . A A . 17 PRO HG2 1 1 10 5844 1 1 17 PRO HG3 H -6.118 -4.842 -6.027 1.00 . A A . 17 PRO HG3 1 1 10 5845 1 1 17 PRO N N -5.987 -3.276 -3.203 1.00 . A A . 17 PRO N 1 1 10 5846 1 1 17 PRO O O -4.474 -5.417 -1.945 1.00 . A A . 17 PRO O 1 1 10 5847 1 1 18 ALA C C -4.756 -7.547 -0.129 1.00 . A A . 18 ALA C 1 1 10 5848 1 1 18 ALA CA C -5.555 -6.372 0.428 1.00 . A A . 18 ALA CA 1 1 10 5849 1 1 18 ALA CB C -6.517 -6.849 1.505 1.00 . A A . 18 ALA CB 1 1 10 5850 1 1 18 ALA H H -7.245 -5.524 -0.525 1.00 . A A . 18 ALA H 1 1 10 5851 1 1 18 ALA HA H -4.871 -5.666 0.877 1.00 . A A . 18 ALA HA 1 1 10 5852 1 1 18 ALA HB1 H -7.273 -6.096 1.671 1.00 . A A . 18 ALA HB1 1 1 10 5853 1 1 18 ALA HB2 H -5.974 -7.022 2.422 1.00 . A A . 18 ALA HB2 1 1 10 5854 1 1 18 ALA HB3 H -6.988 -7.767 1.186 1.00 . A A . 18 ALA HB3 1 1 10 5855 1 1 18 ALA N N -6.284 -5.681 -0.631 1.00 . A A . 18 ALA N 1 1 10 5856 1 1 18 ALA O O -5.327 -8.532 -0.598 1.00 . A A . 18 ALA O 1 1 10 5857 1 1 19 GLY C C -1.799 -8.068 -1.809 1.00 . A A . 19 GLY C 1 1 10 5858 1 1 19 GLY CA C -2.577 -8.491 -0.579 1.00 . A A . 19 GLY CA 1 1 10 5859 1 1 19 GLY H H -3.036 -6.624 0.308 1.00 . A A . 19 GLY H 1 1 10 5860 1 1 19 GLY HA2 H -3.187 -9.347 -0.829 1.00 . A A . 19 GLY HA2 1 1 10 5861 1 1 19 GLY HA3 H -1.879 -8.774 0.196 1.00 . A A . 19 GLY HA3 1 1 10 5862 1 1 19 GLY N N -3.434 -7.434 -0.075 1.00 . A A . 19 GLY N 1 1 10 5863 1 1 19 GLY O O -1.427 -8.902 -2.635 1.00 . A A . 19 GLY O 1 1 10 5864 1 1 20 THR C C 0.375 -5.399 -2.597 1.00 . A A . 20 THR C 1 1 10 5865 1 1 20 THR CA C -0.813 -6.231 -3.068 1.00 . A A . 20 THR CA 1 1 10 5866 1 1 20 THR CB C -1.734 -5.379 -3.944 1.00 . A A . 20 THR CB 1 1 10 5867 1 1 20 THR CG2 C -1.043 -4.805 -5.162 1.00 . A A . 20 THR CG2 1 1 10 5868 1 1 20 THR H H -1.873 -6.153 -1.240 1.00 . A A . 20 THR H 1 1 10 5869 1 1 20 THR HA H -0.447 -7.064 -3.650 1.00 . A A . 20 THR HA 1 1 10 5870 1 1 20 THR HB H -2.109 -4.553 -3.356 1.00 . A A . 20 THR HB 1 1 10 5871 1 1 20 THR HG1 H -2.528 -6.967 -4.770 1.00 . A A . 20 THR HG1 1 1 10 5872 1 1 20 THR HG21 H -0.025 -4.547 -4.910 1.00 . A A . 20 THR HG21 1 1 10 5873 1 1 20 THR HG22 H -1.043 -5.538 -5.955 1.00 . A A . 20 THR HG22 1 1 10 5874 1 1 20 THR HG23 H -1.568 -3.920 -5.490 1.00 . A A . 20 THR HG23 1 1 10 5875 1 1 20 THR N N -1.552 -6.767 -1.931 1.00 . A A . 20 THR N 1 1 10 5876 1 1 20 THR O O 0.207 -4.398 -1.901 1.00 . A A . 20 THR O 1 1 10 5877 1 1 20 THR OG1 O -2.840 -6.140 -4.396 1.00 . A A . 20 THR OG1 1 1 10 5878 1 1 21 THR C C 2.765 -3.672 -3.081 1.00 . A A . 21 THR C 1 1 10 5879 1 1 21 THR CA C 2.792 -5.117 -2.592 1.00 . A A . 21 THR CA 1 1 10 5880 1 1 21 THR CB C 4.024 -5.836 -3.148 1.00 . A A . 21 THR CB 1 1 10 5881 1 1 21 THR CG2 C 5.117 -6.029 -2.120 1.00 . A A . 21 THR CG2 1 1 10 5882 1 1 21 THR H H 1.645 -6.628 -3.531 1.00 . A A . 21 THR H 1 1 10 5883 1 1 21 THR HA H 2.845 -5.117 -1.513 1.00 . A A . 21 THR HA 1 1 10 5884 1 1 21 THR HB H 4.435 -5.252 -3.960 1.00 . A A . 21 THR HB 1 1 10 5885 1 1 21 THR HG1 H 3.427 -7.688 -2.923 1.00 . A A . 21 THR HG1 1 1 10 5886 1 1 21 THR HG21 H 4.933 -5.382 -1.274 1.00 . A A . 21 THR HG21 1 1 10 5887 1 1 21 THR HG22 H 5.124 -7.058 -1.791 1.00 . A A . 21 THR HG22 1 1 10 5888 1 1 21 THR HG23 H 6.073 -5.785 -2.559 1.00 . A A . 21 THR HG23 1 1 10 5889 1 1 21 THR N N 1.575 -5.822 -2.978 1.00 . A A . 21 THR N 1 1 10 5890 1 1 21 THR O O 2.064 -3.343 -4.038 1.00 . A A . 21 THR O 1 1 10 5891 1 1 21 THR OG1 O 3.678 -7.114 -3.651 1.00 . A A . 21 THR OG1 1 1 10 5892 1 1 22 CYS C C 4.890 -1.092 -3.527 1.00 . A A . 22 CYS C 1 1 10 5893 1 1 22 CYS CA C 3.596 -1.404 -2.782 1.00 . A A . 22 CYS CA 1 1 10 5894 1 1 22 CYS CB C 3.488 -0.525 -1.534 1.00 . A A . 22 CYS CB 1 1 10 5895 1 1 22 CYS H H 4.068 -3.137 -1.662 1.00 . A A . 22 CYS H 1 1 10 5896 1 1 22 CYS HA H 2.761 -1.193 -3.433 1.00 . A A . 22 CYS HA 1 1 10 5897 1 1 22 CYS HB2 H 3.686 0.500 -1.807 1.00 . A A . 22 CYS HB2 1 1 10 5898 1 1 22 CYS HB3 H 2.485 -0.599 -1.138 1.00 . A A . 22 CYS HB3 1 1 10 5899 1 1 22 CYS N N 3.532 -2.814 -2.416 1.00 . A A . 22 CYS N 1 1 10 5900 1 1 22 CYS O O 4.883 -0.386 -4.535 1.00 . A A . 22 CYS O 1 1 10 5901 1 1 22 CYS SG S 4.646 -0.977 -0.202 1.00 . A A . 22 CYS SG 1 1 10 5902 1 1 23 TRP C C 7.649 -2.535 -4.600 1.00 . A A . 23 TRP C 1 1 10 5903 1 1 23 TRP CA C 7.301 -1.401 -3.643 1.00 . A A . 23 TRP CA 1 1 10 5904 1 1 23 TRP CB C 8.385 -1.273 -2.571 1.00 . A A . 23 TRP CB 1 1 10 5905 1 1 23 TRP CD1 C 9.948 -0.185 -4.287 1.00 . A A . 23 TRP CD1 1 1 10 5906 1 1 23 TRP CD2 C 10.494 0.226 -2.154 1.00 . A A . 23 TRP CD2 1 1 10 5907 1 1 23 TRP CE2 C 11.424 0.875 -2.989 1.00 . A A . 23 TRP CE2 1 1 10 5908 1 1 23 TRP CE3 C 10.636 0.343 -0.769 1.00 . A A . 23 TRP CE3 1 1 10 5909 1 1 23 TRP CG C 9.558 -0.446 -3.004 1.00 . A A . 23 TRP CG 1 1 10 5910 1 1 23 TRP CH2 C 12.594 1.726 -1.122 1.00 . A A . 23 TRP CH2 1 1 10 5911 1 1 23 TRP CZ2 C 12.480 1.629 -2.482 1.00 . A A . 23 TRP CZ2 1 1 10 5912 1 1 23 TRP CZ3 C 11.684 1.091 -0.267 1.00 . A A . 23 TRP CZ3 1 1 10 5913 1 1 23 TRP H H 5.942 -2.178 -2.218 1.00 . A A . 23 TRP H 1 1 10 5914 1 1 23 TRP HA H 7.249 -0.481 -4.201 1.00 . A A . 23 TRP HA 1 1 10 5915 1 1 23 TRP HB2 H 7.959 -0.811 -1.692 1.00 . A A . 23 TRP HB2 1 1 10 5916 1 1 23 TRP HB3 H 8.746 -2.258 -2.314 1.00 . A A . 23 TRP HB3 1 1 10 5917 1 1 23 TRP HD1 H 9.440 -0.555 -5.165 1.00 . A A . 23 TRP HD1 1 1 10 5918 1 1 23 TRP HE1 H 11.539 0.932 -5.083 1.00 . A A . 23 TRP HE1 1 1 10 5919 1 1 23 TRP HE3 H 9.944 -0.139 -0.094 1.00 . A A . 23 TRP HE3 1 1 10 5920 1 1 23 TRP HH2 H 13.398 2.300 -0.686 1.00 . A A . 23 TRP HH2 1 1 10 5921 1 1 23 TRP HZ2 H 13.189 2.124 -3.128 1.00 . A A . 23 TRP HZ2 1 1 10 5922 1 1 23 TRP HZ3 H 11.810 1.193 0.801 1.00 . A A . 23 TRP HZ3 1 1 10 5923 1 1 23 TRP N N 6.000 -1.624 -3.024 1.00 . A A . 23 TRP N 1 1 10 5924 1 1 23 TRP NE1 N 11.070 0.609 -4.285 1.00 . A A . 23 TRP NE1 1 1 10 5925 1 1 23 TRP O O 8.140 -2.303 -5.704 1.00 . A A . 23 TRP O 1 1 10 5926 1 1 24 ARG C C 9.146 -4.994 -5.369 1.00 . A A . 24 ARG C 1 1 10 5927 1 1 24 ARG CA C 7.672 -4.940 -4.982 1.00 . A A . 24 ARG CA 1 1 10 5928 1 1 24 ARG CB C 6.802 -4.936 -6.240 1.00 . A A . 24 ARG CB 1 1 10 5929 1 1 24 ARG CD C 7.825 -6.417 -7.992 1.00 . A A . 24 ARG CD 1 1 10 5930 1 1 24 ARG CG C 6.737 -6.283 -6.939 1.00 . A A . 24 ARG CG 1 1 10 5931 1 1 24 ARG CZ C 8.447 -7.940 -9.827 1.00 . A A . 24 ARG CZ 1 1 10 5932 1 1 24 ARG H H 6.996 -3.879 -3.278 1.00 . A A . 24 ARG H 1 1 10 5933 1 1 24 ARG HA H 7.434 -5.814 -4.394 1.00 . A A . 24 ARG HA 1 1 10 5934 1 1 24 ARG HB2 H 5.797 -4.647 -5.968 1.00 . A A . 24 ARG HB2 1 1 10 5935 1 1 24 ARG HB3 H 7.199 -4.212 -6.936 1.00 . A A . 24 ARG HB3 1 1 10 5936 1 1 24 ARG HD2 H 7.820 -5.532 -8.611 1.00 . A A . 24 ARG HD2 1 1 10 5937 1 1 24 ARG HD3 H 8.780 -6.502 -7.496 1.00 . A A . 24 ARG HD3 1 1 10 5938 1 1 24 ARG HE H 6.836 -8.144 -8.667 1.00 . A A . 24 ARG HE 1 1 10 5939 1 1 24 ARG HG2 H 6.863 -7.065 -6.205 1.00 . A A . 24 ARG HG2 1 1 10 5940 1 1 24 ARG HG3 H 5.773 -6.385 -7.415 1.00 . A A . 24 ARG HG3 1 1 10 5941 1 1 24 ARG HH11 H 9.724 -6.396 -9.550 1.00 . A A . 24 ARG HH11 1 1 10 5942 1 1 24 ARG HH12 H 10.139 -7.481 -10.834 1.00 . A A . 24 ARG HH12 1 1 10 5943 1 1 24 ARG HH21 H 7.381 -9.573 -10.355 1.00 . A A . 24 ARG HH21 1 1 10 5944 1 1 24 ARG HH22 H 8.809 -9.285 -11.292 1.00 . A A . 24 ARG HH22 1 1 10 5945 1 1 24 ARG N N 7.389 -3.763 -4.167 1.00 . A A . 24 ARG N 1 1 10 5946 1 1 24 ARG NE N 7.625 -7.589 -8.841 1.00 . A A . 24 ARG NE 1 1 10 5947 1 1 24 ARG NH1 N 9.525 -7.212 -10.092 1.00 . A A . 24 ARG NH1 1 1 10 5948 1 1 24 ARG NH2 N 8.191 -9.021 -10.551 1.00 . A A . 24 ARG NH2 1 1 10 5949 1 1 24 ARG O O 9.519 -4.630 -6.484 1.00 . A A . 24 ARG O 1 1 10 5950 1 1 25 THR C C 11.958 -6.888 -4.184 1.00 . A A . 25 THR C 1 1 10 5951 1 1 25 THR CA C 11.414 -5.554 -4.687 1.00 . A A . 25 THR CA 1 1 10 5952 1 1 25 THR CB C 12.153 -4.399 -4.009 1.00 . A A . 25 THR CB 1 1 10 5953 1 1 25 THR CG2 C 13.317 -3.875 -4.821 1.00 . A A . 25 THR CG2 1 1 10 5954 1 1 25 THR H H 9.623 -5.728 -3.571 1.00 . A A . 25 THR H 1 1 10 5955 1 1 25 THR HA H 11.572 -5.495 -5.753 1.00 . A A . 25 THR HA 1 1 10 5956 1 1 25 THR HB H 12.540 -4.741 -3.059 1.00 . A A . 25 THR HB 1 1 10 5957 1 1 25 THR HG1 H 10.598 -3.584 -3.142 1.00 . A A . 25 THR HG1 1 1 10 5958 1 1 25 THR HG21 H 13.154 -4.092 -5.867 1.00 . A A . 25 THR HG21 1 1 10 5959 1 1 25 THR HG22 H 13.400 -2.807 -4.684 1.00 . A A . 25 THR HG22 1 1 10 5960 1 1 25 THR HG23 H 14.229 -4.351 -4.493 1.00 . A A . 25 THR HG23 1 1 10 5961 1 1 25 THR N N 9.980 -5.452 -4.442 1.00 . A A . 25 THR N 1 1 10 5962 1 1 25 THR O O 11.199 -7.759 -3.761 1.00 . A A . 25 THR O 1 1 10 5963 1 1 25 THR OG1 O 11.275 -3.314 -3.767 1.00 . A A . 25 THR OG1 1 1 10 5964 1 1 26 SER C C 14.038 -8.296 -2.262 1.00 . A A . 26 SER C 1 1 10 5965 1 1 26 SER CA C 13.923 -8.267 -3.782 1.00 . A A . 26 SER CA 1 1 10 5966 1 1 26 SER CB C 15.311 -8.399 -4.412 1.00 . A A . 26 SER CB 1 1 10 5967 1 1 26 SER H H 13.830 -6.309 -4.581 1.00 . A A . 26 SER H 1 1 10 5968 1 1 26 SER HA H 13.313 -9.098 -4.101 1.00 . A A . 26 SER HA 1 1 10 5969 1 1 26 SER HB2 H 15.837 -7.461 -4.319 1.00 . A A . 26 SER HB2 1 1 10 5970 1 1 26 SER HB3 H 15.863 -9.174 -3.902 1.00 . A A . 26 SER HB3 1 1 10 5971 1 1 26 SER HG H 15.928 -8.305 -6.269 1.00 . A A . 26 SER HG 1 1 10 5972 1 1 26 SER N N 13.277 -7.039 -4.233 1.00 . A A . 26 SER N 1 1 10 5973 1 1 26 SER O O 13.996 -9.361 -1.646 1.00 . A A . 26 SER O 1 1 10 5974 1 1 26 SER OG O 15.218 -8.734 -5.786 1.00 . A A . 26 SER OG 1 1 10 5975 1 1 27 VAL C C 12.988 -6.558 0.416 1.00 . A A . 27 VAL C 1 1 10 5976 1 1 27 VAL CA C 14.303 -7.010 -0.213 1.00 . A A . 27 VAL CA 1 1 10 5977 1 1 27 VAL CB C 15.421 -6.025 0.184 1.00 . A A . 27 VAL CB 1 1 10 5978 1 1 27 VAL CG1 C 15.117 -4.628 -0.335 1.00 . A A . 27 VAL CG1 1 1 10 5979 1 1 27 VAL CG2 C 15.613 -6.012 1.694 1.00 . A A . 27 VAL CG2 1 1 10 5980 1 1 27 VAL H H 14.208 -6.305 -2.206 1.00 . A A . 27 VAL H 1 1 10 5981 1 1 27 VAL HA H 14.558 -7.986 0.174 1.00 . A A . 27 VAL HA 1 1 10 5982 1 1 27 VAL HB H 16.343 -6.359 -0.270 1.00 . A A . 27 VAL HB 1 1 10 5983 1 1 27 VAL HG11 H 14.116 -4.346 -0.043 1.00 . A A . 27 VAL HG11 1 1 10 5984 1 1 27 VAL HG12 H 15.825 -3.927 0.082 1.00 . A A . 27 VAL HG12 1 1 10 5985 1 1 27 VAL HG13 H 15.193 -4.620 -1.412 1.00 . A A . 27 VAL HG13 1 1 10 5986 1 1 27 VAL HG21 H 15.286 -6.955 2.107 1.00 . A A . 27 VAL HG21 1 1 10 5987 1 1 27 VAL HG22 H 16.657 -5.861 1.923 1.00 . A A . 27 VAL HG22 1 1 10 5988 1 1 27 VAL HG23 H 15.030 -5.210 2.124 1.00 . A A . 27 VAL HG23 1 1 10 5989 1 1 27 VAL N N 14.182 -7.119 -1.661 1.00 . A A . 27 VAL N 1 1 10 5990 1 1 27 VAL O O 12.677 -6.915 1.552 1.00 . A A . 27 VAL O 1 1 10 5991 1 1 28 SER C C 9.798 -6.176 -0.287 1.00 . A A . 28 SER C 1 1 10 5992 1 1 28 SER CA C 10.941 -5.268 0.155 1.00 . A A . 28 SER CA 1 1 10 5993 1 1 28 SER CB C 10.702 -3.844 -0.351 1.00 . A A . 28 SER CB 1 1 10 5994 1 1 28 SER H H 12.523 -5.518 -1.227 1.00 . A A . 28 SER H 1 1 10 5995 1 1 28 SER HA H 10.977 -5.255 1.234 1.00 . A A . 28 SER HA 1 1 10 5996 1 1 28 SER HB2 H 10.076 -3.878 -1.231 1.00 . A A . 28 SER HB2 1 1 10 5997 1 1 28 SER HB3 H 10.209 -3.269 0.419 1.00 . A A . 28 SER HB3 1 1 10 5998 1 1 28 SER HG H 12.365 -2.921 0.118 1.00 . A A . 28 SER HG 1 1 10 5999 1 1 28 SER N N 12.221 -5.769 -0.330 1.00 . A A . 28 SER N 1 1 10 6000 1 1 28 SER O O 9.409 -6.177 -1.455 1.00 . A A . 28 SER O 1 1 10 6001 1 1 28 SER OG O 11.924 -3.209 -0.685 1.00 . A A . 28 SER OG 1 1 10 6002 1 1 29 SER C C 6.913 -7.472 1.143 1.00 . A A . 29 SER C 1 1 10 6003 1 1 29 SER CA C 8.164 -7.860 0.362 1.00 . A A . 29 SER CA 1 1 10 6004 1 1 29 SER CB C 8.564 -9.298 0.700 1.00 . A A . 29 SER CB 1 1 10 6005 1 1 29 SER H H 9.617 -6.902 1.567 1.00 . A A . 29 SER H 1 1 10 6006 1 1 29 SER HA H 7.950 -7.794 -0.694 1.00 . A A . 29 SER HA 1 1 10 6007 1 1 29 SER HB2 H 8.990 -9.327 1.691 1.00 . A A . 29 SER HB2 1 1 10 6008 1 1 29 SER HB3 H 7.689 -9.930 0.665 1.00 . A A . 29 SER HB3 1 1 10 6009 1 1 29 SER HG H 10.200 -9.128 -0.365 1.00 . A A . 29 SER HG 1 1 10 6010 1 1 29 SER N N 9.264 -6.947 0.654 1.00 . A A . 29 SER N 1 1 10 6011 1 1 29 SER O O 6.109 -8.328 1.513 1.00 . A A . 29 SER O 1 1 10 6012 1 1 29 SER OG O 9.521 -9.791 -0.222 1.00 . A A . 29 SER OG 1 1 10 6013 1 1 30 HIS C C 4.303 -6.007 1.398 1.00 . A A . 30 HIS C 1 1 10 6014 1 1 30 HIS CA C 5.600 -5.673 2.126 1.00 . A A . 30 HIS CA 1 1 10 6015 1 1 30 HIS CB C 5.714 -4.161 2.324 1.00 . A A . 30 HIS CB 1 1 10 6016 1 1 30 HIS CD2 C 8.184 -3.396 2.108 1.00 . A A . 30 HIS CD2 1 1 10 6017 1 1 30 HIS CE1 C 8.635 -3.167 4.241 1.00 . A A . 30 HIS CE1 1 1 10 6018 1 1 30 HIS CG C 7.063 -3.718 2.798 1.00 . A A . 30 HIS CG 1 1 10 6019 1 1 30 HIS H H 7.429 -5.542 1.069 1.00 . A A . 30 HIS H 1 1 10 6020 1 1 30 HIS HA H 5.590 -6.154 3.093 1.00 . A A . 30 HIS HA 1 1 10 6021 1 1 30 HIS HB2 H 5.514 -3.666 1.385 1.00 . A A . 30 HIS HB2 1 1 10 6022 1 1 30 HIS HB3 H 4.984 -3.844 3.054 1.00 . A A . 30 HIS HB3 1 1 10 6023 1 1 30 HIS HD1 H 6.775 -3.724 4.885 1.00 . A A . 30 HIS HD1 1 1 10 6024 1 1 30 HIS HD2 H 8.299 -3.404 1.033 1.00 . A A . 30 HIS HD2 1 1 10 6025 1 1 30 HIS HE1 H 9.156 -2.966 5.165 1.00 . A A . 30 HIS HE1 1 1 10 6026 1 1 30 HIS HE2 H 10.084 -2.864 2.825 1.00 . A A . 30 HIS HE2 1 1 10 6027 1 1 30 HIS N N 6.754 -6.175 1.389 1.00 . A A . 30 HIS N 1 1 10 6028 1 1 30 HIS ND1 N 7.380 -3.565 4.131 1.00 . A A . 30 HIS ND1 1 1 10 6029 1 1 30 HIS NE2 N 9.145 -3.058 3.028 1.00 . A A . 30 HIS NE2 1 1 10 6030 1 1 30 HIS O O 4.306 -6.734 0.405 1.00 . A A . 30 HIS O 1 1 10 6031 1 1 31 TYR C C 0.861 -4.706 1.806 1.00 . A A . 31 TYR C 1 1 10 6032 1 1 31 TYR CA C 1.889 -5.709 1.294 1.00 . A A . 31 TYR CA 1 1 10 6033 1 1 31 TYR CB C 1.420 -7.134 1.594 1.00 . A A . 31 TYR CB 1 1 10 6034 1 1 31 TYR CD1 C 2.978 -9.046 1.055 1.00 . A A . 31 TYR CD1 1 1 10 6035 1 1 31 TYR CD2 C 1.514 -8.271 -0.659 1.00 . A A . 31 TYR CD2 1 1 10 6036 1 1 31 TYR CE1 C 3.494 -9.994 0.192 1.00 . A A . 31 TYR CE1 1 1 10 6037 1 1 31 TYR CE2 C 2.024 -9.216 -1.528 1.00 . A A . 31 TYR CE2 1 1 10 6038 1 1 31 TYR CG C 1.981 -8.170 0.646 1.00 . A A . 31 TYR CG 1 1 10 6039 1 1 31 TYR CZ C 3.014 -10.075 -1.098 1.00 . A A . 31 TYR CZ 1 1 10 6040 1 1 31 TYR H H 3.257 -4.898 2.691 1.00 . A A . 31 TYR H 1 1 10 6041 1 1 31 TYR HA H 1.990 -5.590 0.226 1.00 . A A . 31 TYR HA 1 1 10 6042 1 1 31 TYR HB2 H 1.723 -7.403 2.595 1.00 . A A . 31 TYR HB2 1 1 10 6043 1 1 31 TYR HB3 H 0.342 -7.172 1.528 1.00 . A A . 31 TYR HB3 1 1 10 6044 1 1 31 TYR HD1 H 3.352 -8.981 2.067 1.00 . A A . 31 TYR HD1 1 1 10 6045 1 1 31 TYR HD2 H 0.739 -7.596 -0.993 1.00 . A A . 31 TYR HD2 1 1 10 6046 1 1 31 TYR HE1 H 4.268 -10.667 0.529 1.00 . A A . 31 TYR HE1 1 1 10 6047 1 1 31 TYR HE2 H 1.648 -9.279 -2.539 1.00 . A A . 31 TYR HE2 1 1 10 6048 1 1 31 TYR HH H 2.806 -11.533 -2.334 1.00 . A A . 31 TYR HH 1 1 10 6049 1 1 31 TYR N N 3.195 -5.469 1.898 1.00 . A A . 31 TYR N 1 1 10 6050 1 1 31 TYR O O 1.003 -4.160 2.901 1.00 . A A . 31 TYR O 1 1 10 6051 1 1 31 TYR OH O 3.525 -11.017 -1.961 1.00 . A A . 31 TYR OH 1 1 10 6052 1 1 32 CYS C C -2.345 -4.244 2.133 1.00 . A A . 32 CYS C 1 1 10 6053 1 1 32 CYS CA C -1.226 -3.530 1.382 1.00 . A A . 32 CYS CA 1 1 10 6054 1 1 32 CYS CB C -1.788 -2.838 0.138 1.00 . A A . 32 CYS CB 1 1 10 6055 1 1 32 CYS H H -0.234 -4.932 0.149 1.00 . A A . 32 CYS H 1 1 10 6056 1 1 32 CYS HA H -0.791 -2.785 2.032 1.00 . A A . 32 CYS HA 1 1 10 6057 1 1 32 CYS HB2 H -1.169 -3.084 -0.711 1.00 . A A . 32 CYS HB2 1 1 10 6058 1 1 32 CYS HB3 H -2.793 -3.191 -0.041 1.00 . A A . 32 CYS HB3 1 1 10 6059 1 1 32 CYS N N -0.175 -4.467 1.009 1.00 . A A . 32 CYS N 1 1 10 6060 1 1 32 CYS O O -2.825 -5.291 1.700 1.00 . A A . 32 CYS O 1 1 10 6061 1 1 32 CYS SG S -1.853 -1.021 0.264 1.00 . A A . 32 CYS SG 1 1 10 6062 1 1 33 THR C C -5.175 -3.644 3.715 1.00 . A A . 33 THR C 1 1 10 6063 1 1 33 THR CA C -3.820 -4.253 4.067 1.00 . A A . 33 THR CA 1 1 10 6064 1 1 33 THR CB C -3.526 -4.049 5.554 1.00 . A A . 33 THR CB 1 1 10 6065 1 1 33 THR CG2 C -2.092 -4.352 5.927 1.00 . A A . 33 THR CG2 1 1 10 6066 1 1 33 THR H H -2.335 -2.835 3.551 1.00 . A A . 33 THR H 1 1 10 6067 1 1 33 THR HA H -3.851 -5.312 3.859 1.00 . A A . 33 THR HA 1 1 10 6068 1 1 33 THR HB H -4.164 -4.705 6.130 1.00 . A A . 33 THR HB 1 1 10 6069 1 1 33 THR HG1 H -3.191 -2.121 5.491 1.00 . A A . 33 THR HG1 1 1 10 6070 1 1 33 THR HG21 H -1.709 -5.131 5.284 1.00 . A A . 33 THR HG21 1 1 10 6071 1 1 33 THR HG22 H -1.493 -3.461 5.808 1.00 . A A . 33 THR HG22 1 1 10 6072 1 1 33 THR HG23 H -2.048 -4.680 6.955 1.00 . A A . 33 THR HG23 1 1 10 6073 1 1 33 THR N N -2.756 -3.670 3.258 1.00 . A A . 33 THR N 1 1 10 6074 1 1 33 THR O O -6.133 -3.759 4.479 1.00 . A A . 33 THR O 1 1 10 6075 1 1 33 THR OG1 O -3.798 -2.714 5.940 1.00 . A A . 33 THR OG1 1 1 10 6076 1 1 34 GLY C C -7.137 -1.531 3.207 1.00 . A A . 34 GLY C 1 1 10 6077 1 1 34 GLY CA C -6.495 -2.380 2.124 1.00 . A A . 34 GLY CA 1 1 10 6078 1 1 34 GLY H H -4.456 -2.936 1.983 1.00 . A A . 34 GLY H 1 1 10 6079 1 1 34 GLY HA2 H -7.187 -3.158 1.836 1.00 . A A . 34 GLY HA2 1 1 10 6080 1 1 34 GLY HA3 H -6.296 -1.755 1.266 1.00 . A A . 34 GLY HA3 1 1 10 6081 1 1 34 GLY N N -5.251 -2.995 2.554 1.00 . A A . 34 GLY N 1 1 10 6082 1 1 34 GLY O O -8.356 -1.358 3.227 1.00 . A A . 34 GLY O 1 1 10 6083 1 1 35 ARG C C -6.187 1.218 5.157 1.00 . A A . 35 ARG C 1 1 10 6084 1 1 35 ARG CA C -6.813 -0.171 5.200 1.00 . A A . 35 ARG CA 1 1 10 6085 1 1 35 ARG CB C -6.523 -0.833 6.548 1.00 . A A . 35 ARG CB 1 1 10 6086 1 1 35 ARG CD C -6.995 -0.555 9.000 1.00 . A A . 35 ARG CD 1 1 10 6087 1 1 35 ARG CG C -7.586 -0.564 7.600 1.00 . A A . 35 ARG CG 1 1 10 6088 1 1 35 ARG CZ C -7.767 -0.985 11.300 1.00 . A A . 35 ARG CZ 1 1 10 6089 1 1 35 ARG H H -5.355 -1.178 4.041 1.00 . A A . 35 ARG H 1 1 10 6090 1 1 35 ARG HA H -7.880 -0.073 5.081 1.00 . A A . 35 ARG HA 1 1 10 6091 1 1 35 ARG HB2 H -6.452 -1.901 6.404 1.00 . A A . 35 ARG HB2 1 1 10 6092 1 1 35 ARG HB3 H -5.578 -0.466 6.920 1.00 . A A . 35 ARG HB3 1 1 10 6093 1 1 35 ARG HD2 H -6.082 -1.131 8.995 1.00 . A A . 35 ARG HD2 1 1 10 6094 1 1 35 ARG HD3 H -6.775 0.465 9.277 1.00 . A A . 35 ARG HD3 1 1 10 6095 1 1 35 ARG HE H -8.671 -1.645 9.648 1.00 . A A . 35 ARG HE 1 1 10 6096 1 1 35 ARG HG2 H -8.037 0.397 7.404 1.00 . A A . 35 ARG HG2 1 1 10 6097 1 1 35 ARG HG3 H -8.340 -1.336 7.541 1.00 . A A . 35 ARG HG3 1 1 10 6098 1 1 35 ARG HH11 H -6.083 0.128 11.176 1.00 . A A . 35 ARG HH11 1 1 10 6099 1 1 35 ARG HH12 H -6.647 -0.188 12.783 1.00 . A A . 35 ARG HH12 1 1 10 6100 1 1 35 ARG HH21 H -9.415 -2.062 11.760 1.00 . A A . 35 ARG HH21 1 1 10 6101 1 1 35 ARG HH22 H -8.538 -1.432 13.114 1.00 . A A . 35 ARG HH22 1 1 10 6102 1 1 35 ARG N N -6.316 -1.003 4.109 1.00 . A A . 35 ARG N 1 1 10 6103 1 1 35 ARG NE N -7.910 -1.127 9.985 1.00 . A A . 35 ARG NE 1 1 10 6104 1 1 35 ARG NH1 N -6.749 -0.292 11.793 1.00 . A A . 35 ARG NH1 1 1 10 6105 1 1 35 ARG NH2 N -8.645 -1.538 12.126 1.00 . A A . 35 ARG NH2 1 1 10 6106 1 1 35 ARG O O -6.864 2.223 5.372 1.00 . A A . 35 ARG O 1 1 10 6107 1 1 36 SER C C -3.160 2.518 3.665 1.00 . A A . 36 SER C 1 1 10 6108 1 1 36 SER CA C -4.168 2.531 4.809 1.00 . A A . 36 SER CA 1 1 10 6109 1 1 36 SER CB C -3.453 2.808 6.132 1.00 . A A . 36 SER CB 1 1 10 6110 1 1 36 SER H H -4.407 0.429 4.719 1.00 . A A . 36 SER H 1 1 10 6111 1 1 36 SER HA H -4.889 3.314 4.628 1.00 . A A . 36 SER HA 1 1 10 6112 1 1 36 SER HB2 H -3.127 1.874 6.566 1.00 . A A . 36 SER HB2 1 1 10 6113 1 1 36 SER HB3 H -2.595 3.439 5.949 1.00 . A A . 36 SER HB3 1 1 10 6114 1 1 36 SER HG H -4.862 2.811 7.493 1.00 . A A . 36 SER HG 1 1 10 6115 1 1 36 SER N N -4.890 1.265 4.880 1.00 . A A . 36 SER N 1 1 10 6116 1 1 36 SER O O -2.604 1.473 3.326 1.00 . A A . 36 SER O 1 1 10 6117 1 1 36 SER OG O -4.312 3.462 7.050 1.00 . A A . 36 SER OG 1 1 10 6118 1 1 37 CYS C C -0.542 3.677 2.464 1.00 . A A . 37 CYS C 1 1 10 6119 1 1 37 CYS CA C -1.981 3.806 1.970 1.00 . A A . 37 CYS CA 1 1 10 6120 1 1 37 CYS CB C -2.166 5.144 1.253 1.00 . A A . 37 CYS CB 1 1 10 6121 1 1 37 CYS H H -3.397 4.484 3.390 1.00 . A A . 37 CYS H 1 1 10 6122 1 1 37 CYS HA H -2.182 3.005 1.275 1.00 . A A . 37 CYS HA 1 1 10 6123 1 1 37 CYS HB2 H -2.175 5.939 1.984 1.00 . A A . 37 CYS HB2 1 1 10 6124 1 1 37 CYS HB3 H -1.340 5.296 0.574 1.00 . A A . 37 CYS HB3 1 1 10 6125 1 1 37 CYS N N -2.926 3.685 3.075 1.00 . A A . 37 CYS N 1 1 10 6126 1 1 37 CYS O O 0.363 3.371 1.689 1.00 . A A . 37 CYS O 1 1 10 6127 1 1 37 CYS SG S -3.706 5.266 0.286 1.00 . A A . 37 CYS SG 1 1 10 6128 1 1 38 GLU C C 1.433 2.365 4.465 1.00 . A A . 38 GLU C 1 1 10 6129 1 1 38 GLU CA C 0.994 3.821 4.345 1.00 . A A . 38 GLU CA 1 1 10 6130 1 1 38 GLU CB C 1.014 4.488 5.721 1.00 . A A . 38 GLU CB 1 1 10 6131 1 1 38 GLU CD C 2.107 6.474 6.835 1.00 . A A . 38 GLU CD 1 1 10 6132 1 1 38 GLU CG C 2.317 5.208 6.029 1.00 . A A . 38 GLU CG 1 1 10 6133 1 1 38 GLU H H -1.096 4.155 4.327 1.00 . A A . 38 GLU H 1 1 10 6134 1 1 38 GLU HA H 1.681 4.339 3.692 1.00 . A A . 38 GLU HA 1 1 10 6135 1 1 38 GLU HB2 H 0.210 5.207 5.772 1.00 . A A . 38 GLU HB2 1 1 10 6136 1 1 38 GLU HB3 H 0.858 3.732 6.477 1.00 . A A . 38 GLU HB3 1 1 10 6137 1 1 38 GLU HG2 H 2.956 4.544 6.592 1.00 . A A . 38 GLU HG2 1 1 10 6138 1 1 38 GLU HG3 H 2.799 5.466 5.098 1.00 . A A . 38 GLU HG3 1 1 10 6139 1 1 38 GLU N N -0.337 3.913 3.756 1.00 . A A . 38 GLU N 1 1 10 6140 1 1 38 GLU O O 1.007 1.651 5.372 1.00 . A A . 38 GLU O 1 1 10 6141 1 1 38 GLU OE1 O 1.723 6.368 8.019 1.00 . A A . 38 GLU OE1 1 1 10 6142 1 1 38 GLU OE2 O 2.326 7.573 6.282 1.00 . A A . 38 GLU OE2 1 1 10 6143 1 1 39 CYS C C 3.473 0.228 4.865 1.00 . A A . 39 CYS C 1 1 10 6144 1 1 39 CYS CA C 2.782 0.559 3.542 1.00 . A A . 39 CYS CA 1 1 10 6145 1 1 39 CYS CB C 3.753 0.347 2.378 1.00 . A A . 39 CYS CB 1 1 10 6146 1 1 39 CYS H H 2.589 2.548 2.843 1.00 . A A . 39 CYS H 1 1 10 6147 1 1 39 CYS HA H 1.935 -0.098 3.417 1.00 . A A . 39 CYS HA 1 1 10 6148 1 1 39 CYS HB2 H 3.669 1.179 1.694 1.00 . A A . 39 CYS HB2 1 1 10 6149 1 1 39 CYS HB3 H 4.762 0.305 2.761 1.00 . A A . 39 CYS HB3 1 1 10 6150 1 1 39 CYS N N 2.286 1.931 3.542 1.00 . A A . 39 CYS N 1 1 10 6151 1 1 39 CYS O O 4.098 1.091 5.481 1.00 . A A . 39 CYS O 1 1 10 6152 1 1 39 CYS SG S 3.454 -1.180 1.429 1.00 . A A . 39 CYS SG 1 1 10 6153 1 1 40 PRO C C 5.475 -1.144 6.633 1.00 . A A . 40 PRO C 1 1 10 6154 1 1 40 PRO CA C 3.987 -1.473 6.575 1.00 . A A . 40 PRO CA 1 1 10 6155 1 1 40 PRO CB C 3.776 -2.989 6.566 1.00 . A A . 40 PRO CB 1 1 10 6156 1 1 40 PRO CD C 2.642 -2.128 4.648 1.00 . A A . 40 PRO CD 1 1 10 6157 1 1 40 PRO CG C 2.586 -3.203 5.697 1.00 . A A . 40 PRO CG 1 1 10 6158 1 1 40 PRO HA H 3.491 -1.042 7.432 1.00 . A A . 40 PRO HA 1 1 10 6159 1 1 40 PRO HB2 H 4.653 -3.475 6.163 1.00 . A A . 40 PRO HB2 1 1 10 6160 1 1 40 PRO HB3 H 3.596 -3.336 7.573 1.00 . A A . 40 PRO HB3 1 1 10 6161 1 1 40 PRO HD2 H 3.184 -2.475 3.780 1.00 . A A . 40 PRO HD2 1 1 10 6162 1 1 40 PRO HD3 H 1.646 -1.816 4.372 1.00 . A A . 40 PRO HD3 1 1 10 6163 1 1 40 PRO HG2 H 2.637 -4.179 5.237 1.00 . A A . 40 PRO HG2 1 1 10 6164 1 1 40 PRO HG3 H 1.682 -3.108 6.281 1.00 . A A . 40 PRO HG3 1 1 10 6165 1 1 40 PRO N N 3.369 -1.034 5.319 1.00 . A A . 40 PRO N 1 1 10 6166 1 1 40 PRO O O 6.041 -0.612 5.679 1.00 . A A . 40 PRO O 1 1 10 6167 1 1 41 SER C C 8.269 -2.485 8.308 1.00 . A A . 41 SER C 1 1 10 6168 1 1 41 SER CA C 7.525 -1.204 7.944 1.00 . A A . 41 SER CA 1 1 10 6169 1 1 41 SER CB C 7.735 -0.151 9.034 1.00 . A A . 41 SER CB 1 1 10 6170 1 1 41 SER H H 5.596 -1.887 8.485 1.00 . A A . 41 SER H 1 1 10 6171 1 1 41 SER HA H 7.917 -0.827 7.012 1.00 . A A . 41 SER HA 1 1 10 6172 1 1 41 SER HB2 H 8.743 0.232 8.972 1.00 . A A . 41 SER HB2 1 1 10 6173 1 1 41 SER HB3 H 7.033 0.657 8.891 1.00 . A A . 41 SER HB3 1 1 10 6174 1 1 41 SER HG H 8.378 -1.000 10.678 1.00 . A A . 41 SER HG 1 1 10 6175 1 1 41 SER N N 6.102 -1.465 7.760 1.00 . A A . 41 SER N 1 1 10 6176 1 1 41 SER O O 9.261 -2.453 9.036 1.00 . A A . 41 SER O 1 1 10 6177 1 1 41 SER OG O 7.537 -0.705 10.324 1.00 . A A . 41 SER OG 1 1 10 6178 1 1 42 TYR C C 8.822 -5.589 6.769 1.00 . A A . 42 TYR C 1 1 10 6179 1 1 42 TYR CA C 8.401 -4.904 8.067 1.00 . A A . 42 TYR CA 1 1 10 6180 1 1 42 TYR CB C 7.435 -5.803 8.841 1.00 . A A . 42 TYR CB 1 1 10 6181 1 1 42 TYR CD1 C 5.383 -4.765 9.882 1.00 . A A . 42 TYR CD1 1 1 10 6182 1 1 42 TYR CD2 C 7.405 -4.767 11.143 1.00 . A A . 42 TYR CD2 1 1 10 6183 1 1 42 TYR CE1 C 4.732 -4.121 10.917 1.00 . A A . 42 TYR CE1 1 1 10 6184 1 1 42 TYR CE2 C 6.762 -4.123 12.183 1.00 . A A . 42 TYR CE2 1 1 10 6185 1 1 42 TYR CG C 6.728 -5.098 9.977 1.00 . A A . 42 TYR CG 1 1 10 6186 1 1 42 TYR CZ C 5.426 -3.802 12.065 1.00 . A A . 42 TYR CZ 1 1 10 6187 1 1 42 TYR H H 6.989 -3.572 7.223 1.00 . A A . 42 TYR H 1 1 10 6188 1 1 42 TYR HA H 9.280 -4.732 8.671 1.00 . A A . 42 TYR HA 1 1 10 6189 1 1 42 TYR HB2 H 6.683 -6.178 8.164 1.00 . A A . 42 TYR HB2 1 1 10 6190 1 1 42 TYR HB3 H 7.985 -6.636 9.257 1.00 . A A . 42 TYR HB3 1 1 10 6191 1 1 42 TYR HD1 H 4.842 -5.016 8.981 1.00 . A A . 42 TYR HD1 1 1 10 6192 1 1 42 TYR HD2 H 8.452 -5.018 11.233 1.00 . A A . 42 TYR HD2 1 1 10 6193 1 1 42 TYR HE1 H 3.686 -3.870 10.825 1.00 . A A . 42 TYR HE1 1 1 10 6194 1 1 42 TYR HE2 H 7.306 -3.873 13.082 1.00 . A A . 42 TYR HE2 1 1 10 6195 1 1 42 TYR HH H 4.784 -2.214 12.939 1.00 . A A . 42 TYR HH 1 1 10 6196 1 1 42 TYR N N 7.783 -3.611 7.797 1.00 . A A . 42 TYR N 1 1 10 6197 1 1 42 TYR O O 8.060 -6.365 6.192 1.00 . A A . 42 TYR O 1 1 10 6198 1 1 42 TYR OH O 4.782 -3.161 13.099 1.00 . A A . 42 TYR OH 1 1 10 6199 1 1 43 PRO C C 10.444 -7.424 5.046 1.00 . A A . 43 PRO C 1 1 10 6200 1 1 43 PRO CA C 10.566 -5.904 5.054 1.00 . A A . 43 PRO CA 1 1 10 6201 1 1 43 PRO CB C 12.038 -5.485 5.048 1.00 . A A . 43 PRO CB 1 1 10 6202 1 1 43 PRO CD C 11.021 -4.395 6.916 1.00 . A A . 43 PRO CD 1 1 10 6203 1 1 43 PRO CG C 12.080 -4.238 5.860 1.00 . A A . 43 PRO CG 1 1 10 6204 1 1 43 PRO HA H 10.070 -5.500 4.183 1.00 . A A . 43 PRO HA 1 1 10 6205 1 1 43 PRO HB2 H 12.638 -6.267 5.491 1.00 . A A . 43 PRO HB2 1 1 10 6206 1 1 43 PRO HB3 H 12.360 -5.306 4.034 1.00 . A A . 43 PRO HB3 1 1 10 6207 1 1 43 PRO HD2 H 11.441 -4.832 7.810 1.00 . A A . 43 PRO HD2 1 1 10 6208 1 1 43 PRO HD3 H 10.565 -3.442 7.139 1.00 . A A . 43 PRO HD3 1 1 10 6209 1 1 43 PRO HG2 H 13.052 -4.130 6.318 1.00 . A A . 43 PRO HG2 1 1 10 6210 1 1 43 PRO HG3 H 11.861 -3.385 5.235 1.00 . A A . 43 PRO HG3 1 1 10 6211 1 1 43 PRO N N 10.047 -5.310 6.291 1.00 . A A . 43 PRO N 1 1 10 6212 1 1 43 PRO O O 11.192 -8.120 5.731 1.00 . A A . 43 PRO O 1 1 10 6213 1 1 44 GLY C C 10.472 -10.084 3.556 1.00 . A A . 44 GLY C 1 1 10 6214 1 1 44 GLY CA C 9.293 -9.366 4.183 1.00 . A A . 44 GLY CA 1 1 10 6215 1 1 44 GLY H H 8.929 -7.328 3.742 1.00 . A A . 44 GLY H 1 1 10 6216 1 1 44 GLY HA2 H 8.411 -9.561 3.591 1.00 . A A . 44 GLY HA2 1 1 10 6217 1 1 44 GLY HA3 H 9.137 -9.755 5.179 1.00 . A A . 44 GLY HA3 1 1 10 6218 1 1 44 GLY N N 9.495 -7.932 4.266 1.00 . A A . 44 GLY N 1 1 10 6219 1 1 44 GLY O O 10.243 -11.012 2.752 1.00 . A A . 44 GLY O 1 1 10 6220 1 1 44 GLY OXT O 11.624 -9.717 3.868 1.00 . A A . 44 GLY OXT 1 1 11 6221 1 1 1 ALA C C -14.330 11.531 4.667 1.00 . A A . 1 ALA C 1 1 11 6222 1 1 1 ALA CA C -15.383 12.623 4.820 1.00 . A A . 1 ALA CA 1 1 11 6223 1 1 1 ALA CB C -14.879 13.929 4.223 1.00 . A A . 1 ALA CB 1 1 11 6224 1 1 1 ALA H1 H -15.971 11.884 6.647 1.00 . A A . 1 ALA H1 1 1 11 6225 1 1 1 ALA H2 H -14.928 13.244 6.727 1.00 . A A . 1 ALA H2 1 1 11 6226 1 1 1 ALA H3 H -16.573 13.447 6.282 1.00 . A A . 1 ALA H3 1 1 11 6227 1 1 1 ALA HA H -16.271 12.329 4.280 1.00 . A A . 1 ALA HA 1 1 11 6228 1 1 1 ALA HB1 H -14.270 14.446 4.950 1.00 . A A . 1 ALA HB1 1 1 11 6229 1 1 1 ALA HB2 H -14.288 13.718 3.344 1.00 . A A . 1 ALA HB2 1 1 11 6230 1 1 1 ALA HB3 H -15.720 14.549 3.951 1.00 . A A . 1 ALA HB3 1 1 11 6231 1 1 1 ALA N N -15.746 12.817 6.248 1.00 . A A . 1 ALA N 1 1 11 6232 1 1 1 ALA O O -13.617 11.205 5.615 1.00 . A A . 1 ALA O 1 1 11 6233 1 1 2 MET C C -12.075 10.459 2.419 1.00 . A A . 2 MET C 1 1 11 6234 1 1 2 MET CA C -13.273 9.912 3.188 1.00 . A A . 2 MET CA 1 1 11 6235 1 1 2 MET CB C -13.933 8.785 2.392 1.00 . A A . 2 MET CB 1 1 11 6236 1 1 2 MET CE C -17.449 7.158 2.198 1.00 . A A . 2 MET CE 1 1 11 6237 1 1 2 MET CG C -15.008 8.041 3.168 1.00 . A A . 2 MET CG 1 1 11 6238 1 1 2 MET H H -14.835 11.272 2.750 1.00 . A A . 2 MET H 1 1 11 6239 1 1 2 MET HA H -12.930 9.520 4.134 1.00 . A A . 2 MET HA 1 1 11 6240 1 1 2 MET HB2 H -14.385 9.203 1.505 1.00 . A A . 2 MET HB2 1 1 11 6241 1 1 2 MET HB3 H -13.174 8.075 2.099 1.00 . A A . 2 MET HB3 1 1 11 6242 1 1 2 MET HE1 H -17.524 8.234 2.263 1.00 . A A . 2 MET HE1 1 1 11 6243 1 1 2 MET HE2 H -17.899 6.821 1.276 1.00 . A A . 2 MET HE2 1 1 11 6244 1 1 2 MET HE3 H -17.963 6.710 3.035 1.00 . A A . 2 MET HE3 1 1 11 6245 1 1 2 MET HG2 H -14.571 7.646 4.073 1.00 . A A . 2 MET HG2 1 1 11 6246 1 1 2 MET HG3 H -15.794 8.736 3.424 1.00 . A A . 2 MET HG3 1 1 11 6247 1 1 2 MET N N -14.239 10.969 3.466 1.00 . A A . 2 MET N 1 1 11 6248 1 1 2 MET O O -10.943 10.019 2.619 1.00 . A A . 2 MET O 1 1 11 6249 1 1 2 MET SD S -15.724 6.678 2.230 1.00 . A A . 2 MET SD 1 1 11 6250 1 1 3 ASP C C -10.580 10.984 -0.128 1.00 . A A . 3 ASP C 1 1 11 6251 1 1 3 ASP CA C -11.275 12.029 0.739 1.00 . A A . 3 ASP CA 1 1 11 6252 1 1 3 ASP CB C -10.253 12.717 1.646 1.00 . A A . 3 ASP CB 1 1 11 6253 1 1 3 ASP CG C -9.708 13.994 1.038 1.00 . A A . 3 ASP CG 1 1 11 6254 1 1 3 ASP H H -13.255 11.730 1.424 1.00 . A A . 3 ASP H 1 1 11 6255 1 1 3 ASP HA H -11.728 12.768 0.097 1.00 . A A . 3 ASP HA 1 1 11 6256 1 1 3 ASP HB2 H -10.722 12.961 2.587 1.00 . A A . 3 ASP HB2 1 1 11 6257 1 1 3 ASP HB3 H -9.427 12.043 1.824 1.00 . A A . 3 ASP HB3 1 1 11 6258 1 1 3 ASP N N -12.332 11.421 1.539 1.00 . A A . 3 ASP N 1 1 11 6259 1 1 3 ASP O O -10.828 9.786 0.008 1.00 . A A . 3 ASP O 1 1 11 6260 1 1 3 ASP OD1 O -10.479 14.969 0.915 1.00 . A A . 3 ASP OD1 1 1 11 6261 1 1 3 ASP OD2 O -8.510 14.020 0.684 1.00 . A A . 3 ASP OD2 1 1 11 6262 1 1 4 CYS C C -7.544 10.357 -1.426 1.00 . A A . 4 CYS C 1 1 11 6263 1 1 4 CYS CA C -8.978 10.551 -1.909 1.00 . A A . 4 CYS CA 1 1 11 6264 1 1 4 CYS CB C -8.980 11.104 -3.335 1.00 . A A . 4 CYS CB 1 1 11 6265 1 1 4 CYS H H -9.554 12.412 -1.080 1.00 . A A . 4 CYS H 1 1 11 6266 1 1 4 CYS HA H -9.480 9.595 -1.902 1.00 . A A . 4 CYS HA 1 1 11 6267 1 1 4 CYS HB2 H -8.862 12.176 -3.298 1.00 . A A . 4 CYS HB2 1 1 11 6268 1 1 4 CYS HB3 H -8.151 10.675 -3.880 1.00 . A A . 4 CYS HB3 1 1 11 6269 1 1 4 CYS N N -9.709 11.446 -1.019 1.00 . A A . 4 CYS N 1 1 11 6270 1 1 4 CYS O O -6.739 11.288 -1.449 1.00 . A A . 4 CYS O 1 1 11 6271 1 1 4 CYS SG S -10.504 10.747 -4.268 1.00 . A A . 4 CYS SG 1 1 11 6272 1 1 5 THR C C -4.855 9.000 -1.602 1.00 . A A . 5 THR C 1 1 11 6273 1 1 5 THR CA C -5.895 8.823 -0.501 1.00 . A A . 5 THR CA 1 1 11 6274 1 1 5 THR CB C -5.853 7.389 0.030 1.00 . A A . 5 THR CB 1 1 11 6275 1 1 5 THR CG2 C -6.745 7.169 1.232 1.00 . A A . 5 THR CG2 1 1 11 6276 1 1 5 THR H H -7.918 8.441 -0.996 1.00 . A A . 5 THR H 1 1 11 6277 1 1 5 THR HA H -5.668 9.502 0.307 1.00 . A A . 5 THR HA 1 1 11 6278 1 1 5 THR HB H -4.839 7.154 0.323 1.00 . A A . 5 THR HB 1 1 11 6279 1 1 5 THR HG1 H -5.809 6.688 -1.799 1.00 . A A . 5 THR HG1 1 1 11 6280 1 1 5 THR HG21 H -7.702 7.639 1.061 1.00 . A A . 5 THR HG21 1 1 11 6281 1 1 5 THR HG22 H -6.887 6.109 1.386 1.00 . A A . 5 THR HG22 1 1 11 6282 1 1 5 THR HG23 H -6.283 7.600 2.107 1.00 . A A . 5 THR HG23 1 1 11 6283 1 1 5 THR N N -7.232 9.141 -0.990 1.00 . A A . 5 THR N 1 1 11 6284 1 1 5 THR O O -5.196 9.148 -2.775 1.00 . A A . 5 THR O 1 1 11 6285 1 1 5 THR OG1 O -6.249 6.471 -0.974 1.00 . A A . 5 THR OG1 1 1 11 6286 1 1 6 THR C C -1.206 8.520 -1.631 1.00 . A A . 6 THR C 1 1 11 6287 1 1 6 THR CA C -2.491 9.143 -2.168 1.00 . A A . 6 THR CA 1 1 11 6288 1 1 6 THR CB C -2.264 10.625 -2.473 1.00 . A A . 6 THR CB 1 1 11 6289 1 1 6 THR CG2 C -3.343 11.228 -3.347 1.00 . A A . 6 THR CG2 1 1 11 6290 1 1 6 THR H H -3.375 8.863 -0.265 1.00 . A A . 6 THR H 1 1 11 6291 1 1 6 THR HA H -2.771 8.636 -3.079 1.00 . A A . 6 THR HA 1 1 11 6292 1 1 6 THR HB H -1.321 10.735 -2.989 1.00 . A A . 6 THR HB 1 1 11 6293 1 1 6 THR HG1 H -1.875 12.260 -1.468 1.00 . A A . 6 THR HG1 1 1 11 6294 1 1 6 THR HG21 H -3.526 10.579 -4.191 1.00 . A A . 6 THR HG21 1 1 11 6295 1 1 6 THR HG22 H -4.251 11.338 -2.773 1.00 . A A . 6 THR HG22 1 1 11 6296 1 1 6 THR HG23 H -3.020 12.196 -3.700 1.00 . A A . 6 THR HG23 1 1 11 6297 1 1 6 THR N N -3.583 8.985 -1.214 1.00 . A A . 6 THR N 1 1 11 6298 1 1 6 THR O O -0.651 8.980 -0.634 1.00 . A A . 6 THR O 1 1 11 6299 1 1 6 THR OG1 O -2.208 11.381 -1.276 1.00 . A A . 6 THR OG1 1 1 11 6300 1 1 7 GLY C C 0.686 5.473 -2.580 1.00 . A A . 7 GLY C 1 1 11 6301 1 1 7 GLY CA C 0.475 6.801 -1.875 1.00 . A A . 7 GLY CA 1 1 11 6302 1 1 7 GLY H H -1.225 7.147 -3.087 1.00 . A A . 7 GLY H 1 1 11 6303 1 1 7 GLY HA2 H 0.424 6.626 -0.810 1.00 . A A . 7 GLY HA2 1 1 11 6304 1 1 7 GLY HA3 H 1.318 7.444 -2.083 1.00 . A A . 7 GLY HA3 1 1 11 6305 1 1 7 GLY N N -0.740 7.470 -2.300 1.00 . A A . 7 GLY N 1 1 11 6306 1 1 7 GLY O O 0.027 5.189 -3.580 1.00 . A A . 7 GLY O 1 1 11 6307 1 1 8 PRO C C 0.860 2.274 -2.327 1.00 . A A . 8 PRO C 1 1 11 6308 1 1 8 PRO CA C 1.902 3.331 -2.679 1.00 . A A . 8 PRO CA 1 1 11 6309 1 1 8 PRO CB C 3.255 2.970 -2.070 1.00 . A A . 8 PRO CB 1 1 11 6310 1 1 8 PRO CD C 2.448 4.897 -0.893 1.00 . A A . 8 PRO CD 1 1 11 6311 1 1 8 PRO CG C 3.250 3.631 -0.734 1.00 . A A . 8 PRO CG 1 1 11 6312 1 1 8 PRO HA H 1.995 3.401 -3.753 1.00 . A A . 8 PRO HA 1 1 11 6313 1 1 8 PRO HB2 H 3.338 1.896 -1.982 1.00 . A A . 8 PRO HB2 1 1 11 6314 1 1 8 PRO HB3 H 4.049 3.350 -2.695 1.00 . A A . 8 PRO HB3 1 1 11 6315 1 1 8 PRO HD2 H 1.836 5.066 -0.020 1.00 . A A . 8 PRO HD2 1 1 11 6316 1 1 8 PRO HD3 H 3.103 5.738 -1.063 1.00 . A A . 8 PRO HD3 1 1 11 6317 1 1 8 PRO HG2 H 2.785 2.982 -0.006 1.00 . A A . 8 PRO HG2 1 1 11 6318 1 1 8 PRO HG3 H 4.262 3.864 -0.437 1.00 . A A . 8 PRO HG3 1 1 11 6319 1 1 8 PRO N N 1.610 4.635 -2.080 1.00 . A A . 8 PRO N 1 1 11 6320 1 1 8 PRO O O 0.506 1.438 -3.159 1.00 . A A . 8 PRO O 1 1 11 6321 1 1 9 CYS C C -1.975 1.608 -1.295 1.00 . A A . 9 CYS C 1 1 11 6322 1 1 9 CYS CA C -0.624 1.350 -0.634 1.00 . A A . 9 CYS CA 1 1 11 6323 1 1 9 CYS CB C -0.761 1.408 0.889 1.00 . A A . 9 CYS CB 1 1 11 6324 1 1 9 CYS H H 0.695 2.999 -0.470 1.00 . A A . 9 CYS H 1 1 11 6325 1 1 9 CYS HA H -0.284 0.365 -0.916 1.00 . A A . 9 CYS HA 1 1 11 6326 1 1 9 CYS HB2 H -0.082 2.153 1.276 1.00 . A A . 9 CYS HB2 1 1 11 6327 1 1 9 CYS HB3 H -1.774 1.685 1.144 1.00 . A A . 9 CYS HB3 1 1 11 6328 1 1 9 CYS N N 0.374 2.312 -1.090 1.00 . A A . 9 CYS N 1 1 11 6329 1 1 9 CYS O O -2.698 0.672 -1.635 1.00 . A A . 9 CYS O 1 1 11 6330 1 1 9 CYS SG S -0.388 -0.166 1.728 1.00 . A A . 9 CYS SG 1 1 11 6331 1 1 10 CYS C C -3.366 3.597 -3.572 1.00 . A A . 10 CYS C 1 1 11 6332 1 1 10 CYS CA C -3.572 3.258 -2.100 1.00 . A A . 10 CYS CA 1 1 11 6333 1 1 10 CYS CB C -4.198 4.446 -1.366 1.00 . A A . 10 CYS CB 1 1 11 6334 1 1 10 CYS H H -1.691 3.583 -1.185 1.00 . A A . 10 CYS H 1 1 11 6335 1 1 10 CYS HA H -4.239 2.413 -2.032 1.00 . A A . 10 CYS HA 1 1 11 6336 1 1 10 CYS HB2 H -5.177 4.637 -1.777 1.00 . A A . 10 CYS HB2 1 1 11 6337 1 1 10 CYS HB3 H -4.295 4.200 -0.318 1.00 . A A . 10 CYS HB3 1 1 11 6338 1 1 10 CYS N N -2.309 2.881 -1.476 1.00 . A A . 10 CYS N 1 1 11 6339 1 1 10 CYS O O -2.285 4.026 -3.974 1.00 . A A . 10 CYS O 1 1 11 6340 1 1 10 CYS SG S -3.239 5.990 -1.486 1.00 . A A . 10 CYS SG 1 1 11 6341 1 1 11 ARG C C -4.245 5.180 -6.056 1.00 . A A . 11 ARG C 1 1 11 6342 1 1 11 ARG CA C -4.333 3.679 -5.800 1.00 . A A . 11 ARG CA 1 1 11 6343 1 1 11 ARG CB C -5.542 3.078 -6.526 1.00 . A A . 11 ARG CB 1 1 11 6344 1 1 11 ARG CD C -6.367 0.745 -6.975 1.00 . A A . 11 ARG CD 1 1 11 6345 1 1 11 ARG CG C -5.246 1.747 -7.200 1.00 . A A . 11 ARG CG 1 1 11 6346 1 1 11 ARG CZ C -5.738 -1.179 -8.379 1.00 . A A . 11 ARG CZ 1 1 11 6347 1 1 11 ARG H H -5.244 3.052 -3.995 1.00 . A A . 11 ARG H 1 1 11 6348 1 1 11 ARG HA H -3.438 3.217 -6.177 1.00 . A A . 11 ARG HA 1 1 11 6349 1 1 11 ARG HB2 H -6.337 2.927 -5.811 1.00 . A A . 11 ARG HB2 1 1 11 6350 1 1 11 ARG HB3 H -5.876 3.773 -7.282 1.00 . A A . 11 ARG HB3 1 1 11 6351 1 1 11 ARG HD2 H -6.727 0.848 -5.962 1.00 . A A . 11 ARG HD2 1 1 11 6352 1 1 11 ARG HD3 H -7.169 0.961 -7.665 1.00 . A A . 11 ARG HD3 1 1 11 6353 1 1 11 ARG HE H -5.748 -1.175 -6.384 1.00 . A A . 11 ARG HE 1 1 11 6354 1 1 11 ARG HG2 H -5.132 1.910 -8.261 1.00 . A A . 11 ARG HG2 1 1 11 6355 1 1 11 ARG HG3 H -4.329 1.346 -6.795 1.00 . A A . 11 ARG HG3 1 1 11 6356 1 1 11 ARG HH11 H -6.269 0.475 -9.414 1.00 . A A . 11 ARG HH11 1 1 11 6357 1 1 11 ARG HH12 H -5.822 -0.891 -10.379 1.00 . A A . 11 ARG HH12 1 1 11 6358 1 1 11 ARG HH21 H -5.160 -2.973 -7.651 1.00 . A A . 11 ARG HH21 1 1 11 6359 1 1 11 ARG HH22 H -5.192 -2.850 -9.378 1.00 . A A . 11 ARG HH22 1 1 11 6360 1 1 11 ARG N N -4.408 3.398 -4.373 1.00 . A A . 11 ARG N 1 1 11 6361 1 1 11 ARG NE N -5.921 -0.631 -7.181 1.00 . A A . 11 ARG NE 1 1 11 6362 1 1 11 ARG NH1 N -5.961 -0.474 -9.481 1.00 . A A . 11 ARG NH1 1 1 11 6363 1 1 11 ARG NH2 N -5.330 -2.437 -8.477 1.00 . A A . 11 ARG NH2 1 1 11 6364 1 1 11 ARG O O -3.153 5.740 -6.144 1.00 . A A . 11 ARG O 1 1 11 6365 1 1 12 GLN C C -6.448 7.947 -5.499 1.00 . A A . 12 GLN C 1 1 11 6366 1 1 12 GLN CA C -5.446 7.262 -6.422 1.00 . A A . 12 GLN CA 1 1 11 6367 1 1 12 GLN CB C -5.817 7.542 -7.881 1.00 . A A . 12 GLN CB 1 1 11 6368 1 1 12 GLN CD C -7.585 7.040 -9.615 1.00 . A A . 12 GLN CD 1 1 11 6369 1 1 12 GLN CG C -6.716 6.485 -8.503 1.00 . A A . 12 GLN CG 1 1 11 6370 1 1 12 GLN H H -6.235 5.327 -6.099 1.00 . A A . 12 GLN H 1 1 11 6371 1 1 12 GLN HA H -4.463 7.664 -6.228 1.00 . A A . 12 GLN HA 1 1 11 6372 1 1 12 GLN HB2 H -6.330 8.490 -7.930 1.00 . A A . 12 GLN HB2 1 1 11 6373 1 1 12 GLN HB3 H -4.911 7.602 -8.465 1.00 . A A . 12 GLN HB3 1 1 11 6374 1 1 12 GLN HE21 H -6.227 6.517 -10.970 1.00 . A A . 12 GLN HE21 1 1 11 6375 1 1 12 GLN HE22 H -7.644 7.289 -11.587 1.00 . A A . 12 GLN HE22 1 1 11 6376 1 1 12 GLN HG2 H -6.098 5.698 -8.909 1.00 . A A . 12 GLN HG2 1 1 11 6377 1 1 12 GLN HG3 H -7.357 6.078 -7.734 1.00 . A A . 12 GLN HG3 1 1 11 6378 1 1 12 GLN N N -5.397 5.827 -6.176 1.00 . A A . 12 GLN N 1 1 11 6379 1 1 12 GLN NE2 N -7.103 6.939 -10.849 1.00 . A A . 12 GLN NE2 1 1 11 6380 1 1 12 GLN O O -6.389 9.160 -5.297 1.00 . A A . 12 GLN O 1 1 11 6381 1 1 12 GLN OE1 O -8.676 7.553 -9.369 1.00 . A A . 12 GLN OE1 1 1 11 6382 1 1 13 CYS C C -8.597 6.865 -2.810 1.00 . A A . 13 CYS C 1 1 11 6383 1 1 13 CYS CA C -8.395 7.720 -4.061 1.00 . A A . 13 CYS CA 1 1 11 6384 1 1 13 CYS CB C -9.721 7.865 -4.809 1.00 . A A . 13 CYS CB 1 1 11 6385 1 1 13 CYS H H -7.382 6.213 -5.155 1.00 . A A . 13 CYS H 1 1 11 6386 1 1 13 CYS HA H -8.064 8.701 -3.756 1.00 . A A . 13 CYS HA 1 1 11 6387 1 1 13 CYS HB2 H -9.808 7.067 -5.531 1.00 . A A . 13 CYS HB2 1 1 11 6388 1 1 13 CYS HB3 H -10.534 7.792 -4.101 1.00 . A A . 13 CYS HB3 1 1 11 6389 1 1 13 CYS N N -7.376 7.169 -4.950 1.00 . A A . 13 CYS N 1 1 11 6390 1 1 13 CYS O O -8.996 7.380 -1.766 1.00 . A A . 13 CYS O 1 1 11 6391 1 1 13 CYS SG S -9.901 9.442 -5.703 1.00 . A A . 13 CYS SG 1 1 11 6392 1 1 14 LYS C C -7.437 3.596 -1.730 1.00 . A A . 14 LYS C 1 1 11 6393 1 1 14 LYS CA C -8.512 4.675 -1.767 1.00 . A A . 14 LYS CA 1 1 11 6394 1 1 14 LYS CB C -9.897 4.027 -1.810 1.00 . A A . 14 LYS CB 1 1 11 6395 1 1 14 LYS CD C -11.643 5.733 -2.404 1.00 . A A . 14 LYS CD 1 1 11 6396 1 1 14 LYS CE C -13.137 5.908 -2.182 1.00 . A A . 14 LYS CE 1 1 11 6397 1 1 14 LYS CG C -11.005 4.924 -1.286 1.00 . A A . 14 LYS CG 1 1 11 6398 1 1 14 LYS H H -8.025 5.192 -3.762 1.00 . A A . 14 LYS H 1 1 11 6399 1 1 14 LYS HA H -8.435 5.271 -0.871 1.00 . A A . 14 LYS HA 1 1 11 6400 1 1 14 LYS HB2 H -10.128 3.766 -2.833 1.00 . A A . 14 LYS HB2 1 1 11 6401 1 1 14 LYS HB3 H -9.879 3.127 -1.214 1.00 . A A . 14 LYS HB3 1 1 11 6402 1 1 14 LYS HD2 H -11.179 6.707 -2.441 1.00 . A A . 14 LYS HD2 1 1 11 6403 1 1 14 LYS HD3 H -11.485 5.220 -3.341 1.00 . A A . 14 LYS HD3 1 1 11 6404 1 1 14 LYS HE2 H -13.489 5.113 -1.542 1.00 . A A . 14 LYS HE2 1 1 11 6405 1 1 14 LYS HE3 H -13.307 6.859 -1.699 1.00 . A A . 14 LYS HE3 1 1 11 6406 1 1 14 LYS HG2 H -11.763 4.311 -0.821 1.00 . A A . 14 LYS HG2 1 1 11 6407 1 1 14 LYS HG3 H -10.590 5.603 -0.554 1.00 . A A . 14 LYS HG3 1 1 11 6408 1 1 14 LYS HZ1 H -13.358 6.349 -4.212 1.00 . A A . 14 LYS HZ1 1 1 11 6409 1 1 14 LYS HZ2 H -14.069 4.885 -3.747 1.00 . A A . 14 LYS HZ2 1 1 11 6410 1 1 14 LYS HZ3 H -14.812 6.351 -3.348 1.00 . A A . 14 LYS HZ3 1 1 11 6411 1 1 14 LYS N N -8.335 5.563 -2.910 1.00 . A A . 14 LYS N 1 1 11 6412 1 1 14 LYS NZ N -13.897 5.871 -3.462 1.00 . A A . 14 LYS NZ 1 1 11 6413 1 1 14 LYS O O -6.745 3.356 -2.719 1.00 . A A . 14 LYS O 1 1 11 6414 1 1 15 LEU C C -6.483 0.809 -1.466 1.00 . A A . 15 LEU C 1 1 11 6415 1 1 15 LEU CA C -6.323 1.886 -0.397 1.00 . A A . 15 LEU CA 1 1 11 6416 1 1 15 LEU CB C -6.469 1.263 0.992 1.00 . A A . 15 LEU CB 1 1 11 6417 1 1 15 LEU CD1 C -8.073 -0.661 0.923 1.00 . A A . 15 LEU CD1 1 1 11 6418 1 1 15 LEU CD2 C -8.149 0.959 2.827 1.00 . A A . 15 LEU CD2 1 1 11 6419 1 1 15 LEU CG C -7.881 0.789 1.340 1.00 . A A . 15 LEU CG 1 1 11 6420 1 1 15 LEU H H -7.893 3.184 0.172 1.00 . A A . 15 LEU H 1 1 11 6421 1 1 15 LEU HA H -5.342 2.325 -0.484 1.00 . A A . 15 LEU HA 1 1 11 6422 1 1 15 LEU HB2 H -5.800 0.417 1.056 1.00 . A A . 15 LEU HB2 1 1 11 6423 1 1 15 LEU HB3 H -6.168 1.995 1.725 1.00 . A A . 15 LEU HB3 1 1 11 6424 1 1 15 LEU HD11 H -7.145 -1.198 1.050 1.00 . A A . 15 LEU HD11 1 1 11 6425 1 1 15 LEU HD12 H -8.837 -1.113 1.538 1.00 . A A . 15 LEU HD12 1 1 11 6426 1 1 15 LEU HD13 H -8.374 -0.701 -0.113 1.00 . A A . 15 LEU HD13 1 1 11 6427 1 1 15 LEU HD21 H -7.452 1.674 3.239 1.00 . A A . 15 LEU HD21 1 1 11 6428 1 1 15 LEU HD22 H -9.158 1.316 2.972 1.00 . A A . 15 LEU HD22 1 1 11 6429 1 1 15 LEU HD23 H -8.028 0.009 3.326 1.00 . A A . 15 LEU HD23 1 1 11 6430 1 1 15 LEU HG H -8.598 1.389 0.799 1.00 . A A . 15 LEU HG 1 1 11 6431 1 1 15 LEU N N -7.308 2.946 -0.577 1.00 . A A . 15 LEU N 1 1 11 6432 1 1 15 LEU O O -7.598 0.495 -1.880 1.00 . A A . 15 LEU O 1 1 11 6433 1 1 16 LYS C C -5.736 -2.146 -2.302 1.00 . A A . 16 LYS C 1 1 11 6434 1 1 16 LYS CA C -5.389 -0.796 -2.924 1.00 . A A . 16 LYS CA 1 1 11 6435 1 1 16 LYS CB C -4.038 -0.882 -3.636 1.00 . A A . 16 LYS CB 1 1 11 6436 1 1 16 LYS CD C -2.627 0.083 -5.478 1.00 . A A . 16 LYS CD 1 1 11 6437 1 1 16 LYS CE C -1.835 1.332 -5.828 1.00 . A A . 16 LYS CE 1 1 11 6438 1 1 16 LYS CG C -3.683 0.369 -4.423 1.00 . A A . 16 LYS CG 1 1 11 6439 1 1 16 LYS H H -4.503 0.535 -1.538 1.00 . A A . 16 LYS H 1 1 11 6440 1 1 16 LYS HA H -6.151 -0.536 -3.644 1.00 . A A . 16 LYS HA 1 1 11 6441 1 1 16 LYS HB2 H -3.266 -1.049 -2.900 1.00 . A A . 16 LYS HB2 1 1 11 6442 1 1 16 LYS HB3 H -4.057 -1.717 -4.321 1.00 . A A . 16 LYS HB3 1 1 11 6443 1 1 16 LYS HD2 H -1.948 -0.667 -5.099 1.00 . A A . 16 LYS HD2 1 1 11 6444 1 1 16 LYS HD3 H -3.114 -0.286 -6.369 1.00 . A A . 16 LYS HD3 1 1 11 6445 1 1 16 LYS HE2 H -2.221 1.741 -6.750 1.00 . A A . 16 LYS HE2 1 1 11 6446 1 1 16 LYS HE3 H -1.957 2.055 -5.035 1.00 . A A . 16 LYS HE3 1 1 11 6447 1 1 16 LYS HG2 H -4.572 0.741 -4.909 1.00 . A A . 16 LYS HG2 1 1 11 6448 1 1 16 LYS HG3 H -3.305 1.116 -3.740 1.00 . A A . 16 LYS HG3 1 1 11 6449 1 1 16 LYS HZ1 H -0.029 0.503 -5.184 1.00 . A A . 16 LYS HZ1 1 1 11 6450 1 1 16 LYS HZ2 H -0.232 0.480 -6.863 1.00 . A A . 16 LYS HZ2 1 1 11 6451 1 1 16 LYS HZ3 H 0.152 1.928 -6.076 1.00 . A A . 16 LYS HZ3 1 1 11 6452 1 1 16 LYS N N -5.364 0.246 -1.907 1.00 . A A . 16 LYS N 1 1 11 6453 1 1 16 LYS NZ N -0.385 1.040 -6.000 1.00 . A A . 16 LYS NZ 1 1 11 6454 1 1 16 LYS O O -5.600 -2.333 -1.092 1.00 . A A . 16 LYS O 1 1 11 6455 1 1 17 PRO C C -5.448 -5.077 -1.795 1.00 . A A . 17 PRO C 1 1 11 6456 1 1 17 PRO CA C -6.552 -4.447 -2.638 1.00 . A A . 17 PRO CA 1 1 11 6457 1 1 17 PRO CB C -6.763 -5.245 -3.926 1.00 . A A . 17 PRO CB 1 1 11 6458 1 1 17 PRO CD C -6.381 -2.976 -4.577 1.00 . A A . 17 PRO CD 1 1 11 6459 1 1 17 PRO CG C -7.134 -4.224 -4.946 1.00 . A A . 17 PRO CG 1 1 11 6460 1 1 17 PRO HA H -7.470 -4.426 -2.069 1.00 . A A . 17 PRO HA 1 1 11 6461 1 1 17 PRO HB2 H -5.849 -5.755 -4.190 1.00 . A A . 17 PRO HB2 1 1 11 6462 1 1 17 PRO HB3 H -7.556 -5.964 -3.782 1.00 . A A . 17 PRO HB3 1 1 11 6463 1 1 17 PRO HD2 H -5.431 -2.943 -5.090 1.00 . A A . 17 PRO HD2 1 1 11 6464 1 1 17 PRO HD3 H -6.967 -2.099 -4.808 1.00 . A A . 17 PRO HD3 1 1 11 6465 1 1 17 PRO HG2 H -6.839 -4.563 -5.928 1.00 . A A . 17 PRO HG2 1 1 11 6466 1 1 17 PRO HG3 H -8.198 -4.043 -4.915 1.00 . A A . 17 PRO HG3 1 1 11 6467 1 1 17 PRO N N -6.189 -3.111 -3.120 1.00 . A A . 17 PRO N 1 1 11 6468 1 1 17 PRO O O -4.270 -5.007 -2.145 1.00 . A A . 17 PRO O 1 1 11 6469 1 1 18 ALA C C -3.953 -7.276 -0.553 1.00 . A A . 18 ALA C 1 1 11 6470 1 1 18 ALA CA C -4.880 -6.337 0.214 1.00 . A A . 18 ALA CA 1 1 11 6471 1 1 18 ALA CB C -5.613 -7.097 1.309 1.00 . A A . 18 ALA CB 1 1 11 6472 1 1 18 ALA H H -6.790 -5.715 -0.455 1.00 . A A . 18 ALA H 1 1 11 6473 1 1 18 ALA HA H -4.286 -5.563 0.681 1.00 . A A . 18 ALA HA 1 1 11 6474 1 1 18 ALA HB1 H -5.993 -6.398 2.039 1.00 . A A . 18 ALA HB1 1 1 11 6475 1 1 18 ALA HB2 H -4.931 -7.783 1.790 1.00 . A A . 18 ALA HB2 1 1 11 6476 1 1 18 ALA HB3 H -6.434 -7.649 0.877 1.00 . A A . 18 ALA HB3 1 1 11 6477 1 1 18 ALA N N -5.837 -5.693 -0.681 1.00 . A A . 18 ALA N 1 1 11 6478 1 1 18 ALA O O -4.385 -8.308 -1.067 1.00 . A A . 18 ALA O 1 1 11 6479 1 1 19 GLY C C -0.808 -6.911 -2.248 1.00 . A A . 19 GLY C 1 1 11 6480 1 1 19 GLY CA C -1.711 -7.727 -1.338 1.00 . A A . 19 GLY CA 1 1 11 6481 1 1 19 GLY H H -2.392 -6.075 -0.202 1.00 . A A . 19 GLY H 1 1 11 6482 1 1 19 GLY HA2 H -2.241 -8.454 -1.935 1.00 . A A . 19 GLY HA2 1 1 11 6483 1 1 19 GLY HA3 H -1.099 -8.247 -0.616 1.00 . A A . 19 GLY HA3 1 1 11 6484 1 1 19 GLY N N -2.678 -6.909 -0.629 1.00 . A A . 19 GLY N 1 1 11 6485 1 1 19 GLY O O 0.159 -7.435 -2.800 1.00 . A A . 19 GLY O 1 1 11 6486 1 1 20 THR C C 0.986 -4.386 -2.573 1.00 . A A . 20 THR C 1 1 11 6487 1 1 20 THR CA C -0.330 -4.745 -3.251 1.00 . A A . 20 THR CA 1 1 11 6488 1 1 20 THR CB C -1.116 -3.473 -3.573 1.00 . A A . 20 THR CB 1 1 11 6489 1 1 20 THR CG2 C -0.602 -2.746 -4.797 1.00 . A A . 20 THR CG2 1 1 11 6490 1 1 20 THR H H -1.903 -5.265 -1.939 1.00 . A A . 20 THR H 1 1 11 6491 1 1 20 THR HA H -0.117 -5.269 -4.171 1.00 . A A . 20 THR HA 1 1 11 6492 1 1 20 THR HB H -1.046 -2.796 -2.733 1.00 . A A . 20 THR HB 1 1 11 6493 1 1 20 THR HG1 H -2.986 -3.565 -3.001 1.00 . A A . 20 THR HG1 1 1 11 6494 1 1 20 THR HG21 H 0.141 -3.353 -5.291 1.00 . A A . 20 THR HG21 1 1 11 6495 1 1 20 THR HG22 H -1.422 -2.558 -5.474 1.00 . A A . 20 THR HG22 1 1 11 6496 1 1 20 THR HG23 H -0.160 -1.807 -4.499 1.00 . A A . 20 THR HG23 1 1 11 6497 1 1 20 THR N N -1.122 -5.628 -2.404 1.00 . A A . 20 THR N 1 1 11 6498 1 1 20 THR O O 1.000 -3.742 -1.524 1.00 . A A . 20 THR O 1 1 11 6499 1 1 20 THR OG1 O -2.483 -3.770 -3.792 1.00 . A A . 20 THR OG1 1 1 11 6500 1 1 21 THR C C 3.724 -3.042 -2.668 1.00 . A A . 21 THR C 1 1 11 6501 1 1 21 THR CA C 3.412 -4.534 -2.625 1.00 . A A . 21 THR CA 1 1 11 6502 1 1 21 THR CB C 4.483 -5.318 -3.389 1.00 . A A . 21 THR CB 1 1 11 6503 1 1 21 THR CG2 C 5.185 -6.347 -2.532 1.00 . A A . 21 THR CG2 1 1 11 6504 1 1 21 THR H H 2.016 -5.320 -4.008 1.00 . A A . 21 THR H 1 1 11 6505 1 1 21 THR HA H 3.412 -4.857 -1.595 1.00 . A A . 21 THR HA 1 1 11 6506 1 1 21 THR HB H 5.230 -4.628 -3.754 1.00 . A A . 21 THR HB 1 1 11 6507 1 1 21 THR HG1 H 3.391 -6.734 -4.192 1.00 . A A . 21 THR HG1 1 1 11 6508 1 1 21 THR HG21 H 4.449 -6.934 -2.002 1.00 . A A . 21 THR HG21 1 1 11 6509 1 1 21 THR HG22 H 5.778 -6.994 -3.160 1.00 . A A . 21 THR HG22 1 1 11 6510 1 1 21 THR HG23 H 5.825 -5.846 -1.821 1.00 . A A . 21 THR HG23 1 1 11 6511 1 1 21 THR N N 2.091 -4.809 -3.176 1.00 . A A . 21 THR N 1 1 11 6512 1 1 21 THR O O 3.201 -2.311 -3.509 1.00 . A A . 21 THR O 1 1 11 6513 1 1 21 THR OG1 O 3.919 -5.993 -4.500 1.00 . A A . 21 THR OG1 1 1 11 6514 1 1 22 CYS C C 6.222 -0.931 -2.501 1.00 . A A . 22 CYS C 1 1 11 6515 1 1 22 CYS CA C 4.962 -1.194 -1.682 1.00 . A A . 22 CYS CA 1 1 11 6516 1 1 22 CYS CB C 5.187 -0.778 -0.226 1.00 . A A . 22 CYS CB 1 1 11 6517 1 1 22 CYS H H 4.961 -3.230 -1.109 1.00 . A A . 22 CYS H 1 1 11 6518 1 1 22 CYS HA H 4.153 -0.610 -2.092 1.00 . A A . 22 CYS HA 1 1 11 6519 1 1 22 CYS HB2 H 4.706 -1.494 0.423 1.00 . A A . 22 CYS HB2 1 1 11 6520 1 1 22 CYS HB3 H 6.248 -0.771 -0.021 1.00 . A A . 22 CYS HB3 1 1 11 6521 1 1 22 CYS N N 4.579 -2.598 -1.753 1.00 . A A . 22 CYS N 1 1 11 6522 1 1 22 CYS O O 6.179 -0.249 -3.525 1.00 . A A . 22 CYS O 1 1 11 6523 1 1 22 CYS SG S 4.531 0.870 0.187 1.00 . A A . 22 CYS SG 1 1 11 6524 1 1 23 TRP C C 8.910 -2.487 -3.643 1.00 . A A . 23 TRP C 1 1 11 6525 1 1 23 TRP CA C 8.617 -1.301 -2.732 1.00 . A A . 23 TRP CA 1 1 11 6526 1 1 23 TRP CB C 9.750 -1.126 -1.719 1.00 . A A . 23 TRP CB 1 1 11 6527 1 1 23 TRP CD1 C 11.316 -0.301 -3.572 1.00 . A A . 23 TRP CD1 1 1 11 6528 1 1 23 TRP CD2 C 12.368 -1.196 -1.810 1.00 . A A . 23 TRP CD2 1 1 11 6529 1 1 23 TRP CE2 C 13.334 -0.786 -2.748 1.00 . A A . 23 TRP CE2 1 1 11 6530 1 1 23 TRP CE3 C 12.796 -1.788 -0.618 1.00 . A A . 23 TRP CE3 1 1 11 6531 1 1 23 TRP CG C 11.083 -0.876 -2.356 1.00 . A A . 23 TRP CG 1 1 11 6532 1 1 23 TRP CH2 C 15.090 -1.531 -1.356 1.00 . A A . 23 TRP CH2 1 1 11 6533 1 1 23 TRP CZ2 C 14.700 -0.949 -2.531 1.00 . A A . 23 TRP CZ2 1 1 11 6534 1 1 23 TRP CZ3 C 14.152 -1.949 -0.404 1.00 . A A . 23 TRP CZ3 1 1 11 6535 1 1 23 TRP H H 7.316 -2.010 -1.220 1.00 . A A . 23 TRP H 1 1 11 6536 1 1 23 TRP HA H 8.546 -0.413 -3.335 1.00 . A A . 23 TRP HA 1 1 11 6537 1 1 23 TRP HB2 H 9.525 -0.286 -1.079 1.00 . A A . 23 TRP HB2 1 1 11 6538 1 1 23 TRP HB3 H 9.829 -2.020 -1.118 1.00 . A A . 23 TRP HB3 1 1 11 6539 1 1 23 TRP HD1 H 10.541 0.052 -4.237 1.00 . A A . 23 TRP HD1 1 1 11 6540 1 1 23 TRP HE1 H 13.085 0.127 -4.621 1.00 . A A . 23 TRP HE1 1 1 11 6541 1 1 23 TRP HE3 H 12.087 -2.116 0.128 1.00 . A A . 23 TRP HE3 1 1 11 6542 1 1 23 TRP HH2 H 16.139 -1.678 -1.146 1.00 . A A . 23 TRP HH2 1 1 11 6543 1 1 23 TRP HZ2 H 15.436 -0.632 -3.255 1.00 . A A . 23 TRP HZ2 1 1 11 6544 1 1 23 TRP HZ3 H 14.501 -2.405 0.511 1.00 . A A . 23 TRP HZ3 1 1 11 6545 1 1 23 TRP N N 7.344 -1.477 -2.042 1.00 . A A . 23 TRP N 1 1 11 6546 1 1 23 TRP NE1 N 12.667 -0.243 -3.815 1.00 . A A . 23 TRP NE1 1 1 11 6547 1 1 23 TRP O O 8.873 -2.369 -4.867 1.00 . A A . 23 TRP O 1 1 11 6548 1 1 24 ARG C C 10.730 -4.644 -4.668 1.00 . A A . 24 ARG C 1 1 11 6549 1 1 24 ARG CA C 9.504 -4.842 -3.783 1.00 . A A . 24 ARG CA 1 1 11 6550 1 1 24 ARG CB C 8.303 -5.250 -4.639 1.00 . A A . 24 ARG CB 1 1 11 6551 1 1 24 ARG CD C 7.772 -6.655 -6.653 1.00 . A A . 24 ARG CD 1 1 11 6552 1 1 24 ARG CG C 8.460 -6.610 -5.299 1.00 . A A . 24 ARG CG 1 1 11 6553 1 1 24 ARG CZ C 7.114 -8.349 -8.317 1.00 . A A . 24 ARG CZ 1 1 11 6554 1 1 24 ARG H H 9.215 -3.653 -2.056 1.00 . A A . 24 ARG H 1 1 11 6555 1 1 24 ARG HA H 9.711 -5.627 -3.072 1.00 . A A . 24 ARG HA 1 1 11 6556 1 1 24 ARG HB2 H 7.423 -5.276 -4.014 1.00 . A A . 24 ARG HB2 1 1 11 6557 1 1 24 ARG HB3 H 8.161 -4.512 -5.414 1.00 . A A . 24 ARG HB3 1 1 11 6558 1 1 24 ARG HD2 H 6.739 -6.365 -6.528 1.00 . A A . 24 ARG HD2 1 1 11 6559 1 1 24 ARG HD3 H 8.263 -5.956 -7.315 1.00 . A A . 24 ARG HD3 1 1 11 6560 1 1 24 ARG HE H 8.412 -8.649 -6.831 1.00 . A A . 24 ARG HE 1 1 11 6561 1 1 24 ARG HG2 H 9.512 -6.814 -5.433 1.00 . A A . 24 ARG HG2 1 1 11 6562 1 1 24 ARG HG3 H 8.024 -7.362 -4.658 1.00 . A A . 24 ARG HG3 1 1 11 6563 1 1 24 ARG HH11 H 6.220 -6.550 -8.555 1.00 . A A . 24 ARG HH11 1 1 11 6564 1 1 24 ARG HH12 H 5.775 -7.759 -9.712 1.00 . A A . 24 ARG HH12 1 1 11 6565 1 1 24 ARG HH21 H 7.828 -10.240 -8.352 1.00 . A A . 24 ARG HH21 1 1 11 6566 1 1 24 ARG HH22 H 6.687 -9.854 -9.597 1.00 . A A . 24 ARG HH22 1 1 11 6567 1 1 24 ARG N N 9.202 -3.628 -3.034 1.00 . A A . 24 ARG N 1 1 11 6568 1 1 24 ARG NE N 7.821 -7.988 -7.249 1.00 . A A . 24 ARG NE 1 1 11 6569 1 1 24 ARG NH1 N 6.303 -7.481 -8.909 1.00 . A A . 24 ARG NH1 1 1 11 6570 1 1 24 ARG NH2 N 7.218 -9.582 -8.794 1.00 . A A . 24 ARG NH2 1 1 11 6571 1 1 24 ARG O O 10.626 -4.142 -5.787 1.00 . A A . 24 ARG O 1 1 11 6572 1 1 25 THR C C 13.621 -6.269 -5.404 1.00 . A A . 25 THR C 1 1 11 6573 1 1 25 THR CA C 13.138 -4.911 -4.905 1.00 . A A . 25 THR CA 1 1 11 6574 1 1 25 THR CB C 14.213 -4.265 -4.029 1.00 . A A . 25 THR CB 1 1 11 6575 1 1 25 THR CG2 C 15.140 -3.349 -4.798 1.00 . A A . 25 THR CG2 1 1 11 6576 1 1 25 THR H H 11.910 -5.437 -3.263 1.00 . A A . 25 THR H 1 1 11 6577 1 1 25 THR HA H 12.949 -4.274 -5.756 1.00 . A A . 25 THR HA 1 1 11 6578 1 1 25 THR HB H 14.814 -5.044 -3.581 1.00 . A A . 25 THR HB 1 1 11 6579 1 1 25 THR HG1 H 13.356 -4.090 -2.276 1.00 . A A . 25 THR HG1 1 1 11 6580 1 1 25 THR HG21 H 14.560 -2.718 -5.455 1.00 . A A . 25 THR HG21 1 1 11 6581 1 1 25 THR HG22 H 15.694 -2.734 -4.105 1.00 . A A . 25 THR HG22 1 1 11 6582 1 1 25 THR HG23 H 15.828 -3.942 -5.383 1.00 . A A . 25 THR HG23 1 1 11 6583 1 1 25 THR N N 11.891 -5.044 -4.160 1.00 . A A . 25 THR N 1 1 11 6584 1 1 25 THR O O 14.228 -6.369 -6.470 1.00 . A A . 25 THR O 1 1 11 6585 1 1 25 THR OG1 O 13.623 -3.505 -2.989 1.00 . A A . 25 THR OG1 1 1 11 6586 1 1 26 SER C C 13.199 -9.683 -4.001 1.00 . A A . 26 SER C 1 1 11 6587 1 1 26 SER CA C 13.752 -8.664 -4.991 1.00 . A A . 26 SER CA 1 1 11 6588 1 1 26 SER CB C 15.278 -8.762 -5.048 1.00 . A A . 26 SER CB 1 1 11 6589 1 1 26 SER H H 12.858 -7.168 -3.789 1.00 . A A . 26 SER H 1 1 11 6590 1 1 26 SER HA H 13.351 -8.878 -5.967 1.00 . A A . 26 SER HA 1 1 11 6591 1 1 26 SER HB2 H 15.581 -9.768 -4.798 1.00 . A A . 26 SER HB2 1 1 11 6592 1 1 26 SER HB3 H 15.615 -8.522 -6.046 1.00 . A A . 26 SER HB3 1 1 11 6593 1 1 26 SER HG H 16.794 -8.124 -3.984 1.00 . A A . 26 SER HG 1 1 11 6594 1 1 26 SER N N 13.346 -7.311 -4.627 1.00 . A A . 26 SER N 1 1 11 6595 1 1 26 SER O O 12.216 -10.368 -4.282 1.00 . A A . 26 SER O 1 1 11 6596 1 1 26 SER OG O 15.882 -7.864 -4.133 1.00 . A A . 26 SER OG 1 1 11 6597 1 1 27 VAL C C 12.474 -10.037 -0.812 1.00 . A A . 27 VAL C 1 1 11 6598 1 1 27 VAL CA C 13.415 -10.710 -1.806 1.00 . A A . 27 VAL CA 1 1 11 6599 1 1 27 VAL CB C 14.624 -11.292 -1.047 1.00 . A A . 27 VAL CB 1 1 11 6600 1 1 27 VAL CG1 C 15.402 -10.188 -0.348 1.00 . A A . 27 VAL CG1 1 1 11 6601 1 1 27 VAL CG2 C 14.173 -12.350 -0.050 1.00 . A A . 27 VAL CG2 1 1 11 6602 1 1 27 VAL H H 14.615 -9.202 -2.681 1.00 . A A . 27 VAL H 1 1 11 6603 1 1 27 VAL HA H 12.892 -11.525 -2.286 1.00 . A A . 27 VAL HA 1 1 11 6604 1 1 27 VAL HB H 15.280 -11.763 -1.764 1.00 . A A . 27 VAL HB 1 1 11 6605 1 1 27 VAL HG11 H 14.738 -9.630 0.295 1.00 . A A . 27 VAL HG11 1 1 11 6606 1 1 27 VAL HG12 H 16.193 -10.624 0.244 1.00 . A A . 27 VAL HG12 1 1 11 6607 1 1 27 VAL HG13 H 15.829 -9.525 -1.086 1.00 . A A . 27 VAL HG13 1 1 11 6608 1 1 27 VAL HG21 H 13.239 -12.780 -0.380 1.00 . A A . 27 VAL HG21 1 1 11 6609 1 1 27 VAL HG22 H 14.922 -13.125 0.017 1.00 . A A . 27 VAL HG22 1 1 11 6610 1 1 27 VAL HG23 H 14.037 -11.896 0.920 1.00 . A A . 27 VAL HG23 1 1 11 6611 1 1 27 VAL N N 13.839 -9.776 -2.842 1.00 . A A . 27 VAL N 1 1 11 6612 1 1 27 VAL O O 11.589 -10.680 -0.246 1.00 . A A . 27 VAL O 1 1 11 6613 1 1 28 SER C C 10.601 -7.433 -0.381 1.00 . A A . 28 SER C 1 1 11 6614 1 1 28 SER CA C 11.839 -7.979 0.322 1.00 . A A . 28 SER CA 1 1 11 6615 1 1 28 SER CB C 12.641 -6.829 0.934 1.00 . A A . 28 SER CB 1 1 11 6616 1 1 28 SER H H 13.391 -8.282 -1.085 1.00 . A A . 28 SER H 1 1 11 6617 1 1 28 SER HA H 11.525 -8.647 1.110 1.00 . A A . 28 SER HA 1 1 11 6618 1 1 28 SER HB2 H 12.461 -5.927 0.369 1.00 . A A . 28 SER HB2 1 1 11 6619 1 1 28 SER HB3 H 12.330 -6.681 1.958 1.00 . A A . 28 SER HB3 1 1 11 6620 1 1 28 SER HG H 14.494 -6.394 0.472 1.00 . A A . 28 SER HG 1 1 11 6621 1 1 28 SER N N 12.670 -8.739 -0.604 1.00 . A A . 28 SER N 1 1 11 6622 1 1 28 SER O O 10.702 -6.779 -1.419 1.00 . A A . 28 SER O 1 1 11 6623 1 1 28 SER OG O 14.030 -7.109 0.914 1.00 . A A . 28 SER OG 1 1 11 6624 1 1 29 SER C C 7.268 -6.657 0.699 1.00 . A A . 29 SER C 1 1 11 6625 1 1 29 SER CA C 8.174 -7.240 -0.381 1.00 . A A . 29 SER CA 1 1 11 6626 1 1 29 SER CB C 7.460 -8.389 -1.096 1.00 . A A . 29 SER CB 1 1 11 6627 1 1 29 SER H H 9.417 -8.231 1.018 1.00 . A A . 29 SER H 1 1 11 6628 1 1 29 SER HA H 8.402 -6.467 -1.099 1.00 . A A . 29 SER HA 1 1 11 6629 1 1 29 SER HB2 H 7.506 -9.276 -0.483 1.00 . A A . 29 SER HB2 1 1 11 6630 1 1 29 SER HB3 H 6.428 -8.119 -1.263 1.00 . A A . 29 SER HB3 1 1 11 6631 1 1 29 SER HG H 8.876 -9.165 -2.206 1.00 . A A . 29 SER HG 1 1 11 6632 1 1 29 SER N N 9.433 -7.705 0.191 1.00 . A A . 29 SER N 1 1 11 6633 1 1 29 SER O O 7.046 -7.278 1.738 1.00 . A A . 29 SER O 1 1 11 6634 1 1 29 SER OG O 8.067 -8.667 -2.346 1.00 . A A . 29 SER OG 1 1 11 6635 1 1 30 HIS C C 4.416 -4.851 0.925 1.00 . A A . 30 HIS C 1 1 11 6636 1 1 30 HIS CA C 5.866 -4.794 1.396 1.00 . A A . 30 HIS CA 1 1 11 6637 1 1 30 HIS CB C 6.296 -3.338 1.588 1.00 . A A . 30 HIS CB 1 1 11 6638 1 1 30 HIS CD2 C 8.874 -3.581 1.746 1.00 . A A . 30 HIS CD2 1 1 11 6639 1 1 30 HIS CE1 C 9.169 -2.600 3.684 1.00 . A A . 30 HIS CE1 1 1 11 6640 1 1 30 HIS CG C 7.657 -3.191 2.194 1.00 . A A . 30 HIS CG 1 1 11 6641 1 1 30 HIS H H 6.963 -5.016 -0.401 1.00 . A A . 30 HIS H 1 1 11 6642 1 1 30 HIS HA H 5.946 -5.311 2.340 1.00 . A A . 30 HIS HA 1 1 11 6643 1 1 30 HIS HB2 H 6.306 -2.844 0.628 1.00 . A A . 30 HIS HB2 1 1 11 6644 1 1 30 HIS HB3 H 5.587 -2.843 2.235 1.00 . A A . 30 HIS HB3 1 1 11 6645 1 1 30 HIS HD1 H 7.188 -2.190 3.988 1.00 . A A . 30 HIS HD1 1 1 11 6646 1 1 30 HIS HD2 H 9.081 -4.095 0.818 1.00 . A A . 30 HIS HD2 1 1 11 6647 1 1 30 HIS HE1 H 9.634 -2.193 4.571 1.00 . A A . 30 HIS HE1 1 1 11 6648 1 1 30 HIS HE2 H 10.749 -3.430 2.680 1.00 . A A . 30 HIS HE2 1 1 11 6649 1 1 30 HIS N N 6.748 -5.461 0.445 1.00 . A A . 30 HIS N 1 1 11 6650 1 1 30 HIS ND1 N 7.877 -2.580 3.411 1.00 . A A . 30 HIS ND1 1 1 11 6651 1 1 30 HIS NE2 N 9.796 -3.202 2.691 1.00 . A A . 30 HIS NE2 1 1 11 6652 1 1 30 HIS O O 3.885 -3.873 0.398 1.00 . A A . 30 HIS O 1 1 11 6653 1 1 31 TYR C C 1.470 -5.256 1.497 1.00 . A A . 31 TYR C 1 1 11 6654 1 1 31 TYR CA C 2.392 -6.187 0.716 1.00 . A A . 31 TYR CA 1 1 11 6655 1 1 31 TYR CB C 1.967 -7.641 0.927 1.00 . A A . 31 TYR CB 1 1 11 6656 1 1 31 TYR CD1 C 2.722 -8.642 -1.263 1.00 . A A . 31 TYR CD1 1 1 11 6657 1 1 31 TYR CD2 C 3.600 -9.559 0.755 1.00 . A A . 31 TYR CD2 1 1 11 6658 1 1 31 TYR CE1 C 3.462 -9.548 -2.001 1.00 . A A . 31 TYR CE1 1 1 11 6659 1 1 31 TYR CE2 C 4.343 -10.467 0.024 1.00 . A A . 31 TYR CE2 1 1 11 6660 1 1 31 TYR CG C 2.778 -8.633 0.125 1.00 . A A . 31 TYR CG 1 1 11 6661 1 1 31 TYR CZ C 4.270 -10.457 -1.353 1.00 . A A . 31 TYR CZ 1 1 11 6662 1 1 31 TYR H H 4.258 -6.745 1.546 1.00 . A A . 31 TYR H 1 1 11 6663 1 1 31 TYR HA H 2.318 -5.949 -0.334 1.00 . A A . 31 TYR HA 1 1 11 6664 1 1 31 TYR HB2 H 2.076 -7.892 1.972 1.00 . A A . 31 TYR HB2 1 1 11 6665 1 1 31 TYR HB3 H 0.931 -7.750 0.643 1.00 . A A . 31 TYR HB3 1 1 11 6666 1 1 31 TYR HD1 H 2.088 -7.929 -1.768 1.00 . A A . 31 TYR HD1 1 1 11 6667 1 1 31 TYR HD2 H 3.654 -9.564 1.833 1.00 . A A . 31 TYR HD2 1 1 11 6668 1 1 31 TYR HE1 H 3.405 -9.539 -3.079 1.00 . A A . 31 TYR HE1 1 1 11 6669 1 1 31 TYR HE2 H 4.975 -11.179 0.533 1.00 . A A . 31 TYR HE2 1 1 11 6670 1 1 31 TYR HH H 4.421 -11.883 -2.633 1.00 . A A . 31 TYR HH 1 1 11 6671 1 1 31 TYR N N 3.781 -6.002 1.120 1.00 . A A . 31 TYR N 1 1 11 6672 1 1 31 TYR O O 1.666 -5.032 2.692 1.00 . A A . 31 TYR O 1 1 11 6673 1 1 31 TYR OH O 5.008 -11.360 -2.083 1.00 . A A . 31 TYR OH 1 1 11 6674 1 1 32 CYS C C -1.630 -4.590 2.091 1.00 . A A . 32 CYS C 1 1 11 6675 1 1 32 CYS CA C -0.487 -3.812 1.446 1.00 . A A . 32 CYS CA 1 1 11 6676 1 1 32 CYS CB C -1.042 -2.824 0.418 1.00 . A A . 32 CYS CB 1 1 11 6677 1 1 32 CYS H H 0.360 -4.934 -0.134 1.00 . A A . 32 CYS H 1 1 11 6678 1 1 32 CYS HA H 0.036 -3.263 2.214 1.00 . A A . 32 CYS HA 1 1 11 6679 1 1 32 CYS HB2 H -0.229 -2.447 -0.182 1.00 . A A . 32 CYS HB2 1 1 11 6680 1 1 32 CYS HB3 H -1.746 -3.338 -0.220 1.00 . A A . 32 CYS HB3 1 1 11 6681 1 1 32 CYS N N 0.465 -4.718 0.815 1.00 . A A . 32 CYS N 1 1 11 6682 1 1 32 CYS O O -2.196 -5.499 1.484 1.00 . A A . 32 CYS O 1 1 11 6683 1 1 32 CYS SG S -1.899 -1.392 1.150 1.00 . A A . 32 CYS SG 1 1 11 6684 1 1 33 THR C C -4.410 -4.433 3.564 1.00 . A A . 33 THR C 1 1 11 6685 1 1 33 THR CA C -3.037 -4.890 4.055 1.00 . A A . 33 THR CA 1 1 11 6686 1 1 33 THR CB C -2.907 -4.610 5.553 1.00 . A A . 33 THR CB 1 1 11 6687 1 1 33 THR CG2 C -2.711 -3.144 5.870 1.00 . A A . 33 THR CG2 1 1 11 6688 1 1 33 THR H H -1.472 -3.495 3.754 1.00 . A A . 33 THR H 1 1 11 6689 1 1 33 THR HA H -2.944 -5.952 3.889 1.00 . A A . 33 THR HA 1 1 11 6690 1 1 33 THR HB H -2.053 -5.150 5.937 1.00 . A A . 33 THR HB 1 1 11 6691 1 1 33 THR HG1 H -4.802 -4.479 6.030 1.00 . A A . 33 THR HG1 1 1 11 6692 1 1 33 THR HG21 H -2.912 -2.556 4.987 1.00 . A A . 33 THR HG21 1 1 11 6693 1 1 33 THR HG22 H -3.387 -2.853 6.660 1.00 . A A . 33 THR HG22 1 1 11 6694 1 1 33 THR HG23 H -1.692 -2.978 6.189 1.00 . A A . 33 THR HG23 1 1 11 6695 1 1 33 THR N N -1.962 -4.227 3.324 1.00 . A A . 33 THR N 1 1 11 6696 1 1 33 THR O O -5.437 -4.950 4.004 1.00 . A A . 33 THR O 1 1 11 6697 1 1 33 THR OG1 O -4.061 -5.050 6.247 1.00 . A A . 33 THR OG1 1 1 11 6698 1 1 34 GLY C C -6.536 -2.309 3.205 1.00 . A A . 34 GLY C 1 1 11 6699 1 1 34 GLY CA C -5.684 -2.960 2.132 1.00 . A A . 34 GLY CA 1 1 11 6700 1 1 34 GLY H H -3.583 -3.081 2.338 1.00 . A A . 34 GLY H 1 1 11 6701 1 1 34 GLY HA2 H -6.235 -3.781 1.700 1.00 . A A . 34 GLY HA2 1 1 11 6702 1 1 34 GLY HA3 H -5.477 -2.233 1.361 1.00 . A A . 34 GLY HA3 1 1 11 6703 1 1 34 GLY N N -4.427 -3.461 2.654 1.00 . A A . 34 GLY N 1 1 11 6704 1 1 34 GLY O O -7.763 -2.298 3.111 1.00 . A A . 34 GLY O 1 1 11 6705 1 1 35 ARG C C -6.458 0.407 5.225 1.00 . A A . 35 ARG C 1 1 11 6706 1 1 35 ARG CA C -6.586 -1.110 5.324 1.00 . A A . 35 ARG CA 1 1 11 6707 1 1 35 ARG CB C -6.039 -1.593 6.669 1.00 . A A . 35 ARG CB 1 1 11 6708 1 1 35 ARG CD C -6.636 -2.184 9.037 1.00 . A A . 35 ARG CD 1 1 11 6709 1 1 35 ARG CG C -6.964 -1.306 7.840 1.00 . A A . 35 ARG CG 1 1 11 6710 1 1 35 ARG CZ C -7.187 -0.757 10.969 1.00 . A A . 35 ARG CZ 1 1 11 6711 1 1 35 ARG H H -4.903 -1.807 4.245 1.00 . A A . 35 ARG H 1 1 11 6712 1 1 35 ARG HA H -7.630 -1.377 5.254 1.00 . A A . 35 ARG HA 1 1 11 6713 1 1 35 ARG HB2 H -5.878 -2.659 6.617 1.00 . A A . 35 ARG HB2 1 1 11 6714 1 1 35 ARG HB3 H -5.094 -1.104 6.856 1.00 . A A . 35 ARG HB3 1 1 11 6715 1 1 35 ARG HD2 H -6.838 -3.213 8.779 1.00 . A A . 35 ARG HD2 1 1 11 6716 1 1 35 ARG HD3 H -5.587 -2.072 9.272 1.00 . A A . 35 ARG HD3 1 1 11 6717 1 1 35 ARG HE H -8.175 -2.411 10.449 1.00 . A A . 35 ARG HE 1 1 11 6718 1 1 35 ARG HG2 H -6.858 -0.271 8.126 1.00 . A A . 35 ARG HG2 1 1 11 6719 1 1 35 ARG HG3 H -7.983 -1.495 7.535 1.00 . A A . 35 ARG HG3 1 1 11 6720 1 1 35 ARG HH11 H -5.599 -0.126 9.887 1.00 . A A . 35 ARG HH11 1 1 11 6721 1 1 35 ARG HH12 H -6.007 0.860 11.251 1.00 . A A . 35 ARG HH12 1 1 11 6722 1 1 35 ARG HH21 H -8.713 -1.116 12.244 1.00 . A A . 35 ARG HH21 1 1 11 6723 1 1 35 ARG HH22 H -7.775 0.298 12.589 1.00 . A A . 35 ARG HH22 1 1 11 6724 1 1 35 ARG N N -5.882 -1.765 4.227 1.00 . A A . 35 ARG N 1 1 11 6725 1 1 35 ARG NE N -7.426 -1.825 10.212 1.00 . A A . 35 ARG NE 1 1 11 6726 1 1 35 ARG NH1 N -6.181 0.059 10.678 1.00 . A A . 35 ARG NH1 1 1 11 6727 1 1 35 ARG NH2 N -7.955 -0.504 12.020 1.00 . A A . 35 ARG NH2 1 1 11 6728 1 1 35 ARG O O -7.350 1.143 5.648 1.00 . A A . 35 ARG O 1 1 11 6729 1 1 36 SER C C -3.936 2.556 3.564 1.00 . A A . 36 SER C 1 1 11 6730 1 1 36 SER CA C -5.103 2.299 4.512 1.00 . A A . 36 SER CA 1 1 11 6731 1 1 36 SER CB C -4.821 2.939 5.872 1.00 . A A . 36 SER CB 1 1 11 6732 1 1 36 SER H H -4.670 0.233 4.347 1.00 . A A . 36 SER H 1 1 11 6733 1 1 36 SER HA H -5.995 2.742 4.094 1.00 . A A . 36 SER HA 1 1 11 6734 1 1 36 SER HB2 H -4.605 3.988 5.737 1.00 . A A . 36 SER HB2 1 1 11 6735 1 1 36 SER HB3 H -5.689 2.829 6.506 1.00 . A A . 36 SER HB3 1 1 11 6736 1 1 36 SER HG H -2.899 2.697 6.161 1.00 . A A . 36 SER HG 1 1 11 6737 1 1 36 SER N N -5.345 0.869 4.665 1.00 . A A . 36 SER N 1 1 11 6738 1 1 36 SER O O -3.150 1.655 3.273 1.00 . A A . 36 SER O 1 1 11 6739 1 1 36 SER OG O -3.713 2.323 6.506 1.00 . A A . 36 SER OG 1 1 11 6740 1 1 37 CYS C C -1.416 4.244 2.903 1.00 . A A . 37 CYS C 1 1 11 6741 1 1 37 CYS CA C -2.755 4.167 2.173 1.00 . A A . 37 CYS CA 1 1 11 6742 1 1 37 CYS CB C -3.063 5.510 1.509 1.00 . A A . 37 CYS CB 1 1 11 6743 1 1 37 CYS H H -4.485 4.469 3.356 1.00 . A A . 37 CYS H 1 1 11 6744 1 1 37 CYS HA H -2.691 3.407 1.410 1.00 . A A . 37 CYS HA 1 1 11 6745 1 1 37 CYS HB2 H -4.080 5.500 1.146 1.00 . A A . 37 CYS HB2 1 1 11 6746 1 1 37 CYS HB3 H -2.956 6.298 2.241 1.00 . A A . 37 CYS HB3 1 1 11 6747 1 1 37 CYS N N -3.828 3.793 3.087 1.00 . A A . 37 CYS N 1 1 11 6748 1 1 37 CYS O O -0.357 4.107 2.291 1.00 . A A . 37 CYS O 1 1 11 6749 1 1 37 CYS SG S -1.977 5.909 0.102 1.00 . A A . 37 CYS SG 1 1 11 6750 1 1 38 GLU C C 0.516 3.246 4.992 1.00 . A A . 38 GLU C 1 1 11 6751 1 1 38 GLU CA C -0.259 4.559 5.021 1.00 . A A . 38 GLU CA 1 1 11 6752 1 1 38 GLU CB C -0.611 4.926 6.464 1.00 . A A . 38 GLU CB 1 1 11 6753 1 1 38 GLU CD C 0.650 5.460 8.586 1.00 . A A . 38 GLU CD 1 1 11 6754 1 1 38 GLU CG C 0.419 5.822 7.132 1.00 . A A . 38 GLU CG 1 1 11 6755 1 1 38 GLU H H -2.343 4.568 4.647 1.00 . A A . 38 GLU H 1 1 11 6756 1 1 38 GLU HA H 0.359 5.338 4.601 1.00 . A A . 38 GLU HA 1 1 11 6757 1 1 38 GLU HB2 H -1.562 5.438 6.471 1.00 . A A . 38 GLU HB2 1 1 11 6758 1 1 38 GLU HB3 H -0.697 4.018 7.043 1.00 . A A . 38 GLU HB3 1 1 11 6759 1 1 38 GLU HG2 H 1.355 5.731 6.601 1.00 . A A . 38 GLU HG2 1 1 11 6760 1 1 38 GLU HG3 H 0.075 6.845 7.080 1.00 . A A . 38 GLU HG3 1 1 11 6761 1 1 38 GLU N N -1.470 4.465 4.213 1.00 . A A . 38 GLU N 1 1 11 6762 1 1 38 GLU O O 0.352 2.398 5.868 1.00 . A A . 38 GLU O 1 1 11 6763 1 1 38 GLU OE1 O -0.268 4.885 9.208 1.00 . A A . 38 GLU OE1 1 1 11 6764 1 1 38 GLU OE2 O 1.749 5.752 9.102 1.00 . A A . 38 GLU OE2 1 1 11 6765 1 1 39 CYS C C 3.013 1.628 5.078 1.00 . A A . 39 CYS C 1 1 11 6766 1 1 39 CYS CA C 2.162 1.875 3.831 1.00 . A A . 39 CYS CA 1 1 11 6767 1 1 39 CYS CB C 3.062 1.983 2.598 1.00 . A A . 39 CYS CB 1 1 11 6768 1 1 39 CYS H H 1.446 3.798 3.309 1.00 . A A . 39 CYS H 1 1 11 6769 1 1 39 CYS HA H 1.485 1.045 3.697 1.00 . A A . 39 CYS HA 1 1 11 6770 1 1 39 CYS HB2 H 2.719 2.801 1.982 1.00 . A A . 39 CYS HB2 1 1 11 6771 1 1 39 CYS HB3 H 4.076 2.181 2.917 1.00 . A A . 39 CYS HB3 1 1 11 6772 1 1 39 CYS N N 1.360 3.085 3.977 1.00 . A A . 39 CYS N 1 1 11 6773 1 1 39 CYS O O 3.974 2.353 5.333 1.00 . A A . 39 CYS O 1 1 11 6774 1 1 39 CYS SG S 3.088 0.485 1.562 1.00 . A A . 39 CYS SG 1 1 11 6775 1 1 40 PRO C C 4.906 0.088 6.834 1.00 . A A . 40 PRO C 1 1 11 6776 1 1 40 PRO CA C 3.415 0.268 7.095 1.00 . A A . 40 PRO CA 1 1 11 6777 1 1 40 PRO CB C 2.790 -1.054 7.551 1.00 . A A . 40 PRO CB 1 1 11 6778 1 1 40 PRO CD C 1.541 -0.323 5.652 1.00 . A A . 40 PRO CD 1 1 11 6779 1 1 40 PRO CG C 1.423 -1.051 6.962 1.00 . A A . 40 PRO CG 1 1 11 6780 1 1 40 PRO HA H 3.274 1.018 7.859 1.00 . A A . 40 PRO HA 1 1 11 6781 1 1 40 PRO HB2 H 3.379 -1.880 7.181 1.00 . A A . 40 PRO HB2 1 1 11 6782 1 1 40 PRO HB3 H 2.754 -1.085 8.630 1.00 . A A . 40 PRO HB3 1 1 11 6783 1 1 40 PRO HD2 H 1.760 -1.017 4.853 1.00 . A A . 40 PRO HD2 1 1 11 6784 1 1 40 PRO HD3 H 0.634 0.224 5.440 1.00 . A A . 40 PRO HD3 1 1 11 6785 1 1 40 PRO HG2 H 1.090 -2.065 6.799 1.00 . A A . 40 PRO HG2 1 1 11 6786 1 1 40 PRO HG3 H 0.741 -0.531 7.618 1.00 . A A . 40 PRO HG3 1 1 11 6787 1 1 40 PRO N N 2.672 0.598 5.875 1.00 . A A . 40 PRO N 1 1 11 6788 1 1 40 PRO O O 5.362 0.174 5.693 1.00 . A A . 40 PRO O 1 1 11 6789 1 1 41 SER C C 7.503 -1.754 8.240 1.00 . A A . 41 SER C 1 1 11 6790 1 1 41 SER CA C 7.104 -0.355 7.784 1.00 . A A . 41 SER CA 1 1 11 6791 1 1 41 SER CB C 7.846 0.696 8.611 1.00 . A A . 41 SER CB 1 1 11 6792 1 1 41 SER H H 5.241 -0.219 8.781 1.00 . A A . 41 SER H 1 1 11 6793 1 1 41 SER HA H 7.373 -0.238 6.745 1.00 . A A . 41 SER HA 1 1 11 6794 1 1 41 SER HB2 H 7.250 0.962 9.471 1.00 . A A . 41 SER HB2 1 1 11 6795 1 1 41 SER HB3 H 8.791 0.289 8.941 1.00 . A A . 41 SER HB3 1 1 11 6796 1 1 41 SER HG H 8.852 1.720 7.278 1.00 . A A . 41 SER HG 1 1 11 6797 1 1 41 SER N N 5.663 -0.162 7.898 1.00 . A A . 41 SER N 1 1 11 6798 1 1 41 SER O O 8.554 -1.942 8.853 1.00 . A A . 41 SER O 1 1 11 6799 1 1 41 SER OG O 8.094 1.865 7.849 1.00 . A A . 41 SER OG 1 1 11 6800 1 1 42 TYR C C 7.133 -4.990 7.083 1.00 . A A . 42 TYR C 1 1 11 6801 1 1 42 TYR CA C 6.921 -4.117 8.318 1.00 . A A . 42 TYR CA 1 1 11 6802 1 1 42 TYR CB C 5.764 -4.669 9.153 1.00 . A A . 42 TYR CB 1 1 11 6803 1 1 42 TYR CD1 C 6.036 -3.527 11.388 1.00 . A A . 42 TYR CD1 1 1 11 6804 1 1 42 TYR CD2 C 4.098 -3.023 10.096 1.00 . A A . 42 TYR CD2 1 1 11 6805 1 1 42 TYR CE1 C 5.607 -2.663 12.378 1.00 . A A . 42 TYR CE1 1 1 11 6806 1 1 42 TYR CE2 C 3.662 -2.157 11.081 1.00 . A A . 42 TYR CE2 1 1 11 6807 1 1 42 TYR CG C 5.291 -3.722 10.233 1.00 . A A . 42 TYR CG 1 1 11 6808 1 1 42 TYR CZ C 4.419 -1.981 12.219 1.00 . A A . 42 TYR CZ 1 1 11 6809 1 1 42 TYR H H 5.835 -2.521 7.448 1.00 . A A . 42 TYR H 1 1 11 6810 1 1 42 TYR HA H 7.822 -4.132 8.913 1.00 . A A . 42 TYR HA 1 1 11 6811 1 1 42 TYR HB2 H 4.927 -4.875 8.503 1.00 . A A . 42 TYR HB2 1 1 11 6812 1 1 42 TYR HB3 H 6.078 -5.586 9.629 1.00 . A A . 42 TYR HB3 1 1 11 6813 1 1 42 TYR HD1 H 6.966 -4.063 11.510 1.00 . A A . 42 TYR HD1 1 1 11 6814 1 1 42 TYR HD2 H 3.506 -3.164 9.204 1.00 . A A . 42 TYR HD2 1 1 11 6815 1 1 42 TYR HE1 H 6.201 -2.525 13.269 1.00 . A A . 42 TYR HE1 1 1 11 6816 1 1 42 TYR HE2 H 2.731 -1.622 10.956 1.00 . A A . 42 TYR HE2 1 1 11 6817 1 1 42 TYR HH H 4.700 -0.518 13.435 1.00 . A A . 42 TYR HH 1 1 11 6818 1 1 42 TYR N N 6.657 -2.734 7.938 1.00 . A A . 42 TYR N 1 1 11 6819 1 1 42 TYR O O 6.190 -5.592 6.569 1.00 . A A . 42 TYR O 1 1 11 6820 1 1 42 TYR OH O 3.989 -1.119 13.202 1.00 . A A . 42 TYR OH 1 1 11 6821 1 1 43 PRO C C 8.219 -7.313 5.531 1.00 . A A . 43 PRO C 1 1 11 6822 1 1 43 PRO CA C 8.713 -5.875 5.408 1.00 . A A . 43 PRO CA 1 1 11 6823 1 1 43 PRO CB C 10.242 -5.836 5.369 1.00 . A A . 43 PRO CB 1 1 11 6824 1 1 43 PRO CD C 9.564 -4.384 7.142 1.00 . A A . 43 PRO CD 1 1 11 6825 1 1 43 PRO CG C 10.608 -4.579 6.077 1.00 . A A . 43 PRO CG 1 1 11 6826 1 1 43 PRO HA H 8.315 -5.435 4.506 1.00 . A A . 43 PRO HA 1 1 11 6827 1 1 43 PRO HB2 H 10.640 -6.705 5.872 1.00 . A A . 43 PRO HB2 1 1 11 6828 1 1 43 PRO HB3 H 10.578 -5.823 4.343 1.00 . A A . 43 PRO HB3 1 1 11 6829 1 1 43 PRO HD2 H 9.879 -4.844 8.067 1.00 . A A . 43 PRO HD2 1 1 11 6830 1 1 43 PRO HD3 H 9.366 -3.333 7.289 1.00 . A A . 43 PRO HD3 1 1 11 6831 1 1 43 PRO HG2 H 11.586 -4.681 6.525 1.00 . A A . 43 PRO HG2 1 1 11 6832 1 1 43 PRO HG3 H 10.596 -3.750 5.385 1.00 . A A . 43 PRO HG3 1 1 11 6833 1 1 43 PRO N N 8.381 -5.070 6.589 1.00 . A A . 43 PRO N 1 1 11 6834 1 1 43 PRO O O 8.542 -8.010 6.492 1.00 . A A . 43 PRO O 1 1 11 6835 1 1 44 GLY C C 6.994 -9.774 3.212 1.00 . A A . 44 GLY C 1 1 11 6836 1 1 44 GLY CA C 6.910 -9.102 4.568 1.00 . A A . 44 GLY CA 1 1 11 6837 1 1 44 GLY H H 7.211 -7.148 3.810 1.00 . A A . 44 GLY H 1 1 11 6838 1 1 44 GLY HA2 H 5.876 -9.071 4.878 1.00 . A A . 44 GLY HA2 1 1 11 6839 1 1 44 GLY HA3 H 7.472 -9.685 5.283 1.00 . A A . 44 GLY HA3 1 1 11 6840 1 1 44 GLY N N 7.435 -7.749 4.551 1.00 . A A . 44 GLY N 1 1 11 6841 1 1 44 GLY O O 6.102 -10.590 2.897 1.00 . A A . 44 GLY O 1 1 11 6842 1 1 44 GLY OXT O 7.952 -9.485 2.465 1.00 . A A . 44 GLY OXT 1 1 12 6843 1 1 1 ALA C C -12.950 15.174 -2.064 1.00 . A A . 1 ALA C 1 1 12 6844 1 1 1 ALA CA C -13.675 14.893 -3.375 1.00 . A A . 1 ALA CA 1 1 12 6845 1 1 1 ALA CB C -12.932 13.830 -4.171 1.00 . A A . 1 ALA CB 1 1 12 6846 1 1 1 ALA H1 H -14.020 16.915 -3.527 1.00 . A A . 1 ALA H1 1 1 12 6847 1 1 1 ALA H2 H -12.924 16.288 -4.687 1.00 . A A . 1 ALA H2 1 1 12 6848 1 1 1 ALA H3 H -14.606 15.987 -4.847 1.00 . A A . 1 ALA H3 1 1 12 6849 1 1 1 ALA HA H -14.663 14.515 -3.154 1.00 . A A . 1 ALA HA 1 1 12 6850 1 1 1 ALA HB1 H -13.637 13.261 -4.758 1.00 . A A . 1 ALA HB1 1 1 12 6851 1 1 1 ALA HB2 H -12.412 13.170 -3.492 1.00 . A A . 1 ALA HB2 1 1 12 6852 1 1 1 ALA HB3 H -12.218 14.306 -4.827 1.00 . A A . 1 ALA HB3 1 1 12 6853 1 1 1 ALA N N -13.819 16.133 -4.182 1.00 . A A . 1 ALA N 1 1 12 6854 1 1 1 ALA O O -12.332 16.226 -1.898 1.00 . A A . 1 ALA O 1 1 12 6855 1 1 2 MET C C -12.462 13.076 0.961 1.00 . A A . 2 MET C 1 1 12 6856 1 1 2 MET CA C -12.382 14.373 0.163 1.00 . A A . 2 MET CA 1 1 12 6857 1 1 2 MET CB C -13.027 15.513 0.954 1.00 . A A . 2 MET CB 1 1 12 6858 1 1 2 MET CE C -9.795 17.892 2.100 1.00 . A A . 2 MET CE 1 1 12 6859 1 1 2 MET CG C -12.042 16.297 1.805 1.00 . A A . 2 MET CG 1 1 12 6860 1 1 2 MET H H -13.538 13.411 -1.326 1.00 . A A . 2 MET H 1 1 12 6861 1 1 2 MET HA H -11.343 14.612 -0.011 1.00 . A A . 2 MET HA 1 1 12 6862 1 1 2 MET HB2 H -13.496 16.196 0.262 1.00 . A A . 2 MET HB2 1 1 12 6863 1 1 2 MET HB3 H -13.783 15.100 1.606 1.00 . A A . 2 MET HB3 1 1 12 6864 1 1 2 MET HE1 H -9.735 17.208 2.933 1.00 . A A . 2 MET HE1 1 1 12 6865 1 1 2 MET HE2 H -8.804 18.073 1.711 1.00 . A A . 2 MET HE2 1 1 12 6866 1 1 2 MET HE3 H -10.227 18.825 2.431 1.00 . A A . 2 MET HE3 1 1 12 6867 1 1 2 MET HG2 H -12.590 17.014 2.398 1.00 . A A . 2 MET HG2 1 1 12 6868 1 1 2 MET HG3 H -11.526 15.610 2.459 1.00 . A A . 2 MET HG3 1 1 12 6869 1 1 2 MET N N -13.030 14.227 -1.135 1.00 . A A . 2 MET N 1 1 12 6870 1 1 2 MET O O -13.358 12.259 0.748 1.00 . A A . 2 MET O 1 1 12 6871 1 1 2 MET SD S -10.821 17.182 0.816 1.00 . A A . 2 MET SD 1 1 12 6872 1 1 3 ASP C C -11.329 10.443 1.851 1.00 . A A . 3 ASP C 1 1 12 6873 1 1 3 ASP CA C -11.483 11.694 2.709 1.00 . A A . 3 ASP CA 1 1 12 6874 1 1 3 ASP CB C -12.755 11.595 3.553 1.00 . A A . 3 ASP CB 1 1 12 6875 1 1 3 ASP CG C -12.499 10.979 4.915 1.00 . A A . 3 ASP CG 1 1 12 6876 1 1 3 ASP H H -10.831 13.580 2.003 1.00 . A A . 3 ASP H 1 1 12 6877 1 1 3 ASP HA H -10.631 11.772 3.367 1.00 . A A . 3 ASP HA 1 1 12 6878 1 1 3 ASP HB2 H -13.163 12.584 3.698 1.00 . A A . 3 ASP HB2 1 1 12 6879 1 1 3 ASP HB3 H -13.479 10.984 3.032 1.00 . A A . 3 ASP HB3 1 1 12 6880 1 1 3 ASP N N -11.519 12.893 1.880 1.00 . A A . 3 ASP N 1 1 12 6881 1 1 3 ASP O O -11.845 9.378 2.191 1.00 . A A . 3 ASP O 1 1 12 6882 1 1 3 ASP OD1 O -11.700 11.552 5.685 1.00 . A A . 3 ASP OD1 1 1 12 6883 1 1 3 ASP OD2 O -13.098 9.923 5.211 1.00 . A A . 3 ASP OD2 1 1 12 6884 1 1 4 CYS C C -9.097 8.730 0.173 1.00 . A A . 4 CYS C 1 1 12 6885 1 1 4 CYS CA C -10.394 9.459 -0.169 1.00 . A A . 4 CYS CA 1 1 12 6886 1 1 4 CYS CB C -10.357 9.950 -1.619 1.00 . A A . 4 CYS CB 1 1 12 6887 1 1 4 CYS H H -10.230 11.453 0.521 1.00 . A A . 4 CYS H 1 1 12 6888 1 1 4 CYS HA H -11.219 8.772 -0.053 1.00 . A A . 4 CYS HA 1 1 12 6889 1 1 4 CYS HB2 H -10.414 11.028 -1.627 1.00 . A A . 4 CYS HB2 1 1 12 6890 1 1 4 CYS HB3 H -9.428 9.641 -2.075 1.00 . A A . 4 CYS HB3 1 1 12 6891 1 1 4 CYS N N -10.616 10.579 0.738 1.00 . A A . 4 CYS N 1 1 12 6892 1 1 4 CYS O O -8.968 7.530 -0.068 1.00 . A A . 4 CYS O 1 1 12 6893 1 1 4 CYS SG S -11.720 9.318 -2.651 1.00 . A A . 4 CYS SG 1 1 12 6894 1 1 5 THR C C -6.134 8.322 -0.113 1.00 . A A . 5 THR C 1 1 12 6895 1 1 5 THR CA C -6.856 8.880 1.110 1.00 . A A . 5 THR CA 1 1 12 6896 1 1 5 THR CB C -7.056 7.773 2.147 1.00 . A A . 5 THR CB 1 1 12 6897 1 1 5 THR CG2 C -5.964 7.731 3.194 1.00 . A A . 5 THR CG2 1 1 12 6898 1 1 5 THR H H -8.301 10.413 0.903 1.00 . A A . 5 THR H 1 1 12 6899 1 1 5 THR HA H -6.252 9.662 1.544 1.00 . A A . 5 THR HA 1 1 12 6900 1 1 5 THR HB H -7.067 6.818 1.642 1.00 . A A . 5 THR HB 1 1 12 6901 1 1 5 THR HG1 H -8.903 7.250 2.538 1.00 . A A . 5 THR HG1 1 1 12 6902 1 1 5 THR HG21 H -5.122 8.319 2.861 1.00 . A A . 5 THR HG21 1 1 12 6903 1 1 5 THR HG22 H -6.341 8.135 4.123 1.00 . A A . 5 THR HG22 1 1 12 6904 1 1 5 THR HG23 H -5.652 6.708 3.347 1.00 . A A . 5 THR HG23 1 1 12 6905 1 1 5 THR N N -8.140 9.461 0.735 1.00 . A A . 5 THR N 1 1 12 6906 1 1 5 THR O O -6.504 7.273 -0.640 1.00 . A A . 5 THR O 1 1 12 6907 1 1 5 THR OG1 O -8.292 7.934 2.821 1.00 . A A . 5 THR OG1 1 1 12 6908 1 1 6 THR C C -2.842 8.517 -1.377 1.00 . A A . 6 THR C 1 1 12 6909 1 1 6 THR CA C -4.326 8.607 -1.718 1.00 . A A . 6 THR CA 1 1 12 6910 1 1 6 THR CB C -4.536 9.579 -2.880 1.00 . A A . 6 THR CB 1 1 12 6911 1 1 6 THR CG2 C -5.991 9.915 -3.124 1.00 . A A . 6 THR CG2 1 1 12 6912 1 1 6 THR H H -4.854 9.858 -0.095 1.00 . A A . 6 THR H 1 1 12 6913 1 1 6 THR HA H -4.676 7.628 -2.011 1.00 . A A . 6 THR HA 1 1 12 6914 1 1 6 THR HB H -4.144 9.133 -3.784 1.00 . A A . 6 THR HB 1 1 12 6915 1 1 6 THR HG1 H -4.165 11.193 -1.836 1.00 . A A . 6 THR HG1 1 1 12 6916 1 1 6 THR HG21 H -6.613 9.109 -2.764 1.00 . A A . 6 THR HG21 1 1 12 6917 1 1 6 THR HG22 H -6.243 10.825 -2.599 1.00 . A A . 6 THR HG22 1 1 12 6918 1 1 6 THR HG23 H -6.157 10.053 -4.182 1.00 . A A . 6 THR HG23 1 1 12 6919 1 1 6 THR N N -5.101 9.031 -0.558 1.00 . A A . 6 THR N 1 1 12 6920 1 1 6 THR O O -2.290 9.405 -0.727 1.00 . A A . 6 THR O 1 1 12 6921 1 1 6 THR OG1 O -3.847 10.794 -2.649 1.00 . A A . 6 THR OG1 1 1 12 6922 1 1 7 GLY C C -0.231 6.002 -2.197 1.00 . A A . 7 GLY C 1 1 12 6923 1 1 7 GLY CA C -0.789 7.255 -1.548 1.00 . A A . 7 GLY CA 1 1 12 6924 1 1 7 GLY H H -2.694 6.764 -2.331 1.00 . A A . 7 GLY H 1 1 12 6925 1 1 7 GLY HA2 H -0.643 7.190 -0.480 1.00 . A A . 7 GLY HA2 1 1 12 6926 1 1 7 GLY HA3 H -0.248 8.112 -1.923 1.00 . A A . 7 GLY HA3 1 1 12 6927 1 1 7 GLY N N -2.202 7.440 -1.818 1.00 . A A . 7 GLY N 1 1 12 6928 1 1 7 GLY O O -0.840 5.453 -3.115 1.00 . A A . 7 GLY O 1 1 12 6929 1 1 8 PRO C C 0.635 3.116 -2.287 1.00 . A A . 8 PRO C 1 1 12 6930 1 1 8 PRO CA C 1.572 4.320 -2.290 1.00 . A A . 8 PRO CA 1 1 12 6931 1 1 8 PRO CB C 2.757 4.076 -1.351 1.00 . A A . 8 PRO CB 1 1 12 6932 1 1 8 PRO CD C 1.733 6.116 -0.647 1.00 . A A . 8 PRO CD 1 1 12 6933 1 1 8 PRO CG C 3.055 5.410 -0.759 1.00 . A A . 8 PRO CG 1 1 12 6934 1 1 8 PRO HA H 1.933 4.490 -3.293 1.00 . A A . 8 PRO HA 1 1 12 6935 1 1 8 PRO HB2 H 2.476 3.360 -0.593 1.00 . A A . 8 PRO HB2 1 1 12 6936 1 1 8 PRO HB3 H 3.596 3.700 -1.917 1.00 . A A . 8 PRO HB3 1 1 12 6937 1 1 8 PRO HD2 H 1.279 5.918 0.313 1.00 . A A . 8 PRO HD2 1 1 12 6938 1 1 8 PRO HD3 H 1.858 7.178 -0.795 1.00 . A A . 8 PRO HD3 1 1 12 6939 1 1 8 PRO HG2 H 3.499 5.287 0.218 1.00 . A A . 8 PRO HG2 1 1 12 6940 1 1 8 PRO HG3 H 3.719 5.960 -1.408 1.00 . A A . 8 PRO HG3 1 1 12 6941 1 1 8 PRO N N 0.938 5.523 -1.738 1.00 . A A . 8 PRO N 1 1 12 6942 1 1 8 PRO O O 0.315 2.565 -3.340 1.00 . A A . 8 PRO O 1 1 12 6943 1 1 9 CYS C C -2.156 2.013 -1.003 1.00 . A A . 9 CYS C 1 1 12 6944 1 1 9 CYS CA C -0.696 1.570 -0.959 1.00 . A A . 9 CYS CA 1 1 12 6945 1 1 9 CYS CB C -0.411 0.828 0.347 1.00 . A A . 9 CYS CB 1 1 12 6946 1 1 9 CYS H H 0.494 3.190 -0.294 1.00 . A A . 9 CYS H 1 1 12 6947 1 1 9 CYS HA H -0.511 0.903 -1.788 1.00 . A A . 9 CYS HA 1 1 12 6948 1 1 9 CYS HB2 H -0.235 1.548 1.132 1.00 . A A . 9 CYS HB2 1 1 12 6949 1 1 9 CYS HB3 H -1.270 0.225 0.605 1.00 . A A . 9 CYS HB3 1 1 12 6950 1 1 9 CYS N N 0.202 2.712 -1.097 1.00 . A A . 9 CYS N 1 1 12 6951 1 1 9 CYS O O -2.950 1.662 -0.130 1.00 . A A . 9 CYS O 1 1 12 6952 1 1 9 CYS SG S 1.038 -0.274 0.273 1.00 . A A . 9 CYS SG 1 1 12 6953 1 1 10 CYS C C -4.227 3.380 -3.669 1.00 . A A . 10 CYS C 1 1 12 6954 1 1 10 CYS CA C -3.866 3.273 -2.191 1.00 . A A . 10 CYS CA 1 1 12 6955 1 1 10 CYS CB C -4.028 4.633 -1.508 1.00 . A A . 10 CYS CB 1 1 12 6956 1 1 10 CYS H H -1.825 3.027 -2.693 1.00 . A A . 10 CYS H 1 1 12 6957 1 1 10 CYS HA H -4.531 2.564 -1.722 1.00 . A A . 10 CYS HA 1 1 12 6958 1 1 10 CYS HB2 H -3.051 5.066 -1.350 1.00 . A A . 10 CYS HB2 1 1 12 6959 1 1 10 CYS HB3 H -4.606 5.284 -2.148 1.00 . A A . 10 CYS HB3 1 1 12 6960 1 1 10 CYS N N -2.502 2.783 -2.028 1.00 . A A . 10 CYS N 1 1 12 6961 1 1 10 CYS O O -3.354 3.551 -4.520 1.00 . A A . 10 CYS O 1 1 12 6962 1 1 10 CYS SG S -4.866 4.555 0.108 1.00 . A A . 10 CYS SG 1 1 12 6963 1 1 11 ARG C C -6.444 4.782 -5.678 1.00 . A A . 11 ARG C 1 1 12 6964 1 1 11 ARG CA C -5.992 3.365 -5.343 1.00 . A A . 11 ARG CA 1 1 12 6965 1 1 11 ARG CB C -7.144 2.383 -5.569 1.00 . A A . 11 ARG CB 1 1 12 6966 1 1 11 ARG CD C -7.668 0.334 -6.926 1.00 . A A . 11 ARG CD 1 1 12 6967 1 1 11 ARG CG C -6.686 0.990 -5.969 1.00 . A A . 11 ARG CG 1 1 12 6968 1 1 11 ARG CZ C -8.524 -1.617 -5.688 1.00 . A A . 11 ARG CZ 1 1 12 6969 1 1 11 ARG H H -6.167 3.143 -3.245 1.00 . A A . 11 ARG H 1 1 12 6970 1 1 11 ARG HA H -5.172 3.099 -5.993 1.00 . A A . 11 ARG HA 1 1 12 6971 1 1 11 ARG HB2 H -7.717 2.303 -4.658 1.00 . A A . 11 ARG HB2 1 1 12 6972 1 1 11 ARG HB3 H -7.781 2.768 -6.352 1.00 . A A . 11 ARG HB3 1 1 12 6973 1 1 11 ARG HD2 H -8.635 0.801 -6.806 1.00 . A A . 11 ARG HD2 1 1 12 6974 1 1 11 ARG HD3 H -7.321 0.485 -7.938 1.00 . A A . 11 ARG HD3 1 1 12 6975 1 1 11 ARG HE H -7.325 -1.709 -7.281 1.00 . A A . 11 ARG HE 1 1 12 6976 1 1 11 ARG HG2 H -5.723 1.063 -6.452 1.00 . A A . 11 ARG HG2 1 1 12 6977 1 1 11 ARG HG3 H -6.601 0.381 -5.081 1.00 . A A . 11 ARG HG3 1 1 12 6978 1 1 11 ARG HH11 H -9.135 0.170 -4.963 1.00 . A A . 11 ARG HH11 1 1 12 6979 1 1 11 ARG HH12 H -9.723 -1.218 -4.110 1.00 . A A . 11 ARG HH12 1 1 12 6980 1 1 11 ARG HH21 H -8.097 -3.535 -6.160 1.00 . A A . 11 ARG HH21 1 1 12 6981 1 1 11 ARG HH22 H -9.133 -3.321 -4.789 1.00 . A A . 11 ARG HH22 1 1 12 6982 1 1 11 ARG N N -5.518 3.279 -3.967 1.00 . A A . 11 ARG N 1 1 12 6983 1 1 11 ARG NE N -7.800 -1.099 -6.678 1.00 . A A . 11 ARG NE 1 1 12 6984 1 1 11 ARG NH1 N -9.181 -0.823 -4.851 1.00 . A A . 11 ARG NH1 1 1 12 6985 1 1 11 ARG NH2 N -8.590 -2.932 -5.533 1.00 . A A . 11 ARG NH2 1 1 12 6986 1 1 11 ARG O O -7.384 4.979 -6.448 1.00 . A A . 11 ARG O 1 1 12 6987 1 1 12 GLN C C -7.444 7.541 -4.704 1.00 . A A . 12 GLN C 1 1 12 6988 1 1 12 GLN CA C -6.100 7.172 -5.330 1.00 . A A . 12 GLN CA 1 1 12 6989 1 1 12 GLN CB C -6.135 7.463 -6.829 1.00 . A A . 12 GLN CB 1 1 12 6990 1 1 12 GLN CD C -4.195 9.041 -7.190 1.00 . A A . 12 GLN CD 1 1 12 6991 1 1 12 GLN CG C -5.702 8.876 -7.187 1.00 . A A . 12 GLN CG 1 1 12 6992 1 1 12 GLN H H -5.030 5.550 -4.490 1.00 . A A . 12 GLN H 1 1 12 6993 1 1 12 GLN HA H -5.328 7.774 -4.875 1.00 . A A . 12 GLN HA 1 1 12 6994 1 1 12 GLN HB2 H -5.479 6.769 -7.334 1.00 . A A . 12 GLN HB2 1 1 12 6995 1 1 12 GLN HB3 H -7.143 7.316 -7.186 1.00 . A A . 12 GLN HB3 1 1 12 6996 1 1 12 GLN HE21 H -4.291 10.112 -8.862 1.00 . A A . 12 GLN HE21 1 1 12 6997 1 1 12 GLN HE22 H -2.707 9.866 -8.218 1.00 . A A . 12 GLN HE22 1 1 12 6998 1 1 12 GLN HG2 H -6.077 9.115 -8.171 1.00 . A A . 12 GLN HG2 1 1 12 6999 1 1 12 GLN HG3 H -6.124 9.561 -6.466 1.00 . A A . 12 GLN HG3 1 1 12 7000 1 1 12 GLN N N -5.769 5.769 -5.094 1.00 . A A . 12 GLN N 1 1 12 7001 1 1 12 GLN NE2 N -3.679 9.744 -8.191 1.00 . A A . 12 GLN NE2 1 1 12 7002 1 1 12 GLN O O -7.972 8.625 -4.950 1.00 . A A . 12 GLN O 1 1 12 7003 1 1 12 GLN OE1 O -3.503 8.543 -6.302 1.00 . A A . 12 GLN OE1 1 1 12 7004 1 1 13 CYS C C -9.684 5.707 -2.358 1.00 . A A . 13 CYS C 1 1 12 7005 1 1 13 CYS CA C -9.276 6.883 -3.243 1.00 . A A . 13 CYS CA 1 1 12 7006 1 1 13 CYS CB C -10.363 7.153 -4.288 1.00 . A A . 13 CYS CB 1 1 12 7007 1 1 13 CYS H H -7.529 5.795 -3.736 1.00 . A A . 13 CYS H 1 1 12 7008 1 1 13 CYS HA H -9.166 7.759 -2.622 1.00 . A A . 13 CYS HA 1 1 12 7009 1 1 13 CYS HB2 H -10.009 6.829 -5.255 1.00 . A A . 13 CYS HB2 1 1 12 7010 1 1 13 CYS HB3 H -11.250 6.594 -4.029 1.00 . A A . 13 CYS HB3 1 1 12 7011 1 1 13 CYS N N -7.994 6.639 -3.896 1.00 . A A . 13 CYS N 1 1 12 7012 1 1 13 CYS O O -10.334 5.893 -1.329 1.00 . A A . 13 CYS O 1 1 12 7013 1 1 13 CYS SG S -10.834 8.908 -4.431 1.00 . A A . 13 CYS SG 1 1 12 7014 1 1 14 LYS C C -8.387 2.538 -1.599 1.00 . A A . 14 LYS C 1 1 12 7015 1 1 14 LYS CA C -9.644 3.303 -1.994 1.00 . A A . 14 LYS CA 1 1 12 7016 1 1 14 LYS CB C -10.573 2.397 -2.805 1.00 . A A . 14 LYS CB 1 1 12 7017 1 1 14 LYS CD C -12.812 2.507 -1.669 1.00 . A A . 14 LYS CD 1 1 12 7018 1 1 14 LYS CE C -13.341 2.271 -0.264 1.00 . A A . 14 LYS CE 1 1 12 7019 1 1 14 LYS CG C -11.589 1.651 -1.955 1.00 . A A . 14 LYS CG 1 1 12 7020 1 1 14 LYS H H -8.792 4.401 -3.589 1.00 . A A . 14 LYS H 1 1 12 7021 1 1 14 LYS HA H -10.156 3.618 -1.098 1.00 . A A . 14 LYS HA 1 1 12 7022 1 1 14 LYS HB2 H -11.110 3.000 -3.522 1.00 . A A . 14 LYS HB2 1 1 12 7023 1 1 14 LYS HB3 H -9.976 1.670 -3.334 1.00 . A A . 14 LYS HB3 1 1 12 7024 1 1 14 LYS HD2 H -12.543 3.547 -1.772 1.00 . A A . 14 LYS HD2 1 1 12 7025 1 1 14 LYS HD3 H -13.586 2.261 -2.382 1.00 . A A . 14 LYS HD3 1 1 12 7026 1 1 14 LYS HE2 H -14.420 2.288 -0.291 1.00 . A A . 14 LYS HE2 1 1 12 7027 1 1 14 LYS HE3 H -13.006 1.302 0.075 1.00 . A A . 14 LYS HE3 1 1 12 7028 1 1 14 LYS HG2 H -11.899 0.761 -2.481 1.00 . A A . 14 LYS HG2 1 1 12 7029 1 1 14 LYS HG3 H -11.126 1.375 -1.018 1.00 . A A . 14 LYS HG3 1 1 12 7030 1 1 14 LYS HZ1 H -12.719 4.212 0.195 1.00 . A A . 14 LYS HZ1 1 1 12 7031 1 1 14 LYS HZ2 H -13.567 3.451 1.445 1.00 . A A . 14 LYS HZ2 1 1 12 7032 1 1 14 LYS HZ3 H -11.965 3.015 1.121 1.00 . A A . 14 LYS HZ3 1 1 12 7033 1 1 14 LYS N N -9.307 4.496 -2.761 1.00 . A A . 14 LYS N 1 1 12 7034 1 1 14 LYS NZ N -12.865 3.310 0.691 1.00 . A A . 14 LYS NZ 1 1 12 7035 1 1 14 LYS O O -7.462 2.391 -2.397 1.00 . A A . 14 LYS O 1 1 12 7036 1 1 15 LEU C C -6.842 0.180 -0.831 1.00 . A A . 15 LEU C 1 1 12 7037 1 1 15 LEU CA C -7.220 1.294 0.139 1.00 . A A . 15 LEU CA 1 1 12 7038 1 1 15 LEU CB C -7.535 0.701 1.513 1.00 . A A . 15 LEU CB 1 1 12 7039 1 1 15 LEU CD1 C -8.569 1.005 3.776 1.00 . A A . 15 LEU CD1 1 1 12 7040 1 1 15 LEU CD2 C -6.789 2.578 2.996 1.00 . A A . 15 LEU CD2 1 1 12 7041 1 1 15 LEU CG C -7.968 1.715 2.573 1.00 . A A . 15 LEU CG 1 1 12 7042 1 1 15 LEU H H -9.132 2.197 0.225 1.00 . A A . 15 LEU H 1 1 12 7043 1 1 15 LEU HA H -6.386 1.974 0.231 1.00 . A A . 15 LEU HA 1 1 12 7044 1 1 15 LEU HB2 H -8.326 -0.025 1.395 1.00 . A A . 15 LEU HB2 1 1 12 7045 1 1 15 LEU HB3 H -6.654 0.192 1.874 1.00 . A A . 15 LEU HB3 1 1 12 7046 1 1 15 LEU HD11 H -8.043 0.077 3.946 1.00 . A A . 15 LEU HD11 1 1 12 7047 1 1 15 LEU HD12 H -8.480 1.635 4.648 1.00 . A A . 15 LEU HD12 1 1 12 7048 1 1 15 LEU HD13 H -9.612 0.797 3.587 1.00 . A A . 15 LEU HD13 1 1 12 7049 1 1 15 LEU HD21 H -5.909 1.960 3.097 1.00 . A A . 15 LEU HD21 1 1 12 7050 1 1 15 LEU HD22 H -6.611 3.336 2.248 1.00 . A A . 15 LEU HD22 1 1 12 7051 1 1 15 LEU HD23 H -7.009 3.050 3.942 1.00 . A A . 15 LEU HD23 1 1 12 7052 1 1 15 LEU HG H -8.725 2.363 2.155 1.00 . A A . 15 LEU HG 1 1 12 7053 1 1 15 LEU N N -8.363 2.049 -0.363 1.00 . A A . 15 LEU N 1 1 12 7054 1 1 15 LEU O O -7.681 -0.639 -1.207 1.00 . A A . 15 LEU O 1 1 12 7055 1 1 16 LYS C C -5.444 -2.261 -1.668 1.00 . A A . 16 LYS C 1 1 12 7056 1 1 16 LYS CA C -5.095 -0.859 -2.166 1.00 . A A . 16 LYS CA 1 1 12 7057 1 1 16 LYS CB C -3.581 -0.732 -2.356 1.00 . A A . 16 LYS CB 1 1 12 7058 1 1 16 LYS CD C -2.449 -0.871 -4.599 1.00 . A A . 16 LYS CD 1 1 12 7059 1 1 16 LYS CE C -2.922 -0.641 -6.026 1.00 . A A . 16 LYS CE 1 1 12 7060 1 1 16 LYS CG C -3.188 0.024 -3.616 1.00 . A A . 16 LYS CG 1 1 12 7061 1 1 16 LYS H H -4.954 0.835 -0.905 1.00 . A A . 16 LYS H 1 1 12 7062 1 1 16 LYS HA H -5.584 -0.693 -3.116 1.00 . A A . 16 LYS HA 1 1 12 7063 1 1 16 LYS HB2 H -3.167 -0.211 -1.505 1.00 . A A . 16 LYS HB2 1 1 12 7064 1 1 16 LYS HB3 H -3.151 -1.722 -2.405 1.00 . A A . 16 LYS HB3 1 1 12 7065 1 1 16 LYS HD2 H -1.393 -0.656 -4.543 1.00 . A A . 16 LYS HD2 1 1 12 7066 1 1 16 LYS HD3 H -2.623 -1.903 -4.333 1.00 . A A . 16 LYS HD3 1 1 12 7067 1 1 16 LYS HE2 H -3.811 -1.230 -6.196 1.00 . A A . 16 LYS HE2 1 1 12 7068 1 1 16 LYS HE3 H -3.156 0.406 -6.150 1.00 . A A . 16 LYS HE3 1 1 12 7069 1 1 16 LYS HG2 H -4.081 0.402 -4.090 1.00 . A A . 16 LYS HG2 1 1 12 7070 1 1 16 LYS HG3 H -2.547 0.849 -3.342 1.00 . A A . 16 LYS HG3 1 1 12 7071 1 1 16 LYS HZ1 H -0.940 -0.785 -6.670 1.00 . A A . 16 LYS HZ1 1 1 12 7072 1 1 16 LYS HZ2 H -1.926 -2.054 -7.199 1.00 . A A . 16 LYS HZ2 1 1 12 7073 1 1 16 LYS HZ3 H -2.050 -0.528 -7.920 1.00 . A A . 16 LYS HZ3 1 1 12 7074 1 1 16 LYS N N -5.577 0.155 -1.237 1.00 . A A . 16 LYS N 1 1 12 7075 1 1 16 LYS NZ N -1.887 -1.029 -7.024 1.00 . A A . 16 LYS NZ 1 1 12 7076 1 1 16 LYS O O -5.614 -2.476 -0.468 1.00 . A A . 16 LYS O 1 1 12 7077 1 1 17 PRO C C -4.917 -5.200 -1.207 1.00 . A A . 17 PRO C 1 1 12 7078 1 1 17 PRO CA C -5.888 -4.619 -2.229 1.00 . A A . 17 PRO CA 1 1 12 7079 1 1 17 PRO CB C -5.786 -5.379 -3.560 1.00 . A A . 17 PRO CB 1 1 12 7080 1 1 17 PRO CD C -5.370 -3.073 -4.033 1.00 . A A . 17 PRO CD 1 1 12 7081 1 1 17 PRO CG C -5.048 -4.468 -4.484 1.00 . A A . 17 PRO CG 1 1 12 7082 1 1 17 PRO HA H -6.895 -4.695 -1.846 1.00 . A A . 17 PRO HA 1 1 12 7083 1 1 17 PRO HB2 H -5.248 -6.303 -3.408 1.00 . A A . 17 PRO HB2 1 1 12 7084 1 1 17 PRO HB3 H -6.778 -5.593 -3.930 1.00 . A A . 17 PRO HB3 1 1 12 7085 1 1 17 PRO HD2 H -4.548 -2.406 -4.246 1.00 . A A . 17 PRO HD2 1 1 12 7086 1 1 17 PRO HD3 H -6.277 -2.722 -4.502 1.00 . A A . 17 PRO HD3 1 1 12 7087 1 1 17 PRO HG2 H -3.987 -4.650 -4.409 1.00 . A A . 17 PRO HG2 1 1 12 7088 1 1 17 PRO HG3 H -5.386 -4.621 -5.498 1.00 . A A . 17 PRO HG3 1 1 12 7089 1 1 17 PRO N N -5.557 -3.236 -2.585 1.00 . A A . 17 PRO N 1 1 12 7090 1 1 17 PRO O O -3.711 -5.265 -1.449 1.00 . A A . 17 PRO O 1 1 12 7091 1 1 18 ALA C C -3.655 -7.232 0.450 1.00 . A A . 18 ALA C 1 1 12 7092 1 1 18 ALA CA C -4.635 -6.201 1.001 1.00 . A A . 18 ALA CA 1 1 12 7093 1 1 18 ALA CB C -5.524 -6.832 2.063 1.00 . A A . 18 ALA CB 1 1 12 7094 1 1 18 ALA H H -6.418 -5.543 0.069 1.00 . A A . 18 ALA H 1 1 12 7095 1 1 18 ALA HA H -4.076 -5.401 1.464 1.00 . A A . 18 ALA HA 1 1 12 7096 1 1 18 ALA HB1 H -6.344 -6.166 2.287 1.00 . A A . 18 ALA HB1 1 1 12 7097 1 1 18 ALA HB2 H -4.947 -7.006 2.959 1.00 . A A . 18 ALA HB2 1 1 12 7098 1 1 18 ALA HB3 H -5.912 -7.770 1.696 1.00 . A A . 18 ALA HB3 1 1 12 7099 1 1 18 ALA N N -5.451 -5.623 -0.063 1.00 . A A . 18 ALA N 1 1 12 7100 1 1 18 ALA O O -4.058 -8.230 -0.148 1.00 . A A . 18 ALA O 1 1 12 7101 1 1 19 GLY C C -0.595 -7.323 -1.027 1.00 . A A . 19 GLY C 1 1 12 7102 1 1 19 GLY CA C -1.347 -7.888 0.162 1.00 . A A . 19 GLY CA 1 1 12 7103 1 1 19 GLY H H -2.105 -6.166 1.129 1.00 . A A . 19 GLY H 1 1 12 7104 1 1 19 GLY HA2 H -1.815 -8.816 -0.131 1.00 . A A . 19 GLY HA2 1 1 12 7105 1 1 19 GLY HA3 H -0.644 -8.086 0.958 1.00 . A A . 19 GLY HA3 1 1 12 7106 1 1 19 GLY N N -2.366 -6.979 0.650 1.00 . A A . 19 GLY N 1 1 12 7107 1 1 19 GLY O O -0.024 -8.069 -1.822 1.00 . A A . 19 GLY O 1 1 12 7108 1 1 20 THR C C 1.364 -4.652 -1.758 1.00 . A A . 20 THR C 1 1 12 7109 1 1 20 THR CA C 0.088 -5.328 -2.247 1.00 . A A . 20 THR CA 1 1 12 7110 1 1 20 THR CB C -0.837 -4.295 -2.893 1.00 . A A . 20 THR CB 1 1 12 7111 1 1 20 THR CG2 C -0.203 -3.566 -4.058 1.00 . A A . 20 THR CG2 1 1 12 7112 1 1 20 THR H H -1.070 -5.458 -0.483 1.00 . A A . 20 THR H 1 1 12 7113 1 1 20 THR HA H 0.348 -6.075 -2.981 1.00 . A A . 20 THR HA 1 1 12 7114 1 1 20 THR HB H -1.110 -3.558 -2.151 1.00 . A A . 20 THR HB 1 1 12 7115 1 1 20 THR HG1 H -1.807 -5.511 -4.084 1.00 . A A . 20 THR HG1 1 1 12 7116 1 1 20 THR HG21 H 0.837 -3.370 -3.837 1.00 . A A . 20 THR HG21 1 1 12 7117 1 1 20 THR HG22 H -0.274 -4.176 -4.946 1.00 . A A . 20 THR HG22 1 1 12 7118 1 1 20 THR HG23 H -0.719 -2.631 -4.220 1.00 . A A . 20 THR HG23 1 1 12 7119 1 1 20 THR N N -0.596 -5.998 -1.148 1.00 . A A . 20 THR N 1 1 12 7120 1 1 20 THR O O 1.315 -3.702 -0.977 1.00 . A A . 20 THR O 1 1 12 7121 1 1 20 THR OG1 O -2.022 -4.910 -3.366 1.00 . A A . 20 THR OG1 1 1 12 7122 1 1 21 THR C C 3.849 -3.089 -2.075 1.00 . A A . 21 THR C 1 1 12 7123 1 1 21 THR CA C 3.799 -4.595 -1.830 1.00 . A A . 21 THR CA 1 1 12 7124 1 1 21 THR CB C 4.924 -5.285 -2.602 1.00 . A A . 21 THR CB 1 1 12 7125 1 1 21 THR CG2 C 4.634 -5.424 -4.080 1.00 . A A . 21 THR CG2 1 1 12 7126 1 1 21 THR H H 2.480 -5.908 -2.840 1.00 . A A . 21 THR H 1 1 12 7127 1 1 21 THR HA H 3.933 -4.780 -0.775 1.00 . A A . 21 THR HA 1 1 12 7128 1 1 21 THR HB H 5.067 -6.277 -2.199 1.00 . A A . 21 THR HB 1 1 12 7129 1 1 21 THR HG1 H 6.802 -5.136 -2.067 1.00 . A A . 21 THR HG1 1 1 12 7130 1 1 21 THR HG21 H 3.621 -5.106 -4.279 1.00 . A A . 21 THR HG21 1 1 12 7131 1 1 21 THR HG22 H 5.322 -4.809 -4.641 1.00 . A A . 21 THR HG22 1 1 12 7132 1 1 21 THR HG23 H 4.752 -6.456 -4.375 1.00 . A A . 21 THR HG23 1 1 12 7133 1 1 21 THR N N 2.506 -5.149 -2.221 1.00 . A A . 21 THR N 1 1 12 7134 1 1 21 THR O O 3.117 -2.562 -2.913 1.00 . A A . 21 THR O 1 1 12 7135 1 1 21 THR OG1 O 6.139 -4.569 -2.467 1.00 . A A . 21 THR OG1 1 1 12 7136 1 1 22 CYS C C 6.150 -0.610 -2.216 1.00 . A A . 22 CYS C 1 1 12 7137 1 1 22 CYS CA C 4.863 -0.960 -1.475 1.00 . A A . 22 CYS CA 1 1 12 7138 1 1 22 CYS CB C 4.858 -0.295 -0.097 1.00 . A A . 22 CYS CB 1 1 12 7139 1 1 22 CYS H H 5.273 -2.881 -0.688 1.00 . A A . 22 CYS H 1 1 12 7140 1 1 22 CYS HA H 4.022 -0.593 -2.044 1.00 . A A . 22 CYS HA 1 1 12 7141 1 1 22 CYS HB2 H 3.931 -0.530 0.404 1.00 . A A . 22 CYS HB2 1 1 12 7142 1 1 22 CYS HB3 H 5.682 -0.682 0.484 1.00 . A A . 22 CYS HB3 1 1 12 7143 1 1 22 CYS N N 4.717 -2.404 -1.339 1.00 . A A . 22 CYS N 1 1 12 7144 1 1 22 CYS O O 6.180 0.321 -3.021 1.00 . A A . 22 CYS O 1 1 12 7145 1 1 22 CYS SG S 5.015 1.520 -0.145 1.00 . A A . 22 CYS SG 1 1 12 7146 1 1 23 TRP C C 9.192 -2.453 -2.899 1.00 . A A . 23 TRP C 1 1 12 7147 1 1 23 TRP CA C 8.499 -1.132 -2.580 1.00 . A A . 23 TRP CA 1 1 12 7148 1 1 23 TRP CB C 9.394 -0.278 -1.680 1.00 . A A . 23 TRP CB 1 1 12 7149 1 1 23 TRP CD1 C 10.745 1.028 -3.421 1.00 . A A . 23 TRP CD1 1 1 12 7150 1 1 23 TRP CD2 C 11.992 -0.184 -2.010 1.00 . A A . 23 TRP CD2 1 1 12 7151 1 1 23 TRP CE2 C 12.848 0.480 -2.909 1.00 . A A . 23 TRP CE2 1 1 12 7152 1 1 23 TRP CE3 C 12.552 -1.006 -1.028 1.00 . A A . 23 TRP CE3 1 1 12 7153 1 1 23 TRP CG C 10.650 0.181 -2.355 1.00 . A A . 23 TRP CG 1 1 12 7154 1 1 23 TRP CH2 C 14.754 -0.465 -1.883 1.00 . A A . 23 TRP CH2 1 1 12 7155 1 1 23 TRP CZ2 C 14.233 0.346 -2.854 1.00 . A A . 23 TRP CZ2 1 1 12 7156 1 1 23 TRP CZ3 C 13.927 -1.138 -0.975 1.00 . A A . 23 TRP CZ3 1 1 12 7157 1 1 23 TRP H H 7.123 -2.090 -1.288 1.00 . A A . 23 TRP H 1 1 12 7158 1 1 23 TRP HA H 8.320 -0.601 -3.502 1.00 . A A . 23 TRP HA 1 1 12 7159 1 1 23 TRP HB2 H 8.846 0.598 -1.365 1.00 . A A . 23 TRP HB2 1 1 12 7160 1 1 23 TRP HB3 H 9.673 -0.855 -0.810 1.00 . A A . 23 TRP HB3 1 1 12 7161 1 1 23 TRP HD1 H 9.899 1.480 -3.917 1.00 . A A . 23 TRP HD1 1 1 12 7162 1 1 23 TRP HE1 H 12.389 1.778 -4.492 1.00 . A A . 23 TRP HE1 1 1 12 7163 1 1 23 TRP HE3 H 11.930 -1.533 -0.320 1.00 . A A . 23 TRP HE3 1 1 12 7164 1 1 23 TRP HH2 H 15.823 -0.598 -1.805 1.00 . A A . 23 TRP HH2 1 1 12 7165 1 1 23 TRP HZ2 H 14.885 0.858 -3.546 1.00 . A A . 23 TRP HZ2 1 1 12 7166 1 1 23 TRP HZ3 H 14.377 -1.769 -0.224 1.00 . A A . 23 TRP HZ3 1 1 12 7167 1 1 23 TRP N N 7.210 -1.362 -1.939 1.00 . A A . 23 TRP N 1 1 12 7168 1 1 23 TRP NE1 N 12.064 1.213 -3.760 1.00 . A A . 23 TRP NE1 1 1 12 7169 1 1 23 TRP O O 9.943 -2.985 -2.082 1.00 . A A . 23 TRP O 1 1 12 7170 1 1 24 ARG C C 10.485 -4.015 -5.691 1.00 . A A . 24 ARG C 1 1 12 7171 1 1 24 ARG CA C 9.532 -4.236 -4.521 1.00 . A A . 24 ARG CA 1 1 12 7172 1 1 24 ARG CB C 8.442 -5.234 -4.917 1.00 . A A . 24 ARG CB 1 1 12 7173 1 1 24 ARG CD C 7.912 -7.653 -5.347 1.00 . A A . 24 ARG CD 1 1 12 7174 1 1 24 ARG CG C 8.784 -6.675 -4.575 1.00 . A A . 24 ARG CG 1 1 12 7175 1 1 24 ARG CZ C 7.936 -10.055 -5.893 1.00 . A A . 24 ARG CZ 1 1 12 7176 1 1 24 ARG H H 8.325 -2.506 -4.701 1.00 . A A . 24 ARG H 1 1 12 7177 1 1 24 ARG HA H 10.090 -4.638 -3.689 1.00 . A A . 24 ARG HA 1 1 12 7178 1 1 24 ARG HB2 H 7.527 -4.972 -4.406 1.00 . A A . 24 ARG HB2 1 1 12 7179 1 1 24 ARG HB3 H 8.280 -5.169 -5.983 1.00 . A A . 24 ARG HB3 1 1 12 7180 1 1 24 ARG HD2 H 6.887 -7.526 -5.033 1.00 . A A . 24 ARG HD2 1 1 12 7181 1 1 24 ARG HD3 H 7.995 -7.433 -6.401 1.00 . A A . 24 ARG HD3 1 1 12 7182 1 1 24 ARG HE H 8.886 -9.224 -4.347 1.00 . A A . 24 ARG HE 1 1 12 7183 1 1 24 ARG HG2 H 9.819 -6.858 -4.822 1.00 . A A . 24 ARG HG2 1 1 12 7184 1 1 24 ARG HG3 H 8.632 -6.829 -3.516 1.00 . A A . 24 ARG HG3 1 1 12 7185 1 1 24 ARG HH11 H 6.846 -8.919 -7.162 1.00 . A A . 24 ARG HH11 1 1 12 7186 1 1 24 ARG HH12 H 6.879 -10.612 -7.524 1.00 . A A . 24 ARG HH12 1 1 12 7187 1 1 24 ARG HH21 H 8.931 -11.451 -4.822 1.00 . A A . 24 ARG HH21 1 1 12 7188 1 1 24 ARG HH22 H 8.063 -12.050 -6.195 1.00 . A A . 24 ARG HH22 1 1 12 7189 1 1 24 ARG N N 8.933 -2.977 -4.093 1.00 . A A . 24 ARG N 1 1 12 7190 1 1 24 ARG NE N 8.310 -9.040 -5.118 1.00 . A A . 24 ARG NE 1 1 12 7191 1 1 24 ARG NH1 N 7.156 -9.844 -6.946 1.00 . A A . 24 ARG NH1 1 1 12 7192 1 1 24 ARG NH2 N 8.344 -11.286 -5.614 1.00 . A A . 24 ARG NH2 1 1 12 7193 1 1 24 ARG O O 10.389 -3.015 -6.402 1.00 . A A . 24 ARG O 1 1 12 7194 1 1 25 THR C C 12.998 -6.224 -7.260 1.00 . A A . 25 THR C 1 1 12 7195 1 1 25 THR CA C 12.373 -4.864 -6.971 1.00 . A A . 25 THR CA 1 1 12 7196 1 1 25 THR CB C 13.466 -3.852 -6.623 1.00 . A A . 25 THR CB 1 1 12 7197 1 1 25 THR CG2 C 13.959 -3.069 -7.820 1.00 . A A . 25 THR CG2 1 1 12 7198 1 1 25 THR H H 11.428 -5.731 -5.286 1.00 . A A . 25 THR H 1 1 12 7199 1 1 25 THR HA H 11.852 -4.529 -7.852 1.00 . A A . 25 THR HA 1 1 12 7200 1 1 25 THR HB H 14.310 -4.379 -6.202 1.00 . A A . 25 THR HB 1 1 12 7201 1 1 25 THR HG1 H 12.331 -2.357 -6.062 1.00 . A A . 25 THR HG1 1 1 12 7202 1 1 25 THR HG21 H 14.163 -3.748 -8.635 1.00 . A A . 25 THR HG21 1 1 12 7203 1 1 25 THR HG22 H 13.204 -2.359 -8.123 1.00 . A A . 25 THR HG22 1 1 12 7204 1 1 25 THR HG23 H 14.864 -2.542 -7.557 1.00 . A A . 25 THR HG23 1 1 12 7205 1 1 25 THR N N 11.403 -4.956 -5.886 1.00 . A A . 25 THR N 1 1 12 7206 1 1 25 THR O O 13.140 -6.622 -8.416 1.00 . A A . 25 THR O 1 1 12 7207 1 1 25 THR OG1 O 12.999 -2.920 -5.663 1.00 . A A . 25 THR OG1 1 1 12 7208 1 1 26 SER C C 14.252 -8.865 -4.965 1.00 . A A . 26 SER C 1 1 12 7209 1 1 26 SER CA C 13.978 -8.250 -6.333 1.00 . A A . 26 SER CA 1 1 12 7210 1 1 26 SER CB C 15.280 -8.155 -7.132 1.00 . A A . 26 SER CB 1 1 12 7211 1 1 26 SER H H 13.226 -6.558 -5.306 1.00 . A A . 26 SER H 1 1 12 7212 1 1 26 SER HA H 13.285 -8.882 -6.865 1.00 . A A . 26 SER HA 1 1 12 7213 1 1 26 SER HB2 H 15.759 -7.210 -6.924 1.00 . A A . 26 SER HB2 1 1 12 7214 1 1 26 SER HB3 H 15.936 -8.963 -6.844 1.00 . A A . 26 SER HB3 1 1 12 7215 1 1 26 SER HG H 15.809 -7.953 -9.007 1.00 . A A . 26 SER HG 1 1 12 7216 1 1 26 SER N N 13.368 -6.932 -6.200 1.00 . A A . 26 SER N 1 1 12 7217 1 1 26 SER O O 14.065 -10.064 -4.763 1.00 . A A . 26 SER O 1 1 12 7218 1 1 26 SER OG O 15.032 -8.243 -8.525 1.00 . A A . 26 SER OG 1 1 12 7219 1 1 27 VAL C C 13.995 -7.929 -1.674 1.00 . A A . 27 VAL C 1 1 12 7220 1 1 27 VAL CA C 14.996 -8.492 -2.679 1.00 . A A . 27 VAL CA 1 1 12 7221 1 1 27 VAL CB C 16.423 -8.090 -2.254 1.00 . A A . 27 VAL CB 1 1 12 7222 1 1 27 VAL CG1 C 16.570 -6.575 -2.229 1.00 . A A . 27 VAL CG1 1 1 12 7223 1 1 27 VAL CG2 C 16.769 -8.691 -0.899 1.00 . A A . 27 VAL CG2 1 1 12 7224 1 1 27 VAL H H 14.823 -7.089 -4.254 1.00 . A A . 27 VAL H 1 1 12 7225 1 1 27 VAL HA H 14.931 -9.570 -2.671 1.00 . A A . 27 VAL HA 1 1 12 7226 1 1 27 VAL HB H 17.116 -8.482 -2.984 1.00 . A A . 27 VAL HB 1 1 12 7227 1 1 27 VAL HG11 H 15.856 -6.155 -1.537 1.00 . A A . 27 VAL HG11 1 1 12 7228 1 1 27 VAL HG12 H 17.571 -6.317 -1.916 1.00 . A A . 27 VAL HG12 1 1 12 7229 1 1 27 VAL HG13 H 16.389 -6.180 -3.218 1.00 . A A . 27 VAL HG13 1 1 12 7230 1 1 27 VAL HG21 H 15.859 -8.933 -0.370 1.00 . A A . 27 VAL HG21 1 1 12 7231 1 1 27 VAL HG22 H 17.352 -9.588 -1.042 1.00 . A A . 27 VAL HG22 1 1 12 7232 1 1 27 VAL HG23 H 17.341 -7.977 -0.324 1.00 . A A . 27 VAL HG23 1 1 12 7233 1 1 27 VAL N N 14.695 -8.033 -4.030 1.00 . A A . 27 VAL N 1 1 12 7234 1 1 27 VAL O O 13.665 -8.579 -0.681 1.00 . A A . 27 VAL O 1 1 12 7235 1 1 28 SER C C 11.138 -6.572 -1.331 1.00 . A A . 28 SER C 1 1 12 7236 1 1 28 SER CA C 12.551 -6.069 -1.057 1.00 . A A . 28 SER CA 1 1 12 7237 1 1 28 SER CB C 12.608 -4.551 -1.236 1.00 . A A . 28 SER CB 1 1 12 7238 1 1 28 SER H H 13.816 -6.251 -2.745 1.00 . A A . 28 SER H 1 1 12 7239 1 1 28 SER HA H 12.817 -6.313 -0.039 1.00 . A A . 28 SER HA 1 1 12 7240 1 1 28 SER HB2 H 13.574 -4.273 -1.630 1.00 . A A . 28 SER HB2 1 1 12 7241 1 1 28 SER HB3 H 11.836 -4.243 -1.926 1.00 . A A . 28 SER HB3 1 1 12 7242 1 1 28 SER HG H 11.534 -3.493 0.015 1.00 . A A . 28 SER HG 1 1 12 7243 1 1 28 SER N N 13.515 -6.719 -1.938 1.00 . A A . 28 SER N 1 1 12 7244 1 1 28 SER O O 10.825 -7.000 -2.442 1.00 . A A . 28 SER O 1 1 12 7245 1 1 28 SER OG O 12.411 -3.884 -0.002 1.00 . A A . 28 SER OG 1 1 12 7246 1 1 29 SER C C 8.129 -6.718 0.846 1.00 . A A . 29 SER C 1 1 12 7247 1 1 29 SER CA C 8.907 -6.968 -0.442 1.00 . A A . 29 SER CA 1 1 12 7248 1 1 29 SER CB C 8.865 -8.455 -0.796 1.00 . A A . 29 SER CB 1 1 12 7249 1 1 29 SER H H 10.596 -6.166 0.550 1.00 . A A . 29 SER H 1 1 12 7250 1 1 29 SER HA H 8.449 -6.404 -1.240 1.00 . A A . 29 SER HA 1 1 12 7251 1 1 29 SER HB2 H 7.919 -8.871 -0.484 1.00 . A A . 29 SER HB2 1 1 12 7252 1 1 29 SER HB3 H 8.974 -8.572 -1.864 1.00 . A A . 29 SER HB3 1 1 12 7253 1 1 29 SER HG H 10.641 -9.281 -0.760 1.00 . A A . 29 SER HG 1 1 12 7254 1 1 29 SER N N 10.288 -6.518 -0.311 1.00 . A A . 29 SER N 1 1 12 7255 1 1 29 SER O O 8.355 -7.380 1.858 1.00 . A A . 29 SER O 1 1 12 7256 1 1 29 SER OG O 9.909 -9.164 -0.150 1.00 . A A . 29 SER OG 1 1 12 7257 1 1 30 HIS C C 4.920 -5.365 1.597 1.00 . A A . 30 HIS C 1 1 12 7258 1 1 30 HIS CA C 6.400 -5.419 1.963 1.00 . A A . 30 HIS CA 1 1 12 7259 1 1 30 HIS CB C 6.842 -4.077 2.548 1.00 . A A . 30 HIS CB 1 1 12 7260 1 1 30 HIS CD2 C 9.407 -4.377 2.788 1.00 . A A . 30 HIS CD2 1 1 12 7261 1 1 30 HIS CE1 C 9.567 -4.052 4.950 1.00 . A A . 30 HIS CE1 1 1 12 7262 1 1 30 HIS CG C 8.159 -4.137 3.256 1.00 . A A . 30 HIS CG 1 1 12 7263 1 1 30 HIS H H 7.077 -5.264 -0.036 1.00 . A A . 30 HIS H 1 1 12 7264 1 1 30 HIS HA H 6.546 -6.190 2.705 1.00 . A A . 30 HIS HA 1 1 12 7265 1 1 30 HIS HB2 H 6.928 -3.355 1.749 1.00 . A A . 30 HIS HB2 1 1 12 7266 1 1 30 HIS HB3 H 6.099 -3.737 3.254 1.00 . A A . 30 HIS HB3 1 1 12 7267 1 1 30 HIS HD1 H 7.565 -3.742 5.239 1.00 . A A . 30 HIS HD1 1 1 12 7268 1 1 30 HIS HD2 H 9.679 -4.578 1.761 1.00 . A A . 30 HIS HD2 1 1 12 7269 1 1 30 HIS HE1 H 9.969 -3.946 5.946 1.00 . A A . 30 HIS HE1 1 1 12 7270 1 1 30 HIS HE2 H 11.240 -4.367 3.812 1.00 . A A . 30 HIS HE2 1 1 12 7271 1 1 30 HIS N N 7.212 -5.757 0.800 1.00 . A A . 30 HIS N 1 1 12 7272 1 1 30 HIS ND1 N 8.294 -3.938 4.614 1.00 . A A . 30 HIS ND1 1 1 12 7273 1 1 30 HIS NE2 N 10.263 -4.319 3.860 1.00 . A A . 30 HIS NE2 1 1 12 7274 1 1 30 HIS O O 4.366 -4.290 1.370 1.00 . A A . 30 HIS O 1 1 12 7275 1 1 31 TYR C C 2.024 -5.823 2.192 1.00 . A A . 31 TYR C 1 1 12 7276 1 1 31 TYR CA C 2.870 -6.618 1.203 1.00 . A A . 31 TYR CA 1 1 12 7277 1 1 31 TYR CB C 2.417 -8.079 1.187 1.00 . A A . 31 TYR CB 1 1 12 7278 1 1 31 TYR CD1 C 3.606 -10.037 0.125 1.00 . A A . 31 TYR CD1 1 1 12 7279 1 1 31 TYR CD2 C 2.650 -8.389 -1.308 1.00 . A A . 31 TYR CD2 1 1 12 7280 1 1 31 TYR CE1 C 4.049 -10.743 -0.977 1.00 . A A . 31 TYR CE1 1 1 12 7281 1 1 31 TYR CE2 C 3.089 -9.090 -2.415 1.00 . A A . 31 TYR CE2 1 1 12 7282 1 1 31 TYR CG C 2.900 -8.849 -0.021 1.00 . A A . 31 TYR CG 1 1 12 7283 1 1 31 TYR CZ C 3.788 -10.266 -2.244 1.00 . A A . 31 TYR CZ 1 1 12 7284 1 1 31 TYR H H 4.782 -7.355 1.733 1.00 . A A . 31 TYR H 1 1 12 7285 1 1 31 TYR HA H 2.739 -6.199 0.217 1.00 . A A . 31 TYR HA 1 1 12 7286 1 1 31 TYR HB2 H 2.794 -8.576 2.068 1.00 . A A . 31 TYR HB2 1 1 12 7287 1 1 31 TYR HB3 H 1.337 -8.114 1.194 1.00 . A A . 31 TYR HB3 1 1 12 7288 1 1 31 TYR HD1 H 3.808 -10.408 1.118 1.00 . A A . 31 TYR HD1 1 1 12 7289 1 1 31 TYR HD2 H 2.102 -7.467 -1.438 1.00 . A A . 31 TYR HD2 1 1 12 7290 1 1 31 TYR HE1 H 4.597 -11.665 -0.843 1.00 . A A . 31 TYR HE1 1 1 12 7291 1 1 31 TYR HE2 H 2.885 -8.715 -3.407 1.00 . A A . 31 TYR HE2 1 1 12 7292 1 1 31 TYR HH H 4.687 -10.371 -3.940 1.00 . A A . 31 TYR HH 1 1 12 7293 1 1 31 TYR N N 4.286 -6.532 1.542 1.00 . A A . 31 TYR N 1 1 12 7294 1 1 31 TYR O O 1.985 -6.135 3.382 1.00 . A A . 31 TYR O 1 1 12 7295 1 1 31 TYR OH O 4.228 -10.967 -3.344 1.00 . A A . 31 TYR OH 1 1 12 7296 1 1 32 CYS C C -0.696 -4.731 3.055 1.00 . A A . 32 CYS C 1 1 12 7297 1 1 32 CYS CA C 0.506 -3.951 2.534 1.00 . A A . 32 CYS CA 1 1 12 7298 1 1 32 CYS CB C 0.032 -2.722 1.755 1.00 . A A . 32 CYS CB 1 1 12 7299 1 1 32 CYS H H 1.423 -4.592 0.734 1.00 . A A . 32 CYS H 1 1 12 7300 1 1 32 CYS HA H 1.099 -3.625 3.375 1.00 . A A . 32 CYS HA 1 1 12 7301 1 1 32 CYS HB2 H 0.083 -2.933 0.698 1.00 . A A . 32 CYS HB2 1 1 12 7302 1 1 32 CYS HB3 H -0.991 -2.506 2.025 1.00 . A A . 32 CYS HB3 1 1 12 7303 1 1 32 CYS N N 1.350 -4.792 1.692 1.00 . A A . 32 CYS N 1 1 12 7304 1 1 32 CYS O O -0.925 -5.875 2.665 1.00 . A A . 32 CYS O 1 1 12 7305 1 1 32 CYS SG S 1.017 -1.222 2.068 1.00 . A A . 32 CYS SG 1 1 12 7306 1 1 33 THR C C -3.927 -4.130 3.953 1.00 . A A . 33 THR C 1 1 12 7307 1 1 33 THR CA C -2.641 -4.730 4.521 1.00 . A A . 33 THR CA 1 1 12 7308 1 1 33 THR CB C -2.625 -4.580 6.044 1.00 . A A . 33 THR CB 1 1 12 7309 1 1 33 THR CG2 C -2.218 -3.196 6.506 1.00 . A A . 33 THR CG2 1 1 12 7310 1 1 33 THR H H -1.223 -3.189 4.212 1.00 . A A . 33 THR H 1 1 12 7311 1 1 33 THR HA H -2.610 -5.780 4.274 1.00 . A A . 33 THR HA 1 1 12 7312 1 1 33 THR HB H -1.920 -5.287 6.458 1.00 . A A . 33 THR HB 1 1 12 7313 1 1 33 THR HG1 H -4.506 -4.141 6.375 1.00 . A A . 33 THR HG1 1 1 12 7314 1 1 33 THR HG21 H -2.874 -2.461 6.064 1.00 . A A . 33 THR HG21 1 1 12 7315 1 1 33 THR HG22 H -2.289 -3.141 7.583 1.00 . A A . 33 THR HG22 1 1 12 7316 1 1 33 THR HG23 H -1.200 -3.000 6.202 1.00 . A A . 33 THR HG23 1 1 12 7317 1 1 33 THR N N -1.460 -4.100 3.941 1.00 . A A . 33 THR N 1 1 12 7318 1 1 33 THR O O -5.023 -4.440 4.420 1.00 . A A . 33 THR O 1 1 12 7319 1 1 33 THR OG1 O -3.903 -4.856 6.591 1.00 . A A . 33 THR OG1 1 1 12 7320 1 1 34 GLY C C -5.800 -1.893 3.345 1.00 . A A . 34 GLY C 1 1 12 7321 1 1 34 GLY CA C -4.955 -2.650 2.339 1.00 . A A . 34 GLY CA 1 1 12 7322 1 1 34 GLY H H -2.897 -3.058 2.608 1.00 . A A . 34 GLY H 1 1 12 7323 1 1 34 GLY HA2 H -5.562 -3.417 1.881 1.00 . A A . 34 GLY HA2 1 1 12 7324 1 1 34 GLY HA3 H -4.626 -1.963 1.573 1.00 . A A . 34 GLY HA3 1 1 12 7325 1 1 34 GLY N N -3.791 -3.271 2.944 1.00 . A A . 34 GLY N 1 1 12 7326 1 1 34 GLY O O -7.011 -1.756 3.171 1.00 . A A . 34 GLY O 1 1 12 7327 1 1 35 ARG C C -5.596 0.841 5.309 1.00 . A A . 35 ARG C 1 1 12 7328 1 1 35 ARG CA C -5.861 -0.655 5.441 1.00 . A A . 35 ARG CA 1 1 12 7329 1 1 35 ARG CB C -5.429 -1.141 6.825 1.00 . A A . 35 ARG CB 1 1 12 7330 1 1 35 ARG CD C -7.364 -2.033 8.158 1.00 . A A . 35 ARG CD 1 1 12 7331 1 1 35 ARG CG C -6.167 -2.386 7.290 1.00 . A A . 35 ARG CG 1 1 12 7332 1 1 35 ARG CZ C -6.901 -3.153 10.304 1.00 . A A . 35 ARG CZ 1 1 12 7333 1 1 35 ARG H H -4.194 -1.544 4.484 1.00 . A A . 35 ARG H 1 1 12 7334 1 1 35 ARG HA H -6.919 -0.834 5.320 1.00 . A A . 35 ARG HA 1 1 12 7335 1 1 35 ARG HB2 H -4.372 -1.363 6.803 1.00 . A A . 35 ARG HB2 1 1 12 7336 1 1 35 ARG HB3 H -5.608 -0.354 7.543 1.00 . A A . 35 ARG HB3 1 1 12 7337 1 1 35 ARG HD2 H -7.176 -1.084 8.638 1.00 . A A . 35 ARG HD2 1 1 12 7338 1 1 35 ARG HD3 H -8.237 -1.950 7.528 1.00 . A A . 35 ARG HD3 1 1 12 7339 1 1 35 ARG HE H -8.349 -3.671 9.032 1.00 . A A . 35 ARG HE 1 1 12 7340 1 1 35 ARG HG2 H -6.511 -2.933 6.426 1.00 . A A . 35 ARG HG2 1 1 12 7341 1 1 35 ARG HG3 H -5.488 -3.003 7.862 1.00 . A A . 35 ARG HG3 1 1 12 7342 1 1 35 ARG HH11 H -5.669 -1.604 9.884 1.00 . A A . 35 ARG HH11 1 1 12 7343 1 1 35 ARG HH12 H -5.365 -2.408 11.387 1.00 . A A . 35 ARG HH12 1 1 12 7344 1 1 35 ARG HH21 H -7.950 -4.729 11.009 1.00 . A A . 35 ARG HH21 1 1 12 7345 1 1 35 ARG HH22 H -6.659 -4.182 12.026 1.00 . A A . 35 ARG HH22 1 1 12 7346 1 1 35 ARG N N -5.160 -1.401 4.402 1.00 . A A . 35 ARG N 1 1 12 7347 1 1 35 ARG NE N -7.613 -3.042 9.185 1.00 . A A . 35 ARG NE 1 1 12 7348 1 1 35 ARG NH1 N -5.896 -2.320 10.545 1.00 . A A . 35 ARG NH1 1 1 12 7349 1 1 35 ARG NH2 N -7.194 -4.099 11.185 1.00 . A A . 35 ARG NH2 1 1 12 7350 1 1 35 ARG O O -6.458 1.663 5.619 1.00 . A A . 35 ARG O 1 1 12 7351 1 1 36 SER C C -3.140 2.764 3.444 1.00 . A A . 36 SER C 1 1 12 7352 1 1 36 SER CA C -4.020 2.585 4.677 1.00 . A A . 36 SER CA 1 1 12 7353 1 1 36 SER CB C -3.287 3.093 5.919 1.00 . A A . 36 SER CB 1 1 12 7354 1 1 36 SER H H -3.754 0.485 4.620 1.00 . A A . 36 SER H 1 1 12 7355 1 1 36 SER HA H -4.925 3.159 4.544 1.00 . A A . 36 SER HA 1 1 12 7356 1 1 36 SER HB2 H -2.607 2.331 6.270 1.00 . A A . 36 SER HB2 1 1 12 7357 1 1 36 SER HB3 H -2.730 3.984 5.667 1.00 . A A . 36 SER HB3 1 1 12 7358 1 1 36 SER HG H -4.324 2.633 7.516 1.00 . A A . 36 SER HG 1 1 12 7359 1 1 36 SER N N -4.399 1.187 4.849 1.00 . A A . 36 SER N 1 1 12 7360 1 1 36 SER O O -2.622 1.792 2.894 1.00 . A A . 36 SER O 1 1 12 7361 1 1 36 SER OG O -4.198 3.404 6.959 1.00 . A A . 36 SER OG 1 1 12 7362 1 1 37 CYS C C -0.674 4.105 2.157 1.00 . A A . 37 CYS C 1 1 12 7363 1 1 37 CYS CA C -2.153 4.315 1.849 1.00 . A A . 37 CYS CA 1 1 12 7364 1 1 37 CYS CB C -2.391 5.755 1.392 1.00 . A A . 37 CYS CB 1 1 12 7365 1 1 37 CYS H H -3.410 4.745 3.497 1.00 . A A . 37 CYS H 1 1 12 7366 1 1 37 CYS HA H -2.443 3.642 1.056 1.00 . A A . 37 CYS HA 1 1 12 7367 1 1 37 CYS HB2 H -2.013 6.431 2.144 1.00 . A A . 37 CYS HB2 1 1 12 7368 1 1 37 CYS HB3 H -1.860 5.923 0.466 1.00 . A A . 37 CYS HB3 1 1 12 7369 1 1 37 CYS N N -2.973 4.011 3.016 1.00 . A A . 37 CYS N 1 1 12 7370 1 1 37 CYS O O 0.111 3.759 1.275 1.00 . A A . 37 CYS O 1 1 12 7371 1 1 37 CYS SG S -4.143 6.167 1.109 1.00 . A A . 37 CYS SG 1 1 12 7372 1 1 38 GLU C C 1.501 2.687 3.770 1.00 . A A . 38 GLU C 1 1 12 7373 1 1 38 GLU CA C 1.083 4.152 3.841 1.00 . A A . 38 GLU CA 1 1 12 7374 1 1 38 GLU CB C 1.267 4.679 5.265 1.00 . A A . 38 GLU CB 1 1 12 7375 1 1 38 GLU CD C -0.136 4.992 7.343 1.00 . A A . 38 GLU CD 1 1 12 7376 1 1 38 GLU CG C 0.346 4.023 6.281 1.00 . A A . 38 GLU CG 1 1 12 7377 1 1 38 GLU H H -0.975 4.592 4.073 1.00 . A A . 38 GLU H 1 1 12 7378 1 1 38 GLU HA H 1.706 4.725 3.171 1.00 . A A . 38 GLU HA 1 1 12 7379 1 1 38 GLU HB2 H 2.288 4.505 5.572 1.00 . A A . 38 GLU HB2 1 1 12 7380 1 1 38 GLU HB3 H 1.075 5.742 5.271 1.00 . A A . 38 GLU HB3 1 1 12 7381 1 1 38 GLU HG2 H -0.514 3.624 5.763 1.00 . A A . 38 GLU HG2 1 1 12 7382 1 1 38 GLU HG3 H 0.879 3.217 6.764 1.00 . A A . 38 GLU HG3 1 1 12 7383 1 1 38 GLU N N -0.302 4.318 3.415 1.00 . A A . 38 GLU N 1 1 12 7384 1 1 38 GLU O O 0.676 1.806 3.527 1.00 . A A . 38 GLU O 1 1 12 7385 1 1 38 GLU OE1 O -0.472 6.141 6.989 1.00 . A A . 38 GLU OE1 1 1 12 7386 1 1 38 GLU OE2 O -0.177 4.601 8.528 1.00 . A A . 38 GLU OE2 1 1 12 7387 1 1 39 CYS C C 4.431 0.894 4.973 1.00 . A A . 39 CYS C 1 1 12 7388 1 1 39 CYS CA C 3.317 1.075 3.945 1.00 . A A . 39 CYS CA 1 1 12 7389 1 1 39 CYS CB C 3.841 0.750 2.545 1.00 . A A . 39 CYS CB 1 1 12 7390 1 1 39 CYS H H 3.397 3.178 4.173 1.00 . A A . 39 CYS H 1 1 12 7391 1 1 39 CYS HA H 2.509 0.399 4.182 1.00 . A A . 39 CYS HA 1 1 12 7392 1 1 39 CYS HB2 H 4.450 -0.140 2.594 1.00 . A A . 39 CYS HB2 1 1 12 7393 1 1 39 CYS HB3 H 3.003 0.570 1.888 1.00 . A A . 39 CYS HB3 1 1 12 7394 1 1 39 CYS N N 2.788 2.434 3.984 1.00 . A A . 39 CYS N 1 1 12 7395 1 1 39 CYS O O 5.604 1.119 4.674 1.00 . A A . 39 CYS O 1 1 12 7396 1 1 39 CYS SG S 4.854 2.071 1.803 1.00 . A A . 39 CYS SG 1 1 12 7397 1 1 40 PRO C C 5.965 -0.925 7.002 1.00 . A A . 40 PRO C 1 1 12 7398 1 1 40 PRO CA C 5.058 0.270 7.275 1.00 . A A . 40 PRO CA 1 1 12 7399 1 1 40 PRO CB C 4.189 0.011 8.508 1.00 . A A . 40 PRO CB 1 1 12 7400 1 1 40 PRO CD C 2.703 0.188 6.645 1.00 . A A . 40 PRO CD 1 1 12 7401 1 1 40 PRO CG C 2.902 -0.506 7.964 1.00 . A A . 40 PRO CG 1 1 12 7402 1 1 40 PRO HA H 5.663 1.150 7.436 1.00 . A A . 40 PRO HA 1 1 12 7403 1 1 40 PRO HB2 H 4.671 -0.717 9.144 1.00 . A A . 40 PRO HB2 1 1 12 7404 1 1 40 PRO HB3 H 4.045 0.933 9.051 1.00 . A A . 40 PRO HB3 1 1 12 7405 1 1 40 PRO HD2 H 2.204 -0.468 5.946 1.00 . A A . 40 PRO HD2 1 1 12 7406 1 1 40 PRO HD3 H 2.139 1.099 6.779 1.00 . A A . 40 PRO HD3 1 1 12 7407 1 1 40 PRO HG2 H 2.967 -1.574 7.820 1.00 . A A . 40 PRO HG2 1 1 12 7408 1 1 40 PRO HG3 H 2.095 -0.265 8.640 1.00 . A A . 40 PRO HG3 1 1 12 7409 1 1 40 PRO N N 4.079 0.481 6.203 1.00 . A A . 40 PRO N 1 1 12 7410 1 1 40 PRO O O 5.810 -1.619 5.997 1.00 . A A . 40 PRO O 1 1 12 7411 1 1 41 SER C C 7.250 -3.558 8.321 1.00 . A A . 41 SER C 1 1 12 7412 1 1 41 SER CA C 7.847 -2.269 7.760 1.00 . A A . 41 SER CA 1 1 12 7413 1 1 41 SER CB C 9.165 -1.949 8.470 1.00 . A A . 41 SER CB 1 1 12 7414 1 1 41 SER H H 6.987 -0.570 8.683 1.00 . A A . 41 SER H 1 1 12 7415 1 1 41 SER HA H 8.040 -2.406 6.707 1.00 . A A . 41 SER HA 1 1 12 7416 1 1 41 SER HB2 H 8.963 -1.683 9.497 1.00 . A A . 41 SER HB2 1 1 12 7417 1 1 41 SER HB3 H 9.806 -2.818 8.443 1.00 . A A . 41 SER HB3 1 1 12 7418 1 1 41 SER HG H 9.404 -0.044 8.082 1.00 . A A . 41 SER HG 1 1 12 7419 1 1 41 SER N N 6.914 -1.158 7.903 1.00 . A A . 41 SER N 1 1 12 7420 1 1 41 SER O O 7.825 -4.187 9.210 1.00 . A A . 41 SER O 1 1 12 7421 1 1 41 SER OG O 9.833 -0.869 7.843 1.00 . A A . 41 SER OG 1 1 12 7422 1 1 42 TYR C C 5.459 -6.233 7.158 1.00 . A A . 42 TYR C 1 1 12 7423 1 1 42 TYR CA C 5.417 -5.157 8.240 1.00 . A A . 42 TYR CA 1 1 12 7424 1 1 42 TYR CB C 3.966 -4.850 8.613 1.00 . A A . 42 TYR CB 1 1 12 7425 1 1 42 TYR CD1 C 4.572 -3.505 10.662 1.00 . A A . 42 TYR CD1 1 1 12 7426 1 1 42 TYR CD2 C 2.810 -5.099 10.843 1.00 . A A . 42 TYR CD2 1 1 12 7427 1 1 42 TYR CE1 C 4.405 -3.162 11.990 1.00 . A A . 42 TYR CE1 1 1 12 7428 1 1 42 TYR CE2 C 2.636 -4.762 12.172 1.00 . A A . 42 TYR CE2 1 1 12 7429 1 1 42 TYR CG C 3.779 -4.478 10.067 1.00 . A A . 42 TYR CG 1 1 12 7430 1 1 42 TYR CZ C 3.436 -3.793 12.741 1.00 . A A . 42 TYR CZ 1 1 12 7431 1 1 42 TYR H H 5.684 -3.401 7.088 1.00 . A A . 42 TYR H 1 1 12 7432 1 1 42 TYR HA H 5.934 -5.522 9.115 1.00 . A A . 42 TYR HA 1 1 12 7433 1 1 42 TYR HB2 H 3.614 -4.024 8.012 1.00 . A A . 42 TYR HB2 1 1 12 7434 1 1 42 TYR HB3 H 3.358 -5.719 8.411 1.00 . A A . 42 TYR HB3 1 1 12 7435 1 1 42 TYR HD1 H 5.331 -3.012 10.071 1.00 . A A . 42 TYR HD1 1 1 12 7436 1 1 42 TYR HD2 H 2.185 -5.858 10.396 1.00 . A A . 42 TYR HD2 1 1 12 7437 1 1 42 TYR HE1 H 5.031 -2.403 12.435 1.00 . A A . 42 TYR HE1 1 1 12 7438 1 1 42 TYR HE2 H 1.877 -5.257 12.760 1.00 . A A . 42 TYR HE2 1 1 12 7439 1 1 42 TYR HH H 3.292 -4.248 14.603 1.00 . A A . 42 TYR HH 1 1 12 7440 1 1 42 TYR N N 6.093 -3.944 7.794 1.00 . A A . 42 TYR N 1 1 12 7441 1 1 42 TYR O O 4.541 -6.346 6.346 1.00 . A A . 42 TYR O 1 1 12 7442 1 1 42 TYR OH O 3.266 -3.455 14.063 1.00 . A A . 42 TYR OH 1 1 12 7443 1 1 43 PRO C C 5.706 -9.257 6.365 1.00 . A A . 43 PRO C 1 1 12 7444 1 1 43 PRO CA C 6.690 -8.114 6.143 1.00 . A A . 43 PRO CA 1 1 12 7445 1 1 43 PRO CB C 8.126 -8.594 6.363 1.00 . A A . 43 PRO CB 1 1 12 7446 1 1 43 PRO CD C 7.674 -6.977 8.064 1.00 . A A . 43 PRO CD 1 1 12 7447 1 1 43 PRO CG C 8.429 -8.246 7.779 1.00 . A A . 43 PRO CG 1 1 12 7448 1 1 43 PRO HA H 6.583 -7.740 5.135 1.00 . A A . 43 PRO HA 1 1 12 7449 1 1 43 PRO HB2 H 8.181 -9.660 6.197 1.00 . A A . 43 PRO HB2 1 1 12 7450 1 1 43 PRO HB3 H 8.789 -8.083 5.681 1.00 . A A . 43 PRO HB3 1 1 12 7451 1 1 43 PRO HD2 H 7.335 -6.963 9.089 1.00 . A A . 43 PRO HD2 1 1 12 7452 1 1 43 PRO HD3 H 8.291 -6.116 7.857 1.00 . A A . 43 PRO HD3 1 1 12 7453 1 1 43 PRO HG2 H 8.092 -9.038 8.432 1.00 . A A . 43 PRO HG2 1 1 12 7454 1 1 43 PRO HG3 H 9.490 -8.085 7.899 1.00 . A A . 43 PRO HG3 1 1 12 7455 1 1 43 PRO N N 6.533 -7.043 7.132 1.00 . A A . 43 PRO N 1 1 12 7456 1 1 43 PRO O O 5.274 -9.507 7.491 1.00 . A A . 43 PRO O 1 1 12 7457 1 1 44 GLY C C 4.983 -12.214 6.186 1.00 . A A . 44 GLY C 1 1 12 7458 1 1 44 GLY CA C 4.424 -11.056 5.384 1.00 . A A . 44 GLY CA 1 1 12 7459 1 1 44 GLY H H 5.731 -9.702 4.414 1.00 . A A . 44 GLY H 1 1 12 7460 1 1 44 GLY HA2 H 4.187 -11.403 4.389 1.00 . A A . 44 GLY HA2 1 1 12 7461 1 1 44 GLY HA3 H 3.517 -10.709 5.858 1.00 . A A . 44 GLY HA3 1 1 12 7462 1 1 44 GLY N N 5.355 -9.947 5.285 1.00 . A A . 44 GLY N 1 1 12 7463 1 1 44 GLY O O 4.204 -12.862 6.916 1.00 . A A . 44 GLY O 1 1 12 7464 1 1 44 GLY OXT O 6.201 -12.473 6.085 1.00 . A A . 44 GLY OXT 1 1 13 7465 1 1 1 ALA C C -11.419 9.286 6.076 1.00 . A A . 1 ALA C 1 1 13 7466 1 1 1 ALA CA C -12.334 8.314 6.812 1.00 . A A . 1 ALA CA 1 1 13 7467 1 1 1 ALA CB C -13.781 8.770 6.705 1.00 . A A . 1 ALA CB 1 1 13 7468 1 1 1 ALA H1 H -10.958 7.841 8.266 1.00 . A A . 1 ALA H1 1 1 13 7469 1 1 1 ALA H2 H -12.016 9.126 8.675 1.00 . A A . 1 ALA H2 1 1 13 7470 1 1 1 ALA H3 H -12.589 7.509 8.687 1.00 . A A . 1 ALA H3 1 1 13 7471 1 1 1 ALA HA H -12.254 7.342 6.349 1.00 . A A . 1 ALA HA 1 1 13 7472 1 1 1 ALA HB1 H -14.394 8.181 7.372 1.00 . A A . 1 ALA HB1 1 1 13 7473 1 1 1 ALA HB2 H -13.852 9.812 6.978 1.00 . A A . 1 ALA HB2 1 1 13 7474 1 1 1 ALA HB3 H -14.126 8.640 5.690 1.00 . A A . 1 ALA HB3 1 1 13 7475 1 1 1 ALA N N -11.939 8.186 8.239 1.00 . A A . 1 ALA N 1 1 13 7476 1 1 1 ALA O O -10.712 10.081 6.697 1.00 . A A . 1 ALA O 1 1 13 7477 1 1 2 MET C C -11.341 10.500 2.654 1.00 . A A . 2 MET C 1 1 13 7478 1 1 2 MET CA C -10.607 10.092 3.927 1.00 . A A . 2 MET CA 1 1 13 7479 1 1 2 MET CB C -9.292 9.397 3.571 1.00 . A A . 2 MET CB 1 1 13 7480 1 1 2 MET CE C -5.931 8.093 4.079 1.00 . A A . 2 MET CE 1 1 13 7481 1 1 2 MET CG C -8.199 9.595 4.609 1.00 . A A . 2 MET CG 1 1 13 7482 1 1 2 MET H H -12.020 8.564 4.311 1.00 . A A . 2 MET H 1 1 13 7483 1 1 2 MET HA H -10.390 10.980 4.503 1.00 . A A . 2 MET HA 1 1 13 7484 1 1 2 MET HB2 H -9.474 8.337 3.469 1.00 . A A . 2 MET HB2 1 1 13 7485 1 1 2 MET HB3 H -8.937 9.784 2.628 1.00 . A A . 2 MET HB3 1 1 13 7486 1 1 2 MET HE1 H -6.669 7.382 3.738 1.00 . A A . 2 MET HE1 1 1 13 7487 1 1 2 MET HE2 H -5.026 7.976 3.502 1.00 . A A . 2 MET HE2 1 1 13 7488 1 1 2 MET HE3 H -5.717 7.917 5.123 1.00 . A A . 2 MET HE3 1 1 13 7489 1 1 2 MET HG2 H -8.413 10.491 5.172 1.00 . A A . 2 MET HG2 1 1 13 7490 1 1 2 MET HG3 H -8.196 8.745 5.275 1.00 . A A . 2 MET HG3 1 1 13 7491 1 1 2 MET N N -11.436 9.218 4.749 1.00 . A A . 2 MET N 1 1 13 7492 1 1 2 MET O O -12.500 10.137 2.451 1.00 . A A . 2 MET O 1 1 13 7493 1 1 2 MET SD S -6.562 9.756 3.871 1.00 . A A . 2 MET SD 1 1 13 7494 1 1 3 ASP C C -10.833 10.808 -0.611 1.00 . A A . 3 ASP C 1 1 13 7495 1 1 3 ASP CA C -11.247 11.712 0.546 1.00 . A A . 3 ASP CA 1 1 13 7496 1 1 3 ASP CB C -10.829 13.156 0.259 1.00 . A A . 3 ASP CB 1 1 13 7497 1 1 3 ASP CG C -11.708 14.165 0.971 1.00 . A A . 3 ASP CG 1 1 13 7498 1 1 3 ASP H H -9.739 11.512 2.018 1.00 . A A . 3 ASP H 1 1 13 7499 1 1 3 ASP HA H -12.320 11.673 0.649 1.00 . A A . 3 ASP HA 1 1 13 7500 1 1 3 ASP HB2 H -9.810 13.301 0.584 1.00 . A A . 3 ASP HB2 1 1 13 7501 1 1 3 ASP HB3 H -10.892 13.338 -0.804 1.00 . A A . 3 ASP HB3 1 1 13 7502 1 1 3 ASP N N -10.659 11.256 1.800 1.00 . A A . 3 ASP N 1 1 13 7503 1 1 3 ASP O O -11.604 9.956 -1.052 1.00 . A A . 3 ASP O 1 1 13 7504 1 1 3 ASP OD1 O -11.727 14.159 2.220 1.00 . A A . 3 ASP OD1 1 1 13 7505 1 1 3 ASP OD2 O -12.377 14.962 0.281 1.00 . A A . 3 ASP OD2 1 1 13 7506 1 1 4 CYS C C -7.920 9.339 -1.761 1.00 . A A . 4 CYS C 1 1 13 7507 1 1 4 CYS CA C -9.097 10.205 -2.206 1.00 . A A . 4 CYS CA 1 1 13 7508 1 1 4 CYS CB C -8.671 11.118 -3.358 1.00 . A A . 4 CYS CB 1 1 13 7509 1 1 4 CYS H H -9.045 11.698 -0.706 1.00 . A A . 4 CYS H 1 1 13 7510 1 1 4 CYS HA H -9.892 9.559 -2.548 1.00 . A A . 4 CYS HA 1 1 13 7511 1 1 4 CYS HB2 H -8.585 12.129 -2.991 1.00 . A A . 4 CYS HB2 1 1 13 7512 1 1 4 CYS HB3 H -7.711 10.793 -3.732 1.00 . A A . 4 CYS HB3 1 1 13 7513 1 1 4 CYS N N -9.612 11.001 -1.099 1.00 . A A . 4 CYS N 1 1 13 7514 1 1 4 CYS O O -7.666 8.282 -2.338 1.00 . A A . 4 CYS O 1 1 13 7515 1 1 4 CYS SG S -9.835 11.137 -4.760 1.00 . A A . 4 CYS SG 1 1 13 7516 1 1 5 THR C C -5.164 8.533 -1.326 1.00 . A A . 5 THR C 1 1 13 7517 1 1 5 THR CA C -6.049 9.071 -0.204 1.00 . A A . 5 THR CA 1 1 13 7518 1 1 5 THR CB C -6.502 7.923 0.705 1.00 . A A . 5 THR CB 1 1 13 7519 1 1 5 THR CG2 C -7.574 7.047 0.091 1.00 . A A . 5 THR CG2 1 1 13 7520 1 1 5 THR H H -7.458 10.647 -0.319 1.00 . A A . 5 THR H 1 1 13 7521 1 1 5 THR HA H -5.469 9.767 0.384 1.00 . A A . 5 THR HA 1 1 13 7522 1 1 5 THR HB H -6.900 8.339 1.619 1.00 . A A . 5 THR HB 1 1 13 7523 1 1 5 THR HG1 H -5.552 6.702 1.905 1.00 . A A . 5 THR HG1 1 1 13 7524 1 1 5 THR HG21 H -7.231 6.671 -0.861 1.00 . A A . 5 THR HG21 1 1 13 7525 1 1 5 THR HG22 H -7.782 6.218 0.751 1.00 . A A . 5 THR HG22 1 1 13 7526 1 1 5 THR HG23 H -8.473 7.627 -0.054 1.00 . A A . 5 THR HG23 1 1 13 7527 1 1 5 THR N N -7.204 9.797 -0.733 1.00 . A A . 5 THR N 1 1 13 7528 1 1 5 THR O O -5.392 7.439 -1.842 1.00 . A A . 5 THR O 1 1 13 7529 1 1 5 THR OG1 O -5.408 7.088 1.038 1.00 . A A . 5 THR OG1 1 1 13 7530 1 1 6 THR C C -1.879 8.513 -2.185 1.00 . A A . 6 THR C 1 1 13 7531 1 1 6 THR CA C -3.234 8.914 -2.760 1.00 . A A . 6 THR CA 1 1 13 7532 1 1 6 THR CB C -3.057 10.056 -3.763 1.00 . A A . 6 THR CB 1 1 13 7533 1 1 6 THR CG2 C -4.363 10.701 -4.173 1.00 . A A . 6 THR CG2 1 1 13 7534 1 1 6 THR H H -4.022 10.172 -1.251 1.00 . A A . 6 THR H 1 1 13 7535 1 1 6 THR HA H -3.662 8.064 -3.268 1.00 . A A . 6 THR HA 1 1 13 7536 1 1 6 THR HB H -2.585 9.667 -4.654 1.00 . A A . 6 THR HB 1 1 13 7537 1 1 6 THR HG1 H -1.311 10.887 -3.450 1.00 . A A . 6 THR HG1 1 1 13 7538 1 1 6 THR HG21 H -5.182 10.037 -3.938 1.00 . A A . 6 THR HG21 1 1 13 7539 1 1 6 THR HG22 H -4.488 11.631 -3.639 1.00 . A A . 6 THR HG22 1 1 13 7540 1 1 6 THR HG23 H -4.350 10.894 -5.236 1.00 . A A . 6 THR HG23 1 1 13 7541 1 1 6 THR N N -4.153 9.311 -1.699 1.00 . A A . 6 THR N 1 1 13 7542 1 1 6 THR O O -1.393 9.123 -1.232 1.00 . A A . 6 THR O 1 1 13 7543 1 1 6 THR OG1 O -2.226 11.070 -3.226 1.00 . A A . 6 THR OG1 1 1 13 7544 1 1 7 GLY C C 0.355 5.631 -2.812 1.00 . A A . 7 GLY C 1 1 13 7545 1 1 7 GLY CA C 0.018 7.020 -2.303 1.00 . A A . 7 GLY CA 1 1 13 7546 1 1 7 GLY H H -1.711 7.037 -3.526 1.00 . A A . 7 GLY H 1 1 13 7547 1 1 7 GLY HA2 H 0.014 7.005 -1.223 1.00 . A A . 7 GLY HA2 1 1 13 7548 1 1 7 GLY HA3 H 0.778 7.709 -2.640 1.00 . A A . 7 GLY HA3 1 1 13 7549 1 1 7 GLY N N -1.275 7.484 -2.770 1.00 . A A . 7 GLY N 1 1 13 7550 1 1 7 GLY O O -0.406 5.050 -3.586 1.00 . A A . 7 GLY O 1 1 13 7551 1 1 8 PRO C C 0.871 2.666 -2.542 1.00 . A A . 8 PRO C 1 1 13 7552 1 1 8 PRO CA C 1.927 3.730 -2.819 1.00 . A A . 8 PRO CA 1 1 13 7553 1 1 8 PRO CB C 3.182 3.467 -1.981 1.00 . A A . 8 PRO CB 1 1 13 7554 1 1 8 PRO CD C 2.468 5.688 -1.470 1.00 . A A . 8 PRO CD 1 1 13 7555 1 1 8 PRO CG C 3.686 4.820 -1.613 1.00 . A A . 8 PRO CG 1 1 13 7556 1 1 8 PRO HA H 2.183 3.715 -3.869 1.00 . A A . 8 PRO HA 1 1 13 7557 1 1 8 PRO HB2 H 2.918 2.892 -1.106 1.00 . A A . 8 PRO HB2 1 1 13 7558 1 1 8 PRO HB3 H 3.905 2.925 -2.571 1.00 . A A . 8 PRO HB3 1 1 13 7559 1 1 8 PRO HD2 H 2.104 5.663 -0.453 1.00 . A A . 8 PRO HD2 1 1 13 7560 1 1 8 PRO HD3 H 2.689 6.702 -1.769 1.00 . A A . 8 PRO HD3 1 1 13 7561 1 1 8 PRO HG2 H 4.223 4.769 -0.678 1.00 . A A . 8 PRO HG2 1 1 13 7562 1 1 8 PRO HG3 H 4.326 5.199 -2.396 1.00 . A A . 8 PRO HG3 1 1 13 7563 1 1 8 PRO N N 1.500 5.067 -2.392 1.00 . A A . 8 PRO N 1 1 13 7564 1 1 8 PRO O O 0.715 1.717 -3.311 1.00 . A A . 8 PRO O 1 1 13 7565 1 1 9 CYS C C -2.252 2.283 -1.625 1.00 . A A . 9 CYS C 1 1 13 7566 1 1 9 CYS CA C -0.891 1.876 -1.059 1.00 . A A . 9 CYS CA 1 1 13 7567 1 1 9 CYS CB C -0.973 1.762 0.464 1.00 . A A . 9 CYS CB 1 1 13 7568 1 1 9 CYS H H 0.320 3.602 -0.863 1.00 . A A . 9 CYS H 1 1 13 7569 1 1 9 CYS HA H -0.621 0.914 -1.467 1.00 . A A . 9 CYS HA 1 1 13 7570 1 1 9 CYS HB2 H -0.569 2.660 0.906 1.00 . A A . 9 CYS HB2 1 1 13 7571 1 1 9 CYS HB3 H -2.008 1.657 0.756 1.00 . A A . 9 CYS HB3 1 1 13 7572 1 1 9 CYS N N 0.149 2.827 -1.438 1.00 . A A . 9 CYS N 1 1 13 7573 1 1 9 CYS O O -3.281 1.725 -1.243 1.00 . A A . 9 CYS O 1 1 13 7574 1 1 9 CYS SG S -0.056 0.347 1.154 1.00 . A A . 9 CYS SG 1 1 13 7575 1 1 10 CYS C C -3.353 3.812 -4.662 1.00 . A A . 10 CYS C 1 1 13 7576 1 1 10 CYS CA C -3.493 3.721 -3.146 1.00 . A A . 10 CYS CA 1 1 13 7577 1 1 10 CYS CB C -3.885 5.085 -2.576 1.00 . A A . 10 CYS CB 1 1 13 7578 1 1 10 CYS H H -1.406 3.662 -2.804 1.00 . A A . 10 CYS H 1 1 13 7579 1 1 10 CYS HA H -4.269 3.007 -2.911 1.00 . A A . 10 CYS HA 1 1 13 7580 1 1 10 CYS HB2 H -3.155 5.818 -2.883 1.00 . A A . 10 CYS HB2 1 1 13 7581 1 1 10 CYS HB3 H -4.854 5.364 -2.963 1.00 . A A . 10 CYS HB3 1 1 13 7582 1 1 10 CYS N N -2.255 3.253 -2.536 1.00 . A A . 10 CYS N 1 1 13 7583 1 1 10 CYS O O -2.338 4.284 -5.175 1.00 . A A . 10 CYS O 1 1 13 7584 1 1 10 CYS SG S -3.980 5.128 -0.757 1.00 . A A . 10 CYS SG 1 1 13 7585 1 1 11 ARG C C -4.213 4.806 -7.351 1.00 . A A . 11 ARG C 1 1 13 7586 1 1 11 ARG CA C -4.368 3.382 -6.833 1.00 . A A . 11 ARG CA 1 1 13 7587 1 1 11 ARG CB C -5.655 2.765 -7.384 1.00 . A A . 11 ARG CB 1 1 13 7588 1 1 11 ARG CD C -6.910 0.684 -8.024 1.00 . A A . 11 ARG CD 1 1 13 7589 1 1 11 ARG CG C -5.587 1.254 -7.539 1.00 . A A . 11 ARG CG 1 1 13 7590 1 1 11 ARG CZ C -6.350 -1.599 -8.763 1.00 . A A . 11 ARG CZ 1 1 13 7591 1 1 11 ARG H H -5.158 2.989 -4.909 1.00 . A A . 11 ARG H 1 1 13 7592 1 1 11 ARG HA H -3.529 2.799 -7.169 1.00 . A A . 11 ARG HA 1 1 13 7593 1 1 11 ARG HB2 H -6.469 3.000 -6.714 1.00 . A A . 11 ARG HB2 1 1 13 7594 1 1 11 ARG HB3 H -5.862 3.195 -8.352 1.00 . A A . 11 ARG HB3 1 1 13 7595 1 1 11 ARG HD2 H -7.708 1.104 -7.430 1.00 . A A . 11 ARG HD2 1 1 13 7596 1 1 11 ARG HD3 H -7.049 0.961 -9.059 1.00 . A A . 11 ARG HD3 1 1 13 7597 1 1 11 ARG HE H -7.457 -1.154 -7.164 1.00 . A A . 11 ARG HE 1 1 13 7598 1 1 11 ARG HG2 H -4.817 1.010 -8.255 1.00 . A A . 11 ARG HG2 1 1 13 7599 1 1 11 ARG HG3 H -5.345 0.815 -6.582 1.00 . A A . 11 ARG HG3 1 1 13 7600 1 1 11 ARG HH11 H -5.587 -0.130 -9.926 1.00 . A A . 11 ARG HH11 1 1 13 7601 1 1 11 ARG HH12 H -5.207 -1.744 -10.425 1.00 . A A . 11 ARG HH12 1 1 13 7602 1 1 11 ARG HH21 H -6.959 -3.278 -7.818 1.00 . A A . 11 ARG HH21 1 1 13 7603 1 1 11 ARG HH22 H -5.986 -3.531 -9.228 1.00 . A A . 11 ARG HH22 1 1 13 7604 1 1 11 ARG N N -4.377 3.354 -5.375 1.00 . A A . 11 ARG N 1 1 13 7605 1 1 11 ARG NE N -6.953 -0.772 -7.912 1.00 . A A . 11 ARG NE 1 1 13 7606 1 1 11 ARG NH1 N -5.658 -1.118 -9.789 1.00 . A A . 11 ARG NH1 1 1 13 7607 1 1 11 ARG NH2 N -6.439 -2.910 -8.589 1.00 . A A . 11 ARG NH2 1 1 13 7608 1 1 11 ARG O O -3.542 5.044 -8.355 1.00 . A A . 11 ARG O 1 1 13 7609 1 1 12 GLN C C -5.853 7.944 -6.272 1.00 . A A . 12 GLN C 1 1 13 7610 1 1 12 GLN CA C -4.788 7.159 -7.026 1.00 . A A . 12 GLN CA 1 1 13 7611 1 1 12 GLN CB C -4.989 7.337 -8.535 1.00 . A A . 12 GLN CB 1 1 13 7612 1 1 12 GLN CD C -5.685 5.724 -10.353 1.00 . A A . 12 GLN CD 1 1 13 7613 1 1 12 GLN CG C -6.107 6.479 -9.108 1.00 . A A . 12 GLN CG 1 1 13 7614 1 1 12 GLN H H -5.356 5.484 -5.864 1.00 . A A . 12 GLN H 1 1 13 7615 1 1 12 GLN HA H -3.814 7.539 -6.753 1.00 . A A . 12 GLN HA 1 1 13 7616 1 1 12 GLN HB2 H -5.223 8.372 -8.735 1.00 . A A . 12 GLN HB2 1 1 13 7617 1 1 12 GLN HB3 H -4.071 7.081 -9.042 1.00 . A A . 12 GLN HB3 1 1 13 7618 1 1 12 GLN HE21 H -7.586 5.481 -10.881 1.00 . A A . 12 GLN HE21 1 1 13 7619 1 1 12 GLN HE22 H -6.417 4.800 -11.955 1.00 . A A . 12 GLN HE22 1 1 13 7620 1 1 12 GLN HG2 H -6.415 5.764 -8.360 1.00 . A A . 12 GLN HG2 1 1 13 7621 1 1 12 GLN HG3 H -6.941 7.118 -9.358 1.00 . A A . 12 GLN HG3 1 1 13 7622 1 1 12 GLN N N -4.840 5.747 -6.654 1.00 . A A . 12 GLN N 1 1 13 7623 1 1 12 GLN NE2 N -6.661 5.292 -11.143 1.00 . A A . 12 GLN NE2 1 1 13 7624 1 1 12 GLN O O -5.686 9.132 -5.995 1.00 . A A . 12 GLN O 1 1 13 7625 1 1 12 GLN OE1 O -4.495 5.532 -10.604 1.00 . A A . 12 GLN OE1 1 1 13 7626 1 1 13 CYS C C -8.818 6.874 -4.391 1.00 . A A . 13 CYS C 1 1 13 7627 1 1 13 CYS CA C -8.047 7.899 -5.218 1.00 . A A . 13 CYS CA 1 1 13 7628 1 1 13 CYS CB C -8.992 8.601 -6.196 1.00 . A A . 13 CYS CB 1 1 13 7629 1 1 13 CYS H H -7.021 6.322 -6.192 1.00 . A A . 13 CYS H 1 1 13 7630 1 1 13 CYS HA H -7.623 8.636 -4.552 1.00 . A A . 13 CYS HA 1 1 13 7631 1 1 13 CYS HB2 H -8.846 8.190 -7.184 1.00 . A A . 13 CYS HB2 1 1 13 7632 1 1 13 CYS HB3 H -10.013 8.428 -5.887 1.00 . A A . 13 CYS HB3 1 1 13 7633 1 1 13 CYS N N -6.949 7.269 -5.942 1.00 . A A . 13 CYS N 1 1 13 7634 1 1 13 CYS O O -10.004 7.052 -4.115 1.00 . A A . 13 CYS O 1 1 13 7635 1 1 13 CYS SG S -8.743 10.403 -6.306 1.00 . A A . 13 CYS SG 1 1 13 7636 1 1 14 LYS C C -7.722 3.754 -2.707 1.00 . A A . 14 LYS C 1 1 13 7637 1 1 14 LYS CA C -8.763 4.753 -3.200 1.00 . A A . 14 LYS CA 1 1 13 7638 1 1 14 LYS CB C -9.833 4.030 -4.021 1.00 . A A . 14 LYS CB 1 1 13 7639 1 1 14 LYS CD C -12.002 3.884 -2.761 1.00 . A A . 14 LYS CD 1 1 13 7640 1 1 14 LYS CE C -12.700 3.180 -1.609 1.00 . A A . 14 LYS CE 1 1 13 7641 1 1 14 LYS CG C -10.744 3.144 -3.186 1.00 . A A . 14 LYS CG 1 1 13 7642 1 1 14 LYS H H -7.194 5.714 -4.245 1.00 . A A . 14 LYS H 1 1 13 7643 1 1 14 LYS HA H -9.231 5.219 -2.346 1.00 . A A . 14 LYS HA 1 1 13 7644 1 1 14 LYS HB2 H -10.443 4.765 -4.523 1.00 . A A . 14 LYS HB2 1 1 13 7645 1 1 14 LYS HB3 H -9.346 3.412 -4.761 1.00 . A A . 14 LYS HB3 1 1 13 7646 1 1 14 LYS HD2 H -11.734 4.882 -2.450 1.00 . A A . 14 LYS HD2 1 1 13 7647 1 1 14 LYS HD3 H -12.678 3.936 -3.602 1.00 . A A . 14 LYS HD3 1 1 13 7648 1 1 14 LYS HE2 H -12.652 2.114 -1.773 1.00 . A A . 14 LYS HE2 1 1 13 7649 1 1 14 LYS HE3 H -12.187 3.425 -0.691 1.00 . A A . 14 LYS HE3 1 1 13 7650 1 1 14 LYS HG2 H -11.026 2.282 -3.771 1.00 . A A . 14 LYS HG2 1 1 13 7651 1 1 14 LYS HG3 H -10.209 2.825 -2.304 1.00 . A A . 14 LYS HG3 1 1 13 7652 1 1 14 LYS HZ1 H -14.628 3.395 -2.382 1.00 . A A . 14 LYS HZ1 1 1 13 7653 1 1 14 LYS HZ2 H -14.588 3.057 -0.724 1.00 . A A . 14 LYS HZ2 1 1 13 7654 1 1 14 LYS HZ3 H -14.193 4.604 -1.282 1.00 . A A . 14 LYS HZ3 1 1 13 7655 1 1 14 LYS N N -8.138 5.802 -3.996 1.00 . A A . 14 LYS N 1 1 13 7656 1 1 14 LYS NZ N -14.127 3.587 -1.491 1.00 . A A . 14 LYS NZ 1 1 13 7657 1 1 14 LYS O O -6.740 3.475 -3.395 1.00 . A A . 14 LYS O 1 1 13 7658 1 1 15 LEU C C -6.829 1.055 -1.855 1.00 . A A . 15 LEU C 1 1 13 7659 1 1 15 LEU CA C -7.024 2.248 -0.926 1.00 . A A . 15 LEU CA 1 1 13 7660 1 1 15 LEU CB C -7.547 1.771 0.430 1.00 . A A . 15 LEU CB 1 1 13 7661 1 1 15 LEU CD1 C -8.931 2.434 2.411 1.00 . A A . 15 LEU CD1 1 1 13 7662 1 1 15 LEU CD2 C -6.594 3.292 2.178 1.00 . A A . 15 LEU CD2 1 1 13 7663 1 1 15 LEU CG C -7.856 2.882 1.434 1.00 . A A . 15 LEU CG 1 1 13 7664 1 1 15 LEU H H -8.744 3.479 -1.010 1.00 . A A . 15 LEU H 1 1 13 7665 1 1 15 LEU HA H -6.073 2.738 -0.783 1.00 . A A . 15 LEU HA 1 1 13 7666 1 1 15 LEU HB2 H -8.451 1.202 0.264 1.00 . A A . 15 LEU HB2 1 1 13 7667 1 1 15 LEU HB3 H -6.807 1.117 0.868 1.00 . A A . 15 LEU HB3 1 1 13 7668 1 1 15 LEU HD11 H -8.796 1.387 2.640 1.00 . A A . 15 LEU HD11 1 1 13 7669 1 1 15 LEU HD12 H -8.857 3.013 3.320 1.00 . A A . 15 LEU HD12 1 1 13 7670 1 1 15 LEU HD13 H -9.905 2.583 1.968 1.00 . A A . 15 LEU HD13 1 1 13 7671 1 1 15 LEU HD21 H -6.000 2.415 2.390 1.00 . A A . 15 LEU HD21 1 1 13 7672 1 1 15 LEU HD22 H -6.022 3.975 1.568 1.00 . A A . 15 LEU HD22 1 1 13 7673 1 1 15 LEU HD23 H -6.864 3.777 3.105 1.00 . A A . 15 LEU HD23 1 1 13 7674 1 1 15 LEU HG H -8.227 3.746 0.902 1.00 . A A . 15 LEU HG 1 1 13 7675 1 1 15 LEU N N -7.944 3.218 -1.511 1.00 . A A . 15 LEU N 1 1 13 7676 1 1 15 LEU O O -7.790 0.378 -2.222 1.00 . A A . 15 LEU O 1 1 13 7677 1 1 16 LYS C C -5.797 -1.625 -2.561 1.00 . A A . 16 LYS C 1 1 13 7678 1 1 16 LYS CA C -5.261 -0.310 -3.123 1.00 . A A . 16 LYS CA 1 1 13 7679 1 1 16 LYS CB C -3.749 -0.409 -3.329 1.00 . A A . 16 LYS CB 1 1 13 7680 1 1 16 LYS CD C -2.092 -0.090 -5.192 1.00 . A A . 16 LYS CD 1 1 13 7681 1 1 16 LYS CE C -1.590 0.847 -6.279 1.00 . A A . 16 LYS CE 1 1 13 7682 1 1 16 LYS CG C -3.215 0.543 -4.387 1.00 . A A . 16 LYS CG 1 1 13 7683 1 1 16 LYS H H -4.856 1.378 -1.910 1.00 . A A . 16 LYS H 1 1 13 7684 1 1 16 LYS HA H -5.734 -0.118 -4.074 1.00 . A A . 16 LYS HA 1 1 13 7685 1 1 16 LYS HB2 H -3.254 -0.190 -2.395 1.00 . A A . 16 LYS HB2 1 1 13 7686 1 1 16 LYS HB3 H -3.504 -1.418 -3.628 1.00 . A A . 16 LYS HB3 1 1 13 7687 1 1 16 LYS HD2 H -1.274 -0.325 -4.528 1.00 . A A . 16 LYS HD2 1 1 13 7688 1 1 16 LYS HD3 H -2.458 -0.997 -5.651 1.00 . A A . 16 LYS HD3 1 1 13 7689 1 1 16 LYS HE2 H -2.241 0.763 -7.137 1.00 . A A . 16 LYS HE2 1 1 13 7690 1 1 16 LYS HE3 H -1.617 1.859 -5.905 1.00 . A A . 16 LYS HE3 1 1 13 7691 1 1 16 LYS HG2 H -4.019 0.809 -5.057 1.00 . A A . 16 LYS HG2 1 1 13 7692 1 1 16 LYS HG3 H -2.841 1.432 -3.900 1.00 . A A . 16 LYS HG3 1 1 13 7693 1 1 16 LYS HZ1 H -0.126 -0.488 -6.943 1.00 . A A . 16 LYS HZ1 1 1 13 7694 1 1 16 LYS HZ2 H 0.071 1.090 -7.522 1.00 . A A . 16 LYS HZ2 1 1 13 7695 1 1 16 LYS HZ3 H 0.464 0.722 -5.919 1.00 . A A . 16 LYS HZ3 1 1 13 7696 1 1 16 LYS N N -5.580 0.803 -2.234 1.00 . A A . 16 LYS N 1 1 13 7697 1 1 16 LYS NZ N -0.198 0.520 -6.695 1.00 . A A . 16 LYS NZ 1 1 13 7698 1 1 16 LYS O O -6.039 -1.744 -1.360 1.00 . A A . 16 LYS O 1 1 13 7699 1 1 17 PRO C C -5.717 -4.525 -1.837 1.00 . A A . 17 PRO C 1 1 13 7700 1 1 17 PRO CA C -6.501 -3.945 -3.009 1.00 . A A . 17 PRO CA 1 1 13 7701 1 1 17 PRO CB C -6.318 -4.812 -4.256 1.00 . A A . 17 PRO CB 1 1 13 7702 1 1 17 PRO CD C -5.728 -2.580 -4.877 1.00 . A A . 17 PRO CD 1 1 13 7703 1 1 17 PRO CG C -6.346 -3.850 -5.393 1.00 . A A . 17 PRO CG 1 1 13 7704 1 1 17 PRO HA H -7.549 -3.896 -2.750 1.00 . A A . 17 PRO HA 1 1 13 7705 1 1 17 PRO HB2 H -5.373 -5.332 -4.200 1.00 . A A . 17 PRO HB2 1 1 13 7706 1 1 17 PRO HB3 H -7.126 -5.525 -4.324 1.00 . A A . 17 PRO HB3 1 1 13 7707 1 1 17 PRO HD2 H -4.666 -2.569 -5.076 1.00 . A A . 17 PRO HD2 1 1 13 7708 1 1 17 PRO HD3 H -6.206 -1.720 -5.322 1.00 . A A . 17 PRO HD3 1 1 13 7709 1 1 17 PRO HG2 H -5.767 -4.240 -6.217 1.00 . A A . 17 PRO HG2 1 1 13 7710 1 1 17 PRO HG3 H -7.366 -3.673 -5.699 1.00 . A A . 17 PRO HG3 1 1 13 7711 1 1 17 PRO N N -5.991 -2.635 -3.427 1.00 . A A . 17 PRO N 1 1 13 7712 1 1 17 PRO O O -4.501 -4.703 -1.918 1.00 . A A . 17 PRO O 1 1 13 7713 1 1 18 ALA C C -4.890 -6.560 0.093 1.00 . A A . 18 ALA C 1 1 13 7714 1 1 18 ALA CA C -5.791 -5.380 0.446 1.00 . A A . 18 ALA CA 1 1 13 7715 1 1 18 ALA CB C -6.852 -5.808 1.449 1.00 . A A . 18 ALA CB 1 1 13 7716 1 1 18 ALA H H -7.386 -4.653 -0.742 1.00 . A A . 18 ALA H 1 1 13 7717 1 1 18 ALA HA H -5.191 -4.606 0.902 1.00 . A A . 18 ALA HA 1 1 13 7718 1 1 18 ALA HB1 H -7.634 -5.064 1.485 1.00 . A A . 18 ALA HB1 1 1 13 7719 1 1 18 ALA HB2 H -6.404 -5.906 2.427 1.00 . A A . 18 ALA HB2 1 1 13 7720 1 1 18 ALA HB3 H -7.271 -6.757 1.148 1.00 . A A . 18 ALA HB3 1 1 13 7721 1 1 18 ALA N N -6.420 -4.819 -0.746 1.00 . A A . 18 ALA N 1 1 13 7722 1 1 18 ALA O O -5.366 -7.615 -0.326 1.00 . A A . 18 ALA O 1 1 13 7723 1 1 19 GLY C C -1.755 -7.078 -1.234 1.00 . A A . 19 GLY C 1 1 13 7724 1 1 19 GLY CA C -2.635 -7.422 -0.048 1.00 . A A . 19 GLY CA 1 1 13 7725 1 1 19 GLY H H -3.265 -5.506 0.595 1.00 . A A . 19 GLY H 1 1 13 7726 1 1 19 GLY HA2 H -3.177 -8.330 -0.267 1.00 . A A . 19 GLY HA2 1 1 13 7727 1 1 19 GLY HA3 H -2.007 -7.589 0.815 1.00 . A A . 19 GLY HA3 1 1 13 7728 1 1 19 GLY N N -3.585 -6.370 0.261 1.00 . A A . 19 GLY N 1 1 13 7729 1 1 19 GLY O O -1.182 -7.965 -1.868 1.00 . A A . 19 GLY O 1 1 13 7730 1 1 20 THR C C 0.477 -4.722 -2.155 1.00 . A A . 20 THR C 1 1 13 7731 1 1 20 THR CA C -0.831 -5.329 -2.654 1.00 . A A . 20 THR CA 1 1 13 7732 1 1 20 THR CB C -1.601 -4.300 -3.484 1.00 . A A . 20 THR CB 1 1 13 7733 1 1 20 THR CG2 C -0.830 -3.801 -4.687 1.00 . A A . 20 THR CG2 1 1 13 7734 1 1 20 THR H H -2.126 -5.128 -0.994 1.00 . A A . 20 THR H 1 1 13 7735 1 1 20 THR HA H -0.605 -6.184 -3.274 1.00 . A A . 20 THR HA 1 1 13 7736 1 1 20 THR HB H -1.829 -3.448 -2.860 1.00 . A A . 20 THR HB 1 1 13 7737 1 1 20 THR HG1 H -3.493 -4.760 -3.274 1.00 . A A . 20 THR HG1 1 1 13 7738 1 1 20 THR HG21 H 0.166 -3.514 -4.383 1.00 . A A . 20 THR HG21 1 1 13 7739 1 1 20 THR HG22 H -0.769 -4.585 -5.427 1.00 . A A . 20 THR HG22 1 1 13 7740 1 1 20 THR HG23 H -1.337 -2.946 -5.109 1.00 . A A . 20 THR HG23 1 1 13 7741 1 1 20 THR N N -1.647 -5.788 -1.536 1.00 . A A . 20 THR N 1 1 13 7742 1 1 20 THR O O 0.473 -3.768 -1.378 1.00 . A A . 20 THR O 1 1 13 7743 1 1 20 THR OG1 O -2.821 -4.847 -3.953 1.00 . A A . 20 THR OG1 1 1 13 7744 1 1 21 THR C C 3.055 -3.304 -2.481 1.00 . A A . 21 THR C 1 1 13 7745 1 1 21 THR CA C 2.911 -4.798 -2.203 1.00 . A A . 21 THR CA 1 1 13 7746 1 1 21 THR CB C 4.008 -5.572 -2.937 1.00 . A A . 21 THR CB 1 1 13 7747 1 1 21 THR CG2 C 3.739 -5.730 -4.418 1.00 . A A . 21 THR CG2 1 1 13 7748 1 1 21 THR H H 1.533 -6.042 -3.223 1.00 . A A . 21 THR H 1 1 13 7749 1 1 21 THR HA H 3.015 -4.966 -1.142 1.00 . A A . 21 THR HA 1 1 13 7750 1 1 21 THR HB H 4.084 -6.561 -2.508 1.00 . A A . 21 THR HB 1 1 13 7751 1 1 21 THR HG1 H 5.264 -4.113 -3.302 1.00 . A A . 21 THR HG1 1 1 13 7752 1 1 21 THR HG21 H 2.754 -5.351 -4.647 1.00 . A A . 21 THR HG21 1 1 13 7753 1 1 21 THR HG22 H 4.477 -5.176 -4.979 1.00 . A A . 21 THR HG22 1 1 13 7754 1 1 21 THR HG23 H 3.794 -6.775 -4.685 1.00 . A A . 21 THR HG23 1 1 13 7755 1 1 21 THR N N 1.595 -5.283 -2.606 1.00 . A A . 21 THR N 1 1 13 7756 1 1 21 THR O O 2.876 -2.853 -3.612 1.00 . A A . 21 THR O 1 1 13 7757 1 1 21 THR OG1 O 5.261 -4.927 -2.793 1.00 . A A . 21 THR OG1 1 1 13 7758 1 1 22 CYS C C 5.022 -0.715 -1.486 1.00 . A A . 22 CYS C 1 1 13 7759 1 1 22 CYS CA C 3.548 -1.100 -1.572 1.00 . A A . 22 CYS CA 1 1 13 7760 1 1 22 CYS CB C 2.754 -0.370 -0.487 1.00 . A A . 22 CYS CB 1 1 13 7761 1 1 22 CYS H H 3.510 -2.962 -0.565 1.00 . A A . 22 CYS H 1 1 13 7762 1 1 22 CYS HA H 3.169 -0.809 -2.540 1.00 . A A . 22 CYS HA 1 1 13 7763 1 1 22 CYS HB2 H 3.038 0.672 -0.483 1.00 . A A . 22 CYS HB2 1 1 13 7764 1 1 22 CYS HB3 H 1.700 -0.449 -0.709 1.00 . A A . 22 CYS HB3 1 1 13 7765 1 1 22 CYS N N 3.380 -2.543 -1.441 1.00 . A A . 22 CYS N 1 1 13 7766 1 1 22 CYS O O 5.456 0.258 -2.102 1.00 . A A . 22 CYS O 1 1 13 7767 1 1 22 CYS SG S 3.016 -1.019 1.196 1.00 . A A . 22 CYS SG 1 1 13 7768 1 1 23 TRP C C 8.041 -2.191 -1.395 1.00 . A A . 23 TRP C 1 1 13 7769 1 1 23 TRP CA C 7.211 -1.225 -0.553 1.00 . A A . 23 TRP CA 1 1 13 7770 1 1 23 TRP CB C 7.605 -1.343 0.920 1.00 . A A . 23 TRP CB 1 1 13 7771 1 1 23 TRP CD1 C 8.730 0.944 1.182 1.00 . A A . 23 TRP CD1 1 1 13 7772 1 1 23 TRP CD2 C 9.964 -0.776 1.909 1.00 . A A . 23 TRP CD2 1 1 13 7773 1 1 23 TRP CE2 C 10.691 0.413 2.108 1.00 . A A . 23 TRP CE2 1 1 13 7774 1 1 23 TRP CE3 C 10.541 -1.990 2.293 1.00 . A A . 23 TRP CE3 1 1 13 7775 1 1 23 TRP CG C 8.712 -0.414 1.316 1.00 . A A . 23 TRP CG 1 1 13 7776 1 1 23 TRP CH2 C 12.504 -0.780 3.039 1.00 . A A . 23 TRP CH2 1 1 13 7777 1 1 23 TRP CZ2 C 11.964 0.423 2.673 1.00 . A A . 23 TRP CZ2 1 1 13 7778 1 1 23 TRP CZ3 C 11.805 -1.979 2.853 1.00 . A A . 23 TRP CZ3 1 1 13 7779 1 1 23 TRP H H 5.382 -2.248 -0.253 1.00 . A A . 23 TRP H 1 1 13 7780 1 1 23 TRP HA H 7.405 -0.217 -0.889 1.00 . A A . 23 TRP HA 1 1 13 7781 1 1 23 TRP HB2 H 6.746 -1.118 1.535 1.00 . A A . 23 TRP HB2 1 1 13 7782 1 1 23 TRP HB3 H 7.929 -2.354 1.120 1.00 . A A . 23 TRP HB3 1 1 13 7783 1 1 23 TRP HD1 H 7.922 1.524 0.761 1.00 . A A . 23 TRP HD1 1 1 13 7784 1 1 23 TRP HE1 H 10.167 2.397 1.668 1.00 . A A . 23 TRP HE1 1 1 13 7785 1 1 23 TRP HE3 H 10.018 -2.925 2.158 1.00 . A A . 23 TRP HE3 1 1 13 7786 1 1 23 TRP HH2 H 13.489 -0.819 3.480 1.00 . A A . 23 TRP HH2 1 1 13 7787 1 1 23 TRP HZ2 H 12.516 1.339 2.823 1.00 . A A . 23 TRP HZ2 1 1 13 7788 1 1 23 TRP HZ3 H 12.267 -2.907 3.155 1.00 . A A . 23 TRP HZ3 1 1 13 7789 1 1 23 TRP N N 5.786 -1.486 -0.719 1.00 . A A . 23 TRP N 1 1 13 7790 1 1 23 TRP NE1 N 9.916 1.449 1.656 1.00 . A A . 23 TRP NE1 1 1 13 7791 1 1 23 TRP O O 8.742 -3.052 -0.863 1.00 . A A . 23 TRP O 1 1 13 7792 1 1 24 ARG C C 10.198 -2.769 -3.404 1.00 . A A . 24 ARG C 1 1 13 7793 1 1 24 ARG CA C 8.696 -2.901 -3.629 1.00 . A A . 24 ARG CA 1 1 13 7794 1 1 24 ARG CB C 8.353 -2.551 -5.079 1.00 . A A . 24 ARG CB 1 1 13 7795 1 1 24 ARG CD C 6.953 -4.271 -6.263 1.00 . A A . 24 ARG CD 1 1 13 7796 1 1 24 ARG CG C 8.360 -3.752 -6.011 1.00 . A A . 24 ARG CG 1 1 13 7797 1 1 24 ARG CZ C 5.713 -5.261 -8.148 1.00 . A A . 24 ARG CZ 1 1 13 7798 1 1 24 ARG H H 7.378 -1.338 -3.078 1.00 . A A . 24 ARG H 1 1 13 7799 1 1 24 ARG HA H 8.404 -3.922 -3.436 1.00 . A A . 24 ARG HA 1 1 13 7800 1 1 24 ARG HB2 H 7.369 -2.106 -5.106 1.00 . A A . 24 ARG HB2 1 1 13 7801 1 1 24 ARG HB3 H 9.074 -1.835 -5.444 1.00 . A A . 24 ARG HB3 1 1 13 7802 1 1 24 ARG HD2 H 6.673 -4.924 -5.450 1.00 . A A . 24 ARG HD2 1 1 13 7803 1 1 24 ARG HD3 H 6.275 -3.431 -6.299 1.00 . A A . 24 ARG HD3 1 1 13 7804 1 1 24 ARG HE H 7.693 -5.338 -7.915 1.00 . A A . 24 ARG HE 1 1 13 7805 1 1 24 ARG HG2 H 8.799 -3.461 -6.954 1.00 . A A . 24 ARG HG2 1 1 13 7806 1 1 24 ARG HG3 H 8.950 -4.539 -5.565 1.00 . A A . 24 ARG HG3 1 1 13 7807 1 1 24 ARG HH11 H 4.553 -4.320 -6.784 1.00 . A A . 24 ARG HH11 1 1 13 7808 1 1 24 ARG HH12 H 3.705 -5.024 -8.120 1.00 . A A . 24 ARG HH12 1 1 13 7809 1 1 24 ARG HH21 H 6.580 -6.266 -9.672 1.00 . A A . 24 ARG HH21 1 1 13 7810 1 1 24 ARG HH22 H 4.856 -6.130 -9.759 1.00 . A A . 24 ARG HH22 1 1 13 7811 1 1 24 ARG N N 7.954 -2.042 -2.713 1.00 . A A . 24 ARG N 1 1 13 7812 1 1 24 ARG NE N 6.859 -5.011 -7.519 1.00 . A A . 24 ARG NE 1 1 13 7813 1 1 24 ARG NH1 N 4.563 -4.833 -7.642 1.00 . A A . 24 ARG NH1 1 1 13 7814 1 1 24 ARG NH2 N 5.716 -5.941 -9.286 1.00 . A A . 24 ARG NH2 1 1 13 7815 1 1 24 ARG O O 10.814 -1.785 -3.815 1.00 . A A . 24 ARG O 1 1 13 7816 1 1 25 THR C C 12.964 -4.693 -3.422 1.00 . A A . 25 THR C 1 1 13 7817 1 1 25 THR CA C 12.213 -3.765 -2.469 1.00 . A A . 25 THR CA 1 1 13 7818 1 1 25 THR CB C 12.469 -4.188 -1.022 1.00 . A A . 25 THR CB 1 1 13 7819 1 1 25 THR CG2 C 12.087 -3.128 -0.012 1.00 . A A . 25 THR CG2 1 1 13 7820 1 1 25 THR H H 10.237 -4.523 -2.448 1.00 . A A . 25 THR H 1 1 13 7821 1 1 25 THR HA H 12.575 -2.758 -2.608 1.00 . A A . 25 THR HA 1 1 13 7822 1 1 25 THR HB H 13.523 -4.397 -0.900 1.00 . A A . 25 THR HB 1 1 13 7823 1 1 25 THR HG1 H 12.178 -5.824 0.015 1.00 . A A . 25 THR HG1 1 1 13 7824 1 1 25 THR HG21 H 11.191 -2.624 -0.340 1.00 . A A . 25 THR HG21 1 1 13 7825 1 1 25 THR HG22 H 11.909 -3.592 0.947 1.00 . A A . 25 THR HG22 1 1 13 7826 1 1 25 THR HG23 H 12.890 -2.411 0.079 1.00 . A A . 25 THR HG23 1 1 13 7827 1 1 25 THR N N 10.782 -3.767 -2.749 1.00 . A A . 25 THR N 1 1 13 7828 1 1 25 THR O O 14.188 -4.621 -3.534 1.00 . A A . 25 THR O 1 1 13 7829 1 1 25 THR OG1 O 11.744 -5.363 -0.707 1.00 . A A . 25 THR OG1 1 1 13 7830 1 1 26 SER C C 13.727 -7.499 -4.315 1.00 . A A . 26 SER C 1 1 13 7831 1 1 26 SER CA C 12.830 -6.506 -5.046 1.00 . A A . 26 SER CA 1 1 13 7832 1 1 26 SER CB C 13.635 -5.755 -6.110 1.00 . A A . 26 SER CB 1 1 13 7833 1 1 26 SER H H 11.256 -5.580 -3.977 1.00 . A A . 26 SER H 1 1 13 7834 1 1 26 SER HA H 12.031 -7.049 -5.528 1.00 . A A . 26 SER HA 1 1 13 7835 1 1 26 SER HB2 H 13.028 -4.966 -6.527 1.00 . A A . 26 SER HB2 1 1 13 7836 1 1 26 SER HB3 H 14.518 -5.329 -5.656 1.00 . A A . 26 SER HB3 1 1 13 7837 1 1 26 SER HG H 13.266 -7.085 -7.500 1.00 . A A . 26 SER HG 1 1 13 7838 1 1 26 SER N N 12.227 -5.566 -4.107 1.00 . A A . 26 SER N 1 1 13 7839 1 1 26 SER O O 14.833 -7.802 -4.764 1.00 . A A . 26 SER O 1 1 13 7840 1 1 26 SER OG O 14.034 -6.625 -7.155 1.00 . A A . 26 SER OG 1 1 13 7841 1 1 27 VAL C C 13.206 -9.405 -1.162 1.00 . A A . 27 VAL C 1 1 13 7842 1 1 27 VAL CA C 13.997 -8.963 -2.389 1.00 . A A . 27 VAL CA 1 1 13 7843 1 1 27 VAL CB C 15.350 -8.377 -1.936 1.00 . A A . 27 VAL CB 1 1 13 7844 1 1 27 VAL CG1 C 15.138 -7.152 -1.060 1.00 . A A . 27 VAL CG1 1 1 13 7845 1 1 27 VAL CG2 C 16.173 -9.429 -1.206 1.00 . A A . 27 VAL CG2 1 1 13 7846 1 1 27 VAL H H 12.354 -7.724 -2.880 1.00 . A A . 27 VAL H 1 1 13 7847 1 1 27 VAL HA H 14.192 -9.826 -3.007 1.00 . A A . 27 VAL HA 1 1 13 7848 1 1 27 VAL HB H 15.898 -8.071 -2.816 1.00 . A A . 27 VAL HB 1 1 13 7849 1 1 27 VAL HG11 H 14.573 -6.411 -1.607 1.00 . A A . 27 VAL HG11 1 1 13 7850 1 1 27 VAL HG12 H 14.595 -7.434 -0.171 1.00 . A A . 27 VAL HG12 1 1 13 7851 1 1 27 VAL HG13 H 16.097 -6.739 -0.781 1.00 . A A . 27 VAL HG13 1 1 13 7852 1 1 27 VAL HG21 H 16.080 -10.377 -1.716 1.00 . A A . 27 VAL HG21 1 1 13 7853 1 1 27 VAL HG22 H 17.210 -9.128 -1.192 1.00 . A A . 27 VAL HG22 1 1 13 7854 1 1 27 VAL HG23 H 15.813 -9.528 -0.193 1.00 . A A . 27 VAL HG23 1 1 13 7855 1 1 27 VAL N N 13.242 -8.004 -3.185 1.00 . A A . 27 VAL N 1 1 13 7856 1 1 27 VAL O O 13.257 -10.568 -0.763 1.00 . A A . 27 VAL O 1 1 13 7857 1 1 28 SER C C 10.195 -8.878 0.254 1.00 . A A . 28 SER C 1 1 13 7858 1 1 28 SER CA C 11.672 -8.760 0.614 1.00 . A A . 28 SER CA 1 1 13 7859 1 1 28 SER CB C 11.867 -7.671 1.670 1.00 . A A . 28 SER CB 1 1 13 7860 1 1 28 SER H H 12.476 -7.559 -0.934 1.00 . A A . 28 SER H 1 1 13 7861 1 1 28 SER HA H 12.008 -9.703 1.016 1.00 . A A . 28 SER HA 1 1 13 7862 1 1 28 SER HB2 H 12.797 -7.154 1.484 1.00 . A A . 28 SER HB2 1 1 13 7863 1 1 28 SER HB3 H 11.048 -6.969 1.616 1.00 . A A . 28 SER HB3 1 1 13 7864 1 1 28 SER HG H 12.392 -7.636 3.557 1.00 . A A . 28 SER HG 1 1 13 7865 1 1 28 SER N N 12.475 -8.468 -0.568 1.00 . A A . 28 SER N 1 1 13 7866 1 1 28 SER O O 9.474 -9.705 0.813 1.00 . A A . 28 SER O 1 1 13 7867 1 1 28 SER OG O 11.908 -8.225 2.974 1.00 . A A . 28 SER OG 1 1 13 7868 1 1 29 SER C C 7.422 -7.762 0.049 1.00 . A A . 29 SER C 1 1 13 7869 1 1 29 SER CA C 8.361 -8.056 -1.117 1.00 . A A . 29 SER CA 1 1 13 7870 1 1 29 SER CB C 8.010 -9.407 -1.742 1.00 . A A . 29 SER CB 1 1 13 7871 1 1 29 SER H H 10.377 -7.411 -1.089 1.00 . A A . 29 SER H 1 1 13 7872 1 1 29 SER HA H 8.242 -7.283 -1.863 1.00 . A A . 29 SER HA 1 1 13 7873 1 1 29 SER HB2 H 7.945 -10.155 -0.965 1.00 . A A . 29 SER HB2 1 1 13 7874 1 1 29 SER HB3 H 7.058 -9.331 -2.248 1.00 . A A . 29 SER HB3 1 1 13 7875 1 1 29 SER HG H 9.135 -9.105 -3.316 1.00 . A A . 29 SER HG 1 1 13 7876 1 1 29 SER N N 9.753 -8.046 -0.681 1.00 . A A . 29 SER N 1 1 13 7877 1 1 29 SER O O 7.254 -8.588 0.946 1.00 . A A . 29 SER O 1 1 13 7878 1 1 29 SER OG O 8.995 -9.808 -2.679 1.00 . A A . 29 SER OG 1 1 13 7879 1 1 30 HIS C C 4.453 -6.522 0.712 1.00 . A A . 30 HIS C 1 1 13 7880 1 1 30 HIS CA C 5.891 -6.179 1.085 1.00 . A A . 30 HIS CA 1 1 13 7881 1 1 30 HIS CB C 6.016 -4.679 1.355 1.00 . A A . 30 HIS CB 1 1 13 7882 1 1 30 HIS CD2 C 8.224 -4.962 2.688 1.00 . A A . 30 HIS CD2 1 1 13 7883 1 1 30 HIS CE1 C 8.047 -3.199 3.979 1.00 . A A . 30 HIS CE1 1 1 13 7884 1 1 30 HIS CG C 7.064 -4.339 2.369 1.00 . A A . 30 HIS CG 1 1 13 7885 1 1 30 HIS H H 6.988 -5.966 -0.713 1.00 . A A . 30 HIS H 1 1 13 7886 1 1 30 HIS HA H 6.157 -6.720 1.980 1.00 . A A . 30 HIS HA 1 1 13 7887 1 1 30 HIS HB2 H 6.269 -4.174 0.435 1.00 . A A . 30 HIS HB2 1 1 13 7888 1 1 30 HIS HB3 H 5.069 -4.305 1.717 1.00 . A A . 30 HIS HB3 1 1 13 7889 1 1 30 HIS HD1 H 6.255 -2.583 3.207 1.00 . A A . 30 HIS HD1 1 1 13 7890 1 1 30 HIS HD2 H 8.611 -5.865 2.237 1.00 . A A . 30 HIS HD2 1 1 13 7891 1 1 30 HIS HE1 H 8.253 -2.449 4.728 1.00 . A A . 30 HIS HE1 1 1 13 7892 1 1 30 HIS HE2 H 9.707 -4.396 4.062 1.00 . A A . 30 HIS HE2 1 1 13 7893 1 1 30 HIS N N 6.813 -6.581 0.029 1.00 . A A . 30 HIS N 1 1 13 7894 1 1 30 HIS ND1 N 6.984 -3.238 3.196 1.00 . A A . 30 HIS ND1 1 1 13 7895 1 1 30 HIS NE2 N 8.814 -4.234 3.691 1.00 . A A . 30 HIS NE2 1 1 13 7896 1 1 30 HIS O O 4.198 -7.116 -0.336 1.00 . A A . 30 HIS O 1 1 13 7897 1 1 31 TYR C C 1.225 -5.405 2.070 1.00 . A A . 31 TYR C 1 1 13 7898 1 1 31 TYR CA C 2.103 -6.413 1.337 1.00 . A A . 31 TYR CA 1 1 13 7899 1 1 31 TYR CB C 1.749 -7.833 1.782 1.00 . A A . 31 TYR CB 1 1 13 7900 1 1 31 TYR CD1 C 2.725 -10.036 1.028 1.00 . A A . 31 TYR CD1 1 1 13 7901 1 1 31 TYR CD2 C 1.546 -8.720 -0.573 1.00 . A A . 31 TYR CD2 1 1 13 7902 1 1 31 TYR CE1 C 2.967 -10.998 0.065 1.00 . A A . 31 TYR CE1 1 1 13 7903 1 1 31 TYR CE2 C 1.783 -9.678 -1.541 1.00 . A A . 31 TYR CE2 1 1 13 7904 1 1 31 TYR CG C 2.012 -8.883 0.726 1.00 . A A . 31 TYR CG 1 1 13 7905 1 1 31 TYR CZ C 2.494 -10.814 -1.217 1.00 . A A . 31 TYR CZ 1 1 13 7906 1 1 31 TYR H H 3.782 -5.676 2.394 1.00 . A A . 31 TYR H 1 1 13 7907 1 1 31 TYR HA H 1.924 -6.324 0.276 1.00 . A A . 31 TYR HA 1 1 13 7908 1 1 31 TYR HB2 H 2.336 -8.086 2.653 1.00 . A A . 31 TYR HB2 1 1 13 7909 1 1 31 TYR HB3 H 0.700 -7.872 2.037 1.00 . A A . 31 TYR HB3 1 1 13 7910 1 1 31 TYR HD1 H 3.094 -10.178 2.033 1.00 . A A . 31 TYR HD1 1 1 13 7911 1 1 31 TYR HD2 H 0.990 -7.829 -0.823 1.00 . A A . 31 TYR HD2 1 1 13 7912 1 1 31 TYR HE1 H 3.524 -11.888 0.319 1.00 . A A . 31 TYR HE1 1 1 13 7913 1 1 31 TYR HE2 H 1.413 -9.533 -2.545 1.00 . A A . 31 TYR HE2 1 1 13 7914 1 1 31 TYR HH H 3.641 -11.698 -2.482 1.00 . A A . 31 TYR HH 1 1 13 7915 1 1 31 TYR N N 3.516 -6.145 1.576 1.00 . A A . 31 TYR N 1 1 13 7916 1 1 31 TYR O O 1.226 -5.344 3.300 1.00 . A A . 31 TYR O 1 1 13 7917 1 1 31 TYR OH O 2.733 -11.769 -2.178 1.00 . A A . 31 TYR OH 1 1 13 7918 1 1 32 CYS C C -1.657 -4.252 2.471 1.00 . A A . 32 CYS C 1 1 13 7919 1 1 32 CYS CA C -0.405 -3.607 1.885 1.00 . A A . 32 CYS CA 1 1 13 7920 1 1 32 CYS CB C -0.797 -2.575 0.826 1.00 . A A . 32 CYS CB 1 1 13 7921 1 1 32 CYS H H 0.521 -4.709 0.333 1.00 . A A . 32 CYS H 1 1 13 7922 1 1 32 CYS HA H 0.133 -3.109 2.677 1.00 . A A . 32 CYS HA 1 1 13 7923 1 1 32 CYS HB2 H 0.078 -2.309 0.253 1.00 . A A . 32 CYS HB2 1 1 13 7924 1 1 32 CYS HB3 H -1.535 -3.009 0.166 1.00 . A A . 32 CYS HB3 1 1 13 7925 1 1 32 CYS N N 0.478 -4.614 1.307 1.00 . A A . 32 CYS N 1 1 13 7926 1 1 32 CYS O O -2.004 -5.382 2.127 1.00 . A A . 32 CYS O 1 1 13 7927 1 1 32 CYS SG S -1.498 -1.038 1.508 1.00 . A A . 32 CYS SG 1 1 13 7928 1 1 33 THR C C -4.799 -3.475 3.317 1.00 . A A . 33 THR C 1 1 13 7929 1 1 33 THR CA C -3.545 -4.029 3.993 1.00 . A A . 33 THR CA 1 1 13 7930 1 1 33 THR CB C -3.554 -3.665 5.479 1.00 . A A . 33 THR CB 1 1 13 7931 1 1 33 THR CG2 C -3.162 -2.227 5.747 1.00 . A A . 33 THR CG2 1 1 13 7932 1 1 33 THR H H -2.003 -2.633 3.591 1.00 . A A . 33 THR H 1 1 13 7933 1 1 33 THR HA H -3.546 -5.104 3.897 1.00 . A A . 33 THR HA 1 1 13 7934 1 1 33 THR HB H -2.853 -4.302 5.999 1.00 . A A . 33 THR HB 1 1 13 7935 1 1 33 THR HG1 H -4.840 -3.593 6.956 1.00 . A A . 33 THR HG1 1 1 13 7936 1 1 33 THR HG21 H -3.759 -1.571 5.132 1.00 . A A . 33 THR HG21 1 1 13 7937 1 1 33 THR HG22 H -3.330 -1.997 6.789 1.00 . A A . 33 THR HG22 1 1 13 7938 1 1 33 THR HG23 H -2.117 -2.090 5.512 1.00 . A A . 33 THR HG23 1 1 13 7939 1 1 33 THR N N -2.331 -3.527 3.358 1.00 . A A . 33 THR N 1 1 13 7940 1 1 33 THR O O -5.917 -3.727 3.768 1.00 . A A . 33 THR O 1 1 13 7941 1 1 33 THR OG1 O -4.841 -3.871 6.037 1.00 . A A . 33 THR OG1 1 1 13 7942 1 1 34 GLY C C -6.681 -1.379 2.437 1.00 . A A . 34 GLY C 1 1 13 7943 1 1 34 GLY CA C -5.743 -2.148 1.525 1.00 . A A . 34 GLY CA 1 1 13 7944 1 1 34 GLY H H -3.703 -2.549 1.917 1.00 . A A . 34 GLY H 1 1 13 7945 1 1 34 GLY HA2 H -6.295 -2.946 1.050 1.00 . A A . 34 GLY HA2 1 1 13 7946 1 1 34 GLY HA3 H -5.373 -1.479 0.762 1.00 . A A . 34 GLY HA3 1 1 13 7947 1 1 34 GLY N N -4.613 -2.719 2.236 1.00 . A A . 34 GLY N 1 1 13 7948 1 1 34 GLY O O -7.870 -1.247 2.145 1.00 . A A . 34 GLY O 1 1 13 7949 1 1 35 ARG C C -6.462 1.328 4.593 1.00 . A A . 35 ARG C 1 1 13 7950 1 1 35 ARG CA C -6.945 -0.115 4.501 1.00 . A A . 35 ARG CA 1 1 13 7951 1 1 35 ARG CB C -6.887 -0.774 5.880 1.00 . A A . 35 ARG CB 1 1 13 7952 1 1 35 ARG CD C -8.215 -1.606 7.844 1.00 . A A . 35 ARG CD 1 1 13 7953 1 1 35 ARG CG C -8.175 -0.635 6.675 1.00 . A A . 35 ARG CG 1 1 13 7954 1 1 35 ARG CZ C -9.211 -3.792 8.392 1.00 . A A . 35 ARG CZ 1 1 13 7955 1 1 35 ARG H H -5.193 -1.012 3.722 1.00 . A A . 35 ARG H 1 1 13 7956 1 1 35 ARG HA H -7.966 -0.117 4.154 1.00 . A A . 35 ARG HA 1 1 13 7957 1 1 35 ARG HB2 H -6.677 -1.826 5.755 1.00 . A A . 35 ARG HB2 1 1 13 7958 1 1 35 ARG HB3 H -6.088 -0.322 6.449 1.00 . A A . 35 ARG HB3 1 1 13 7959 1 1 35 ARG HD2 H -7.202 -1.853 8.125 1.00 . A A . 35 ARG HD2 1 1 13 7960 1 1 35 ARG HD3 H -8.712 -1.128 8.675 1.00 . A A . 35 ARG HD3 1 1 13 7961 1 1 35 ARG HE H -9.209 -2.958 6.579 1.00 . A A . 35 ARG HE 1 1 13 7962 1 1 35 ARG HG2 H -8.246 0.373 7.055 1.00 . A A . 35 ARG HG2 1 1 13 7963 1 1 35 ARG HG3 H -9.012 -0.836 6.023 1.00 . A A . 35 ARG HG3 1 1 13 7964 1 1 35 ARG HH11 H -8.354 -2.846 9.960 1.00 . A A . 35 ARG HH11 1 1 13 7965 1 1 35 ARG HH12 H -9.062 -4.385 10.319 1.00 . A A . 35 ARG HH12 1 1 13 7966 1 1 35 ARG HH21 H -10.141 -4.982 7.049 1.00 . A A . 35 ARG HH21 1 1 13 7967 1 1 35 ARG HH22 H -10.076 -5.598 8.666 1.00 . A A . 35 ARG HH22 1 1 13 7968 1 1 35 ARG N N -6.146 -0.873 3.544 1.00 . A A . 35 ARG N 1 1 13 7969 1 1 35 ARG NE N -8.928 -2.837 7.509 1.00 . A A . 35 ARG NE 1 1 13 7970 1 1 35 ARG NH1 N -8.846 -3.663 9.661 1.00 . A A . 35 ARG NH1 1 1 13 7971 1 1 35 ARG NH2 N -9.863 -4.880 8.004 1.00 . A A . 35 ARG NH2 1 1 13 7972 1 1 35 ARG O O -7.263 2.256 4.708 1.00 . A A . 35 ARG O 1 1 13 7973 1 1 36 SER C C -3.400 2.981 3.637 1.00 . A A . 36 SER C 1 1 13 7974 1 1 36 SER CA C -4.556 2.840 4.621 1.00 . A A . 36 SER CA 1 1 13 7975 1 1 36 SER CB C -4.068 3.121 6.043 1.00 . A A . 36 SER CB 1 1 13 7976 1 1 36 SER H H -4.562 0.730 4.451 1.00 . A A . 36 SER H 1 1 13 7977 1 1 36 SER HA H -5.321 3.558 4.364 1.00 . A A . 36 SER HA 1 1 13 7978 1 1 36 SER HB2 H -4.879 2.962 6.738 1.00 . A A . 36 SER HB2 1 1 13 7979 1 1 36 SER HB3 H -3.254 2.452 6.280 1.00 . A A . 36 SER HB3 1 1 13 7980 1 1 36 SER HG H -2.818 4.475 6.709 1.00 . A A . 36 SER HG 1 1 13 7981 1 1 36 SER N N -5.148 1.510 4.543 1.00 . A A . 36 SER N 1 1 13 7982 1 1 36 SER O O -2.745 1.999 3.288 1.00 . A A . 36 SER O 1 1 13 7983 1 1 36 SER OG O -3.614 4.457 6.172 1.00 . A A . 36 SER OG 1 1 13 7984 1 1 37 CYS C C -0.711 4.381 2.929 1.00 . A A . 37 CYS C 1 1 13 7985 1 1 37 CYS CA C -2.075 4.479 2.248 1.00 . A A . 37 CYS CA 1 1 13 7986 1 1 37 CYS CB C -2.250 5.864 1.622 1.00 . A A . 37 CYS CB 1 1 13 7987 1 1 37 CYS H H -3.710 4.953 3.507 1.00 . A A . 37 CYS H 1 1 13 7988 1 1 37 CYS HA H -2.127 3.734 1.468 1.00 . A A . 37 CYS HA 1 1 13 7989 1 1 37 CYS HB2 H -3.211 6.262 1.912 1.00 . A A . 37 CYS HB2 1 1 13 7990 1 1 37 CYS HB3 H -1.471 6.518 1.986 1.00 . A A . 37 CYS HB3 1 1 13 7991 1 1 37 CYS N N -3.153 4.210 3.192 1.00 . A A . 37 CYS N 1 1 13 7992 1 1 37 CYS O O 0.307 4.169 2.271 1.00 . A A . 37 CYS O 1 1 13 7993 1 1 37 CYS SG S -2.176 5.871 -0.198 1.00 . A A . 37 CYS SG 1 1 13 7994 1 1 38 GLU C C 1.181 3.085 4.885 1.00 . A A . 38 GLU C 1 1 13 7995 1 1 38 GLU CA C 0.544 4.465 5.013 1.00 . A A . 38 GLU CA 1 1 13 7996 1 1 38 GLU CB C 0.281 4.784 6.485 1.00 . A A . 38 GLU CB 1 1 13 7997 1 1 38 GLU CD C 1.292 5.674 8.622 1.00 . A A . 38 GLU CD 1 1 13 7998 1 1 38 GLU CG C 1.549 4.974 7.302 1.00 . A A . 38 GLU CG 1 1 13 7999 1 1 38 GLU H H -1.539 4.704 4.723 1.00 . A A . 38 GLU H 1 1 13 8000 1 1 38 GLU HA H 1.224 5.201 4.610 1.00 . A A . 38 GLU HA 1 1 13 8001 1 1 38 GLU HB2 H -0.301 5.692 6.547 1.00 . A A . 38 GLU HB2 1 1 13 8002 1 1 38 GLU HB3 H -0.284 3.974 6.922 1.00 . A A . 38 GLU HB3 1 1 13 8003 1 1 38 GLU HG2 H 1.981 4.006 7.504 1.00 . A A . 38 GLU HG2 1 1 13 8004 1 1 38 GLU HG3 H 2.247 5.566 6.727 1.00 . A A . 38 GLU HG3 1 1 13 8005 1 1 38 GLU N N -0.697 4.537 4.250 1.00 . A A . 38 GLU N 1 1 13 8006 1 1 38 GLU O O 0.950 2.205 5.714 1.00 . A A . 38 GLU O 1 1 13 8007 1 1 38 GLU OE1 O 2.045 5.418 9.586 1.00 . A A . 38 GLU OE1 1 1 13 8008 1 1 38 GLU OE2 O 0.339 6.478 8.693 1.00 . A A . 38 GLU OE2 1 1 13 8009 1 1 39 CYS C C 3.487 1.214 4.815 1.00 . A A . 39 CYS C 1 1 13 8010 1 1 39 CYS CA C 2.655 1.630 3.601 1.00 . A A . 39 CYS CA 1 1 13 8011 1 1 39 CYS CB C 3.552 1.730 2.365 1.00 . A A . 39 CYS CB 1 1 13 8012 1 1 39 CYS H H 2.127 3.643 3.214 1.00 . A A . 39 CYS H 1 1 13 8013 1 1 39 CYS HA H 1.896 0.884 3.422 1.00 . A A . 39 CYS HA 1 1 13 8014 1 1 39 CYS HB2 H 2.945 1.986 1.509 1.00 . A A . 39 CYS HB2 1 1 13 8015 1 1 39 CYS HB3 H 4.285 2.508 2.524 1.00 . A A . 39 CYS HB3 1 1 13 8016 1 1 39 CYS N N 1.983 2.903 3.840 1.00 . A A . 39 CYS N 1 1 13 8017 1 1 39 CYS O O 4.523 1.816 5.099 1.00 . A A . 39 CYS O 1 1 13 8018 1 1 39 CYS SG S 4.449 0.195 1.967 1.00 . A A . 39 CYS SG 1 1 13 8019 1 1 40 PRO C C 5.226 -0.616 6.442 1.00 . A A . 40 PRO C 1 1 13 8020 1 1 40 PRO CA C 3.762 -0.309 6.735 1.00 . A A . 40 PRO CA 1 1 13 8021 1 1 40 PRO CB C 3.012 -1.590 7.109 1.00 . A A . 40 PRO CB 1 1 13 8022 1 1 40 PRO CD C 1.821 -0.604 5.288 1.00 . A A . 40 PRO CD 1 1 13 8023 1 1 40 PRO CG C 1.645 -1.406 6.547 1.00 . A A . 40 PRO CG 1 1 13 8024 1 1 40 PRO HA H 3.701 0.398 7.550 1.00 . A A . 40 PRO HA 1 1 13 8025 1 1 40 PRO HB2 H 3.509 -2.442 6.669 1.00 . A A . 40 PRO HB2 1 1 13 8026 1 1 40 PRO HB3 H 2.985 -1.695 8.183 1.00 . A A . 40 PRO HB3 1 1 13 8027 1 1 40 PRO HD2 H 1.955 -1.258 4.439 1.00 . A A . 40 PRO HD2 1 1 13 8028 1 1 40 PRO HD3 H 0.975 0.049 5.135 1.00 . A A . 40 PRO HD3 1 1 13 8029 1 1 40 PRO HG2 H 1.209 -2.368 6.320 1.00 . A A . 40 PRO HG2 1 1 13 8030 1 1 40 PRO HG3 H 1.027 -0.869 7.251 1.00 . A A . 40 PRO HG3 1 1 13 8031 1 1 40 PRO N N 3.046 0.176 5.550 1.00 . A A . 40 PRO N 1 1 13 8032 1 1 40 PRO O O 5.680 -0.497 5.304 1.00 . A A . 40 PRO O 1 1 13 8033 1 1 41 SER C C 7.683 -2.705 7.935 1.00 . A A . 41 SER C 1 1 13 8034 1 1 41 SER CA C 7.375 -1.339 7.331 1.00 . A A . 41 SER CA 1 1 13 8035 1 1 41 SER CB C 8.238 -0.265 7.997 1.00 . A A . 41 SER CB 1 1 13 8036 1 1 41 SER H H 5.542 -1.089 8.359 1.00 . A A . 41 SER H 1 1 13 8037 1 1 41 SER HA H 7.601 -1.366 6.275 1.00 . A A . 41 SER HA 1 1 13 8038 1 1 41 SER HB2 H 7.715 0.133 8.853 1.00 . A A . 41 SER HB2 1 1 13 8039 1 1 41 SER HB3 H 9.171 -0.705 8.318 1.00 . A A . 41 SER HB3 1 1 13 8040 1 1 41 SER HG H 9.246 0.547 6.527 1.00 . A A . 41 SER HG 1 1 13 8041 1 1 41 SER N N 5.961 -1.013 7.476 1.00 . A A . 41 SER N 1 1 13 8042 1 1 41 SER O O 8.700 -2.885 8.604 1.00 . A A . 41 SER O 1 1 13 8043 1 1 41 SER OG O 8.517 0.795 7.100 1.00 . A A . 41 SER OG 1 1 13 8044 1 1 42 TYR C C 7.196 -6.013 7.079 1.00 . A A . 42 TYR C 1 1 13 8045 1 1 42 TYR CA C 6.972 -5.017 8.214 1.00 . A A . 42 TYR CA 1 1 13 8046 1 1 42 TYR CB C 5.750 -5.432 9.037 1.00 . A A . 42 TYR CB 1 1 13 8047 1 1 42 TYR CD1 C 4.056 -3.720 9.794 1.00 . A A . 42 TYR CD1 1 1 13 8048 1 1 42 TYR CD2 C 6.034 -3.997 11.095 1.00 . A A . 42 TYR CD2 1 1 13 8049 1 1 42 TYR CE1 C 3.615 -2.743 10.666 1.00 . A A . 42 TYR CE1 1 1 13 8050 1 1 42 TYR CE2 C 5.600 -3.021 11.971 1.00 . A A . 42 TYR CE2 1 1 13 8051 1 1 42 TYR CG C 5.271 -4.363 9.993 1.00 . A A . 42 TYR CG 1 1 13 8052 1 1 42 TYR CZ C 4.390 -2.397 11.752 1.00 . A A . 42 TYR CZ 1 1 13 8053 1 1 42 TYR H H 6.004 -3.461 7.154 1.00 . A A . 42 TYR H 1 1 13 8054 1 1 42 TYR HA H 7.842 -5.016 8.854 1.00 . A A . 42 TYR HA 1 1 13 8055 1 1 42 TYR HB2 H 4.937 -5.666 8.367 1.00 . A A . 42 TYR HB2 1 1 13 8056 1 1 42 TYR HB3 H 5.997 -6.310 9.616 1.00 . A A . 42 TYR HB3 1 1 13 8057 1 1 42 TYR HD1 H 3.451 -3.994 8.942 1.00 . A A . 42 TYR HD1 1 1 13 8058 1 1 42 TYR HD2 H 6.982 -4.487 11.264 1.00 . A A . 42 TYR HD2 1 1 13 8059 1 1 42 TYR HE1 H 2.667 -2.255 10.494 1.00 . A A . 42 TYR HE1 1 1 13 8060 1 1 42 TYR HE2 H 6.207 -2.750 12.822 1.00 . A A . 42 TYR HE2 1 1 13 8061 1 1 42 TYR HH H 3.201 -1.753 13.119 1.00 . A A . 42 TYR HH 1 1 13 8062 1 1 42 TYR N N 6.796 -3.666 7.694 1.00 . A A . 42 TYR N 1 1 13 8063 1 1 42 TYR O O 6.246 -6.599 6.560 1.00 . A A . 42 TYR O 1 1 13 8064 1 1 42 TYR OH O 3.954 -1.424 12.622 1.00 . A A . 42 TYR OH 1 1 13 8065 1 1 43 PRO C C 8.197 -8.531 5.806 1.00 . A A . 43 PRO C 1 1 13 8066 1 1 43 PRO CA C 8.806 -7.149 5.596 1.00 . A A . 43 PRO CA 1 1 13 8067 1 1 43 PRO CB C 10.333 -7.222 5.662 1.00 . A A . 43 PRO CB 1 1 13 8068 1 1 43 PRO CD C 9.656 -5.560 7.240 1.00 . A A . 43 PRO CD 1 1 13 8069 1 1 43 PRO CG C 10.748 -5.930 6.275 1.00 . A A . 43 PRO CG 1 1 13 8070 1 1 43 PRO HA H 8.503 -6.766 4.633 1.00 . A A . 43 PRO HA 1 1 13 8071 1 1 43 PRO HB2 H 10.629 -8.063 6.272 1.00 . A A . 43 PRO HB2 1 1 13 8072 1 1 43 PRO HB3 H 10.735 -7.333 4.666 1.00 . A A . 43 PRO HB3 1 1 13 8073 1 1 43 PRO HD2 H 9.877 -5.942 8.226 1.00 . A A . 43 PRO HD2 1 1 13 8074 1 1 43 PRO HD3 H 9.527 -4.488 7.270 1.00 . A A . 43 PRO HD3 1 1 13 8075 1 1 43 PRO HG2 H 11.685 -6.056 6.799 1.00 . A A . 43 PRO HG2 1 1 13 8076 1 1 43 PRO HG3 H 10.844 -5.174 5.510 1.00 . A A . 43 PRO HG3 1 1 13 8077 1 1 43 PRO N N 8.462 -6.218 6.676 1.00 . A A . 43 PRO N 1 1 13 8078 1 1 43 PRO O O 7.753 -8.864 6.905 1.00 . A A . 43 PRO O 1 1 13 8079 1 1 44 GLY C C 8.512 -11.712 4.190 1.00 . A A . 44 GLY C 1 1 13 8080 1 1 44 GLY CA C 7.621 -10.668 4.834 1.00 . A A . 44 GLY CA 1 1 13 8081 1 1 44 GLY H H 8.546 -9.011 3.895 1.00 . A A . 44 GLY H 1 1 13 8082 1 1 44 GLY HA2 H 6.659 -10.678 4.343 1.00 . A A . 44 GLY HA2 1 1 13 8083 1 1 44 GLY HA3 H 7.484 -10.920 5.875 1.00 . A A . 44 GLY HA3 1 1 13 8084 1 1 44 GLY N N 8.178 -9.331 4.745 1.00 . A A . 44 GLY N 1 1 13 8085 1 1 44 GLY O O 9.306 -12.345 4.917 1.00 . A A . 44 GLY O 1 1 13 8086 1 1 44 GLY OXT O 8.414 -11.897 2.958 1.00 . A A . 44 GLY OXT 1 1 14 8087 1 1 1 ALA C C -12.035 14.057 -1.961 1.00 . A A . 1 ALA C 1 1 14 8088 1 1 1 ALA CA C -12.007 13.168 -3.200 1.00 . A A . 1 ALA CA 1 1 14 8089 1 1 1 ALA CB C -10.943 13.653 -4.172 1.00 . A A . 1 ALA CB 1 1 14 8090 1 1 1 ALA H1 H -14.061 13.090 -3.121 1.00 . A A . 1 ALA H1 1 1 14 8091 1 1 1 ALA H2 H -13.429 14.009 -4.425 1.00 . A A . 1 ALA H2 1 1 14 8092 1 1 1 ALA H3 H -13.368 12.294 -4.471 1.00 . A A . 1 ALA H3 1 1 14 8093 1 1 1 ALA HA H -11.754 12.161 -2.900 1.00 . A A . 1 ALA HA 1 1 14 8094 1 1 1 ALA HB1 H -10.012 13.800 -3.644 1.00 . A A . 1 ALA HB1 1 1 14 8095 1 1 1 ALA HB2 H -10.803 12.916 -4.949 1.00 . A A . 1 ALA HB2 1 1 14 8096 1 1 1 ALA HB3 H -11.257 14.587 -4.614 1.00 . A A . 1 ALA HB3 1 1 14 8097 1 1 1 ALA N N -13.336 13.138 -3.864 1.00 . A A . 1 ALA N 1 1 14 8098 1 1 1 ALA O O -12.258 15.264 -2.055 1.00 . A A . 1 ALA O 1 1 14 8099 1 1 2 MET C C -10.782 13.608 1.428 1.00 . A A . 2 MET C 1 1 14 8100 1 1 2 MET CA C -11.806 14.189 0.459 1.00 . A A . 2 MET CA 1 1 14 8101 1 1 2 MET CB C -13.198 14.161 1.092 1.00 . A A . 2 MET CB 1 1 14 8102 1 1 2 MET CE C -15.882 16.462 2.102 1.00 . A A . 2 MET CE 1 1 14 8103 1 1 2 MET CG C -13.403 15.224 2.158 1.00 . A A . 2 MET CG 1 1 14 8104 1 1 2 MET H H -11.635 12.487 -0.789 1.00 . A A . 2 MET H 1 1 14 8105 1 1 2 MET HA H -11.539 15.213 0.243 1.00 . A A . 2 MET HA 1 1 14 8106 1 1 2 MET HB2 H -13.936 14.311 0.317 1.00 . A A . 2 MET HB2 1 1 14 8107 1 1 2 MET HB3 H -13.356 13.193 1.544 1.00 . A A . 2 MET HB3 1 1 14 8108 1 1 2 MET HE1 H -15.951 15.512 2.612 1.00 . A A . 2 MET HE1 1 1 14 8109 1 1 2 MET HE2 H -16.144 17.257 2.785 1.00 . A A . 2 MET HE2 1 1 14 8110 1 1 2 MET HE3 H -16.562 16.470 1.263 1.00 . A A . 2 MET HE3 1 1 14 8111 1 1 2 MET HG2 H -14.017 14.812 2.945 1.00 . A A . 2 MET HG2 1 1 14 8112 1 1 2 MET HG3 H -12.440 15.501 2.561 1.00 . A A . 2 MET HG3 1 1 14 8113 1 1 2 MET N N -11.807 13.452 -0.800 1.00 . A A . 2 MET N 1 1 14 8114 1 1 2 MET O O -9.862 14.301 1.864 1.00 . A A . 2 MET O 1 1 14 8115 1 1 2 MET SD S -14.208 16.705 1.516 1.00 . A A . 2 MET SD 1 1 14 8116 1 1 3 ASP C C -9.123 10.695 1.932 1.00 . A A . 3 ASP C 1 1 14 8117 1 1 3 ASP CA C -10.038 11.658 2.681 1.00 . A A . 3 ASP CA 1 1 14 8118 1 1 3 ASP CB C -10.828 10.902 3.751 1.00 . A A . 3 ASP CB 1 1 14 8119 1 1 3 ASP CG C -10.016 10.665 5.009 1.00 . A A . 3 ASP CG 1 1 14 8120 1 1 3 ASP H H -11.701 11.833 1.382 1.00 . A A . 3 ASP H 1 1 14 8121 1 1 3 ASP HA H -9.432 12.413 3.160 1.00 . A A . 3 ASP HA 1 1 14 8122 1 1 3 ASP HB2 H -11.705 11.474 4.014 1.00 . A A . 3 ASP HB2 1 1 14 8123 1 1 3 ASP HB3 H -11.133 9.945 3.355 1.00 . A A . 3 ASP HB3 1 1 14 8124 1 1 3 ASP N N -10.948 12.333 1.763 1.00 . A A . 3 ASP N 1 1 14 8125 1 1 3 ASP O O -8.775 9.630 2.442 1.00 . A A . 3 ASP O 1 1 14 8126 1 1 3 ASP OD1 O -8.842 10.255 4.890 1.00 . A A . 3 ASP OD1 1 1 14 8127 1 1 3 ASP OD2 O -10.553 10.890 6.114 1.00 . A A . 3 ASP OD2 1 1 14 8128 1 1 4 CYS C C -6.521 10.022 0.588 1.00 . A A . 4 CYS C 1 1 14 8129 1 1 4 CYS CA C -7.863 10.246 -0.102 1.00 . A A . 4 CYS CA 1 1 14 8130 1 1 4 CYS CB C -7.642 10.896 -1.469 1.00 . A A . 4 CYS CB 1 1 14 8131 1 1 4 CYS H H -9.048 11.937 0.366 1.00 . A A . 4 CYS H 1 1 14 8132 1 1 4 CYS HA H -8.347 9.291 -0.241 1.00 . A A . 4 CYS HA 1 1 14 8133 1 1 4 CYS HB2 H -7.396 11.938 -1.328 1.00 . A A . 4 CYS HB2 1 1 14 8134 1 1 4 CYS HB3 H -6.819 10.401 -1.964 1.00 . A A . 4 CYS HB3 1 1 14 8135 1 1 4 CYS N N -8.738 11.077 0.718 1.00 . A A . 4 CYS N 1 1 14 8136 1 1 4 CYS O O -5.717 10.945 0.719 1.00 . A A . 4 CYS O 1 1 14 8137 1 1 4 CYS SG S -9.087 10.814 -2.575 1.00 . A A . 4 CYS SG 1 1 14 8138 1 1 5 THR C C -3.906 8.291 0.685 1.00 . A A . 5 THR C 1 1 14 8139 1 1 5 THR CA C -5.039 8.443 1.696 1.00 . A A . 5 THR CA 1 1 14 8140 1 1 5 THR CB C -5.208 7.150 2.496 1.00 . A A . 5 THR CB 1 1 14 8141 1 1 5 THR CG2 C -4.206 7.006 3.621 1.00 . A A . 5 THR CG2 1 1 14 8142 1 1 5 THR H H -6.964 8.096 0.887 1.00 . A A . 5 THR H 1 1 14 8143 1 1 5 THR HA H -4.793 9.246 2.375 1.00 . A A . 5 THR HA 1 1 14 8144 1 1 5 THR HB H -5.082 6.308 1.831 1.00 . A A . 5 THR HB 1 1 14 8145 1 1 5 THR HG1 H -6.771 6.158 3.137 1.00 . A A . 5 THR HG1 1 1 14 8146 1 1 5 THR HG21 H -3.223 7.275 3.263 1.00 . A A . 5 THR HG21 1 1 14 8147 1 1 5 THR HG22 H -4.483 7.658 4.436 1.00 . A A . 5 THR HG22 1 1 14 8148 1 1 5 THR HG23 H -4.196 5.983 3.966 1.00 . A A . 5 THR HG23 1 1 14 8149 1 1 5 THR N N -6.285 8.789 1.024 1.00 . A A . 5 THR N 1 1 14 8150 1 1 5 THR O O -3.345 7.208 0.521 1.00 . A A . 5 THR O 1 1 14 8151 1 1 5 THR OG1 O -6.504 7.077 3.063 1.00 . A A . 5 THR OG1 1 1 14 8152 1 1 6 THR C C -1.244 8.736 -0.450 1.00 . A A . 6 THR C 1 1 14 8153 1 1 6 THR CA C -2.514 9.384 -0.994 1.00 . A A . 6 THR CA 1 1 14 8154 1 1 6 THR CB C -2.216 10.812 -1.454 1.00 . A A . 6 THR CB 1 1 14 8155 1 1 6 THR CG2 C -3.002 11.221 -2.681 1.00 . A A . 6 THR CG2 1 1 14 8156 1 1 6 THR H H -4.064 10.219 0.183 1.00 . A A . 6 THR H 1 1 14 8157 1 1 6 THR HA H -2.861 8.810 -1.840 1.00 . A A . 6 THR HA 1 1 14 8158 1 1 6 THR HB H -1.165 10.890 -1.693 1.00 . A A . 6 THR HB 1 1 14 8159 1 1 6 THR HG1 H -2.201 12.613 -0.685 1.00 . A A . 6 THR HG1 1 1 14 8160 1 1 6 THR HG21 H -3.357 10.339 -3.192 1.00 . A A . 6 THR HG21 1 1 14 8161 1 1 6 THR HG22 H -3.844 11.828 -2.383 1.00 . A A . 6 THR HG22 1 1 14 8162 1 1 6 THR HG23 H -2.365 11.789 -3.343 1.00 . A A . 6 THR HG23 1 1 14 8163 1 1 6 THR N N -3.577 9.387 0.008 1.00 . A A . 6 THR N 1 1 14 8164 1 1 6 THR O O -0.521 9.334 0.347 1.00 . A A . 6 THR O 1 1 14 8165 1 1 6 THR OG1 O -2.509 11.741 -0.426 1.00 . A A . 6 THR OG1 1 1 14 8166 1 1 7 GLY C C 0.609 5.693 -1.396 1.00 . A A . 7 GLY C 1 1 14 8167 1 1 7 GLY CA C 0.201 6.798 -0.439 1.00 . A A . 7 GLY CA 1 1 14 8168 1 1 7 GLY H H -1.594 7.085 -1.524 1.00 . A A . 7 GLY H 1 1 14 8169 1 1 7 GLY HA2 H 0.000 6.364 0.529 1.00 . A A . 7 GLY HA2 1 1 14 8170 1 1 7 GLY HA3 H 1.017 7.499 -0.347 1.00 . A A . 7 GLY HA3 1 1 14 8171 1 1 7 GLY N N -0.980 7.510 -0.889 1.00 . A A . 7 GLY N 1 1 14 8172 1 1 7 GLY O O -0.122 5.386 -2.338 1.00 . A A . 7 GLY O 1 1 14 8173 1 1 8 PRO C C 1.239 2.887 -2.236 1.00 . A A . 8 PRO C 1 1 14 8174 1 1 8 PRO CA C 2.273 3.992 -2.041 1.00 . A A . 8 PRO CA 1 1 14 8175 1 1 8 PRO CB C 3.489 3.458 -1.282 1.00 . A A . 8 PRO CB 1 1 14 8176 1 1 8 PRO CD C 2.716 5.374 -0.080 1.00 . A A . 8 PRO CD 1 1 14 8177 1 1 8 PRO CG C 3.954 4.606 -0.455 1.00 . A A . 8 PRO CG 1 1 14 8178 1 1 8 PRO HA H 2.583 4.367 -3.006 1.00 . A A . 8 PRO HA 1 1 14 8179 1 1 8 PRO HB2 H 3.193 2.621 -0.666 1.00 . A A . 8 PRO HB2 1 1 14 8180 1 1 8 PRO HB3 H 4.247 3.146 -1.984 1.00 . A A . 8 PRO HB3 1 1 14 8181 1 1 8 PRO HD2 H 2.327 5.024 0.864 1.00 . A A . 8 PRO HD2 1 1 14 8182 1 1 8 PRO HD3 H 2.928 6.432 -0.035 1.00 . A A . 8 PRO HD3 1 1 14 8183 1 1 8 PRO HG2 H 4.453 4.243 0.431 1.00 . A A . 8 PRO HG2 1 1 14 8184 1 1 8 PRO HG3 H 4.620 5.229 -1.034 1.00 . A A . 8 PRO HG3 1 1 14 8185 1 1 8 PRO N N 1.781 5.072 -1.180 1.00 . A A . 8 PRO N 1 1 14 8186 1 1 8 PRO O O 1.274 2.161 -3.230 1.00 . A A . 8 PRO O 1 1 14 8187 1 1 9 CYS C C -2.087 2.370 -1.607 1.00 . A A . 9 CYS C 1 1 14 8188 1 1 9 CYS CA C -0.719 1.743 -1.350 1.00 . A A . 9 CYS CA 1 1 14 8189 1 1 9 CYS CB C -0.752 0.935 -0.052 1.00 . A A . 9 CYS CB 1 1 14 8190 1 1 9 CYS H H 0.346 3.369 -0.513 1.00 . A A . 9 CYS H 1 1 14 8191 1 1 9 CYS HA H -0.481 1.081 -2.169 1.00 . A A . 9 CYS HA 1 1 14 8192 1 1 9 CYS HB2 H 0.225 0.964 0.406 1.00 . A A . 9 CYS HB2 1 1 14 8193 1 1 9 CYS HB3 H -1.472 1.378 0.620 1.00 . A A . 9 CYS HB3 1 1 14 8194 1 1 9 CYS N N 0.322 2.763 -1.282 1.00 . A A . 9 CYS N 1 1 14 8195 1 1 9 CYS O O -3.118 1.798 -1.251 1.00 . A A . 9 CYS O 1 1 14 8196 1 1 9 CYS SG S -1.206 -0.815 -0.276 1.00 . A A . 9 CYS SG 1 1 14 8197 1 1 10 CYS C C -3.305 4.820 -3.945 1.00 . A A . 10 CYS C 1 1 14 8198 1 1 10 CYS CA C -3.334 4.245 -2.532 1.00 . A A . 10 CYS CA 1 1 14 8199 1 1 10 CYS CB C -3.575 5.365 -1.517 1.00 . A A . 10 CYS CB 1 1 14 8200 1 1 10 CYS H H -1.239 3.951 -2.489 1.00 . A A . 10 CYS H 1 1 14 8201 1 1 10 CYS HA H -4.141 3.531 -2.464 1.00 . A A . 10 CYS HA 1 1 14 8202 1 1 10 CYS HB2 H -2.775 5.362 -0.793 1.00 . A A . 10 CYS HB2 1 1 14 8203 1 1 10 CYS HB3 H -3.582 6.315 -2.032 1.00 . A A . 10 CYS HB3 1 1 14 8204 1 1 10 CYS N N -2.091 3.545 -2.229 1.00 . A A . 10 CYS N 1 1 14 8205 1 1 10 CYS O O -2.746 5.891 -4.179 1.00 . A A . 10 CYS O 1 1 14 8206 1 1 10 CYS SG S -5.146 5.218 -0.605 1.00 . A A . 10 CYS SG 1 1 14 8207 1 1 11 ARG C C -5.377 4.934 -6.669 1.00 . A A . 11 ARG C 1 1 14 8208 1 1 11 ARG CA C -3.958 4.541 -6.273 1.00 . A A . 11 ARG CA 1 1 14 8209 1 1 11 ARG CB C -3.446 3.435 -7.198 1.00 . A A . 11 ARG CB 1 1 14 8210 1 1 11 ARG CD C -3.380 2.839 -9.638 1.00 . A A . 11 ARG CD 1 1 14 8211 1 1 11 ARG CG C -3.117 3.919 -8.601 1.00 . A A . 11 ARG CG 1 1 14 8212 1 1 11 ARG CZ C -2.428 0.649 -10.246 1.00 . A A . 11 ARG CZ 1 1 14 8213 1 1 11 ARG H H -4.342 3.256 -4.635 1.00 . A A . 11 ARG H 1 1 14 8214 1 1 11 ARG HA H -3.318 5.405 -6.369 1.00 . A A . 11 ARG HA 1 1 14 8215 1 1 11 ARG HB2 H -2.551 3.009 -6.768 1.00 . A A . 11 ARG HB2 1 1 14 8216 1 1 11 ARG HB3 H -4.200 2.666 -7.272 1.00 . A A . 11 ARG HB3 1 1 14 8217 1 1 11 ARG HD2 H -4.437 2.614 -9.645 1.00 . A A . 11 ARG HD2 1 1 14 8218 1 1 11 ARG HD3 H -3.086 3.210 -10.608 1.00 . A A . 11 ARG HD3 1 1 14 8219 1 1 11 ARG HE H -2.276 1.503 -8.449 1.00 . A A . 11 ARG HE 1 1 14 8220 1 1 11 ARG HG2 H -3.730 4.778 -8.828 1.00 . A A . 11 ARG HG2 1 1 14 8221 1 1 11 ARG HG3 H -2.074 4.197 -8.640 1.00 . A A . 11 ARG HG3 1 1 14 8222 1 1 11 ARG HH11 H -3.421 1.576 -11.744 1.00 . A A . 11 ARG HH11 1 1 14 8223 1 1 11 ARG HH12 H -2.742 0.034 -12.146 1.00 . A A . 11 ARG HH12 1 1 14 8224 1 1 11 ARG HH21 H -1.381 -0.524 -8.975 1.00 . A A . 11 ARG HH21 1 1 14 8225 1 1 11 ARG HH22 H -1.585 -1.158 -10.574 1.00 . A A . 11 ARG HH22 1 1 14 8226 1 1 11 ARG N N -3.912 4.101 -4.884 1.00 . A A . 11 ARG N 1 1 14 8227 1 1 11 ARG NE N -2.638 1.613 -9.353 1.00 . A A . 11 ARG NE 1 1 14 8228 1 1 11 ARG NH1 N -2.903 0.763 -11.480 1.00 . A A . 11 ARG NH1 1 1 14 8229 1 1 11 ARG NH2 N -1.742 -0.433 -9.904 1.00 . A A . 11 ARG NH2 1 1 14 8230 1 1 11 ARG O O -6.324 4.179 -6.449 1.00 . A A . 11 ARG O 1 1 14 8231 1 1 12 GLN C C -7.752 6.839 -6.486 1.00 . A A . 12 GLN C 1 1 14 8232 1 1 12 GLN CA C -6.825 6.617 -7.680 1.00 . A A . 12 GLN CA 1 1 14 8233 1 1 12 GLN CB C -7.469 5.633 -8.653 1.00 . A A . 12 GLN CB 1 1 14 8234 1 1 12 GLN CD C -8.478 6.720 -10.698 1.00 . A A . 12 GLN CD 1 1 14 8235 1 1 12 GLN CG C -7.276 6.004 -10.114 1.00 . A A . 12 GLN CG 1 1 14 8236 1 1 12 GLN H H -4.726 6.679 -7.400 1.00 . A A . 12 GLN H 1 1 14 8237 1 1 12 GLN HA H -6.674 7.560 -8.183 1.00 . A A . 12 GLN HA 1 1 14 8238 1 1 12 GLN HB2 H -7.039 4.657 -8.490 1.00 . A A . 12 GLN HB2 1 1 14 8239 1 1 12 GLN HB3 H -8.528 5.588 -8.451 1.00 . A A . 12 GLN HB3 1 1 14 8240 1 1 12 GLN HE21 H -9.279 4.983 -11.242 1.00 . A A . 12 GLN HE21 1 1 14 8241 1 1 12 GLN HE22 H -10.203 6.390 -11.631 1.00 . A A . 12 GLN HE22 1 1 14 8242 1 1 12 GLN HG2 H -6.416 6.652 -10.197 1.00 . A A . 12 GLN HG2 1 1 14 8243 1 1 12 GLN HG3 H -7.102 5.101 -10.681 1.00 . A A . 12 GLN HG3 1 1 14 8244 1 1 12 GLN N N -5.518 6.122 -7.253 1.00 . A A . 12 GLN N 1 1 14 8245 1 1 12 GLN NE2 N -9.414 5.953 -11.245 1.00 . A A . 12 GLN NE2 1 1 14 8246 1 1 12 GLN O O -8.962 6.997 -6.651 1.00 . A A . 12 GLN O 1 1 14 8247 1 1 12 GLN OE1 O -8.565 7.947 -10.656 1.00 . A A . 12 GLN OE1 1 1 14 8248 1 1 13 CYS C C -8.755 5.798 -3.718 1.00 . A A . 13 CYS C 1 1 14 8249 1 1 13 CYS CA C -7.947 7.045 -4.061 1.00 . A A . 13 CYS CA 1 1 14 8250 1 1 13 CYS CB C -8.878 8.254 -4.192 1.00 . A A . 13 CYS CB 1 1 14 8251 1 1 13 CYS H H -6.213 6.711 -5.226 1.00 . A A . 13 CYS H 1 1 14 8252 1 1 13 CYS HA H -7.245 7.231 -3.262 1.00 . A A . 13 CYS HA 1 1 14 8253 1 1 13 CYS HB2 H -8.333 9.073 -4.638 1.00 . A A . 13 CYS HB2 1 1 14 8254 1 1 13 CYS HB3 H -9.709 7.992 -4.831 1.00 . A A . 13 CYS HB3 1 1 14 8255 1 1 13 CYS N N -7.178 6.846 -5.288 1.00 . A A . 13 CYS N 1 1 14 8256 1 1 13 CYS O O -9.923 5.887 -3.339 1.00 . A A . 13 CYS O 1 1 14 8257 1 1 13 CYS SG S -9.560 8.840 -2.607 1.00 . A A . 13 CYS SG 1 1 14 8258 1 1 14 LYS C C -7.821 2.433 -2.825 1.00 . A A . 14 LYS C 1 1 14 8259 1 1 14 LYS CA C -8.780 3.371 -3.547 1.00 . A A . 14 LYS CA 1 1 14 8260 1 1 14 LYS CB C -9.287 2.715 -4.832 1.00 . A A . 14 LYS CB 1 1 14 8261 1 1 14 LYS CD C -11.748 2.338 -4.495 1.00 . A A . 14 LYS CD 1 1 14 8262 1 1 14 LYS CE C -13.017 3.147 -4.278 1.00 . A A . 14 LYS CE 1 1 14 8263 1 1 14 LYS CG C -10.689 3.149 -5.225 1.00 . A A . 14 LYS CG 1 1 14 8264 1 1 14 LYS H H -7.191 4.627 -4.151 1.00 . A A . 14 LYS H 1 1 14 8265 1 1 14 LYS HA H -9.620 3.578 -2.901 1.00 . A A . 14 LYS HA 1 1 14 8266 1 1 14 LYS HB2 H -8.616 2.966 -5.640 1.00 . A A . 14 LYS HB2 1 1 14 8267 1 1 14 LYS HB3 H -9.289 1.643 -4.699 1.00 . A A . 14 LYS HB3 1 1 14 8268 1 1 14 LYS HD2 H -11.987 1.464 -5.082 1.00 . A A . 14 LYS HD2 1 1 14 8269 1 1 14 LYS HD3 H -11.356 2.034 -3.535 1.00 . A A . 14 LYS HD3 1 1 14 8270 1 1 14 LYS HE2 H -12.811 3.931 -3.565 1.00 . A A . 14 LYS HE2 1 1 14 8271 1 1 14 LYS HE3 H -13.315 3.586 -5.219 1.00 . A A . 14 LYS HE3 1 1 14 8272 1 1 14 LYS HG2 H -10.815 4.192 -4.977 1.00 . A A . 14 LYS HG2 1 1 14 8273 1 1 14 LYS HG3 H -10.814 3.012 -6.289 1.00 . A A . 14 LYS HG3 1 1 14 8274 1 1 14 LYS HZ1 H -13.997 1.316 -4.056 1.00 . A A . 14 LYS HZ1 1 1 14 8275 1 1 14 LYS HZ2 H -14.158 2.345 -2.722 1.00 . A A . 14 LYS HZ2 1 1 14 8276 1 1 14 LYS HZ3 H -15.040 2.646 -4.134 1.00 . A A . 14 LYS HZ3 1 1 14 8277 1 1 14 LYS N N -8.123 4.635 -3.848 1.00 . A A . 14 LYS N 1 1 14 8278 1 1 14 LYS NZ N -14.131 2.305 -3.761 1.00 . A A . 14 LYS NZ 1 1 14 8279 1 1 14 LYS O O -6.856 1.946 -3.414 1.00 . A A . 14 LYS O 1 1 14 8280 1 1 15 LEU C C -6.912 0.027 -1.495 1.00 . A A . 15 LEU C 1 1 14 8281 1 1 15 LEU CA C -7.246 1.309 -0.740 1.00 . A A . 15 LEU CA 1 1 14 8282 1 1 15 LEU CB C -7.939 0.973 0.582 1.00 . A A . 15 LEU CB 1 1 14 8283 1 1 15 LEU CD1 C -7.810 0.762 3.077 1.00 . A A . 15 LEU CD1 1 1 14 8284 1 1 15 LEU CD2 C -6.099 -0.359 1.637 1.00 . A A . 15 LEU CD2 1 1 14 8285 1 1 15 LEU CG C -7.007 0.851 1.788 1.00 . A A . 15 LEU CG 1 1 14 8286 1 1 15 LEU H H -8.872 2.608 -1.133 1.00 . A A . 15 LEU H 1 1 14 8287 1 1 15 LEU HA H -6.329 1.835 -0.529 1.00 . A A . 15 LEU HA 1 1 14 8288 1 1 15 LEU HB2 H -8.664 1.748 0.789 1.00 . A A . 15 LEU HB2 1 1 14 8289 1 1 15 LEU HB3 H -8.462 0.037 0.463 1.00 . A A . 15 LEU HB3 1 1 14 8290 1 1 15 LEU HD11 H -8.816 1.114 2.901 1.00 . A A . 15 LEU HD11 1 1 14 8291 1 1 15 LEU HD12 H -7.841 -0.264 3.412 1.00 . A A . 15 LEU HD12 1 1 14 8292 1 1 15 LEU HD13 H -7.343 1.374 3.835 1.00 . A A . 15 LEU HD13 1 1 14 8293 1 1 15 LEU HD21 H -6.635 -1.152 1.137 1.00 . A A . 15 LEU HD21 1 1 14 8294 1 1 15 LEU HD22 H -5.231 -0.088 1.054 1.00 . A A . 15 LEU HD22 1 1 14 8295 1 1 15 LEU HD23 H -5.784 -0.698 2.614 1.00 . A A . 15 LEU HD23 1 1 14 8296 1 1 15 LEU HG H -6.385 1.733 1.844 1.00 . A A . 15 LEU HG 1 1 14 8297 1 1 15 LEU N N -8.090 2.187 -1.546 1.00 . A A . 15 LEU N 1 1 14 8298 1 1 15 LEU O O -7.757 -0.856 -1.647 1.00 . A A . 15 LEU O 1 1 14 8299 1 1 16 LYS C C -5.616 -2.528 -2.014 1.00 . A A . 16 LYS C 1 1 14 8300 1 1 16 LYS CA C -5.222 -1.231 -2.721 1.00 . A A . 16 LYS CA 1 1 14 8301 1 1 16 LYS CB C -3.705 -1.183 -2.912 1.00 . A A . 16 LYS CB 1 1 14 8302 1 1 16 LYS CD C -3.422 -1.010 -5.403 1.00 . A A . 16 LYS CD 1 1 14 8303 1 1 16 LYS CE C -3.454 -0.023 -6.559 1.00 . A A . 16 LYS CE 1 1 14 8304 1 1 16 LYS CG C -3.265 -0.299 -4.069 1.00 . A A . 16 LYS CG 1 1 14 8305 1 1 16 LYS H H -5.049 0.677 -1.821 1.00 . A A . 16 LYS H 1 1 14 8306 1 1 16 LYS HA H -5.698 -1.202 -3.690 1.00 . A A . 16 LYS HA 1 1 14 8307 1 1 16 LYS HB2 H -3.251 -0.806 -2.007 1.00 . A A . 16 LYS HB2 1 1 14 8308 1 1 16 LYS HB3 H -3.344 -2.184 -3.095 1.00 . A A . 16 LYS HB3 1 1 14 8309 1 1 16 LYS HD2 H -2.590 -1.684 -5.542 1.00 . A A . 16 LYS HD2 1 1 14 8310 1 1 16 LYS HD3 H -4.346 -1.571 -5.395 1.00 . A A . 16 LYS HD3 1 1 14 8311 1 1 16 LYS HE2 H -2.977 0.894 -6.246 1.00 . A A . 16 LYS HE2 1 1 14 8312 1 1 16 LYS HE3 H -2.910 -0.445 -7.391 1.00 . A A . 16 LYS HE3 1 1 14 8313 1 1 16 LYS HG2 H -3.869 0.595 -4.075 1.00 . A A . 16 LYS HG2 1 1 14 8314 1 1 16 LYS HG3 H -2.227 -0.034 -3.932 1.00 . A A . 16 LYS HG3 1 1 14 8315 1 1 16 LYS HZ1 H -5.470 -0.525 -6.782 1.00 . A A . 16 LYS HZ1 1 1 14 8316 1 1 16 LYS HZ2 H -5.202 1.120 -6.493 1.00 . A A . 16 LYS HZ2 1 1 14 8317 1 1 16 LYS HZ3 H -4.869 0.463 -8.017 1.00 . A A . 16 LYS HZ3 1 1 14 8318 1 1 16 LYS N N -5.674 -0.063 -1.972 1.00 . A A . 16 LYS N 1 1 14 8319 1 1 16 LYS NZ N -4.846 0.280 -6.993 1.00 . A A . 16 LYS NZ 1 1 14 8320 1 1 16 LYS O O -5.723 -2.568 -0.788 1.00 . A A . 16 LYS O 1 1 14 8321 1 1 17 PRO C C -5.265 -5.381 -1.136 1.00 . A A . 17 PRO C 1 1 14 8322 1 1 17 PRO CA C -6.224 -4.908 -2.223 1.00 . A A . 17 PRO CA 1 1 14 8323 1 1 17 PRO CB C -6.166 -5.848 -3.430 1.00 . A A . 17 PRO CB 1 1 14 8324 1 1 17 PRO CD C -5.734 -3.646 -4.252 1.00 . A A . 17 PRO CD 1 1 14 8325 1 1 17 PRO CG C -6.362 -4.963 -4.612 1.00 . A A . 17 PRO CG 1 1 14 8326 1 1 17 PRO HA H -7.229 -4.886 -1.829 1.00 . A A . 17 PRO HA 1 1 14 8327 1 1 17 PRO HB2 H -5.205 -6.341 -3.460 1.00 . A A . 17 PRO HB2 1 1 14 8328 1 1 17 PRO HB3 H -6.952 -6.585 -3.355 1.00 . A A . 17 PRO HB3 1 1 14 8329 1 1 17 PRO HD2 H -4.701 -3.622 -4.566 1.00 . A A . 17 PRO HD2 1 1 14 8330 1 1 17 PRO HD3 H -6.285 -2.831 -4.698 1.00 . A A . 17 PRO HD3 1 1 14 8331 1 1 17 PRO HG2 H -5.872 -5.390 -5.475 1.00 . A A . 17 PRO HG2 1 1 14 8332 1 1 17 PRO HG3 H -7.417 -4.836 -4.804 1.00 . A A . 17 PRO HG3 1 1 14 8333 1 1 17 PRO N N -5.839 -3.608 -2.782 1.00 . A A . 17 PRO N 1 1 14 8334 1 1 17 PRO O O -4.052 -5.198 -1.242 1.00 . A A . 17 PRO O 1 1 14 8335 1 1 18 ALA C C -4.008 -7.538 0.525 1.00 . A A . 18 ALA C 1 1 14 8336 1 1 18 ALA CA C -5.009 -6.496 1.012 1.00 . A A . 18 ALA CA 1 1 14 8337 1 1 18 ALA CB C -5.904 -7.086 2.092 1.00 . A A . 18 ALA CB 1 1 14 8338 1 1 18 ALA H H -6.789 -6.112 -0.068 1.00 . A A . 18 ALA H 1 1 14 8339 1 1 18 ALA HA H -4.470 -5.663 1.439 1.00 . A A . 18 ALA HA 1 1 14 8340 1 1 18 ALA HB1 H -6.883 -6.636 2.034 1.00 . A A . 18 ALA HB1 1 1 14 8341 1 1 18 ALA HB2 H -5.988 -8.153 1.947 1.00 . A A . 18 ALA HB2 1 1 14 8342 1 1 18 ALA HB3 H -5.474 -6.887 3.063 1.00 . A A . 18 ALA HB3 1 1 14 8343 1 1 18 ALA N N -5.816 -5.994 -0.093 1.00 . A A . 18 ALA N 1 1 14 8344 1 1 18 ALA O O -4.270 -8.266 -0.432 1.00 . A A . 18 ALA O 1 1 14 8345 1 1 19 GLY C C -1.081 -8.140 -0.443 1.00 . A A . 19 GLY C 1 1 14 8346 1 1 19 GLY CA C -1.835 -8.556 0.807 1.00 . A A . 19 GLY CA 1 1 14 8347 1 1 19 GLY H H -2.704 -6.996 1.943 1.00 . A A . 19 GLY H 1 1 14 8348 1 1 19 GLY HA2 H -2.301 -9.514 0.629 1.00 . A A . 19 GLY HA2 1 1 14 8349 1 1 19 GLY HA3 H -1.132 -8.657 1.620 1.00 . A A . 19 GLY HA3 1 1 14 8350 1 1 19 GLY N N -2.859 -7.602 1.189 1.00 . A A . 19 GLY N 1 1 14 8351 1 1 19 GLY O O -0.292 -8.914 -0.984 1.00 . A A . 19 GLY O 1 1 14 8352 1 1 20 THR C C 0.384 -5.350 -1.728 1.00 . A A . 20 THR C 1 1 14 8353 1 1 20 THR CA C -0.655 -6.404 -2.097 1.00 . A A . 20 THR CA 1 1 14 8354 1 1 20 THR CB C -1.679 -5.810 -3.065 1.00 . A A . 20 THR CB 1 1 14 8355 1 1 20 THR CG2 C -1.061 -5.288 -4.344 1.00 . A A . 20 THR CG2 1 1 14 8356 1 1 20 THR H H -1.959 -6.340 -0.433 1.00 . A A . 20 THR H 1 1 14 8357 1 1 20 THR HA H -0.156 -7.232 -2.578 1.00 . A A . 20 THR HA 1 1 14 8358 1 1 20 THR HB H -2.182 -4.985 -2.580 1.00 . A A . 20 THR HB 1 1 14 8359 1 1 20 THR HG1 H -3.286 -6.384 -4.027 1.00 . A A . 20 THR HG1 1 1 14 8360 1 1 20 THR HG21 H 0.010 -5.218 -4.223 1.00 . A A . 20 THR HG21 1 1 14 8361 1 1 20 THR HG22 H -1.289 -5.963 -5.156 1.00 . A A . 20 THR HG22 1 1 14 8362 1 1 20 THR HG23 H -1.463 -4.310 -4.565 1.00 . A A . 20 THR HG23 1 1 14 8363 1 1 20 THR N N -1.321 -6.914 -0.905 1.00 . A A . 20 THR N 1 1 14 8364 1 1 20 THR O O 0.043 -4.266 -1.255 1.00 . A A . 20 THR O 1 1 14 8365 1 1 20 THR OG1 O -2.652 -6.776 -3.421 1.00 . A A . 20 THR OG1 1 1 14 8366 1 1 21 THR C C 2.571 -3.434 -2.370 1.00 . A A . 21 THR C 1 1 14 8367 1 1 21 THR CA C 2.745 -4.760 -1.637 1.00 . A A . 21 THR CA 1 1 14 8368 1 1 21 THR CB C 4.087 -5.390 -2.010 1.00 . A A . 21 THR CB 1 1 14 8369 1 1 21 THR CG2 C 4.081 -6.046 -3.374 1.00 . A A . 21 THR CG2 1 1 14 8370 1 1 21 THR H H 1.862 -6.557 -2.325 1.00 . A A . 21 THR H 1 1 14 8371 1 1 21 THR HA H 2.729 -4.574 -0.574 1.00 . A A . 21 THR HA 1 1 14 8372 1 1 21 THR HB H 4.333 -6.148 -1.280 1.00 . A A . 21 THR HB 1 1 14 8373 1 1 21 THR HG1 H 5.957 -4.839 -2.197 1.00 . A A . 21 THR HG1 1 1 14 8374 1 1 21 THR HG21 H 3.600 -5.391 -4.086 1.00 . A A . 21 THR HG21 1 1 14 8375 1 1 21 THR HG22 H 5.097 -6.235 -3.687 1.00 . A A . 21 THR HG22 1 1 14 8376 1 1 21 THR HG23 H 3.540 -6.979 -3.322 1.00 . A A . 21 THR HG23 1 1 14 8377 1 1 21 THR N N 1.653 -5.677 -1.947 1.00 . A A . 21 THR N 1 1 14 8378 1 1 21 THR O O 1.962 -3.378 -3.438 1.00 . A A . 21 THR O 1 1 14 8379 1 1 21 THR OG1 O 5.117 -4.417 -2.006 1.00 . A A . 21 THR OG1 1 1 14 8380 1 1 22 CYS C C 4.298 -0.687 -3.131 1.00 . A A . 22 CYS C 1 1 14 8381 1 1 22 CYS CA C 3.016 -1.041 -2.383 1.00 . A A . 22 CYS CA 1 1 14 8382 1 1 22 CYS CB C 2.736 0.007 -1.304 1.00 . A A . 22 CYS CB 1 1 14 8383 1 1 22 CYS H H 3.584 -2.477 -0.936 1.00 . A A . 22 CYS H 1 1 14 8384 1 1 22 CYS HA H 2.196 -1.050 -3.085 1.00 . A A . 22 CYS HA 1 1 14 8385 1 1 22 CYS HB2 H 2.782 0.990 -1.747 1.00 . A A . 22 CYS HB2 1 1 14 8386 1 1 22 CYS HB3 H 1.746 -0.156 -0.904 1.00 . A A . 22 CYS HB3 1 1 14 8387 1 1 22 CYS N N 3.111 -2.368 -1.787 1.00 . A A . 22 CYS N 1 1 14 8388 1 1 22 CYS O O 4.259 -0.055 -4.186 1.00 . A A . 22 CYS O 1 1 14 8389 1 1 22 CYS SG S 3.910 -0.027 0.089 1.00 . A A . 22 CYS SG 1 1 14 8390 1 1 23 TRP C C 7.550 -2.104 -3.316 1.00 . A A . 23 TRP C 1 1 14 8391 1 1 23 TRP CA C 6.728 -0.826 -3.190 1.00 . A A . 23 TRP CA 1 1 14 8392 1 1 23 TRP CB C 7.497 0.210 -2.368 1.00 . A A . 23 TRP CB 1 1 14 8393 1 1 23 TRP CD1 C 8.873 1.359 -4.199 1.00 . A A . 23 TRP CD1 1 1 14 8394 1 1 23 TRP CD2 C 10.098 0.470 -2.549 1.00 . A A . 23 TRP CD2 1 1 14 8395 1 1 23 TRP CE2 C 10.967 1.065 -3.482 1.00 . A A . 23 TRP CE2 1 1 14 8396 1 1 23 TRP CE3 C 10.643 -0.153 -1.423 1.00 . A A . 23 TRP CE3 1 1 14 8397 1 1 23 TRP CG C 8.762 0.669 -3.026 1.00 . A A . 23 TRP CG 1 1 14 8398 1 1 23 TRP CH2 C 12.857 0.439 -2.212 1.00 . A A . 23 TRP CH2 1 1 14 8399 1 1 23 TRP CZ2 C 12.351 1.056 -3.323 1.00 . A A . 23 TRP CZ2 1 1 14 8400 1 1 23 TRP CZ3 C 12.017 -0.162 -1.266 1.00 . A A . 23 TRP CZ3 1 1 14 8401 1 1 23 TRP H H 5.400 -1.599 -1.733 1.00 . A A . 23 TRP H 1 1 14 8402 1 1 23 TRP HA H 6.549 -0.429 -4.177 1.00 . A A . 23 TRP HA 1 1 14 8403 1 1 23 TRP HB2 H 6.869 1.075 -2.214 1.00 . A A . 23 TRP HB2 1 1 14 8404 1 1 23 TRP HB3 H 7.754 -0.219 -1.411 1.00 . A A . 23 TRP HB3 1 1 14 8405 1 1 23 TRP HD1 H 8.034 1.662 -4.807 1.00 . A A . 23 TRP HD1 1 1 14 8406 1 1 23 TRP HE1 H 10.532 2.080 -5.267 1.00 . A A . 23 TRP HE1 1 1 14 8407 1 1 23 TRP HE3 H 10.011 -0.622 -0.683 1.00 . A A . 23 TRP HE3 1 1 14 8408 1 1 23 TRP HH2 H 13.924 0.407 -2.049 1.00 . A A . 23 TRP HH2 1 1 14 8409 1 1 23 TRP HZ2 H 13.012 1.515 -4.043 1.00 . A A . 23 TRP HZ2 1 1 14 8410 1 1 23 TRP HZ3 H 12.456 -0.639 -0.402 1.00 . A A . 23 TRP HZ3 1 1 14 8411 1 1 23 TRP N N 5.433 -1.099 -2.576 1.00 . A A . 23 TRP N 1 1 14 8412 1 1 23 TRP NE1 N 10.196 1.601 -4.480 1.00 . A A . 23 TRP NE1 1 1 14 8413 1 1 23 TRP O O 8.099 -2.601 -2.332 1.00 . A A . 23 TRP O 1 1 14 8414 1 1 24 ARG C C 9.569 -3.577 -5.715 1.00 . A A . 24 ARG C 1 1 14 8415 1 1 24 ARG CA C 8.389 -3.852 -4.789 1.00 . A A . 24 ARG CA 1 1 14 8416 1 1 24 ARG CB C 7.481 -4.919 -5.405 1.00 . A A . 24 ARG CB 1 1 14 8417 1 1 24 ARG CD C 5.587 -5.228 -7.027 1.00 . A A . 24 ARG CD 1 1 14 8418 1 1 24 ARG CG C 6.907 -4.524 -6.755 1.00 . A A . 24 ARG CG 1 1 14 8419 1 1 24 ARG CZ C 4.705 -7.528 -7.084 1.00 . A A . 24 ARG CZ 1 1 14 8420 1 1 24 ARG H H 7.173 -2.189 -5.278 1.00 . A A . 24 ARG H 1 1 14 8421 1 1 24 ARG HA H 8.764 -4.214 -3.844 1.00 . A A . 24 ARG HA 1 1 14 8422 1 1 24 ARG HB2 H 8.050 -5.829 -5.531 1.00 . A A . 24 ARG HB2 1 1 14 8423 1 1 24 ARG HB3 H 6.660 -5.109 -4.730 1.00 . A A . 24 ARG HB3 1 1 14 8424 1 1 24 ARG HD2 H 4.879 -4.944 -6.263 1.00 . A A . 24 ARG HD2 1 1 14 8425 1 1 24 ARG HD3 H 5.219 -4.915 -7.992 1.00 . A A . 24 ARG HD3 1 1 14 8426 1 1 24 ARG HE H 6.639 -7.047 -6.970 1.00 . A A . 24 ARG HE 1 1 14 8427 1 1 24 ARG HG2 H 6.744 -3.457 -6.768 1.00 . A A . 24 ARG HG2 1 1 14 8428 1 1 24 ARG HG3 H 7.613 -4.792 -7.528 1.00 . A A . 24 ARG HG3 1 1 14 8429 1 1 24 ARG HH11 H 3.290 -6.086 -7.162 1.00 . A A . 24 ARG HH11 1 1 14 8430 1 1 24 ARG HH12 H 2.695 -7.712 -7.201 1.00 . A A . 24 ARG HH12 1 1 14 8431 1 1 24 ARG HH21 H 5.859 -9.186 -7.022 1.00 . A A . 24 ARG HH21 1 1 14 8432 1 1 24 ARG HH22 H 4.154 -9.472 -7.121 1.00 . A A . 24 ARG HH22 1 1 14 8433 1 1 24 ARG N N 7.632 -2.631 -4.534 1.00 . A A . 24 ARG N 1 1 14 8434 1 1 24 ARG NE N 5.731 -6.682 -7.022 1.00 . A A . 24 ARG NE 1 1 14 8435 1 1 24 ARG NH1 N 3.461 -7.071 -7.155 1.00 . A A . 24 ARG NH1 1 1 14 8436 1 1 24 ARG NH2 N 4.924 -8.836 -7.075 1.00 . A A . 24 ARG NH2 1 1 14 8437 1 1 24 ARG O O 9.651 -2.516 -6.334 1.00 . A A . 24 ARG O 1 1 14 8438 1 1 25 THR C C 12.436 -5.710 -6.725 1.00 . A A . 25 THR C 1 1 14 8439 1 1 25 THR CA C 11.657 -4.401 -6.656 1.00 . A A . 25 THR CA 1 1 14 8440 1 1 25 THR CB C 12.561 -3.283 -6.132 1.00 . A A . 25 THR CB 1 1 14 8441 1 1 25 THR CG2 C 12.929 -3.445 -4.673 1.00 . A A . 25 THR CG2 1 1 14 8442 1 1 25 THR H H 10.360 -5.363 -5.287 1.00 . A A . 25 THR H 1 1 14 8443 1 1 25 THR HA H 11.320 -4.143 -7.648 1.00 . A A . 25 THR HA 1 1 14 8444 1 1 25 THR HB H 12.049 -2.338 -6.242 1.00 . A A . 25 THR HB 1 1 14 8445 1 1 25 THR HG1 H 13.730 -2.483 -7.485 1.00 . A A . 25 THR HG1 1 1 14 8446 1 1 25 THR HG21 H 12.289 -4.188 -4.221 1.00 . A A . 25 THR HG21 1 1 14 8447 1 1 25 THR HG22 H 13.959 -3.760 -4.594 1.00 . A A . 25 THR HG22 1 1 14 8448 1 1 25 THR HG23 H 12.801 -2.501 -4.163 1.00 . A A . 25 THR HG23 1 1 14 8449 1 1 25 THR N N 10.481 -4.539 -5.805 1.00 . A A . 25 THR N 1 1 14 8450 1 1 25 THR O O 13.666 -5.712 -6.766 1.00 . A A . 25 THR O 1 1 14 8451 1 1 25 THR OG1 O 13.766 -3.224 -6.875 1.00 . A A . 25 THR OG1 1 1 14 8452 1 1 26 SER C C 13.235 -8.377 -5.596 1.00 . A A . 26 SER C 1 1 14 8453 1 1 26 SER CA C 12.333 -8.141 -6.804 1.00 . A A . 26 SER CA 1 1 14 8454 1 1 26 SER CB C 13.141 -8.283 -8.095 1.00 . A A . 26 SER CB 1 1 14 8455 1 1 26 SER H H 10.733 -6.758 -6.704 1.00 . A A . 26 SER H 1 1 14 8456 1 1 26 SER HA H 11.546 -8.880 -6.799 1.00 . A A . 26 SER HA 1 1 14 8457 1 1 26 SER HB2 H 13.563 -7.325 -8.361 1.00 . A A . 26 SER HB2 1 1 14 8458 1 1 26 SER HB3 H 13.938 -8.996 -7.942 1.00 . A A . 26 SER HB3 1 1 14 8459 1 1 26 SER HG H 12.105 -7.992 -9.732 1.00 . A A . 26 SER HG 1 1 14 8460 1 1 26 SER N N 11.711 -6.824 -6.739 1.00 . A A . 26 SER N 1 1 14 8461 1 1 26 SER O O 14.293 -8.996 -5.711 1.00 . A A . 26 SER O 1 1 14 8462 1 1 26 SER OG O 12.324 -8.733 -9.162 1.00 . A A . 26 SER OG 1 1 14 8463 1 1 27 VAL C C 12.851 -7.411 -2.025 1.00 . A A . 27 VAL C 1 1 14 8464 1 1 27 VAL CA C 13.578 -8.036 -3.211 1.00 . A A . 27 VAL CA 1 1 14 8465 1 1 27 VAL CB C 14.978 -7.403 -3.340 1.00 . A A . 27 VAL CB 1 1 14 8466 1 1 27 VAL CG1 C 14.871 -5.904 -3.582 1.00 . A A . 27 VAL CG1 1 1 14 8467 1 1 27 VAL CG2 C 15.814 -7.693 -2.101 1.00 . A A . 27 VAL CG2 1 1 14 8468 1 1 27 VAL H H 11.957 -7.396 -4.413 1.00 . A A . 27 VAL H 1 1 14 8469 1 1 27 VAL HA H 13.699 -9.092 -3.028 1.00 . A A . 27 VAL HA 1 1 14 8470 1 1 27 VAL HB H 15.473 -7.846 -4.192 1.00 . A A . 27 VAL HB 1 1 14 8471 1 1 27 VAL HG11 H 14.310 -5.726 -4.488 1.00 . A A . 27 VAL HG11 1 1 14 8472 1 1 27 VAL HG12 H 14.367 -5.440 -2.748 1.00 . A A . 27 VAL HG12 1 1 14 8473 1 1 27 VAL HG13 H 15.861 -5.485 -3.684 1.00 . A A . 27 VAL HG13 1 1 14 8474 1 1 27 VAL HG21 H 15.162 -7.933 -1.274 1.00 . A A . 27 VAL HG21 1 1 14 8475 1 1 27 VAL HG22 H 16.470 -8.529 -2.297 1.00 . A A . 27 VAL HG22 1 1 14 8476 1 1 27 VAL HG23 H 16.405 -6.823 -1.853 1.00 . A A . 27 VAL HG23 1 1 14 8477 1 1 27 VAL N N 12.809 -7.879 -4.440 1.00 . A A . 27 VAL N 1 1 14 8478 1 1 27 VAL O O 12.860 -7.955 -0.921 1.00 . A A . 27 VAL O 1 1 14 8479 1 1 28 SER C C 9.988 -5.815 -1.341 1.00 . A A . 28 SER C 1 1 14 8480 1 1 28 SER CA C 11.488 -5.565 -1.216 1.00 . A A . 28 SER CA 1 1 14 8481 1 1 28 SER CB C 11.773 -4.064 -1.282 1.00 . A A . 28 SER CB 1 1 14 8482 1 1 28 SER H H 12.251 -5.885 -3.164 1.00 . A A . 28 SER H 1 1 14 8483 1 1 28 SER HA H 11.825 -5.945 -0.263 1.00 . A A . 28 SER HA 1 1 14 8484 1 1 28 SER HB2 H 11.409 -3.671 -2.220 1.00 . A A . 28 SER HB2 1 1 14 8485 1 1 28 SER HB3 H 11.272 -3.567 -0.464 1.00 . A A . 28 SER HB3 1 1 14 8486 1 1 28 SER HG H 13.347 -3.327 -0.377 1.00 . A A . 28 SER HG 1 1 14 8487 1 1 28 SER N N 12.221 -6.267 -2.262 1.00 . A A . 28 SER N 1 1 14 8488 1 1 28 SER O O 9.445 -5.852 -2.445 1.00 . A A . 28 SER O 1 1 14 8489 1 1 28 SER OG O 13.163 -3.804 -1.190 1.00 . A A . 28 SER OG 1 1 14 8490 1 1 29 SER C C 7.319 -6.034 1.216 1.00 . A A . 29 SER C 1 1 14 8491 1 1 29 SER CA C 7.888 -6.233 -0.185 1.00 . A A . 29 SER CA 1 1 14 8492 1 1 29 SER CB C 7.586 -7.650 -0.674 1.00 . A A . 29 SER CB 1 1 14 8493 1 1 29 SER H H 9.813 -5.945 0.646 1.00 . A A . 29 SER H 1 1 14 8494 1 1 29 SER HA H 7.422 -5.524 -0.853 1.00 . A A . 29 SER HA 1 1 14 8495 1 1 29 SER HB2 H 8.212 -8.353 -0.144 1.00 . A A . 29 SER HB2 1 1 14 8496 1 1 29 SER HB3 H 6.548 -7.880 -0.487 1.00 . A A . 29 SER HB3 1 1 14 8497 1 1 29 SER HG H 7.449 -7.030 -2.528 1.00 . A A . 29 SER HG 1 1 14 8498 1 1 29 SER N N 9.325 -5.986 -0.202 1.00 . A A . 29 SER N 1 1 14 8499 1 1 29 SER O O 7.745 -6.688 2.169 1.00 . A A . 29 SER O 1 1 14 8500 1 1 29 SER OG O 7.838 -7.775 -2.063 1.00 . A A . 29 SER OG 1 1 14 8501 1 1 30 HIS C C 4.340 -5.476 2.700 1.00 . A A . 30 HIS C 1 1 14 8502 1 1 30 HIS CA C 5.725 -4.844 2.620 1.00 . A A . 30 HIS CA 1 1 14 8503 1 1 30 HIS CB C 5.623 -3.334 2.838 1.00 . A A . 30 HIS CB 1 1 14 8504 1 1 30 HIS CD2 C 8.082 -2.596 2.467 1.00 . A A . 30 HIS CD2 1 1 14 8505 1 1 30 HIS CE1 C 8.401 -1.571 4.379 1.00 . A A . 30 HIS CE1 1 1 14 8506 1 1 30 HIS CG C 6.931 -2.688 3.175 1.00 . A A . 30 HIS CG 1 1 14 8507 1 1 30 HIS H H 6.056 -4.640 0.539 1.00 . A A . 30 HIS H 1 1 14 8508 1 1 30 HIS HA H 6.347 -5.269 3.393 1.00 . A A . 30 HIS HA 1 1 14 8509 1 1 30 HIS HB2 H 5.247 -2.872 1.938 1.00 . A A . 30 HIS HB2 1 1 14 8510 1 1 30 HIS HB3 H 4.937 -3.140 3.650 1.00 . A A . 30 HIS HB3 1 1 14 8511 1 1 30 HIS HD1 H 6.519 -1.929 5.097 1.00 . A A . 30 HIS HD1 1 1 14 8512 1 1 30 HIS HD2 H 8.262 -2.998 1.480 1.00 . A A . 30 HIS HD2 1 1 14 8513 1 1 30 HIS HE1 H 8.861 -1.018 5.184 1.00 . A A . 30 HIS HE1 1 1 14 8514 1 1 30 HIS HE2 H 9.868 -1.602 2.950 1.00 . A A . 30 HIS HE2 1 1 14 8515 1 1 30 HIS N N 6.353 -5.129 1.335 1.00 . A A . 30 HIS N 1 1 14 8516 1 1 30 HIS ND1 N 7.164 -2.036 4.367 1.00 . A A . 30 HIS ND1 1 1 14 8517 1 1 30 HIS NE2 N 8.979 -1.898 3.238 1.00 . A A . 30 HIS NE2 1 1 14 8518 1 1 30 HIS O O 3.893 -5.880 3.773 1.00 . A A . 30 HIS O 1 1 14 8519 1 1 31 TYR C C 1.342 -5.339 2.333 1.00 . A A . 31 TYR C 1 1 14 8520 1 1 31 TYR CA C 2.329 -6.141 1.492 1.00 . A A . 31 TYR CA 1 1 14 8521 1 1 31 TYR CB C 2.359 -7.596 1.965 1.00 . A A . 31 TYR CB 1 1 14 8522 1 1 31 TYR CD1 C 3.802 -9.528 1.218 1.00 . A A . 31 TYR CD1 1 1 14 8523 1 1 31 TYR CD2 C 2.354 -8.519 -0.384 1.00 . A A . 31 TYR CD2 1 1 14 8524 1 1 31 TYR CE1 C 4.252 -10.416 0.259 1.00 . A A . 31 TYR CE1 1 1 14 8525 1 1 31 TYR CE2 C 2.798 -9.404 -1.349 1.00 . A A . 31 TYR CE2 1 1 14 8526 1 1 31 TYR CG C 2.848 -8.566 0.913 1.00 . A A . 31 TYR CG 1 1 14 8527 1 1 31 TYR CZ C 3.747 -10.350 -1.022 1.00 . A A . 31 TYR CZ 1 1 14 8528 1 1 31 TYR H H 4.078 -5.219 0.735 1.00 . A A . 31 TYR H 1 1 14 8529 1 1 31 TYR HA H 2.008 -6.115 0.461 1.00 . A A . 31 TYR HA 1 1 14 8530 1 1 31 TYR HB2 H 3.014 -7.677 2.819 1.00 . A A . 31 TYR HB2 1 1 14 8531 1 1 31 TYR HB3 H 1.361 -7.893 2.254 1.00 . A A . 31 TYR HB3 1 1 14 8532 1 1 31 TYR HD1 H 4.196 -9.577 2.222 1.00 . A A . 31 TYR HD1 1 1 14 8533 1 1 31 TYR HD2 H 1.611 -7.777 -0.637 1.00 . A A . 31 TYR HD2 1 1 14 8534 1 1 31 TYR HE1 H 4.995 -11.157 0.515 1.00 . A A . 31 TYR HE1 1 1 14 8535 1 1 31 TYR HE2 H 2.402 -9.352 -2.352 1.00 . A A . 31 TYR HE2 1 1 14 8536 1 1 31 TYR HH H 5.006 -10.902 -2.366 1.00 . A A . 31 TYR HH 1 1 14 8537 1 1 31 TYR N N 3.666 -5.558 1.556 1.00 . A A . 31 TYR N 1 1 14 8538 1 1 31 TYR O O 1.570 -5.102 3.519 1.00 . A A . 31 TYR O 1 1 14 8539 1 1 31 TYR OH O 4.191 -11.232 -1.980 1.00 . A A . 31 TYR OH 1 1 14 8540 1 1 32 CYS C C -1.718 -5.069 3.185 1.00 . A A . 32 CYS C 1 1 14 8541 1 1 32 CYS CA C -0.781 -4.152 2.406 1.00 . A A . 32 CYS CA 1 1 14 8542 1 1 32 CYS CB C -1.580 -3.311 1.407 1.00 . A A . 32 CYS CB 1 1 14 8543 1 1 32 CYS H H 0.113 -5.147 0.766 1.00 . A A . 32 CYS H 1 1 14 8544 1 1 32 CYS HA H -0.283 -3.492 3.101 1.00 . A A . 32 CYS HA 1 1 14 8545 1 1 32 CYS HB2 H -1.262 -3.558 0.406 1.00 . A A . 32 CYS HB2 1 1 14 8546 1 1 32 CYS HB3 H -2.631 -3.540 1.512 1.00 . A A . 32 CYS HB3 1 1 14 8547 1 1 32 CYS N N 0.241 -4.926 1.712 1.00 . A A . 32 CYS N 1 1 14 8548 1 1 32 CYS O O -1.644 -6.292 3.070 1.00 . A A . 32 CYS O 1 1 14 8549 1 1 32 CYS SG S -1.380 -1.513 1.622 1.00 . A A . 32 CYS SG 1 1 14 8550 1 1 33 THR C C -4.988 -4.849 4.426 1.00 . A A . 33 THR C 1 1 14 8551 1 1 33 THR CA C -3.552 -5.231 4.775 1.00 . A A . 33 THR CA 1 1 14 8552 1 1 33 THR CB C -3.299 -5.000 6.266 1.00 . A A . 33 THR CB 1 1 14 8553 1 1 33 THR CG2 C -1.831 -5.019 6.634 1.00 . A A . 33 THR CG2 1 1 14 8554 1 1 33 THR H H -2.609 -3.490 4.026 1.00 . A A . 33 THR H 1 1 14 8555 1 1 33 THR HA H -3.407 -6.278 4.554 1.00 . A A . 33 THR HA 1 1 14 8556 1 1 33 THR HB H -3.791 -5.780 6.829 1.00 . A A . 33 THR HB 1 1 14 8557 1 1 33 THR HG1 H -3.940 -3.750 7.631 1.00 . A A . 33 THR HG1 1 1 14 8558 1 1 33 THR HG21 H -1.305 -5.697 5.979 1.00 . A A . 33 THR HG21 1 1 14 8559 1 1 33 THR HG22 H -1.420 -4.025 6.527 1.00 . A A . 33 THR HG22 1 1 14 8560 1 1 33 THR HG23 H -1.719 -5.347 7.657 1.00 . A A . 33 THR HG23 1 1 14 8561 1 1 33 THR N N -2.598 -4.469 3.977 1.00 . A A . 33 THR N 1 1 14 8562 1 1 33 THR O O -5.911 -5.099 5.201 1.00 . A A . 33 THR O 1 1 14 8563 1 1 33 THR OG1 O -3.829 -3.753 6.677 1.00 . A A . 33 THR OG1 1 1 14 8564 1 1 34 GLY C C -7.248 -3.054 3.890 1.00 . A A . 34 GLY C 1 1 14 8565 1 1 34 GLY CA C -6.500 -3.837 2.826 1.00 . A A . 34 GLY CA 1 1 14 8566 1 1 34 GLY H H -4.399 -4.068 2.676 1.00 . A A . 34 GLY H 1 1 14 8567 1 1 34 GLY HA2 H -7.069 -4.720 2.578 1.00 . A A . 34 GLY HA2 1 1 14 8568 1 1 34 GLY HA3 H -6.408 -3.223 1.943 1.00 . A A . 34 GLY HA3 1 1 14 8569 1 1 34 GLY N N -5.171 -4.242 3.255 1.00 . A A . 34 GLY N 1 1 14 8570 1 1 34 GLY O O -8.479 -3.049 3.914 1.00 . A A . 34 GLY O 1 1 14 8571 1 1 35 ARG C C -6.723 -0.135 5.724 1.00 . A A . 35 ARG C 1 1 14 8572 1 1 35 ARG CA C -7.108 -1.606 5.843 1.00 . A A . 35 ARG CA 1 1 14 8573 1 1 35 ARG CB C -6.679 -2.149 7.207 1.00 . A A . 35 ARG CB 1 1 14 8574 1 1 35 ARG CD C -7.593 -2.924 9.415 1.00 . A A . 35 ARG CD 1 1 14 8575 1 1 35 ARG CG C -7.687 -1.882 8.313 1.00 . A A . 35 ARG CG 1 1 14 8576 1 1 35 ARG CZ C -8.077 -5.325 9.683 1.00 . A A . 35 ARG CZ 1 1 14 8577 1 1 35 ARG H H -5.529 -2.436 4.702 1.00 . A A . 35 ARG H 1 1 14 8578 1 1 35 ARG HA H -8.179 -1.692 5.753 1.00 . A A . 35 ARG HA 1 1 14 8579 1 1 35 ARG HB2 H -6.537 -3.217 7.128 1.00 . A A . 35 ARG HB2 1 1 14 8580 1 1 35 ARG HB3 H -5.741 -1.690 7.485 1.00 . A A . 35 ARG HB3 1 1 14 8581 1 1 35 ARG HD2 H -6.551 -3.132 9.609 1.00 . A A . 35 ARG HD2 1 1 14 8582 1 1 35 ARG HD3 H -8.052 -2.526 10.309 1.00 . A A . 35 ARG HD3 1 1 14 8583 1 1 35 ARG HE H -8.887 -4.143 8.295 1.00 . A A . 35 ARG HE 1 1 14 8584 1 1 35 ARG HG2 H -7.493 -0.907 8.735 1.00 . A A . 35 ARG HG2 1 1 14 8585 1 1 35 ARG HG3 H -8.682 -1.904 7.892 1.00 . A A . 35 ARG HG3 1 1 14 8586 1 1 35 ARG HH11 H -6.746 -4.585 11.015 1.00 . A A . 35 ARG HH11 1 1 14 8587 1 1 35 ARG HH12 H -7.104 -6.271 11.182 1.00 . A A . 35 ARG HH12 1 1 14 8588 1 1 35 ARG HH21 H -9.359 -6.360 8.513 1.00 . A A . 35 ARG HH21 1 1 14 8589 1 1 35 ARG HH22 H -8.587 -7.279 9.762 1.00 . A A . 35 ARG HH22 1 1 14 8590 1 1 35 ARG N N -6.505 -2.393 4.772 1.00 . A A . 35 ARG N 1 1 14 8591 1 1 35 ARG NE N -8.264 -4.169 9.051 1.00 . A A . 35 ARG NE 1 1 14 8592 1 1 35 ARG NH1 N -7.240 -5.400 10.711 1.00 . A A . 35 ARG NH1 1 1 14 8593 1 1 35 ARG NH2 N -8.727 -6.411 9.287 1.00 . A A . 35 ARG NH2 1 1 14 8594 1 1 35 ARG O O -7.537 0.753 5.978 1.00 . A A . 35 ARG O 1 1 14 8595 1 1 36 SER C C -4.069 1.588 3.968 1.00 . A A . 36 SER C 1 1 14 8596 1 1 36 SER CA C -4.982 1.477 5.184 1.00 . A A . 36 SER CA 1 1 14 8597 1 1 36 SER CB C -4.229 1.912 6.443 1.00 . A A . 36 SER CB 1 1 14 8598 1 1 36 SER H H -4.878 -0.636 5.150 1.00 . A A . 36 SER H 1 1 14 8599 1 1 36 SER HA H -5.832 2.127 5.042 1.00 . A A . 36 SER HA 1 1 14 8600 1 1 36 SER HB2 H -3.775 1.049 6.905 1.00 . A A . 36 SER HB2 1 1 14 8601 1 1 36 SER HB3 H -3.460 2.621 6.173 1.00 . A A . 36 SER HB3 1 1 14 8602 1 1 36 SER HG H -4.783 3.400 7.590 1.00 . A A . 36 SER HG 1 1 14 8603 1 1 36 SER N N -5.478 0.114 5.338 1.00 . A A . 36 SER N 1 1 14 8604 1 1 36 SER O O -3.734 0.586 3.337 1.00 . A A . 36 SER O 1 1 14 8605 1 1 36 SER OG O -5.104 2.521 7.376 1.00 . A A . 36 SER OG 1 1 14 8606 1 1 37 CYS C C -1.385 3.422 2.962 1.00 . A A . 37 CYS C 1 1 14 8607 1 1 37 CYS CA C -2.794 3.054 2.504 1.00 . A A . 37 CYS CA 1 1 14 8608 1 1 37 CYS CB C -3.366 4.164 1.623 1.00 . A A . 37 CYS CB 1 1 14 8609 1 1 37 CYS H H -3.968 3.573 4.187 1.00 . A A . 37 CYS H 1 1 14 8610 1 1 37 CYS HA H -2.744 2.142 1.929 1.00 . A A . 37 CYS HA 1 1 14 8611 1 1 37 CYS HB2 H -3.651 4.998 2.246 1.00 . A A . 37 CYS HB2 1 1 14 8612 1 1 37 CYS HB3 H -2.607 4.486 0.925 1.00 . A A . 37 CYS HB3 1 1 14 8613 1 1 37 CYS N N -3.669 2.813 3.645 1.00 . A A . 37 CYS N 1 1 14 8614 1 1 37 CYS O O -0.610 4.008 2.206 1.00 . A A . 37 CYS O 1 1 14 8615 1 1 37 CYS SG S -4.830 3.663 0.662 1.00 . A A . 37 CYS SG 1 1 14 8616 1 1 38 GLU C C 1.012 2.075 5.067 1.00 . A A . 38 GLU C 1 1 14 8617 1 1 38 GLU CA C 0.257 3.364 4.759 1.00 . A A . 38 GLU CA 1 1 14 8618 1 1 38 GLU CB C 0.123 4.206 6.029 1.00 . A A . 38 GLU CB 1 1 14 8619 1 1 38 GLU CD C 1.455 6.259 5.405 1.00 . A A . 38 GLU CD 1 1 14 8620 1 1 38 GLU CG C 0.092 5.703 5.766 1.00 . A A . 38 GLU CG 1 1 14 8621 1 1 38 GLU H H -1.718 2.606 4.758 1.00 . A A . 38 GLU H 1 1 14 8622 1 1 38 GLU HA H 0.812 3.925 4.022 1.00 . A A . 38 GLU HA 1 1 14 8623 1 1 38 GLU HB2 H -0.791 3.932 6.534 1.00 . A A . 38 GLU HB2 1 1 14 8624 1 1 38 GLU HB3 H 0.960 3.993 6.678 1.00 . A A . 38 GLU HB3 1 1 14 8625 1 1 38 GLU HG2 H -0.587 5.898 4.950 1.00 . A A . 38 GLU HG2 1 1 14 8626 1 1 38 GLU HG3 H -0.261 6.204 6.656 1.00 . A A . 38 GLU HG3 1 1 14 8627 1 1 38 GLU N N -1.059 3.073 4.203 1.00 . A A . 38 GLU N 1 1 14 8628 1 1 38 GLU O O 0.846 1.486 6.135 1.00 . A A . 38 GLU O 1 1 14 8629 1 1 38 GLU OE1 O 2.266 5.511 4.819 1.00 . A A . 38 GLU OE1 1 1 14 8630 1 1 38 GLU OE2 O 1.712 7.444 5.707 1.00 . A A . 38 GLU OE2 1 1 14 8631 1 1 39 CYS C C 3.440 0.461 5.580 1.00 . A A . 39 CYS C 1 1 14 8632 1 1 39 CYS CA C 2.622 0.418 4.289 1.00 . A A . 39 CYS CA 1 1 14 8633 1 1 39 CYS CB C 3.555 0.221 3.092 1.00 . A A . 39 CYS CB 1 1 14 8634 1 1 39 CYS H H 1.929 2.153 3.292 1.00 . A A . 39 CYS H 1 1 14 8635 1 1 39 CYS HA H 1.933 -0.411 4.335 1.00 . A A . 39 CYS HA 1 1 14 8636 1 1 39 CYS HB2 H 3.909 1.184 2.758 1.00 . A A . 39 CYS HB2 1 1 14 8637 1 1 39 CYS HB3 H 4.398 -0.381 3.398 1.00 . A A . 39 CYS HB3 1 1 14 8638 1 1 39 CYS N N 1.841 1.640 4.122 1.00 . A A . 39 CYS N 1 1 14 8639 1 1 39 CYS O O 4.418 1.201 5.678 1.00 . A A . 39 CYS O 1 1 14 8640 1 1 39 CYS SG S 2.772 -0.603 1.668 1.00 . A A . 39 CYS SG 1 1 14 8641 1 1 40 PRO C C 5.255 -0.617 7.706 1.00 . A A . 40 PRO C 1 1 14 8642 1 1 40 PRO CA C 3.759 -0.379 7.878 1.00 . A A . 40 PRO CA 1 1 14 8643 1 1 40 PRO CB C 3.110 -1.559 8.604 1.00 . A A . 40 PRO CB 1 1 14 8644 1 1 40 PRO CD C 1.896 -1.254 6.569 1.00 . A A . 40 PRO CD 1 1 14 8645 1 1 40 PRO CG C 1.751 -1.670 8.007 1.00 . A A . 40 PRO CG 1 1 14 8646 1 1 40 PRO HA H 3.603 0.527 8.445 1.00 . A A . 40 PRO HA 1 1 14 8647 1 1 40 PRO HB2 H 3.692 -2.453 8.435 1.00 . A A . 40 PRO HB2 1 1 14 8648 1 1 40 PRO HB3 H 3.059 -1.350 9.662 1.00 . A A . 40 PRO HB3 1 1 14 8649 1 1 40 PRO HD2 H 2.099 -2.113 5.947 1.00 . A A . 40 PRO HD2 1 1 14 8650 1 1 40 PRO HD3 H 1.006 -0.744 6.232 1.00 . A A . 40 PRO HD3 1 1 14 8651 1 1 40 PRO HG2 H 1.405 -2.692 8.069 1.00 . A A . 40 PRO HG2 1 1 14 8652 1 1 40 PRO HG3 H 1.068 -1.010 8.521 1.00 . A A . 40 PRO HG3 1 1 14 8653 1 1 40 PRO N N 3.051 -0.336 6.594 1.00 . A A . 40 PRO N 1 1 14 8654 1 1 40 PRO O O 5.742 -0.792 6.589 1.00 . A A . 40 PRO O 1 1 14 8655 1 1 41 SER C C 7.758 -2.297 9.086 1.00 . A A . 41 SER C 1 1 14 8656 1 1 41 SER CA C 7.421 -0.838 8.794 1.00 . A A . 41 SER CA 1 1 14 8657 1 1 41 SER CB C 8.113 0.072 9.811 1.00 . A A . 41 SER CB 1 1 14 8658 1 1 41 SER H H 5.534 -0.476 9.681 1.00 . A A . 41 SER H 1 1 14 8659 1 1 41 SER HA H 7.775 -0.591 7.804 1.00 . A A . 41 SER HA 1 1 14 8660 1 1 41 SER HB2 H 7.860 -0.251 10.810 1.00 . A A . 41 SER HB2 1 1 14 8661 1 1 41 SER HB3 H 9.183 0.013 9.674 1.00 . A A . 41 SER HB3 1 1 14 8662 1 1 41 SER HG H 6.788 1.510 9.919 1.00 . A A . 41 SER HG 1 1 14 8663 1 1 41 SER N N 5.979 -0.621 8.820 1.00 . A A . 41 SER N 1 1 14 8664 1 1 41 SER O O 8.722 -2.593 9.792 1.00 . A A . 41 SER O 1 1 14 8665 1 1 41 SER OG O 7.705 1.419 9.651 1.00 . A A . 41 SER OG 1 1 14 8666 1 1 42 TYR C C 7.743 -5.281 7.480 1.00 . A A . 42 TYR C 1 1 14 8667 1 1 42 TYR CA C 7.171 -4.634 8.738 1.00 . A A . 42 TYR CA 1 1 14 8668 1 1 42 TYR CB C 5.858 -5.317 9.125 1.00 . A A . 42 TYR CB 1 1 14 8669 1 1 42 TYR CD1 C 6.375 -5.476 11.591 1.00 . A A . 42 TYR CD1 1 1 14 8670 1 1 42 TYR CD2 C 4.245 -4.626 10.940 1.00 . A A . 42 TYR CD2 1 1 14 8671 1 1 42 TYR CE1 C 6.038 -5.312 12.921 1.00 . A A . 42 TYR CE1 1 1 14 8672 1 1 42 TYR CE2 C 3.901 -4.459 12.268 1.00 . A A . 42 TYR CE2 1 1 14 8673 1 1 42 TYR CG C 5.485 -5.136 10.579 1.00 . A A . 42 TYR CG 1 1 14 8674 1 1 42 TYR CZ C 4.801 -4.804 13.255 1.00 . A A . 42 TYR CZ 1 1 14 8675 1 1 42 TYR H H 6.205 -2.908 7.984 1.00 . A A . 42 TYR H 1 1 14 8676 1 1 42 TYR HA H 7.879 -4.752 9.544 1.00 . A A . 42 TYR HA 1 1 14 8677 1 1 42 TYR HB2 H 5.058 -4.909 8.525 1.00 . A A . 42 TYR HB2 1 1 14 8678 1 1 42 TYR HB3 H 5.942 -6.377 8.932 1.00 . A A . 42 TYR HB3 1 1 14 8679 1 1 42 TYR HD1 H 7.344 -5.873 11.327 1.00 . A A . 42 TYR HD1 1 1 14 8680 1 1 42 TYR HD2 H 3.542 -4.358 10.165 1.00 . A A . 42 TYR HD2 1 1 14 8681 1 1 42 TYR HE1 H 6.743 -5.582 13.694 1.00 . A A . 42 TYR HE1 1 1 14 8682 1 1 42 TYR HE2 H 2.931 -4.061 12.529 1.00 . A A . 42 TYR HE2 1 1 14 8683 1 1 42 TYR HH H 3.976 -3.818 14.685 1.00 . A A . 42 TYR HH 1 1 14 8684 1 1 42 TYR N N 6.957 -3.205 8.537 1.00 . A A . 42 TYR N 1 1 14 8685 1 1 42 TYR O O 7.000 -5.786 6.639 1.00 . A A . 42 TYR O 1 1 14 8686 1 1 42 TYR OH O 4.462 -4.639 14.578 1.00 . A A . 42 TYR OH 1 1 14 8687 1 1 43 PRO C C 9.655 -7.387 6.159 1.00 . A A . 43 PRO C 1 1 14 8688 1 1 43 PRO CA C 9.750 -5.865 6.172 1.00 . A A . 43 PRO CA 1 1 14 8689 1 1 43 PRO CB C 11.206 -5.422 6.336 1.00 . A A . 43 PRO CB 1 1 14 8690 1 1 43 PRO CD C 10.040 -4.694 8.292 1.00 . A A . 43 PRO CD 1 1 14 8691 1 1 43 PRO CG C 11.370 -5.196 7.799 1.00 . A A . 43 PRO CG 1 1 14 8692 1 1 43 PRO HA H 9.354 -5.473 5.246 1.00 . A A . 43 PRO HA 1 1 14 8693 1 1 43 PRO HB2 H 11.864 -6.201 5.980 1.00 . A A . 43 PRO HB2 1 1 14 8694 1 1 43 PRO HB3 H 11.375 -4.515 5.776 1.00 . A A . 43 PRO HB3 1 1 14 8695 1 1 43 PRO HD2 H 9.850 -5.050 9.293 1.00 . A A . 43 PRO HD2 1 1 14 8696 1 1 43 PRO HD3 H 10.009 -3.615 8.261 1.00 . A A . 43 PRO HD3 1 1 14 8697 1 1 43 PRO HG2 H 11.625 -6.124 8.288 1.00 . A A . 43 PRO HG2 1 1 14 8698 1 1 43 PRO HG3 H 12.137 -4.456 7.973 1.00 . A A . 43 PRO HG3 1 1 14 8699 1 1 43 PRO N N 9.080 -5.275 7.335 1.00 . A A . 43 PRO N 1 1 14 8700 1 1 43 PRO O O 10.223 -8.062 7.017 1.00 . A A . 43 PRO O 1 1 14 8701 1 1 44 GLY C C 9.852 -9.999 4.219 1.00 . A A . 44 GLY C 1 1 14 8702 1 1 44 GLY CA C 8.776 -9.360 5.073 1.00 . A A . 44 GLY CA 1 1 14 8703 1 1 44 GLY H H 8.502 -7.333 4.524 1.00 . A A . 44 GLY H 1 1 14 8704 1 1 44 GLY HA2 H 7.811 -9.574 4.638 1.00 . A A . 44 GLY HA2 1 1 14 8705 1 1 44 GLY HA3 H 8.815 -9.789 6.064 1.00 . A A . 44 GLY HA3 1 1 14 8706 1 1 44 GLY N N 8.932 -7.921 5.180 1.00 . A A . 44 GLY N 1 1 14 8707 1 1 44 GLY O O 10.648 -9.253 3.610 1.00 . A A . 44 GLY O 1 1 14 8708 1 1 44 GLY OXT O 9.900 -11.246 4.158 1.00 . A A . 44 GLY OXT 1 1 15 8709 1 1 1 ALA C C -11.779 17.648 2.338 1.00 . A A . 1 ALA C 1 1 15 8710 1 1 1 ALA CA C -12.470 18.005 3.650 1.00 . A A . 1 ALA CA 1 1 15 8711 1 1 1 ALA CB C -13.741 18.795 3.379 1.00 . A A . 1 ALA CB 1 1 15 8712 1 1 1 ALA H1 H -10.673 18.248 4.622 1.00 . A A . 1 ALA H1 1 1 15 8713 1 1 1 ALA H2 H -11.405 19.708 4.095 1.00 . A A . 1 ALA H2 1 1 15 8714 1 1 1 ALA H3 H -12.029 18.876 5.461 1.00 . A A . 1 ALA H3 1 1 15 8715 1 1 1 ALA HA H -12.744 17.092 4.159 1.00 . A A . 1 ALA HA 1 1 15 8716 1 1 1 ALA HB1 H -14.365 18.247 2.688 1.00 . A A . 1 ALA HB1 1 1 15 8717 1 1 1 ALA HB2 H -13.485 19.753 2.950 1.00 . A A . 1 ALA HB2 1 1 15 8718 1 1 1 ALA HB3 H -14.276 18.946 4.305 1.00 . A A . 1 ALA HB3 1 1 15 8719 1 1 1 ALA N N -11.562 18.779 4.537 1.00 . A A . 1 ALA N 1 1 15 8720 1 1 1 ALA O O -11.614 18.496 1.461 1.00 . A A . 1 ALA O 1 1 15 8721 1 1 2 MET C C -11.129 14.493 0.666 1.00 . A A . 2 MET C 1 1 15 8722 1 1 2 MET CA C -10.705 15.918 1.005 1.00 . A A . 2 MET CA 1 1 15 8723 1 1 2 MET CB C -9.187 15.981 1.186 1.00 . A A . 2 MET CB 1 1 15 8724 1 1 2 MET CE C -7.463 19.514 2.566 1.00 . A A . 2 MET CE 1 1 15 8725 1 1 2 MET CG C -8.637 17.398 1.215 1.00 . A A . 2 MET CG 1 1 15 8726 1 1 2 MET H H -11.538 15.758 2.945 1.00 . A A . 2 MET H 1 1 15 8727 1 1 2 MET HA H -10.989 16.569 0.192 1.00 . A A . 2 MET HA 1 1 15 8728 1 1 2 MET HB2 H -8.926 15.497 2.115 1.00 . A A . 2 MET HB2 1 1 15 8729 1 1 2 MET HB3 H -8.717 15.453 0.370 1.00 . A A . 2 MET HB3 1 1 15 8730 1 1 2 MET HE1 H -7.972 20.082 1.802 1.00 . A A . 2 MET HE1 1 1 15 8731 1 1 2 MET HE2 H -7.403 20.101 3.471 1.00 . A A . 2 MET HE2 1 1 15 8732 1 1 2 MET HE3 H -6.467 19.269 2.229 1.00 . A A . 2 MET HE3 1 1 15 8733 1 1 2 MET HG2 H -7.694 17.415 0.688 1.00 . A A . 2 MET HG2 1 1 15 8734 1 1 2 MET HG3 H -9.337 18.052 0.717 1.00 . A A . 2 MET HG3 1 1 15 8735 1 1 2 MET N N -11.378 16.387 2.211 1.00 . A A . 2 MET N 1 1 15 8736 1 1 2 MET O O -11.496 14.198 -0.472 1.00 . A A . 2 MET O 1 1 15 8737 1 1 2 MET SD S -8.370 18.005 2.892 1.00 . A A . 2 MET SD 1 1 15 8738 1 1 3 ASP C C -10.571 11.555 0.412 1.00 . A A . 3 ASP C 1 1 15 8739 1 1 3 ASP CA C -11.454 12.217 1.465 1.00 . A A . 3 ASP CA 1 1 15 8740 1 1 3 ASP CB C -12.923 12.119 1.051 1.00 . A A . 3 ASP CB 1 1 15 8741 1 1 3 ASP CG C -13.833 12.935 1.948 1.00 . A A . 3 ASP CG 1 1 15 8742 1 1 3 ASP H H -10.774 13.907 2.544 1.00 . A A . 3 ASP H 1 1 15 8743 1 1 3 ASP HA H -11.319 11.704 2.406 1.00 . A A . 3 ASP HA 1 1 15 8744 1 1 3 ASP HB2 H -13.030 12.478 0.039 1.00 . A A . 3 ASP HB2 1 1 15 8745 1 1 3 ASP HB3 H -13.235 11.085 1.097 1.00 . A A . 3 ASP HB3 1 1 15 8746 1 1 3 ASP N N -11.075 13.612 1.659 1.00 . A A . 3 ASP N 1 1 15 8747 1 1 3 ASP O O -9.617 12.157 -0.080 1.00 . A A . 3 ASP O 1 1 15 8748 1 1 3 ASP OD1 O -14.083 12.502 3.092 1.00 . A A . 3 ASP OD1 1 1 15 8749 1 1 3 ASP OD2 O -14.294 14.009 1.506 1.00 . A A . 3 ASP OD2 1 1 15 8750 1 1 4 CYS C C -8.689 9.373 -0.469 1.00 . A A . 4 CYS C 1 1 15 8751 1 1 4 CYS CA C -10.133 9.567 -0.924 1.00 . A A . 4 CYS CA 1 1 15 8752 1 1 4 CYS CB C -10.165 10.294 -2.270 1.00 . A A . 4 CYS CB 1 1 15 8753 1 1 4 CYS H H -11.668 9.886 0.499 1.00 . A A . 4 CYS H 1 1 15 8754 1 1 4 CYS HA H -10.595 8.598 -1.037 1.00 . A A . 4 CYS HA 1 1 15 8755 1 1 4 CYS HB2 H -10.233 11.357 -2.096 1.00 . A A . 4 CYS HB2 1 1 15 8756 1 1 4 CYS HB3 H -9.252 10.080 -2.808 1.00 . A A . 4 CYS HB3 1 1 15 8757 1 1 4 CYS N N -10.896 10.312 0.072 1.00 . A A . 4 CYS N 1 1 15 8758 1 1 4 CYS O O -7.938 10.337 -0.326 1.00 . A A . 4 CYS O 1 1 15 8759 1 1 4 CYS SG S -11.563 9.817 -3.338 1.00 . A A . 4 CYS SG 1 1 15 8760 1 1 5 THR C C -5.919 8.328 -0.785 1.00 . A A . 5 THR C 1 1 15 8761 1 1 5 THR CA C -6.956 7.794 0.198 1.00 . A A . 5 THR CA 1 1 15 8762 1 1 5 THR CB C -6.797 6.281 0.352 1.00 . A A . 5 THR CB 1 1 15 8763 1 1 5 THR CG2 C -7.658 5.697 1.451 1.00 . A A . 5 THR CG2 1 1 15 8764 1 1 5 THR H H -8.955 7.393 -0.373 1.00 . A A . 5 THR H 1 1 15 8765 1 1 5 THR HA H -6.798 8.262 1.158 1.00 . A A . 5 THR HA 1 1 15 8766 1 1 5 THR HB H -5.765 6.060 0.588 1.00 . A A . 5 THR HB 1 1 15 8767 1 1 5 THR HG1 H -8.074 5.689 -1.010 1.00 . A A . 5 THR HG1 1 1 15 8768 1 1 5 THR HG21 H -8.350 6.448 1.803 1.00 . A A . 5 THR HG21 1 1 15 8769 1 1 5 THR HG22 H -8.210 4.852 1.066 1.00 . A A . 5 THR HG22 1 1 15 8770 1 1 5 THR HG23 H -7.030 5.375 2.268 1.00 . A A . 5 THR HG23 1 1 15 8771 1 1 5 THR N N -8.309 8.119 -0.242 1.00 . A A . 5 THR N 1 1 15 8772 1 1 5 THR O O -6.262 8.831 -1.854 1.00 . A A . 5 THR O 1 1 15 8773 1 1 5 THR OG1 O -7.129 5.616 -0.854 1.00 . A A . 5 THR OG1 1 1 15 8774 1 1 6 THR C C -2.266 7.937 -0.954 1.00 . A A . 6 THR C 1 1 15 8775 1 1 6 THR CA C -3.559 8.686 -1.261 1.00 . A A . 6 THR CA 1 1 15 8776 1 1 6 THR CB C -3.348 10.189 -1.069 1.00 . A A . 6 THR CB 1 1 15 8777 1 1 6 THR CG2 C -4.359 11.035 -1.813 1.00 . A A . 6 THR CG2 1 1 15 8778 1 1 6 THR H H -4.437 7.806 0.452 1.00 . A A . 6 THR H 1 1 15 8779 1 1 6 THR HA H -3.834 8.499 -2.288 1.00 . A A . 6 THR HA 1 1 15 8780 1 1 6 THR HB H -2.365 10.453 -1.431 1.00 . A A . 6 THR HB 1 1 15 8781 1 1 6 THR HG1 H -3.183 11.457 0.415 1.00 . A A . 6 THR HG1 1 1 15 8782 1 1 6 THR HG21 H -4.571 10.583 -2.771 1.00 . A A . 6 THR HG21 1 1 15 8783 1 1 6 THR HG22 H -5.270 11.098 -1.236 1.00 . A A . 6 THR HG22 1 1 15 8784 1 1 6 THR HG23 H -3.958 12.026 -1.962 1.00 . A A . 6 THR HG23 1 1 15 8785 1 1 6 THR N N -4.648 8.215 -0.413 1.00 . A A . 6 THR N 1 1 15 8786 1 1 6 THR O O -1.826 7.882 0.194 1.00 . A A . 6 THR O 1 1 15 8787 1 1 6 THR OG1 O -3.425 10.534 0.303 1.00 . A A . 6 THR OG1 1 1 15 8788 1 1 7 GLY C C -0.288 5.472 -2.791 1.00 . A A . 7 GLY C 1 1 15 8789 1 1 7 GLY CA C -0.427 6.622 -1.809 1.00 . A A . 7 GLY CA 1 1 15 8790 1 1 7 GLY H H -2.060 7.437 -2.881 1.00 . A A . 7 GLY H 1 1 15 8791 1 1 7 GLY HA2 H -0.398 6.228 -0.804 1.00 . A A . 7 GLY HA2 1 1 15 8792 1 1 7 GLY HA3 H 0.406 7.297 -1.944 1.00 . A A . 7 GLY HA3 1 1 15 8793 1 1 7 GLY N N -1.663 7.360 -1.989 1.00 . A A . 7 GLY N 1 1 15 8794 1 1 7 GLY O O -1.136 5.296 -3.666 1.00 . A A . 7 GLY O 1 1 15 8795 1 1 8 PRO C C 0.081 2.357 -3.278 1.00 . A A . 8 PRO C 1 1 15 8796 1 1 8 PRO CA C 1.017 3.528 -3.563 1.00 . A A . 8 PRO CA 1 1 15 8797 1 1 8 PRO CB C 2.464 3.140 -3.259 1.00 . A A . 8 PRO CB 1 1 15 8798 1 1 8 PRO CD C 1.844 4.805 -1.656 1.00 . A A . 8 PRO CD 1 1 15 8799 1 1 8 PRO CG C 2.679 3.567 -1.849 1.00 . A A . 8 PRO CG 1 1 15 8800 1 1 8 PRO HA H 0.929 3.814 -4.601 1.00 . A A . 8 PRO HA 1 1 15 8801 1 1 8 PRO HB2 H 2.586 2.073 -3.373 1.00 . A A . 8 PRO HB2 1 1 15 8802 1 1 8 PRO HB3 H 3.129 3.659 -3.934 1.00 . A A . 8 PRO HB3 1 1 15 8803 1 1 8 PRO HD2 H 1.426 4.825 -0.660 1.00 . A A . 8 PRO HD2 1 1 15 8804 1 1 8 PRO HD3 H 2.435 5.690 -1.837 1.00 . A A . 8 PRO HD3 1 1 15 8805 1 1 8 PRO HG2 H 2.355 2.787 -1.176 1.00 . A A . 8 PRO HG2 1 1 15 8806 1 1 8 PRO HG3 H 3.723 3.792 -1.688 1.00 . A A . 8 PRO HG3 1 1 15 8807 1 1 8 PRO N N 0.781 4.666 -2.670 1.00 . A A . 8 PRO N 1 1 15 8808 1 1 8 PRO O O -0.254 1.587 -4.177 1.00 . A A . 8 PRO O 1 1 15 8809 1 1 9 CYS C C -2.689 1.600 -1.671 1.00 . A A . 9 CYS C 1 1 15 8810 1 1 9 CYS CA C -1.231 1.148 -1.623 1.00 . A A . 9 CYS CA 1 1 15 8811 1 1 9 CYS CB C -0.878 0.659 -0.217 1.00 . A A . 9 CYS CB 1 1 15 8812 1 1 9 CYS H H -0.033 2.872 -1.349 1.00 . A A . 9 CYS H 1 1 15 8813 1 1 9 CYS HA H -1.098 0.334 -2.320 1.00 . A A . 9 CYS HA 1 1 15 8814 1 1 9 CYS HB2 H 0.181 0.451 -0.173 1.00 . A A . 9 CYS HB2 1 1 15 8815 1 1 9 CYS HB3 H -1.117 1.434 0.495 1.00 . A A . 9 CYS HB3 1 1 15 8816 1 1 9 CYS N N -0.336 2.228 -2.023 1.00 . A A . 9 CYS N 1 1 15 8817 1 1 9 CYS O O -3.458 1.359 -0.740 1.00 . A A . 9 CYS O 1 1 15 8818 1 1 9 CYS SG S -1.760 -0.852 0.288 1.00 . A A . 9 CYS SG 1 1 15 8819 1 1 10 CYS C C -4.570 3.424 -4.304 1.00 . A A . 10 CYS C 1 1 15 8820 1 1 10 CYS CA C -4.423 2.742 -2.948 1.00 . A A . 10 CYS CA 1 1 15 8821 1 1 10 CYS CB C -4.803 3.710 -1.825 1.00 . A A . 10 CYS CB 1 1 15 8822 1 1 10 CYS H H -2.401 2.413 -3.473 1.00 . A A . 10 CYS H 1 1 15 8823 1 1 10 CYS HA H -5.088 1.891 -2.916 1.00 . A A . 10 CYS HA 1 1 15 8824 1 1 10 CYS HB2 H -5.780 4.121 -2.029 1.00 . A A . 10 CYS HB2 1 1 15 8825 1 1 10 CYS HB3 H -4.835 3.169 -0.890 1.00 . A A . 10 CYS HB3 1 1 15 8826 1 1 10 CYS N N -3.060 2.254 -2.766 1.00 . A A . 10 CYS N 1 1 15 8827 1 1 10 CYS O O -3.582 3.840 -4.909 1.00 . A A . 10 CYS O 1 1 15 8828 1 1 10 CYS SG S -3.651 5.107 -1.618 1.00 . A A . 10 CYS SG 1 1 15 8829 1 1 11 ARG C C -6.376 5.647 -5.903 1.00 . A A . 11 ARG C 1 1 15 8830 1 1 11 ARG CA C -6.075 4.160 -6.068 1.00 . A A . 11 ARG CA 1 1 15 8831 1 1 11 ARG CB C -7.249 3.466 -6.761 1.00 . A A . 11 ARG CB 1 1 15 8832 1 1 11 ARG CD C -8.023 2.331 -8.865 1.00 . A A . 11 ARG CD 1 1 15 8833 1 1 11 ARG CG C -7.101 3.383 -8.271 1.00 . A A . 11 ARG CG 1 1 15 8834 1 1 11 ARG CZ C -6.504 0.654 -9.839 1.00 . A A . 11 ARG CZ 1 1 15 8835 1 1 11 ARG H H -6.554 3.178 -4.253 1.00 . A A . 11 ARG H 1 1 15 8836 1 1 11 ARG HA H -5.193 4.050 -6.680 1.00 . A A . 11 ARG HA 1 1 15 8837 1 1 11 ARG HB2 H -7.337 2.461 -6.374 1.00 . A A . 11 ARG HB2 1 1 15 8838 1 1 11 ARG HB3 H -8.155 4.008 -6.538 1.00 . A A . 11 ARG HB3 1 1 15 8839 1 1 11 ARG HD2 H -8.275 1.616 -8.096 1.00 . A A . 11 ARG HD2 1 1 15 8840 1 1 11 ARG HD3 H -8.924 2.816 -9.212 1.00 . A A . 11 ARG HD3 1 1 15 8841 1 1 11 ARG HE H -7.668 1.890 -10.888 1.00 . A A . 11 ARG HE 1 1 15 8842 1 1 11 ARG HG2 H -7.344 4.344 -8.700 1.00 . A A . 11 ARG HG2 1 1 15 8843 1 1 11 ARG HG3 H -6.078 3.129 -8.510 1.00 . A A . 11 ARG HG3 1 1 15 8844 1 1 11 ARG HH11 H -6.504 0.710 -7.817 1.00 . A A . 11 ARG HH11 1 1 15 8845 1 1 11 ARG HH12 H -5.444 -0.461 -8.527 1.00 . A A . 11 ARG HH12 1 1 15 8846 1 1 11 ARG HH21 H -6.274 0.350 -11.824 1.00 . A A . 11 ARG HH21 1 1 15 8847 1 1 11 ARG HH22 H -5.313 -0.665 -10.801 1.00 . A A . 11 ARG HH22 1 1 15 8848 1 1 11 ARG N N -5.806 3.532 -4.779 1.00 . A A . 11 ARG N 1 1 15 8849 1 1 11 ARG NE N -7.402 1.626 -9.983 1.00 . A A . 11 ARG NE 1 1 15 8850 1 1 11 ARG NH1 N -6.119 0.270 -8.628 1.00 . A A . 11 ARG NH1 1 1 15 8851 1 1 11 ARG NH2 N -5.988 0.065 -10.909 1.00 . A A . 11 ARG NH2 1 1 15 8852 1 1 11 ARG O O -7.196 6.207 -6.631 1.00 . A A . 11 ARG O 1 1 15 8853 1 1 12 GLN C C -7.331 8.000 -4.234 1.00 . A A . 12 GLN C 1 1 15 8854 1 1 12 GLN CA C -5.903 7.706 -4.686 1.00 . A A . 12 GLN CA 1 1 15 8855 1 1 12 GLN CB C -5.586 8.514 -5.941 1.00 . A A . 12 GLN CB 1 1 15 8856 1 1 12 GLN CD C -3.860 9.799 -7.264 1.00 . A A . 12 GLN CD 1 1 15 8857 1 1 12 GLN CG C -4.146 8.997 -6.010 1.00 . A A . 12 GLN CG 1 1 15 8858 1 1 12 GLN H H -5.066 5.784 -4.397 1.00 . A A . 12 GLN H 1 1 15 8859 1 1 12 GLN HA H -5.222 7.997 -3.901 1.00 . A A . 12 GLN HA 1 1 15 8860 1 1 12 GLN HB2 H -5.779 7.898 -6.806 1.00 . A A . 12 GLN HB2 1 1 15 8861 1 1 12 GLN HB3 H -6.235 9.376 -5.973 1.00 . A A . 12 GLN HB3 1 1 15 8862 1 1 12 GLN HE21 H -3.889 8.141 -8.361 1.00 . A A . 12 GLN HE21 1 1 15 8863 1 1 12 GLN HE22 H -3.583 9.606 -9.224 1.00 . A A . 12 GLN HE22 1 1 15 8864 1 1 12 GLN HG2 H -3.947 9.620 -5.150 1.00 . A A . 12 GLN HG2 1 1 15 8865 1 1 12 GLN HG3 H -3.491 8.139 -5.991 1.00 . A A . 12 GLN HG3 1 1 15 8866 1 1 12 GLN N N -5.707 6.282 -4.944 1.00 . A A . 12 GLN N 1 1 15 8867 1 1 12 GLN NE2 N -3.768 9.113 -8.397 1.00 . A A . 12 GLN NE2 1 1 15 8868 1 1 12 GLN O O -7.750 9.157 -4.195 1.00 . A A . 12 GLN O 1 1 15 8869 1 1 12 GLN OE1 O -3.722 11.021 -7.216 1.00 . A A . 12 GLN OE1 1 1 15 8870 1 1 13 CYS C C -9.937 5.908 -2.653 1.00 . A A . 13 CYS C 1 1 15 8871 1 1 13 CYS CA C -9.455 7.118 -3.452 1.00 . A A . 13 CYS CA 1 1 15 8872 1 1 13 CYS CB C -10.374 7.353 -4.652 1.00 . A A . 13 CYS CB 1 1 15 8873 1 1 13 CYS H H -7.692 6.059 -3.947 1.00 . A A . 13 CYS H 1 1 15 8874 1 1 13 CYS HA H -9.491 7.986 -2.813 1.00 . A A . 13 CYS HA 1 1 15 8875 1 1 13 CYS HB2 H -9.931 6.904 -5.529 1.00 . A A . 13 CYS HB2 1 1 15 8876 1 1 13 CYS HB3 H -11.330 6.888 -4.461 1.00 . A A . 13 CYS HB3 1 1 15 8877 1 1 13 CYS N N -8.076 6.954 -3.896 1.00 . A A . 13 CYS N 1 1 15 8878 1 1 13 CYS O O -10.662 6.059 -1.670 1.00 . A A . 13 CYS O 1 1 15 8879 1 1 13 CYS SG S -10.674 9.112 -5.022 1.00 . A A . 13 CYS SG 1 1 15 8880 1 1 14 LYS C C -8.739 2.609 -2.097 1.00 . A A . 14 LYS C 1 1 15 8881 1 1 14 LYS CA C -9.943 3.495 -2.383 1.00 . A A . 14 LYS CA 1 1 15 8882 1 1 14 LYS CB C -10.970 2.727 -3.218 1.00 . A A . 14 LYS CB 1 1 15 8883 1 1 14 LYS CD C -13.159 3.464 -2.229 1.00 . A A . 14 LYS CD 1 1 15 8884 1 1 14 LYS CE C -14.230 2.394 -2.352 1.00 . A A . 14 LYS CE 1 1 15 8885 1 1 14 LYS CG C -12.259 3.496 -3.454 1.00 . A A . 14 LYS CG 1 1 15 8886 1 1 14 LYS H H -8.959 4.639 -3.864 1.00 . A A . 14 LYS H 1 1 15 8887 1 1 14 LYS HA H -10.395 3.781 -1.446 1.00 . A A . 14 LYS HA 1 1 15 8888 1 1 14 LYS HB2 H -10.534 2.493 -4.178 1.00 . A A . 14 LYS HB2 1 1 15 8889 1 1 14 LYS HB3 H -11.213 1.806 -2.709 1.00 . A A . 14 LYS HB3 1 1 15 8890 1 1 14 LYS HD2 H -12.556 3.258 -1.357 1.00 . A A . 14 LYS HD2 1 1 15 8891 1 1 14 LYS HD3 H -13.635 4.428 -2.119 1.00 . A A . 14 LYS HD3 1 1 15 8892 1 1 14 LYS HE2 H -15.071 2.804 -2.890 1.00 . A A . 14 LYS HE2 1 1 15 8893 1 1 14 LYS HE3 H -13.824 1.558 -2.903 1.00 . A A . 14 LYS HE3 1 1 15 8894 1 1 14 LYS HG2 H -12.018 4.523 -3.684 1.00 . A A . 14 LYS HG2 1 1 15 8895 1 1 14 LYS HG3 H -12.784 3.052 -4.287 1.00 . A A . 14 LYS HG3 1 1 15 8896 1 1 14 LYS HZ1 H -13.945 2.048 -0.312 1.00 . A A . 14 LYS HZ1 1 1 15 8897 1 1 14 LYS HZ2 H -15.535 2.451 -0.722 1.00 . A A . 14 LYS HZ2 1 1 15 8898 1 1 14 LYS HZ3 H -14.940 0.907 -1.068 1.00 . A A . 14 LYS HZ3 1 1 15 8899 1 1 14 LYS N N -9.537 4.710 -3.074 1.00 . A A . 14 LYS N 1 1 15 8900 1 1 14 LYS NZ N -14.695 1.917 -1.020 1.00 . A A . 14 LYS NZ 1 1 15 8901 1 1 14 LYS O O -7.955 2.302 -2.996 1.00 . A A . 14 LYS O 1 1 15 8902 1 1 15 LEU C C -7.304 0.199 -1.421 1.00 . A A . 15 LEU C 1 1 15 8903 1 1 15 LEU CA C -7.489 1.343 -0.433 1.00 . A A . 15 LEU CA 1 1 15 8904 1 1 15 LEU CB C -7.734 0.791 0.973 1.00 . A A . 15 LEU CB 1 1 15 8905 1 1 15 LEU CD1 C -7.078 1.911 3.123 1.00 . A A . 15 LEU CD1 1 1 15 8906 1 1 15 LEU CD2 C -6.043 -0.278 2.487 1.00 . A A . 15 LEU CD2 1 1 15 8907 1 1 15 LEU CG C -6.599 1.041 1.970 1.00 . A A . 15 LEU CG 1 1 15 8908 1 1 15 LEU H H -9.255 2.477 -0.171 1.00 . A A . 15 LEU H 1 1 15 8909 1 1 15 LEU HA H -6.592 1.944 -0.423 1.00 . A A . 15 LEU HA 1 1 15 8910 1 1 15 LEU HB2 H -8.636 1.244 1.361 1.00 . A A . 15 LEU HB2 1 1 15 8911 1 1 15 LEU HB3 H -7.891 -0.275 0.898 1.00 . A A . 15 LEU HB3 1 1 15 8912 1 1 15 LEU HD11 H -8.006 2.391 2.852 1.00 . A A . 15 LEU HD11 1 1 15 8913 1 1 15 LEU HD12 H -7.232 1.297 3.998 1.00 . A A . 15 LEU HD12 1 1 15 8914 1 1 15 LEU HD13 H -6.334 2.664 3.338 1.00 . A A . 15 LEU HD13 1 1 15 8915 1 1 15 LEU HD21 H -6.016 -0.997 1.682 1.00 . A A . 15 LEU HD21 1 1 15 8916 1 1 15 LEU HD22 H -5.044 -0.123 2.865 1.00 . A A . 15 LEU HD22 1 1 15 8917 1 1 15 LEU HD23 H -6.676 -0.649 3.279 1.00 . A A . 15 LEU HD23 1 1 15 8918 1 1 15 LEU HG H -5.800 1.567 1.467 1.00 . A A . 15 LEU HG 1 1 15 8919 1 1 15 LEU N N -8.598 2.199 -0.840 1.00 . A A . 15 LEU N 1 1 15 8920 1 1 15 LEU O O -8.260 -0.495 -1.769 1.00 . A A . 15 LEU O 1 1 15 8921 1 1 16 LYS C C -6.198 -2.406 -2.286 1.00 . A A . 16 LYS C 1 1 15 8922 1 1 16 LYS CA C -5.773 -1.044 -2.834 1.00 . A A . 16 LYS CA 1 1 15 8923 1 1 16 LYS CB C -4.279 -1.052 -3.166 1.00 . A A . 16 LYS CB 1 1 15 8924 1 1 16 LYS CD C -2.479 -0.530 -4.839 1.00 . A A . 16 LYS CD 1 1 15 8925 1 1 16 LYS CE C -2.195 -0.041 -6.250 1.00 . A A . 16 LYS CE 1 1 15 8926 1 1 16 LYS CG C -3.943 -0.351 -4.472 1.00 . A A . 16 LYS CG 1 1 15 8927 1 1 16 LYS H H -5.352 0.598 -1.569 1.00 . A A . 16 LYS H 1 1 15 8928 1 1 16 LYS HA H -6.335 -0.835 -3.734 1.00 . A A . 16 LYS HA 1 1 15 8929 1 1 16 LYS HB2 H -3.742 -0.559 -2.369 1.00 . A A . 16 LYS HB2 1 1 15 8930 1 1 16 LYS HB3 H -3.942 -2.076 -3.235 1.00 . A A . 16 LYS HB3 1 1 15 8931 1 1 16 LYS HD2 H -1.873 0.032 -4.146 1.00 . A A . 16 LYS HD2 1 1 15 8932 1 1 16 LYS HD3 H -2.227 -1.578 -4.773 1.00 . A A . 16 LYS HD3 1 1 15 8933 1 1 16 LYS HE2 H -2.406 -0.841 -6.944 1.00 . A A . 16 LYS HE2 1 1 15 8934 1 1 16 LYS HE3 H -2.841 0.799 -6.463 1.00 . A A . 16 LYS HE3 1 1 15 8935 1 1 16 LYS HG2 H -4.555 -0.765 -5.260 1.00 . A A . 16 LYS HG2 1 1 15 8936 1 1 16 LYS HG3 H -4.153 0.703 -4.367 1.00 . A A . 16 LYS HG3 1 1 15 8937 1 1 16 LYS HZ1 H -0.174 -0.112 -5.729 1.00 . A A . 16 LYS HZ1 1 1 15 8938 1 1 16 LYS HZ2 H -0.448 0.158 -7.377 1.00 . A A . 16 LYS HZ2 1 1 15 8939 1 1 16 LYS HZ3 H -0.690 1.407 -6.263 1.00 . A A . 16 LYS HZ3 1 1 15 8940 1 1 16 LYS N N -6.073 0.011 -1.878 1.00 . A A . 16 LYS N 1 1 15 8941 1 1 16 LYS NZ N -0.777 0.383 -6.417 1.00 . A A . 16 LYS NZ 1 1 15 8942 1 1 16 LYS O O -6.482 -2.542 -1.096 1.00 . A A . 16 LYS O 1 1 15 8943 1 1 17 PRO C C -5.655 -5.405 -1.753 1.00 . A A . 17 PRO C 1 1 15 8944 1 1 17 PRO CA C -6.644 -4.787 -2.736 1.00 . A A . 17 PRO CA 1 1 15 8945 1 1 17 PRO CB C -6.657 -5.577 -4.049 1.00 . A A . 17 PRO CB 1 1 15 8946 1 1 17 PRO CD C -5.929 -3.365 -4.584 1.00 . A A . 17 PRO CD 1 1 15 8947 1 1 17 PRO CG C -5.773 -4.809 -4.970 1.00 . A A . 17 PRO CG 1 1 15 8948 1 1 17 PRO HA H -7.632 -4.793 -2.300 1.00 . A A . 17 PRO HA 1 1 15 8949 1 1 17 PRO HB2 H -6.278 -6.573 -3.876 1.00 . A A . 17 PRO HB2 1 1 15 8950 1 1 17 PRO HB3 H -7.667 -5.632 -4.428 1.00 . A A . 17 PRO HB3 1 1 15 8951 1 1 17 PRO HD2 H -5.006 -2.829 -4.749 1.00 . A A . 17 PRO HD2 1 1 15 8952 1 1 17 PRO HD3 H -6.737 -2.911 -5.138 1.00 . A A . 17 PRO HD3 1 1 15 8953 1 1 17 PRO HG2 H -4.748 -5.123 -4.842 1.00 . A A . 17 PRO HG2 1 1 15 8954 1 1 17 PRO HG3 H -6.088 -4.959 -5.992 1.00 . A A . 17 PRO HG3 1 1 15 8955 1 1 17 PRO N N -6.249 -3.435 -3.148 1.00 . A A . 17 PRO N 1 1 15 8956 1 1 17 PRO O O -4.451 -5.438 -2.006 1.00 . A A . 17 PRO O 1 1 15 8957 1 1 18 ALA C C -4.475 -7.626 -0.201 1.00 . A A . 18 ALA C 1 1 15 8958 1 1 18 ALA CA C -5.337 -6.517 0.394 1.00 . A A . 18 ALA CA 1 1 15 8959 1 1 18 ALA CB C -6.202 -7.066 1.518 1.00 . A A . 18 ALA CB 1 1 15 8960 1 1 18 ALA H H -7.141 -5.842 -0.486 1.00 . A A . 18 ALA H 1 1 15 8961 1 1 18 ALA HA H -4.692 -5.753 0.808 1.00 . A A . 18 ALA HA 1 1 15 8962 1 1 18 ALA HB1 H -7.138 -6.527 1.549 1.00 . A A . 18 ALA HB1 1 1 15 8963 1 1 18 ALA HB2 H -6.396 -8.114 1.343 1.00 . A A . 18 ALA HB2 1 1 15 8964 1 1 18 ALA HB3 H -5.687 -6.948 2.460 1.00 . A A . 18 ALA HB3 1 1 15 8965 1 1 18 ALA N N -6.173 -5.896 -0.629 1.00 . A A . 18 ALA N 1 1 15 8966 1 1 18 ALA O O -4.952 -8.734 -0.444 1.00 . A A . 18 ALA O 1 1 15 8967 1 1 19 GLY C C -1.302 -7.680 -1.969 1.00 . A A . 19 GLY C 1 1 15 8968 1 1 19 GLY CA C -2.297 -8.298 -1.004 1.00 . A A . 19 GLY CA 1 1 15 8969 1 1 19 GLY H H -2.880 -6.418 -0.224 1.00 . A A . 19 GLY H 1 1 15 8970 1 1 19 GLY HA2 H -2.874 -9.044 -1.529 1.00 . A A . 19 GLY HA2 1 1 15 8971 1 1 19 GLY HA3 H -1.754 -8.776 -0.202 1.00 . A A . 19 GLY HA3 1 1 15 8972 1 1 19 GLY N N -3.204 -7.318 -0.436 1.00 . A A . 19 GLY N 1 1 15 8973 1 1 19 GLY O O -0.291 -8.296 -2.305 1.00 . A A . 19 GLY O 1 1 15 8974 1 1 20 THR C C 0.695 -5.624 -2.764 1.00 . A A . 20 THR C 1 1 15 8975 1 1 20 THR CA C -0.708 -5.758 -3.344 1.00 . A A . 20 THR CA 1 1 15 8976 1 1 20 THR CB C -1.274 -4.374 -3.670 1.00 . A A . 20 THR CB 1 1 15 8977 1 1 20 THR CG2 C -1.159 -4.011 -5.135 1.00 . A A . 20 THR CG2 1 1 15 8978 1 1 20 THR H H -2.406 -6.017 -2.110 1.00 . A A . 20 THR H 1 1 15 8979 1 1 20 THR HA H -0.653 -6.339 -4.252 1.00 . A A . 20 THR HA 1 1 15 8980 1 1 20 THR HB H -0.732 -3.631 -3.103 1.00 . A A . 20 THR HB 1 1 15 8981 1 1 20 THR HG1 H -3.117 -5.036 -3.697 1.00 . A A . 20 THR HG1 1 1 15 8982 1 1 20 THR HG21 H -1.085 -4.913 -5.725 1.00 . A A . 20 THR HG21 1 1 15 8983 1 1 20 THR HG22 H -2.034 -3.454 -5.437 1.00 . A A . 20 THR HG22 1 1 15 8984 1 1 20 THR HG23 H -0.277 -3.407 -5.289 1.00 . A A . 20 THR HG23 1 1 15 8985 1 1 20 THR N N -1.587 -6.459 -2.414 1.00 . A A . 20 THR N 1 1 15 8986 1 1 20 THR O O 0.939 -5.989 -1.615 1.00 . A A . 20 THR O 1 1 15 8987 1 1 20 THR OG1 O -2.643 -4.294 -3.315 1.00 . A A . 20 THR OG1 1 1 15 8988 1 1 21 THR C C 3.382 -3.446 -3.153 1.00 . A A . 21 THR C 1 1 15 8989 1 1 21 THR CA C 2.992 -4.920 -3.130 1.00 . A A . 21 THR CA 1 1 15 8990 1 1 21 THR CB C 3.943 -5.729 -4.016 1.00 . A A . 21 THR CB 1 1 15 8991 1 1 21 THR CG2 C 4.663 -6.828 -3.266 1.00 . A A . 21 THR CG2 1 1 15 8992 1 1 21 THR H H 1.356 -4.831 -4.473 1.00 . A A . 21 THR H 1 1 15 8993 1 1 21 THR HA H 3.066 -5.282 -2.115 1.00 . A A . 21 THR HA 1 1 15 8994 1 1 21 THR HB H 4.691 -5.066 -4.428 1.00 . A A . 21 THR HB 1 1 15 8995 1 1 21 THR HG1 H 3.079 -5.676 -5.773 1.00 . A A . 21 THR HG1 1 1 15 8996 1 1 21 THR HG21 H 3.951 -7.390 -2.680 1.00 . A A . 21 THR HG21 1 1 15 8997 1 1 21 THR HG22 H 5.149 -7.487 -3.971 1.00 . A A . 21 THR HG22 1 1 15 8998 1 1 21 THR HG23 H 5.404 -6.392 -2.612 1.00 . A A . 21 THR HG23 1 1 15 8999 1 1 21 THR N N 1.612 -5.101 -3.566 1.00 . A A . 21 THR N 1 1 15 9000 1 1 21 THR O O 2.918 -2.683 -4.000 1.00 . A A . 21 THR O 1 1 15 9001 1 1 21 THR OG1 O 3.243 -6.331 -5.091 1.00 . A A . 21 THR OG1 1 1 15 9002 1 1 22 CYS C C 6.112 -1.526 -2.662 1.00 . A A . 22 CYS C 1 1 15 9003 1 1 22 CYS CA C 4.691 -1.669 -2.126 1.00 . A A . 22 CYS CA 1 1 15 9004 1 1 22 CYS CB C 4.628 -1.183 -0.677 1.00 . A A . 22 CYS CB 1 1 15 9005 1 1 22 CYS H H 4.572 -3.707 -1.568 1.00 . A A . 22 CYS H 1 1 15 9006 1 1 22 CYS HA H 4.030 -1.065 -2.728 1.00 . A A . 22 CYS HA 1 1 15 9007 1 1 22 CYS HB2 H 3.734 -1.570 -0.214 1.00 . A A . 22 CYS HB2 1 1 15 9008 1 1 22 CYS HB3 H 5.492 -1.552 -0.144 1.00 . A A . 22 CYS HB3 1 1 15 9009 1 1 22 CYS N N 4.238 -3.052 -2.215 1.00 . A A . 22 CYS N 1 1 15 9010 1 1 22 CYS O O 6.343 -0.847 -3.662 1.00 . A A . 22 CYS O 1 1 15 9011 1 1 22 CYS SG S 4.600 0.630 -0.502 1.00 . A A . 22 CYS SG 1 1 15 9012 1 1 23 TRP C C 9.040 -3.517 -2.548 1.00 . A A . 23 TRP C 1 1 15 9013 1 1 23 TRP CA C 8.459 -2.114 -2.398 1.00 . A A . 23 TRP CA 1 1 15 9014 1 1 23 TRP CB C 9.278 -1.317 -1.381 1.00 . A A . 23 TRP CB 1 1 15 9015 1 1 23 TRP CD1 C 10.431 0.072 -3.199 1.00 . A A . 23 TRP CD1 1 1 15 9016 1 1 23 TRP CD2 C 11.726 -0.386 -1.431 1.00 . A A . 23 TRP CD2 1 1 15 9017 1 1 23 TRP CE2 C 12.473 0.376 -2.349 1.00 . A A . 23 TRP CE2 1 1 15 9018 1 1 23 TRP CE3 C 12.335 -0.790 -0.239 1.00 . A A . 23 TRP CE3 1 1 15 9019 1 1 23 TRP CG C 10.422 -0.569 -1.993 1.00 . A A . 23 TRP CG 1 1 15 9020 1 1 23 TRP CH2 C 14.366 0.331 -0.938 1.00 . A A . 23 TRP CH2 1 1 15 9021 1 1 23 TRP CZ2 C 13.796 0.741 -2.112 1.00 . A A . 23 TRP CZ2 1 1 15 9022 1 1 23 TRP CZ3 C 13.648 -0.428 -0.005 1.00 . A A . 23 TRP CZ3 1 1 15 9023 1 1 23 TRP H H 6.814 -2.696 -1.200 1.00 . A A . 23 TRP H 1 1 15 9024 1 1 23 TRP HA H 8.506 -1.615 -3.354 1.00 . A A . 23 TRP HA 1 1 15 9025 1 1 23 TRP HB2 H 8.634 -0.600 -0.894 1.00 . A A . 23 TRP HB2 1 1 15 9026 1 1 23 TRP HB3 H 9.678 -1.995 -0.641 1.00 . A A . 23 TRP HB3 1 1 15 9027 1 1 23 TRP HD1 H 9.587 0.114 -3.871 1.00 . A A . 23 TRP HD1 1 1 15 9028 1 1 23 TRP HE1 H 11.915 1.158 -4.214 1.00 . A A . 23 TRP HE1 1 1 15 9029 1 1 23 TRP HE3 H 11.797 -1.376 0.492 1.00 . A A . 23 TRP HE3 1 1 15 9030 1 1 23 TRP HH2 H 15.390 0.590 -0.714 1.00 . A A . 23 TRP HH2 1 1 15 9031 1 1 23 TRP HZ2 H 14.363 1.326 -2.821 1.00 . A A . 23 TRP HZ2 1 1 15 9032 1 1 23 TRP HZ3 H 14.135 -0.732 0.909 1.00 . A A . 23 TRP HZ3 1 1 15 9033 1 1 23 TRP N N 7.060 -2.170 -1.990 1.00 . A A . 23 TRP N 1 1 15 9034 1 1 23 TRP NE1 N 11.661 0.643 -3.420 1.00 . A A . 23 TRP NE1 1 1 15 9035 1 1 23 TRP O O 8.680 -4.431 -1.805 1.00 . A A . 23 TRP O 1 1 15 9036 1 1 24 ARG C C 11.613 -4.863 -4.868 1.00 . A A . 24 ARG C 1 1 15 9037 1 1 24 ARG CA C 10.570 -4.971 -3.760 1.00 . A A . 24 ARG CA 1 1 15 9038 1 1 24 ARG CB C 9.516 -6.014 -4.136 1.00 . A A . 24 ARG CB 1 1 15 9039 1 1 24 ARG CD C 8.958 -6.209 -6.580 1.00 . A A . 24 ARG CD 1 1 15 9040 1 1 24 ARG CG C 8.587 -5.566 -5.253 1.00 . A A . 24 ARG CG 1 1 15 9041 1 1 24 ARG CZ C 7.745 -4.752 -8.155 1.00 . A A . 24 ARG CZ 1 1 15 9042 1 1 24 ARG H H 10.184 -2.913 -4.072 1.00 . A A . 24 ARG H 1 1 15 9043 1 1 24 ARG HA H 11.061 -5.280 -2.849 1.00 . A A . 24 ARG HA 1 1 15 9044 1 1 24 ARG HB2 H 10.016 -6.917 -4.452 1.00 . A A . 24 ARG HB2 1 1 15 9045 1 1 24 ARG HB3 H 8.916 -6.232 -3.264 1.00 . A A . 24 ARG HB3 1 1 15 9046 1 1 24 ARG HD2 H 9.966 -6.590 -6.513 1.00 . A A . 24 ARG HD2 1 1 15 9047 1 1 24 ARG HD3 H 8.277 -7.026 -6.772 1.00 . A A . 24 ARG HD3 1 1 15 9048 1 1 24 ARG HE H 9.727 -4.987 -8.107 1.00 . A A . 24 ARG HE 1 1 15 9049 1 1 24 ARG HG2 H 7.575 -5.844 -5.001 1.00 . A A . 24 ARG HG2 1 1 15 9050 1 1 24 ARG HG3 H 8.653 -4.492 -5.353 1.00 . A A . 24 ARG HG3 1 1 15 9051 1 1 24 ARG HH11 H 6.561 -5.745 -6.850 1.00 . A A . 24 ARG HH11 1 1 15 9052 1 1 24 ARG HH12 H 5.733 -4.714 -7.967 1.00 . A A . 24 ARG HH12 1 1 15 9053 1 1 24 ARG HH21 H 8.639 -3.630 -9.578 1.00 . A A . 24 ARG HH21 1 1 15 9054 1 1 24 ARG HH22 H 6.912 -3.513 -9.517 1.00 . A A . 24 ARG HH22 1 1 15 9055 1 1 24 ARG N N 9.939 -3.680 -3.513 1.00 . A A . 24 ARG N 1 1 15 9056 1 1 24 ARG NE N 8.884 -5.260 -7.689 1.00 . A A . 24 ARG NE 1 1 15 9057 1 1 24 ARG NH1 N 6.584 -5.099 -7.613 1.00 . A A . 24 ARG NH1 1 1 15 9058 1 1 24 ARG NH2 N 7.767 -3.895 -9.166 1.00 . A A . 24 ARG NH2 1 1 15 9059 1 1 24 ARG O O 11.274 -4.827 -6.051 1.00 . A A . 24 ARG O 1 1 15 9060 1 1 25 THR C C 14.808 -5.985 -5.454 1.00 . A A . 25 THR C 1 1 15 9061 1 1 25 THR CA C 13.974 -4.708 -5.437 1.00 . A A . 25 THR CA 1 1 15 9062 1 1 25 THR CB C 14.863 -3.510 -5.102 1.00 . A A . 25 THR CB 1 1 15 9063 1 1 25 THR CG2 C 14.190 -2.177 -5.349 1.00 . A A . 25 THR CG2 1 1 15 9064 1 1 25 THR H H 13.089 -4.845 -3.519 1.00 . A A . 25 THR H 1 1 15 9065 1 1 25 THR HA H 13.543 -4.562 -6.415 1.00 . A A . 25 THR HA 1 1 15 9066 1 1 25 THR HB H 15.751 -3.550 -5.717 1.00 . A A . 25 THR HB 1 1 15 9067 1 1 25 THR HG1 H 15.690 -4.383 -3.556 1.00 . A A . 25 THR HG1 1 1 15 9068 1 1 25 THR HG21 H 13.148 -2.243 -5.070 1.00 . A A . 25 THR HG21 1 1 15 9069 1 1 25 THR HG22 H 14.673 -1.414 -4.757 1.00 . A A . 25 THR HG22 1 1 15 9070 1 1 25 THR HG23 H 14.267 -1.923 -6.396 1.00 . A A . 25 THR HG23 1 1 15 9071 1 1 25 THR N N 12.882 -4.812 -4.477 1.00 . A A . 25 THR N 1 1 15 9072 1 1 25 THR O O 15.306 -6.400 -6.501 1.00 . A A . 25 THR O 1 1 15 9073 1 1 25 THR OG1 O 15.261 -3.545 -3.743 1.00 . A A . 25 THR OG1 1 1 15 9074 1 1 26 SER C C 15.704 -8.355 -2.734 1.00 . A A . 26 SER C 1 1 15 9075 1 1 26 SER CA C 15.729 -7.835 -4.166 1.00 . A A . 26 SER CA 1 1 15 9076 1 1 26 SER CB C 17.174 -7.602 -4.611 1.00 . A A . 26 SER CB 1 1 15 9077 1 1 26 SER H H 14.534 -6.224 -3.489 1.00 . A A . 26 SER H 1 1 15 9078 1 1 26 SER HA H 15.278 -8.573 -4.811 1.00 . A A . 26 SER HA 1 1 15 9079 1 1 26 SER HB2 H 17.747 -8.503 -4.452 1.00 . A A . 26 SER HB2 1 1 15 9080 1 1 26 SER HB3 H 17.188 -7.347 -5.661 1.00 . A A . 26 SER HB3 1 1 15 9081 1 1 26 SER HG H 18.254 -5.974 -4.475 1.00 . A A . 26 SER HG 1 1 15 9082 1 1 26 SER N N 14.956 -6.604 -4.287 1.00 . A A . 26 SER N 1 1 15 9083 1 1 26 SER O O 15.614 -9.561 -2.501 1.00 . A A . 26 SER O 1 1 15 9084 1 1 26 SER OG O 17.771 -6.547 -3.876 1.00 . A A . 26 SER OG 1 1 15 9085 1 1 27 VAL C C 14.461 -7.382 0.297 1.00 . A A . 27 VAL C 1 1 15 9086 1 1 27 VAL CA C 15.770 -7.800 -0.366 1.00 . A A . 27 VAL CA 1 1 15 9087 1 1 27 VAL CB C 16.951 -7.157 0.390 1.00 . A A . 27 VAL CB 1 1 15 9088 1 1 27 VAL CG1 C 16.856 -5.639 0.344 1.00 . A A . 27 VAL CG1 1 1 15 9089 1 1 27 VAL CG2 C 17.002 -7.653 1.828 1.00 . A A . 27 VAL CG2 1 1 15 9090 1 1 27 VAL H H 15.853 -6.493 -2.028 1.00 . A A . 27 VAL H 1 1 15 9091 1 1 27 VAL HA H 15.869 -8.874 -0.297 1.00 . A A . 27 VAL HA 1 1 15 9092 1 1 27 VAL HB H 17.867 -7.451 -0.100 1.00 . A A . 27 VAL HB 1 1 15 9093 1 1 27 VAL HG11 H 16.749 -5.316 -0.681 1.00 . A A . 27 VAL HG11 1 1 15 9094 1 1 27 VAL HG12 H 15.999 -5.314 0.915 1.00 . A A . 27 VAL HG12 1 1 15 9095 1 1 27 VAL HG13 H 17.753 -5.209 0.765 1.00 . A A . 27 VAL HG13 1 1 15 9096 1 1 27 VAL HG21 H 16.029 -8.025 2.116 1.00 . A A . 27 VAL HG21 1 1 15 9097 1 1 27 VAL HG22 H 17.729 -8.448 1.909 1.00 . A A . 27 VAL HG22 1 1 15 9098 1 1 27 VAL HG23 H 17.284 -6.840 2.481 1.00 . A A . 27 VAL HG23 1 1 15 9099 1 1 27 VAL N N 15.784 -7.438 -1.777 1.00 . A A . 27 VAL N 1 1 15 9100 1 1 27 VAL O O 13.975 -8.048 1.211 1.00 . A A . 27 VAL O 1 1 15 9101 1 1 28 SER C C 11.446 -6.429 -0.302 1.00 . A A . 28 SER C 1 1 15 9102 1 1 28 SER CA C 12.642 -5.767 0.375 1.00 . A A . 28 SER CA 1 1 15 9103 1 1 28 SER CB C 12.564 -4.249 0.204 1.00 . A A . 28 SER CB 1 1 15 9104 1 1 28 SER H H 14.330 -5.787 -0.902 1.00 . A A . 28 SER H 1 1 15 9105 1 1 28 SER HA H 12.620 -6.004 1.428 1.00 . A A . 28 SER HA 1 1 15 9106 1 1 28 SER HB2 H 12.818 -3.990 -0.813 1.00 . A A . 28 SER HB2 1 1 15 9107 1 1 28 SER HB3 H 11.560 -3.916 0.420 1.00 . A A . 28 SER HB3 1 1 15 9108 1 1 28 SER HG H 13.068 -3.523 1.953 1.00 . A A . 28 SER HG 1 1 15 9109 1 1 28 SER N N 13.895 -6.275 -0.171 1.00 . A A . 28 SER N 1 1 15 9110 1 1 28 SER O O 11.555 -6.937 -1.418 1.00 . A A . 28 SER O 1 1 15 9111 1 1 28 SER OG O 13.462 -3.590 1.080 1.00 . A A . 28 SER OG 1 1 15 9112 1 1 29 SER C C 7.889 -6.701 0.732 1.00 . A A . 29 SER C 1 1 15 9113 1 1 29 SER CA C 9.089 -7.016 -0.157 1.00 . A A . 29 SER CA 1 1 15 9114 1 1 29 SER CB C 9.256 -8.531 -0.290 1.00 . A A . 29 SER CB 1 1 15 9115 1 1 29 SER H H 10.281 -5.996 1.264 1.00 . A A . 29 SER H 1 1 15 9116 1 1 29 SER HA H 8.916 -6.595 -1.136 1.00 . A A . 29 SER HA 1 1 15 9117 1 1 29 SER HB2 H 10.303 -8.765 -0.414 1.00 . A A . 29 SER HB2 1 1 15 9118 1 1 29 SER HB3 H 8.884 -9.012 0.603 1.00 . A A . 29 SER HB3 1 1 15 9119 1 1 29 SER HG H 7.651 -8.669 -1.405 1.00 . A A . 29 SER HG 1 1 15 9120 1 1 29 SER N N 10.305 -6.417 0.379 1.00 . A A . 29 SER N 1 1 15 9121 1 1 29 SER O O 7.449 -7.540 1.518 1.00 . A A . 29 SER O 1 1 15 9122 1 1 29 SER OG O 8.542 -9.027 -1.409 1.00 . A A . 29 SER OG 1 1 15 9123 1 1 30 HIS C C 4.910 -5.400 0.678 1.00 . A A . 30 HIS C 1 1 15 9124 1 1 30 HIS CA C 6.216 -5.062 1.391 1.00 . A A . 30 HIS CA 1 1 15 9125 1 1 30 HIS CB C 6.287 -3.558 1.664 1.00 . A A . 30 HIS CB 1 1 15 9126 1 1 30 HIS CD2 C 8.543 -3.755 2.929 1.00 . A A . 30 HIS CD2 1 1 15 9127 1 1 30 HIS CE1 C 8.335 -2.002 4.229 1.00 . A A . 30 HIS CE1 1 1 15 9128 1 1 30 HIS CG C 7.351 -3.178 2.647 1.00 . A A . 30 HIS CG 1 1 15 9129 1 1 30 HIS H H 7.759 -4.863 -0.044 1.00 . A A . 30 HIS H 1 1 15 9130 1 1 30 HIS HA H 6.246 -5.591 2.331 1.00 . A A . 30 HIS HA 1 1 15 9131 1 1 30 HIS HB2 H 6.490 -3.041 0.739 1.00 . A A . 30 HIS HB2 1 1 15 9132 1 1 30 HIS HB3 H 5.337 -3.226 2.057 1.00 . A A . 30 HIS HB3 1 1 15 9133 1 1 30 HIS HD1 H 6.497 -1.458 3.514 1.00 . A A . 30 HIS HD1 1 1 15 9134 1 1 30 HIS HD2 H 8.953 -4.641 2.464 1.00 . A A . 30 HIS HD2 1 1 15 9135 1 1 30 HIS HE1 H 8.534 -1.246 4.974 1.00 . A A . 30 HIS HE1 1 1 15 9136 1 1 30 HIS HE2 H 9.967 -3.231 4.380 1.00 . A A . 30 HIS HE2 1 1 15 9137 1 1 30 HIS N N 7.365 -5.487 0.600 1.00 . A A . 30 HIS N 1 1 15 9138 1 1 30 HIS ND1 N 7.251 -2.083 3.479 1.00 . A A . 30 HIS ND1 1 1 15 9139 1 1 30 HIS NE2 N 9.135 -3.005 3.915 1.00 . A A . 30 HIS NE2 1 1 15 9140 1 1 30 HIS O O 4.820 -5.315 -0.546 1.00 . A A . 30 HIS O 1 1 15 9141 1 1 31 TYR C C 1.509 -5.216 1.438 1.00 . A A . 31 TYR C 1 1 15 9142 1 1 31 TYR CA C 2.600 -6.134 0.896 1.00 . A A . 31 TYR CA 1 1 15 9143 1 1 31 TYR CB C 2.261 -7.591 1.216 1.00 . A A . 31 TYR CB 1 1 15 9144 1 1 31 TYR CD1 C 3.953 -9.407 0.755 1.00 . A A . 31 TYR CD1 1 1 15 9145 1 1 31 TYR CD2 C 2.540 -8.706 -1.032 1.00 . A A . 31 TYR CD2 1 1 15 9146 1 1 31 TYR CE1 C 4.568 -10.318 -0.083 1.00 . A A . 31 TYR CE1 1 1 15 9147 1 1 31 TYR CE2 C 3.149 -9.615 -1.876 1.00 . A A . 31 TYR CE2 1 1 15 9148 1 1 31 TYR CG C 2.931 -8.586 0.296 1.00 . A A . 31 TYR CG 1 1 15 9149 1 1 31 TYR CZ C 4.162 -10.418 -1.397 1.00 . A A . 31 TYR CZ 1 1 15 9150 1 1 31 TYR H H 4.034 -5.831 2.423 1.00 . A A . 31 TYR H 1 1 15 9151 1 1 31 TYR HA H 2.655 -6.015 -0.176 1.00 . A A . 31 TYR HA 1 1 15 9152 1 1 31 TYR HB2 H 2.573 -7.812 2.226 1.00 . A A . 31 TYR HB2 1 1 15 9153 1 1 31 TYR HB3 H 1.193 -7.731 1.136 1.00 . A A . 31 TYR HB3 1 1 15 9154 1 1 31 TYR HD1 H 4.269 -9.326 1.785 1.00 . A A . 31 TYR HD1 1 1 15 9155 1 1 31 TYR HD2 H 1.747 -8.075 -1.404 1.00 . A A . 31 TYR HD2 1 1 15 9156 1 1 31 TYR HE1 H 5.361 -10.947 0.293 1.00 . A A . 31 TYR HE1 1 1 15 9157 1 1 31 TYR HE2 H 2.831 -9.692 -2.905 1.00 . A A . 31 TYR HE2 1 1 15 9158 1 1 31 TYR HH H 4.102 -11.835 -2.695 1.00 . A A . 31 TYR HH 1 1 15 9159 1 1 31 TYR N N 3.901 -5.783 1.453 1.00 . A A . 31 TYR N 1 1 15 9160 1 1 31 TYR O O 1.698 -4.540 2.449 1.00 . A A . 31 TYR O 1 1 15 9161 1 1 31 TYR OH O 4.772 -11.324 -2.234 1.00 . A A . 31 TYR OH 1 1 15 9162 1 1 32 CYS C C -1.697 -5.142 2.083 1.00 . A A . 32 CYS C 1 1 15 9163 1 1 32 CYS CA C -0.755 -4.366 1.171 1.00 . A A . 32 CYS CA 1 1 15 9164 1 1 32 CYS CB C -1.517 -3.857 -0.053 1.00 . A A . 32 CYS CB 1 1 15 9165 1 1 32 CYS H H 0.274 -5.759 -0.038 1.00 . A A . 32 CYS H 1 1 15 9166 1 1 32 CYS HA H -0.359 -3.522 1.716 1.00 . A A . 32 CYS HA 1 1 15 9167 1 1 32 CYS HB2 H -1.493 -4.614 -0.823 1.00 . A A . 32 CYS HB2 1 1 15 9168 1 1 32 CYS HB3 H -2.543 -3.665 0.225 1.00 . A A . 32 CYS HB3 1 1 15 9169 1 1 32 CYS N N 0.366 -5.198 0.759 1.00 . A A . 32 CYS N 1 1 15 9170 1 1 32 CYS O O -2.212 -6.196 1.710 1.00 . A A . 32 CYS O 1 1 15 9171 1 1 32 CYS SG S -0.839 -2.323 -0.765 1.00 . A A . 32 CYS SG 1 1 15 9172 1 1 33 THR C C -4.267 -4.921 3.962 1.00 . A A . 33 THR C 1 1 15 9173 1 1 33 THR CA C -2.802 -5.250 4.248 1.00 . A A . 33 THR CA 1 1 15 9174 1 1 33 THR CB C -2.442 -4.799 5.662 1.00 . A A . 33 THR CB 1 1 15 9175 1 1 33 THR CG2 C -2.353 -3.294 5.799 1.00 . A A . 33 THR CG2 1 1 15 9176 1 1 33 THR H H -1.480 -3.769 3.516 1.00 . A A . 33 THR H 1 1 15 9177 1 1 33 THR HA H -2.663 -6.318 4.173 1.00 . A A . 33 THR HA 1 1 15 9178 1 1 33 THR HB H -1.480 -5.213 5.928 1.00 . A A . 33 THR HB 1 1 15 9179 1 1 33 THR HG1 H -3.207 -4.897 7.464 1.00 . A A . 33 THR HG1 1 1 15 9180 1 1 33 THR HG21 H -2.790 -2.829 4.927 1.00 . A A . 33 THR HG21 1 1 15 9181 1 1 33 THR HG22 H -2.889 -2.980 6.682 1.00 . A A . 33 THR HG22 1 1 15 9182 1 1 33 THR HG23 H -1.317 -3.001 5.882 1.00 . A A . 33 THR HG23 1 1 15 9183 1 1 33 THR N N -1.919 -4.612 3.279 1.00 . A A . 33 THR N 1 1 15 9184 1 1 33 THR O O -5.157 -5.327 4.709 1.00 . A A . 33 THR O 1 1 15 9185 1 1 33 THR OG1 O -3.401 -5.261 6.597 1.00 . A A . 33 THR OG1 1 1 15 9186 1 1 34 GLY C C -6.602 -3.114 3.668 1.00 . A A . 34 GLY C 1 1 15 9187 1 1 34 GLY CA C -5.875 -3.814 2.533 1.00 . A A . 34 GLY CA 1 1 15 9188 1 1 34 GLY H H -3.769 -3.881 2.320 1.00 . A A . 34 GLY H 1 1 15 9189 1 1 34 GLY HA2 H -6.420 -4.707 2.268 1.00 . A A . 34 GLY HA2 1 1 15 9190 1 1 34 GLY HA3 H -5.849 -3.155 1.677 1.00 . A A . 34 GLY HA3 1 1 15 9191 1 1 34 GLY N N -4.514 -4.181 2.882 1.00 . A A . 34 GLY N 1 1 15 9192 1 1 34 GLY O O -7.832 -3.103 3.710 1.00 . A A . 34 GLY O 1 1 15 9193 1 1 35 ARG C C -6.095 -0.338 5.672 1.00 . A A . 35 ARG C 1 1 15 9194 1 1 35 ARG CA C -6.421 -1.827 5.729 1.00 . A A . 35 ARG CA 1 1 15 9195 1 1 35 ARG CB C -5.907 -2.424 7.040 1.00 . A A . 35 ARG CB 1 1 15 9196 1 1 35 ARG CD C -5.923 -4.577 8.336 1.00 . A A . 35 ARG CD 1 1 15 9197 1 1 35 ARG CG C -6.758 -3.570 7.562 1.00 . A A . 35 ARG CG 1 1 15 9198 1 1 35 ARG CZ C -7.657 -6.070 9.250 1.00 . A A . 35 ARG CZ 1 1 15 9199 1 1 35 ARG H H -4.866 -2.573 4.502 1.00 . A A . 35 ARG H 1 1 15 9200 1 1 35 ARG HA H -7.493 -1.950 5.683 1.00 . A A . 35 ARG HA 1 1 15 9201 1 1 35 ARG HB2 H -4.903 -2.791 6.885 1.00 . A A . 35 ARG HB2 1 1 15 9202 1 1 35 ARG HB3 H -5.886 -1.649 7.791 1.00 . A A . 35 ARG HB3 1 1 15 9203 1 1 35 ARG HD2 H -5.598 -5.352 7.658 1.00 . A A . 35 ARG HD2 1 1 15 9204 1 1 35 ARG HD3 H -5.060 -4.071 8.744 1.00 . A A . 35 ARG HD3 1 1 15 9205 1 1 35 ARG HE H -6.438 -4.928 10.343 1.00 . A A . 35 ARG HE 1 1 15 9206 1 1 35 ARG HG2 H -7.520 -3.172 8.215 1.00 . A A . 35 ARG HG2 1 1 15 9207 1 1 35 ARG HG3 H -7.224 -4.070 6.725 1.00 . A A . 35 ARG HG3 1 1 15 9208 1 1 35 ARG HH11 H -7.533 -6.068 7.232 1.00 . A A . 35 ARG HH11 1 1 15 9209 1 1 35 ARG HH12 H -8.744 -7.109 7.900 1.00 . A A . 35 ARG HH12 1 1 15 9210 1 1 35 ARG HH21 H -8.031 -6.298 11.223 1.00 . A A . 35 ARG HH21 1 1 15 9211 1 1 35 ARG HH22 H -9.027 -7.240 10.166 1.00 . A A . 35 ARG HH22 1 1 15 9212 1 1 35 ARG N N -5.841 -2.530 4.589 1.00 . A A . 35 ARG N 1 1 15 9213 1 1 35 ARG NE N -6.676 -5.188 9.429 1.00 . A A . 35 ARG NE 1 1 15 9214 1 1 35 ARG NH1 N -8.007 -6.446 8.027 1.00 . A A . 35 ARG NH1 1 1 15 9215 1 1 35 ARG NH2 N -8.290 -6.577 10.299 1.00 . A A . 35 ARG NH2 1 1 15 9216 1 1 35 ARG O O -6.911 0.502 6.054 1.00 . A A . 35 ARG O 1 1 15 9217 1 1 36 SER C C -3.492 1.530 3.912 1.00 . A A . 36 SER C 1 1 15 9218 1 1 36 SER CA C -4.460 1.366 5.079 1.00 . A A . 36 SER CA 1 1 15 9219 1 1 36 SER CB C -3.793 1.820 6.379 1.00 . A A . 36 SER CB 1 1 15 9220 1 1 36 SER H H -4.295 -0.735 4.903 1.00 . A A . 36 SER H 1 1 15 9221 1 1 36 SER HA H -5.331 1.977 4.898 1.00 . A A . 36 SER HA 1 1 15 9222 1 1 36 SER HB2 H -3.168 1.025 6.757 1.00 . A A . 36 SER HB2 1 1 15 9223 1 1 36 SER HB3 H -3.187 2.693 6.184 1.00 . A A . 36 SER HB3 1 1 15 9224 1 1 36 SER HG H -4.927 3.091 7.346 1.00 . A A . 36 SER HG 1 1 15 9225 1 1 36 SER N N -4.899 -0.020 5.191 1.00 . A A . 36 SER N 1 1 15 9226 1 1 36 SER O O -2.650 0.666 3.669 1.00 . A A . 36 SER O 1 1 15 9227 1 1 36 SER OG O -4.760 2.146 7.362 1.00 . A A . 36 SER OG 1 1 15 9228 1 1 37 CYS C C -1.320 3.217 2.520 1.00 . A A . 37 CYS C 1 1 15 9229 1 1 37 CYS CA C -2.740 2.907 2.055 1.00 . A A . 37 CYS CA 1 1 15 9230 1 1 37 CYS CB C -3.280 4.069 1.219 1.00 . A A . 37 CYS CB 1 1 15 9231 1 1 37 CYS H H -4.299 3.298 3.434 1.00 . A A . 37 CYS H 1 1 15 9232 1 1 37 CYS HA H -2.718 2.017 1.444 1.00 . A A . 37 CYS HA 1 1 15 9233 1 1 37 CYS HB2 H -4.285 3.837 0.899 1.00 . A A . 37 CYS HB2 1 1 15 9234 1 1 37 CYS HB3 H -3.297 4.963 1.825 1.00 . A A . 37 CYS HB3 1 1 15 9235 1 1 37 CYS N N -3.612 2.642 3.193 1.00 . A A . 37 CYS N 1 1 15 9236 1 1 37 CYS O O -0.366 3.107 1.750 1.00 . A A . 37 CYS O 1 1 15 9237 1 1 37 CYS SG S -2.292 4.426 -0.272 1.00 . A A . 37 CYS SG 1 1 15 9238 1 1 38 GLU C C 0.983 2.671 4.461 1.00 . A A . 38 GLU C 1 1 15 9239 1 1 38 GLU CA C 0.119 3.923 4.351 1.00 . A A . 38 GLU CA 1 1 15 9240 1 1 38 GLU CB C -0.042 4.569 5.729 1.00 . A A . 38 GLU CB 1 1 15 9241 1 1 38 GLU CD C 2.169 5.144 6.805 1.00 . A A . 38 GLU CD 1 1 15 9242 1 1 38 GLU CG C 0.981 5.656 6.015 1.00 . A A . 38 GLU CG 1 1 15 9243 1 1 38 GLU H H -1.982 3.669 4.353 1.00 . A A . 38 GLU H 1 1 15 9244 1 1 38 GLU HA H 0.604 4.624 3.689 1.00 . A A . 38 GLU HA 1 1 15 9245 1 1 38 GLU HB2 H -1.028 5.005 5.795 1.00 . A A . 38 GLU HB2 1 1 15 9246 1 1 38 GLU HB3 H 0.055 3.804 6.485 1.00 . A A . 38 GLU HB3 1 1 15 9247 1 1 38 GLU HG2 H 1.337 6.053 5.076 1.00 . A A . 38 GLU HG2 1 1 15 9248 1 1 38 GLU HG3 H 0.502 6.443 6.579 1.00 . A A . 38 GLU HG3 1 1 15 9249 1 1 38 GLU N N -1.186 3.602 3.786 1.00 . A A . 38 GLU N 1 1 15 9250 1 1 38 GLU O O 0.845 1.890 5.403 1.00 . A A . 38 GLU O 1 1 15 9251 1 1 38 GLU OE1 O 2.048 5.014 8.041 1.00 . A A . 38 GLU OE1 1 1 15 9252 1 1 38 GLU OE2 O 3.221 4.874 6.188 1.00 . A A . 38 GLU OE2 1 1 15 9253 1 1 39 CYS C C 3.543 1.215 4.784 1.00 . A A . 39 CYS C 1 1 15 9254 1 1 39 CYS CA C 2.760 1.326 3.475 1.00 . A A . 39 CYS CA 1 1 15 9255 1 1 39 CYS CB C 3.731 1.420 2.296 1.00 . A A . 39 CYS CB 1 1 15 9256 1 1 39 CYS H H 1.934 3.142 2.766 1.00 . A A . 39 CYS H 1 1 15 9257 1 1 39 CYS HA H 2.150 0.445 3.355 1.00 . A A . 39 CYS HA 1 1 15 9258 1 1 39 CYS HB2 H 4.097 2.433 2.220 1.00 . A A . 39 CYS HB2 1 1 15 9259 1 1 39 CYS HB3 H 4.564 0.755 2.472 1.00 . A A . 39 CYS HB3 1 1 15 9260 1 1 39 CYS N N 1.873 2.485 3.491 1.00 . A A . 39 CYS N 1 1 15 9261 1 1 39 CYS O O 4.448 2.008 5.042 1.00 . A A . 39 CYS O 1 1 15 9262 1 1 39 CYS SG S 2.994 0.976 0.690 1.00 . A A . 39 CYS SG 1 1 15 9263 1 1 40 PRO C C 5.320 -0.469 6.739 1.00 . A A . 40 PRO C 1 1 15 9264 1 1 40 PRO CA C 3.887 0.022 6.915 1.00 . A A . 40 PRO CA 1 1 15 9265 1 1 40 PRO CB C 3.037 -1.047 7.606 1.00 . A A . 40 PRO CB 1 1 15 9266 1 1 40 PRO CD C 2.140 -0.771 5.410 1.00 . A A . 40 PRO CD 1 1 15 9267 1 1 40 PRO CG C 2.379 -1.785 6.493 1.00 . A A . 40 PRO CG 1 1 15 9268 1 1 40 PRO HA H 3.888 0.925 7.509 1.00 . A A . 40 PRO HA 1 1 15 9269 1 1 40 PRO HB2 H 3.674 -1.696 8.190 1.00 . A A . 40 PRO HB2 1 1 15 9270 1 1 40 PRO HB3 H 2.310 -0.573 8.249 1.00 . A A . 40 PRO HB3 1 1 15 9271 1 1 40 PRO HD2 H 2.237 -1.229 4.436 1.00 . A A . 40 PRO HD2 1 1 15 9272 1 1 40 PRO HD3 H 1.164 -0.322 5.522 1.00 . A A . 40 PRO HD3 1 1 15 9273 1 1 40 PRO HG2 H 3.030 -2.569 6.136 1.00 . A A . 40 PRO HG2 1 1 15 9274 1 1 40 PRO HG3 H 1.441 -2.200 6.831 1.00 . A A . 40 PRO HG3 1 1 15 9275 1 1 40 PRO N N 3.206 0.225 5.632 1.00 . A A . 40 PRO N 1 1 15 9276 1 1 40 PRO O O 5.773 -0.701 5.618 1.00 . A A . 40 PRO O 1 1 15 9277 1 1 41 SER C C 7.499 -2.561 8.214 1.00 . A A . 41 SER C 1 1 15 9278 1 1 41 SER CA C 7.410 -1.090 7.821 1.00 . A A . 41 SER CA 1 1 15 9279 1 1 41 SER CB C 8.274 -0.246 8.759 1.00 . A A . 41 SER CB 1 1 15 9280 1 1 41 SER H H 5.611 -0.425 8.716 1.00 . A A . 41 SER H 1 1 15 9281 1 1 41 SER HA H 7.774 -0.977 6.811 1.00 . A A . 41 SER HA 1 1 15 9282 1 1 41 SER HB2 H 7.705 0.006 9.641 1.00 . A A . 41 SER HB2 1 1 15 9283 1 1 41 SER HB3 H 9.150 -0.811 9.044 1.00 . A A . 41 SER HB3 1 1 15 9284 1 1 41 SER HG H 8.139 1.680 8.427 1.00 . A A . 41 SER HG 1 1 15 9285 1 1 41 SER N N 6.028 -0.626 7.852 1.00 . A A . 41 SER N 1 1 15 9286 1 1 41 SER O O 8.439 -2.977 8.891 1.00 . A A . 41 SER O 1 1 15 9287 1 1 41 SER OG O 8.690 0.954 8.128 1.00 . A A . 41 SER OG 1 1 15 9288 1 1 42 TYR C C 6.632 -5.603 6.822 1.00 . A A . 42 TYR C 1 1 15 9289 1 1 42 TYR CA C 6.480 -4.769 8.092 1.00 . A A . 42 TYR CA 1 1 15 9290 1 1 42 TYR CB C 5.172 -5.129 8.799 1.00 . A A . 42 TYR CB 1 1 15 9291 1 1 42 TYR CD1 C 3.776 -3.420 10.026 1.00 . A A . 42 TYR CD1 1 1 15 9292 1 1 42 TYR CD2 C 5.702 -4.297 11.123 1.00 . A A . 42 TYR CD2 1 1 15 9293 1 1 42 TYR CE1 C 3.504 -2.630 11.127 1.00 . A A . 42 TYR CE1 1 1 15 9294 1 1 42 TYR CE2 C 5.437 -3.510 12.228 1.00 . A A . 42 TYR CE2 1 1 15 9295 1 1 42 TYR CG C 4.878 -4.266 10.005 1.00 . A A . 42 TYR CG 1 1 15 9296 1 1 42 TYR CZ C 4.337 -2.679 12.224 1.00 . A A . 42 TYR CZ 1 1 15 9297 1 1 42 TYR H H 5.792 -2.953 7.249 1.00 . A A . 42 TYR H 1 1 15 9298 1 1 42 TYR HA H 7.307 -4.985 8.752 1.00 . A A . 42 TYR HA 1 1 15 9299 1 1 42 TYR HB2 H 4.353 -5.017 8.104 1.00 . A A . 42 TYR HB2 1 1 15 9300 1 1 42 TYR HB3 H 5.221 -6.156 9.128 1.00 . A A . 42 TYR HB3 1 1 15 9301 1 1 42 TYR HD1 H 3.125 -3.385 9.165 1.00 . A A . 42 TYR HD1 1 1 15 9302 1 1 42 TYR HD2 H 6.563 -4.949 11.122 1.00 . A A . 42 TYR HD2 1 1 15 9303 1 1 42 TYR HE1 H 2.642 -1.979 11.124 1.00 . A A . 42 TYR HE1 1 1 15 9304 1 1 42 TYR HE2 H 6.089 -3.548 13.087 1.00 . A A . 42 TYR HE2 1 1 15 9305 1 1 42 TYR HH H 3.218 -2.140 13.693 1.00 . A A . 42 TYR HH 1 1 15 9306 1 1 42 TYR N N 6.513 -3.343 7.785 1.00 . A A . 42 TYR N 1 1 15 9307 1 1 42 TYR O O 5.641 -5.988 6.201 1.00 . A A . 42 TYR O 1 1 15 9308 1 1 42 TYR OH O 4.069 -1.894 13.322 1.00 . A A . 42 TYR OH 1 1 15 9309 1 1 43 PRO C C 7.395 -8.008 5.206 1.00 . A A . 43 PRO C 1 1 15 9310 1 1 43 PRO CA C 8.158 -6.688 5.217 1.00 . A A . 43 PRO CA 1 1 15 9311 1 1 43 PRO CB C 9.665 -6.942 5.297 1.00 . A A . 43 PRO CB 1 1 15 9312 1 1 43 PRO CD C 9.119 -5.475 7.103 1.00 . A A . 43 PRO CD 1 1 15 9313 1 1 43 PRO CG C 10.197 -5.814 6.111 1.00 . A A . 43 PRO CG 1 1 15 9314 1 1 43 PRO HA H 7.930 -6.135 4.318 1.00 . A A . 43 PRO HA 1 1 15 9315 1 1 43 PRO HB2 H 9.847 -7.895 5.774 1.00 . A A . 43 PRO HB2 1 1 15 9316 1 1 43 PRO HB3 H 10.086 -6.944 4.303 1.00 . A A . 43 PRO HB3 1 1 15 9317 1 1 43 PRO HD2 H 9.261 -6.030 8.019 1.00 . A A . 43 PRO HD2 1 1 15 9318 1 1 43 PRO HD3 H 9.108 -4.413 7.300 1.00 . A A . 43 PRO HD3 1 1 15 9319 1 1 43 PRO HG2 H 11.095 -6.124 6.624 1.00 . A A . 43 PRO HG2 1 1 15 9320 1 1 43 PRO HG3 H 10.400 -4.966 5.474 1.00 . A A . 43 PRO HG3 1 1 15 9321 1 1 43 PRO N N 7.881 -5.895 6.419 1.00 . A A . 43 PRO N 1 1 15 9322 1 1 43 PRO O O 7.128 -8.591 6.257 1.00 . A A . 43 PRO O 1 1 15 9323 1 1 44 GLY C C 7.200 -10.935 4.110 1.00 . A A . 44 GLY C 1 1 15 9324 1 1 44 GLY CA C 6.317 -9.723 3.886 1.00 . A A . 44 GLY CA 1 1 15 9325 1 1 44 GLY H H 7.286 -7.967 3.208 1.00 . A A . 44 GLY H 1 1 15 9326 1 1 44 GLY HA2 H 5.891 -9.780 2.896 1.00 . A A . 44 GLY HA2 1 1 15 9327 1 1 44 GLY HA3 H 5.518 -9.734 4.612 1.00 . A A . 44 GLY HA3 1 1 15 9328 1 1 44 GLY N N 7.046 -8.475 4.011 1.00 . A A . 44 GLY N 1 1 15 9329 1 1 44 GLY O O 7.504 -11.239 5.283 1.00 . A A . 44 GLY O 1 1 15 9330 1 1 44 GLY OXT O 7.586 -11.581 3.113 1.00 . A A . 44 GLY OXT 1 1 16 9331 1 1 1 ALA C C -12.415 9.105 0.247 1.00 . A A . 1 ALA C 1 1 16 9332 1 1 1 ALA CA C -11.731 7.786 0.588 1.00 . A A . 1 ALA CA 1 1 16 9333 1 1 1 ALA CB C -12.440 7.110 1.753 1.00 . A A . 1 ALA CB 1 1 16 9334 1 1 1 ALA H1 H -9.892 8.609 0.175 1.00 . A A . 1 ALA H1 1 1 16 9335 1 1 1 ALA H2 H -10.245 8.452 1.845 1.00 . A A . 1 ALA H2 1 1 16 9336 1 1 1 ALA H3 H -9.834 7.065 0.922 1.00 . A A . 1 ALA H3 1 1 16 9337 1 1 1 ALA HA H -11.793 7.129 -0.268 1.00 . A A . 1 ALA HA 1 1 16 9338 1 1 1 ALA HB1 H -12.770 7.860 2.457 1.00 . A A . 1 ALA HB1 1 1 16 9339 1 1 1 ALA HB2 H -13.294 6.561 1.385 1.00 . A A . 1 ALA HB2 1 1 16 9340 1 1 1 ALA HB3 H -11.759 6.430 2.243 1.00 . A A . 1 ALA HB3 1 1 16 9341 1 1 1 ALA N N -10.296 7.997 0.911 1.00 . A A . 1 ALA N 1 1 16 9342 1 1 1 ALA O O -12.912 9.288 -0.864 1.00 . A A . 1 ALA O 1 1 16 9343 1 1 2 MET C C -12.286 12.147 -0.013 1.00 . A A . 2 MET C 1 1 16 9344 1 1 2 MET CA C -13.061 11.324 1.011 1.00 . A A . 2 MET CA 1 1 16 9345 1 1 2 MET CB C -13.141 12.082 2.337 1.00 . A A . 2 MET CB 1 1 16 9346 1 1 2 MET CE C -15.825 14.999 3.647 1.00 . A A . 2 MET CE 1 1 16 9347 1 1 2 MET CG C -14.387 12.942 2.472 1.00 . A A . 2 MET CG 1 1 16 9348 1 1 2 MET H H -12.024 9.815 2.074 1.00 . A A . 2 MET H 1 1 16 9349 1 1 2 MET HA H -14.061 11.159 0.640 1.00 . A A . 2 MET HA 1 1 16 9350 1 1 2 MET HB2 H -13.133 11.368 3.148 1.00 . A A . 2 MET HB2 1 1 16 9351 1 1 2 MET HB3 H -12.276 12.723 2.425 1.00 . A A . 2 MET HB3 1 1 16 9352 1 1 2 MET HE1 H -16.634 14.284 3.683 1.00 . A A . 2 MET HE1 1 1 16 9353 1 1 2 MET HE2 H -15.934 15.707 4.455 1.00 . A A . 2 MET HE2 1 1 16 9354 1 1 2 MET HE3 H -15.849 15.523 2.703 1.00 . A A . 2 MET HE3 1 1 16 9355 1 1 2 MET HG2 H -14.541 13.476 1.546 1.00 . A A . 2 MET HG2 1 1 16 9356 1 1 2 MET HG3 H -15.234 12.298 2.660 1.00 . A A . 2 MET HG3 1 1 16 9357 1 1 2 MET N N -12.437 10.021 1.210 1.00 . A A . 2 MET N 1 1 16 9358 1 1 2 MET O O -12.793 12.450 -1.093 1.00 . A A . 2 MET O 1 1 16 9359 1 1 2 MET SD S -14.262 14.140 3.813 1.00 . A A . 2 MET SD 1 1 16 9360 1 1 3 ASP C C -9.127 12.426 -1.189 1.00 . A A . 3 ASP C 1 1 16 9361 1 1 3 ASP CA C -10.209 13.295 -0.554 1.00 . A A . 3 ASP CA 1 1 16 9362 1 1 3 ASP CB C -9.566 14.451 0.213 1.00 . A A . 3 ASP CB 1 1 16 9363 1 1 3 ASP CG C -8.714 13.973 1.372 1.00 . A A . 3 ASP CG 1 1 16 9364 1 1 3 ASP H H -10.705 12.234 1.209 1.00 . A A . 3 ASP H 1 1 16 9365 1 1 3 ASP HA H -10.835 13.697 -1.336 1.00 . A A . 3 ASP HA 1 1 16 9366 1 1 3 ASP HB2 H -8.939 15.017 -0.460 1.00 . A A . 3 ASP HB2 1 1 16 9367 1 1 3 ASP HB3 H -10.342 15.094 0.600 1.00 . A A . 3 ASP HB3 1 1 16 9368 1 1 3 ASP N N -11.054 12.506 0.334 1.00 . A A . 3 ASP N 1 1 16 9369 1 1 3 ASP O O -8.019 12.893 -1.454 1.00 . A A . 3 ASP O 1 1 16 9370 1 1 3 ASP OD1 O -7.611 14.526 1.566 1.00 . A A . 3 ASP OD1 1 1 16 9371 1 1 3 ASP OD2 O -9.150 13.047 2.087 1.00 . A A . 3 ASP OD2 1 1 16 9372 1 1 4 CYS C C -7.273 10.066 -1.160 1.00 . A A . 4 CYS C 1 1 16 9373 1 1 4 CYS CA C -8.513 10.227 -2.033 1.00 . A A . 4 CYS CA 1 1 16 9374 1 1 4 CYS CB C -8.110 10.707 -3.428 1.00 . A A . 4 CYS CB 1 1 16 9375 1 1 4 CYS H H -10.355 10.849 -1.195 1.00 . A A . 4 CYS H 1 1 16 9376 1 1 4 CYS HA H -9.005 9.270 -2.119 1.00 . A A . 4 CYS HA 1 1 16 9377 1 1 4 CYS HB2 H -7.889 11.763 -3.388 1.00 . A A . 4 CYS HB2 1 1 16 9378 1 1 4 CYS HB3 H -7.226 10.171 -3.743 1.00 . A A . 4 CYS HB3 1 1 16 9379 1 1 4 CYS N N -9.457 11.161 -1.429 1.00 . A A . 4 CYS N 1 1 16 9380 1 1 4 CYS O O -6.471 10.990 -1.025 1.00 . A A . 4 CYS O 1 1 16 9381 1 1 4 CYS SG S -9.391 10.459 -4.701 1.00 . A A . 4 CYS SG 1 1 16 9382 1 1 5 THR C C -4.683 8.578 -0.518 1.00 . A A . 5 THR C 1 1 16 9383 1 1 5 THR CA C -5.977 8.600 0.290 1.00 . A A . 5 THR CA 1 1 16 9384 1 1 5 THR CB C -6.171 7.262 1.004 1.00 . A A . 5 THR CB 1 1 16 9385 1 1 5 THR CG2 C -7.203 7.318 2.109 1.00 . A A . 5 THR CG2 1 1 16 9386 1 1 5 THR H H -7.793 8.187 -0.716 1.00 . A A . 5 THR H 1 1 16 9387 1 1 5 THR HA H -5.913 9.386 1.028 1.00 . A A . 5 THR HA 1 1 16 9388 1 1 5 THR HB H -5.231 6.962 1.444 1.00 . A A . 5 THR HB 1 1 16 9389 1 1 5 THR HG1 H -6.022 6.300 -0.695 1.00 . A A . 5 THR HG1 1 1 16 9390 1 1 5 THR HG21 H -7.495 8.344 2.278 1.00 . A A . 5 THR HG21 1 1 16 9391 1 1 5 THR HG22 H -8.070 6.740 1.822 1.00 . A A . 5 THR HG22 1 1 16 9392 1 1 5 THR HG23 H -6.783 6.909 3.016 1.00 . A A . 5 THR HG23 1 1 16 9393 1 1 5 THR N N -7.121 8.885 -0.570 1.00 . A A . 5 THR N 1 1 16 9394 1 1 5 THR O O -4.366 7.585 -1.173 1.00 . A A . 5 THR O 1 1 16 9395 1 1 5 THR OG1 O -6.575 6.259 0.089 1.00 . A A . 5 THR OG1 1 1 16 9396 1 1 6 THR C C -1.605 8.915 -0.558 1.00 . A A . 6 THR C 1 1 16 9397 1 1 6 THR CA C -2.682 9.787 -1.195 1.00 . A A . 6 THR CA 1 1 16 9398 1 1 6 THR CB C -2.216 11.244 -1.236 1.00 . A A . 6 THR CB 1 1 16 9399 1 1 6 THR CG2 C -3.188 12.164 -1.942 1.00 . A A . 6 THR CG2 1 1 16 9400 1 1 6 THR H H -4.248 10.438 0.071 1.00 . A A . 6 THR H 1 1 16 9401 1 1 6 THR HA H -2.853 9.446 -2.205 1.00 . A A . 6 THR HA 1 1 16 9402 1 1 6 THR HB H -1.272 11.295 -1.760 1.00 . A A . 6 THR HB 1 1 16 9403 1 1 6 THR HG1 H -2.873 11.821 0.516 1.00 . A A . 6 THR HG1 1 1 16 9404 1 1 6 THR HG21 H -4.187 11.759 -1.865 1.00 . A A . 6 THR HG21 1 1 16 9405 1 1 6 THR HG22 H -3.159 13.140 -1.482 1.00 . A A . 6 THR HG22 1 1 16 9406 1 1 6 THR HG23 H -2.913 12.248 -2.983 1.00 . A A . 6 THR HG23 1 1 16 9407 1 1 6 THR N N -3.941 9.679 -0.467 1.00 . A A . 6 THR N 1 1 16 9408 1 1 6 THR O O -1.385 8.968 0.652 1.00 . A A . 6 THR O 1 1 16 9409 1 1 6 THR OG1 O -2.024 11.745 0.075 1.00 . A A . 6 THR OG1 1 1 16 9410 1 1 7 GLY C C 0.308 6.014 -1.753 1.00 . A A . 7 GLY C 1 1 16 9411 1 1 7 GLY CA C 0.109 7.240 -0.881 1.00 . A A . 7 GLY CA 1 1 16 9412 1 1 7 GLY H H -1.156 8.114 -2.336 1.00 . A A . 7 GLY H 1 1 16 9413 1 1 7 GLY HA2 H -0.150 6.920 0.118 1.00 . A A . 7 GLY HA2 1 1 16 9414 1 1 7 GLY HA3 H 1.036 7.794 -0.840 1.00 . A A . 7 GLY HA3 1 1 16 9415 1 1 7 GLY N N -0.937 8.113 -1.381 1.00 . A A . 7 GLY N 1 1 16 9416 1 1 7 GLY O O -0.547 5.692 -2.577 1.00 . A A . 7 GLY O 1 1 16 9417 1 1 8 PRO C C 0.823 2.933 -2.018 1.00 . A A . 8 PRO C 1 1 16 9418 1 1 8 PRO CA C 1.733 4.102 -2.380 1.00 . A A . 8 PRO CA 1 1 16 9419 1 1 8 PRO CB C 3.185 3.784 -2.014 1.00 . A A . 8 PRO CB 1 1 16 9420 1 1 8 PRO CD C 2.513 5.614 -0.632 1.00 . A A . 8 PRO CD 1 1 16 9421 1 1 8 PRO CG C 3.375 4.383 -0.663 1.00 . A A . 8 PRO CG 1 1 16 9422 1 1 8 PRO HA H 1.661 4.297 -3.440 1.00 . A A . 8 PRO HA 1 1 16 9423 1 1 8 PRO HB2 H 3.328 2.713 -1.996 1.00 . A A . 8 PRO HB2 1 1 16 9424 1 1 8 PRO HB3 H 3.849 4.229 -2.739 1.00 . A A . 8 PRO HB3 1 1 16 9425 1 1 8 PRO HD2 H 2.112 5.769 0.359 1.00 . A A . 8 PRO HD2 1 1 16 9426 1 1 8 PRO HD3 H 3.077 6.478 -0.952 1.00 . A A . 8 PRO HD3 1 1 16 9427 1 1 8 PRO HG2 H 3.058 3.683 0.096 1.00 . A A . 8 PRO HG2 1 1 16 9428 1 1 8 PRO HG3 H 4.412 4.648 -0.522 1.00 . A A . 8 PRO HG3 1 1 16 9429 1 1 8 PRO N N 1.438 5.303 -1.592 1.00 . A A . 8 PRO N 1 1 16 9430 1 1 8 PRO O O 0.366 2.196 -2.890 1.00 . A A . 8 PRO O 1 1 16 9431 1 1 9 CYS C C -1.685 1.784 -0.861 1.00 . A A . 9 CYS C 1 1 16 9432 1 1 9 CYS CA C -0.292 1.692 -0.244 1.00 . A A . 9 CYS CA 1 1 16 9433 1 1 9 CYS CB C -0.392 1.735 1.282 1.00 . A A . 9 CYS CB 1 1 16 9434 1 1 9 CYS H H 0.959 3.392 -0.076 1.00 . A A . 9 CYS H 1 1 16 9435 1 1 9 CYS HA H 0.158 0.756 -0.540 1.00 . A A . 9 CYS HA 1 1 16 9436 1 1 9 CYS HB2 H 0.410 2.345 1.670 1.00 . A A . 9 CYS HB2 1 1 16 9437 1 1 9 CYS HB3 H -1.338 2.173 1.562 1.00 . A A . 9 CYS HB3 1 1 16 9438 1 1 9 CYS N N 0.565 2.771 -0.724 1.00 . A A . 9 CYS N 1 1 16 9439 1 1 9 CYS O O -2.384 0.779 -0.993 1.00 . A A . 9 CYS O 1 1 16 9440 1 1 9 CYS SG S -0.279 0.101 2.081 1.00 . A A . 9 CYS SG 1 1 16 9441 1 1 10 CYS C C -3.317 3.130 -3.358 1.00 . A A . 10 CYS C 1 1 16 9442 1 1 10 CYS CA C -3.393 3.215 -1.838 1.00 . A A . 10 CYS CA 1 1 16 9443 1 1 10 CYS CB C -3.946 4.578 -1.420 1.00 . A A . 10 CYS CB 1 1 16 9444 1 1 10 CYS H H -1.484 3.759 -1.106 1.00 . A A . 10 CYS H 1 1 16 9445 1 1 10 CYS HA H -4.057 2.444 -1.479 1.00 . A A . 10 CYS HA 1 1 16 9446 1 1 10 CYS HB2 H -3.307 5.354 -1.814 1.00 . A A . 10 CYS HB2 1 1 16 9447 1 1 10 CYS HB3 H -4.940 4.696 -1.828 1.00 . A A . 10 CYS HB3 1 1 16 9448 1 1 10 CYS N N -2.084 2.995 -1.237 1.00 . A A . 10 CYS N 1 1 16 9449 1 1 10 CYS O O -2.231 3.144 -3.938 1.00 . A A . 10 CYS O 1 1 16 9450 1 1 10 CYS SG S -4.054 4.814 0.383 1.00 . A A . 10 CYS SG 1 1 16 9451 1 1 11 ARG C C -4.755 4.342 -6.061 1.00 . A A . 11 ARG C 1 1 16 9452 1 1 11 ARG CA C -4.548 2.959 -5.451 1.00 . A A . 11 ARG CA 1 1 16 9453 1 1 11 ARG CB C -5.683 2.024 -5.875 1.00 . A A . 11 ARG CB 1 1 16 9454 1 1 11 ARG CD C -6.212 2.224 -8.323 1.00 . A A . 11 ARG CD 1 1 16 9455 1 1 11 ARG CG C -5.489 1.419 -7.255 1.00 . A A . 11 ARG CG 1 1 16 9456 1 1 11 ARG CZ C -7.917 0.675 -9.199 1.00 . A A . 11 ARG CZ 1 1 16 9457 1 1 11 ARG H H -5.309 3.039 -3.479 1.00 . A A . 11 ARG H 1 1 16 9458 1 1 11 ARG HA H -3.611 2.558 -5.805 1.00 . A A . 11 ARG HA 1 1 16 9459 1 1 11 ARG HB2 H -5.756 1.218 -5.159 1.00 . A A . 11 ARG HB2 1 1 16 9460 1 1 11 ARG HB3 H -6.610 2.578 -5.875 1.00 . A A . 11 ARG HB3 1 1 16 9461 1 1 11 ARG HD2 H -7.002 2.791 -7.854 1.00 . A A . 11 ARG HD2 1 1 16 9462 1 1 11 ARG HD3 H -5.508 2.902 -8.783 1.00 . A A . 11 ARG HD3 1 1 16 9463 1 1 11 ARG HE H -6.317 1.307 -10.211 1.00 . A A . 11 ARG HE 1 1 16 9464 1 1 11 ARG HG2 H -4.434 1.401 -7.485 1.00 . A A . 11 ARG HG2 1 1 16 9465 1 1 11 ARG HG3 H -5.876 0.410 -7.253 1.00 . A A . 11 ARG HG3 1 1 16 9466 1 1 11 ARG HH11 H -8.247 1.300 -7.304 1.00 . A A . 11 ARG HH11 1 1 16 9467 1 1 11 ARG HH12 H -9.431 0.211 -7.943 1.00 . A A . 11 ARG HH12 1 1 16 9468 1 1 11 ARG HH21 H -7.873 -0.126 -11.054 1.00 . A A . 11 ARG HH21 1 1 16 9469 1 1 11 ARG HH22 H -9.219 -0.599 -10.072 1.00 . A A . 11 ARG HH22 1 1 16 9470 1 1 11 ARG N N -4.478 3.044 -3.998 1.00 . A A . 11 ARG N 1 1 16 9471 1 1 11 ARG NE N -6.791 1.369 -9.356 1.00 . A A . 11 ARG NE 1 1 16 9472 1 1 11 ARG NH1 N -8.586 0.734 -8.055 1.00 . A A . 11 ARG NH1 1 1 16 9473 1 1 11 ARG NH2 N -8.374 -0.078 -10.190 1.00 . A A . 11 ARG NH2 1 1 16 9474 1 1 11 ARG O O -5.581 4.521 -6.956 1.00 . A A . 11 ARG O 1 1 16 9475 1 1 12 GLN C C -5.328 7.400 -5.520 1.00 . A A . 12 GLN C 1 1 16 9476 1 1 12 GLN CA C -4.084 6.692 -6.055 1.00 . A A . 12 GLN CA 1 1 16 9477 1 1 12 GLN CB C -4.088 6.723 -7.586 1.00 . A A . 12 GLN CB 1 1 16 9478 1 1 12 GLN CD C -2.707 6.175 -9.629 1.00 . A A . 12 GLN CD 1 1 16 9479 1 1 12 GLN CG C -3.087 5.769 -8.219 1.00 . A A . 12 GLN CG 1 1 16 9480 1 1 12 GLN H H -3.357 5.107 -4.855 1.00 . A A . 12 GLN H 1 1 16 9481 1 1 12 GLN HA H -3.210 7.219 -5.701 1.00 . A A . 12 GLN HA 1 1 16 9482 1 1 12 GLN HB2 H -5.075 6.459 -7.937 1.00 . A A . 12 GLN HB2 1 1 16 9483 1 1 12 GLN HB3 H -3.856 7.725 -7.915 1.00 . A A . 12 GLN HB3 1 1 16 9484 1 1 12 GLN HE21 H -0.809 6.395 -9.081 1.00 . A A . 12 GLN HE21 1 1 16 9485 1 1 12 GLN HE22 H -1.154 6.726 -10.741 1.00 . A A . 12 GLN HE22 1 1 16 9486 1 1 12 GLN HG2 H -2.194 5.752 -7.613 1.00 . A A . 12 GLN HG2 1 1 16 9487 1 1 12 GLN HG3 H -3.521 4.780 -8.248 1.00 . A A . 12 GLN HG3 1 1 16 9488 1 1 12 GLN N N -3.995 5.317 -5.567 1.00 . A A . 12 GLN N 1 1 16 9489 1 1 12 GLN NE2 N -1.427 6.460 -9.838 1.00 . A A . 12 GLN NE2 1 1 16 9490 1 1 12 GLN O O -5.595 8.547 -5.879 1.00 . A A . 12 GLN O 1 1 16 9491 1 1 12 GLN OE1 O -3.554 6.230 -10.521 1.00 . A A . 12 GLN OE1 1 1 16 9492 1 1 13 CYS C C -7.962 6.364 -3.093 1.00 . A A . 13 CYS C 1 1 16 9493 1 1 13 CYS CA C -7.295 7.310 -4.088 1.00 . A A . 13 CYS CA 1 1 16 9494 1 1 13 CYS CB C -8.285 7.676 -5.195 1.00 . A A . 13 CYS CB 1 1 16 9495 1 1 13 CYS H H -5.831 5.813 -4.403 1.00 . A A . 13 CYS H 1 1 16 9496 1 1 13 CYS HA H -7.007 8.211 -3.568 1.00 . A A . 13 CYS HA 1 1 16 9497 1 1 13 CYS HB2 H -7.809 8.357 -5.885 1.00 . A A . 13 CYS HB2 1 1 16 9498 1 1 13 CYS HB3 H -8.571 6.779 -5.724 1.00 . A A . 13 CYS HB3 1 1 16 9499 1 1 13 CYS N N -6.087 6.722 -4.660 1.00 . A A . 13 CYS N 1 1 16 9500 1 1 13 CYS O O -8.483 6.800 -2.066 1.00 . A A . 13 CYS O 1 1 16 9501 1 1 13 CYS SG S -9.808 8.475 -4.594 1.00 . A A . 13 CYS SG 1 1 16 9502 1 1 14 LYS C C -7.551 3.018 -2.105 1.00 . A A . 14 LYS C 1 1 16 9503 1 1 14 LYS CA C -8.563 4.076 -2.526 1.00 . A A . 14 LYS CA 1 1 16 9504 1 1 14 LYS CB C -9.748 3.411 -3.229 1.00 . A A . 14 LYS CB 1 1 16 9505 1 1 14 LYS CD C -12.098 2.537 -3.056 1.00 . A A . 14 LYS CD 1 1 16 9506 1 1 14 LYS CE C -12.841 3.662 -3.757 1.00 . A A . 14 LYS CE 1 1 16 9507 1 1 14 LYS CG C -10.891 3.058 -2.292 1.00 . A A . 14 LYS CG 1 1 16 9508 1 1 14 LYS H H -7.523 4.777 -4.233 1.00 . A A . 14 LYS H 1 1 16 9509 1 1 14 LYS HA H -8.920 4.585 -1.644 1.00 . A A . 14 LYS HA 1 1 16 9510 1 1 14 LYS HB2 H -10.126 4.083 -3.985 1.00 . A A . 14 LYS HB2 1 1 16 9511 1 1 14 LYS HB3 H -9.407 2.504 -3.705 1.00 . A A . 14 LYS HB3 1 1 16 9512 1 1 14 LYS HD2 H -11.763 1.825 -3.796 1.00 . A A . 14 LYS HD2 1 1 16 9513 1 1 14 LYS HD3 H -12.768 2.050 -2.363 1.00 . A A . 14 LYS HD3 1 1 16 9514 1 1 14 LYS HE2 H -13.512 4.128 -3.050 1.00 . A A . 14 LYS HE2 1 1 16 9515 1 1 14 LYS HE3 H -12.123 4.390 -4.104 1.00 . A A . 14 LYS HE3 1 1 16 9516 1 1 14 LYS HG2 H -10.557 2.295 -1.604 1.00 . A A . 14 LYS HG2 1 1 16 9517 1 1 14 LYS HG3 H -11.179 3.941 -1.741 1.00 . A A . 14 LYS HG3 1 1 16 9518 1 1 14 LYS HZ1 H -13.905 2.176 -4.768 1.00 . A A . 14 LYS HZ1 1 1 16 9519 1 1 14 LYS HZ2 H -14.492 3.739 -5.035 1.00 . A A . 14 LYS HZ2 1 1 16 9520 1 1 14 LYS HZ3 H -13.065 3.233 -5.789 1.00 . A A . 14 LYS HZ3 1 1 16 9521 1 1 14 LYS N N -7.950 5.070 -3.400 1.00 . A A . 14 LYS N 1 1 16 9522 1 1 14 LYS NZ N -13.631 3.168 -4.918 1.00 . A A . 14 LYS NZ 1 1 16 9523 1 1 14 LYS O O -6.760 2.542 -2.918 1.00 . A A . 14 LYS O 1 1 16 9524 1 1 15 LEU C C -6.629 0.410 -1.189 1.00 . A A . 15 LEU C 1 1 16 9525 1 1 15 LEU CA C -6.670 1.644 -0.293 1.00 . A A . 15 LEU CA 1 1 16 9526 1 1 15 LEU CB C -7.091 1.242 1.122 1.00 . A A . 15 LEU CB 1 1 16 9527 1 1 15 LEU CD1 C -8.296 2.118 3.137 1.00 . A A . 15 LEU CD1 1 1 16 9528 1 1 15 LEU CD2 C -5.871 2.633 2.811 1.00 . A A . 15 LEU CD2 1 1 16 9529 1 1 15 LEU CG C -7.204 2.398 2.117 1.00 . A A . 15 LEU CG 1 1 16 9530 1 1 15 LEU H H -8.240 3.063 -0.228 1.00 . A A . 15 LEU H 1 1 16 9531 1 1 15 LEU HA H -5.683 2.079 -0.255 1.00 . A A . 15 LEU HA 1 1 16 9532 1 1 15 LEU HB2 H -8.051 0.750 1.063 1.00 . A A . 15 LEU HB2 1 1 16 9533 1 1 15 LEU HB3 H -6.367 0.538 1.504 1.00 . A A . 15 LEU HB3 1 1 16 9534 1 1 15 LEU HD11 H -8.258 1.078 3.429 1.00 . A A . 15 LEU HD11 1 1 16 9535 1 1 15 LEU HD12 H -8.146 2.741 4.006 1.00 . A A . 15 LEU HD12 1 1 16 9536 1 1 15 LEU HD13 H -9.260 2.334 2.701 1.00 . A A . 15 LEU HD13 1 1 16 9537 1 1 15 LEU HD21 H -5.439 1.684 3.092 1.00 . A A . 15 LEU HD21 1 1 16 9538 1 1 15 LEU HD22 H -5.202 3.149 2.139 1.00 . A A . 15 LEU HD22 1 1 16 9539 1 1 15 LEU HD23 H -6.027 3.233 3.695 1.00 . A A . 15 LEU HD23 1 1 16 9540 1 1 15 LEU HG H -7.469 3.300 1.584 1.00 . A A . 15 LEU HG 1 1 16 9541 1 1 15 LEU N N -7.584 2.650 -0.827 1.00 . A A . 15 LEU N 1 1 16 9542 1 1 15 LEU O O -7.661 -0.203 -1.465 1.00 . A A . 15 LEU O 1 1 16 9543 1 1 16 LYS C C -5.762 -2.377 -1.814 1.00 . A A . 16 LYS C 1 1 16 9544 1 1 16 LYS CA C -5.262 -1.110 -2.505 1.00 . A A . 16 LYS CA 1 1 16 9545 1 1 16 LYS CB C -3.792 -1.272 -2.895 1.00 . A A . 16 LYS CB 1 1 16 9546 1 1 16 LYS CD C -1.862 -0.218 -4.111 1.00 . A A . 16 LYS CD 1 1 16 9547 1 1 16 LYS CE C -1.397 0.221 -5.490 1.00 . A A . 16 LYS CE 1 1 16 9548 1 1 16 LYS CG C -3.371 -0.392 -4.061 1.00 . A A . 16 LYS CG 1 1 16 9549 1 1 16 LYS H H -4.646 0.577 -1.387 1.00 . A A . 16 LYS H 1 1 16 9550 1 1 16 LYS HA H -5.847 -0.945 -3.399 1.00 . A A . 16 LYS HA 1 1 16 9551 1 1 16 LYS HB2 H -3.176 -1.023 -2.044 1.00 . A A . 16 LYS HB2 1 1 16 9552 1 1 16 LYS HB3 H -3.615 -2.302 -3.167 1.00 . A A . 16 LYS HB3 1 1 16 9553 1 1 16 LYS HD2 H -1.571 0.530 -3.389 1.00 . A A . 16 LYS HD2 1 1 16 9554 1 1 16 LYS HD3 H -1.393 -1.160 -3.865 1.00 . A A . 16 LYS HD3 1 1 16 9555 1 1 16 LYS HE2 H -2.096 0.948 -5.877 1.00 . A A . 16 LYS HE2 1 1 16 9556 1 1 16 LYS HE3 H -0.421 0.674 -5.400 1.00 . A A . 16 LYS HE3 1 1 16 9557 1 1 16 LYS HG2 H -3.701 -0.850 -4.982 1.00 . A A . 16 LYS HG2 1 1 16 9558 1 1 16 LYS HG3 H -3.834 0.578 -3.953 1.00 . A A . 16 LYS HG3 1 1 16 9559 1 1 16 LYS HZ1 H -2.086 -1.596 -6.256 1.00 . A A . 16 LYS HZ1 1 1 16 9560 1 1 16 LYS HZ2 H -1.393 -0.582 -7.419 1.00 . A A . 16 LYS HZ2 1 1 16 9561 1 1 16 LYS HZ3 H -0.406 -1.417 -6.326 1.00 . A A . 16 LYS HZ3 1 1 16 9562 1 1 16 LYS N N -5.433 0.051 -1.641 1.00 . A A . 16 LYS N 1 1 16 9563 1 1 16 LYS NZ N -1.315 -0.924 -6.439 1.00 . A A . 16 LYS NZ 1 1 16 9564 1 1 16 LYS O O -5.841 -2.433 -0.587 1.00 . A A . 16 LYS O 1 1 16 9565 1 1 17 PRO C C -5.686 -5.241 -0.965 1.00 . A A . 17 PRO C 1 1 16 9566 1 1 17 PRO CA C -6.601 -4.682 -2.049 1.00 . A A . 17 PRO CA 1 1 16 9567 1 1 17 PRO CB C -6.618 -5.610 -3.265 1.00 . A A . 17 PRO CB 1 1 16 9568 1 1 17 PRO CD C -6.044 -3.432 -4.069 1.00 . A A . 17 PRO CD 1 1 16 9569 1 1 17 PRO CG C -6.768 -4.699 -4.434 1.00 . A A . 17 PRO CG 1 1 16 9570 1 1 17 PRO HA H -7.602 -4.579 -1.656 1.00 . A A . 17 PRO HA 1 1 16 9571 1 1 17 PRO HB2 H -5.693 -6.165 -3.311 1.00 . A A . 17 PRO HB2 1 1 16 9572 1 1 17 PRO HB3 H -7.451 -6.293 -3.189 1.00 . A A . 17 PRO HB3 1 1 16 9573 1 1 17 PRO HD2 H -5.020 -3.471 -4.411 1.00 . A A . 17 PRO HD2 1 1 16 9574 1 1 17 PRO HD3 H -6.551 -2.575 -4.487 1.00 . A A . 17 PRO HD3 1 1 16 9575 1 1 17 PRO HG2 H -6.319 -5.148 -5.308 1.00 . A A . 17 PRO HG2 1 1 16 9576 1 1 17 PRO HG3 H -7.814 -4.496 -4.610 1.00 . A A . 17 PRO HG3 1 1 16 9577 1 1 17 PRO N N -6.107 -3.414 -2.595 1.00 . A A . 17 PRO N 1 1 16 9578 1 1 17 PRO O O -4.496 -5.458 -1.195 1.00 . A A . 17 PRO O 1 1 16 9579 1 1 18 ALA C C -4.637 -7.204 0.915 1.00 . A A . 18 ALA C 1 1 16 9580 1 1 18 ALA CA C -5.485 -6.010 1.342 1.00 . A A . 18 ALA CA 1 1 16 9581 1 1 18 ALA CB C -6.422 -6.406 2.474 1.00 . A A . 18 ALA CB 1 1 16 9582 1 1 18 ALA H H -7.202 -5.280 0.340 1.00 . A A . 18 ALA H 1 1 16 9583 1 1 18 ALA HA H -4.833 -5.229 1.704 1.00 . A A . 18 ALA HA 1 1 16 9584 1 1 18 ALA HB1 H -6.974 -5.538 2.804 1.00 . A A . 18 ALA HB1 1 1 16 9585 1 1 18 ALA HB2 H -5.845 -6.801 3.297 1.00 . A A . 18 ALA HB2 1 1 16 9586 1 1 18 ALA HB3 H -7.112 -7.159 2.123 1.00 . A A . 18 ALA HB3 1 1 16 9587 1 1 18 ALA N N -6.249 -5.474 0.219 1.00 . A A . 18 ALA N 1 1 16 9588 1 1 18 ALA O O -5.162 -8.268 0.588 1.00 . A A . 18 ALA O 1 1 16 9589 1 1 19 GLY C C -1.641 -7.752 -0.735 1.00 . A A . 19 GLY C 1 1 16 9590 1 1 19 GLY CA C -2.417 -8.082 0.526 1.00 . A A . 19 GLY CA 1 1 16 9591 1 1 19 GLY H H -2.961 -6.146 1.186 1.00 . A A . 19 GLY H 1 1 16 9592 1 1 19 GLY HA2 H -2.990 -8.982 0.358 1.00 . A A . 19 GLY HA2 1 1 16 9593 1 1 19 GLY HA3 H -1.717 -8.259 1.330 1.00 . A A . 19 GLY HA3 1 1 16 9594 1 1 19 GLY N N -3.321 -7.017 0.918 1.00 . A A . 19 GLY N 1 1 16 9595 1 1 19 GLY O O -1.089 -8.642 -1.382 1.00 . A A . 19 GLY O 1 1 16 9596 1 1 20 THR C C 0.304 -5.144 -1.899 1.00 . A A . 20 THR C 1 1 16 9597 1 1 20 THR CA C -0.883 -6.025 -2.277 1.00 . A A . 20 THR CA 1 1 16 9598 1 1 20 THR CB C -1.827 -5.260 -3.207 1.00 . A A . 20 THR CB 1 1 16 9599 1 1 20 THR CG2 C -1.163 -4.794 -4.485 1.00 . A A . 20 THR CG2 1 1 16 9600 1 1 20 THR H H -2.056 -5.805 -0.532 1.00 . A A . 20 THR H 1 1 16 9601 1 1 20 THR HA H -0.517 -6.901 -2.791 1.00 . A A . 20 THR HA 1 1 16 9602 1 1 20 THR HB H -2.195 -4.386 -2.688 1.00 . A A . 20 THR HB 1 1 16 9603 1 1 20 THR HG1 H -2.627 -6.926 -3.856 1.00 . A A . 20 THR HG1 1 1 16 9604 1 1 20 THR HG21 H -0.128 -4.556 -4.288 1.00 . A A . 20 THR HG21 1 1 16 9605 1 1 20 THR HG22 H -1.217 -5.579 -5.225 1.00 . A A . 20 THR HG22 1 1 16 9606 1 1 20 THR HG23 H -1.671 -3.916 -4.854 1.00 . A A . 20 THR HG23 1 1 16 9607 1 1 20 THR N N -1.597 -6.469 -1.086 1.00 . A A . 20 THR N 1 1 16 9608 1 1 20 THR O O 0.130 -4.048 -1.366 1.00 . A A . 20 THR O 1 1 16 9609 1 1 20 THR OG1 O -2.936 -6.064 -3.567 1.00 . A A . 20 THR OG1 1 1 16 9610 1 1 21 THR C C 2.698 -3.499 -2.491 1.00 . A A . 21 THR C 1 1 16 9611 1 1 21 THR CA C 2.726 -4.890 -1.864 1.00 . A A . 21 THR CA 1 1 16 9612 1 1 21 THR CB C 3.955 -5.658 -2.355 1.00 . A A . 21 THR CB 1 1 16 9613 1 1 21 THR CG2 C 3.796 -6.205 -3.757 1.00 . A A . 21 THR CG2 1 1 16 9614 1 1 21 THR H H 1.582 -6.512 -2.601 1.00 . A A . 21 THR H 1 1 16 9615 1 1 21 THR HA H 2.784 -4.786 -0.791 1.00 . A A . 21 THR HA 1 1 16 9616 1 1 21 THR HB H 4.133 -6.493 -1.692 1.00 . A A . 21 THR HB 1 1 16 9617 1 1 21 THR HG1 H 5.032 -4.171 -3.040 1.00 . A A . 21 THR HG1 1 1 16 9618 1 1 21 THR HG21 H 2.793 -6.012 -4.107 1.00 . A A . 21 THR HG21 1 1 16 9619 1 1 21 THR HG22 H 4.506 -5.725 -4.414 1.00 . A A . 21 THR HG22 1 1 16 9620 1 1 21 THR HG23 H 3.976 -7.270 -3.750 1.00 . A A . 21 THR HG23 1 1 16 9621 1 1 21 THR N N 1.509 -5.632 -2.177 1.00 . A A . 21 THR N 1 1 16 9622 1 1 21 THR O O 2.442 -3.351 -3.686 1.00 . A A . 21 THR O 1 1 16 9623 1 1 21 THR OG1 O 5.104 -4.828 -2.343 1.00 . A A . 21 THR OG1 1 1 16 9624 1 1 22 CYS C C 4.241 -0.800 -2.928 1.00 . A A . 22 CYS C 1 1 16 9625 1 1 22 CYS CA C 2.966 -1.104 -2.148 1.00 . A A . 22 CYS CA 1 1 16 9626 1 1 22 CYS CB C 2.833 -0.139 -0.969 1.00 . A A . 22 CYS CB 1 1 16 9627 1 1 22 CYS H H 3.157 -2.666 -0.733 1.00 . A A . 22 CYS H 1 1 16 9628 1 1 22 CYS HA H 2.118 -0.976 -2.804 1.00 . A A . 22 CYS HA 1 1 16 9629 1 1 22 CYS HB2 H 2.914 0.875 -1.332 1.00 . A A . 22 CYS HB2 1 1 16 9630 1 1 22 CYS HB3 H 1.865 -0.275 -0.509 1.00 . A A . 22 CYS HB3 1 1 16 9631 1 1 22 CYS N N 2.961 -2.484 -1.675 1.00 . A A . 22 CYS N 1 1 16 9632 1 1 22 CYS O O 4.224 -0.033 -3.891 1.00 . A A . 22 CYS O 1 1 16 9633 1 1 22 CYS SG S 4.098 -0.365 0.324 1.00 . A A . 22 CYS SG 1 1 16 9634 1 1 23 TRP C C 7.316 -2.534 -3.447 1.00 . A A . 23 TRP C 1 1 16 9635 1 1 23 TRP CA C 6.630 -1.201 -3.165 1.00 . A A . 23 TRP CA 1 1 16 9636 1 1 23 TRP CB C 7.535 -0.322 -2.300 1.00 . A A . 23 TRP CB 1 1 16 9637 1 1 23 TRP CD1 C 8.971 0.748 -4.133 1.00 . A A . 23 TRP CD1 1 1 16 9638 1 1 23 TRP CD2 C 10.145 -0.272 -2.523 1.00 . A A . 23 TRP CD2 1 1 16 9639 1 1 23 TRP CE2 C 11.046 0.269 -3.460 1.00 . A A . 23 TRP CE2 1 1 16 9640 1 1 23 TRP CE3 C 10.656 -0.961 -1.419 1.00 . A A . 23 TRP CE3 1 1 16 9641 1 1 23 TRP CG C 8.823 0.045 -2.972 1.00 . A A . 23 TRP CG 1 1 16 9642 1 1 23 TRP CH2 C 12.897 -0.537 -2.236 1.00 . A A . 23 TRP CH2 1 1 16 9643 1 1 23 TRP CZ2 C 12.426 0.142 -3.326 1.00 . A A . 23 TRP CZ2 1 1 16 9644 1 1 23 TRP CZ3 C 12.026 -1.087 -1.287 1.00 . A A . 23 TRP CZ3 1 1 16 9645 1 1 23 TRP H H 5.296 -2.007 -1.732 1.00 . A A . 23 TRP H 1 1 16 9646 1 1 23 TRP HA H 6.444 -0.699 -4.102 1.00 . A A . 23 TRP HA 1 1 16 9647 1 1 23 TRP HB2 H 7.013 0.592 -2.058 1.00 . A A . 23 TRP HB2 1 1 16 9648 1 1 23 TRP HB3 H 7.772 -0.848 -1.387 1.00 . A A . 23 TRP HB3 1 1 16 9649 1 1 23 TRP HD1 H 8.150 1.132 -4.720 1.00 . A A . 23 TRP HD1 1 1 16 9650 1 1 23 TRP HE1 H 10.666 1.352 -5.216 1.00 . A A . 23 TRP HE1 1 1 16 9651 1 1 23 TRP HE3 H 10.000 -1.392 -0.677 1.00 . A A . 23 TRP HE3 1 1 16 9652 1 1 23 TRP HH2 H 13.961 -0.660 -2.093 1.00 . A A . 23 TRP HH2 1 1 16 9653 1 1 23 TRP HZ2 H 13.111 0.560 -4.048 1.00 . A A . 23 TRP HZ2 1 1 16 9654 1 1 23 TRP HZ3 H 12.438 -1.616 -0.441 1.00 . A A . 23 TRP HZ3 1 1 16 9655 1 1 23 TRP N N 5.345 -1.407 -2.506 1.00 . A A . 23 TRP N 1 1 16 9656 1 1 23 TRP NE1 N 10.305 0.887 -4.433 1.00 . A A . 23 TRP NE1 1 1 16 9657 1 1 23 TRP O O 7.814 -3.193 -2.535 1.00 . A A . 23 TRP O 1 1 16 9658 1 1 24 ARG C C 9.312 -3.925 -5.786 1.00 . A A . 24 ARG C 1 1 16 9659 1 1 24 ARG CA C 7.963 -4.178 -5.121 1.00 . A A . 24 ARG CA 1 1 16 9660 1 1 24 ARG CB C 7.046 -4.946 -6.075 1.00 . A A . 24 ARG CB 1 1 16 9661 1 1 24 ARG CD C 5.792 -4.976 -8.252 1.00 . A A . 24 ARG CD 1 1 16 9662 1 1 24 ARG CG C 6.772 -4.211 -7.377 1.00 . A A . 24 ARG CG 1 1 16 9663 1 1 24 ARG CZ C 5.504 -3.519 -10.219 1.00 . A A . 24 ARG CZ 1 1 16 9664 1 1 24 ARG H H 6.924 -2.355 -5.400 1.00 . A A . 24 ARG H 1 1 16 9665 1 1 24 ARG HA H 8.120 -4.771 -4.232 1.00 . A A . 24 ARG HA 1 1 16 9666 1 1 24 ARG HB2 H 7.505 -5.894 -6.312 1.00 . A A . 24 ARG HB2 1 1 16 9667 1 1 24 ARG HB3 H 6.102 -5.126 -5.582 1.00 . A A . 24 ARG HB3 1 1 16 9668 1 1 24 ARG HD2 H 5.960 -6.034 -8.119 1.00 . A A . 24 ARG HD2 1 1 16 9669 1 1 24 ARG HD3 H 4.786 -4.731 -7.944 1.00 . A A . 24 ARG HD3 1 1 16 9670 1 1 24 ARG HE H 6.409 -5.298 -10.235 1.00 . A A . 24 ARG HE 1 1 16 9671 1 1 24 ARG HG2 H 6.355 -3.241 -7.151 1.00 . A A . 24 ARG HG2 1 1 16 9672 1 1 24 ARG HG3 H 7.701 -4.089 -7.913 1.00 . A A . 24 ARG HG3 1 1 16 9673 1 1 24 ARG HH11 H 4.734 -2.773 -8.503 1.00 . A A . 24 ARG HH11 1 1 16 9674 1 1 24 ARG HH12 H 4.545 -1.768 -9.901 1.00 . A A . 24 ARG HH12 1 1 16 9675 1 1 24 ARG HH21 H 6.161 -3.977 -12.074 1.00 . A A . 24 ARG HH21 1 1 16 9676 1 1 24 ARG HH22 H 5.355 -2.451 -11.928 1.00 . A A . 24 ARG HH22 1 1 16 9677 1 1 24 ARG N N 7.338 -2.924 -4.718 1.00 . A A . 24 ARG N 1 1 16 9678 1 1 24 ARG NE N 5.949 -4.646 -9.667 1.00 . A A . 24 ARG NE 1 1 16 9679 1 1 24 ARG NH1 N 4.876 -2.613 -9.480 1.00 . A A . 24 ARG NH1 1 1 16 9680 1 1 24 ARG NH2 N 5.688 -3.298 -11.513 1.00 . A A . 24 ARG NH2 1 1 16 9681 1 1 24 ARG O O 9.538 -2.865 -6.370 1.00 . A A . 24 ARG O 1 1 16 9682 1 1 25 THR C C 12.138 -6.164 -6.541 1.00 . A A . 25 THR C 1 1 16 9683 1 1 25 THR CA C 11.531 -4.788 -6.288 1.00 . A A . 25 THR CA 1 1 16 9684 1 1 25 THR CB C 12.450 -3.970 -5.379 1.00 . A A . 25 THR CB 1 1 16 9685 1 1 25 THR CG2 C 12.115 -2.494 -5.362 1.00 . A A . 25 THR CG2 1 1 16 9686 1 1 25 THR H H 9.966 -5.726 -5.217 1.00 . A A . 25 THR H 1 1 16 9687 1 1 25 THR HA H 11.428 -4.277 -7.231 1.00 . A A . 25 THR HA 1 1 16 9688 1 1 25 THR HB H 13.468 -4.074 -5.725 1.00 . A A . 25 THR HB 1 1 16 9689 1 1 25 THR HG1 H 13.209 -4.247 -3.595 1.00 . A A . 25 THR HG1 1 1 16 9690 1 1 25 THR HG21 H 11.935 -2.154 -6.371 1.00 . A A . 25 THR HG21 1 1 16 9691 1 1 25 THR HG22 H 11.230 -2.332 -4.765 1.00 . A A . 25 THR HG22 1 1 16 9692 1 1 25 THR HG23 H 12.941 -1.942 -4.938 1.00 . A A . 25 THR HG23 1 1 16 9693 1 1 25 THR N N 10.205 -4.905 -5.695 1.00 . A A . 25 THR N 1 1 16 9694 1 1 25 THR O O 12.149 -6.651 -7.672 1.00 . A A . 25 THR O 1 1 16 9695 1 1 25 THR OG1 O 12.383 -4.440 -4.044 1.00 . A A . 25 THR OG1 1 1 16 9696 1 1 26 SER C C 13.675 -8.615 -4.211 1.00 . A A . 26 SER C 1 1 16 9697 1 1 26 SER CA C 13.249 -8.105 -5.583 1.00 . A A . 26 SER CA 1 1 16 9698 1 1 26 SER CB C 14.456 -8.063 -6.522 1.00 . A A . 26 SER CB 1 1 16 9699 1 1 26 SER H H 12.599 -6.341 -4.609 1.00 . A A . 26 SER H 1 1 16 9700 1 1 26 SER HA H 12.512 -8.778 -5.989 1.00 . A A . 26 SER HA 1 1 16 9701 1 1 26 SER HB2 H 14.670 -9.061 -6.875 1.00 . A A . 26 SER HB2 1 1 16 9702 1 1 26 SER HB3 H 14.233 -7.423 -7.363 1.00 . A A . 26 SER HB3 1 1 16 9703 1 1 26 SER HG H 15.655 -6.610 -5.984 1.00 . A A . 26 SER HG 1 1 16 9704 1 1 26 SER N N 12.640 -6.783 -5.481 1.00 . A A . 26 SER N 1 1 16 9705 1 1 26 SER O O 13.524 -9.797 -3.901 1.00 . A A . 26 SER O 1 1 16 9706 1 1 26 SER OG O 15.602 -7.560 -5.857 1.00 . A A . 26 SER OG 1 1 16 9707 1 1 27 VAL C C 14.086 -7.117 -1.010 1.00 . A A . 27 VAL C 1 1 16 9708 1 1 27 VAL CA C 14.658 -8.071 -2.053 1.00 . A A . 27 VAL CA 1 1 16 9709 1 1 27 VAL CB C 16.195 -8.059 -1.954 1.00 . A A . 27 VAL CB 1 1 16 9710 1 1 27 VAL CG1 C 16.789 -9.230 -2.721 1.00 . A A . 27 VAL CG1 1 1 16 9711 1 1 27 VAL CG2 C 16.753 -6.739 -2.465 1.00 . A A . 27 VAL CG2 1 1 16 9712 1 1 27 VAL H H 14.302 -6.790 -3.699 1.00 . A A . 27 VAL H 1 1 16 9713 1 1 27 VAL HA H 14.312 -9.072 -1.839 1.00 . A A . 27 VAL HA 1 1 16 9714 1 1 27 VAL HB H 16.470 -8.163 -0.914 1.00 . A A . 27 VAL HB 1 1 16 9715 1 1 27 VAL HG11 H 16.069 -10.034 -2.766 1.00 . A A . 27 VAL HG11 1 1 16 9716 1 1 27 VAL HG12 H 17.041 -8.915 -3.722 1.00 . A A . 27 VAL HG12 1 1 16 9717 1 1 27 VAL HG13 H 17.681 -9.575 -2.218 1.00 . A A . 27 VAL HG13 1 1 16 9718 1 1 27 VAL HG21 H 16.032 -5.954 -2.294 1.00 . A A . 27 VAL HG21 1 1 16 9719 1 1 27 VAL HG22 H 17.668 -6.508 -1.940 1.00 . A A . 27 VAL HG22 1 1 16 9720 1 1 27 VAL HG23 H 16.955 -6.819 -3.523 1.00 . A A . 27 VAL HG23 1 1 16 9721 1 1 27 VAL N N 14.209 -7.715 -3.393 1.00 . A A . 27 VAL N 1 1 16 9722 1 1 27 VAL O O 14.714 -6.853 0.016 1.00 . A A . 27 VAL O 1 1 16 9723 1 1 28 SER C C 10.801 -5.398 -0.806 1.00 . A A . 28 SER C 1 1 16 9724 1 1 28 SER CA C 12.234 -5.676 -0.364 1.00 . A A . 28 SER CA 1 1 16 9725 1 1 28 SER CB C 13.018 -4.365 -0.281 1.00 . A A . 28 SER CB 1 1 16 9726 1 1 28 SER H H 12.440 -6.850 -2.113 1.00 . A A . 28 SER H 1 1 16 9727 1 1 28 SER HA H 12.214 -6.135 0.613 1.00 . A A . 28 SER HA 1 1 16 9728 1 1 28 SER HB2 H 14.076 -4.581 -0.263 1.00 . A A . 28 SER HB2 1 1 16 9729 1 1 28 SER HB3 H 12.789 -3.756 -1.143 1.00 . A A . 28 SER HB3 1 1 16 9730 1 1 28 SER HG H 11.757 -3.387 0.855 1.00 . A A . 28 SER HG 1 1 16 9731 1 1 28 SER N N 12.891 -6.601 -1.279 1.00 . A A . 28 SER N 1 1 16 9732 1 1 28 SER O O 10.563 -4.951 -1.928 1.00 . A A . 28 SER O 1 1 16 9733 1 1 28 SER OG O 12.682 -3.642 0.891 1.00 . A A . 28 SER OG 1 1 16 9734 1 1 29 SER C C 7.614 -5.394 1.064 1.00 . A A . 29 SER C 1 1 16 9735 1 1 29 SER CA C 8.440 -5.443 -0.216 1.00 . A A . 29 SER CA 1 1 16 9736 1 1 29 SER CB C 7.913 -6.547 -1.135 1.00 . A A . 29 SER CB 1 1 16 9737 1 1 29 SER H H 10.103 -6.019 0.961 1.00 . A A . 29 SER H 1 1 16 9738 1 1 29 SER HA H 8.355 -4.494 -0.723 1.00 . A A . 29 SER HA 1 1 16 9739 1 1 29 SER HB2 H 8.450 -7.462 -0.940 1.00 . A A . 29 SER HB2 1 1 16 9740 1 1 29 SER HB3 H 6.861 -6.699 -0.944 1.00 . A A . 29 SER HB3 1 1 16 9741 1 1 29 SER HG H 7.236 -5.952 -2.875 1.00 . A A . 29 SER HG 1 1 16 9742 1 1 29 SER N N 9.850 -5.665 0.083 1.00 . A A . 29 SER N 1 1 16 9743 1 1 29 SER O O 8.056 -5.851 2.118 1.00 . A A . 29 SER O 1 1 16 9744 1 1 29 SER OG O 8.083 -6.200 -2.499 1.00 . A A . 29 SER OG 1 1 16 9745 1 1 30 HIS C C 4.061 -4.779 1.682 1.00 . A A . 30 HIS C 1 1 16 9746 1 1 30 HIS CA C 5.522 -4.727 2.116 1.00 . A A . 30 HIS CA 1 1 16 9747 1 1 30 HIS CB C 5.794 -3.427 2.875 1.00 . A A . 30 HIS CB 1 1 16 9748 1 1 30 HIS CD2 C 8.252 -2.769 2.369 1.00 . A A . 30 HIS CD2 1 1 16 9749 1 1 30 HIS CE1 C 9.095 -3.122 4.362 1.00 . A A . 30 HIS CE1 1 1 16 9750 1 1 30 HIS CG C 7.244 -3.196 3.167 1.00 . A A . 30 HIS CG 1 1 16 9751 1 1 30 HIS H H 6.115 -4.490 0.098 1.00 . A A . 30 HIS H 1 1 16 9752 1 1 30 HIS HA H 5.722 -5.563 2.769 1.00 . A A . 30 HIS HA 1 1 16 9753 1 1 30 HIS HB2 H 5.438 -2.594 2.288 1.00 . A A . 30 HIS HB2 1 1 16 9754 1 1 30 HIS HB3 H 5.264 -3.450 3.816 1.00 . A A . 30 HIS HB3 1 1 16 9755 1 1 30 HIS HD1 H 7.330 -3.723 5.206 1.00 . A A . 30 HIS HD1 1 1 16 9756 1 1 30 HIS HD2 H 8.174 -2.506 1.323 1.00 . A A . 30 HIS HD2 1 1 16 9757 1 1 30 HIS HE1 H 9.789 -3.195 5.186 1.00 . A A . 30 HIS HE1 1 1 16 9758 1 1 30 HIS HE2 H 10.294 -2.545 2.805 1.00 . A A . 30 HIS HE2 1 1 16 9759 1 1 30 HIS N N 6.411 -4.836 0.965 1.00 . A A . 30 HIS N 1 1 16 9760 1 1 30 HIS ND1 N 7.806 -3.409 4.409 1.00 . A A . 30 HIS ND1 1 1 16 9761 1 1 30 HIS NE2 N 9.390 -2.732 3.136 1.00 . A A . 30 HIS NE2 1 1 16 9762 1 1 30 HIS O O 3.544 -3.831 1.091 1.00 . A A . 30 HIS O 1 1 16 9763 1 1 31 TYR C C 1.131 -4.993 2.262 1.00 . A A . 31 TYR C 1 1 16 9764 1 1 31 TYR CA C 1.998 -6.071 1.619 1.00 . A A . 31 TYR CA 1 1 16 9765 1 1 31 TYR CB C 1.511 -7.456 2.047 1.00 . A A . 31 TYR CB 1 1 16 9766 1 1 31 TYR CD1 C 2.564 -9.696 1.548 1.00 . A A . 31 TYR CD1 1 1 16 9767 1 1 31 TYR CD2 C 1.626 -8.465 -0.265 1.00 . A A . 31 TYR CD2 1 1 16 9768 1 1 31 TYR CE1 C 2.928 -10.707 0.679 1.00 . A A . 31 TYR CE1 1 1 16 9769 1 1 31 TYR CE2 C 1.986 -9.472 -1.140 1.00 . A A . 31 TYR CE2 1 1 16 9770 1 1 31 TYR CG C 1.908 -8.560 1.092 1.00 . A A . 31 TYR CG 1 1 16 9771 1 1 31 TYR CZ C 2.637 -10.590 -0.664 1.00 . A A . 31 TYR CZ 1 1 16 9772 1 1 31 TYR H H 3.867 -6.615 2.451 1.00 . A A . 31 TYR H 1 1 16 9773 1 1 31 TYR HA H 1.919 -5.987 0.545 1.00 . A A . 31 TYR HA 1 1 16 9774 1 1 31 TYR HB2 H 1.925 -7.692 3.016 1.00 . A A . 31 TYR HB2 1 1 16 9775 1 1 31 TYR HB3 H 0.433 -7.446 2.114 1.00 . A A . 31 TYR HB3 1 1 16 9776 1 1 31 TYR HD1 H 2.790 -9.785 2.600 1.00 . A A . 31 TYR HD1 1 1 16 9777 1 1 31 TYR HD2 H 1.116 -7.587 -0.635 1.00 . A A . 31 TYR HD2 1 1 16 9778 1 1 31 TYR HE1 H 3.437 -11.583 1.052 1.00 . A A . 31 TYR HE1 1 1 16 9779 1 1 31 TYR HE2 H 1.758 -9.379 -2.192 1.00 . A A . 31 TYR HE2 1 1 16 9780 1 1 31 TYR HH H 2.798 -12.446 -1.138 1.00 . A A . 31 TYR HH 1 1 16 9781 1 1 31 TYR N N 3.401 -5.894 1.979 1.00 . A A . 31 TYR N 1 1 16 9782 1 1 31 TYR O O 1.284 -4.682 3.443 1.00 . A A . 31 TYR O 1 1 16 9783 1 1 31 TYR OH O 2.997 -11.594 -1.533 1.00 . A A . 31 TYR OH 1 1 16 9784 1 1 32 CYS C C -1.864 -3.991 2.700 1.00 . A A . 32 CYS C 1 1 16 9785 1 1 32 CYS CA C -0.671 -3.384 1.969 1.00 . A A . 32 CYS CA 1 1 16 9786 1 1 32 CYS CB C -1.157 -2.511 0.812 1.00 . A A . 32 CYS CB 1 1 16 9787 1 1 32 CYS H H 0.147 -4.717 0.544 1.00 . A A . 32 CYS H 1 1 16 9788 1 1 32 CYS HA H -0.114 -2.771 2.662 1.00 . A A . 32 CYS HA 1 1 16 9789 1 1 32 CYS HB2 H -0.326 -2.300 0.155 1.00 . A A . 32 CYS HB2 1 1 16 9790 1 1 32 CYS HB3 H -1.917 -3.046 0.261 1.00 . A A . 32 CYS HB3 1 1 16 9791 1 1 32 CYS N N 0.221 -4.427 1.476 1.00 . A A . 32 CYS N 1 1 16 9792 1 1 32 CYS O O -2.398 -5.021 2.289 1.00 . A A . 32 CYS O 1 1 16 9793 1 1 32 CYS SG S -1.868 -0.916 1.332 1.00 . A A . 32 CYS SG 1 1 16 9794 1 1 33 THR C C -4.734 -3.301 4.016 1.00 . A A . 33 THR C 1 1 16 9795 1 1 33 THR CA C -3.409 -3.821 4.573 1.00 . A A . 33 THR CA 1 1 16 9796 1 1 33 THR CB C -3.253 -3.389 6.031 1.00 . A A . 33 THR CB 1 1 16 9797 1 1 33 THR CG2 C -2.035 -3.984 6.703 1.00 . A A . 33 THR CG2 1 1 16 9798 1 1 33 THR H H -1.812 -2.529 4.062 1.00 . A A . 33 THR H 1 1 16 9799 1 1 33 THR HA H -3.413 -4.899 4.527 1.00 . A A . 33 THR HA 1 1 16 9800 1 1 33 THR HB H -4.125 -3.706 6.585 1.00 . A A . 33 THR HB 1 1 16 9801 1 1 33 THR HG1 H -3.053 -1.728 7.049 1.00 . A A . 33 THR HG1 1 1 16 9802 1 1 33 THR HG21 H -1.768 -4.908 6.212 1.00 . A A . 33 THR HG21 1 1 16 9803 1 1 33 THR HG22 H -1.210 -3.289 6.634 1.00 . A A . 33 THR HG22 1 1 16 9804 1 1 33 THR HG23 H -2.255 -4.178 7.742 1.00 . A A . 33 THR HG23 1 1 16 9805 1 1 33 THR N N -2.278 -3.345 3.784 1.00 . A A . 33 THR N 1 1 16 9806 1 1 33 THR O O -5.799 -3.587 4.563 1.00 . A A . 33 THR O 1 1 16 9807 1 1 33 THR OG1 O -3.152 -1.979 6.128 1.00 . A A . 33 THR OG1 1 1 16 9808 1 1 34 GLY C C -6.747 -1.253 3.314 1.00 . A A . 34 GLY C 1 1 16 9809 1 1 34 GLY CA C -5.870 -1.995 2.321 1.00 . A A . 34 GLY CA 1 1 16 9810 1 1 34 GLY H H -3.792 -2.340 2.530 1.00 . A A . 34 GLY H 1 1 16 9811 1 1 34 GLY HA2 H -6.439 -2.807 1.893 1.00 . A A . 34 GLY HA2 1 1 16 9812 1 1 34 GLY HA3 H -5.586 -1.314 1.533 1.00 . A A . 34 GLY HA3 1 1 16 9813 1 1 34 GLY N N -4.666 -2.537 2.927 1.00 . A A . 34 GLY N 1 1 16 9814 1 1 34 GLY O O -7.953 -1.122 3.106 1.00 . A A . 34 GLY O 1 1 16 9815 1 1 35 ARG C C -6.335 1.372 5.604 1.00 . A A . 35 ARG C 1 1 16 9816 1 1 35 ARG CA C -6.886 -0.041 5.421 1.00 . A A . 35 ARG CA 1 1 16 9817 1 1 35 ARG CB C -6.840 -0.796 6.751 1.00 . A A . 35 ARG CB 1 1 16 9818 1 1 35 ARG CD C -5.358 -0.670 8.779 1.00 . A A . 35 ARG CD 1 1 16 9819 1 1 35 ARG CG C -5.433 -0.993 7.295 1.00 . A A . 35 ARG CG 1 1 16 9820 1 1 35 ARG CZ C -2.960 -0.755 9.344 1.00 . A A . 35 ARG CZ 1 1 16 9821 1 1 35 ARG H H -5.181 -0.907 4.509 1.00 . A A . 35 ARG H 1 1 16 9822 1 1 35 ARG HA H -7.913 0.029 5.096 1.00 . A A . 35 ARG HA 1 1 16 9823 1 1 35 ARG HB2 H -7.413 -0.246 7.483 1.00 . A A . 35 ARG HB2 1 1 16 9824 1 1 35 ARG HB3 H -7.288 -1.769 6.614 1.00 . A A . 35 ARG HB3 1 1 16 9825 1 1 35 ARG HD2 H -5.311 0.403 8.899 1.00 . A A . 35 ARG HD2 1 1 16 9826 1 1 35 ARG HD3 H -6.248 -1.045 9.262 1.00 . A A . 35 ARG HD3 1 1 16 9827 1 1 35 ARG HE H -4.319 -2.100 9.916 1.00 . A A . 35 ARG HE 1 1 16 9828 1 1 35 ARG HG2 H -5.141 -2.022 7.147 1.00 . A A . 35 ARG HG2 1 1 16 9829 1 1 35 ARG HG3 H -4.756 -0.344 6.760 1.00 . A A . 35 ARG HG3 1 1 16 9830 1 1 35 ARG HH11 H -3.497 0.831 8.209 1.00 . A A . 35 ARG HH11 1 1 16 9831 1 1 35 ARG HH12 H -1.818 0.749 8.622 1.00 . A A . 35 ARG HH12 1 1 16 9832 1 1 35 ARG HH21 H -2.111 -2.209 10.460 1.00 . A A . 35 ARG HH21 1 1 16 9833 1 1 35 ARG HH22 H -1.030 -0.977 9.899 1.00 . A A . 35 ARG HH22 1 1 16 9834 1 1 35 ARG N N -6.144 -0.769 4.396 1.00 . A A . 35 ARG N 1 1 16 9835 1 1 35 ARG NE N -4.186 -1.270 9.413 1.00 . A A . 35 ARG NE 1 1 16 9836 1 1 35 ARG NH1 N -2.741 0.367 8.669 1.00 . A A . 35 ARG NH1 1 1 16 9837 1 1 35 ARG NH2 N -1.951 -1.364 9.951 1.00 . A A . 35 ARG NH2 1 1 16 9838 1 1 35 ARG O O -7.078 2.298 5.930 1.00 . A A . 35 ARG O 1 1 16 9839 1 1 36 SER C C -3.338 3.045 4.455 1.00 . A A . 36 SER C 1 1 16 9840 1 1 36 SER CA C -4.390 2.834 5.539 1.00 . A A . 36 SER CA 1 1 16 9841 1 1 36 SER CB C -3.747 2.958 6.921 1.00 . A A . 36 SER CB 1 1 16 9842 1 1 36 SER H H -4.489 0.759 5.137 1.00 . A A . 36 SER H 1 1 16 9843 1 1 36 SER HA H -5.152 3.592 5.437 1.00 . A A . 36 SER HA 1 1 16 9844 1 1 36 SER HB2 H -4.465 2.675 7.676 1.00 . A A . 36 SER HB2 1 1 16 9845 1 1 36 SER HB3 H -2.889 2.304 6.977 1.00 . A A . 36 SER HB3 1 1 16 9846 1 1 36 SER HG H -3.866 4.671 7.865 1.00 . A A . 36 SER HG 1 1 16 9847 1 1 36 SER N N -5.032 1.533 5.394 1.00 . A A . 36 SER N 1 1 16 9848 1 1 36 SER O O -2.721 2.091 3.982 1.00 . A A . 36 SER O 1 1 16 9849 1 1 36 SER OG O -3.325 4.288 7.170 1.00 . A A . 36 SER OG 1 1 16 9850 1 1 37 CYS C C -0.734 4.456 3.569 1.00 . A A . 37 CYS C 1 1 16 9851 1 1 37 CYS CA C -2.156 4.636 3.043 1.00 . A A . 37 CYS CA 1 1 16 9852 1 1 37 CYS CB C -2.361 6.075 2.563 1.00 . A A . 37 CYS CB 1 1 16 9853 1 1 37 CYS H H -3.657 5.019 4.485 1.00 . A A . 37 CYS H 1 1 16 9854 1 1 37 CYS HA H -2.305 3.964 2.211 1.00 . A A . 37 CYS HA 1 1 16 9855 1 1 37 CYS HB2 H -3.217 6.495 3.069 1.00 . A A . 37 CYS HB2 1 1 16 9856 1 1 37 CYS HB3 H -1.485 6.658 2.806 1.00 . A A . 37 CYS HB3 1 1 16 9857 1 1 37 CYS N N -3.136 4.301 4.069 1.00 . A A . 37 CYS N 1 1 16 9858 1 1 37 CYS O O 0.205 4.272 2.795 1.00 . A A . 37 CYS O 1 1 16 9859 1 1 37 CYS SG S -2.649 6.227 0.771 1.00 . A A . 37 CYS SG 1 1 16 9860 1 1 38 GLU C C 1.196 2.904 5.432 1.00 . A A . 38 GLU C 1 1 16 9861 1 1 38 GLU CA C 0.725 4.352 5.515 1.00 . A A . 38 GLU CA 1 1 16 9862 1 1 38 GLU CB C 0.672 4.801 6.976 1.00 . A A . 38 GLU CB 1 1 16 9863 1 1 38 GLU CD C -0.086 3.779 9.158 1.00 . A A . 38 GLU CD 1 1 16 9864 1 1 38 GLU CG C -0.484 4.197 7.756 1.00 . A A . 38 GLU CG 1 1 16 9865 1 1 38 GLU H H -1.369 4.659 5.455 1.00 . A A . 38 GLU H 1 1 16 9866 1 1 38 GLU HA H 1.425 4.977 4.981 1.00 . A A . 38 GLU HA 1 1 16 9867 1 1 38 GLU HB2 H 1.594 4.516 7.462 1.00 . A A . 38 GLU HB2 1 1 16 9868 1 1 38 GLU HB3 H 0.576 5.876 7.007 1.00 . A A . 38 GLU HB3 1 1 16 9869 1 1 38 GLU HG2 H -1.275 4.928 7.827 1.00 . A A . 38 GLU HG2 1 1 16 9870 1 1 38 GLU HG3 H -0.844 3.328 7.226 1.00 . A A . 38 GLU HG3 1 1 16 9871 1 1 38 GLU N N -0.583 4.510 4.889 1.00 . A A . 38 GLU N 1 1 16 9872 1 1 38 GLU O O 0.979 2.117 6.353 1.00 . A A . 38 GLU O 1 1 16 9873 1 1 38 GLU OE1 O 0.269 2.596 9.347 1.00 . A A . 38 GLU OE1 1 1 16 9874 1 1 38 GLU OE2 O -0.128 4.634 10.067 1.00 . A A . 38 GLU OE2 1 1 16 9875 1 1 39 CYS C C 3.308 0.805 5.236 1.00 . A A . 39 CYS C 1 1 16 9876 1 1 39 CYS CA C 2.345 1.205 4.117 1.00 . A A . 39 CYS CA 1 1 16 9877 1 1 39 CYS CB C 3.051 1.103 2.764 1.00 . A A . 39 CYS CB 1 1 16 9878 1 1 39 CYS H H 1.984 3.232 3.624 1.00 . A A . 39 CYS H 1 1 16 9879 1 1 39 CYS HA H 1.500 0.534 4.123 1.00 . A A . 39 CYS HA 1 1 16 9880 1 1 39 CYS HB2 H 2.575 1.777 2.067 1.00 . A A . 39 CYS HB2 1 1 16 9881 1 1 39 CYS HB3 H 4.085 1.389 2.883 1.00 . A A . 39 CYS HB3 1 1 16 9882 1 1 39 CYS N N 1.842 2.559 4.322 1.00 . A A . 39 CYS N 1 1 16 9883 1 1 39 CYS O O 4.421 1.324 5.318 1.00 . A A . 39 CYS O 1 1 16 9884 1 1 39 CYS SG S 3.017 -0.565 2.030 1.00 . A A . 39 CYS SG 1 1 16 9885 1 1 40 PRO C C 5.113 -1.040 6.761 1.00 . A A . 40 PRO C 1 1 16 9886 1 1 40 PRO CA C 3.734 -0.587 7.227 1.00 . A A . 40 PRO CA 1 1 16 9887 1 1 40 PRO CB C 2.949 -1.768 7.802 1.00 . A A . 40 PRO CB 1 1 16 9888 1 1 40 PRO CD C 1.583 -0.803 6.097 1.00 . A A . 40 PRO CD 1 1 16 9889 1 1 40 PRO CG C 1.533 -1.502 7.427 1.00 . A A . 40 PRO CG 1 1 16 9890 1 1 40 PRO HA H 3.844 0.178 7.981 1.00 . A A . 40 PRO HA 1 1 16 9891 1 1 40 PRO HB2 H 3.308 -2.689 7.365 1.00 . A A . 40 PRO HB2 1 1 16 9892 1 1 40 PRO HB3 H 3.074 -1.799 8.874 1.00 . A A . 40 PRO HB3 1 1 16 9893 1 1 40 PRO HD2 H 1.531 -1.522 5.292 1.00 . A A . 40 PRO HD2 1 1 16 9894 1 1 40 PRO HD3 H 0.780 -0.086 6.017 1.00 . A A . 40 PRO HD3 1 1 16 9895 1 1 40 PRO HG2 H 0.994 -2.433 7.342 1.00 . A A . 40 PRO HG2 1 1 16 9896 1 1 40 PRO HG3 H 1.071 -0.865 8.167 1.00 . A A . 40 PRO HG3 1 1 16 9897 1 1 40 PRO N N 2.894 -0.127 6.115 1.00 . A A . 40 PRO N 1 1 16 9898 1 1 40 PRO O O 5.369 -1.152 5.562 1.00 . A A . 40 PRO O 1 1 16 9899 1 1 41 SER C C 7.536 -3.217 7.746 1.00 . A A . 41 SER C 1 1 16 9900 1 1 41 SER CA C 7.353 -1.742 7.406 1.00 . A A . 41 SER CA 1 1 16 9901 1 1 41 SER CB C 8.375 -0.899 8.170 1.00 . A A . 41 SER CB 1 1 16 9902 1 1 41 SER H H 5.735 -1.193 8.655 1.00 . A A . 41 SER H 1 1 16 9903 1 1 41 SER HA H 7.510 -1.607 6.346 1.00 . A A . 41 SER HA 1 1 16 9904 1 1 41 SER HB2 H 8.170 0.148 8.007 1.00 . A A . 41 SER HB2 1 1 16 9905 1 1 41 SER HB3 H 8.303 -1.120 9.225 1.00 . A A . 41 SER HB3 1 1 16 9906 1 1 41 SER HG H 9.749 -1.063 6.784 1.00 . A A . 41 SER HG 1 1 16 9907 1 1 41 SER N N 5.999 -1.300 7.717 1.00 . A A . 41 SER N 1 1 16 9908 1 1 41 SER O O 8.616 -3.640 8.161 1.00 . A A . 41 SER O 1 1 16 9909 1 1 41 SER OG O 9.695 -1.178 7.735 1.00 . A A . 41 SER OG 1 1 16 9910 1 1 42 TYR C C 6.558 -6.241 6.566 1.00 . A A . 42 TYR C 1 1 16 9911 1 1 42 TYR CA C 6.519 -5.426 7.856 1.00 . A A . 42 TYR CA 1 1 16 9912 1 1 42 TYR CB C 5.307 -5.835 8.695 1.00 . A A . 42 TYR CB 1 1 16 9913 1 1 42 TYR CD1 C 6.174 -5.518 11.045 1.00 . A A . 42 TYR CD1 1 1 16 9914 1 1 42 TYR CD2 C 4.303 -4.214 10.350 1.00 . A A . 42 TYR CD2 1 1 16 9915 1 1 42 TYR CE1 C 6.135 -4.919 12.290 1.00 . A A . 42 TYR CE1 1 1 16 9916 1 1 42 TYR CE2 C 4.258 -3.610 11.592 1.00 . A A . 42 TYR CE2 1 1 16 9917 1 1 42 TYR CG C 5.260 -5.177 10.056 1.00 . A A . 42 TYR CG 1 1 16 9918 1 1 42 TYR CZ C 5.175 -3.966 12.558 1.00 . A A . 42 TYR CZ 1 1 16 9919 1 1 42 TYR H H 5.642 -3.602 7.235 1.00 . A A . 42 TYR H 1 1 16 9920 1 1 42 TYR HA H 7.418 -5.622 8.420 1.00 . A A . 42 TYR HA 1 1 16 9921 1 1 42 TYR HB2 H 4.404 -5.566 8.166 1.00 . A A . 42 TYR HB2 1 1 16 9922 1 1 42 TYR HB3 H 5.326 -6.905 8.844 1.00 . A A . 42 TYR HB3 1 1 16 9923 1 1 42 TYR HD1 H 6.924 -6.265 10.831 1.00 . A A . 42 TYR HD1 1 1 16 9924 1 1 42 TYR HD2 H 3.585 -3.938 9.592 1.00 . A A . 42 TYR HD2 1 1 16 9925 1 1 42 TYR HE1 H 6.854 -5.198 13.046 1.00 . A A . 42 TYR HE1 1 1 16 9926 1 1 42 TYR HE2 H 3.506 -2.864 11.802 1.00 . A A . 42 TYR HE2 1 1 16 9927 1 1 42 TYR HH H 6.026 -3.165 14.085 1.00 . A A . 42 TYR HH 1 1 16 9928 1 1 42 TYR N N 6.475 -3.997 7.568 1.00 . A A . 42 TYR N 1 1 16 9929 1 1 42 TYR O O 5.519 -6.654 6.051 1.00 . A A . 42 TYR O 1 1 16 9930 1 1 42 TYR OH O 5.133 -3.367 13.796 1.00 . A A . 42 TYR OH 1 1 16 9931 1 1 43 PRO C C 7.616 -8.733 4.980 1.00 . A A . 43 PRO C 1 1 16 9932 1 1 43 PRO CA C 7.934 -7.254 4.789 1.00 . A A . 43 PRO CA 1 1 16 9933 1 1 43 PRO CB C 9.415 -7.065 4.452 1.00 . A A . 43 PRO CB 1 1 16 9934 1 1 43 PRO CD C 9.055 -6.028 6.575 1.00 . A A . 43 PRO CD 1 1 16 9935 1 1 43 PRO CG C 10.068 -6.784 5.761 1.00 . A A . 43 PRO CG 1 1 16 9936 1 1 43 PRO HA H 7.327 -6.857 3.989 1.00 . A A . 43 PRO HA 1 1 16 9937 1 1 43 PRO HB2 H 9.802 -7.968 4.001 1.00 . A A . 43 PRO HB2 1 1 16 9938 1 1 43 PRO HB3 H 9.529 -6.237 3.769 1.00 . A A . 43 PRO HB3 1 1 16 9939 1 1 43 PRO HD2 H 9.142 -6.287 7.620 1.00 . A A . 43 PRO HD2 1 1 16 9940 1 1 43 PRO HD3 H 9.178 -4.964 6.437 1.00 . A A . 43 PRO HD3 1 1 16 9941 1 1 43 PRO HG2 H 10.324 -7.713 6.250 1.00 . A A . 43 PRO HG2 1 1 16 9942 1 1 43 PRO HG3 H 10.951 -6.182 5.609 1.00 . A A . 43 PRO HG3 1 1 16 9943 1 1 43 PRO N N 7.764 -6.484 6.025 1.00 . A A . 43 PRO N 1 1 16 9944 1 1 43 PRO O O 7.312 -9.175 6.088 1.00 . A A . 43 PRO O 1 1 16 9945 1 1 44 GLY C C 7.953 -11.675 2.771 1.00 . A A . 44 GLY C 1 1 16 9946 1 1 44 GLY CA C 7.403 -10.915 3.962 1.00 . A A . 44 GLY CA 1 1 16 9947 1 1 44 GLY H H 7.934 -9.087 3.036 1.00 . A A . 44 GLY H 1 1 16 9948 1 1 44 GLY HA2 H 6.333 -11.056 4.002 1.00 . A A . 44 GLY HA2 1 1 16 9949 1 1 44 GLY HA3 H 7.842 -11.315 4.864 1.00 . A A . 44 GLY HA3 1 1 16 9950 1 1 44 GLY N N 7.687 -9.494 3.892 1.00 . A A . 44 GLY N 1 1 16 9951 1 1 44 GLY O O 7.968 -11.107 1.659 1.00 . A A . 44 GLY O 1 1 16 9952 1 1 44 GLY OXT O 8.370 -12.839 2.951 1.00 . A A . 44 GLY OXT 1 1 17 9953 1 1 1 ALA C C -15.762 12.603 3.534 1.00 . A A . 1 ALA C 1 1 17 9954 1 1 1 ALA CA C -16.477 11.776 4.597 1.00 . A A . 1 ALA CA 1 1 17 9955 1 1 1 ALA CB C -16.398 10.296 4.254 1.00 . A A . 1 ALA CB 1 1 17 9956 1 1 1 ALA H1 H -18.300 12.268 3.780 1.00 . A A . 1 ALA H1 1 1 17 9957 1 1 1 ALA H2 H -18.387 11.475 5.300 1.00 . A A . 1 ALA H2 1 1 17 9958 1 1 1 ALA H3 H -17.906 13.118 5.219 1.00 . A A . 1 ALA H3 1 1 17 9959 1 1 1 ALA HA H -15.983 11.927 5.546 1.00 . A A . 1 ALA HA 1 1 17 9960 1 1 1 ALA HB1 H -15.471 10.094 3.740 1.00 . A A . 1 ALA HB1 1 1 17 9961 1 1 1 ALA HB2 H -17.229 10.029 3.617 1.00 . A A . 1 ALA HB2 1 1 17 9962 1 1 1 ALA HB3 H -16.440 9.713 5.163 1.00 . A A . 1 ALA HB3 1 1 17 9963 1 1 1 ALA N N -17.895 12.197 4.737 1.00 . A A . 1 ALA N 1 1 17 9964 1 1 1 ALA O O -16.198 12.664 2.384 1.00 . A A . 1 ALA O 1 1 17 9965 1 1 2 MET C C -12.401 13.728 3.096 1.00 . A A . 2 MET C 1 1 17 9966 1 1 2 MET CA C -13.887 14.061 3.005 1.00 . A A . 2 MET CA 1 1 17 9967 1 1 2 MET CB C -14.108 15.545 3.306 1.00 . A A . 2 MET CB 1 1 17 9968 1 1 2 MET CE C -15.809 18.015 0.603 1.00 . A A . 2 MET CE 1 1 17 9969 1 1 2 MET CG C -14.074 16.428 2.069 1.00 . A A . 2 MET CG 1 1 17 9970 1 1 2 MET H H -14.365 13.150 4.855 1.00 . A A . 2 MET H 1 1 17 9971 1 1 2 MET HA H -14.230 13.851 2.003 1.00 . A A . 2 MET HA 1 1 17 9972 1 1 2 MET HB2 H -15.070 15.665 3.782 1.00 . A A . 2 MET HB2 1 1 17 9973 1 1 2 MET HB3 H -13.337 15.882 3.983 1.00 . A A . 2 MET HB3 1 1 17 9974 1 1 2 MET HE1 H -15.071 17.726 -0.131 1.00 . A A . 2 MET HE1 1 1 17 9975 1 1 2 MET HE2 H -16.662 17.356 0.535 1.00 . A A . 2 MET HE2 1 1 17 9976 1 1 2 MET HE3 H -16.124 19.031 0.416 1.00 . A A . 2 MET HE3 1 1 17 9977 1 1 2 MET HG2 H -13.054 16.733 1.889 1.00 . A A . 2 MET HG2 1 1 17 9978 1 1 2 MET HG3 H -14.432 15.856 1.226 1.00 . A A . 2 MET HG3 1 1 17 9979 1 1 2 MET N N -14.663 13.237 3.925 1.00 . A A . 2 MET N 1 1 17 9980 1 1 2 MET O O -11.635 14.436 3.750 1.00 . A A . 2 MET O 1 1 17 9981 1 1 2 MET SD S -15.096 17.903 2.242 1.00 . A A . 2 MET SD 1 1 17 9982 1 1 3 ASP C C -10.356 11.165 1.369 1.00 . A A . 3 ASP C 1 1 17 9983 1 1 3 ASP CA C -10.608 12.217 2.444 1.00 . A A . 3 ASP CA 1 1 17 9984 1 1 3 ASP CB C -10.230 11.660 3.817 1.00 . A A . 3 ASP CB 1 1 17 9985 1 1 3 ASP CG C -8.755 11.830 4.125 1.00 . A A . 3 ASP CG 1 1 17 9986 1 1 3 ASP H H -12.660 12.121 1.935 1.00 . A A . 3 ASP H 1 1 17 9987 1 1 3 ASP HA H -9.995 13.081 2.235 1.00 . A A . 3 ASP HA 1 1 17 9988 1 1 3 ASP HB2 H -10.799 12.175 4.577 1.00 . A A . 3 ASP HB2 1 1 17 9989 1 1 3 ASP HB3 H -10.467 10.606 3.849 1.00 . A A . 3 ASP HB3 1 1 17 9990 1 1 3 ASP N N -12.002 12.645 2.437 1.00 . A A . 3 ASP N 1 1 17 9991 1 1 3 ASP O O -11.093 10.185 1.261 1.00 . A A . 3 ASP O 1 1 17 9992 1 1 3 ASP OD1 O -8.120 12.715 3.514 1.00 . A A . 3 ASP OD1 1 1 17 9993 1 1 3 ASP OD2 O -8.236 11.080 4.978 1.00 . A A . 3 ASP OD2 1 1 17 9994 1 1 4 CYS C C -7.708 9.654 -0.137 1.00 . A A . 4 CYS C 1 1 17 9995 1 1 4 CYS CA C -8.963 10.445 -0.492 1.00 . A A . 4 CYS CA 1 1 17 9996 1 1 4 CYS CB C -8.749 11.199 -1.806 1.00 . A A . 4 CYS CB 1 1 17 9997 1 1 4 CYS H H -8.762 12.175 0.710 1.00 . A A . 4 CYS H 1 1 17 9998 1 1 4 CYS HA H -9.785 9.756 -0.613 1.00 . A A . 4 CYS HA 1 1 17 9999 1 1 4 CYS HB2 H -8.353 12.180 -1.589 1.00 . A A . 4 CYS HB2 1 1 17 10000 1 1 4 CYS HB3 H -8.038 10.656 -2.412 1.00 . A A . 4 CYS HB3 1 1 17 10001 1 1 4 CYS N N -9.312 11.375 0.575 1.00 . A A . 4 CYS N 1 1 17 10002 1 1 4 CYS O O -7.553 8.504 -0.546 1.00 . A A . 4 CYS O 1 1 17 10003 1 1 4 CYS SG S -10.265 11.421 -2.792 1.00 . A A . 4 CYS SG 1 1 17 10004 1 1 5 THR C C -4.754 9.200 -0.171 1.00 . A A . 5 THR C 1 1 17 10005 1 1 5 THR CA C -5.573 9.636 1.040 1.00 . A A . 5 THR CA 1 1 17 10006 1 1 5 THR CB C -5.865 8.430 1.936 1.00 . A A . 5 THR CB 1 1 17 10007 1 1 5 THR CG2 C -6.959 8.686 2.952 1.00 . A A . 5 THR CG2 1 1 17 10008 1 1 5 THR H H -7.000 11.196 0.920 1.00 . A A . 5 THR H 1 1 17 10009 1 1 5 THR HA H -5.001 10.359 1.603 1.00 . A A . 5 THR HA 1 1 17 10010 1 1 5 THR HB H -4.966 8.172 2.478 1.00 . A A . 5 THR HB 1 1 17 10011 1 1 5 THR HG1 H -6.423 6.563 1.740 1.00 . A A . 5 THR HG1 1 1 17 10012 1 1 5 THR HG21 H -6.846 9.680 3.359 1.00 . A A . 5 THR HG21 1 1 17 10013 1 1 5 THR HG22 H -7.923 8.601 2.472 1.00 . A A . 5 THR HG22 1 1 17 10014 1 1 5 THR HG23 H -6.888 7.961 3.748 1.00 . A A . 5 THR HG23 1 1 17 10015 1 1 5 THR N N -6.817 10.279 0.627 1.00 . A A . 5 THR N 1 1 17 10016 1 1 5 THR O O -5.122 8.262 -0.877 1.00 . A A . 5 THR O 1 1 17 10017 1 1 5 THR OG1 O -6.253 7.310 1.161 1.00 . A A . 5 THR OG1 1 1 17 10018 1 1 6 THR C C -1.585 8.722 -1.078 1.00 . A A . 6 THR C 1 1 17 10019 1 1 6 THR CA C -2.769 9.571 -1.529 1.00 . A A . 6 THR CA 1 1 17 10020 1 1 6 THR CB C -2.267 10.856 -2.189 1.00 . A A . 6 THR CB 1 1 17 10021 1 1 6 THR CG2 C -3.308 11.528 -3.059 1.00 . A A . 6 THR CG2 1 1 17 10022 1 1 6 THR H H -3.400 10.625 0.195 1.00 . A A . 6 THR H 1 1 17 10023 1 1 6 THR HA H -3.346 9.009 -2.248 1.00 . A A . 6 THR HA 1 1 17 10024 1 1 6 THR HB H -1.417 10.620 -2.814 1.00 . A A . 6 THR HB 1 1 17 10025 1 1 6 THR HG1 H -1.291 11.358 -0.567 1.00 . A A . 6 THR HG1 1 1 17 10026 1 1 6 THR HG21 H -4.291 11.347 -2.649 1.00 . A A . 6 THR HG21 1 1 17 10027 1 1 6 THR HG22 H -3.121 12.591 -3.089 1.00 . A A . 6 THR HG22 1 1 17 10028 1 1 6 THR HG23 H -3.255 11.125 -4.060 1.00 . A A . 6 THR HG23 1 1 17 10029 1 1 6 THR N N -3.641 9.887 -0.404 1.00 . A A . 6 THR N 1 1 17 10030 1 1 6 THR O O -1.151 8.805 0.071 1.00 . A A . 6 THR O 1 1 17 10031 1 1 6 THR OG1 O -1.854 11.794 -1.212 1.00 . A A . 6 THR OG1 1 1 17 10032 1 1 7 GLY C C 0.131 5.821 -2.548 1.00 . A A . 7 GLY C 1 1 17 10033 1 1 7 GLY CA C 0.062 7.054 -1.666 1.00 . A A . 7 GLY CA 1 1 17 10034 1 1 7 GLY H H -1.454 7.882 -2.890 1.00 . A A . 7 GLY H 1 1 17 10035 1 1 7 GLY HA2 H -0.020 6.741 -0.636 1.00 . A A . 7 GLY HA2 1 1 17 10036 1 1 7 GLY HA3 H 0.974 7.621 -1.788 1.00 . A A . 7 GLY HA3 1 1 17 10037 1 1 7 GLY N N -1.067 7.906 -1.990 1.00 . A A . 7 GLY N 1 1 17 10038 1 1 7 GLY O O -0.674 5.668 -3.467 1.00 . A A . 7 GLY O 1 1 17 10039 1 1 8 PRO C C 0.126 2.688 -2.826 1.00 . A A . 8 PRO C 1 1 17 10040 1 1 8 PRO CA C 1.249 3.688 -3.078 1.00 . A A . 8 PRO CA 1 1 17 10041 1 1 8 PRO CB C 2.586 3.125 -2.591 1.00 . A A . 8 PRO CB 1 1 17 10042 1 1 8 PRO CD C 2.094 5.016 -1.214 1.00 . A A . 8 PRO CD 1 1 17 10043 1 1 8 PRO CG C 2.739 3.658 -1.209 1.00 . A A . 8 PRO CG 1 1 17 10044 1 1 8 PRO HA H 1.309 3.901 -4.135 1.00 . A A . 8 PRO HA 1 1 17 10045 1 1 8 PRO HB2 H 2.548 2.045 -2.598 1.00 . A A . 8 PRO HB2 1 1 17 10046 1 1 8 PRO HB3 H 3.381 3.468 -3.236 1.00 . A A . 8 PRO HB3 1 1 17 10047 1 1 8 PRO HD2 H 1.620 5.213 -0.264 1.00 . A A . 8 PRO HD2 1 1 17 10048 1 1 8 PRO HD3 H 2.823 5.780 -1.439 1.00 . A A . 8 PRO HD3 1 1 17 10049 1 1 8 PRO HG2 H 2.238 3.007 -0.507 1.00 . A A . 8 PRO HG2 1 1 17 10050 1 1 8 PRO HG3 H 3.787 3.742 -0.962 1.00 . A A . 8 PRO HG3 1 1 17 10051 1 1 8 PRO N N 1.090 4.915 -2.291 1.00 . A A . 8 PRO N 1 1 17 10052 1 1 8 PRO O O -0.212 1.886 -3.697 1.00 . A A . 8 PRO O 1 1 17 10053 1 1 9 CYS C C -2.891 2.491 -1.510 1.00 . A A . 9 CYS C 1 1 17 10054 1 1 9 CYS CA C -1.534 1.838 -1.262 1.00 . A A . 9 CYS CA 1 1 17 10055 1 1 9 CYS CB C -1.407 1.425 0.206 1.00 . A A . 9 CYS CB 1 1 17 10056 1 1 9 CYS H H -0.135 3.400 -0.976 1.00 . A A . 9 CYS H 1 1 17 10057 1 1 9 CYS HA H -1.455 0.957 -1.882 1.00 . A A . 9 CYS HA 1 1 17 10058 1 1 9 CYS HB2 H -0.885 2.200 0.746 1.00 . A A . 9 CYS HB2 1 1 17 10059 1 1 9 CYS HB3 H -2.394 1.303 0.626 1.00 . A A . 9 CYS HB3 1 1 17 10060 1 1 9 CYS N N -0.448 2.740 -1.629 1.00 . A A . 9 CYS N 1 1 17 10061 1 1 9 CYS O O -3.787 2.431 -0.667 1.00 . A A . 9 CYS O 1 1 17 10062 1 1 9 CYS SG S -0.499 -0.133 0.464 1.00 . A A . 9 CYS SG 1 1 17 10063 1 1 10 CYS C C -4.189 4.366 -4.444 1.00 . A A . 10 CYS C 1 1 17 10064 1 1 10 CYS CA C -4.282 3.779 -3.040 1.00 . A A . 10 CYS CA 1 1 17 10065 1 1 10 CYS CB C -4.619 4.883 -2.032 1.00 . A A . 10 CYS CB 1 1 17 10066 1 1 10 CYS H H -2.286 3.127 -3.305 1.00 . A A . 10 CYS H 1 1 17 10067 1 1 10 CYS HA H -5.067 3.039 -3.025 1.00 . A A . 10 CYS HA 1 1 17 10068 1 1 10 CYS HB2 H -5.285 5.593 -2.498 1.00 . A A . 10 CYS HB2 1 1 17 10069 1 1 10 CYS HB3 H -5.116 4.440 -1.180 1.00 . A A . 10 CYS HB3 1 1 17 10070 1 1 10 CYS N N -3.036 3.114 -2.674 1.00 . A A . 10 CYS N 1 1 17 10071 1 1 10 CYS O O -3.337 5.211 -4.720 1.00 . A A . 10 CYS O 1 1 17 10072 1 1 10 CYS SG S -3.174 5.806 -1.414 1.00 . A A . 10 CYS SG 1 1 17 10073 1 1 11 ARG C C -5.182 5.908 -6.773 1.00 . A A . 11 ARG C 1 1 17 10074 1 1 11 ARG CA C -5.078 4.382 -6.714 1.00 . A A . 11 ARG CA 1 1 17 10075 1 1 11 ARG CB C -6.221 3.730 -7.507 1.00 . A A . 11 ARG CB 1 1 17 10076 1 1 11 ARG CD C -7.525 1.972 -6.266 1.00 . A A . 11 ARG CD 1 1 17 10077 1 1 11 ARG CG C -7.465 3.434 -6.680 1.00 . A A . 11 ARG CG 1 1 17 10078 1 1 11 ARG CZ C -9.521 1.228 -7.506 1.00 . A A . 11 ARG CZ 1 1 17 10079 1 1 11 ARG H H -5.716 3.229 -5.052 1.00 . A A . 11 ARG H 1 1 17 10080 1 1 11 ARG HA H -4.141 4.091 -7.161 1.00 . A A . 11 ARG HA 1 1 17 10081 1 1 11 ARG HB2 H -6.504 4.391 -8.313 1.00 . A A . 11 ARG HB2 1 1 17 10082 1 1 11 ARG HB3 H -5.865 2.800 -7.926 1.00 . A A . 11 ARG HB3 1 1 17 10083 1 1 11 ARG HD2 H -6.877 1.400 -6.914 1.00 . A A . 11 ARG HD2 1 1 17 10084 1 1 11 ARG HD3 H -7.181 1.885 -5.246 1.00 . A A . 11 ARG HD3 1 1 17 10085 1 1 11 ARG HE H -9.337 1.212 -5.519 1.00 . A A . 11 ARG HE 1 1 17 10086 1 1 11 ARG HG2 H -7.449 4.048 -5.792 1.00 . A A . 11 ARG HG2 1 1 17 10087 1 1 11 ARG HG3 H -8.340 3.669 -7.267 1.00 . A A . 11 ARG HG3 1 1 17 10088 1 1 11 ARG HH11 H -8.007 1.888 -8.674 1.00 . A A . 11 ARG HH11 1 1 17 10089 1 1 11 ARG HH12 H -9.421 1.359 -9.521 1.00 . A A . 11 ARG HH12 1 1 17 10090 1 1 11 ARG HH21 H -11.198 0.516 -6.631 1.00 . A A . 11 ARG HH21 1 1 17 10091 1 1 11 ARG HH22 H -11.233 0.581 -8.362 1.00 . A A . 11 ARG HH22 1 1 17 10092 1 1 11 ARG N N -5.066 3.907 -5.332 1.00 . A A . 11 ARG N 1 1 17 10093 1 1 11 ARG NE N -8.880 1.433 -6.357 1.00 . A A . 11 ARG NE 1 1 17 10094 1 1 11 ARG NH1 N -8.934 1.515 -8.661 1.00 . A A . 11 ARG NH1 1 1 17 10095 1 1 11 ARG NH2 N -10.751 0.734 -7.499 1.00 . A A . 11 ARG NH2 1 1 17 10096 1 1 11 ARG O O -4.167 6.603 -6.757 1.00 . A A . 11 ARG O 1 1 17 10097 1 1 12 GLN C C -7.448 8.358 -5.723 1.00 . A A . 12 GLN C 1 1 17 10098 1 1 12 GLN CA C -6.620 7.868 -6.909 1.00 . A A . 12 GLN CA 1 1 17 10099 1 1 12 GLN CB C -7.316 8.241 -8.219 1.00 . A A . 12 GLN CB 1 1 17 10100 1 1 12 GLN CD C -5.488 9.380 -9.538 1.00 . A A . 12 GLN CD 1 1 17 10101 1 1 12 GLN CG C -6.404 8.176 -9.433 1.00 . A A . 12 GLN CG 1 1 17 10102 1 1 12 GLN H H -7.181 5.830 -6.858 1.00 . A A . 12 GLN H 1 1 17 10103 1 1 12 GLN HA H -5.653 8.347 -6.879 1.00 . A A . 12 GLN HA 1 1 17 10104 1 1 12 GLN HB2 H -8.142 7.565 -8.380 1.00 . A A . 12 GLN HB2 1 1 17 10105 1 1 12 GLN HB3 H -7.698 9.248 -8.136 1.00 . A A . 12 GLN HB3 1 1 17 10106 1 1 12 GLN HE21 H -4.797 8.732 -11.287 1.00 . A A . 12 GLN HE21 1 1 17 10107 1 1 12 GLN HE22 H -4.125 10.218 -10.718 1.00 . A A . 12 GLN HE22 1 1 17 10108 1 1 12 GLN HG2 H -5.796 7.286 -9.363 1.00 . A A . 12 GLN HG2 1 1 17 10109 1 1 12 GLN HG3 H -7.013 8.127 -10.323 1.00 . A A . 12 GLN HG3 1 1 17 10110 1 1 12 GLN N N -6.406 6.426 -6.845 1.00 . A A . 12 GLN N 1 1 17 10111 1 1 12 GLN NE2 N -4.726 9.451 -10.624 1.00 . A A . 12 GLN NE2 1 1 17 10112 1 1 12 GLN O O -7.419 9.542 -5.386 1.00 . A A . 12 GLN O 1 1 17 10113 1 1 12 GLN OE1 O -5.465 10.237 -8.655 1.00 . A A . 12 GLN OE1 1 1 17 10114 1 1 13 CYS C C -9.702 6.565 -3.370 1.00 . A A . 13 CYS C 1 1 17 10115 1 1 13 CYS CA C -9.020 7.800 -3.951 1.00 . A A . 13 CYS CA 1 1 17 10116 1 1 13 CYS CB C -10.072 8.832 -4.363 1.00 . A A . 13 CYS CB 1 1 17 10117 1 1 13 CYS H H -8.172 6.519 -5.407 1.00 . A A . 13 CYS H 1 1 17 10118 1 1 13 CYS HA H -8.381 8.232 -3.196 1.00 . A A . 13 CYS HA 1 1 17 10119 1 1 13 CYS HB2 H -9.585 9.646 -4.877 1.00 . A A . 13 CYS HB2 1 1 17 10120 1 1 13 CYS HB3 H -10.781 8.364 -5.031 1.00 . A A . 13 CYS HB3 1 1 17 10121 1 1 13 CYS N N -8.186 7.447 -5.095 1.00 . A A . 13 CYS N 1 1 17 10122 1 1 13 CYS O O -10.852 6.628 -2.933 1.00 . A A . 13 CYS O 1 1 17 10123 1 1 13 CYS SG S -11.008 9.540 -2.969 1.00 . A A . 13 CYS SG 1 1 17 10124 1 1 14 LYS C C -8.418 3.281 -2.350 1.00 . A A . 14 LYS C 1 1 17 10125 1 1 14 LYS CA C -9.534 4.199 -2.835 1.00 . A A . 14 LYS CA 1 1 17 10126 1 1 14 LYS CB C -10.367 3.486 -3.902 1.00 . A A . 14 LYS CB 1 1 17 10127 1 1 14 LYS CD C -10.887 1.103 -3.299 1.00 . A A . 14 LYS CD 1 1 17 10128 1 1 14 LYS CE C -11.622 0.267 -2.263 1.00 . A A . 14 LYS CE 1 1 17 10129 1 1 14 LYS CG C -11.403 2.532 -3.329 1.00 . A A . 14 LYS CG 1 1 17 10130 1 1 14 LYS H H -8.078 5.450 -3.726 1.00 . A A . 14 LYS H 1 1 17 10131 1 1 14 LYS HA H -10.171 4.445 -1.999 1.00 . A A . 14 LYS HA 1 1 17 10132 1 1 14 LYS HB2 H -10.882 4.228 -4.495 1.00 . A A . 14 LYS HB2 1 1 17 10133 1 1 14 LYS HB3 H -9.706 2.922 -4.543 1.00 . A A . 14 LYS HB3 1 1 17 10134 1 1 14 LYS HD2 H -11.029 0.658 -4.272 1.00 . A A . 14 LYS HD2 1 1 17 10135 1 1 14 LYS HD3 H -9.834 1.116 -3.057 1.00 . A A . 14 LYS HD3 1 1 17 10136 1 1 14 LYS HE2 H -11.109 0.356 -1.317 1.00 . A A . 14 LYS HE2 1 1 17 10137 1 1 14 LYS HE3 H -12.629 0.646 -2.163 1.00 . A A . 14 LYS HE3 1 1 17 10138 1 1 14 LYS HG2 H -11.642 2.839 -2.322 1.00 . A A . 14 LYS HG2 1 1 17 10139 1 1 14 LYS HG3 H -12.292 2.572 -3.941 1.00 . A A . 14 LYS HG3 1 1 17 10140 1 1 14 LYS HZ1 H -12.135 -1.273 -3.578 1.00 . A A . 14 LYS HZ1 1 1 17 10141 1 1 14 LYS HZ2 H -10.720 -1.565 -2.700 1.00 . A A . 14 LYS HZ2 1 1 17 10142 1 1 14 LYS HZ3 H -12.227 -1.707 -1.945 1.00 . A A . 14 LYS HZ3 1 1 17 10143 1 1 14 LYS N N -8.990 5.442 -3.365 1.00 . A A . 14 LYS N 1 1 17 10144 1 1 14 LYS NZ N -11.680 -1.170 -2.648 1.00 . A A . 14 LYS NZ 1 1 17 10145 1 1 14 LYS O O -7.394 3.128 -3.015 1.00 . A A . 14 LYS O 1 1 17 10146 1 1 15 LEU C C -7.262 0.671 -1.607 1.00 . A A . 15 LEU C 1 1 17 10147 1 1 15 LEU CA C -7.632 1.767 -0.613 1.00 . A A . 15 LEU CA 1 1 17 10148 1 1 15 LEU CB C -8.166 1.143 0.678 1.00 . A A . 15 LEU CB 1 1 17 10149 1 1 15 LEU CD1 C -9.252 1.475 2.913 1.00 . A A . 15 LEU CD1 1 1 17 10150 1 1 15 LEU CD2 C -7.123 2.670 2.369 1.00 . A A . 15 LEU CD2 1 1 17 10151 1 1 15 LEU CG C -8.433 2.133 1.813 1.00 . A A . 15 LEU CG 1 1 17 10152 1 1 15 LEU H H -9.460 2.833 -0.703 1.00 . A A . 15 LEU H 1 1 17 10153 1 1 15 LEU HA H -6.749 2.344 -0.385 1.00 . A A . 15 LEU HA 1 1 17 10154 1 1 15 LEU HB2 H -9.090 0.630 0.450 1.00 . A A . 15 LEU HB2 1 1 17 10155 1 1 15 LEU HB3 H -7.448 0.417 1.026 1.00 . A A . 15 LEU HB3 1 1 17 10156 1 1 15 LEU HD11 H -8.982 0.432 2.988 1.00 . A A . 15 LEU HD11 1 1 17 10157 1 1 15 LEU HD12 H -9.052 1.967 3.854 1.00 . A A . 15 LEU HD12 1 1 17 10158 1 1 15 LEU HD13 H -10.303 1.559 2.679 1.00 . A A . 15 LEU HD13 1 1 17 10159 1 1 15 LEU HD21 H -6.415 1.860 2.467 1.00 . A A . 15 LEU HD21 1 1 17 10160 1 1 15 LEU HD22 H -6.726 3.416 1.697 1.00 . A A . 15 LEU HD22 1 1 17 10161 1 1 15 LEU HD23 H -7.298 3.114 3.338 1.00 . A A . 15 LEU HD23 1 1 17 10162 1 1 15 LEU HG H -9.001 2.967 1.428 1.00 . A A . 15 LEU HG 1 1 17 10163 1 1 15 LEU N N -8.623 2.672 -1.186 1.00 . A A . 15 LEU N 1 1 17 10164 1 1 15 LEU O O -8.122 -0.085 -2.061 1.00 . A A . 15 LEU O 1 1 17 10165 1 1 16 LYS C C -5.999 -1.805 -2.517 1.00 . A A . 16 LYS C 1 1 17 10166 1 1 16 LYS CA C -5.494 -0.410 -2.888 1.00 . A A . 16 LYS CA 1 1 17 10167 1 1 16 LYS CB C -3.964 -0.401 -2.933 1.00 . A A . 16 LYS CB 1 1 17 10168 1 1 16 LYS CD C -1.980 -0.271 -4.470 1.00 . A A . 16 LYS CD 1 1 17 10169 1 1 16 LYS CE C -1.386 0.398 -5.699 1.00 . A A . 16 LYS CE 1 1 17 10170 1 1 16 LYS CG C -3.397 0.211 -4.204 1.00 . A A . 16 LYS CG 1 1 17 10171 1 1 16 LYS H H -5.341 1.224 -1.550 1.00 . A A . 16 LYS H 1 1 17 10172 1 1 16 LYS HA H -5.875 -0.151 -3.865 1.00 . A A . 16 LYS HA 1 1 17 10173 1 1 16 LYS HB2 H -3.594 0.166 -2.091 1.00 . A A . 16 LYS HB2 1 1 17 10174 1 1 16 LYS HB3 H -3.604 -1.417 -2.857 1.00 . A A . 16 LYS HB3 1 1 17 10175 1 1 16 LYS HD2 H -1.365 -0.039 -3.614 1.00 . A A . 16 LYS HD2 1 1 17 10176 1 1 16 LYS HD3 H -1.997 -1.339 -4.625 1.00 . A A . 16 LYS HD3 1 1 17 10177 1 1 16 LYS HE2 H -1.987 0.142 -6.559 1.00 . A A . 16 LYS HE2 1 1 17 10178 1 1 16 LYS HE3 H -1.404 1.469 -5.554 1.00 . A A . 16 LYS HE3 1 1 17 10179 1 1 16 LYS HG2 H -4.024 -0.069 -5.037 1.00 . A A . 16 LYS HG2 1 1 17 10180 1 1 16 LYS HG3 H -3.390 1.286 -4.102 1.00 . A A . 16 LYS HG3 1 1 17 10181 1 1 16 LYS HZ1 H 0.075 -1.073 -5.951 1.00 . A A . 16 LYS HZ1 1 1 17 10182 1 1 16 LYS HZ2 H 0.349 0.327 -6.860 1.00 . A A . 16 LYS HZ2 1 1 17 10183 1 1 16 LYS HZ3 H 0.640 0.331 -5.194 1.00 . A A . 16 LYS HZ3 1 1 17 10184 1 1 16 LYS N N -5.978 0.592 -1.943 1.00 . A A . 16 LYS N 1 1 17 10185 1 1 16 LYS NZ N 0.017 -0.035 -5.943 1.00 . A A . 16 LYS NZ 1 1 17 10186 1 1 16 LYS O O -6.494 -2.020 -1.411 1.00 . A A . 16 LYS O 1 1 17 10187 1 1 17 PRO C C -5.503 -4.850 -2.131 1.00 . A A . 17 PRO C 1 1 17 10188 1 1 17 PRO CA C -6.327 -4.150 -3.206 1.00 . A A . 17 PRO CA 1 1 17 10189 1 1 17 PRO CB C -6.127 -4.832 -4.563 1.00 . A A . 17 PRO CB 1 1 17 10190 1 1 17 PRO CD C -5.301 -2.602 -4.787 1.00 . A A . 17 PRO CD 1 1 17 10191 1 1 17 PRO CG C -5.090 -4.016 -5.253 1.00 . A A . 17 PRO CG 1 1 17 10192 1 1 17 PRO HA H -7.372 -4.183 -2.934 1.00 . A A . 17 PRO HA 1 1 17 10193 1 1 17 PRO HB2 H -5.795 -5.848 -4.411 1.00 . A A . 17 PRO HB2 1 1 17 10194 1 1 17 PRO HB3 H -7.058 -4.830 -5.110 1.00 . A A . 17 PRO HB3 1 1 17 10195 1 1 17 PRO HD2 H -4.358 -2.077 -4.739 1.00 . A A . 17 PRO HD2 1 1 17 10196 1 1 17 PRO HD3 H -5.989 -2.088 -5.441 1.00 . A A . 17 PRO HD3 1 1 17 10197 1 1 17 PRO HG2 H -4.105 -4.360 -4.973 1.00 . A A . 17 PRO HG2 1 1 17 10198 1 1 17 PRO HG3 H -5.222 -4.081 -6.322 1.00 . A A . 17 PRO HG3 1 1 17 10199 1 1 17 PRO N N -5.879 -2.773 -3.442 1.00 . A A . 17 PRO N 1 1 17 10200 1 1 17 PRO O O -4.299 -5.050 -2.290 1.00 . A A . 17 PRO O 1 1 17 10201 1 1 18 ALA C C -4.917 -7.241 -0.387 1.00 . A A . 18 ALA C 1 1 17 10202 1 1 18 ALA CA C -5.490 -5.901 0.063 1.00 . A A . 18 ALA CA 1 1 17 10203 1 1 18 ALA CB C -6.452 -6.101 1.225 1.00 . A A . 18 ALA CB 1 1 17 10204 1 1 18 ALA H H -7.120 -5.035 -0.971 1.00 . A A . 18 ALA H 1 1 17 10205 1 1 18 ALA HA H -4.680 -5.270 0.401 1.00 . A A . 18 ALA HA 1 1 17 10206 1 1 18 ALA HB1 H -7.218 -5.340 1.192 1.00 . A A . 18 ALA HB1 1 1 17 10207 1 1 18 ALA HB2 H -6.910 -7.076 1.149 1.00 . A A . 18 ALA HB2 1 1 17 10208 1 1 18 ALA HB3 H -5.911 -6.028 2.157 1.00 . A A . 18 ALA HB3 1 1 17 10209 1 1 18 ALA N N -6.161 -5.222 -1.038 1.00 . A A . 18 ALA N 1 1 17 10210 1 1 18 ALA O O -5.644 -8.105 -0.877 1.00 . A A . 18 ALA O 1 1 17 10211 1 1 19 GLY C C -2.069 -8.466 -1.828 1.00 . A A . 19 GLY C 1 1 17 10212 1 1 19 GLY CA C -2.961 -8.642 -0.616 1.00 . A A . 19 GLY CA 1 1 17 10213 1 1 19 GLY H H -3.080 -6.682 0.175 1.00 . A A . 19 GLY H 1 1 17 10214 1 1 19 GLY HA2 H -3.719 -9.377 -0.844 1.00 . A A . 19 GLY HA2 1 1 17 10215 1 1 19 GLY HA3 H -2.362 -9.002 0.208 1.00 . A A . 19 GLY HA3 1 1 17 10216 1 1 19 GLY N N -3.609 -7.406 -0.220 1.00 . A A . 19 GLY N 1 1 17 10217 1 1 19 GLY O O -1.873 -9.400 -2.605 1.00 . A A . 19 GLY O 1 1 17 10218 1 1 20 THR C C 0.716 -6.499 -2.631 1.00 . A A . 20 THR C 1 1 17 10219 1 1 20 THR CA C -0.651 -6.963 -3.117 1.00 . A A . 20 THR CA 1 1 17 10220 1 1 20 THR CB C -1.282 -5.894 -4.013 1.00 . A A . 20 THR CB 1 1 17 10221 1 1 20 THR CG2 C -1.337 -4.524 -3.371 1.00 . A A . 20 THR CG2 1 1 17 10222 1 1 20 THR H H -1.722 -6.559 -1.337 1.00 . A A . 20 THR H 1 1 17 10223 1 1 20 THR HA H -0.524 -7.870 -3.690 1.00 . A A . 20 THR HA 1 1 17 10224 1 1 20 THR HB H -2.294 -6.190 -4.248 1.00 . A A . 20 THR HB 1 1 17 10225 1 1 20 THR HG1 H -0.956 -6.339 -5.892 1.00 . A A . 20 THR HG1 1 1 17 10226 1 1 20 THR HG21 H -0.368 -4.278 -2.962 1.00 . A A . 20 THR HG21 1 1 17 10227 1 1 20 THR HG22 H -1.611 -3.789 -4.114 1.00 . A A . 20 THR HG22 1 1 17 10228 1 1 20 THR HG23 H -2.072 -4.527 -2.580 1.00 . A A . 20 THR HG23 1 1 17 10229 1 1 20 THR N N -1.528 -7.263 -1.991 1.00 . A A . 20 THR N 1 1 17 10230 1 1 20 THR O O 0.936 -6.329 -1.432 1.00 . A A . 20 THR O 1 1 17 10231 1 1 20 THR OG1 O -0.562 -5.770 -5.227 1.00 . A A . 20 THR OG1 1 1 17 10232 1 1 21 THR C C 3.087 -4.331 -3.327 1.00 . A A . 21 THR C 1 1 17 10233 1 1 21 THR CA C 2.979 -5.851 -3.239 1.00 . A A . 21 THR CA 1 1 17 10234 1 1 21 THR CB C 4.001 -6.505 -4.172 1.00 . A A . 21 THR CB 1 1 17 10235 1 1 21 THR CG2 C 5.056 -7.301 -3.436 1.00 . A A . 21 THR CG2 1 1 17 10236 1 1 21 THR H H 1.394 -6.451 -4.508 1.00 . A A . 21 THR H 1 1 17 10237 1 1 21 THR HA H 3.186 -6.155 -2.224 1.00 . A A . 21 THR HA 1 1 17 10238 1 1 21 THR HB H 4.504 -5.734 -4.737 1.00 . A A . 21 THR HB 1 1 17 10239 1 1 21 THR HG1 H 3.225 -6.927 -5.920 1.00 . A A . 21 THR HG1 1 1 17 10240 1 1 21 THR HG21 H 4.629 -7.719 -2.536 1.00 . A A . 21 THR HG21 1 1 17 10241 1 1 21 THR HG22 H 5.412 -8.100 -4.070 1.00 . A A . 21 THR HG22 1 1 17 10242 1 1 21 THR HG23 H 5.880 -6.654 -3.176 1.00 . A A . 21 THR HG23 1 1 17 10243 1 1 21 THR N N 1.631 -6.296 -3.570 1.00 . A A . 21 THR N 1 1 17 10244 1 1 21 THR O O 2.500 -3.707 -4.211 1.00 . A A . 21 THR O 1 1 17 10245 1 1 21 THR OG1 O 3.363 -7.380 -5.086 1.00 . A A . 21 THR OG1 1 1 17 10246 1 1 22 CYS C C 5.317 -1.901 -3.087 1.00 . A A . 22 CYS C 1 1 17 10247 1 1 22 CYS CA C 4.027 -2.296 -2.377 1.00 . A A . 22 CYS CA 1 1 17 10248 1 1 22 CYS CB C 4.049 -1.791 -0.933 1.00 . A A . 22 CYS CB 1 1 17 10249 1 1 22 CYS H H 4.283 -4.294 -1.725 1.00 . A A . 22 CYS H 1 1 17 10250 1 1 22 CYS HA H 3.193 -1.845 -2.894 1.00 . A A . 22 CYS HA 1 1 17 10251 1 1 22 CYS HB2 H 3.116 -2.047 -0.455 1.00 . A A . 22 CYS HB2 1 1 17 10252 1 1 22 CYS HB3 H 4.861 -2.270 -0.405 1.00 . A A . 22 CYS HB3 1 1 17 10253 1 1 22 CYS N N 3.841 -3.742 -2.404 1.00 . A A . 22 CYS N 1 1 17 10254 1 1 22 CYS O O 5.288 -1.322 -4.173 1.00 . A A . 22 CYS O 1 1 17 10255 1 1 22 CYS SG S 4.272 0.011 -0.778 1.00 . A A . 22 CYS SG 1 1 17 10256 1 1 23 TRP C C 8.632 -3.139 -3.117 1.00 . A A . 23 TRP C 1 1 17 10257 1 1 23 TRP CA C 7.751 -1.897 -3.039 1.00 . A A . 23 TRP CA 1 1 17 10258 1 1 23 TRP CB C 8.445 -0.817 -2.207 1.00 . A A . 23 TRP CB 1 1 17 10259 1 1 23 TRP CD1 C 10.006 -0.012 -4.073 1.00 . A A . 23 TRP CD1 1 1 17 10260 1 1 23 TRP CD2 C 11.002 -0.255 -2.082 1.00 . A A . 23 TRP CD2 1 1 17 10261 1 1 23 TRP CE2 C 11.961 0.188 -3.012 1.00 . A A . 23 TRP CE2 1 1 17 10262 1 1 23 TRP CE3 C 11.398 -0.477 -0.760 1.00 . A A . 23 TRP CE3 1 1 17 10263 1 1 23 TRP CG C 9.757 -0.376 -2.781 1.00 . A A . 23 TRP CG 1 1 17 10264 1 1 23 TRP CH2 C 13.649 0.187 -1.362 1.00 . A A . 23 TRP CH2 1 1 17 10265 1 1 23 TRP CZ2 C 13.290 0.413 -2.662 1.00 . A A . 23 TRP CZ2 1 1 17 10266 1 1 23 TRP CZ3 C 12.717 -0.254 -0.414 1.00 . A A . 23 TRP CZ3 1 1 17 10267 1 1 23 TRP H H 6.408 -2.679 -1.603 1.00 . A A . 23 TRP H 1 1 17 10268 1 1 23 TRP HA H 7.591 -1.521 -4.038 1.00 . A A . 23 TRP HA 1 1 17 10269 1 1 23 TRP HB2 H 7.802 0.048 -2.143 1.00 . A A . 23 TRP HB2 1 1 17 10270 1 1 23 TRP HB3 H 8.626 -1.199 -1.213 1.00 . A A . 23 TRP HB3 1 1 17 10271 1 1 23 TRP HD1 H 9.261 0.002 -4.855 1.00 . A A . 23 TRP HD1 1 1 17 10272 1 1 23 TRP HE1 H 11.750 0.626 -5.054 1.00 . A A . 23 TRP HE1 1 1 17 10273 1 1 23 TRP HE3 H 10.693 -0.818 -0.016 1.00 . A A . 23 TRP HE3 1 1 17 10274 1 1 23 TRP HH2 H 14.670 0.348 -1.047 1.00 . A A . 23 TRP HH2 1 1 17 10275 1 1 23 TRP HZ2 H 14.020 0.754 -3.381 1.00 . A A . 23 TRP HZ2 1 1 17 10276 1 1 23 TRP HZ3 H 13.042 -0.421 0.603 1.00 . A A . 23 TRP HZ3 1 1 17 10277 1 1 23 TRP N N 6.449 -2.218 -2.467 1.00 . A A . 23 TRP N 1 1 17 10278 1 1 23 TRP NE1 N 11.329 0.329 -4.220 1.00 . A A . 23 TRP NE1 1 1 17 10279 1 1 23 TRP O O 9.373 -3.447 -2.183 1.00 . A A . 23 TRP O 1 1 17 10280 1 1 24 ARG C C 10.769 -4.716 -4.829 1.00 . A A . 24 ARG C 1 1 17 10281 1 1 24 ARG CA C 9.336 -5.060 -4.437 1.00 . A A . 24 ARG CA 1 1 17 10282 1 1 24 ARG CB C 8.697 -5.938 -5.514 1.00 . A A . 24 ARG CB 1 1 17 10283 1 1 24 ARG CD C 7.598 -8.190 -5.706 1.00 . A A . 24 ARG CD 1 1 17 10284 1 1 24 ARG CG C 7.605 -6.853 -4.983 1.00 . A A . 24 ARG CG 1 1 17 10285 1 1 24 ARG CZ C 7.270 -10.576 -5.181 1.00 . A A . 24 ARG CZ 1 1 17 10286 1 1 24 ARG H H 7.937 -3.554 -4.945 1.00 . A A . 24 ARG H 1 1 17 10287 1 1 24 ARG HA H 9.351 -5.603 -3.504 1.00 . A A . 24 ARG HA 1 1 17 10288 1 1 24 ARG HB2 H 8.266 -5.302 -6.273 1.00 . A A . 24 ARG HB2 1 1 17 10289 1 1 24 ARG HB3 H 9.464 -6.552 -5.963 1.00 . A A . 24 ARG HB3 1 1 17 10290 1 1 24 ARG HD2 H 6.843 -8.164 -6.478 1.00 . A A . 24 ARG HD2 1 1 17 10291 1 1 24 ARG HD3 H 8.567 -8.347 -6.157 1.00 . A A . 24 ARG HD3 1 1 17 10292 1 1 24 ARG HE H 7.139 -9.085 -3.860 1.00 . A A . 24 ARG HE 1 1 17 10293 1 1 24 ARG HG2 H 7.772 -7.025 -3.931 1.00 . A A . 24 ARG HG2 1 1 17 10294 1 1 24 ARG HG3 H 6.647 -6.373 -5.124 1.00 . A A . 24 ARG HG3 1 1 17 10295 1 1 24 ARG HH11 H 7.700 -10.196 -7.121 1.00 . A A . 24 ARG HH11 1 1 17 10296 1 1 24 ARG HH12 H 7.465 -11.865 -6.725 1.00 . A A . 24 ARG HH12 1 1 17 10297 1 1 24 ARG HH21 H 6.830 -11.280 -3.338 1.00 . A A . 24 ARG HH21 1 1 17 10298 1 1 24 ARG HH22 H 6.971 -12.481 -4.579 1.00 . A A . 24 ARG HH22 1 1 17 10299 1 1 24 ARG N N 8.546 -3.850 -4.237 1.00 . A A . 24 ARG N 1 1 17 10300 1 1 24 ARG NE N 7.311 -9.301 -4.801 1.00 . A A . 24 ARG NE 1 1 17 10301 1 1 24 ARG NH1 N 7.497 -10.906 -6.446 1.00 . A A . 24 ARG NH1 1 1 17 10302 1 1 24 ARG NH2 N 7.002 -11.523 -4.293 1.00 . A A . 24 ARG NH2 1 1 17 10303 1 1 24 ARG O O 11.008 -4.095 -5.865 1.00 . A A . 24 ARG O 1 1 17 10304 1 1 25 THR C C 13.875 -6.153 -4.570 1.00 . A A . 25 THR C 1 1 17 10305 1 1 25 THR CA C 13.130 -4.861 -4.254 1.00 . A A . 25 THR CA 1 1 17 10306 1 1 25 THR CB C 13.770 -4.168 -3.050 1.00 . A A . 25 THR CB 1 1 17 10307 1 1 25 THR CG2 C 13.677 -2.659 -3.109 1.00 . A A . 25 THR CG2 1 1 17 10308 1 1 25 THR H H 11.466 -5.615 -3.185 1.00 . A A . 25 THR H 1 1 17 10309 1 1 25 THR HA H 13.193 -4.208 -5.108 1.00 . A A . 25 THR HA 1 1 17 10310 1 1 25 THR HB H 14.817 -4.434 -3.010 1.00 . A A . 25 THR HB 1 1 17 10311 1 1 25 THR HG1 H 12.254 -4.269 -1.815 1.00 . A A . 25 THR HG1 1 1 17 10312 1 1 25 THR HG21 H 12.643 -2.366 -3.215 1.00 . A A . 25 THR HG21 1 1 17 10313 1 1 25 THR HG22 H 14.078 -2.238 -2.199 1.00 . A A . 25 THR HG22 1 1 17 10314 1 1 25 THR HG23 H 14.243 -2.296 -3.954 1.00 . A A . 25 THR HG23 1 1 17 10315 1 1 25 THR N N 11.719 -5.124 -3.995 1.00 . A A . 25 THR N 1 1 17 10316 1 1 25 THR O O 14.187 -6.437 -5.726 1.00 . A A . 25 THR O 1 1 17 10317 1 1 25 THR OG1 O 13.158 -4.590 -1.845 1.00 . A A . 25 THR OG1 1 1 17 10318 1 1 26 SER C C 14.998 -8.915 -2.354 1.00 . A A . 26 SER C 1 1 17 10319 1 1 26 SER CA C 14.862 -8.196 -3.691 1.00 . A A . 26 SER CA 1 1 17 10320 1 1 26 SER CB C 16.246 -7.959 -4.299 1.00 . A A . 26 SER CB 1 1 17 10321 1 1 26 SER H H 13.877 -6.647 -2.638 1.00 . A A . 26 SER H 1 1 17 10322 1 1 26 SER HA H 14.286 -8.815 -4.360 1.00 . A A . 26 SER HA 1 1 17 10323 1 1 26 SER HB2 H 16.629 -7.010 -3.957 1.00 . A A . 26 SER HB2 1 1 17 10324 1 1 26 SER HB3 H 16.913 -8.750 -3.990 1.00 . A A . 26 SER HB3 1 1 17 10325 1 1 26 SER HG H 16.879 -7.375 -6.059 1.00 . A A . 26 SER HG 1 1 17 10326 1 1 26 SER N N 14.154 -6.931 -3.532 1.00 . A A . 26 SER N 1 1 17 10327 1 1 26 SER O O 14.866 -10.137 -2.277 1.00 . A A . 26 SER O 1 1 17 10328 1 1 26 SER OG O 16.185 -7.942 -5.715 1.00 . A A . 26 SER OG 1 1 17 10329 1 1 27 VAL C C 14.280 -8.271 0.950 1.00 . A A . 27 VAL C 1 1 17 10330 1 1 27 VAL CA C 15.419 -8.708 0.034 1.00 . A A . 27 VAL CA 1 1 17 10331 1 1 27 VAL CB C 16.765 -8.293 0.663 1.00 . A A . 27 VAL CB 1 1 17 10332 1 1 27 VAL CG1 C 16.838 -6.782 0.827 1.00 . A A . 27 VAL CG1 1 1 17 10333 1 1 27 VAL CG2 C 16.973 -8.995 1.997 1.00 . A A . 27 VAL CG2 1 1 17 10334 1 1 27 VAL H H 15.357 -7.182 -1.431 1.00 . A A . 27 VAL H 1 1 17 10335 1 1 27 VAL HA H 15.404 -9.785 -0.053 1.00 . A A . 27 VAL HA 1 1 17 10336 1 1 27 VAL HB H 17.558 -8.597 -0.005 1.00 . A A . 27 VAL HB 1 1 17 10337 1 1 27 VAL HG11 H 16.614 -6.306 -0.116 1.00 . A A . 27 VAL HG11 1 1 17 10338 1 1 27 VAL HG12 H 16.121 -6.465 1.570 1.00 . A A . 27 VAL HG12 1 1 17 10339 1 1 27 VAL HG13 H 17.832 -6.503 1.143 1.00 . A A . 27 VAL HG13 1 1 17 10340 1 1 27 VAL HG21 H 16.021 -9.333 2.379 1.00 . A A . 27 VAL HG21 1 1 17 10341 1 1 27 VAL HG22 H 17.627 -9.843 1.860 1.00 . A A . 27 VAL HG22 1 1 17 10342 1 1 27 VAL HG23 H 17.418 -8.307 2.701 1.00 . A A . 27 VAL HG23 1 1 17 10343 1 1 27 VAL N N 15.264 -8.148 -1.303 1.00 . A A . 27 VAL N 1 1 17 10344 1 1 27 VAL O O 13.870 -9.011 1.844 1.00 . A A . 27 VAL O 1 1 17 10345 1 1 28 SER C C 11.341 -7.100 1.078 1.00 . A A . 28 SER C 1 1 17 10346 1 1 28 SER CA C 12.681 -6.528 1.526 1.00 . A A . 28 SER CA 1 1 17 10347 1 1 28 SER CB C 12.656 -5.000 1.437 1.00 . A A . 28 SER CB 1 1 17 10348 1 1 28 SER H H 14.141 -6.520 -0.006 1.00 . A A . 28 SER H 1 1 17 10349 1 1 28 SER HA H 12.854 -6.815 2.550 1.00 . A A . 28 SER HA 1 1 17 10350 1 1 28 SER HB2 H 13.507 -4.597 1.965 1.00 . A A . 28 SER HB2 1 1 17 10351 1 1 28 SER HB3 H 12.701 -4.702 0.400 1.00 . A A . 28 SER HB3 1 1 17 10352 1 1 28 SER HG H 11.515 -3.516 2.016 1.00 . A A . 28 SER HG 1 1 17 10353 1 1 28 SER N N 13.773 -7.064 0.721 1.00 . A A . 28 SER N 1 1 17 10354 1 1 28 SER O O 10.799 -8.008 1.709 1.00 . A A . 28 SER O 1 1 17 10355 1 1 28 SER OG O 11.472 -4.475 2.013 1.00 . A A . 28 SER OG 1 1 17 10356 1 1 29 SER C C 8.417 -6.825 0.469 1.00 . A A . 29 SER C 1 1 17 10357 1 1 29 SER CA C 9.535 -7.018 -0.551 1.00 . A A . 29 SER CA 1 1 17 10358 1 1 29 SER CB C 9.623 -8.490 -0.957 1.00 . A A . 29 SER CB 1 1 17 10359 1 1 29 SER H H 11.294 -5.843 -0.471 1.00 . A A . 29 SER H 1 1 17 10360 1 1 29 SER HA H 9.313 -6.425 -1.426 1.00 . A A . 29 SER HA 1 1 17 10361 1 1 29 SER HB2 H 10.076 -9.055 -0.156 1.00 . A A . 29 SER HB2 1 1 17 10362 1 1 29 SER HB3 H 8.629 -8.869 -1.147 1.00 . A A . 29 SER HB3 1 1 17 10363 1 1 29 SER HG H 11.291 -8.317 -1.970 1.00 . A A . 29 SER HG 1 1 17 10364 1 1 29 SER N N 10.812 -6.563 -0.015 1.00 . A A . 29 SER N 1 1 17 10365 1 1 29 SER O O 8.269 -7.618 1.399 1.00 . A A . 29 SER O 1 1 17 10366 1 1 29 SER OG O 10.405 -8.651 -2.128 1.00 . A A . 29 SER OG 1 1 17 10367 1 1 30 HIS C C 5.192 -5.837 0.559 1.00 . A A . 30 HIS C 1 1 17 10368 1 1 30 HIS CA C 6.529 -5.471 1.194 1.00 . A A . 30 HIS CA 1 1 17 10369 1 1 30 HIS CB C 6.538 -3.989 1.573 1.00 . A A . 30 HIS CB 1 1 17 10370 1 1 30 HIS CD2 C 8.833 -4.282 2.746 1.00 . A A . 30 HIS CD2 1 1 17 10371 1 1 30 HIS CE1 C 9.009 -2.275 3.612 1.00 . A A . 30 HIS CE1 1 1 17 10372 1 1 30 HIS CG C 7.726 -3.588 2.392 1.00 . A A . 30 HIS CG 1 1 17 10373 1 1 30 HIS H H 7.802 -5.172 -0.471 1.00 . A A . 30 HIS H 1 1 17 10374 1 1 30 HIS HA H 6.664 -6.063 2.086 1.00 . A A . 30 HIS HA 1 1 17 10375 1 1 30 HIS HB2 H 6.539 -3.393 0.673 1.00 . A A . 30 HIS HB2 1 1 17 10376 1 1 30 HIS HB3 H 5.648 -3.766 2.145 1.00 . A A . 30 HIS HB3 1 1 17 10377 1 1 30 HIS HD1 H 7.225 -1.598 2.873 1.00 . A A . 30 HIS HD1 1 1 17 10378 1 1 30 HIS HD2 H 9.060 -5.305 2.482 1.00 . A A . 30 HIS HD2 1 1 17 10379 1 1 30 HIS HE1 H 9.384 -1.418 4.150 1.00 . A A . 30 HIS HE1 1 1 17 10380 1 1 30 HIS HE2 H 10.517 -3.645 3.827 1.00 . A A . 30 HIS HE2 1 1 17 10381 1 1 30 HIS N N 7.634 -5.767 0.289 1.00 . A A . 30 HIS N 1 1 17 10382 1 1 30 HIS ND1 N 7.867 -2.335 2.950 1.00 . A A . 30 HIS ND1 1 1 17 10383 1 1 30 HIS NE2 N 9.613 -3.444 3.503 1.00 . A A . 30 HIS NE2 1 1 17 10384 1 1 30 HIS O O 5.144 -6.352 -0.558 1.00 . A A . 30 HIS O 1 1 17 10385 1 1 31 TYR C C 1.762 -4.833 1.276 1.00 . A A . 31 TYR C 1 1 17 10386 1 1 31 TYR CA C 2.768 -5.868 0.785 1.00 . A A . 31 TYR CA 1 1 17 10387 1 1 31 TYR CB C 2.339 -7.266 1.233 1.00 . A A . 31 TYR CB 1 1 17 10388 1 1 31 TYR CD1 C 4.275 -8.799 0.707 1.00 . A A . 31 TYR CD1 1 1 17 10389 1 1 31 TYR CD2 C 2.284 -9.016 -0.585 1.00 . A A . 31 TYR CD2 1 1 17 10390 1 1 31 TYR CE1 C 4.862 -9.818 -0.019 1.00 . A A . 31 TYR CE1 1 1 17 10391 1 1 31 TYR CE2 C 2.864 -10.036 -1.316 1.00 . A A . 31 TYR CE2 1 1 17 10392 1 1 31 TYR CG C 2.978 -8.381 0.437 1.00 . A A . 31 TYR CG 1 1 17 10393 1 1 31 TYR CZ C 4.153 -10.433 -1.029 1.00 . A A . 31 TYR CZ 1 1 17 10394 1 1 31 TYR H H 4.210 -5.156 2.162 1.00 . A A . 31 TYR H 1 1 17 10395 1 1 31 TYR HA H 2.799 -5.840 -0.294 1.00 . A A . 31 TYR HA 1 1 17 10396 1 1 31 TYR HB2 H 2.609 -7.403 2.270 1.00 . A A . 31 TYR HB2 1 1 17 10397 1 1 31 TYR HB3 H 1.267 -7.356 1.131 1.00 . A A . 31 TYR HB3 1 1 17 10398 1 1 31 TYR HD1 H 4.828 -8.316 1.499 1.00 . A A . 31 TYR HD1 1 1 17 10399 1 1 31 TYR HD2 H 1.274 -8.703 -0.808 1.00 . A A . 31 TYR HD2 1 1 17 10400 1 1 31 TYR HE1 H 5.872 -10.129 0.206 1.00 . A A . 31 TYR HE1 1 1 17 10401 1 1 31 TYR HE2 H 2.308 -10.517 -2.107 1.00 . A A . 31 TYR HE2 1 1 17 10402 1 1 31 TYR HH H 4.126 -12.188 -1.812 1.00 . A A . 31 TYR HH 1 1 17 10403 1 1 31 TYR N N 4.107 -5.567 1.278 1.00 . A A . 31 TYR N 1 1 17 10404 1 1 31 TYR O O 2.018 -4.112 2.240 1.00 . A A . 31 TYR O 1 1 17 10405 1 1 31 TYR OH O 4.734 -11.448 -1.754 1.00 . A A . 31 TYR OH 1 1 17 10406 1 1 32 CYS C C -1.604 -4.532 1.629 1.00 . A A . 32 CYS C 1 1 17 10407 1 1 32 CYS CA C -0.429 -3.816 0.973 1.00 . A A . 32 CYS CA 1 1 17 10408 1 1 32 CYS CB C -0.907 -3.050 -0.261 1.00 . A A . 32 CYS CB 1 1 17 10409 1 1 32 CYS H H 0.469 -5.364 -0.155 1.00 . A A . 32 CYS H 1 1 17 10410 1 1 32 CYS HA H -0.008 -3.116 1.680 1.00 . A A . 32 CYS HA 1 1 17 10411 1 1 32 CYS HB2 H -0.049 -2.733 -0.834 1.00 . A A . 32 CYS HB2 1 1 17 10412 1 1 32 CYS HB3 H -1.517 -3.704 -0.866 1.00 . A A . 32 CYS HB3 1 1 17 10413 1 1 32 CYS N N 0.616 -4.763 0.605 1.00 . A A . 32 CYS N 1 1 17 10414 1 1 32 CYS O O -2.148 -5.488 1.077 1.00 . A A . 32 CYS O 1 1 17 10415 1 1 32 CYS SG S -1.894 -1.567 0.121 1.00 . A A . 32 CYS SG 1 1 17 10416 1 1 33 THR C C -4.442 -4.050 3.110 1.00 . A A . 33 THR C 1 1 17 10417 1 1 33 THR CA C -3.106 -4.657 3.541 1.00 . A A . 33 THR CA 1 1 17 10418 1 1 33 THR CB C -2.912 -4.468 5.046 1.00 . A A . 33 THR CB 1 1 17 10419 1 1 33 THR CG2 C -2.583 -3.043 5.433 1.00 . A A . 33 THR CG2 1 1 17 10420 1 1 33 THR H H -1.520 -3.296 3.198 1.00 . A A . 33 THR H 1 1 17 10421 1 1 33 THR HA H -3.119 -5.714 3.320 1.00 . A A . 33 THR HA 1 1 17 10422 1 1 33 THR HB H -2.097 -5.097 5.375 1.00 . A A . 33 THR HB 1 1 17 10423 1 1 33 THR HG1 H -4.779 -4.212 5.580 1.00 . A A . 33 THR HG1 1 1 17 10424 1 1 33 THR HG21 H -2.795 -2.386 4.602 1.00 . A A . 33 THR HG21 1 1 17 10425 1 1 33 THR HG22 H -3.183 -2.753 6.283 1.00 . A A . 33 THR HG22 1 1 17 10426 1 1 33 THR HG23 H -1.537 -2.972 5.690 1.00 . A A . 33 THR HG23 1 1 17 10427 1 1 33 THR N N -1.993 -4.062 2.810 1.00 . A A . 33 THR N 1 1 17 10428 1 1 33 THR O O -5.484 -4.352 3.692 1.00 . A A . 33 THR O 1 1 17 10429 1 1 33 THR OG1 O -4.080 -4.847 5.753 1.00 . A A . 33 THR OG1 1 1 17 10430 1 1 34 GLY C C -6.405 -1.877 2.713 1.00 . A A . 34 GLY C 1 1 17 10431 1 1 34 GLY CA C -5.625 -2.565 1.608 1.00 . A A . 34 GLY CA 1 1 17 10432 1 1 34 GLY H H -3.552 -2.988 1.662 1.00 . A A . 34 GLY H 1 1 17 10433 1 1 34 GLY HA2 H -6.252 -3.320 1.157 1.00 . A A . 34 GLY HA2 1 1 17 10434 1 1 34 GLY HA3 H -5.365 -1.833 0.858 1.00 . A A . 34 GLY HA3 1 1 17 10435 1 1 34 GLY N N -4.408 -3.194 2.091 1.00 . A A . 34 GLY N 1 1 17 10436 1 1 34 GLY O O -7.636 -1.879 2.707 1.00 . A A . 34 GLY O 1 1 17 10437 1 1 35 ARG C C -6.016 0.900 4.741 1.00 . A A . 35 ARG C 1 1 17 10438 1 1 35 ARG CA C -6.321 -0.594 4.780 1.00 . A A . 35 ARG CA 1 1 17 10439 1 1 35 ARG CB C -5.850 -1.187 6.109 1.00 . A A . 35 ARG CB 1 1 17 10440 1 1 35 ARG CD C -6.381 0.281 8.079 1.00 . A A . 35 ARG CD 1 1 17 10441 1 1 35 ARG CG C -6.806 -0.930 7.263 1.00 . A A . 35 ARG CG 1 1 17 10442 1 1 35 ARG CZ C -5.231 0.704 10.217 1.00 . A A . 35 ARG CZ 1 1 17 10443 1 1 35 ARG H H -4.709 -1.320 3.615 1.00 . A A . 35 ARG H 1 1 17 10444 1 1 35 ARG HA H -7.387 -0.732 4.693 1.00 . A A . 35 ARG HA 1 1 17 10445 1 1 35 ARG HB2 H -5.738 -2.255 5.994 1.00 . A A . 35 ARG HB2 1 1 17 10446 1 1 35 ARG HB3 H -4.891 -0.759 6.362 1.00 . A A . 35 ARG HB3 1 1 17 10447 1 1 35 ARG HD2 H -5.873 0.977 7.428 1.00 . A A . 35 ARG HD2 1 1 17 10448 1 1 35 ARG HD3 H -7.263 0.750 8.488 1.00 . A A . 35 ARG HD3 1 1 17 10449 1 1 35 ARG HE H -5.052 -0.961 9.131 1.00 . A A . 35 ARG HE 1 1 17 10450 1 1 35 ARG HG2 H -7.795 -0.755 6.867 1.00 . A A . 35 ARG HG2 1 1 17 10451 1 1 35 ARG HG3 H -6.821 -1.798 7.905 1.00 . A A . 35 ARG HG3 1 1 17 10452 1 1 35 ARG HH11 H -6.425 2.213 9.595 1.00 . A A . 35 ARG HH11 1 1 17 10453 1 1 35 ARG HH12 H -5.605 2.486 11.095 1.00 . A A . 35 ARG HH12 1 1 17 10454 1 1 35 ARG HH21 H -3.973 -0.605 11.105 1.00 . A A . 35 ARG HH21 1 1 17 10455 1 1 35 ARG HH22 H -4.213 0.886 11.953 1.00 . A A . 35 ARG HH22 1 1 17 10456 1 1 35 ARG N N -5.687 -1.287 3.664 1.00 . A A . 35 ARG N 1 1 17 10457 1 1 35 ARG NE N -5.486 -0.084 9.174 1.00 . A A . 35 ARG NE 1 1 17 10458 1 1 35 ARG NH1 N -5.801 1.899 10.309 1.00 . A A . 35 ARG NH1 1 1 17 10459 1 1 35 ARG NH2 N -4.405 0.295 11.170 1.00 . A A . 35 ARG NH2 1 1 17 10460 1 1 35 ARG O O -6.872 1.727 5.054 1.00 . A A . 35 ARG O 1 1 17 10461 1 1 36 SER C C -3.269 2.809 3.235 1.00 . A A . 36 SER C 1 1 17 10462 1 1 36 SER CA C -4.371 2.631 4.274 1.00 . A A . 36 SER CA 1 1 17 10463 1 1 36 SER CB C -3.885 3.119 5.639 1.00 . A A . 36 SER CB 1 1 17 10464 1 1 36 SER H H -4.155 0.531 4.118 1.00 . A A . 36 SER H 1 1 17 10465 1 1 36 SER HA H -5.227 3.218 3.976 1.00 . A A . 36 SER HA 1 1 17 10466 1 1 36 SER HB2 H -4.319 2.505 6.414 1.00 . A A . 36 SER HB2 1 1 17 10467 1 1 36 SER HB3 H -2.808 3.044 5.683 1.00 . A A . 36 SER HB3 1 1 17 10468 1 1 36 SER HG H -4.272 4.643 6.807 1.00 . A A . 36 SER HG 1 1 17 10469 1 1 36 SER N N -4.791 1.237 4.354 1.00 . A A . 36 SER N 1 1 17 10470 1 1 36 SER O O -2.675 1.835 2.773 1.00 . A A . 36 SER O 1 1 17 10471 1 1 36 SER OG O -4.259 4.467 5.863 1.00 . A A . 36 SER OG 1 1 17 10472 1 1 37 CYS C C -0.576 4.122 2.468 1.00 . A A . 37 CYS C 1 1 17 10473 1 1 37 CYS CA C -1.966 4.364 1.890 1.00 . A A . 37 CYS CA 1 1 17 10474 1 1 37 CYS CB C -2.090 5.816 1.422 1.00 . A A . 37 CYS CB 1 1 17 10475 1 1 37 CYS H H -3.505 4.794 3.279 1.00 . A A . 37 CYS H 1 1 17 10476 1 1 37 CYS HA H -2.111 3.710 1.044 1.00 . A A . 37 CYS HA 1 1 17 10477 1 1 37 CYS HB2 H -2.047 6.468 2.281 1.00 . A A . 37 CYS HB2 1 1 17 10478 1 1 37 CYS HB3 H -1.266 6.044 0.762 1.00 . A A . 37 CYS HB3 1 1 17 10479 1 1 37 CYS N N -2.999 4.059 2.873 1.00 . A A . 37 CYS N 1 1 17 10480 1 1 37 CYS O O 0.357 3.777 1.743 1.00 . A A . 37 CYS O 1 1 17 10481 1 1 37 CYS SG S -3.635 6.180 0.528 1.00 . A A . 37 CYS SG 1 1 17 10482 1 1 38 GLU C C 1.284 2.653 4.345 1.00 . A A . 38 GLU C 1 1 17 10483 1 1 38 GLU CA C 0.831 4.105 4.454 1.00 . A A . 38 GLU CA 1 1 17 10484 1 1 38 GLU CB C 0.721 4.508 5.925 1.00 . A A . 38 GLU CB 1 1 17 10485 1 1 38 GLU CD C 1.779 6.253 7.415 1.00 . A A . 38 GLU CD 1 1 17 10486 1 1 38 GLU CG C 0.955 5.990 6.169 1.00 . A A . 38 GLU CG 1 1 17 10487 1 1 38 GLU H H -1.227 4.580 4.302 1.00 . A A . 38 GLU H 1 1 17 10488 1 1 38 GLU HA H 1.563 4.736 3.971 1.00 . A A . 38 GLU HA 1 1 17 10489 1 1 38 GLU HB2 H -0.267 4.258 6.282 1.00 . A A . 38 GLU HB2 1 1 17 10490 1 1 38 GLU HB3 H 1.451 3.952 6.494 1.00 . A A . 38 GLU HB3 1 1 17 10491 1 1 38 GLU HG2 H 1.475 6.405 5.319 1.00 . A A . 38 GLU HG2 1 1 17 10492 1 1 38 GLU HG3 H -0.002 6.479 6.279 1.00 . A A . 38 GLU HG3 1 1 17 10493 1 1 38 GLU N N -0.446 4.304 3.777 1.00 . A A . 38 GLU N 1 1 17 10494 1 1 38 GLU O O 0.775 1.779 5.046 1.00 . A A . 38 GLU O 1 1 17 10495 1 1 38 GLU OE1 O 2.690 7.105 7.355 1.00 . A A . 38 GLU OE1 1 1 17 10496 1 1 38 GLU OE2 O 1.513 5.607 8.450 1.00 . A A . 38 GLU OE2 1 1 17 10497 1 1 39 CYS C C 3.549 0.587 4.485 1.00 . A A . 39 CYS C 1 1 17 10498 1 1 39 CYS CA C 2.767 1.056 3.260 1.00 . A A . 39 CYS CA 1 1 17 10499 1 1 39 CYS CB C 3.663 1.013 2.021 1.00 . A A . 39 CYS CB 1 1 17 10500 1 1 39 CYS H H 2.611 3.141 2.930 1.00 . A A . 39 CYS H 1 1 17 10501 1 1 39 CYS HA H 1.927 0.394 3.109 1.00 . A A . 39 CYS HA 1 1 17 10502 1 1 39 CYS HB2 H 4.112 1.984 1.877 1.00 . A A . 39 CYS HB2 1 1 17 10503 1 1 39 CYS HB3 H 4.442 0.281 2.175 1.00 . A A . 39 CYS HB3 1 1 17 10504 1 1 39 CYS N N 2.245 2.403 3.460 1.00 . A A . 39 CYS N 1 1 17 10505 1 1 39 CYS O O 4.066 1.401 5.250 1.00 . A A . 39 CYS O 1 1 17 10506 1 1 39 CYS SG S 2.786 0.577 0.484 1.00 . A A . 39 CYS SG 1 1 17 10507 1 1 40 PRO C C 5.878 -1.118 5.710 1.00 . A A . 40 PRO C 1 1 17 10508 1 1 40 PRO CA C 4.370 -1.312 5.825 1.00 . A A . 40 PRO CA 1 1 17 10509 1 1 40 PRO CB C 4.015 -2.799 5.760 1.00 . A A . 40 PRO CB 1 1 17 10510 1 1 40 PRO CD C 3.059 -1.779 3.822 1.00 . A A . 40 PRO CD 1 1 17 10511 1 1 40 PRO CG C 3.686 -3.048 4.329 1.00 . A A . 40 PRO CG 1 1 17 10512 1 1 40 PRO HA H 4.026 -0.898 6.762 1.00 . A A . 40 PRO HA 1 1 17 10513 1 1 40 PRO HB2 H 4.862 -3.388 6.080 1.00 . A A . 40 PRO HB2 1 1 17 10514 1 1 40 PRO HB3 H 3.168 -2.999 6.399 1.00 . A A . 40 PRO HB3 1 1 17 10515 1 1 40 PRO HD2 H 3.323 -1.615 2.787 1.00 . A A . 40 PRO HD2 1 1 17 10516 1 1 40 PRO HD3 H 1.986 -1.816 3.938 1.00 . A A . 40 PRO HD3 1 1 17 10517 1 1 40 PRO HG2 H 4.589 -3.266 3.777 1.00 . A A . 40 PRO HG2 1 1 17 10518 1 1 40 PRO HG3 H 2.989 -3.868 4.249 1.00 . A A . 40 PRO HG3 1 1 17 10519 1 1 40 PRO N N 3.646 -0.738 4.686 1.00 . A A . 40 PRO N 1 1 17 10520 1 1 40 PRO O O 6.400 -0.868 4.623 1.00 . A A . 40 PRO O 1 1 17 10521 1 1 41 SER C C 8.685 -2.226 7.609 1.00 . A A . 41 SER C 1 1 17 10522 1 1 41 SER CA C 8.021 -1.074 6.861 1.00 . A A . 41 SER CA 1 1 17 10523 1 1 41 SER CB C 8.395 0.257 7.516 1.00 . A A . 41 SER CB 1 1 17 10524 1 1 41 SER H H 6.099 -1.437 7.671 1.00 . A A . 41 SER H 1 1 17 10525 1 1 41 SER HA H 8.372 -1.073 5.840 1.00 . A A . 41 SER HA 1 1 17 10526 1 1 41 SER HB2 H 7.746 0.436 8.360 1.00 . A A . 41 SER HB2 1 1 17 10527 1 1 41 SER HB3 H 9.420 0.214 7.854 1.00 . A A . 41 SER HB3 1 1 17 10528 1 1 41 SER HG H 8.480 2.156 7.042 1.00 . A A . 41 SER HG 1 1 17 10529 1 1 41 SER N N 6.572 -1.236 6.836 1.00 . A A . 41 SER N 1 1 17 10530 1 1 41 SER O O 9.713 -2.045 8.262 1.00 . A A . 41 SER O 1 1 17 10531 1 1 41 SER OG O 8.260 1.332 6.602 1.00 . A A . 41 SER OG 1 1 17 10532 1 1 42 TYR C C 8.557 -5.811 7.259 1.00 . A A . 42 TYR C 1 1 17 10533 1 1 42 TYR CA C 8.625 -4.592 8.175 1.00 . A A . 42 TYR CA 1 1 17 10534 1 1 42 TYR CB C 7.852 -4.867 9.467 1.00 . A A . 42 TYR CB 1 1 17 10535 1 1 42 TYR CD1 C 5.557 -3.870 9.135 1.00 . A A . 42 TYR CD1 1 1 17 10536 1 1 42 TYR CD2 C 5.753 -6.245 9.204 1.00 . A A . 42 TYR CD2 1 1 17 10537 1 1 42 TYR CE1 C 4.192 -3.984 8.950 1.00 . A A . 42 TYR CE1 1 1 17 10538 1 1 42 TYR CE2 C 4.389 -6.367 9.019 1.00 . A A . 42 TYR CE2 1 1 17 10539 1 1 42 TYR CG C 6.359 -4.996 9.265 1.00 . A A . 42 TYR CG 1 1 17 10540 1 1 42 TYR CZ C 3.613 -5.234 8.893 1.00 . A A . 42 TYR CZ 1 1 17 10541 1 1 42 TYR H H 7.274 -3.491 6.973 1.00 . A A . 42 TYR H 1 1 17 10542 1 1 42 TYR HA H 9.658 -4.396 8.419 1.00 . A A . 42 TYR HA 1 1 17 10543 1 1 42 TYR HB2 H 8.208 -5.789 9.902 1.00 . A A . 42 TYR HB2 1 1 17 10544 1 1 42 TYR HB3 H 8.025 -4.057 10.161 1.00 . A A . 42 TYR HB3 1 1 17 10545 1 1 42 TYR HD1 H 6.013 -2.892 9.180 1.00 . A A . 42 TYR HD1 1 1 17 10546 1 1 42 TYR HD2 H 6.363 -7.130 9.303 1.00 . A A . 42 TYR HD2 1 1 17 10547 1 1 42 TYR HE1 H 3.584 -3.096 8.851 1.00 . A A . 42 TYR HE1 1 1 17 10548 1 1 42 TYR HE2 H 3.936 -7.347 8.974 1.00 . A A . 42 TYR HE2 1 1 17 10549 1 1 42 TYR HH H 2.075 -6.076 8.105 1.00 . A A . 42 TYR HH 1 1 17 10550 1 1 42 TYR N N 8.091 -3.410 7.509 1.00 . A A . 42 TYR N 1 1 17 10551 1 1 42 TYR O O 7.728 -5.871 6.351 1.00 . A A . 42 TYR O 1 1 17 10552 1 1 42 TYR OH O 2.254 -5.352 8.708 1.00 . A A . 42 TYR OH 1 1 17 10553 1 1 43 PRO C C 8.256 -8.917 6.918 1.00 . A A . 43 PRO C 1 1 17 10554 1 1 43 PRO CA C 9.470 -8.027 6.676 1.00 . A A . 43 PRO CA 1 1 17 10555 1 1 43 PRO CB C 10.748 -8.726 7.144 1.00 . A A . 43 PRO CB 1 1 17 10556 1 1 43 PRO CD C 10.457 -6.815 8.549 1.00 . A A . 43 PRO CD 1 1 17 10557 1 1 43 PRO CG C 10.965 -8.230 8.531 1.00 . A A . 43 PRO CG 1 1 17 10558 1 1 43 PRO HA H 9.545 -7.800 5.623 1.00 . A A . 43 PRO HA 1 1 17 10559 1 1 43 PRO HB2 H 10.603 -9.797 7.125 1.00 . A A . 43 PRO HB2 1 1 17 10560 1 1 43 PRO HB3 H 11.568 -8.456 6.496 1.00 . A A . 43 PRO HB3 1 1 17 10561 1 1 43 PRO HD2 H 10.018 -6.583 9.509 1.00 . A A . 43 PRO HD2 1 1 17 10562 1 1 43 PRO HD3 H 11.256 -6.124 8.321 1.00 . A A . 43 PRO HD3 1 1 17 10563 1 1 43 PRO HG2 H 10.408 -8.837 9.230 1.00 . A A . 43 PRO HG2 1 1 17 10564 1 1 43 PRO HG3 H 12.018 -8.253 8.769 1.00 . A A . 43 PRO HG3 1 1 17 10565 1 1 43 PRO N N 9.434 -6.805 7.486 1.00 . A A . 43 PRO N 1 1 17 10566 1 1 43 PRO O O 8.127 -9.535 7.974 1.00 . A A . 43 PRO O 1 1 17 10567 1 1 44 GLY C C 6.475 -11.278 5.951 1.00 . A A . 44 GLY C 1 1 17 10568 1 1 44 GLY CA C 6.176 -9.795 6.056 1.00 . A A . 44 GLY CA 1 1 17 10569 1 1 44 GLY H H 7.523 -8.464 5.111 1.00 . A A . 44 GLY H 1 1 17 10570 1 1 44 GLY HA2 H 5.482 -9.523 5.274 1.00 . A A . 44 GLY HA2 1 1 17 10571 1 1 44 GLY HA3 H 5.716 -9.599 7.013 1.00 . A A . 44 GLY HA3 1 1 17 10572 1 1 44 GLY N N 7.368 -8.978 5.931 1.00 . A A . 44 GLY N 1 1 17 10573 1 1 44 GLY O O 7.476 -11.636 5.295 1.00 . A A . 44 GLY O 1 1 17 10574 1 1 44 GLY OXT O 5.709 -12.080 6.525 1.00 . A A . 44 GLY OXT 1 1 18 10575 1 1 1 ALA C C -13.769 13.803 -2.395 1.00 . A A . 1 ALA C 1 1 18 10576 1 1 1 ALA CA C -14.929 12.863 -2.703 1.00 . A A . 1 ALA CA 1 1 18 10577 1 1 1 ALA CB C -14.672 11.492 -2.096 1.00 . A A . 1 ALA CB 1 1 18 10578 1 1 1 ALA H1 H -15.026 13.692 -4.583 1.00 . A A . 1 ALA H1 1 1 18 10579 1 1 1 ALA H2 H -14.437 12.080 -4.541 1.00 . A A . 1 ALA H2 1 1 18 10580 1 1 1 ALA H3 H -16.109 12.386 -4.320 1.00 . A A . 1 ALA H3 1 1 18 10581 1 1 1 ALA HA H -15.829 13.263 -2.259 1.00 . A A . 1 ALA HA 1 1 18 10582 1 1 1 ALA HB1 H -13.611 11.291 -2.095 1.00 . A A . 1 ALA HB1 1 1 18 10583 1 1 1 ALA HB2 H -15.181 10.739 -2.680 1.00 . A A . 1 ALA HB2 1 1 18 10584 1 1 1 ALA HB3 H -15.043 11.472 -1.082 1.00 . A A . 1 ALA HB3 1 1 18 10585 1 1 1 ALA N N -15.145 12.745 -4.169 1.00 . A A . 1 ALA N 1 1 18 10586 1 1 1 ALA O O -12.894 14.021 -3.232 1.00 . A A . 1 ALA O 1 1 18 10587 1 1 2 MET C C -11.550 14.515 -0.141 1.00 . A A . 2 MET C 1 1 18 10588 1 1 2 MET CA C -12.716 15.275 -0.767 1.00 . A A . 2 MET CA 1 1 18 10589 1 1 2 MET CB C -13.268 16.296 0.229 1.00 . A A . 2 MET CB 1 1 18 10590 1 1 2 MET CE C -16.569 18.303 -0.626 1.00 . A A . 2 MET CE 1 1 18 10591 1 1 2 MET CG C -13.925 17.497 -0.433 1.00 . A A . 2 MET CG 1 1 18 10592 1 1 2 MET H H -14.494 14.144 -0.563 1.00 . A A . 2 MET H 1 1 18 10593 1 1 2 MET HA H -12.361 15.795 -1.644 1.00 . A A . 2 MET HA 1 1 18 10594 1 1 2 MET HB2 H -14.001 15.811 0.855 1.00 . A A . 2 MET HB2 1 1 18 10595 1 1 2 MET HB3 H -12.457 16.653 0.848 1.00 . A A . 2 MET HB3 1 1 18 10596 1 1 2 MET HE1 H -16.153 18.413 -1.617 1.00 . A A . 2 MET HE1 1 1 18 10597 1 1 2 MET HE2 H -17.159 17.400 -0.582 1.00 . A A . 2 MET HE2 1 1 18 10598 1 1 2 MET HE3 H -17.196 19.154 -0.403 1.00 . A A . 2 MET HE3 1 1 18 10599 1 1 2 MET HG2 H -13.173 18.253 -0.603 1.00 . A A . 2 MET HG2 1 1 18 10600 1 1 2 MET HG3 H -14.342 17.185 -1.380 1.00 . A A . 2 MET HG3 1 1 18 10601 1 1 2 MET N N -13.769 14.357 -1.187 1.00 . A A . 2 MET N 1 1 18 10602 1 1 2 MET O O -10.398 14.692 -0.535 1.00 . A A . 2 MET O 1 1 18 10603 1 1 2 MET SD S -15.242 18.209 0.572 1.00 . A A . 2 MET SD 1 1 18 10604 1 1 3 ASP C C -10.385 11.712 0.651 1.00 . A A . 3 ASP C 1 1 18 10605 1 1 3 ASP CA C -10.837 12.883 1.518 1.00 . A A . 3 ASP CA 1 1 18 10606 1 1 3 ASP CB C -11.369 12.367 2.856 1.00 . A A . 3 ASP CB 1 1 18 10607 1 1 3 ASP CG C -12.620 11.526 2.696 1.00 . A A . 3 ASP CG 1 1 18 10608 1 1 3 ASP H H -12.796 13.572 1.107 1.00 . A A . 3 ASP H 1 1 18 10609 1 1 3 ASP HA H -9.991 13.528 1.701 1.00 . A A . 3 ASP HA 1 1 18 10610 1 1 3 ASP HB2 H -10.610 11.762 3.329 1.00 . A A . 3 ASP HB2 1 1 18 10611 1 1 3 ASP HB3 H -11.601 13.208 3.493 1.00 . A A . 3 ASP HB3 1 1 18 10612 1 1 3 ASP N N -11.859 13.670 0.837 1.00 . A A . 3 ASP N 1 1 18 10613 1 1 3 ASP O O -11.183 10.846 0.295 1.00 . A A . 3 ASP O 1 1 18 10614 1 1 3 ASP OD1 O -13.482 11.896 1.871 1.00 . A A . 3 ASP OD1 1 1 18 10615 1 1 3 ASP OD2 O -12.738 10.498 3.394 1.00 . A A . 3 ASP OD2 1 1 18 10616 1 1 4 CYS C C -7.086 10.358 -0.136 1.00 . A A . 4 CYS C 1 1 18 10617 1 1 4 CYS CA C -8.540 10.628 -0.508 1.00 . A A . 4 CYS CA 1 1 18 10618 1 1 4 CYS CB C -8.639 10.995 -1.989 1.00 . A A . 4 CYS CB 1 1 18 10619 1 1 4 CYS H H -8.512 12.411 0.631 1.00 . A A . 4 CYS H 1 1 18 10620 1 1 4 CYS HA H -9.116 9.733 -0.329 1.00 . A A . 4 CYS HA 1 1 18 10621 1 1 4 CYS HB2 H -8.396 12.040 -2.111 1.00 . A A . 4 CYS HB2 1 1 18 10622 1 1 4 CYS HB3 H -7.932 10.399 -2.548 1.00 . A A . 4 CYS HB3 1 1 18 10623 1 1 4 CYS N N -9.099 11.693 0.317 1.00 . A A . 4 CYS N 1 1 18 10624 1 1 4 CYS O O -6.210 11.193 -0.365 1.00 . A A . 4 CYS O 1 1 18 10625 1 1 4 CYS SG S -10.289 10.724 -2.713 1.00 . A A . 4 CYS SG 1 1 18 10626 1 1 5 THR C C -4.563 8.722 -0.372 1.00 . A A . 5 THR C 1 1 18 10627 1 1 5 THR CA C -5.486 8.805 0.840 1.00 . A A . 5 THR CA 1 1 18 10628 1 1 5 THR CB C -5.508 7.462 1.576 1.00 . A A . 5 THR CB 1 1 18 10629 1 1 5 THR CG2 C -4.816 7.508 2.921 1.00 . A A . 5 THR CG2 1 1 18 10630 1 1 5 THR H H -7.575 8.562 0.592 1.00 . A A . 5 THR H 1 1 18 10631 1 1 5 THR HA H -5.114 9.566 1.509 1.00 . A A . 5 THR HA 1 1 18 10632 1 1 5 THR HB H -5.005 6.721 0.971 1.00 . A A . 5 THR HB 1 1 18 10633 1 1 5 THR HG1 H -6.943 6.133 1.462 1.00 . A A . 5 THR HG1 1 1 18 10634 1 1 5 THR HG21 H -3.811 7.882 2.796 1.00 . A A . 5 THR HG21 1 1 18 10635 1 1 5 THR HG22 H -5.363 8.160 3.586 1.00 . A A . 5 THR HG22 1 1 18 10636 1 1 5 THR HG23 H -4.780 6.513 3.342 1.00 . A A . 5 THR HG23 1 1 18 10637 1 1 5 THR N N -6.835 9.186 0.437 1.00 . A A . 5 THR N 1 1 18 10638 1 1 5 THR O O -4.966 8.264 -1.441 1.00 . A A . 5 THR O 1 1 18 10639 1 1 5 THR OG1 O -6.839 7.027 1.794 1.00 . A A . 5 THR OG1 1 1 18 10640 1 1 6 THR C C -1.052 8.474 -0.831 1.00 . A A . 6 THR C 1 1 18 10641 1 1 6 THR CA C -2.345 9.147 -1.280 1.00 . A A . 6 THR CA 1 1 18 10642 1 1 6 THR CB C -2.053 10.569 -1.760 1.00 . A A . 6 THR CB 1 1 18 10643 1 1 6 THR CG2 C -3.212 11.202 -2.498 1.00 . A A . 6 THR CG2 1 1 18 10644 1 1 6 THR H H -3.062 9.525 0.676 1.00 . A A . 6 THR H 1 1 18 10645 1 1 6 THR HA H -2.767 8.581 -2.097 1.00 . A A . 6 THR HA 1 1 18 10646 1 1 6 THR HB H -1.207 10.544 -2.433 1.00 . A A . 6 THR HB 1 1 18 10647 1 1 6 THR HG1 H -0.950 11.931 -0.885 1.00 . A A . 6 THR HG1 1 1 18 10648 1 1 6 THR HG21 H -3.867 10.429 -2.872 1.00 . A A . 6 THR HG21 1 1 18 10649 1 1 6 THR HG22 H -3.761 11.843 -1.824 1.00 . A A . 6 THR HG22 1 1 18 10650 1 1 6 THR HG23 H -2.837 11.787 -3.325 1.00 . A A . 6 THR HG23 1 1 18 10651 1 1 6 THR N N -3.324 9.170 -0.199 1.00 . A A . 6 THR N 1 1 18 10652 1 1 6 THR O O -0.438 8.881 0.155 1.00 . A A . 6 THR O 1 1 18 10653 1 1 6 THR OG1 O -1.727 11.411 -0.668 1.00 . A A . 6 THR OG1 1 1 18 10654 1 1 7 GLY C C 0.729 5.440 -2.010 1.00 . A A . 7 GLY C 1 1 18 10655 1 1 7 GLY CA C 0.574 6.730 -1.226 1.00 . A A . 7 GLY CA 1 1 18 10656 1 1 7 GLY H H -1.174 7.164 -2.339 1.00 . A A . 7 GLY H 1 1 18 10657 1 1 7 GLY HA2 H 0.564 6.499 -0.172 1.00 . A A . 7 GLY HA2 1 1 18 10658 1 1 7 GLY HA3 H 1.420 7.368 -1.435 1.00 . A A . 7 GLY HA3 1 1 18 10659 1 1 7 GLY N N -0.644 7.442 -1.563 1.00 . A A . 7 GLY N 1 1 18 10660 1 1 7 GLY O O -0.017 5.195 -2.959 1.00 . A A . 7 GLY O 1 1 18 10661 1 1 8 PRO C C 0.948 2.234 -1.918 1.00 . A A . 8 PRO C 1 1 18 10662 1 1 8 PRO CA C 1.944 3.318 -2.320 1.00 . A A . 8 PRO CA 1 1 18 10663 1 1 8 PRO CB C 3.352 2.948 -1.859 1.00 . A A . 8 PRO CB 1 1 18 10664 1 1 8 PRO CD C 2.639 4.803 -0.518 1.00 . A A . 8 PRO CD 1 1 18 10665 1 1 8 PRO CG C 3.468 3.544 -0.499 1.00 . A A . 8 PRO CG 1 1 18 10666 1 1 8 PRO HA H 1.933 3.436 -3.393 1.00 . A A . 8 PRO HA 1 1 18 10667 1 1 8 PRO HB2 H 3.455 1.873 -1.832 1.00 . A A . 8 PRO HB2 1 1 18 10668 1 1 8 PRO HB3 H 4.079 3.369 -2.537 1.00 . A A . 8 PRO HB3 1 1 18 10669 1 1 8 PRO HD2 H 2.107 4.918 0.415 1.00 . A A . 8 PRO HD2 1 1 18 10670 1 1 8 PRO HD3 H 3.266 5.663 -0.702 1.00 . A A . 8 PRO HD3 1 1 18 10671 1 1 8 PRO HG2 H 3.082 2.854 0.237 1.00 . A A . 8 PRO HG2 1 1 18 10672 1 1 8 PRO HG3 H 4.500 3.779 -0.288 1.00 . A A . 8 PRO HG3 1 1 18 10673 1 1 8 PRO N N 1.699 4.589 -1.636 1.00 . A A . 8 PRO N 1 1 18 10674 1 1 8 PRO O O 0.589 1.377 -2.726 1.00 . A A . 8 PRO O 1 1 18 10675 1 1 9 CYS C C -1.849 1.560 -0.689 1.00 . A A . 9 CYS C 1 1 18 10676 1 1 9 CYS CA C -0.443 1.291 -0.157 1.00 . A A . 9 CYS CA 1 1 18 10677 1 1 9 CYS CB C -0.450 1.300 1.373 1.00 . A A . 9 CYS CB 1 1 18 10678 1 1 9 CYS H H 0.832 2.979 -0.065 1.00 . A A . 9 CYS H 1 1 18 10679 1 1 9 CYS HA H -0.124 0.317 -0.499 1.00 . A A . 9 CYS HA 1 1 18 10680 1 1 9 CYS HB2 H 0.438 1.802 1.726 1.00 . A A . 9 CYS HB2 1 1 18 10681 1 1 9 CYS HB3 H -1.322 1.835 1.720 1.00 . A A . 9 CYS HB3 1 1 18 10682 1 1 9 CYS N N 0.508 2.274 -0.664 1.00 . A A . 9 CYS N 1 1 18 10683 1 1 9 CYS O O -2.661 0.644 -0.811 1.00 . A A . 9 CYS O 1 1 18 10684 1 1 9 CYS SG S -0.481 -0.358 2.128 1.00 . A A . 9 CYS SG 1 1 18 10685 1 1 10 CYS C C -3.328 3.645 -2.987 1.00 . A A . 10 CYS C 1 1 18 10686 1 1 10 CYS CA C -3.437 3.201 -1.532 1.00 . A A . 10 CYS CA 1 1 18 10687 1 1 10 CYS CB C -4.045 4.321 -0.683 1.00 . A A . 10 CYS CB 1 1 18 10688 1 1 10 CYS H H -1.442 3.506 -0.893 1.00 . A A . 10 CYS H 1 1 18 10689 1 1 10 CYS HA H -4.080 2.334 -1.480 1.00 . A A . 10 CYS HA 1 1 18 10690 1 1 10 CYS HB2 H -5.061 4.494 -1.005 1.00 . A A . 10 CYS HB2 1 1 18 10691 1 1 10 CYS HB3 H -4.049 4.014 0.353 1.00 . A A . 10 CYS HB3 1 1 18 10692 1 1 10 CYS N N -2.130 2.819 -1.009 1.00 . A A . 10 CYS N 1 1 18 10693 1 1 10 CYS O O -2.432 4.408 -3.348 1.00 . A A . 10 CYS O 1 1 18 10694 1 1 10 CYS SG S -3.154 5.907 -0.788 1.00 . A A . 10 CYS SG 1 1 18 10695 1 1 11 ARG C C -4.380 5.011 -5.439 1.00 . A A . 11 ARG C 1 1 18 10696 1 1 11 ARG CA C -4.240 3.501 -5.239 1.00 . A A . 11 ARG CA 1 1 18 10697 1 1 11 ARG CB C -5.359 2.752 -5.969 1.00 . A A . 11 ARG CB 1 1 18 10698 1 1 11 ARG CD C -5.658 1.042 -7.786 1.00 . A A . 11 ARG CD 1 1 18 10699 1 1 11 ARG CG C -4.938 1.389 -6.493 1.00 . A A . 11 ARG CG 1 1 18 10700 1 1 11 ARG CZ C -7.962 0.994 -8.659 1.00 . A A . 11 ARG CZ 1 1 18 10701 1 1 11 ARG H H -4.928 2.550 -3.477 1.00 . A A . 11 ARG H 1 1 18 10702 1 1 11 ARG HA H -3.292 3.190 -5.648 1.00 . A A . 11 ARG HA 1 1 18 10703 1 1 11 ARG HB2 H -6.186 2.612 -5.288 1.00 . A A . 11 ARG HB2 1 1 18 10704 1 1 11 ARG HB3 H -5.690 3.348 -6.806 1.00 . A A . 11 ARG HB3 1 1 18 10705 1 1 11 ARG HD2 H -5.331 1.721 -8.559 1.00 . A A . 11 ARG HD2 1 1 18 10706 1 1 11 ARG HD3 H -5.403 0.030 -8.064 1.00 . A A . 11 ARG HD3 1 1 18 10707 1 1 11 ARG HE H -7.467 1.336 -6.756 1.00 . A A . 11 ARG HE 1 1 18 10708 1 1 11 ARG HG2 H -3.874 1.397 -6.677 1.00 . A A . 11 ARG HG2 1 1 18 10709 1 1 11 ARG HG3 H -5.170 0.640 -5.749 1.00 . A A . 11 ARG HG3 1 1 18 10710 1 1 11 ARG HH11 H -6.531 0.651 -10.048 1.00 . A A . 11 ARG HH11 1 1 18 10711 1 1 11 ARG HH12 H -8.160 0.622 -10.637 1.00 . A A . 11 ARG HH12 1 1 18 10712 1 1 11 ARG HH21 H -9.609 1.299 -7.529 1.00 . A A . 11 ARG HH21 1 1 18 10713 1 1 11 ARG HH22 H -9.907 0.991 -9.207 1.00 . A A . 11 ARG HH22 1 1 18 10714 1 1 11 ARG N N -4.241 3.157 -3.822 1.00 . A A . 11 ARG N 1 1 18 10715 1 1 11 ARG NE N -7.109 1.144 -7.648 1.00 . A A . 11 ARG NE 1 1 18 10716 1 1 11 ARG NH1 N -7.514 0.735 -9.882 1.00 . A A . 11 ARG NH1 1 1 18 10717 1 1 11 ARG NH2 N -9.266 1.103 -8.448 1.00 . A A . 11 ARG NH2 1 1 18 10718 1 1 11 ARG O O -3.388 5.740 -5.410 1.00 . A A . 11 ARG O 1 1 18 10719 1 1 12 GLN C C -6.800 7.454 -4.781 1.00 . A A . 12 GLN C 1 1 18 10720 1 1 12 GLN CA C -5.859 6.901 -5.849 1.00 . A A . 12 GLN CA 1 1 18 10721 1 1 12 GLN CB C -6.452 7.140 -7.239 1.00 . A A . 12 GLN CB 1 1 18 10722 1 1 12 GLN CD C -6.529 8.697 -9.226 1.00 . A A . 12 GLN CD 1 1 18 10723 1 1 12 GLN CG C -6.280 8.566 -7.736 1.00 . A A . 12 GLN CG 1 1 18 10724 1 1 12 GLN H H -6.363 4.855 -5.660 1.00 . A A . 12 GLN H 1 1 18 10725 1 1 12 GLN HA H -4.913 7.417 -5.779 1.00 . A A . 12 GLN HA 1 1 18 10726 1 1 12 GLN HB2 H -5.971 6.476 -7.941 1.00 . A A . 12 GLN HB2 1 1 18 10727 1 1 12 GLN HB3 H -7.508 6.916 -7.210 1.00 . A A . 12 GLN HB3 1 1 18 10728 1 1 12 GLN HE21 H -4.949 9.891 -9.409 1.00 . A A . 12 GLN HE21 1 1 18 10729 1 1 12 GLN HE22 H -5.816 9.564 -10.868 1.00 . A A . 12 GLN HE22 1 1 18 10730 1 1 12 GLN HG2 H -6.978 9.203 -7.213 1.00 . A A . 12 GLN HG2 1 1 18 10731 1 1 12 GLN HG3 H -5.271 8.889 -7.524 1.00 . A A . 12 GLN HG3 1 1 18 10732 1 1 12 GLN N N -5.609 5.479 -5.644 1.00 . A A . 12 GLN N 1 1 18 10733 1 1 12 GLN NE2 N -5.679 9.461 -9.903 1.00 . A A . 12 GLN NE2 1 1 18 10734 1 1 12 GLN O O -6.824 8.659 -4.528 1.00 . A A . 12 GLN O 1 1 18 10735 1 1 12 GLN OE1 O -7.474 8.119 -9.763 1.00 . A A . 12 GLN OE1 1 1 18 10736 1 1 13 CYS C C -9.225 5.770 -2.518 1.00 . A A . 13 CYS C 1 1 18 10737 1 1 13 CYS CA C -8.517 6.979 -3.122 1.00 . A A . 13 CYS CA 1 1 18 10738 1 1 13 CYS CB C -9.549 7.951 -3.698 1.00 . A A . 13 CYS CB 1 1 18 10739 1 1 13 CYS H H -7.515 5.624 -4.402 1.00 . A A . 13 CYS H 1 1 18 10740 1 1 13 CYS HA H -7.958 7.479 -2.346 1.00 . A A . 13 CYS HA 1 1 18 10741 1 1 13 CYS HB2 H -9.035 8.737 -4.230 1.00 . A A . 13 CYS HB2 1 1 18 10742 1 1 13 CYS HB3 H -10.190 7.419 -4.385 1.00 . A A . 13 CYS HB3 1 1 18 10743 1 1 13 CYS N N -7.576 6.571 -4.159 1.00 . A A . 13 CYS N 1 1 18 10744 1 1 13 CYS O O -10.402 5.840 -2.166 1.00 . A A . 13 CYS O 1 1 18 10745 1 1 13 CYS SG S -10.612 8.738 -2.444 1.00 . A A . 13 CYS SG 1 1 18 10746 1 1 14 LYS C C -7.961 2.472 -1.432 1.00 . A A . 14 LYS C 1 1 18 10747 1 1 14 LYS CA C -9.065 3.442 -1.835 1.00 . A A . 14 LYS CA 1 1 18 10748 1 1 14 LYS CB C -10.004 2.775 -2.842 1.00 . A A . 14 LYS CB 1 1 18 10749 1 1 14 LYS CD C -12.382 1.988 -3.041 1.00 . A A . 14 LYS CD 1 1 18 10750 1 1 14 LYS CE C -13.629 1.833 -2.185 1.00 . A A . 14 LYS CE 1 1 18 10751 1 1 14 LYS CG C -11.120 1.972 -2.194 1.00 . A A . 14 LYS CG 1 1 18 10752 1 1 14 LYS H H -7.567 4.662 -2.694 1.00 . A A . 14 LYS H 1 1 18 10753 1 1 14 LYS HA H -9.629 3.713 -0.955 1.00 . A A . 14 LYS HA 1 1 18 10754 1 1 14 LYS HB2 H -10.452 3.540 -3.459 1.00 . A A . 14 LYS HB2 1 1 18 10755 1 1 14 LYS HB3 H -9.428 2.110 -3.469 1.00 . A A . 14 LYS HB3 1 1 18 10756 1 1 14 LYS HD2 H -12.436 2.927 -3.571 1.00 . A A . 14 LYS HD2 1 1 18 10757 1 1 14 LYS HD3 H -12.339 1.174 -3.750 1.00 . A A . 14 LYS HD3 1 1 18 10758 1 1 14 LYS HE2 H -14.484 1.721 -2.835 1.00 . A A . 14 LYS HE2 1 1 18 10759 1 1 14 LYS HE3 H -13.523 0.948 -1.575 1.00 . A A . 14 LYS HE3 1 1 18 10760 1 1 14 LYS HG2 H -10.792 0.950 -2.075 1.00 . A A . 14 LYS HG2 1 1 18 10761 1 1 14 LYS HG3 H -11.341 2.397 -1.226 1.00 . A A . 14 LYS HG3 1 1 18 10762 1 1 14 LYS HZ1 H -13.395 3.854 -1.710 1.00 . A A . 14 LYS HZ1 1 1 18 10763 1 1 14 LYS HZ2 H -14.863 3.193 -1.189 1.00 . A A . 14 LYS HZ2 1 1 18 10764 1 1 14 LYS HZ3 H -13.432 2.833 -0.362 1.00 . A A . 14 LYS HZ3 1 1 18 10765 1 1 14 LYS N N -8.501 4.661 -2.398 1.00 . A A . 14 LYS N 1 1 18 10766 1 1 14 LYS NZ N -13.845 3.011 -1.300 1.00 . A A . 14 LYS NZ 1 1 18 10767 1 1 14 LYS O O -7.097 2.130 -2.240 1.00 . A A . 14 LYS O 1 1 18 10768 1 1 15 LEU C C -6.829 -0.090 -0.611 1.00 . A A . 15 LEU C 1 1 18 10769 1 1 15 LEU CA C -6.994 1.098 0.332 1.00 . A A . 15 LEU CA 1 1 18 10770 1 1 15 LEU CB C -7.388 0.612 1.729 1.00 . A A . 15 LEU CB 1 1 18 10771 1 1 15 LEU CD1 C -5.018 0.610 2.547 1.00 . A A . 15 LEU CD1 1 1 18 10772 1 1 15 LEU CD2 C -6.515 2.550 3.057 1.00 . A A . 15 LEU CD2 1 1 18 10773 1 1 15 LEU CG C -6.444 1.044 2.852 1.00 . A A . 15 LEU CG 1 1 18 10774 1 1 15 LEU H H -8.707 2.340 0.418 1.00 . A A . 15 LEU H 1 1 18 10775 1 1 15 LEU HA H -6.054 1.624 0.395 1.00 . A A . 15 LEU HA 1 1 18 10776 1 1 15 LEU HB2 H -8.376 0.989 1.952 1.00 . A A . 15 LEU HB2 1 1 18 10777 1 1 15 LEU HB3 H -7.427 -0.467 1.717 1.00 . A A . 15 LEU HB3 1 1 18 10778 1 1 15 LEU HD11 H -5.031 -0.175 1.806 1.00 . A A . 15 LEU HD11 1 1 18 10779 1 1 15 LEU HD12 H -4.459 1.453 2.168 1.00 . A A . 15 LEU HD12 1 1 18 10780 1 1 15 LEU HD13 H -4.552 0.246 3.450 1.00 . A A . 15 LEU HD13 1 1 18 10781 1 1 15 LEU HD21 H -7.448 2.924 2.663 1.00 . A A . 15 LEU HD21 1 1 18 10782 1 1 15 LEU HD22 H -6.454 2.773 4.112 1.00 . A A . 15 LEU HD22 1 1 18 10783 1 1 15 LEU HD23 H -5.691 3.022 2.542 1.00 . A A . 15 LEU HD23 1 1 18 10784 1 1 15 LEU HG H -6.749 0.566 3.771 1.00 . A A . 15 LEU HG 1 1 18 10785 1 1 15 LEU N N -7.994 2.031 -0.179 1.00 . A A . 15 LEU N 1 1 18 10786 1 1 15 LEU O O -7.757 -0.877 -0.802 1.00 . A A . 15 LEU O 1 1 18 10787 1 1 16 LYS C C -5.767 -2.650 -1.533 1.00 . A A . 16 LYS C 1 1 18 10788 1 1 16 LYS CA C -5.358 -1.302 -2.128 1.00 . A A . 16 LYS CA 1 1 18 10789 1 1 16 LYS CB C -3.871 -1.319 -2.486 1.00 . A A . 16 LYS CB 1 1 18 10790 1 1 16 LYS CD C -1.936 -0.148 -3.581 1.00 . A A . 16 LYS CD 1 1 18 10791 1 1 16 LYS CE C -1.538 0.870 -4.637 1.00 . A A . 16 LYS CE 1 1 18 10792 1 1 16 LYS CG C -3.435 -0.130 -3.326 1.00 . A A . 16 LYS CG 1 1 18 10793 1 1 16 LYS H H -4.945 0.449 -1.011 1.00 . A A . 16 LYS H 1 1 18 10794 1 1 16 LYS HA H -5.933 -1.128 -3.026 1.00 . A A . 16 LYS HA 1 1 18 10795 1 1 16 LYS HB2 H -3.293 -1.320 -1.574 1.00 . A A . 16 LYS HB2 1 1 18 10796 1 1 16 LYS HB3 H -3.656 -2.221 -3.039 1.00 . A A . 16 LYS HB3 1 1 18 10797 1 1 16 LYS HD2 H -1.421 0.083 -2.661 1.00 . A A . 16 LYS HD2 1 1 18 10798 1 1 16 LYS HD3 H -1.650 -1.134 -3.919 1.00 . A A . 16 LYS HD3 1 1 18 10799 1 1 16 LYS HE2 H -2.385 1.051 -5.282 1.00 . A A . 16 LYS HE2 1 1 18 10800 1 1 16 LYS HE3 H -1.260 1.790 -4.144 1.00 . A A . 16 LYS HE3 1 1 18 10801 1 1 16 LYS HG2 H -3.951 -0.162 -4.274 1.00 . A A . 16 LYS HG2 1 1 18 10802 1 1 16 LYS HG3 H -3.691 0.780 -2.805 1.00 . A A . 16 LYS HG3 1 1 18 10803 1 1 16 LYS HZ1 H 0.173 -0.291 -4.928 1.00 . A A . 16 LYS HZ1 1 1 18 10804 1 1 16 LYS HZ2 H -0.744 -0.060 -6.330 1.00 . A A . 16 LYS HZ2 1 1 18 10805 1 1 16 LYS HZ3 H 0.213 1.199 -5.727 1.00 . A A . 16 LYS HZ3 1 1 18 10806 1 1 16 LYS N N -5.644 -0.212 -1.201 1.00 . A A . 16 LYS N 1 1 18 10807 1 1 16 LYS NZ N -0.394 0.396 -5.463 1.00 . A A . 16 LYS NZ 1 1 18 10808 1 1 16 LYS O O -5.855 -2.798 -0.314 1.00 . A A . 16 LYS O 1 1 18 10809 1 1 17 PRO C C -5.476 -5.564 -0.899 1.00 . A A . 17 PRO C 1 1 18 10810 1 1 17 PRO CA C -6.428 -4.989 -1.943 1.00 . A A . 17 PRO CA 1 1 18 10811 1 1 17 PRO CB C -6.381 -5.824 -3.224 1.00 . A A . 17 PRO CB 1 1 18 10812 1 1 17 PRO CD C -5.946 -3.560 -3.860 1.00 . A A . 17 PRO CD 1 1 18 10813 1 1 17 PRO CG C -6.580 -4.842 -4.326 1.00 . A A . 17 PRO CG 1 1 18 10814 1 1 17 PRO HA H -7.433 -4.987 -1.548 1.00 . A A . 17 PRO HA 1 1 18 10815 1 1 17 PRO HB2 H -5.422 -6.316 -3.301 1.00 . A A . 17 PRO HB2 1 1 18 10816 1 1 17 PRO HB3 H -7.170 -6.561 -3.206 1.00 . A A . 17 PRO HB3 1 1 18 10817 1 1 17 PRO HD2 H -4.918 -3.507 -4.188 1.00 . A A . 17 PRO HD2 1 1 18 10818 1 1 17 PRO HD3 H -6.504 -2.710 -4.223 1.00 . A A . 17 PRO HD3 1 1 18 10819 1 1 17 PRO HG2 H -6.094 -5.195 -5.224 1.00 . A A . 17 PRO HG2 1 1 18 10820 1 1 17 PRO HG3 H -7.635 -4.696 -4.501 1.00 . A A . 17 PRO HG3 1 1 18 10821 1 1 17 PRO N N -6.025 -3.652 -2.391 1.00 . A A . 17 PRO N 1 1 18 10822 1 1 17 PRO O O -4.257 -5.497 -1.053 1.00 . A A . 17 PRO O 1 1 18 10823 1 1 18 ALA C C -4.322 -7.805 0.691 1.00 . A A . 18 ALA C 1 1 18 10824 1 1 18 ALA CA C -5.245 -6.719 1.232 1.00 . A A . 18 ALA CA 1 1 18 10825 1 1 18 ALA CB C -6.151 -7.284 2.315 1.00 . A A . 18 ALA CB 1 1 18 10826 1 1 18 ALA H H -7.020 -6.153 0.228 1.00 . A A . 18 ALA H 1 1 18 10827 1 1 18 ALA HA H -4.644 -5.935 1.671 1.00 . A A . 18 ALA HA 1 1 18 10828 1 1 18 ALA HB1 H -6.866 -6.533 2.615 1.00 . A A . 18 ALA HB1 1 1 18 10829 1 1 18 ALA HB2 H -5.555 -7.575 3.168 1.00 . A A . 18 ALA HB2 1 1 18 10830 1 1 18 ALA HB3 H -6.675 -8.147 1.932 1.00 . A A . 18 ALA HB3 1 1 18 10831 1 1 18 ALA N N -6.043 -6.130 0.163 1.00 . A A . 18 ALA N 1 1 18 10832 1 1 18 ALA O O -4.746 -8.669 -0.076 1.00 . A A . 18 ALA O 1 1 18 10833 1 1 19 GLY C C -1.487 -8.378 -0.706 1.00 . A A . 19 GLY C 1 1 18 10834 1 1 19 GLY CA C -2.093 -8.738 0.637 1.00 . A A . 19 GLY CA 1 1 18 10835 1 1 19 GLY H H -2.774 -7.042 1.704 1.00 . A A . 19 GLY H 1 1 18 10836 1 1 19 GLY HA2 H -2.586 -9.696 0.552 1.00 . A A . 19 GLY HA2 1 1 18 10837 1 1 19 GLY HA3 H -1.301 -8.816 1.367 1.00 . A A . 19 GLY HA3 1 1 18 10838 1 1 19 GLY N N -3.057 -7.754 1.094 1.00 . A A . 19 GLY N 1 1 18 10839 1 1 19 GLY O O -0.976 -9.245 -1.415 1.00 . A A . 19 GLY O 1 1 18 10840 1 1 20 THR C C 0.247 -5.772 -2.089 1.00 . A A . 20 THR C 1 1 18 10841 1 1 20 THR CA C -0.996 -6.625 -2.323 1.00 . A A . 20 THR CA 1 1 18 10842 1 1 20 THR CB C -2.048 -5.818 -3.087 1.00 . A A . 20 THR CB 1 1 18 10843 1 1 20 THR CG2 C -1.558 -5.308 -4.425 1.00 . A A . 20 THR CG2 1 1 18 10844 1 1 20 THR H H -1.963 -6.453 -0.450 1.00 . A A . 20 THR H 1 1 18 10845 1 1 20 THR HA H -0.721 -7.489 -2.908 1.00 . A A . 20 THR HA 1 1 18 10846 1 1 20 THR HB H -2.333 -4.963 -2.491 1.00 . A A . 20 THR HB 1 1 18 10847 1 1 20 THR HG1 H -3.622 -6.815 -2.486 1.00 . A A . 20 THR HG1 1 1 18 10848 1 1 20 THR HG21 H -0.521 -5.018 -4.343 1.00 . A A . 20 THR HG21 1 1 18 10849 1 1 20 THR HG22 H -1.655 -6.089 -5.165 1.00 . A A . 20 THR HG22 1 1 18 10850 1 1 20 THR HG23 H -2.148 -4.454 -4.723 1.00 . A A . 20 THR HG23 1 1 18 10851 1 1 20 THR N N -1.544 -7.097 -1.057 1.00 . A A . 20 THR N 1 1 18 10852 1 1 20 THR O O 0.180 -4.721 -1.452 1.00 . A A . 20 THR O 1 1 18 10853 1 1 20 THR OG1 O -3.204 -6.601 -3.323 1.00 . A A . 20 THR OG1 1 1 18 10854 1 1 21 THR C C 2.536 -4.105 -3.032 1.00 . A A . 21 THR C 1 1 18 10855 1 1 21 THR CA C 2.639 -5.513 -2.453 1.00 . A A . 21 THR CA 1 1 18 10856 1 1 21 THR CB C 3.779 -6.278 -3.133 1.00 . A A . 21 THR CB 1 1 18 10857 1 1 21 THR CG2 C 4.936 -6.572 -2.203 1.00 . A A . 21 THR CG2 1 1 18 10858 1 1 21 THR H H 1.370 -7.078 -3.104 1.00 . A A . 21 THR H 1 1 18 10859 1 1 21 THR HA H 2.849 -5.439 -1.397 1.00 . A A . 21 THR HA 1 1 18 10860 1 1 21 THR HB H 4.158 -5.688 -3.955 1.00 . A A . 21 THR HB 1 1 18 10861 1 1 21 THR HG1 H 3.084 -8.098 -2.923 1.00 . A A . 21 THR HG1 1 1 18 10862 1 1 21 THR HG21 H 4.556 -6.827 -1.225 1.00 . A A . 21 THR HG21 1 1 18 10863 1 1 21 THR HG22 H 5.511 -7.399 -2.594 1.00 . A A . 21 THR HG22 1 1 18 10864 1 1 21 THR HG23 H 5.568 -5.699 -2.128 1.00 . A A . 21 THR HG23 1 1 18 10865 1 1 21 THR N N 1.380 -6.233 -2.607 1.00 . A A . 21 THR N 1 1 18 10866 1 1 21 THR O O 2.142 -3.924 -4.184 1.00 . A A . 21 THR O 1 1 18 10867 1 1 21 THR OG1 O 3.320 -7.515 -3.649 1.00 . A A . 21 THR OG1 1 1 18 10868 1 1 22 CYS C C 4.155 -1.300 -3.300 1.00 . A A . 22 CYS C 1 1 18 10869 1 1 22 CYS CA C 2.839 -1.721 -2.654 1.00 . A A . 22 CYS CA 1 1 18 10870 1 1 22 CYS CB C 2.526 -0.810 -1.465 1.00 . A A . 22 CYS CB 1 1 18 10871 1 1 22 CYS H H 3.198 -3.321 -1.316 1.00 . A A . 22 CYS H 1 1 18 10872 1 1 22 CYS HA H 2.049 -1.630 -3.384 1.00 . A A . 22 CYS HA 1 1 18 10873 1 1 22 CYS HB2 H 2.389 0.200 -1.822 1.00 . A A . 22 CYS HB2 1 1 18 10874 1 1 22 CYS HB3 H 1.613 -1.146 -0.995 1.00 . A A . 22 CYS HB3 1 1 18 10875 1 1 22 CYS N N 2.892 -3.112 -2.224 1.00 . A A . 22 CYS N 1 1 18 10876 1 1 22 CYS O O 4.165 -0.589 -4.306 1.00 . A A . 22 CYS O 1 1 18 10877 1 1 22 CYS SG S 3.827 -0.774 -0.190 1.00 . A A . 22 CYS SG 1 1 18 10878 1 1 23 TRP C C 7.477 -2.649 -3.284 1.00 . A A . 23 TRP C 1 1 18 10879 1 1 23 TRP CA C 6.586 -1.412 -3.236 1.00 . A A . 23 TRP CA 1 1 18 10880 1 1 23 TRP CB C 7.240 -0.331 -2.373 1.00 . A A . 23 TRP CB 1 1 18 10881 1 1 23 TRP CD1 C 8.818 0.776 -4.060 1.00 . A A . 23 TRP CD1 1 1 18 10882 1 1 23 TRP CD2 C 9.844 -0.066 -2.257 1.00 . A A . 23 TRP CD2 1 1 18 10883 1 1 23 TRP CE2 C 10.816 0.510 -3.098 1.00 . A A . 23 TRP CE2 1 1 18 10884 1 1 23 TRP CE3 C 10.255 -0.658 -1.059 1.00 . A A . 23 TRP CE3 1 1 18 10885 1 1 23 TRP CG C 8.573 0.116 -2.891 1.00 . A A . 23 TRP CG 1 1 18 10886 1 1 23 TRP CH2 C 12.545 -0.077 -1.601 1.00 . A A . 23 TRP CH2 1 1 18 10887 1 1 23 TRP CZ2 C 12.171 0.509 -2.779 1.00 . A A . 23 TRP CZ2 1 1 18 10888 1 1 23 TRP CZ3 C 11.601 -0.657 -0.744 1.00 . A A . 23 TRP CZ3 1 1 18 10889 1 1 23 TRP H H 5.191 -2.305 -1.917 1.00 . A A . 23 TRP H 1 1 18 10890 1 1 23 TRP HA H 6.462 -1.033 -4.239 1.00 . A A . 23 TRP HA 1 1 18 10891 1 1 23 TRP HB2 H 6.591 0.531 -2.335 1.00 . A A . 23 TRP HB2 1 1 18 10892 1 1 23 TRP HB3 H 7.381 -0.715 -1.373 1.00 . A A . 23 TRP HB3 1 1 18 10893 1 1 23 TRP HD1 H 8.056 1.061 -4.770 1.00 . A A . 23 TRP HD1 1 1 18 10894 1 1 23 TRP HE1 H 10.590 1.477 -4.946 1.00 . A A . 23 TRP HE1 1 1 18 10895 1 1 23 TRP HE3 H 9.542 -1.110 -0.386 1.00 . A A . 23 TRP HE3 1 1 18 10896 1 1 23 TRP HH2 H 13.586 -0.100 -1.314 1.00 . A A . 23 TRP HH2 1 1 18 10897 1 1 23 TRP HZ2 H 12.911 0.953 -3.428 1.00 . A A . 23 TRP HZ2 1 1 18 10898 1 1 23 TRP HZ3 H 11.938 -1.111 0.177 1.00 . A A . 23 TRP HZ3 1 1 18 10899 1 1 23 TRP N N 5.264 -1.743 -2.716 1.00 . A A . 23 TRP N 1 1 18 10900 1 1 23 TRP NE1 N 10.165 1.017 -4.192 1.00 . A A . 23 TRP NE1 1 1 18 10901 1 1 23 TRP O O 7.455 -3.478 -2.373 1.00 . A A . 23 TRP O 1 1 18 10902 1 1 24 ARG C C 10.400 -3.505 -5.308 1.00 . A A . 24 ARG C 1 1 18 10903 1 1 24 ARG CA C 9.158 -3.904 -4.517 1.00 . A A . 24 ARG CA 1 1 18 10904 1 1 24 ARG CB C 8.437 -5.052 -5.224 1.00 . A A . 24 ARG CB 1 1 18 10905 1 1 24 ARG CD C 7.818 -5.771 -7.551 1.00 . A A . 24 ARG CD 1 1 18 10906 1 1 24 ARG CG C 7.777 -4.644 -6.531 1.00 . A A . 24 ARG CG 1 1 18 10907 1 1 24 ARG CZ C 7.669 -8.230 -7.520 1.00 . A A . 24 ARG CZ 1 1 18 10908 1 1 24 ARG H H 8.233 -2.074 -5.043 1.00 . A A . 24 ARG H 1 1 18 10909 1 1 24 ARG HA H 9.462 -4.232 -3.535 1.00 . A A . 24 ARG HA 1 1 18 10910 1 1 24 ARG HB2 H 9.150 -5.835 -5.435 1.00 . A A . 24 ARG HB2 1 1 18 10911 1 1 24 ARG HB3 H 7.673 -5.441 -4.567 1.00 . A A . 24 ARG HB3 1 1 18 10912 1 1 24 ARG HD2 H 7.157 -5.523 -8.368 1.00 . A A . 24 ARG HD2 1 1 18 10913 1 1 24 ARG HD3 H 8.827 -5.867 -7.922 1.00 . A A . 24 ARG HD3 1 1 18 10914 1 1 24 ARG HE H 6.893 -7.020 -6.136 1.00 . A A . 24 ARG HE 1 1 18 10915 1 1 24 ARG HG2 H 6.748 -4.384 -6.338 1.00 . A A . 24 ARG HG2 1 1 18 10916 1 1 24 ARG HG3 H 8.298 -3.787 -6.933 1.00 . A A . 24 ARG HG3 1 1 18 10917 1 1 24 ARG HH11 H 8.671 -7.471 -9.105 1.00 . A A . 24 ARG HH11 1 1 18 10918 1 1 24 ARG HH12 H 8.553 -9.198 -9.060 1.00 . A A . 24 ARG HH12 1 1 18 10919 1 1 24 ARG HH21 H 6.736 -9.291 -6.075 1.00 . A A . 24 ARG HH21 1 1 18 10920 1 1 24 ARG HH22 H 7.454 -10.232 -7.340 1.00 . A A . 24 ARG HH22 1 1 18 10921 1 1 24 ARG N N 8.260 -2.767 -4.351 1.00 . A A . 24 ARG N 1 1 18 10922 1 1 24 ARG NE N 7.400 -7.046 -6.974 1.00 . A A . 24 ARG NE 1 1 18 10923 1 1 24 ARG NH1 N 8.354 -8.305 -8.655 1.00 . A A . 24 ARG NH1 1 1 18 10924 1 1 24 ARG NH2 N 7.253 -9.342 -6.930 1.00 . A A . 24 ARG NH2 1 1 18 10925 1 1 24 ARG O O 10.337 -2.652 -6.194 1.00 . A A . 24 ARG O 1 1 18 10926 1 1 25 THR C C 13.786 -4.971 -5.461 1.00 . A A . 25 THR C 1 1 18 10927 1 1 25 THR CA C 12.785 -3.837 -5.662 1.00 . A A . 25 THR CA 1 1 18 10928 1 1 25 THR CB C 13.375 -2.523 -5.148 1.00 . A A . 25 THR CB 1 1 18 10929 1 1 25 THR CG2 C 14.305 -1.857 -6.139 1.00 . A A . 25 THR CG2 1 1 18 10930 1 1 25 THR H H 11.515 -4.797 -4.267 1.00 . A A . 25 THR H 1 1 18 10931 1 1 25 THR HA H 12.577 -3.740 -6.716 1.00 . A A . 25 THR HA 1 1 18 10932 1 1 25 THR HB H 13.938 -2.720 -4.247 1.00 . A A . 25 THR HB 1 1 18 10933 1 1 25 THR HG1 H 11.849 -1.394 -5.631 1.00 . A A . 25 THR HG1 1 1 18 10934 1 1 25 THR HG21 H 15.065 -2.559 -6.447 1.00 . A A . 25 THR HG21 1 1 18 10935 1 1 25 THR HG22 H 13.741 -1.535 -7.002 1.00 . A A . 25 THR HG22 1 1 18 10936 1 1 25 THR HG23 H 14.773 -1.001 -5.675 1.00 . A A . 25 THR HG23 1 1 18 10937 1 1 25 THR N N 11.528 -4.127 -4.982 1.00 . A A . 25 THR N 1 1 18 10938 1 1 25 THR O O 14.982 -4.734 -5.290 1.00 . A A . 25 THR O 1 1 18 10939 1 1 25 THR OG1 O 12.347 -1.599 -4.836 1.00 . A A . 25 THR OG1 1 1 18 10940 1 1 26 SER C C 14.824 -7.345 -3.940 1.00 . A A . 26 SER C 1 1 18 10941 1 1 26 SER CA C 14.137 -7.374 -5.301 1.00 . A A . 26 SER CA 1 1 18 10942 1 1 26 SER CB C 15.186 -7.445 -6.413 1.00 . A A . 26 SER CB 1 1 18 10943 1 1 26 SER H H 12.326 -6.327 -5.621 1.00 . A A . 26 SER H 1 1 18 10944 1 1 26 SER HA H 13.509 -8.250 -5.355 1.00 . A A . 26 SER HA 1 1 18 10945 1 1 26 SER HB2 H 15.562 -6.453 -6.614 1.00 . A A . 26 SER HB2 1 1 18 10946 1 1 26 SER HB3 H 15.999 -8.082 -6.097 1.00 . A A . 26 SER HB3 1 1 18 10947 1 1 26 SER HG H 14.774 -8.920 -7.635 1.00 . A A . 26 SER HG 1 1 18 10948 1 1 26 SER N N 13.288 -6.203 -5.481 1.00 . A A . 26 SER N 1 1 18 10949 1 1 26 SER O O 15.928 -7.865 -3.779 1.00 . A A . 26 SER O 1 1 18 10950 1 1 26 SER OG O 14.630 -7.972 -7.606 1.00 . A A . 26 SER OG 1 1 18 10951 1 1 27 VAL C C 13.732 -7.184 -0.581 1.00 . A A . 27 VAL C 1 1 18 10952 1 1 27 VAL CA C 14.712 -6.637 -1.614 1.00 . A A . 27 VAL CA 1 1 18 10953 1 1 27 VAL CB C 15.067 -5.180 -1.255 1.00 . A A . 27 VAL CB 1 1 18 10954 1 1 27 VAL CG1 C 13.826 -4.301 -1.283 1.00 . A A . 27 VAL CG1 1 1 18 10955 1 1 27 VAL CG2 C 15.746 -5.113 0.106 1.00 . A A . 27 VAL CG2 1 1 18 10956 1 1 27 VAL H H 13.288 -6.338 -3.151 1.00 . A A . 27 VAL H 1 1 18 10957 1 1 27 VAL HA H 15.615 -7.224 -1.580 1.00 . A A . 27 VAL HA 1 1 18 10958 1 1 27 VAL HB H 15.760 -4.808 -1.996 1.00 . A A . 27 VAL HB 1 1 18 10959 1 1 27 VAL HG11 H 13.236 -4.540 -2.156 1.00 . A A . 27 VAL HG11 1 1 18 10960 1 1 27 VAL HG12 H 13.240 -4.476 -0.393 1.00 . A A . 27 VAL HG12 1 1 18 10961 1 1 27 VAL HG13 H 14.121 -3.263 -1.322 1.00 . A A . 27 VAL HG13 1 1 18 10962 1 1 27 VAL HG21 H 16.353 -5.995 0.249 1.00 . A A . 27 VAL HG21 1 1 18 10963 1 1 27 VAL HG22 H 16.372 -4.234 0.153 1.00 . A A . 27 VAL HG22 1 1 18 10964 1 1 27 VAL HG23 H 14.996 -5.063 0.881 1.00 . A A . 27 VAL HG23 1 1 18 10965 1 1 27 VAL N N 14.164 -6.733 -2.961 1.00 . A A . 27 VAL N 1 1 18 10966 1 1 27 VAL O O 14.121 -7.898 0.344 1.00 . A A . 27 VAL O 1 1 18 10967 1 1 28 SER C C 10.037 -7.127 -0.450 1.00 . A A . 28 SER C 1 1 18 10968 1 1 28 SER CA C 11.420 -7.299 0.169 1.00 . A A . 28 SER CA 1 1 18 10969 1 1 28 SER CB C 11.500 -6.528 1.488 1.00 . A A . 28 SER CB 1 1 18 10970 1 1 28 SER H H 12.215 -6.273 -1.503 1.00 . A A . 28 SER H 1 1 18 10971 1 1 28 SER HA H 11.586 -8.347 0.365 1.00 . A A . 28 SER HA 1 1 18 10972 1 1 28 SER HB2 H 11.895 -5.540 1.302 1.00 . A A . 28 SER HB2 1 1 18 10973 1 1 28 SER HB3 H 10.511 -6.446 1.915 1.00 . A A . 28 SER HB3 1 1 18 10974 1 1 28 SER HG H 13.133 -6.662 2.562 1.00 . A A . 28 SER HG 1 1 18 10975 1 1 28 SER N N 12.460 -6.844 -0.746 1.00 . A A . 28 SER N 1 1 18 10976 1 1 28 SER O O 9.909 -6.718 -1.604 1.00 . A A . 28 SER O 1 1 18 10977 1 1 28 SER OG O 12.344 -7.189 2.415 1.00 . A A . 28 SER OG 1 1 18 10978 1 1 29 SER C C 6.755 -6.628 0.889 1.00 . A A . 29 SER C 1 1 18 10979 1 1 29 SER CA C 7.630 -7.322 -0.149 1.00 . A A . 29 SER CA 1 1 18 10980 1 1 29 SER CB C 7.058 -8.704 -0.473 1.00 . A A . 29 SER CB 1 1 18 10981 1 1 29 SER H H 9.170 -7.763 1.235 1.00 . A A . 29 SER H 1 1 18 10982 1 1 29 SER HA H 7.640 -6.727 -1.050 1.00 . A A . 29 SER HA 1 1 18 10983 1 1 29 SER HB2 H 6.801 -9.209 0.446 1.00 . A A . 29 SER HB2 1 1 18 10984 1 1 29 SER HB3 H 6.172 -8.591 -1.080 1.00 . A A . 29 SER HB3 1 1 18 10985 1 1 29 SER HG H 8.410 -8.963 -1.867 1.00 . A A . 29 SER HG 1 1 18 10986 1 1 29 SER N N 9.004 -7.442 0.324 1.00 . A A . 29 SER N 1 1 18 10987 1 1 29 SER O O 6.587 -7.121 2.004 1.00 . A A . 29 SER O 1 1 18 10988 1 1 29 SER OG O 7.998 -9.493 -1.180 1.00 . A A . 29 SER OG 1 1 18 10989 1 1 30 HIS C C 3.878 -4.851 1.015 1.00 . A A . 30 HIS C 1 1 18 10990 1 1 30 HIS CA C 5.343 -4.716 1.415 1.00 . A A . 30 HIS CA 1 1 18 10991 1 1 30 HIS CB C 5.750 -3.241 1.412 1.00 . A A . 30 HIS CB 1 1 18 10992 1 1 30 HIS CD2 C 8.144 -3.886 2.175 1.00 . A A . 30 HIS CD2 1 1 18 10993 1 1 30 HIS CE1 C 9.012 -1.873 2.241 1.00 . A A . 30 HIS CE1 1 1 18 10994 1 1 30 HIS CG C 7.176 -3.013 1.809 1.00 . A A . 30 HIS CG 1 1 18 10995 1 1 30 HIS H H 6.373 -5.136 -0.387 1.00 . A A . 30 HIS H 1 1 18 10996 1 1 30 HIS HA H 5.471 -5.113 2.410 1.00 . A A . 30 HIS HA 1 1 18 10997 1 1 30 HIS HB2 H 5.614 -2.839 0.419 1.00 . A A . 30 HIS HB2 1 1 18 10998 1 1 30 HIS HB3 H 5.121 -2.700 2.104 1.00 . A A . 30 HIS HB3 1 1 18 10999 1 1 30 HIS HD1 H 7.303 -0.915 1.650 1.00 . A A . 30 HIS HD1 1 1 18 11000 1 1 30 HIS HD2 H 8.046 -4.960 2.247 1.00 . A A . 30 HIS HD2 1 1 18 11001 1 1 30 HIS HE1 H 9.708 -1.058 2.370 1.00 . A A . 30 HIS HE1 1 1 18 11002 1 1 30 HIS HE2 H 10.159 -3.522 2.642 1.00 . A A . 30 HIS HE2 1 1 18 11003 1 1 30 HIS N N 6.201 -5.479 0.515 1.00 . A A . 30 HIS N 1 1 18 11004 1 1 30 HIS ND1 N 7.751 -1.761 1.861 1.00 . A A . 30 HIS ND1 1 1 18 11005 1 1 30 HIS NE2 N 9.274 -3.152 2.439 1.00 . A A . 30 HIS NE2 1 1 18 11006 1 1 30 HIS O O 3.342 -4.014 0.289 1.00 . A A . 30 HIS O 1 1 18 11007 1 1 31 TYR C C 0.929 -5.196 1.955 1.00 . A A . 31 TYR C 1 1 18 11008 1 1 31 TYR CA C 1.830 -6.157 1.186 1.00 . A A . 31 TYR CA 1 1 18 11009 1 1 31 TYR CB C 1.458 -7.602 1.521 1.00 . A A . 31 TYR CB 1 1 18 11010 1 1 31 TYR CD1 C 3.356 -9.259 1.360 1.00 . A A . 31 TYR CD1 1 1 18 11011 1 1 31 TYR CD2 C 1.953 -8.967 -0.544 1.00 . A A . 31 TYR CD2 1 1 18 11012 1 1 31 TYR CE1 C 4.102 -10.197 0.672 1.00 . A A . 31 TYR CE1 1 1 18 11013 1 1 31 TYR CE2 C 2.693 -9.905 -1.239 1.00 . A A . 31 TYR CE2 1 1 18 11014 1 1 31 TYR CG C 2.271 -8.628 0.765 1.00 . A A . 31 TYR CG 1 1 18 11015 1 1 31 TYR CZ C 3.766 -10.517 -0.627 1.00 . A A . 31 TYR CZ 1 1 18 11016 1 1 31 TYR H H 3.716 -6.544 2.067 1.00 . A A . 31 TYR H 1 1 18 11017 1 1 31 TYR HA H 1.690 -5.994 0.128 1.00 . A A . 31 TYR HA 1 1 18 11018 1 1 31 TYR HB2 H 1.612 -7.770 2.577 1.00 . A A . 31 TYR HB2 1 1 18 11019 1 1 31 TYR HB3 H 0.416 -7.762 1.284 1.00 . A A . 31 TYR HB3 1 1 18 11020 1 1 31 TYR HD1 H 3.617 -9.007 2.378 1.00 . A A . 31 TYR HD1 1 1 18 11021 1 1 31 TYR HD2 H 1.112 -8.485 -1.022 1.00 . A A . 31 TYR HD2 1 1 18 11022 1 1 31 TYR HE1 H 4.942 -10.677 1.152 1.00 . A A . 31 TYR HE1 1 1 18 11023 1 1 31 TYR HE2 H 2.430 -10.154 -2.256 1.00 . A A . 31 TYR HE2 1 1 18 11024 1 1 31 TYR HH H 4.629 -11.158 -2.221 1.00 . A A . 31 TYR HH 1 1 18 11025 1 1 31 TYR N N 3.235 -5.911 1.493 1.00 . A A . 31 TYR N 1 1 18 11026 1 1 31 TYR O O 1.118 -4.975 3.151 1.00 . A A . 31 TYR O 1 1 18 11027 1 1 31 TYR OH O 4.505 -11.451 -1.315 1.00 . A A . 31 TYR OH 1 1 18 11028 1 1 32 CYS C C -2.042 -4.433 2.685 1.00 . A A . 32 CYS C 1 1 18 11029 1 1 32 CYS CA C -0.982 -3.692 1.878 1.00 . A A . 32 CYS CA 1 1 18 11030 1 1 32 CYS CB C -1.652 -2.826 0.810 1.00 . A A . 32 CYS CB 1 1 18 11031 1 1 32 CYS H H -0.152 -4.844 0.310 1.00 . A A . 32 CYS H 1 1 18 11032 1 1 32 CYS HA H -0.419 -3.055 2.544 1.00 . A A . 32 CYS HA 1 1 18 11033 1 1 32 CYS HB2 H -0.957 -2.667 -0.001 1.00 . A A . 32 CYS HB2 1 1 18 11034 1 1 32 CYS HB3 H -2.524 -3.340 0.435 1.00 . A A . 32 CYS HB3 1 1 18 11035 1 1 32 CYS N N -0.051 -4.628 1.260 1.00 . A A . 32 CYS N 1 1 18 11036 1 1 32 CYS O O -2.533 -5.482 2.268 1.00 . A A . 32 CYS O 1 1 18 11037 1 1 32 CYS SG S -2.186 -1.190 1.408 1.00 . A A . 32 CYS SG 1 1 18 11038 1 1 33 THR C C -4.791 -3.950 4.404 1.00 . A A . 33 THR C 1 1 18 11039 1 1 33 THR CA C -3.395 -4.491 4.707 1.00 . A A . 33 THR CA 1 1 18 11040 1 1 33 THR CB C -3.051 -4.243 6.177 1.00 . A A . 33 THR CB 1 1 18 11041 1 1 33 THR CG2 C -1.582 -4.431 6.489 1.00 . A A . 33 THR CG2 1 1 18 11042 1 1 33 THR H H -1.965 -3.044 4.121 1.00 . A A . 33 THR H 1 1 18 11043 1 1 33 THR HA H -3.388 -5.555 4.522 1.00 . A A . 33 THR HA 1 1 18 11044 1 1 33 THR HB H -3.610 -4.935 6.789 1.00 . A A . 33 THR HB 1 1 18 11045 1 1 33 THR HG1 H -2.847 -2.296 6.095 1.00 . A A . 33 THR HG1 1 1 18 11046 1 1 33 THR HG21 H -1.094 -4.904 5.650 1.00 . A A . 33 THR HG21 1 1 18 11047 1 1 33 THR HG22 H -1.127 -3.469 6.675 1.00 . A A . 33 THR HG22 1 1 18 11048 1 1 33 THR HG23 H -1.477 -5.054 7.365 1.00 . A A . 33 THR HG23 1 1 18 11049 1 1 33 THR N N -2.391 -3.881 3.842 1.00 . A A . 33 THR N 1 1 18 11050 1 1 33 THR O O -5.738 -4.206 5.148 1.00 . A A . 33 THR O 1 1 18 11051 1 1 33 THR OG1 O -3.405 -2.925 6.559 1.00 . A A . 33 THR OG1 1 1 18 11052 1 1 34 GLY C C -6.876 -1.904 4.081 1.00 . A A . 34 GLY C 1 1 18 11053 1 1 34 GLY CA C -6.203 -2.639 2.936 1.00 . A A . 34 GLY CA 1 1 18 11054 1 1 34 GLY H H -4.130 -3.027 2.751 1.00 . A A . 34 GLY H 1 1 18 11055 1 1 34 GLY HA2 H -6.849 -3.440 2.607 1.00 . A A . 34 GLY HA2 1 1 18 11056 1 1 34 GLY HA3 H -6.058 -1.950 2.117 1.00 . A A . 34 GLY HA3 1 1 18 11057 1 1 34 GLY N N -4.916 -3.200 3.310 1.00 . A A . 34 GLY N 1 1 18 11058 1 1 34 GLY O O -8.102 -1.793 4.119 1.00 . A A . 34 GLY O 1 1 18 11059 1 1 35 ARG C C -6.130 0.771 6.165 1.00 . A A . 35 ARG C 1 1 18 11060 1 1 35 ARG CA C -6.601 -0.679 6.167 1.00 . A A . 35 ARG CA 1 1 18 11061 1 1 35 ARG CB C -6.173 -1.364 7.466 1.00 . A A . 35 ARG CB 1 1 18 11062 1 1 35 ARG CD C -6.362 -1.137 9.962 1.00 . A A . 35 ARG CD 1 1 18 11063 1 1 35 ARG CG C -7.104 -1.087 8.636 1.00 . A A . 35 ARG CG 1 1 18 11064 1 1 35 ARG CZ C -7.350 0.777 11.159 1.00 . A A . 35 ARG CZ 1 1 18 11065 1 1 35 ARG H H -5.106 -1.528 4.931 1.00 . A A . 35 ARG H 1 1 18 11066 1 1 35 ARG HA H -7.678 -0.694 6.102 1.00 . A A . 35 ARG HA 1 1 18 11067 1 1 35 ARG HB2 H -6.142 -2.432 7.304 1.00 . A A . 35 ARG HB2 1 1 18 11068 1 1 35 ARG HB3 H -5.184 -1.021 7.732 1.00 . A A . 35 ARG HB3 1 1 18 11069 1 1 35 ARG HD2 H -6.163 -2.169 10.209 1.00 . A A . 35 ARG HD2 1 1 18 11070 1 1 35 ARG HD3 H -5.428 -0.606 9.857 1.00 . A A . 35 ARG HD3 1 1 18 11071 1 1 35 ARG HE H -7.512 -1.131 11.721 1.00 . A A . 35 ARG HE 1 1 18 11072 1 1 35 ARG HG2 H -7.536 -0.105 8.514 1.00 . A A . 35 ARG HG2 1 1 18 11073 1 1 35 ARG HG3 H -7.888 -1.830 8.643 1.00 . A A . 35 ARG HG3 1 1 18 11074 1 1 35 ARG HH11 H -6.315 1.274 9.493 1.00 . A A . 35 ARG HH11 1 1 18 11075 1 1 35 ARG HH12 H -7.019 2.602 10.353 1.00 . A A . 35 ARG HH12 1 1 18 11076 1 1 35 ARG HH21 H -8.439 0.614 12.853 1.00 . A A . 35 ARG HH21 1 1 18 11077 1 1 35 ARG HH22 H -8.225 2.228 12.261 1.00 . A A . 35 ARG HH22 1 1 18 11078 1 1 35 ARG N N -6.074 -1.404 5.016 1.00 . A A . 35 ARG N 1 1 18 11079 1 1 35 ARG NE N -7.134 -0.532 11.044 1.00 . A A . 35 ARG NE 1 1 18 11080 1 1 35 ARG NH1 N -6.853 1.620 10.261 1.00 . A A . 35 ARG NH1 1 1 18 11081 1 1 35 ARG NH2 N -8.063 1.245 12.174 1.00 . A A . 35 ARG NH2 1 1 18 11082 1 1 35 ARG O O -6.870 1.675 6.554 1.00 . A A . 35 ARG O 1 1 18 11083 1 1 36 SER C C -3.412 2.489 4.464 1.00 . A A . 36 SER C 1 1 18 11084 1 1 36 SER CA C -4.325 2.329 5.676 1.00 . A A . 36 SER CA 1 1 18 11085 1 1 36 SER CB C -3.545 2.621 6.958 1.00 . A A . 36 SER CB 1 1 18 11086 1 1 36 SER H H -4.354 0.226 5.431 1.00 . A A . 36 SER H 1 1 18 11087 1 1 36 SER HA H -5.140 3.032 5.593 1.00 . A A . 36 SER HA 1 1 18 11088 1 1 36 SER HB2 H -3.135 1.700 7.345 1.00 . A A . 36 SER HB2 1 1 18 11089 1 1 36 SER HB3 H -2.741 3.309 6.739 1.00 . A A . 36 SER HB3 1 1 18 11090 1 1 36 SER HG H -4.251 2.744 8.781 1.00 . A A . 36 SER HG 1 1 18 11091 1 1 36 SER N N -4.895 0.987 5.726 1.00 . A A . 36 SER N 1 1 18 11092 1 1 36 SER O O -2.797 1.526 4.007 1.00 . A A . 36 SER O 1 1 18 11093 1 1 36 SER OG O -4.383 3.197 7.945 1.00 . A A . 36 SER OG 1 1 18 11094 1 1 37 CYS C C -1.006 3.987 3.175 1.00 . A A . 37 CYS C 1 1 18 11095 1 1 37 CYS CA C -2.485 3.998 2.794 1.00 . A A . 37 CYS CA 1 1 18 11096 1 1 37 CYS CB C -2.857 5.351 2.185 1.00 . A A . 37 CYS CB 1 1 18 11097 1 1 37 CYS H H -3.839 4.440 4.360 1.00 . A A . 37 CYS H 1 1 18 11098 1 1 37 CYS HA H -2.660 3.225 2.060 1.00 . A A . 37 CYS HA 1 1 18 11099 1 1 37 CYS HB2 H -3.885 5.320 1.858 1.00 . A A . 37 CYS HB2 1 1 18 11100 1 1 37 CYS HB3 H -2.747 6.118 2.938 1.00 . A A . 37 CYS HB3 1 1 18 11101 1 1 37 CYS N N -3.326 3.712 3.950 1.00 . A A . 37 CYS N 1 1 18 11102 1 1 37 CYS O O -0.136 3.857 2.314 1.00 . A A . 37 CYS O 1 1 18 11103 1 1 37 CYS SG S -1.835 5.829 0.753 1.00 . A A . 37 CYS SG 1 1 18 11104 1 1 38 GLU C C 1.239 2.728 4.933 1.00 . A A . 38 GLU C 1 1 18 11105 1 1 38 GLU CA C 0.649 4.134 4.953 1.00 . A A . 38 GLU CA 1 1 18 11106 1 1 38 GLU CB C 0.709 4.705 6.372 1.00 . A A . 38 GLU CB 1 1 18 11107 1 1 38 GLU CD C -0.625 6.826 6.050 1.00 . A A . 38 GLU CD 1 1 18 11108 1 1 38 GLU CG C 0.718 6.224 6.417 1.00 . A A . 38 GLU CG 1 1 18 11109 1 1 38 GLU H H -1.459 4.230 5.109 1.00 . A A . 38 GLU H 1 1 18 11110 1 1 38 GLU HA H 1.230 4.765 4.297 1.00 . A A . 38 GLU HA 1 1 18 11111 1 1 38 GLU HB2 H -0.151 4.355 6.924 1.00 . A A . 38 GLU HB2 1 1 18 11112 1 1 38 GLU HB3 H 1.606 4.346 6.854 1.00 . A A . 38 GLU HB3 1 1 18 11113 1 1 38 GLU HG2 H 0.976 6.540 7.416 1.00 . A A . 38 GLU HG2 1 1 18 11114 1 1 38 GLU HG3 H 1.461 6.587 5.722 1.00 . A A . 38 GLU HG3 1 1 18 11115 1 1 38 GLU N N -0.726 4.128 4.468 1.00 . A A . 38 GLU N 1 1 18 11116 1 1 38 GLU O O 1.201 2.013 5.934 1.00 . A A . 38 GLU O 1 1 18 11117 1 1 38 GLU OE1 O -1.548 6.774 6.890 1.00 . A A . 38 GLU OE1 1 1 18 11118 1 1 38 GLU OE2 O -0.753 7.349 4.924 1.00 . A A . 38 GLU OE2 1 1 18 11119 1 1 39 CYS C C 3.499 0.799 4.656 1.00 . A A . 39 CYS C 1 1 18 11120 1 1 39 CYS CA C 2.384 1.016 3.632 1.00 . A A . 39 CYS CA 1 1 18 11121 1 1 39 CYS CB C 2.940 0.848 2.217 1.00 . A A . 39 CYS CB 1 1 18 11122 1 1 39 CYS H H 1.785 2.952 3.022 1.00 . A A . 39 CYS H 1 1 18 11123 1 1 39 CYS HA H 1.610 0.281 3.794 1.00 . A A . 39 CYS HA 1 1 18 11124 1 1 39 CYS HB2 H 2.406 1.506 1.548 1.00 . A A . 39 CYS HB2 1 1 18 11125 1 1 39 CYS HB3 H 3.987 1.114 2.215 1.00 . A A . 39 CYS HB3 1 1 18 11126 1 1 39 CYS N N 1.785 2.337 3.785 1.00 . A A . 39 CYS N 1 1 18 11127 1 1 39 CYS O O 4.562 1.411 4.562 1.00 . A A . 39 CYS O 1 1 18 11128 1 1 39 CYS SG S 2.796 -0.845 1.557 1.00 . A A . 39 CYS SG 1 1 18 11129 1 1 40 PRO C C 5.621 -0.757 6.099 1.00 . A A . 40 PRO C 1 1 18 11130 1 1 40 PRO CA C 4.270 -0.366 6.689 1.00 . A A . 40 PRO CA 1 1 18 11131 1 1 40 PRO CB C 3.662 -1.543 7.455 1.00 . A A . 40 PRO CB 1 1 18 11132 1 1 40 PRO CD C 2.035 -0.858 5.846 1.00 . A A . 40 PRO CD 1 1 18 11133 1 1 40 PRO CG C 2.195 -1.425 7.229 1.00 . A A . 40 PRO CG 1 1 18 11134 1 1 40 PRO HA H 4.400 0.474 7.355 1.00 . A A . 40 PRO HA 1 1 18 11135 1 1 40 PRO HB2 H 4.050 -2.471 7.062 1.00 . A A . 40 PRO HB2 1 1 18 11136 1 1 40 PRO HB3 H 3.907 -1.458 8.504 1.00 . A A . 40 PRO HB3 1 1 18 11137 1 1 40 PRO HD2 H 1.961 -1.653 5.119 1.00 . A A . 40 PRO HD2 1 1 18 11138 1 1 40 PRO HD3 H 1.166 -0.219 5.798 1.00 . A A . 40 PRO HD3 1 1 18 11139 1 1 40 PRO HG2 H 1.734 -2.400 7.291 1.00 . A A . 40 PRO HG2 1 1 18 11140 1 1 40 PRO HG3 H 1.763 -0.757 7.960 1.00 . A A . 40 PRO HG3 1 1 18 11141 1 1 40 PRO N N 3.273 -0.079 5.652 1.00 . A A . 40 PRO N 1 1 18 11142 1 1 40 PRO O O 5.774 -0.852 4.881 1.00 . A A . 40 PRO O 1 1 18 11143 1 1 41 SER C C 8.250 -2.801 6.936 1.00 . A A . 41 SER C 1 1 18 11144 1 1 41 SER CA C 7.938 -1.363 6.537 1.00 . A A . 41 SER CA 1 1 18 11145 1 1 41 SER CB C 8.980 -0.417 7.138 1.00 . A A . 41 SER CB 1 1 18 11146 1 1 41 SER H H 6.415 -0.890 7.929 1.00 . A A . 41 SER H 1 1 18 11147 1 1 41 SER HA H 7.972 -1.285 5.461 1.00 . A A . 41 SER HA 1 1 18 11148 1 1 41 SER HB2 H 8.670 -0.128 8.131 1.00 . A A . 41 SER HB2 1 1 18 11149 1 1 41 SER HB3 H 9.933 -0.922 7.191 1.00 . A A . 41 SER HB3 1 1 18 11150 1 1 41 SER HG H 10.047 0.864 6.110 1.00 . A A . 41 SER HG 1 1 18 11151 1 1 41 SER N N 6.599 -0.982 6.971 1.00 . A A . 41 SER N 1 1 18 11152 1 1 41 SER O O 9.401 -3.145 7.209 1.00 . A A . 41 SER O 1 1 18 11153 1 1 41 SER OG O 9.124 0.751 6.348 1.00 . A A . 41 SER OG 1 1 18 11154 1 1 42 TYR C C 8.158 -5.797 6.258 1.00 . A A . 42 TYR C 1 1 18 11155 1 1 42 TYR CA C 7.383 -5.040 7.335 1.00 . A A . 42 TYR CA 1 1 18 11156 1 1 42 TYR CB C 6.018 -5.696 7.552 1.00 . A A . 42 TYR CB 1 1 18 11157 1 1 42 TYR CD1 C 5.366 -6.698 9.776 1.00 . A A . 42 TYR CD1 1 1 18 11158 1 1 42 TYR CD2 C 5.166 -4.338 9.503 1.00 . A A . 42 TYR CD2 1 1 18 11159 1 1 42 TYR CE1 C 4.899 -6.592 11.072 1.00 . A A . 42 TYR CE1 1 1 18 11160 1 1 42 TYR CE2 C 4.698 -4.224 10.799 1.00 . A A . 42 TYR CE2 1 1 18 11161 1 1 42 TYR CG C 5.507 -5.575 8.970 1.00 . A A . 42 TYR CG 1 1 18 11162 1 1 42 TYR CZ C 4.567 -5.353 11.579 1.00 . A A . 42 TYR CZ 1 1 18 11163 1 1 42 TYR H H 6.325 -3.305 6.741 1.00 . A A . 42 TYR H 1 1 18 11164 1 1 42 TYR HA H 7.942 -5.078 8.258 1.00 . A A . 42 TYR HA 1 1 18 11165 1 1 42 TYR HB2 H 5.295 -5.230 6.899 1.00 . A A . 42 TYR HB2 1 1 18 11166 1 1 42 TYR HB3 H 6.089 -6.746 7.312 1.00 . A A . 42 TYR HB3 1 1 18 11167 1 1 42 TYR HD1 H 5.627 -7.667 9.376 1.00 . A A . 42 TYR HD1 1 1 18 11168 1 1 42 TYR HD2 H 5.269 -3.456 8.889 1.00 . A A . 42 TYR HD2 1 1 18 11169 1 1 42 TYR HE1 H 4.796 -7.477 11.683 1.00 . A A . 42 TYR HE1 1 1 18 11170 1 1 42 TYR HE2 H 4.438 -3.253 11.195 1.00 . A A . 42 TYR HE2 1 1 18 11171 1 1 42 TYR HH H 4.589 -5.844 13.437 1.00 . A A . 42 TYR HH 1 1 18 11172 1 1 42 TYR N N 7.219 -3.638 6.969 1.00 . A A . 42 TYR N 1 1 18 11173 1 1 42 TYR O O 8.083 -5.461 5.076 1.00 . A A . 42 TYR O 1 1 18 11174 1 1 42 TYR OH O 4.102 -5.244 12.869 1.00 . A A . 42 TYR OH 1 1 18 11175 1 1 43 PRO C C 8.830 -8.506 4.820 1.00 . A A . 43 PRO C 1 1 18 11176 1 1 43 PRO CA C 9.705 -7.639 5.719 1.00 . A A . 43 PRO CA 1 1 18 11177 1 1 43 PRO CB C 10.562 -8.514 6.636 1.00 . A A . 43 PRO CB 1 1 18 11178 1 1 43 PRO CD C 9.060 -7.303 8.047 1.00 . A A . 43 PRO CD 1 1 18 11179 1 1 43 PRO CG C 9.781 -8.614 7.900 1.00 . A A . 43 PRO CG 1 1 18 11180 1 1 43 PRO HA H 10.345 -7.020 5.107 1.00 . A A . 43 PRO HA 1 1 18 11181 1 1 43 PRO HB2 H 10.706 -9.484 6.181 1.00 . A A . 43 PRO HB2 1 1 18 11182 1 1 43 PRO HB3 H 11.518 -8.041 6.800 1.00 . A A . 43 PRO HB3 1 1 18 11183 1 1 43 PRO HD2 H 8.094 -7.452 8.506 1.00 . A A . 43 PRO HD2 1 1 18 11184 1 1 43 PRO HD3 H 9.652 -6.610 8.627 1.00 . A A . 43 PRO HD3 1 1 18 11185 1 1 43 PRO HG2 H 9.072 -9.426 7.831 1.00 . A A . 43 PRO HG2 1 1 18 11186 1 1 43 PRO HG3 H 10.450 -8.769 8.734 1.00 . A A . 43 PRO HG3 1 1 18 11187 1 1 43 PRO N N 8.915 -6.834 6.656 1.00 . A A . 43 PRO N 1 1 18 11188 1 1 43 PRO O O 7.699 -8.840 5.173 1.00 . A A . 43 PRO O 1 1 18 11189 1 1 44 GLY C C 9.515 -10.437 1.759 1.00 . A A . 44 GLY C 1 1 18 11190 1 1 44 GLY CA C 8.614 -9.692 2.725 1.00 . A A . 44 GLY CA 1 1 18 11191 1 1 44 GLY H H 10.267 -8.571 3.428 1.00 . A A . 44 GLY H 1 1 18 11192 1 1 44 GLY HA2 H 7.944 -9.061 2.160 1.00 . A A . 44 GLY HA2 1 1 18 11193 1 1 44 GLY HA3 H 8.032 -10.410 3.283 1.00 . A A . 44 GLY HA3 1 1 18 11194 1 1 44 GLY N N 9.361 -8.867 3.656 1.00 . A A . 44 GLY N 1 1 18 11195 1 1 44 GLY O O 9.719 -9.939 0.632 1.00 . A A . 44 GLY O 1 1 18 11196 1 1 44 GLY OXT O 10.016 -11.519 2.130 1.00 . A A . 44 GLY OXT 1 1 19 11197 1 1 1 ALA C C -15.943 11.904 3.355 1.00 . A A . 1 ALA C 1 1 19 11198 1 1 1 ALA CA C -17.104 12.887 3.454 1.00 . A A . 1 ALA CA 1 1 19 11199 1 1 1 ALA CB C -16.582 14.297 3.686 1.00 . A A . 1 ALA CB 1 1 19 11200 1 1 1 ALA H1 H -17.471 12.242 5.372 1.00 . A A . 1 ALA H1 1 1 19 11201 1 1 1 ALA H2 H -18.649 13.318 4.741 1.00 . A A . 1 ALA H2 1 1 19 11202 1 1 1 ALA H3 H -18.600 11.691 4.203 1.00 . A A . 1 ALA H3 1 1 19 11203 1 1 1 ALA HA H -17.646 12.881 2.519 1.00 . A A . 1 ALA HA 1 1 19 11204 1 1 1 ALA HB1 H -17.337 14.882 4.191 1.00 . A A . 1 ALA HB1 1 1 19 11205 1 1 1 ALA HB2 H -15.692 14.255 4.297 1.00 . A A . 1 ALA HB2 1 1 19 11206 1 1 1 ALA HB3 H -16.346 14.755 2.737 1.00 . A A . 1 ALA HB3 1 1 19 11207 1 1 1 ALA N N -18.040 12.500 4.540 1.00 . A A . 1 ALA N 1 1 19 11208 1 1 1 ALA O O -15.496 11.352 4.361 1.00 . A A . 1 ALA O 1 1 19 11209 1 1 2 MET C C -13.331 11.378 0.946 1.00 . A A . 2 MET C 1 1 19 11210 1 1 2 MET CA C -14.348 10.771 1.907 1.00 . A A . 2 MET CA 1 1 19 11211 1 1 2 MET CB C -14.864 9.443 1.350 1.00 . A A . 2 MET CB 1 1 19 11212 1 1 2 MET CE C -12.138 6.290 1.586 1.00 . A A . 2 MET CE 1 1 19 11213 1 1 2 MET CG C -14.096 8.233 1.855 1.00 . A A . 2 MET CG 1 1 19 11214 1 1 2 MET H H -15.856 12.158 1.374 1.00 . A A . 2 MET H 1 1 19 11215 1 1 2 MET HA H -13.866 10.590 2.855 1.00 . A A . 2 MET HA 1 1 19 11216 1 1 2 MET HB2 H -15.901 9.327 1.630 1.00 . A A . 2 MET HB2 1 1 19 11217 1 1 2 MET HB3 H -14.791 9.465 0.273 1.00 . A A . 2 MET HB3 1 1 19 11218 1 1 2 MET HE1 H -11.735 6.640 2.525 1.00 . A A . 2 MET HE1 1 1 19 11219 1 1 2 MET HE2 H -12.905 5.554 1.775 1.00 . A A . 2 MET HE2 1 1 19 11220 1 1 2 MET HE3 H -11.348 5.844 1.000 1.00 . A A . 2 MET HE3 1 1 19 11221 1 1 2 MET HG2 H -13.611 8.493 2.784 1.00 . A A . 2 MET HG2 1 1 19 11222 1 1 2 MET HG3 H -14.794 7.427 2.028 1.00 . A A . 2 MET HG3 1 1 19 11223 1 1 2 MET N N -15.458 11.689 2.137 1.00 . A A . 2 MET N 1 1 19 11224 1 1 2 MET O O -13.631 12.334 0.231 1.00 . A A . 2 MET O 1 1 19 11225 1 1 2 MET SD S -12.842 7.670 0.687 1.00 . A A . 2 MET SD 1 1 19 11226 1 1 3 ASP C C -10.148 10.160 -0.368 1.00 . A A . 3 ASP C 1 1 19 11227 1 1 3 ASP CA C -11.065 11.301 0.060 1.00 . A A . 3 ASP CA 1 1 19 11228 1 1 3 ASP CB C -10.251 12.386 0.767 1.00 . A A . 3 ASP CB 1 1 19 11229 1 1 3 ASP CG C -11.011 13.692 0.889 1.00 . A A . 3 ASP CG 1 1 19 11230 1 1 3 ASP H H -11.948 10.056 1.527 1.00 . A A . 3 ASP H 1 1 19 11231 1 1 3 ASP HA H -11.527 11.725 -0.818 1.00 . A A . 3 ASP HA 1 1 19 11232 1 1 3 ASP HB2 H -9.995 12.047 1.760 1.00 . A A . 3 ASP HB2 1 1 19 11233 1 1 3 ASP HB3 H -9.344 12.569 0.208 1.00 . A A . 3 ASP HB3 1 1 19 11234 1 1 3 ASP N N -12.127 10.816 0.934 1.00 . A A . 3 ASP N 1 1 19 11235 1 1 3 ASP O O -10.211 9.060 0.182 1.00 . A A . 3 ASP O 1 1 19 11236 1 1 3 ASP OD1 O -11.013 14.277 1.993 1.00 . A A . 3 ASP OD1 1 1 19 11237 1 1 3 ASP OD2 O -11.604 14.130 -0.119 1.00 . A A . 3 ASP OD2 1 1 19 11238 1 1 4 CYS C C -7.059 9.455 -1.075 1.00 . A A . 4 CYS C 1 1 19 11239 1 1 4 CYS CA C -8.368 9.424 -1.856 1.00 . A A . 4 CYS CA 1 1 19 11240 1 1 4 CYS CB C -8.095 9.650 -3.345 1.00 . A A . 4 CYS CB 1 1 19 11241 1 1 4 CYS H H -9.296 11.324 -1.752 1.00 . A A . 4 CYS H 1 1 19 11242 1 1 4 CYS HA H -8.827 8.455 -1.727 1.00 . A A . 4 CYS HA 1 1 19 11243 1 1 4 CYS HB2 H -8.261 10.691 -3.579 1.00 . A A . 4 CYS HB2 1 1 19 11244 1 1 4 CYS HB3 H -7.067 9.398 -3.557 1.00 . A A . 4 CYS HB3 1 1 19 11245 1 1 4 CYS N N -9.298 10.428 -1.354 1.00 . A A . 4 CYS N 1 1 19 11246 1 1 4 CYS O O -6.330 10.447 -1.103 1.00 . A A . 4 CYS O 1 1 19 11247 1 1 4 CYS SG S -9.150 8.659 -4.452 1.00 . A A . 4 CYS SG 1 1 19 11248 1 1 5 THR C C -4.318 8.184 -0.494 1.00 . A A . 5 THR C 1 1 19 11249 1 1 5 THR CA C -5.544 8.260 0.410 1.00 . A A . 5 THR CA 1 1 19 11250 1 1 5 THR CB C -5.600 7.032 1.319 1.00 . A A . 5 THR CB 1 1 19 11251 1 1 5 THR CG2 C -6.116 7.338 2.708 1.00 . A A . 5 THR CG2 1 1 19 11252 1 1 5 THR H H -7.386 7.603 -0.397 1.00 . A A . 5 THR H 1 1 19 11253 1 1 5 THR HA H -5.470 9.147 1.022 1.00 . A A . 5 THR HA 1 1 19 11254 1 1 5 THR HB H -4.605 6.623 1.419 1.00 . A A . 5 THR HB 1 1 19 11255 1 1 5 THR HG1 H -6.204 5.178 1.129 1.00 . A A . 5 THR HG1 1 1 19 11256 1 1 5 THR HG21 H -5.815 8.336 2.992 1.00 . A A . 5 THR HG21 1 1 19 11257 1 1 5 THR HG22 H -7.194 7.272 2.715 1.00 . A A . 5 THR HG22 1 1 19 11258 1 1 5 THR HG23 H -5.708 6.625 3.410 1.00 . A A . 5 THR HG23 1 1 19 11259 1 1 5 THR N N -6.766 8.361 -0.379 1.00 . A A . 5 THR N 1 1 19 11260 1 1 5 THR O O -4.124 7.202 -1.212 1.00 . A A . 5 THR O 1 1 19 11261 1 1 5 THR OG1 O -6.437 6.033 0.761 1.00 . A A . 5 THR OG1 1 1 19 11262 1 1 6 THR C C -1.142 8.522 -0.601 1.00 . A A . 6 THR C 1 1 19 11263 1 1 6 THR CA C -2.286 9.276 -1.272 1.00 . A A . 6 THR CA 1 1 19 11264 1 1 6 THR CB C -1.876 10.728 -1.524 1.00 . A A . 6 THR CB 1 1 19 11265 1 1 6 THR CG2 C -3.002 11.581 -2.067 1.00 . A A . 6 THR CG2 1 1 19 11266 1 1 6 THR H H -3.702 9.978 0.137 1.00 . A A . 6 THR H 1 1 19 11267 1 1 6 THR HA H -2.506 8.804 -2.218 1.00 . A A . 6 THR HA 1 1 19 11268 1 1 6 THR HB H -1.071 10.744 -2.245 1.00 . A A . 6 THR HB 1 1 19 11269 1 1 6 THR HG1 H -2.131 11.366 0.310 1.00 . A A . 6 THR HG1 1 1 19 11270 1 1 6 THR HG21 H -3.554 11.021 -2.807 1.00 . A A . 6 THR HG21 1 1 19 11271 1 1 6 THR HG22 H -3.663 11.861 -1.260 1.00 . A A . 6 THR HG22 1 1 19 11272 1 1 6 THR HG23 H -2.591 12.471 -2.522 1.00 . A A . 6 THR HG23 1 1 19 11273 1 1 6 THR N N -3.493 9.225 -0.455 1.00 . A A . 6 THR N 1 1 19 11274 1 1 6 THR O O -0.837 8.751 0.569 1.00 . A A . 6 THR O 1 1 19 11275 1 1 6 THR OG1 O -1.415 11.333 -0.329 1.00 . A A . 6 THR OG1 1 1 19 11276 1 1 7 GLY C C 0.901 5.620 -1.647 1.00 . A A . 7 GLY C 1 1 19 11277 1 1 7 GLY CA C 0.589 6.848 -0.811 1.00 . A A . 7 GLY CA 1 1 19 11278 1 1 7 GLY H H -0.801 7.482 -2.276 1.00 . A A . 7 GLY H 1 1 19 11279 1 1 7 GLY HA2 H 0.337 6.533 0.191 1.00 . A A . 7 GLY HA2 1 1 19 11280 1 1 7 GLY HA3 H 1.468 7.474 -0.769 1.00 . A A . 7 GLY HA3 1 1 19 11281 1 1 7 GLY N N -0.514 7.622 -1.350 1.00 . A A . 7 GLY N 1 1 19 11282 1 1 7 GLY O O 0.197 5.332 -2.614 1.00 . A A . 7 GLY O 1 1 19 11283 1 1 8 PRO C C 1.356 2.524 -1.845 1.00 . A A . 8 PRO C 1 1 19 11284 1 1 8 PRO CA C 2.353 3.664 -2.030 1.00 . A A . 8 PRO CA 1 1 19 11285 1 1 8 PRO CB C 3.705 3.297 -1.415 1.00 . A A . 8 PRO CB 1 1 19 11286 1 1 8 PRO CD C 2.855 5.140 -0.154 1.00 . A A . 8 PRO CD 1 1 19 11287 1 1 8 PRO CG C 3.670 3.881 -0.046 1.00 . A A . 8 PRO CG 1 1 19 11288 1 1 8 PRO HA H 2.475 3.866 -3.084 1.00 . A A . 8 PRO HA 1 1 19 11289 1 1 8 PRO HB2 H 3.810 2.222 -1.385 1.00 . A A . 8 PRO HB2 1 1 19 11290 1 1 8 PRO HB3 H 4.501 3.725 -2.006 1.00 . A A . 8 PRO HB3 1 1 19 11291 1 1 8 PRO HD2 H 2.288 5.301 0.751 1.00 . A A . 8 PRO HD2 1 1 19 11292 1 1 8 PRO HD3 H 3.493 5.987 -0.357 1.00 . A A . 8 PRO HD3 1 1 19 11293 1 1 8 PRO HG2 H 3.202 3.188 0.637 1.00 . A A . 8 PRO HG2 1 1 19 11294 1 1 8 PRO HG3 H 4.674 4.112 0.281 1.00 . A A . 8 PRO HG3 1 1 19 11295 1 1 8 PRO N N 1.960 4.870 -1.295 1.00 . A A . 8 PRO N 1 1 19 11296 1 1 8 PRO O O 1.012 1.827 -2.800 1.00 . A A . 8 PRO O 1 1 19 11297 1 1 9 CYS C C -1.338 1.447 -1.123 1.00 . A A . 9 CYS C 1 1 19 11298 1 1 9 CYS CA C -0.062 1.286 -0.301 1.00 . A A . 9 CYS CA 1 1 19 11299 1 1 9 CYS CB C -0.396 1.298 1.192 1.00 . A A . 9 CYS CB 1 1 19 11300 1 1 9 CYS H H 1.209 2.930 0.107 1.00 . A A . 9 CYS H 1 1 19 11301 1 1 9 CYS HA H 0.395 0.340 -0.551 1.00 . A A . 9 CYS HA 1 1 19 11302 1 1 9 CYS HB2 H 0.351 1.876 1.715 1.00 . A A . 9 CYS HB2 1 1 19 11303 1 1 9 CYS HB3 H -1.363 1.758 1.335 1.00 . A A . 9 CYS HB3 1 1 19 11304 1 1 9 CYS N N 0.897 2.341 -0.612 1.00 . A A . 9 CYS N 1 1 19 11305 1 1 9 CYS O O -2.039 0.474 -1.395 1.00 . A A . 9 CYS O 1 1 19 11306 1 1 9 CYS SG S -0.448 -0.355 1.958 1.00 . A A . 9 CYS SG 1 1 19 11307 1 1 10 CYS C C -2.508 2.953 -3.795 1.00 . A A . 10 CYS C 1 1 19 11308 1 1 10 CYS CA C -2.825 2.970 -2.304 1.00 . A A . 10 CYS CA 1 1 19 11309 1 1 10 CYS CB C -3.407 4.329 -1.910 1.00 . A A . 10 CYS CB 1 1 19 11310 1 1 10 CYS H H -1.038 3.419 -1.266 1.00 . A A . 10 CYS H 1 1 19 11311 1 1 10 CYS HA H -3.554 2.202 -2.095 1.00 . A A . 10 CYS HA 1 1 19 11312 1 1 10 CYS HB2 H -2.717 5.106 -2.202 1.00 . A A . 10 CYS HB2 1 1 19 11313 1 1 10 CYS HB3 H -4.344 4.474 -2.428 1.00 . A A . 10 CYS HB3 1 1 19 11314 1 1 10 CYS N N -1.634 2.683 -1.514 1.00 . A A . 10 CYS N 1 1 19 11315 1 1 10 CYS O O -1.344 2.973 -4.193 1.00 . A A . 10 CYS O 1 1 19 11316 1 1 10 CYS SG S -3.724 4.513 -0.125 1.00 . A A . 10 CYS SG 1 1 19 11317 1 1 11 ARG C C -3.431 4.311 -6.635 1.00 . A A . 11 ARG C 1 1 19 11318 1 1 11 ARG CA C -3.388 2.896 -6.064 1.00 . A A . 11 ARG CA 1 1 19 11319 1 1 11 ARG CB C -4.478 2.037 -6.710 1.00 . A A . 11 ARG CB 1 1 19 11320 1 1 11 ARG CD C -5.525 1.428 -8.912 1.00 . A A . 11 ARG CD 1 1 19 11321 1 1 11 ARG CG C -4.230 1.747 -8.182 1.00 . A A . 11 ARG CG 1 1 19 11322 1 1 11 ARG CZ C -6.254 0.281 -10.968 1.00 . A A . 11 ARG CZ 1 1 19 11323 1 1 11 ARG H H -4.457 2.901 -4.238 1.00 . A A . 11 ARG H 1 1 19 11324 1 1 11 ARG HA H -2.424 2.462 -6.282 1.00 . A A . 11 ARG HA 1 1 19 11325 1 1 11 ARG HB2 H -4.537 1.096 -6.185 1.00 . A A . 11 ARG HB2 1 1 19 11326 1 1 11 ARG HB3 H -5.424 2.550 -6.621 1.00 . A A . 11 ARG HB3 1 1 19 11327 1 1 11 ARG HD2 H -6.168 0.867 -8.249 1.00 . A A . 11 ARG HD2 1 1 19 11328 1 1 11 ARG HD3 H -6.009 2.354 -9.182 1.00 . A A . 11 ARG HD3 1 1 19 11329 1 1 11 ARG HE H -4.370 0.370 -10.314 1.00 . A A . 11 ARG HE 1 1 19 11330 1 1 11 ARG HG2 H -3.776 2.614 -8.638 1.00 . A A . 11 ARG HG2 1 1 19 11331 1 1 11 ARG HG3 H -3.562 0.902 -8.265 1.00 . A A . 11 ARG HG3 1 1 19 11332 1 1 11 ARG HH11 H -7.746 1.170 -9.930 1.00 . A A . 11 ARG HH11 1 1 19 11333 1 1 11 ARG HH12 H -8.232 0.357 -11.379 1.00 . A A . 11 ARG HH12 1 1 19 11334 1 1 11 ARG HH21 H -5.008 -0.699 -12.221 1.00 . A A . 11 ARG HH21 1 1 19 11335 1 1 11 ARG HH22 H -6.678 -0.704 -12.680 1.00 . A A . 11 ARG HH22 1 1 19 11336 1 1 11 ARG N N -3.553 2.916 -4.616 1.00 . A A . 11 ARG N 1 1 19 11337 1 1 11 ARG NE N -5.292 0.643 -10.122 1.00 . A A . 11 ARG NE 1 1 19 11338 1 1 11 ARG NH1 N -7.514 0.632 -10.740 1.00 . A A . 11 ARG NH1 1 1 19 11339 1 1 11 ARG NH2 N -5.956 -0.432 -12.045 1.00 . A A . 11 ARG NH2 1 1 19 11340 1 1 11 ARG O O -4.134 4.579 -7.609 1.00 . A A . 11 ARG O 1 1 19 11341 1 1 12 GLN C C -3.907 7.352 -6.127 1.00 . A A . 12 GLN C 1 1 19 11342 1 1 12 GLN CA C -2.616 6.606 -6.463 1.00 . A A . 12 GLN CA 1 1 19 11343 1 1 12 GLN CB C -2.357 6.676 -7.968 1.00 . A A . 12 GLN CB 1 1 19 11344 1 1 12 GLN CD C -0.978 7.773 -9.778 1.00 . A A . 12 GLN CD 1 1 19 11345 1 1 12 GLN CG C -1.589 7.915 -8.398 1.00 . A A . 12 GLN CG 1 1 19 11346 1 1 12 GLN H H -2.132 4.938 -5.249 1.00 . A A . 12 GLN H 1 1 19 11347 1 1 12 GLN HA H -1.797 7.083 -5.946 1.00 . A A . 12 GLN HA 1 1 19 11348 1 1 12 GLN HB2 H -1.791 5.806 -8.265 1.00 . A A . 12 GLN HB2 1 1 19 11349 1 1 12 GLN HB3 H -3.306 6.670 -8.484 1.00 . A A . 12 GLN HB3 1 1 19 11350 1 1 12 GLN HE21 H 0.840 8.076 -9.031 1.00 . A A . 12 GLN HE21 1 1 19 11351 1 1 12 GLN HE22 H 0.764 7.812 -10.737 1.00 . A A . 12 GLN HE22 1 1 19 11352 1 1 12 GLN HG2 H -2.264 8.757 -8.405 1.00 . A A . 12 GLN HG2 1 1 19 11353 1 1 12 GLN HG3 H -0.797 8.096 -7.686 1.00 . A A . 12 GLN HG3 1 1 19 11354 1 1 12 GLN N N -2.671 5.214 -6.020 1.00 . A A . 12 GLN N 1 1 19 11355 1 1 12 GLN NE2 N 0.342 7.900 -9.857 1.00 . A A . 12 GLN NE2 1 1 19 11356 1 1 12 GLN O O -4.100 8.491 -6.553 1.00 . A A . 12 GLN O 1 1 19 11357 1 1 12 GLN OE1 O -1.683 7.550 -10.762 1.00 . A A . 12 GLN OE1 1 1 19 11358 1 1 13 CYS C C -6.648 6.642 -3.755 1.00 . A A . 13 CYS C 1 1 19 11359 1 1 13 CYS CA C -6.052 7.328 -4.980 1.00 . A A . 13 CYS CA 1 1 19 11360 1 1 13 CYS CB C -7.045 7.273 -6.142 1.00 . A A . 13 CYS CB 1 1 19 11361 1 1 13 CYS H H -4.584 5.807 -5.051 1.00 . A A . 13 CYS H 1 1 19 11362 1 1 13 CYS HA H -5.855 8.361 -4.737 1.00 . A A . 13 CYS HA 1 1 19 11363 1 1 13 CYS HB2 H -6.497 7.229 -7.072 1.00 . A A . 13 CYS HB2 1 1 19 11364 1 1 13 CYS HB3 H -7.652 6.384 -6.046 1.00 . A A . 13 CYS HB3 1 1 19 11365 1 1 13 CYS N N -4.788 6.711 -5.363 1.00 . A A . 13 CYS N 1 1 19 11366 1 1 13 CYS O O -6.865 7.275 -2.722 1.00 . A A . 13 CYS O 1 1 19 11367 1 1 13 CYS SG S -8.167 8.706 -6.229 1.00 . A A . 13 CYS SG 1 1 19 11368 1 1 14 LYS C C -6.594 3.398 -2.407 1.00 . A A . 14 LYS C 1 1 19 11369 1 1 14 LYS CA C -7.488 4.578 -2.776 1.00 . A A . 14 LYS CA 1 1 19 11370 1 1 14 LYS CB C -8.884 4.077 -3.151 1.00 . A A . 14 LYS CB 1 1 19 11371 1 1 14 LYS CD C -10.023 2.686 -1.394 1.00 . A A . 14 LYS CD 1 1 19 11372 1 1 14 LYS CE C -11.280 2.002 -1.909 1.00 . A A . 14 LYS CE 1 1 19 11373 1 1 14 LYS CG C -9.863 4.076 -1.988 1.00 . A A . 14 LYS CG 1 1 19 11374 1 1 14 LYS H H -6.722 4.894 -4.724 1.00 . A A . 14 LYS H 1 1 19 11375 1 1 14 LYS HA H -7.569 5.233 -1.921 1.00 . A A . 14 LYS HA 1 1 19 11376 1 1 14 LYS HB2 H -9.284 4.710 -3.929 1.00 . A A . 14 LYS HB2 1 1 19 11377 1 1 14 LYS HB3 H -8.803 3.068 -3.526 1.00 . A A . 14 LYS HB3 1 1 19 11378 1 1 14 LYS HD2 H -9.165 2.089 -1.663 1.00 . A A . 14 LYS HD2 1 1 19 11379 1 1 14 LYS HD3 H -10.084 2.769 -0.319 1.00 . A A . 14 LYS HD3 1 1 19 11380 1 1 14 LYS HE2 H -11.697 1.400 -1.116 1.00 . A A . 14 LYS HE2 1 1 19 11381 1 1 14 LYS HE3 H -11.993 2.759 -2.199 1.00 . A A . 14 LYS HE3 1 1 19 11382 1 1 14 LYS HG2 H -9.498 4.743 -1.222 1.00 . A A . 14 LYS HG2 1 1 19 11383 1 1 14 LYS HG3 H -10.825 4.421 -2.339 1.00 . A A . 14 LYS HG3 1 1 19 11384 1 1 14 LYS HZ1 H -10.153 0.547 -2.898 1.00 . A A . 14 LYS HZ1 1 1 19 11385 1 1 14 LYS HZ2 H -11.805 0.501 -3.263 1.00 . A A . 14 LYS HZ2 1 1 19 11386 1 1 14 LYS HZ3 H -10.826 1.709 -3.927 1.00 . A A . 14 LYS HZ3 1 1 19 11387 1 1 14 LYS N N -6.914 5.345 -3.876 1.00 . A A . 14 LYS N 1 1 19 11388 1 1 14 LYS NZ N -10.996 1.128 -3.081 1.00 . A A . 14 LYS NZ 1 1 19 11389 1 1 14 LYS O O -5.791 2.938 -3.219 1.00 . A A . 14 LYS O 1 1 19 11390 1 1 15 LEU C C -6.096 0.581 -1.625 1.00 . A A . 15 LEU C 1 1 19 11391 1 1 15 LEU CA C -5.945 1.785 -0.700 1.00 . A A . 15 LEU CA 1 1 19 11392 1 1 15 LEU CB C -6.358 1.403 0.724 1.00 . A A . 15 LEU CB 1 1 19 11393 1 1 15 LEU CD1 C -8.321 0.317 1.848 1.00 . A A . 15 LEU CD1 1 1 19 11394 1 1 15 LEU CD2 C -8.172 2.810 1.733 1.00 . A A . 15 LEU CD2 1 1 19 11395 1 1 15 LEU CG C -7.857 1.504 1.018 1.00 . A A . 15 LEU CG 1 1 19 11396 1 1 15 LEU H H -7.396 3.324 -0.578 1.00 . A A . 15 LEU H 1 1 19 11397 1 1 15 LEU HA H -4.910 2.091 -0.694 1.00 . A A . 15 LEU HA 1 1 19 11398 1 1 15 LEU HB2 H -6.043 0.385 0.904 1.00 . A A . 15 LEU HB2 1 1 19 11399 1 1 15 LEU HB3 H -5.834 2.049 1.413 1.00 . A A . 15 LEU HB3 1 1 19 11400 1 1 15 LEU HD11 H -8.122 -0.598 1.309 1.00 . A A . 15 LEU HD11 1 1 19 11401 1 1 15 LEU HD12 H -7.790 0.304 2.788 1.00 . A A . 15 LEU HD12 1 1 19 11402 1 1 15 LEU HD13 H -9.381 0.401 2.034 1.00 . A A . 15 LEU HD13 1 1 19 11403 1 1 15 LEU HD21 H -7.389 3.528 1.533 1.00 . A A . 15 LEU HD21 1 1 19 11404 1 1 15 LEU HD22 H -9.115 3.197 1.376 1.00 . A A . 15 LEU HD22 1 1 19 11405 1 1 15 LEU HD23 H -8.234 2.633 2.796 1.00 . A A . 15 LEU HD23 1 1 19 11406 1 1 15 LEU HG H -8.401 1.492 0.085 1.00 . A A . 15 LEU HG 1 1 19 11407 1 1 15 LEU N N -6.740 2.913 -1.178 1.00 . A A . 15 LEU N 1 1 19 11408 1 1 15 LEU O O -7.208 0.197 -1.985 1.00 . A A . 15 LEU O 1 1 19 11409 1 1 16 LYS C C -5.597 -2.378 -2.203 1.00 . A A . 16 LYS C 1 1 19 11410 1 1 16 LYS CA C -4.973 -1.167 -2.893 1.00 . A A . 16 LYS CA 1 1 19 11411 1 1 16 LYS CB C -3.549 -1.498 -3.342 1.00 . A A . 16 LYS CB 1 1 19 11412 1 1 16 LYS CD C -1.775 -1.264 -5.107 1.00 . A A . 16 LYS CD 1 1 19 11413 1 1 16 LYS CE C -0.660 -0.313 -4.704 1.00 . A A . 16 LYS CE 1 1 19 11414 1 1 16 LYS CG C -3.128 -0.777 -4.612 1.00 . A A . 16 LYS CG 1 1 19 11415 1 1 16 LYS H H -4.111 0.345 -1.689 1.00 . A A . 16 LYS H 1 1 19 11416 1 1 16 LYS HA H -5.565 -0.918 -3.761 1.00 . A A . 16 LYS HA 1 1 19 11417 1 1 16 LYS HB2 H -2.863 -1.224 -2.554 1.00 . A A . 16 LYS HB2 1 1 19 11418 1 1 16 LYS HB3 H -3.476 -2.561 -3.517 1.00 . A A . 16 LYS HB3 1 1 19 11419 1 1 16 LYS HD2 H -1.576 -2.236 -4.683 1.00 . A A . 16 LYS HD2 1 1 19 11420 1 1 16 LYS HD3 H -1.802 -1.337 -6.184 1.00 . A A . 16 LYS HD3 1 1 19 11421 1 1 16 LYS HE2 H 0.051 -0.249 -5.514 1.00 . A A . 16 LYS HE2 1 1 19 11422 1 1 16 LYS HE3 H -1.085 0.664 -4.521 1.00 . A A . 16 LYS HE3 1 1 19 11423 1 1 16 LYS HG2 H -3.866 -0.958 -5.379 1.00 . A A . 16 LYS HG2 1 1 19 11424 1 1 16 LYS HG3 H -3.068 0.282 -4.410 1.00 . A A . 16 LYS HG3 1 1 19 11425 1 1 16 LYS HZ1 H 0.382 -1.748 -3.601 1.00 . A A . 16 LYS HZ1 1 1 19 11426 1 1 16 LYS HZ2 H 0.862 -0.158 -3.282 1.00 . A A . 16 LYS HZ2 1 1 19 11427 1 1 16 LYS HZ3 H -0.599 -0.742 -2.661 1.00 . A A . 16 LYS HZ3 1 1 19 11428 1 1 16 LYS N N -4.968 -0.008 -2.008 1.00 . A A . 16 LYS N 1 1 19 11429 1 1 16 LYS NZ N 0.046 -0.772 -3.476 1.00 . A A . 16 LYS NZ 1 1 19 11430 1 1 16 LYS O O -5.780 -2.382 -0.986 1.00 . A A . 16 LYS O 1 1 19 11431 1 1 17 PRO C C -5.709 -5.251 -1.304 1.00 . A A . 17 PRO C 1 1 19 11432 1 1 17 PRO CA C -6.538 -4.646 -2.432 1.00 . A A . 17 PRO CA 1 1 19 11433 1 1 17 PRO CB C -6.576 -5.594 -3.633 1.00 . A A . 17 PRO CB 1 1 19 11434 1 1 17 PRO CD C -5.748 -3.502 -4.436 1.00 . A A . 17 PRO CD 1 1 19 11435 1 1 17 PRO CG C -6.566 -4.701 -4.825 1.00 . A A . 17 PRO CG 1 1 19 11436 1 1 17 PRO HA H -7.543 -4.464 -2.080 1.00 . A A . 17 PRO HA 1 1 19 11437 1 1 17 PRO HB2 H -5.709 -6.238 -3.614 1.00 . A A . 17 PRO HB2 1 1 19 11438 1 1 17 PRO HB3 H -7.476 -6.190 -3.596 1.00 . A A . 17 PRO HB3 1 1 19 11439 1 1 17 PRO HD2 H -4.708 -3.656 -4.686 1.00 . A A . 17 PRO HD2 1 1 19 11440 1 1 17 PRO HD3 H -6.126 -2.613 -4.919 1.00 . A A . 17 PRO HD3 1 1 19 11441 1 1 17 PRO HG2 H -6.110 -5.211 -5.662 1.00 . A A . 17 PRO HG2 1 1 19 11442 1 1 17 PRO HG3 H -7.574 -4.403 -5.070 1.00 . A A . 17 PRO HG3 1 1 19 11443 1 1 17 PRO N N -5.932 -3.425 -2.975 1.00 . A A . 17 PRO N 1 1 19 11444 1 1 17 PRO O O -4.479 -5.238 -1.348 1.00 . A A . 17 PRO O 1 1 19 11445 1 1 18 ALA C C -4.845 -7.562 0.401 1.00 . A A . 18 ALA C 1 1 19 11446 1 1 18 ALA CA C -5.719 -6.394 0.844 1.00 . A A . 18 ALA CA 1 1 19 11447 1 1 18 ALA CB C -6.739 -6.857 1.874 1.00 . A A . 18 ALA CB 1 1 19 11448 1 1 18 ALA H H -7.371 -5.763 -0.317 1.00 . A A . 18 ALA H 1 1 19 11449 1 1 18 ALA HA H -5.093 -5.643 1.305 1.00 . A A . 18 ALA HA 1 1 19 11450 1 1 18 ALA HB1 H -7.547 -6.142 1.926 1.00 . A A . 18 ALA HB1 1 1 19 11451 1 1 18 ALA HB2 H -7.130 -7.821 1.585 1.00 . A A . 18 ALA HB2 1 1 19 11452 1 1 18 ALA HB3 H -6.265 -6.935 2.841 1.00 . A A . 18 ALA HB3 1 1 19 11453 1 1 18 ALA N N -6.392 -5.782 -0.295 1.00 . A A . 18 ALA N 1 1 19 11454 1 1 18 ALA O O -5.349 -8.621 0.028 1.00 . A A . 18 ALA O 1 1 19 11455 1 1 19 GLY C C -1.807 -8.034 -1.190 1.00 . A A . 19 GLY C 1 1 19 11456 1 1 19 GLY CA C -2.607 -8.406 0.044 1.00 . A A . 19 GLY CA 1 1 19 11457 1 1 19 GLY H H -3.188 -6.496 0.750 1.00 . A A . 19 GLY H 1 1 19 11458 1 1 19 GLY HA2 H -3.166 -9.307 -0.162 1.00 . A A . 19 GLY HA2 1 1 19 11459 1 1 19 GLY HA3 H -1.924 -8.597 0.858 1.00 . A A . 19 GLY HA3 1 1 19 11460 1 1 19 GLY N N -3.532 -7.361 0.444 1.00 . A A . 19 GLY N 1 1 19 11461 1 1 19 GLY O O -1.351 -8.908 -1.928 1.00 . A A . 19 GLY O 1 1 19 11462 1 1 20 THR C C 0.358 -5.483 -2.122 1.00 . A A . 20 THR C 1 1 19 11463 1 1 20 THR CA C -0.882 -6.251 -2.567 1.00 . A A . 20 THR CA 1 1 19 11464 1 1 20 THR CB C -1.765 -5.357 -3.439 1.00 . A A . 20 THR CB 1 1 19 11465 1 1 20 THR CG2 C -1.066 -4.861 -4.686 1.00 . A A . 20 THR CG2 1 1 19 11466 1 1 20 THR H H -2.020 -6.086 -0.790 1.00 . A A . 20 THR H 1 1 19 11467 1 1 20 THR HA H -0.572 -7.109 -3.144 1.00 . A A . 20 THR HA 1 1 19 11468 1 1 20 THR HB H -2.065 -4.494 -2.863 1.00 . A A . 20 THR HB 1 1 19 11469 1 1 20 THR HG1 H -3.691 -5.467 -3.773 1.00 . A A . 20 THR HG1 1 1 19 11470 1 1 20 THR HG21 H -0.354 -5.602 -5.019 1.00 . A A . 20 THR HG21 1 1 19 11471 1 1 20 THR HG22 H -1.796 -4.689 -5.463 1.00 . A A . 20 THR HG22 1 1 19 11472 1 1 20 THR HG23 H -0.550 -3.938 -4.467 1.00 . A A . 20 THR HG23 1 1 19 11473 1 1 20 THR N N -1.634 -6.735 -1.414 1.00 . A A . 20 THR N 1 1 19 11474 1 1 20 THR O O 0.258 -4.462 -1.442 1.00 . A A . 20 THR O 1 1 19 11475 1 1 20 THR OG1 O -2.932 -6.049 -3.846 1.00 . A A . 20 THR OG1 1 1 19 11476 1 1 21 THR C C 2.876 -3.939 -2.746 1.00 . A A . 21 THR C 1 1 19 11477 1 1 21 THR CA C 2.788 -5.341 -2.154 1.00 . A A . 21 THR CA 1 1 19 11478 1 1 21 THR CB C 3.967 -6.186 -2.639 1.00 . A A . 21 THR CB 1 1 19 11479 1 1 21 THR CG2 C 3.849 -6.601 -4.089 1.00 . A A . 21 THR CG2 1 1 19 11480 1 1 21 THR H H 1.543 -6.798 -3.053 1.00 . A A . 21 THR H 1 1 19 11481 1 1 21 THR HA H 2.828 -5.268 -1.078 1.00 . A A . 21 THR HA 1 1 19 11482 1 1 21 THR HB H 4.023 -7.085 -2.041 1.00 . A A . 21 THR HB 1 1 19 11483 1 1 21 THR HG1 H 5.443 -5.472 -1.567 1.00 . A A . 21 THR HG1 1 1 19 11484 1 1 21 THR HG21 H 2.876 -6.322 -4.465 1.00 . A A . 21 THR HG21 1 1 19 11485 1 1 21 THR HG22 H 4.614 -6.106 -4.668 1.00 . A A . 21 THR HG22 1 1 19 11486 1 1 21 THR HG23 H 3.973 -7.671 -4.168 1.00 . A A . 21 THR HG23 1 1 19 11487 1 1 21 THR N N 1.527 -5.981 -2.512 1.00 . A A . 21 THR N 1 1 19 11488 1 1 21 THR O O 2.668 -3.745 -3.943 1.00 . A A . 21 THR O 1 1 19 11489 1 1 21 THR OG1 O 5.185 -5.478 -2.492 1.00 . A A . 21 THR OG1 1 1 19 11490 1 1 22 CYS C C 4.701 -1.292 -2.871 1.00 . A A . 22 CYS C 1 1 19 11491 1 1 22 CYS CA C 3.301 -1.577 -2.337 1.00 . A A . 22 CYS CA 1 1 19 11492 1 1 22 CYS CB C 2.979 -0.626 -1.183 1.00 . A A . 22 CYS CB 1 1 19 11493 1 1 22 CYS H H 3.339 -3.180 -0.955 1.00 . A A . 22 CYS H 1 1 19 11494 1 1 22 CYS HA H 2.587 -1.420 -3.131 1.00 . A A . 22 CYS HA 1 1 19 11495 1 1 22 CYS HB2 H 3.024 0.391 -1.542 1.00 . A A . 22 CYS HB2 1 1 19 11496 1 1 22 CYS HB3 H 1.980 -0.832 -0.826 1.00 . A A . 22 CYS HB3 1 1 19 11497 1 1 22 CYS N N 3.185 -2.963 -1.898 1.00 . A A . 22 CYS N 1 1 19 11498 1 1 22 CYS O O 4.879 -0.466 -3.765 1.00 . A A . 22 CYS O 1 1 19 11499 1 1 22 CYS SG S 4.115 -0.763 0.235 1.00 . A A . 22 CYS SG 1 1 19 11500 1 1 23 TRP C C 7.623 -3.088 -3.360 1.00 . A A . 23 TRP C 1 1 19 11501 1 1 23 TRP CA C 7.078 -1.806 -2.737 1.00 . A A . 23 TRP CA 1 1 19 11502 1 1 23 TRP CB C 7.945 -1.392 -1.545 1.00 . A A . 23 TRP CB 1 1 19 11503 1 1 23 TRP CD1 C 9.172 0.767 -0.914 1.00 . A A . 23 TRP CD1 1 1 19 11504 1 1 23 TRP CD2 C 9.360 0.202 -3.073 1.00 . A A . 23 TRP CD2 1 1 19 11505 1 1 23 TRP CE2 C 10.073 1.396 -2.858 1.00 . A A . 23 TRP CE2 1 1 19 11506 1 1 23 TRP CE3 C 9.336 -0.346 -4.359 1.00 . A A . 23 TRP CE3 1 1 19 11507 1 1 23 TRP CG C 8.791 -0.185 -1.816 1.00 . A A . 23 TRP CG 1 1 19 11508 1 1 23 TRP CH2 C 10.716 1.491 -5.128 1.00 . A A . 23 TRP CH2 1 1 19 11509 1 1 23 TRP CZ2 C 10.756 2.050 -3.880 1.00 . A A . 23 TRP CZ2 1 1 19 11510 1 1 23 TRP CZ3 C 10.014 0.304 -5.373 1.00 . A A . 23 TRP CZ3 1 1 19 11511 1 1 23 TRP H H 5.487 -2.629 -1.608 1.00 . A A . 23 TRP H 1 1 19 11512 1 1 23 TRP HA H 7.101 -1.022 -3.478 1.00 . A A . 23 TRP HA 1 1 19 11513 1 1 23 TRP HB2 H 7.305 -1.167 -0.705 1.00 . A A . 23 TRP HB2 1 1 19 11514 1 1 23 TRP HB3 H 8.602 -2.208 -1.283 1.00 . A A . 23 TRP HB3 1 1 19 11515 1 1 23 TRP HD1 H 8.899 0.759 0.131 1.00 . A A . 23 TRP HD1 1 1 19 11516 1 1 23 TRP HE1 H 10.337 2.505 -1.096 1.00 . A A . 23 TRP HE1 1 1 19 11517 1 1 23 TRP HE3 H 8.801 -1.261 -4.567 1.00 . A A . 23 TRP HE3 1 1 19 11518 1 1 23 TRP HH2 H 11.231 1.966 -5.951 1.00 . A A . 23 TRP HH2 1 1 19 11519 1 1 23 TRP HZ2 H 11.302 2.966 -3.708 1.00 . A A . 23 TRP HZ2 1 1 19 11520 1 1 23 TRP HZ3 H 10.007 -0.104 -6.372 1.00 . A A . 23 TRP HZ3 1 1 19 11521 1 1 23 TRP N N 5.692 -1.983 -2.316 1.00 . A A . 23 TRP N 1 1 19 11522 1 1 23 TRP NE1 N 9.944 1.721 -1.533 1.00 . A A . 23 TRP NE1 1 1 19 11523 1 1 23 TRP O O 8.211 -3.923 -2.673 1.00 . A A . 23 TRP O 1 1 19 11524 1 1 24 ARG C C 9.026 -4.057 -6.339 1.00 . A A . 24 ARG C 1 1 19 11525 1 1 24 ARG CA C 7.894 -4.417 -5.381 1.00 . A A . 24 ARG CA 1 1 19 11526 1 1 24 ARG CB C 6.743 -5.063 -6.154 1.00 . A A . 24 ARG CB 1 1 19 11527 1 1 24 ARG CD C 7.999 -7.072 -6.992 1.00 . A A . 24 ARG CD 1 1 19 11528 1 1 24 ARG CG C 6.808 -6.581 -6.185 1.00 . A A . 24 ARG CG 1 1 19 11529 1 1 24 ARG CZ C 9.032 -9.235 -7.565 1.00 . A A . 24 ARG CZ 1 1 19 11530 1 1 24 ARG H H 6.946 -2.537 -5.159 1.00 . A A . 24 ARG H 1 1 19 11531 1 1 24 ARG HA H 8.266 -5.121 -4.652 1.00 . A A . 24 ARG HA 1 1 19 11532 1 1 24 ARG HB2 H 5.809 -4.774 -5.696 1.00 . A A . 24 ARG HB2 1 1 19 11533 1 1 24 ARG HB3 H 6.761 -4.703 -7.172 1.00 . A A . 24 ARG HB3 1 1 19 11534 1 1 24 ARG HD2 H 7.981 -6.597 -7.961 1.00 . A A . 24 ARG HD2 1 1 19 11535 1 1 24 ARG HD3 H 8.906 -6.796 -6.474 1.00 . A A . 24 ARG HD3 1 1 19 11536 1 1 24 ARG HE H 7.135 -8.987 -6.996 1.00 . A A . 24 ARG HE 1 1 19 11537 1 1 24 ARG HG2 H 6.895 -6.949 -5.174 1.00 . A A . 24 ARG HG2 1 1 19 11538 1 1 24 ARG HG3 H 5.901 -6.962 -6.632 1.00 . A A . 24 ARG HG3 1 1 19 11539 1 1 24 ARG HH11 H 10.276 -7.647 -7.712 1.00 . A A . 24 ARG HH11 1 1 19 11540 1 1 24 ARG HH12 H 10.978 -9.179 -8.110 1.00 . A A . 24 ARG HH12 1 1 19 11541 1 1 24 ARG HH21 H 8.056 -11.004 -7.518 1.00 . A A . 24 ARG HH21 1 1 19 11542 1 1 24 ARG HH22 H 9.718 -11.085 -8.000 1.00 . A A . 24 ARG HH22 1 1 19 11543 1 1 24 ARG N N 7.423 -3.237 -4.665 1.00 . A A . 24 ARG N 1 1 19 11544 1 1 24 ARG NE N 7.978 -8.521 -7.174 1.00 . A A . 24 ARG NE 1 1 19 11545 1 1 24 ARG NH1 N 10.190 -8.637 -7.816 1.00 . A A . 24 ARG NH1 1 1 19 11546 1 1 24 ARG NH2 N 8.927 -10.549 -7.706 1.00 . A A . 24 ARG NH2 1 1 19 11547 1 1 24 ARG O O 8.797 -3.822 -7.525 1.00 . A A . 24 ARG O 1 1 19 11548 1 1 25 THR C C 12.432 -4.821 -6.598 1.00 . A A . 25 THR C 1 1 19 11549 1 1 25 THR CA C 11.415 -3.685 -6.623 1.00 . A A . 25 THR CA 1 1 19 11550 1 1 25 THR CB C 12.062 -2.394 -6.118 1.00 . A A . 25 THR CB 1 1 19 11551 1 1 25 THR CG2 C 12.379 -2.422 -4.638 1.00 . A A . 25 THR CG2 1 1 19 11552 1 1 25 THR H H 10.365 -4.213 -4.862 1.00 . A A . 25 THR H 1 1 19 11553 1 1 25 THR HA H 11.083 -3.536 -7.640 1.00 . A A . 25 THR HA 1 1 19 11554 1 1 25 THR HB H 11.384 -1.571 -6.295 1.00 . A A . 25 THR HB 1 1 19 11555 1 1 25 THR HG1 H 13.648 -1.310 -6.496 1.00 . A A . 25 THR HG1 1 1 19 11556 1 1 25 THR HG21 H 12.051 -3.361 -4.217 1.00 . A A . 25 THR HG21 1 1 19 11557 1 1 25 THR HG22 H 13.444 -2.316 -4.496 1.00 . A A . 25 THR HG22 1 1 19 11558 1 1 25 THR HG23 H 11.868 -1.609 -4.145 1.00 . A A . 25 THR HG23 1 1 19 11559 1 1 25 THR N N 10.246 -4.015 -5.815 1.00 . A A . 25 THR N 1 1 19 11560 1 1 25 THR O O 13.640 -4.587 -6.618 1.00 . A A . 25 THR O 1 1 19 11561 1 1 25 THR OG1 O 13.269 -2.133 -6.811 1.00 . A A . 25 THR OG1 1 1 19 11562 1 1 26 SER C C 13.693 -7.217 -5.294 1.00 . A A . 26 SER C 1 1 19 11563 1 1 26 SER CA C 12.798 -7.227 -6.530 1.00 . A A . 26 SER CA 1 1 19 11564 1 1 26 SER CB C 13.656 -7.283 -7.796 1.00 . A A . 26 SER CB 1 1 19 11565 1 1 26 SER H H 10.961 -6.175 -6.542 1.00 . A A . 26 SER H 1 1 19 11566 1 1 26 SER HA H 12.167 -8.102 -6.495 1.00 . A A . 26 SER HA 1 1 19 11567 1 1 26 SER HB2 H 13.893 -6.278 -8.112 1.00 . A A . 26 SER HB2 1 1 19 11568 1 1 26 SER HB3 H 14.569 -7.819 -7.586 1.00 . A A . 26 SER HB3 1 1 19 11569 1 1 26 SER HG H 12.337 -7.339 -9.243 1.00 . A A . 26 SER HG 1 1 19 11570 1 1 26 SER N N 11.934 -6.053 -6.556 1.00 . A A . 26 SER N 1 1 19 11571 1 1 26 SER O O 14.864 -7.591 -5.361 1.00 . A A . 26 SER O 1 1 19 11572 1 1 26 SER OG O 12.971 -7.941 -8.847 1.00 . A A . 26 SER OG 1 1 19 11573 1 1 27 VAL C C 13.001 -6.240 -1.772 1.00 . A A . 27 VAL C 1 1 19 11574 1 1 27 VAL CA C 13.881 -6.732 -2.917 1.00 . A A . 27 VAL CA 1 1 19 11575 1 1 27 VAL CB C 15.114 -5.813 -3.040 1.00 . A A . 27 VAL CB 1 1 19 11576 1 1 27 VAL CG1 C 14.691 -4.384 -3.346 1.00 . A A . 27 VAL CG1 1 1 19 11577 1 1 27 VAL CG2 C 15.955 -5.871 -1.773 1.00 . A A . 27 VAL CG2 1 1 19 11578 1 1 27 VAL H H 12.196 -6.505 -4.178 1.00 . A A . 27 VAL H 1 1 19 11579 1 1 27 VAL HA H 14.223 -7.729 -2.689 1.00 . A A . 27 VAL HA 1 1 19 11580 1 1 27 VAL HB H 15.718 -6.167 -3.863 1.00 . A A . 27 VAL HB 1 1 19 11581 1 1 27 VAL HG11 H 13.933 -4.389 -4.115 1.00 . A A . 27 VAL HG11 1 1 19 11582 1 1 27 VAL HG12 H 14.293 -3.927 -2.452 1.00 . A A . 27 VAL HG12 1 1 19 11583 1 1 27 VAL HG13 H 15.547 -3.820 -3.687 1.00 . A A . 27 VAL HG13 1 1 19 11584 1 1 27 VAL HG21 H 15.348 -6.223 -0.953 1.00 . A A . 27 VAL HG21 1 1 19 11585 1 1 27 VAL HG22 H 16.784 -6.546 -1.923 1.00 . A A . 27 VAL HG22 1 1 19 11586 1 1 27 VAL HG23 H 16.331 -4.884 -1.545 1.00 . A A . 27 VAL HG23 1 1 19 11587 1 1 27 VAL N N 13.134 -6.789 -4.168 1.00 . A A . 27 VAL N 1 1 19 11588 1 1 27 VAL O O 13.099 -6.727 -0.646 1.00 . A A . 27 VAL O 1 1 19 11589 1 1 28 SER C C 9.956 -5.525 -0.974 1.00 . A A . 28 SER C 1 1 19 11590 1 1 28 SER CA C 11.243 -4.712 -1.068 1.00 . A A . 28 SER CA 1 1 19 11591 1 1 28 SER CB C 10.916 -3.256 -1.403 1.00 . A A . 28 SER CB 1 1 19 11592 1 1 28 SER H H 12.112 -4.927 -2.986 1.00 . A A . 28 SER H 1 1 19 11593 1 1 28 SER HA H 11.747 -4.748 -0.114 1.00 . A A . 28 SER HA 1 1 19 11594 1 1 28 SER HB2 H 10.311 -3.221 -2.296 1.00 . A A . 28 SER HB2 1 1 19 11595 1 1 28 SER HB3 H 10.372 -2.813 -0.582 1.00 . A A . 28 SER HB3 1 1 19 11596 1 1 28 SER HG H 12.717 -2.664 -0.907 1.00 . A A . 28 SER HG 1 1 19 11597 1 1 28 SER N N 12.142 -5.273 -2.070 1.00 . A A . 28 SER N 1 1 19 11598 1 1 28 SER O O 9.490 -6.086 -1.966 1.00 . A A . 28 SER O 1 1 19 11599 1 1 28 SER OG O 12.098 -2.506 -1.624 1.00 . A A . 28 SER OG 1 1 19 11600 1 1 29 SER C C 7.470 -5.873 1.736 1.00 . A A . 29 SER C 1 1 19 11601 1 1 29 SER CA C 8.152 -6.328 0.450 1.00 . A A . 29 SER CA 1 1 19 11602 1 1 29 SER CB C 8.441 -7.829 0.515 1.00 . A A . 29 SER CB 1 1 19 11603 1 1 29 SER H H 9.805 -5.116 0.977 1.00 . A A . 29 SER H 1 1 19 11604 1 1 29 SER HA H 7.492 -6.134 -0.382 1.00 . A A . 29 SER HA 1 1 19 11605 1 1 29 SER HB2 H 8.856 -8.072 1.482 1.00 . A A . 29 SER HB2 1 1 19 11606 1 1 29 SER HB3 H 7.522 -8.377 0.371 1.00 . A A . 29 SER HB3 1 1 19 11607 1 1 29 SER HG H 8.895 -8.398 -1.304 1.00 . A A . 29 SER HG 1 1 19 11608 1 1 29 SER N N 9.386 -5.584 0.225 1.00 . A A . 29 SER N 1 1 19 11609 1 1 29 SER O O 7.870 -6.261 2.833 1.00 . A A . 29 SER O 1 1 19 11610 1 1 29 SER OG O 9.365 -8.215 -0.487 1.00 . A A . 29 SER OG 1 1 19 11611 1 1 30 HIS C C 4.301 -5.143 2.806 1.00 . A A . 30 HIS C 1 1 19 11612 1 1 30 HIS CA C 5.700 -4.539 2.743 1.00 . A A . 30 HIS CA 1 1 19 11613 1 1 30 HIS CB C 5.607 -3.013 2.680 1.00 . A A . 30 HIS CB 1 1 19 11614 1 1 30 HIS CD2 C 8.010 -2.523 1.835 1.00 . A A . 30 HIS CD2 1 1 19 11615 1 1 30 HIS CE1 C 8.523 -0.921 3.241 1.00 . A A . 30 HIS CE1 1 1 19 11616 1 1 30 HIS CG C 6.940 -2.333 2.643 1.00 . A A . 30 HIS CG 1 1 19 11617 1 1 30 HIS H H 6.166 -4.774 0.691 1.00 . A A . 30 HIS H 1 1 19 11618 1 1 30 HIS HA H 6.241 -4.820 3.634 1.00 . A A . 30 HIS HA 1 1 19 11619 1 1 30 HIS HB2 H 5.065 -2.729 1.790 1.00 . A A . 30 HIS HB2 1 1 19 11620 1 1 30 HIS HB3 H 5.074 -2.656 3.549 1.00 . A A . 30 HIS HB3 1 1 19 11621 1 1 30 HIS HD1 H 6.729 -0.956 4.224 1.00 . A A . 30 HIS HD1 1 1 19 11622 1 1 30 HIS HD2 H 8.086 -3.241 1.031 1.00 . A A . 30 HIS HD2 1 1 19 11623 1 1 30 HIS HE1 H 9.063 -0.143 3.760 1.00 . A A . 30 HIS HE1 1 1 19 11624 1 1 30 HIS HE2 H 9.895 -1.600 1.881 1.00 . A A . 30 HIS HE2 1 1 19 11625 1 1 30 HIS N N 6.438 -5.048 1.592 1.00 . A A . 30 HIS N 1 1 19 11626 1 1 30 HIS ND1 N 7.294 -1.323 3.514 1.00 . A A . 30 HIS ND1 1 1 19 11627 1 1 30 HIS NE2 N 8.979 -1.633 2.228 1.00 . A A . 30 HIS NE2 1 1 19 11628 1 1 30 HIS O O 3.736 -5.312 3.887 1.00 . A A . 30 HIS O 1 1 19 11629 1 1 31 TYR C C 1.365 -5.086 2.114 1.00 . A A . 31 TYR C 1 1 19 11630 1 1 31 TYR CA C 2.412 -6.050 1.566 1.00 . A A . 31 TYR CA 1 1 19 11631 1 1 31 TYR CB C 2.364 -7.369 2.341 1.00 . A A . 31 TYR CB 1 1 19 11632 1 1 31 TYR CD1 C 3.646 -9.502 1.914 1.00 . A A . 31 TYR CD1 1 1 19 11633 1 1 31 TYR CD2 C 2.052 -8.802 0.286 1.00 . A A . 31 TYR CD2 1 1 19 11634 1 1 31 TYR CE1 C 3.950 -10.610 1.146 1.00 . A A . 31 TYR CE1 1 1 19 11635 1 1 31 TYR CE2 C 2.350 -9.907 -0.487 1.00 . A A . 31 TYR CE2 1 1 19 11636 1 1 31 TYR CG C 2.693 -8.580 1.498 1.00 . A A . 31 TYR CG 1 1 19 11637 1 1 31 TYR CZ C 3.299 -10.808 -0.053 1.00 . A A . 31 TYR CZ 1 1 19 11638 1 1 31 TYR H H 4.245 -5.307 0.814 1.00 . A A . 31 TYR H 1 1 19 11639 1 1 31 TYR HA H 2.194 -6.246 0.527 1.00 . A A . 31 TYR HA 1 1 19 11640 1 1 31 TYR HB2 H 3.075 -7.327 3.153 1.00 . A A . 31 TYR HB2 1 1 19 11641 1 1 31 TYR HB3 H 1.371 -7.505 2.746 1.00 . A A . 31 TYR HB3 1 1 19 11642 1 1 31 TYR HD1 H 4.154 -9.344 2.854 1.00 . A A . 31 TYR HD1 1 1 19 11643 1 1 31 TYR HD2 H 1.309 -8.094 -0.052 1.00 . A A . 31 TYR HD2 1 1 19 11644 1 1 31 TYR HE1 H 4.693 -11.315 1.487 1.00 . A A . 31 TYR HE1 1 1 19 11645 1 1 31 TYR HE2 H 1.840 -10.062 -1.427 1.00 . A A . 31 TYR HE2 1 1 19 11646 1 1 31 TYR HH H 4.254 -11.673 -1.480 1.00 . A A . 31 TYR HH 1 1 19 11647 1 1 31 TYR N N 3.746 -5.466 1.642 1.00 . A A . 31 TYR N 1 1 19 11648 1 1 31 TYR O O 1.387 -4.736 3.294 1.00 . A A . 31 TYR O 1 1 19 11649 1 1 31 TYR OH O 3.599 -11.910 -0.820 1.00 . A A . 31 TYR OH 1 1 19 11650 1 1 32 CYS C C -1.790 -4.493 2.245 1.00 . A A . 32 CYS C 1 1 19 11651 1 1 32 CYS CA C -0.607 -3.739 1.648 1.00 . A A . 32 CYS CA 1 1 19 11652 1 1 32 CYS CB C -1.068 -2.910 0.448 1.00 . A A . 32 CYS CB 1 1 19 11653 1 1 32 CYS H H 0.482 -4.977 0.323 1.00 . A A . 32 CYS H 1 1 19 11654 1 1 32 CYS HA H -0.203 -3.076 2.398 1.00 . A A . 32 CYS HA 1 1 19 11655 1 1 32 CYS HB2 H -0.213 -2.678 -0.169 1.00 . A A . 32 CYS HB2 1 1 19 11656 1 1 32 CYS HB3 H -1.775 -3.489 -0.129 1.00 . A A . 32 CYS HB3 1 1 19 11657 1 1 32 CYS N N 0.448 -4.662 1.250 1.00 . A A . 32 CYS N 1 1 19 11658 1 1 32 CYS O O -2.234 -5.503 1.699 1.00 . A A . 32 CYS O 1 1 19 11659 1 1 32 CYS SG S -1.871 -1.337 0.895 1.00 . A A . 32 CYS SG 1 1 19 11660 1 1 33 THR C C -4.755 -4.025 3.558 1.00 . A A . 33 THR C 1 1 19 11661 1 1 33 THR CA C -3.433 -4.623 4.035 1.00 . A A . 33 THR CA 1 1 19 11662 1 1 33 THR CB C -3.308 -4.465 5.551 1.00 . A A . 33 THR CB 1 1 19 11663 1 1 33 THR CG2 C -1.917 -4.757 6.071 1.00 . A A . 33 THR CG2 1 1 19 11664 1 1 33 THR H H -1.903 -3.186 3.754 1.00 . A A . 33 THR H 1 1 19 11665 1 1 33 THR HA H -3.419 -5.674 3.791 1.00 . A A . 33 THR HA 1 1 19 11666 1 1 33 THR HB H -3.991 -5.150 6.032 1.00 . A A . 33 THR HB 1 1 19 11667 1 1 33 THR HG1 H -3.791 -3.126 6.896 1.00 . A A . 33 THR HG1 1 1 19 11668 1 1 33 THR HG21 H -1.410 -5.422 5.388 1.00 . A A . 33 THR HG21 1 1 19 11669 1 1 33 THR HG22 H -1.362 -3.834 6.154 1.00 . A A . 33 THR HG22 1 1 19 11670 1 1 33 THR HG23 H -1.986 -5.224 7.043 1.00 . A A . 33 THR HG23 1 1 19 11671 1 1 33 THR N N -2.299 -3.995 3.367 1.00 . A A . 33 THR N 1 1 19 11672 1 1 33 THR O O -5.803 -4.258 4.162 1.00 . A A . 33 THR O 1 1 19 11673 1 1 33 THR OG1 O -3.647 -3.148 5.948 1.00 . A A . 33 THR OG1 1 1 19 11674 1 1 34 GLY C C -6.742 -1.955 3.005 1.00 . A A . 34 GLY C 1 1 19 11675 1 1 34 GLY CA C -5.909 -2.640 1.938 1.00 . A A . 34 GLY CA 1 1 19 11676 1 1 34 GLY H H -3.844 -3.103 2.029 1.00 . A A . 34 GLY H 1 1 19 11677 1 1 34 GLY HA2 H -6.508 -3.404 1.465 1.00 . A A . 34 GLY HA2 1 1 19 11678 1 1 34 GLY HA3 H -5.626 -1.910 1.195 1.00 . A A . 34 GLY HA3 1 1 19 11679 1 1 34 GLY N N -4.705 -3.255 2.472 1.00 . A A . 34 GLY N 1 1 19 11680 1 1 34 GLY O O -7.960 -2.123 3.053 1.00 . A A . 34 GLY O 1 1 19 11681 1 1 35 ARG C C -6.208 0.933 5.114 1.00 . A A . 35 ARG C 1 1 19 11682 1 1 35 ARG CA C -6.774 -0.471 4.934 1.00 . A A . 35 ARG CA 1 1 19 11683 1 1 35 ARG CB C -6.663 -1.251 6.245 1.00 . A A . 35 ARG CB 1 1 19 11684 1 1 35 ARG CD C -7.271 -3.505 7.173 1.00 . A A . 35 ARG CD 1 1 19 11685 1 1 35 ARG CG C -7.773 -2.270 6.442 1.00 . A A . 35 ARG CG 1 1 19 11686 1 1 35 ARG CZ C -5.662 -4.006 8.971 1.00 . A A . 35 ARG CZ 1 1 19 11687 1 1 35 ARG H H -5.112 -1.087 3.774 1.00 . A A . 35 ARG H 1 1 19 11688 1 1 35 ARG HA H -7.812 -0.392 4.660 1.00 . A A . 35 ARG HA 1 1 19 11689 1 1 35 ARG HB2 H -5.717 -1.772 6.262 1.00 . A A . 35 ARG HB2 1 1 19 11690 1 1 35 ARG HB3 H -6.694 -0.553 7.069 1.00 . A A . 35 ARG HB3 1 1 19 11691 1 1 35 ARG HD2 H -8.121 -4.098 7.477 1.00 . A A . 35 ARG HD2 1 1 19 11692 1 1 35 ARG HD3 H -6.655 -4.081 6.498 1.00 . A A . 35 ARG HD3 1 1 19 11693 1 1 35 ARG HE H -6.578 -2.252 8.711 1.00 . A A . 35 ARG HE 1 1 19 11694 1 1 35 ARG HG2 H -8.565 -1.819 7.021 1.00 . A A . 35 ARG HG2 1 1 19 11695 1 1 35 ARG HG3 H -8.153 -2.565 5.475 1.00 . A A . 35 ARG HG3 1 1 19 11696 1 1 35 ARG HH11 H -6.018 -5.548 7.712 1.00 . A A . 35 ARG HH11 1 1 19 11697 1 1 35 ARG HH12 H -4.890 -5.874 8.985 1.00 . A A . 35 ARG HH12 1 1 19 11698 1 1 35 ARG HH21 H -5.095 -2.679 10.386 1.00 . A A . 35 ARG HH21 1 1 19 11699 1 1 35 ARG HH22 H -4.366 -4.246 10.503 1.00 . A A . 35 ARG HH22 1 1 19 11700 1 1 35 ARG N N -6.084 -1.181 3.863 1.00 . A A . 35 ARG N 1 1 19 11701 1 1 35 ARG NE N -6.486 -3.161 8.356 1.00 . A A . 35 ARG NE 1 1 19 11702 1 1 35 ARG NH1 N -5.512 -5.244 8.519 1.00 . A A . 35 ARG NH1 1 1 19 11703 1 1 35 ARG NH2 N -4.985 -3.611 10.041 1.00 . A A . 35 ARG NH2 1 1 19 11704 1 1 35 ARG O O -6.954 1.905 5.226 1.00 . A A . 35 ARG O 1 1 19 11705 1 1 36 SER C C -3.180 2.538 4.215 1.00 . A A . 36 SER C 1 1 19 11706 1 1 36 SER CA C -4.214 2.312 5.314 1.00 . A A . 36 SER CA 1 1 19 11707 1 1 36 SER CB C -3.540 2.381 6.685 1.00 . A A . 36 SER CB 1 1 19 11708 1 1 36 SER H H -4.348 0.216 5.051 1.00 . A A . 36 SER H 1 1 19 11709 1 1 36 SER HA H -4.963 3.088 5.251 1.00 . A A . 36 SER HA 1 1 19 11710 1 1 36 SER HB2 H -3.246 1.388 6.989 1.00 . A A . 36 SER HB2 1 1 19 11711 1 1 36 SER HB3 H -2.666 3.013 6.623 1.00 . A A . 36 SER HB3 1 1 19 11712 1 1 36 SER HG H -4.756 2.202 8.211 1.00 . A A . 36 SER HG 1 1 19 11713 1 1 36 SER N N -4.885 1.028 5.144 1.00 . A A . 36 SER N 1 1 19 11714 1 1 36 SER O O -2.576 1.591 3.713 1.00 . A A . 36 SER O 1 1 19 11715 1 1 36 SER OG O -4.421 2.913 7.660 1.00 . A A . 36 SER OG 1 1 19 11716 1 1 37 CYS C C -0.585 4.027 3.322 1.00 . A A . 37 CYS C 1 1 19 11717 1 1 37 CYS CA C -2.019 4.154 2.811 1.00 . A A . 37 CYS CA 1 1 19 11718 1 1 37 CYS CB C -2.272 5.579 2.317 1.00 . A A . 37 CYS CB 1 1 19 11719 1 1 37 CYS H H -3.493 4.512 4.288 1.00 . A A . 37 CYS H 1 1 19 11720 1 1 37 CYS HA H -2.155 3.469 1.988 1.00 . A A . 37 CYS HA 1 1 19 11721 1 1 37 CYS HB2 H -3.242 5.904 2.662 1.00 . A A . 37 CYS HB2 1 1 19 11722 1 1 37 CYS HB3 H -1.515 6.234 2.722 1.00 . A A . 37 CYS HB3 1 1 19 11723 1 1 37 CYS N N -2.981 3.800 3.849 1.00 . A A . 37 CYS N 1 1 19 11724 1 1 37 CYS O O 0.357 3.940 2.535 1.00 . A A . 37 CYS O 1 1 19 11725 1 1 37 CYS SG S -2.244 5.753 0.503 1.00 . A A . 37 CYS SG 1 1 19 11726 1 1 38 GLU C C 1.356 2.449 5.282 1.00 . A A . 38 GLU C 1 1 19 11727 1 1 38 GLU CA C 0.896 3.903 5.250 1.00 . A A . 38 GLU CA 1 1 19 11728 1 1 38 GLU CB C 0.880 4.476 6.668 1.00 . A A . 38 GLU CB 1 1 19 11729 1 1 38 GLU CD C 1.867 6.396 7.981 1.00 . A A . 38 GLU CD 1 1 19 11730 1 1 38 GLU CG C 1.135 5.974 6.722 1.00 . A A . 38 GLU CG 1 1 19 11731 1 1 38 GLU H H -1.211 4.092 5.222 1.00 . A A . 38 GLU H 1 1 19 11732 1 1 38 GLU HA H 1.588 4.473 4.649 1.00 . A A . 38 GLU HA 1 1 19 11733 1 1 38 GLU HB2 H -0.084 4.281 7.112 1.00 . A A . 38 GLU HB2 1 1 19 11734 1 1 38 GLU HB3 H 1.643 3.982 7.253 1.00 . A A . 38 GLU HB3 1 1 19 11735 1 1 38 GLU HG2 H 1.731 6.255 5.867 1.00 . A A . 38 GLU HG2 1 1 19 11736 1 1 38 GLU HG3 H 0.187 6.489 6.684 1.00 . A A . 38 GLU HG3 1 1 19 11737 1 1 38 GLU N N -0.424 4.018 4.643 1.00 . A A . 38 GLU N 1 1 19 11738 1 1 38 GLU O O 1.012 1.699 6.196 1.00 . A A . 38 GLU O 1 1 19 11739 1 1 38 GLU OE1 O 1.716 7.566 8.391 1.00 . A A . 38 GLU OE1 1 1 19 11740 1 1 38 GLU OE2 O 2.590 5.556 8.557 1.00 . A A . 38 GLU OE2 1 1 19 11741 1 1 39 CYS C C 3.496 0.352 5.413 1.00 . A A . 39 CYS C 1 1 19 11742 1 1 39 CYS CA C 2.641 0.692 4.193 1.00 . A A . 39 CYS CA 1 1 19 11743 1 1 39 CYS CB C 3.460 0.510 2.912 1.00 . A A . 39 CYS CB 1 1 19 11744 1 1 39 CYS H H 2.374 2.700 3.580 1.00 . A A . 39 CYS H 1 1 19 11745 1 1 39 CYS HA H 1.793 0.025 4.165 1.00 . A A . 39 CYS HA 1 1 19 11746 1 1 39 CYS HB2 H 3.419 1.422 2.336 1.00 . A A . 39 CYS HB2 1 1 19 11747 1 1 39 CYS HB3 H 4.487 0.303 3.174 1.00 . A A . 39 CYS HB3 1 1 19 11748 1 1 39 CYS N N 2.134 2.057 4.279 1.00 . A A . 39 CYS N 1 1 19 11749 1 1 39 CYS O O 4.185 1.214 5.957 1.00 . A A . 39 CYS O 1 1 19 11750 1 1 39 CYS SG S 2.876 -0.844 1.841 1.00 . A A . 39 CYS SG 1 1 19 11751 1 1 40 PRO C C 5.733 -1.422 6.732 1.00 . A A . 40 PRO C 1 1 19 11752 1 1 40 PRO CA C 4.237 -1.363 7.023 1.00 . A A . 40 PRO CA 1 1 19 11753 1 1 40 PRO CB C 3.689 -2.764 7.297 1.00 . A A . 40 PRO CB 1 1 19 11754 1 1 40 PRO CD C 2.666 -2.011 5.272 1.00 . A A . 40 PRO CD 1 1 19 11755 1 1 40 PRO CG C 3.178 -3.235 5.980 1.00 . A A . 40 PRO CG 1 1 19 11756 1 1 40 PRO HA H 4.063 -0.730 7.881 1.00 . A A . 40 PRO HA 1 1 19 11757 1 1 40 PRO HB2 H 4.483 -3.399 7.664 1.00 . A A . 40 PRO HB2 1 1 19 11758 1 1 40 PRO HB3 H 2.898 -2.708 8.029 1.00 . A A . 40 PRO HB3 1 1 19 11759 1 1 40 PRO HD2 H 2.844 -2.087 4.210 1.00 . A A . 40 PRO HD2 1 1 19 11760 1 1 40 PRO HD3 H 1.614 -1.872 5.471 1.00 . A A . 40 PRO HD3 1 1 19 11761 1 1 40 PRO HG2 H 3.981 -3.687 5.415 1.00 . A A . 40 PRO HG2 1 1 19 11762 1 1 40 PRO HG3 H 2.377 -3.944 6.129 1.00 . A A . 40 PRO HG3 1 1 19 11763 1 1 40 PRO N N 3.461 -0.916 5.861 1.00 . A A . 40 PRO N 1 1 19 11764 1 1 40 PRO O O 6.160 -2.023 5.746 1.00 . A A . 40 PRO O 1 1 19 11765 1 1 41 SER C C 8.548 -2.186 7.523 1.00 . A A . 41 SER C 1 1 19 11766 1 1 41 SER CA C 7.972 -0.777 7.432 1.00 . A A . 41 SER CA 1 1 19 11767 1 1 41 SER CB C 8.615 0.118 8.493 1.00 . A A . 41 SER CB 1 1 19 11768 1 1 41 SER H H 6.123 -0.334 8.363 1.00 . A A . 41 SER H 1 1 19 11769 1 1 41 SER HA H 8.190 -0.374 6.454 1.00 . A A . 41 SER HA 1 1 19 11770 1 1 41 SER HB2 H 9.630 0.347 8.201 1.00 . A A . 41 SER HB2 1 1 19 11771 1 1 41 SER HB3 H 8.050 1.035 8.578 1.00 . A A . 41 SER HB3 1 1 19 11772 1 1 41 SER HG H 7.742 -0.736 10.024 1.00 . A A . 41 SER HG 1 1 19 11773 1 1 41 SER N N 6.524 -0.795 7.596 1.00 . A A . 41 SER N 1 1 19 11774 1 1 41 SER O O 9.547 -2.502 6.877 1.00 . A A . 41 SER O 1 1 19 11775 1 1 41 SER OG O 8.639 -0.523 9.756 1.00 . A A . 41 SER OG 1 1 19 11776 1 1 42 TYR C C 7.849 -5.294 7.373 1.00 . A A . 42 TYR C 1 1 19 11777 1 1 42 TYR CA C 8.360 -4.406 8.505 1.00 . A A . 42 TYR CA 1 1 19 11778 1 1 42 TYR CB C 7.883 -4.952 9.852 1.00 . A A . 42 TYR CB 1 1 19 11779 1 1 42 TYR CD1 C 5.677 -6.125 9.486 1.00 . A A . 42 TYR CD1 1 1 19 11780 1 1 42 TYR CD2 C 5.659 -4.008 10.583 1.00 . A A . 42 TYR CD2 1 1 19 11781 1 1 42 TYR CE1 C 4.302 -6.199 9.597 1.00 . A A . 42 TYR CE1 1 1 19 11782 1 1 42 TYR CE2 C 4.283 -4.076 10.698 1.00 . A A . 42 TYR CE2 1 1 19 11783 1 1 42 TYR CG C 6.378 -5.030 9.976 1.00 . A A . 42 TYR CG 1 1 19 11784 1 1 42 TYR CZ C 3.610 -5.173 10.204 1.00 . A A . 42 TYR CZ 1 1 19 11785 1 1 42 TYR H H 7.121 -2.718 8.818 1.00 . A A . 42 TYR H 1 1 19 11786 1 1 42 TYR HA H 9.440 -4.407 8.488 1.00 . A A . 42 TYR HA 1 1 19 11787 1 1 42 TYR HB2 H 8.279 -5.947 9.989 1.00 . A A . 42 TYR HB2 1 1 19 11788 1 1 42 TYR HB3 H 8.250 -4.312 10.641 1.00 . A A . 42 TYR HB3 1 1 19 11789 1 1 42 TYR HD1 H 6.222 -6.927 9.011 1.00 . A A . 42 TYR HD1 1 1 19 11790 1 1 42 TYR HD2 H 6.189 -3.150 10.968 1.00 . A A . 42 TYR HD2 1 1 19 11791 1 1 42 TYR HE1 H 3.775 -7.059 9.210 1.00 . A A . 42 TYR HE1 1 1 19 11792 1 1 42 TYR HE2 H 3.741 -3.271 11.174 1.00 . A A . 42 TYR HE2 1 1 19 11793 1 1 42 TYR HH H 1.839 -5.066 9.463 1.00 . A A . 42 TYR HH 1 1 19 11794 1 1 42 TYR N N 7.911 -3.029 8.329 1.00 . A A . 42 TYR N 1 1 19 11795 1 1 42 TYR O O 6.782 -5.045 6.811 1.00 . A A . 42 TYR O 1 1 19 11796 1 1 42 TYR OH O 2.240 -5.243 10.317 1.00 . A A . 42 TYR OH 1 1 19 11797 1 1 43 PRO C C 7.033 -8.140 6.335 1.00 . A A . 43 PRO C 1 1 19 11798 1 1 43 PRO CA C 8.227 -7.273 5.951 1.00 . A A . 43 PRO CA 1 1 19 11799 1 1 43 PRO CB C 9.476 -8.135 5.765 1.00 . A A . 43 PRO CB 1 1 19 11800 1 1 43 PRO CD C 9.895 -6.715 7.641 1.00 . A A . 43 PRO CD 1 1 19 11801 1 1 43 PRO CG C 10.173 -8.083 7.080 1.00 . A A . 43 PRO CG 1 1 19 11802 1 1 43 PRO HA H 8.008 -6.747 5.033 1.00 . A A . 43 PRO HA 1 1 19 11803 1 1 43 PRO HB2 H 9.186 -9.144 5.510 1.00 . A A . 43 PRO HB2 1 1 19 11804 1 1 43 PRO HB3 H 10.089 -7.722 4.978 1.00 . A A . 43 PRO HB3 1 1 19 11805 1 1 43 PRO HD2 H 9.808 -6.759 8.716 1.00 . A A . 43 PRO HD2 1 1 19 11806 1 1 43 PRO HD3 H 10.673 -6.024 7.352 1.00 . A A . 43 PRO HD3 1 1 19 11807 1 1 43 PRO HG2 H 9.777 -8.844 7.736 1.00 . A A . 43 PRO HG2 1 1 19 11808 1 1 43 PRO HG3 H 11.234 -8.222 6.940 1.00 . A A . 43 PRO HG3 1 1 19 11809 1 1 43 PRO N N 8.608 -6.346 7.022 1.00 . A A . 43 PRO N 1 1 19 11810 1 1 43 PRO O O 7.019 -8.761 7.397 1.00 . A A . 43 PRO O 1 1 19 11811 1 1 44 GLY C C 3.691 -8.137 6.244 1.00 . A A . 44 GLY C 1 1 19 11812 1 1 44 GLY CA C 4.846 -8.972 5.728 1.00 . A A . 44 GLY CA 1 1 19 11813 1 1 44 GLY H H 6.097 -7.663 4.631 1.00 . A A . 44 GLY H 1 1 19 11814 1 1 44 GLY HA2 H 5.088 -9.725 6.463 1.00 . A A . 44 GLY HA2 1 1 19 11815 1 1 44 GLY HA3 H 4.542 -9.462 4.814 1.00 . A A . 44 GLY HA3 1 1 19 11816 1 1 44 GLY N N 6.031 -8.178 5.462 1.00 . A A . 44 GLY N 1 1 19 11817 1 1 44 GLY O O 3.947 -7.155 6.972 1.00 . A A . 44 GLY O 1 1 19 11818 1 1 44 GLY OXT O 2.530 -8.464 5.919 1.00 . A A . 44 GLY OXT 1 1 20 11819 1 1 1 ALA C C -14.858 14.360 -0.504 1.00 . A A . 1 ALA C 1 1 20 11820 1 1 1 ALA CA C -14.894 15.866 -0.272 1.00 . A A . 1 ALA CA 1 1 20 11821 1 1 1 ALA CB C -14.924 16.604 -1.602 1.00 . A A . 1 ALA CB 1 1 20 11822 1 1 1 ALA H1 H -12.888 15.808 0.181 1.00 . A A . 1 ALA H1 1 1 20 11823 1 1 1 ALA H2 H -13.628 17.337 0.412 1.00 . A A . 1 ALA H2 1 1 20 11824 1 1 1 ALA H3 H -13.919 16.066 1.528 1.00 . A A . 1 ALA H3 1 1 20 11825 1 1 1 ALA HA H -15.795 16.115 0.269 1.00 . A A . 1 ALA HA 1 1 20 11826 1 1 1 ALA HB1 H -15.524 17.497 -1.505 1.00 . A A . 1 ALA HB1 1 1 20 11827 1 1 1 ALA HB2 H -15.352 15.963 -2.359 1.00 . A A . 1 ALA HB2 1 1 20 11828 1 1 1 ALA HB3 H -13.918 16.875 -1.887 1.00 . A A . 1 ALA HB3 1 1 20 11829 1 1 1 ALA N N -13.727 16.309 0.535 1.00 . A A . 1 ALA N 1 1 20 11830 1 1 1 ALA O O -15.684 13.620 0.031 1.00 . A A . 1 ALA O 1 1 20 11831 1 1 2 MET C C -12.845 11.808 -0.591 1.00 . A A . 2 MET C 1 1 20 11832 1 1 2 MET CA C -13.754 12.492 -1.607 1.00 . A A . 2 MET CA 1 1 20 11833 1 1 2 MET CB C -13.193 12.304 -3.018 1.00 . A A . 2 MET CB 1 1 20 11834 1 1 2 MET CE C -15.045 12.456 -5.549 1.00 . A A . 2 MET CE 1 1 20 11835 1 1 2 MET CG C -13.618 11.000 -3.672 1.00 . A A . 2 MET CG 1 1 20 11836 1 1 2 MET H H -13.268 14.551 -1.701 1.00 . A A . 2 MET H 1 1 20 11837 1 1 2 MET HA H -14.734 12.042 -1.556 1.00 . A A . 2 MET HA 1 1 20 11838 1 1 2 MET HB2 H -13.532 13.120 -3.639 1.00 . A A . 2 MET HB2 1 1 20 11839 1 1 2 MET HB3 H -12.115 12.323 -2.970 1.00 . A A . 2 MET HB3 1 1 20 11840 1 1 2 MET HE1 H -15.726 12.369 -4.716 1.00 . A A . 2 MET HE1 1 1 20 11841 1 1 2 MET HE2 H -14.551 13.416 -5.512 1.00 . A A . 2 MET HE2 1 1 20 11842 1 1 2 MET HE3 H -15.594 12.369 -6.475 1.00 . A A . 2 MET HE3 1 1 20 11843 1 1 2 MET HG2 H -12.866 10.251 -3.472 1.00 . A A . 2 MET HG2 1 1 20 11844 1 1 2 MET HG3 H -14.558 10.687 -3.242 1.00 . A A . 2 MET HG3 1 1 20 11845 1 1 2 MET N N -13.897 13.912 -1.304 1.00 . A A . 2 MET N 1 1 20 11846 1 1 2 MET O O -13.019 10.630 -0.282 1.00 . A A . 2 MET O 1 1 20 11847 1 1 2 MET SD S -13.821 11.152 -5.457 1.00 . A A . 2 MET SD 1 1 20 11848 1 1 3 ASP C C -10.150 10.852 0.327 1.00 . A A . 3 ASP C 1 1 20 11849 1 1 3 ASP CA C -10.938 12.022 0.907 1.00 . A A . 3 ASP CA 1 1 20 11850 1 1 3 ASP CB C -11.685 11.574 2.165 1.00 . A A . 3 ASP CB 1 1 20 11851 1 1 3 ASP CG C -11.828 12.690 3.181 1.00 . A A . 3 ASP CG 1 1 20 11852 1 1 3 ASP H H -11.787 13.489 -0.360 1.00 . A A . 3 ASP H 1 1 20 11853 1 1 3 ASP HA H -10.249 12.810 1.170 1.00 . A A . 3 ASP HA 1 1 20 11854 1 1 3 ASP HB2 H -12.673 11.236 1.888 1.00 . A A . 3 ASP HB2 1 1 20 11855 1 1 3 ASP HB3 H -11.146 10.759 2.625 1.00 . A A . 3 ASP HB3 1 1 20 11856 1 1 3 ASP N N -11.875 12.556 -0.075 1.00 . A A . 3 ASP N 1 1 20 11857 1 1 3 ASP O O -10.703 9.782 0.073 1.00 . A A . 3 ASP O 1 1 20 11858 1 1 3 ASP OD1 O -12.954 13.204 3.344 1.00 . A A . 3 ASP OD1 1 1 20 11859 1 1 3 ASP OD2 O -10.813 13.050 3.814 1.00 . A A . 3 ASP OD2 1 1 20 11860 1 1 4 CYS C C -6.703 9.903 0.380 1.00 . A A . 4 CYS C 1 1 20 11861 1 1 4 CYS CA C -7.989 10.027 -0.431 1.00 . A A . 4 CYS CA 1 1 20 11862 1 1 4 CYS CB C -7.656 10.333 -1.892 1.00 . A A . 4 CYS CB 1 1 20 11863 1 1 4 CYS H H -8.470 11.937 0.342 1.00 . A A . 4 CYS H 1 1 20 11864 1 1 4 CYS HA H -8.523 9.089 -0.382 1.00 . A A . 4 CYS HA 1 1 20 11865 1 1 4 CYS HB2 H -6.956 11.155 -1.929 1.00 . A A . 4 CYS HB2 1 1 20 11866 1 1 4 CYS HB3 H -7.203 9.461 -2.341 1.00 . A A . 4 CYS HB3 1 1 20 11867 1 1 4 CYS N N -8.854 11.064 0.119 1.00 . A A . 4 CYS N 1 1 20 11868 1 1 4 CYS O O -5.838 10.777 0.327 1.00 . A A . 4 CYS O 1 1 20 11869 1 1 4 CYS SG S -9.100 10.792 -2.905 1.00 . A A . 4 CYS SG 1 1 20 11870 1 1 5 THR C C -4.175 8.337 1.076 1.00 . A A . 5 THR C 1 1 20 11871 1 1 5 THR CA C -5.403 8.572 1.949 1.00 . A A . 5 THR CA 1 1 20 11872 1 1 5 THR CB C -5.630 7.370 2.867 1.00 . A A . 5 THR CB 1 1 20 11873 1 1 5 THR CG2 C -4.507 7.154 3.859 1.00 . A A . 5 THR CG2 1 1 20 11874 1 1 5 THR H H -7.308 8.150 1.127 1.00 . A A . 5 THR H 1 1 20 11875 1 1 5 THR HA H -5.237 9.449 2.555 1.00 . A A . 5 THR HA 1 1 20 11876 1 1 5 THR HB H -5.713 6.478 2.262 1.00 . A A . 5 THR HB 1 1 20 11877 1 1 5 THR HG1 H -6.848 8.388 4.014 1.00 . A A . 5 THR HG1 1 1 20 11878 1 1 5 THR HG21 H -3.562 7.155 3.338 1.00 . A A . 5 THR HG21 1 1 20 11879 1 1 5 THR HG22 H -4.516 7.948 4.591 1.00 . A A . 5 THR HG22 1 1 20 11880 1 1 5 THR HG23 H -4.644 6.205 4.356 1.00 . A A . 5 THR HG23 1 1 20 11881 1 1 5 THR N N -6.584 8.811 1.128 1.00 . A A . 5 THR N 1 1 20 11882 1 1 5 THR O O -3.724 7.204 0.913 1.00 . A A . 5 THR O 1 1 20 11883 1 1 5 THR OG1 O -6.831 7.521 3.603 1.00 . A A . 5 THR OG1 1 1 20 11884 1 1 6 THR C C -1.328 8.576 0.345 1.00 . A A . 6 THR C 1 1 20 11885 1 1 6 THR CA C -2.461 9.330 -0.346 1.00 . A A . 6 THR CA 1 1 20 11886 1 1 6 THR CB C -1.990 10.730 -0.742 1.00 . A A . 6 THR CB 1 1 20 11887 1 1 6 THR CG2 C -2.951 11.445 -1.666 1.00 . A A . 6 THR CG2 1 1 20 11888 1 1 6 THR H H -4.043 10.293 0.681 1.00 . A A . 6 THR H 1 1 20 11889 1 1 6 THR HA H -2.743 8.790 -1.237 1.00 . A A . 6 THR HA 1 1 20 11890 1 1 6 THR HB H -1.040 10.648 -1.251 1.00 . A A . 6 THR HB 1 1 20 11891 1 1 6 THR HG1 H -2.665 11.733 0.799 1.00 . A A . 6 THR HG1 1 1 20 11892 1 1 6 THR HG21 H -3.537 10.718 -2.209 1.00 . A A . 6 THR HG21 1 1 20 11893 1 1 6 THR HG22 H -3.608 12.075 -1.085 1.00 . A A . 6 THR HG22 1 1 20 11894 1 1 6 THR HG23 H -2.394 12.053 -2.364 1.00 . A A . 6 THR HG23 1 1 20 11895 1 1 6 THR N N -3.638 9.416 0.515 1.00 . A A . 6 THR N 1 1 20 11896 1 1 6 THR O O -0.786 9.035 1.351 1.00 . A A . 6 THR O 1 1 20 11897 1 1 6 THR OG1 O -1.811 11.542 0.405 1.00 . A A . 6 THR OG1 1 1 20 11898 1 1 7 GLY C C 0.561 5.518 -0.561 1.00 . A A . 7 GLY C 1 1 20 11899 1 1 7 GLY CA C 0.090 6.618 0.373 1.00 . A A . 7 GLY CA 1 1 20 11900 1 1 7 GLY H H -1.444 7.102 -1.003 1.00 . A A . 7 GLY H 1 1 20 11901 1 1 7 GLY HA2 H -0.265 6.169 1.289 1.00 . A A . 7 GLY HA2 1 1 20 11902 1 1 7 GLY HA3 H 0.925 7.263 0.602 1.00 . A A . 7 GLY HA3 1 1 20 11903 1 1 7 GLY N N -0.976 7.417 -0.202 1.00 . A A . 7 GLY N 1 1 20 11904 1 1 7 GLY O O -0.071 5.260 -1.586 1.00 . A A . 7 GLY O 1 1 20 11905 1 1 8 PRO C C 1.196 2.687 -1.366 1.00 . A A . 8 PRO C 1 1 20 11906 1 1 8 PRO CA C 2.227 3.769 -1.061 1.00 . A A . 8 PRO CA 1 1 20 11907 1 1 8 PRO CB C 3.360 3.199 -0.203 1.00 . A A . 8 PRO CB 1 1 20 11908 1 1 8 PRO CD C 2.497 5.093 0.970 1.00 . A A . 8 PRO CD 1 1 20 11909 1 1 8 PRO CG C 3.756 4.319 0.696 1.00 . A A . 8 PRO CG 1 1 20 11910 1 1 8 PRO HA H 2.631 4.149 -1.988 1.00 . A A . 8 PRO HA 1 1 20 11911 1 1 8 PRO HB2 H 2.998 2.350 0.357 1.00 . A A . 8 PRO HB2 1 1 20 11912 1 1 8 PRO HB3 H 4.179 2.896 -0.838 1.00 . A A . 8 PRO HB3 1 1 20 11913 1 1 8 PRO HD2 H 2.006 4.714 1.854 1.00 . A A . 8 PRO HD2 1 1 20 11914 1 1 8 PRO HD3 H 2.716 6.145 1.079 1.00 . A A . 8 PRO HD3 1 1 20 11915 1 1 8 PRO HG2 H 4.162 3.925 1.616 1.00 . A A . 8 PRO HG2 1 1 20 11916 1 1 8 PRO HG3 H 4.482 4.947 0.203 1.00 . A A . 8 PRO HG3 1 1 20 11917 1 1 8 PRO N N 1.679 4.849 -0.232 1.00 . A A . 8 PRO N 1 1 20 11918 1 1 8 PRO O O 1.240 2.055 -2.421 1.00 . A A . 8 PRO O 1 1 20 11919 1 1 9 CYS C C -2.065 2.100 -1.116 1.00 . A A . 9 CYS C 1 1 20 11920 1 1 9 CYS CA C -0.771 1.469 -0.608 1.00 . A A . 9 CYS CA 1 1 20 11921 1 1 9 CYS CB C -1.028 0.741 0.712 1.00 . A A . 9 CYS CB 1 1 20 11922 1 1 9 CYS H H 0.287 3.012 0.385 1.00 . A A . 9 CYS H 1 1 20 11923 1 1 9 CYS HA H -0.422 0.756 -1.340 1.00 . A A . 9 CYS HA 1 1 20 11924 1 1 9 CYS HB2 H -0.082 0.525 1.185 1.00 . A A . 9 CYS HB2 1 1 20 11925 1 1 9 CYS HB3 H -1.611 1.379 1.359 1.00 . A A . 9 CYS HB3 1 1 20 11926 1 1 9 CYS N N 0.270 2.477 -0.436 1.00 . A A . 9 CYS N 1 1 20 11927 1 1 9 CYS O O -3.159 1.612 -0.831 1.00 . A A . 9 CYS O 1 1 20 11928 1 1 9 CYS SG S -1.926 -0.833 0.529 1.00 . A A . 9 CYS SG 1 1 20 11929 1 1 10 CYS C C -2.906 4.124 -3.918 1.00 . A A . 10 CYS C 1 1 20 11930 1 1 10 CYS CA C -3.086 3.883 -2.421 1.00 . A A . 10 CYS CA 1 1 20 11931 1 1 10 CYS CB C -3.291 5.215 -1.694 1.00 . A A . 10 CYS CB 1 1 20 11932 1 1 10 CYS H H -1.032 3.524 -2.064 1.00 . A A . 10 CYS H 1 1 20 11933 1 1 10 CYS HA H -3.955 3.261 -2.269 1.00 . A A . 10 CYS HA 1 1 20 11934 1 1 10 CYS HB2 H -2.619 5.262 -0.852 1.00 . A A . 10 CYS HB2 1 1 20 11935 1 1 10 CYS HB3 H -3.066 6.026 -2.372 1.00 . A A . 10 CYS HB3 1 1 20 11936 1 1 10 CYS N N -1.931 3.185 -1.871 1.00 . A A . 10 CYS N 1 1 20 11937 1 1 10 CYS O O -2.084 4.942 -4.330 1.00 . A A . 10 CYS O 1 1 20 11938 1 1 10 CYS SG S -4.982 5.472 -1.065 1.00 . A A . 10 CYS SG 1 1 20 11939 1 1 11 ARG C C -3.754 4.989 -6.610 1.00 . A A . 11 ARG C 1 1 20 11940 1 1 11 ARG CA C -3.602 3.535 -6.179 1.00 . A A . 11 ARG CA 1 1 20 11941 1 1 11 ARG CB C -4.680 2.679 -6.847 1.00 . A A . 11 ARG CB 1 1 20 11942 1 1 11 ARG CD C -4.971 0.760 -8.443 1.00 . A A . 11 ARG CD 1 1 20 11943 1 1 11 ARG CG C -4.238 2.062 -8.164 1.00 . A A . 11 ARG CG 1 1 20 11944 1 1 11 ARG CZ C -7.277 -0.109 -8.406 1.00 . A A . 11 ARG CZ 1 1 20 11945 1 1 11 ARG H H -4.312 2.765 -4.338 1.00 . A A . 11 ARG H 1 1 20 11946 1 1 11 ARG HA H -2.635 3.184 -6.491 1.00 . A A . 11 ARG HA 1 1 20 11947 1 1 11 ARG HB2 H -4.956 1.880 -6.174 1.00 . A A . 11 ARG HB2 1 1 20 11948 1 1 11 ARG HB3 H -5.547 3.294 -7.035 1.00 . A A . 11 ARG HB3 1 1 20 11949 1 1 11 ARG HD2 H -4.785 0.469 -9.466 1.00 . A A . 11 ARG HD2 1 1 20 11950 1 1 11 ARG HD3 H -4.592 -0.002 -7.778 1.00 . A A . 11 ARG HD3 1 1 20 11951 1 1 11 ARG HE H -6.755 1.767 -7.971 1.00 . A A . 11 ARG HE 1 1 20 11952 1 1 11 ARG HG2 H -4.444 2.758 -8.963 1.00 . A A . 11 ARG HG2 1 1 20 11953 1 1 11 ARG HG3 H -3.177 1.865 -8.119 1.00 . A A . 11 ARG HG3 1 1 20 11954 1 1 11 ARG HH11 H -5.876 -1.472 -8.928 1.00 . A A . 11 ARG HH11 1 1 20 11955 1 1 11 ARG HH12 H -7.505 -2.058 -8.894 1.00 . A A . 11 ARG HH12 1 1 20 11956 1 1 11 ARG HH21 H -8.898 0.998 -7.926 1.00 . A A . 11 ARG HH21 1 1 20 11957 1 1 11 ARG HH22 H -9.221 -0.656 -8.326 1.00 . A A . 11 ARG HH22 1 1 20 11958 1 1 11 ARG N N -3.678 3.403 -4.727 1.00 . A A . 11 ARG N 1 1 20 11959 1 1 11 ARG NE N -6.413 0.890 -8.242 1.00 . A A . 11 ARG NE 1 1 20 11960 1 1 11 ARG NH1 N -6.851 -1.311 -8.773 1.00 . A A . 11 ARG NH1 1 1 20 11961 1 1 11 ARG NH2 N -8.571 0.094 -8.202 1.00 . A A . 11 ARG NH2 1 1 20 11962 1 1 11 ARG O O -3.205 5.406 -7.629 1.00 . A A . 11 ARG O 1 1 20 11963 1 1 12 GLN C C -5.823 7.694 -5.164 1.00 . A A . 12 GLN C 1 1 20 11964 1 1 12 GLN CA C -4.746 7.162 -6.099 1.00 . A A . 12 GLN CA 1 1 20 11965 1 1 12 GLN CB C -5.174 7.368 -7.559 1.00 . A A . 12 GLN CB 1 1 20 11966 1 1 12 GLN CD C -7.054 8.874 -8.325 1.00 . A A . 12 GLN CD 1 1 20 11967 1 1 12 GLN CG C -5.608 8.791 -7.876 1.00 . A A . 12 GLN CG 1 1 20 11968 1 1 12 GLN H H -4.907 5.348 -5.026 1.00 . A A . 12 GLN H 1 1 20 11969 1 1 12 GLN HA H -3.827 7.701 -5.919 1.00 . A A . 12 GLN HA 1 1 20 11970 1 1 12 GLN HB2 H -4.345 7.119 -8.204 1.00 . A A . 12 GLN HB2 1 1 20 11971 1 1 12 GLN HB3 H -5.998 6.705 -7.776 1.00 . A A . 12 GLN HB3 1 1 20 11972 1 1 12 GLN HE21 H -7.590 7.566 -6.927 1.00 . A A . 12 GLN HE21 1 1 20 11973 1 1 12 GLN HE22 H -8.867 8.158 -7.930 1.00 . A A . 12 GLN HE22 1 1 20 11974 1 1 12 GLN HG2 H -5.488 9.396 -6.990 1.00 . A A . 12 GLN HG2 1 1 20 11975 1 1 12 GLN HG3 H -4.979 9.178 -8.664 1.00 . A A . 12 GLN HG3 1 1 20 11976 1 1 12 GLN N N -4.503 5.749 -5.823 1.00 . A A . 12 GLN N 1 1 20 11977 1 1 12 GLN NE2 N -7.925 8.124 -7.660 1.00 . A A . 12 GLN NE2 1 1 20 11978 1 1 12 GLN O O -5.818 8.868 -4.791 1.00 . A A . 12 GLN O 1 1 20 11979 1 1 12 GLN OE1 O -7.385 9.605 -9.259 1.00 . A A . 12 GLN OE1 1 1 20 11980 1 1 13 CYS C C -8.686 5.970 -3.534 1.00 . A A . 13 CYS C 1 1 20 11981 1 1 13 CYS CA C -7.836 7.186 -3.892 1.00 . A A . 13 CYS CA 1 1 20 11982 1 1 13 CYS CB C -8.711 8.263 -4.536 1.00 . A A . 13 CYS CB 1 1 20 11983 1 1 13 CYS H H -6.692 5.894 -5.121 1.00 . A A . 13 CYS H 1 1 20 11984 1 1 13 CYS HA H -7.400 7.583 -2.988 1.00 . A A . 13 CYS HA 1 1 20 11985 1 1 13 CYS HB2 H -8.078 9.056 -4.905 1.00 . A A . 13 CYS HB2 1 1 20 11986 1 1 13 CYS HB3 H -9.253 7.828 -5.363 1.00 . A A . 13 CYS HB3 1 1 20 11987 1 1 13 CYS N N -6.746 6.816 -4.787 1.00 . A A . 13 CYS N 1 1 20 11988 1 1 13 CYS O O -9.898 6.082 -3.350 1.00 . A A . 13 CYS O 1 1 20 11989 1 1 13 CYS SG S -9.929 9.007 -3.404 1.00 . A A . 13 CYS SG 1 1 20 11990 1 1 14 LYS C C -7.776 2.563 -2.503 1.00 . A A . 14 LYS C 1 1 20 11991 1 1 14 LYS CA C -8.743 3.578 -3.096 1.00 . A A . 14 LYS CA 1 1 20 11992 1 1 14 LYS CB C -9.422 2.993 -4.336 1.00 . A A . 14 LYS CB 1 1 20 11993 1 1 14 LYS CD C -11.907 3.325 -4.173 1.00 . A A . 14 LYS CD 1 1 20 11994 1 1 14 LYS CE C -12.974 3.082 -3.118 1.00 . A A . 14 LYS CE 1 1 20 11995 1 1 14 LYS CG C -10.761 2.335 -4.043 1.00 . A A . 14 LYS CG 1 1 20 11996 1 1 14 LYS H H -7.077 4.779 -3.590 1.00 . A A . 14 LYS H 1 1 20 11997 1 1 14 LYS HA H -9.497 3.815 -2.360 1.00 . A A . 14 LYS HA 1 1 20 11998 1 1 14 LYS HB2 H -9.583 3.785 -5.052 1.00 . A A . 14 LYS HB2 1 1 20 11999 1 1 14 LYS HB3 H -8.769 2.251 -4.773 1.00 . A A . 14 LYS HB3 1 1 20 12000 1 1 14 LYS HD2 H -11.521 4.326 -4.056 1.00 . A A . 14 LYS HD2 1 1 20 12001 1 1 14 LYS HD3 H -12.351 3.220 -5.153 1.00 . A A . 14 LYS HD3 1 1 20 12002 1 1 14 LYS HE2 H -13.945 3.255 -3.560 1.00 . A A . 14 LYS HE2 1 1 20 12003 1 1 14 LYS HE3 H -12.908 2.056 -2.787 1.00 . A A . 14 LYS HE3 1 1 20 12004 1 1 14 LYS HG2 H -10.915 1.528 -4.743 1.00 . A A . 14 LYS HG2 1 1 20 12005 1 1 14 LYS HG3 H -10.746 1.944 -3.036 1.00 . A A . 14 LYS HG3 1 1 20 12006 1 1 14 LYS HZ1 H -12.336 4.863 -2.232 1.00 . A A . 14 LYS HZ1 1 1 20 12007 1 1 14 LYS HZ2 H -13.739 4.219 -1.541 1.00 . A A . 14 LYS HZ2 1 1 20 12008 1 1 14 LYS HZ3 H -12.236 3.516 -1.213 1.00 . A A . 14 LYS HZ3 1 1 20 12009 1 1 14 LYS N N -8.045 4.809 -3.435 1.00 . A A . 14 LYS N 1 1 20 12010 1 1 14 LYS NZ N -12.810 3.983 -1.944 1.00 . A A . 14 LYS NZ 1 1 20 12011 1 1 14 LYS O O -6.915 2.030 -3.203 1.00 . A A . 14 LYS O 1 1 20 12012 1 1 15 LEU C C -6.883 0.075 -1.330 1.00 . A A . 15 LEU C 1 1 20 12013 1 1 15 LEU CA C -7.055 1.351 -0.513 1.00 . A A . 15 LEU CA 1 1 20 12014 1 1 15 LEU CB C -7.630 1.022 0.865 1.00 . A A . 15 LEU CB 1 1 20 12015 1 1 15 LEU CD1 C -7.171 1.556 3.272 1.00 . A A . 15 LEU CD1 1 1 20 12016 1 1 15 LEU CD2 C -6.158 -0.481 2.228 1.00 . A A . 15 LEU CD2 1 1 20 12017 1 1 15 LEU CG C -6.601 0.956 1.996 1.00 . A A . 15 LEU CG 1 1 20 12018 1 1 15 LEU H H -8.623 2.762 -0.702 1.00 . A A . 15 LEU H 1 1 20 12019 1 1 15 LEU HA H -6.089 1.813 -0.389 1.00 . A A . 15 LEU HA 1 1 20 12020 1 1 15 LEU HB2 H -8.360 1.778 1.114 1.00 . A A . 15 LEU HB2 1 1 20 12021 1 1 15 LEU HB3 H -8.129 0.067 0.807 1.00 . A A . 15 LEU HB3 1 1 20 12022 1 1 15 LEU HD11 H -8.248 1.600 3.201 1.00 . A A . 15 LEU HD11 1 1 20 12023 1 1 15 LEU HD12 H -6.891 0.943 4.115 1.00 . A A . 15 LEU HD12 1 1 20 12024 1 1 15 LEU HD13 H -6.779 2.554 3.407 1.00 . A A . 15 LEU HD13 1 1 20 12025 1 1 15 LEU HD21 H -6.955 -1.153 1.946 1.00 . A A . 15 LEU HD21 1 1 20 12026 1 1 15 LEU HD22 H -5.283 -0.689 1.631 1.00 . A A . 15 LEU HD22 1 1 20 12027 1 1 15 LEU HD23 H -5.922 -0.620 3.273 1.00 . A A . 15 LEU HD23 1 1 20 12028 1 1 15 LEU HG H -5.732 1.534 1.716 1.00 . A A . 15 LEU HG 1 1 20 12029 1 1 15 LEU N N -7.920 2.302 -1.206 1.00 . A A . 15 LEU N 1 1 20 12030 1 1 15 LEU O O -7.809 -0.726 -1.453 1.00 . A A . 15 LEU O 1 1 20 12031 1 1 16 LYS C C -5.865 -2.555 -2.032 1.00 . A A . 16 LYS C 1 1 20 12032 1 1 16 LYS CA C -5.391 -1.269 -2.711 1.00 . A A . 16 LYS CA 1 1 20 12033 1 1 16 LYS CB C -3.889 -1.350 -2.989 1.00 . A A . 16 LYS CB 1 1 20 12034 1 1 16 LYS CD C -2.131 -1.043 -4.757 1.00 . A A . 16 LYS CD 1 1 20 12035 1 1 16 LYS CE C -0.945 -0.354 -4.103 1.00 . A A . 16 LYS CE 1 1 20 12036 1 1 16 LYS CG C -3.449 -0.537 -4.195 1.00 . A A . 16 LYS CG 1 1 20 12037 1 1 16 LYS H H -4.998 0.581 -1.762 1.00 . A A . 16 LYS H 1 1 20 12038 1 1 16 LYS HA H -5.915 -1.155 -3.648 1.00 . A A . 16 LYS HA 1 1 20 12039 1 1 16 LYS HB2 H -3.354 -0.989 -2.123 1.00 . A A . 16 LYS HB2 1 1 20 12040 1 1 16 LYS HB3 H -3.622 -2.382 -3.161 1.00 . A A . 16 LYS HB3 1 1 20 12041 1 1 16 LYS HD2 H -2.059 -2.106 -4.580 1.00 . A A . 16 LYS HD2 1 1 20 12042 1 1 16 LYS HD3 H -2.107 -0.850 -5.820 1.00 . A A . 16 LYS HD3 1 1 20 12043 1 1 16 LYS HE2 H -1.079 -0.373 -3.032 1.00 . A A . 16 LYS HE2 1 1 20 12044 1 1 16 LYS HE3 H -0.044 -0.892 -4.362 1.00 . A A . 16 LYS HE3 1 1 20 12045 1 1 16 LYS HG2 H -4.207 -0.608 -4.961 1.00 . A A . 16 LYS HG2 1 1 20 12046 1 1 16 LYS HG3 H -3.331 0.495 -3.897 1.00 . A A . 16 LYS HG3 1 1 20 12047 1 1 16 LYS HZ1 H -1.733 1.432 -4.846 1.00 . A A . 16 LYS HZ1 1 1 20 12048 1 1 16 LYS HZ2 H -0.448 1.647 -3.768 1.00 . A A . 16 LYS HZ2 1 1 20 12049 1 1 16 LYS HZ3 H -0.148 1.122 -5.348 1.00 . A A . 16 LYS HZ3 1 1 20 12050 1 1 16 LYS N N -5.691 -0.099 -1.894 1.00 . A A . 16 LYS N 1 1 20 12051 1 1 16 LYS NZ N -0.809 1.061 -4.547 1.00 . A A . 16 LYS NZ 1 1 20 12052 1 1 16 LYS O O -6.005 -2.606 -0.810 1.00 . A A . 16 LYS O 1 1 20 12053 1 1 17 PRO C C -5.692 -5.419 -1.163 1.00 . A A . 17 PRO C 1 1 20 12054 1 1 17 PRO CA C -6.581 -4.901 -2.289 1.00 . A A . 17 PRO CA 1 1 20 12055 1 1 17 PRO CB C -6.505 -5.833 -3.500 1.00 . A A . 17 PRO CB 1 1 20 12056 1 1 17 PRO CD C -5.979 -3.638 -4.288 1.00 . A A . 17 PRO CD 1 1 20 12057 1 1 17 PRO CG C -6.636 -4.933 -4.679 1.00 . A A . 17 PRO CG 1 1 20 12058 1 1 17 PRO HA H -7.601 -4.841 -1.940 1.00 . A A . 17 PRO HA 1 1 20 12059 1 1 17 PRO HB2 H -5.558 -6.351 -3.500 1.00 . A A . 17 PRO HB2 1 1 20 12060 1 1 17 PRO HB3 H -7.313 -6.548 -3.458 1.00 . A A . 17 PRO HB3 1 1 20 12061 1 1 17 PRO HD2 H -4.938 -3.641 -4.576 1.00 . A A . 17 PRO HD2 1 1 20 12062 1 1 17 PRO HD3 H -6.494 -2.803 -4.738 1.00 . A A . 17 PRO HD3 1 1 20 12063 1 1 17 PRO HG2 H -6.131 -5.368 -5.530 1.00 . A A . 17 PRO HG2 1 1 20 12064 1 1 17 PRO HG3 H -7.680 -4.771 -4.904 1.00 . A A . 17 PRO HG3 1 1 20 12065 1 1 17 PRO N N -6.119 -3.614 -2.820 1.00 . A A . 17 PRO N 1 1 20 12066 1 1 17 PRO O O -4.465 -5.363 -1.251 1.00 . A A . 17 PRO O 1 1 20 12067 1 1 18 ALA C C -4.684 -7.612 0.617 1.00 . A A . 18 ALA C 1 1 20 12068 1 1 18 ALA CA C -5.586 -6.457 1.037 1.00 . A A . 18 ALA CA 1 1 20 12069 1 1 18 ALA CB C -6.554 -6.909 2.120 1.00 . A A . 18 ALA CB 1 1 20 12070 1 1 18 ALA H H -7.299 -5.944 -0.095 1.00 . A A . 18 ALA H 1 1 20 12071 1 1 18 ALA HA H -4.974 -5.663 1.441 1.00 . A A . 18 ALA HA 1 1 20 12072 1 1 18 ALA HB1 H -7.475 -6.351 2.036 1.00 . A A . 18 ALA HB1 1 1 20 12073 1 1 18 ALA HB2 H -6.759 -7.963 2.003 1.00 . A A . 18 ALA HB2 1 1 20 12074 1 1 18 ALA HB3 H -6.115 -6.734 3.091 1.00 . A A . 18 ALA HB3 1 1 20 12075 1 1 18 ALA N N -6.319 -5.926 -0.106 1.00 . A A . 18 ALA N 1 1 20 12076 1 1 18 ALA O O -5.161 -8.700 0.294 1.00 . A A . 18 ALA O 1 1 20 12077 1 1 19 GLY C C -1.698 -8.060 -1.047 1.00 . A A . 19 GLY C 1 1 20 12078 1 1 19 GLY CA C -2.429 -8.397 0.238 1.00 . A A . 19 GLY CA 1 1 20 12079 1 1 19 GLY H H -3.056 -6.482 0.888 1.00 . A A . 19 GLY H 1 1 20 12080 1 1 19 GLY HA2 H -2.958 -9.329 0.105 1.00 . A A . 19 GLY HA2 1 1 20 12081 1 1 19 GLY HA3 H -1.705 -8.517 1.031 1.00 . A A . 19 GLY HA3 1 1 20 12082 1 1 19 GLY N N -3.378 -7.368 0.622 1.00 . A A . 19 GLY N 1 1 20 12083 1 1 19 GLY O O -1.252 -8.953 -1.768 1.00 . A A . 19 GLY O 1 1 20 12084 1 1 20 THR C C 0.338 -5.486 -2.184 1.00 . A A . 20 THR C 1 1 20 12085 1 1 20 THR CA C -0.892 -6.313 -2.539 1.00 . A A . 20 THR CA 1 1 20 12086 1 1 20 THR CB C -1.844 -5.488 -3.408 1.00 . A A . 20 THR CB 1 1 20 12087 1 1 20 THR CG2 C -1.217 -5.016 -4.702 1.00 . A A . 20 THR CG2 1 1 20 12088 1 1 20 THR H H -1.950 -6.104 -0.719 1.00 . A A . 20 THR H 1 1 20 12089 1 1 20 THR HA H -0.578 -7.185 -3.093 1.00 . A A . 20 THR HA 1 1 20 12090 1 1 20 THR HB H -2.154 -4.614 -2.853 1.00 . A A . 20 THR HB 1 1 20 12091 1 1 20 THR HG1 H -3.695 -5.644 -4.029 1.00 . A A . 20 THR HG1 1 1 20 12092 1 1 20 THR HG21 H -0.197 -4.712 -4.518 1.00 . A A . 20 THR HG21 1 1 20 12093 1 1 20 THR HG22 H -1.229 -5.821 -5.422 1.00 . A A . 20 THR HG22 1 1 20 12094 1 1 20 THR HG23 H -1.779 -4.179 -5.089 1.00 . A A . 20 THR HG23 1 1 20 12095 1 1 20 THR N N -1.574 -6.768 -1.334 1.00 . A A . 20 THR N 1 1 20 12096 1 1 20 THR O O 0.268 -4.573 -1.361 1.00 . A A . 20 THR O 1 1 20 12097 1 1 20 THR OG1 O -2.999 -6.238 -3.738 1.00 . A A . 20 THR OG1 1 1 20 12098 1 1 21 THR C C 2.570 -3.618 -2.897 1.00 . A A . 21 THR C 1 1 20 12099 1 1 21 THR CA C 2.711 -5.098 -2.556 1.00 . A A . 21 THR CA 1 1 20 12100 1 1 21 THR CB C 3.855 -5.717 -3.366 1.00 . A A . 21 THR CB 1 1 20 12101 1 1 21 THR CG2 C 4.955 -6.290 -2.499 1.00 . A A . 21 THR CG2 1 1 20 12102 1 1 21 THR H H 1.458 -6.549 -3.454 1.00 . A A . 21 THR H 1 1 20 12103 1 1 21 THR HA H 2.937 -5.191 -1.505 1.00 . A A . 21 THR HA 1 1 20 12104 1 1 21 THR HB H 4.293 -4.955 -3.995 1.00 . A A . 21 THR HB 1 1 20 12105 1 1 21 THR HG1 H 3.771 -6.679 -5.070 1.00 . A A . 21 THR HG1 1 1 20 12106 1 1 21 THR HG21 H 4.517 -6.808 -1.659 1.00 . A A . 21 THR HG21 1 1 20 12107 1 1 21 THR HG22 H 5.548 -6.980 -3.080 1.00 . A A . 21 THR HG22 1 1 20 12108 1 1 21 THR HG23 H 5.584 -5.488 -2.140 1.00 . A A . 21 THR HG23 1 1 20 12109 1 1 21 THR N N 1.465 -5.811 -2.809 1.00 . A A . 21 THR N 1 1 20 12110 1 1 21 THR O O 1.839 -3.248 -3.816 1.00 . A A . 21 THR O 1 1 20 12111 1 1 21 THR OG1 O 3.378 -6.759 -4.198 1.00 . A A . 21 THR OG1 1 1 20 12112 1 1 22 CYS C C 4.413 -0.874 -3.211 1.00 . A A . 22 CYS C 1 1 20 12113 1 1 22 CYS CA C 3.227 -1.334 -2.370 1.00 . A A . 22 CYS CA 1 1 20 12114 1 1 22 CYS CB C 3.215 -0.591 -1.033 1.00 . A A . 22 CYS CB 1 1 20 12115 1 1 22 CYS H H 3.838 -3.130 -1.430 1.00 . A A . 22 CYS H 1 1 20 12116 1 1 22 CYS HA H 2.316 -1.112 -2.904 1.00 . A A . 22 CYS HA 1 1 20 12117 1 1 22 CYS HB2 H 3.294 0.470 -1.219 1.00 . A A . 22 CYS HB2 1 1 20 12118 1 1 22 CYS HB3 H 2.282 -0.793 -0.526 1.00 . A A . 22 CYS HB3 1 1 20 12119 1 1 22 CYS N N 3.274 -2.775 -2.148 1.00 . A A . 22 CYS N 1 1 20 12120 1 1 22 CYS O O 4.312 0.092 -3.968 1.00 . A A . 22 CYS O 1 1 20 12121 1 1 22 CYS SG S 4.571 -1.057 0.091 1.00 . A A . 22 CYS SG 1 1 20 12122 1 1 23 TRP C C 7.330 -2.467 -4.494 1.00 . A A . 23 TRP C 1 1 20 12123 1 1 23 TRP CA C 6.742 -1.232 -3.822 1.00 . A A . 23 TRP CA 1 1 20 12124 1 1 23 TRP CB C 7.779 -0.591 -2.897 1.00 . A A . 23 TRP CB 1 1 20 12125 1 1 23 TRP CD1 C 9.169 0.190 -4.903 1.00 . A A . 23 TRP CD1 1 1 20 12126 1 1 23 TRP CD2 C 10.360 -0.157 -3.039 1.00 . A A . 23 TRP CD2 1 1 20 12127 1 1 23 TRP CE2 C 11.235 0.265 -4.058 1.00 . A A . 23 TRP CE2 1 1 20 12128 1 1 23 TRP CE3 C 10.885 -0.436 -1.773 1.00 . A A . 23 TRP CE3 1 1 20 12129 1 1 23 TRP CG C 9.043 -0.198 -3.600 1.00 . A A . 23 TRP CG 1 1 20 12130 1 1 23 TRP CH2 C 13.089 0.136 -2.602 1.00 . A A . 23 TRP CH2 1 1 20 12131 1 1 23 TRP CZ2 C 12.603 0.415 -3.850 1.00 . A A . 23 TRP CZ2 1 1 20 12132 1 1 23 TRP CZ3 C 12.243 -0.287 -1.568 1.00 . A A . 23 TRP CZ3 1 1 20 12133 1 1 23 TRP H H 5.556 -2.330 -2.455 1.00 . A A . 23 TRP H 1 1 20 12134 1 1 23 TRP HA H 6.468 -0.523 -4.584 1.00 . A A . 23 TRP HA 1 1 20 12135 1 1 23 TRP HB2 H 7.356 0.298 -2.454 1.00 . A A . 23 TRP HB2 1 1 20 12136 1 1 23 TRP HB3 H 8.035 -1.289 -2.114 1.00 . A A . 23 TRP HB3 1 1 20 12137 1 1 23 TRP HD1 H 8.346 0.262 -5.599 1.00 . A A . 23 TRP HD1 1 1 20 12138 1 1 23 TRP HE1 H 10.828 0.770 -6.053 1.00 . A A . 23 TRP HE1 1 1 20 12139 1 1 23 TRP HE3 H 10.248 -0.762 -0.964 1.00 . A A . 23 TRP HE3 1 1 20 12140 1 1 23 TRP HH2 H 14.145 0.238 -2.396 1.00 . A A . 23 TRP HH2 1 1 20 12141 1 1 23 TRP HZ2 H 13.269 0.740 -4.636 1.00 . A A . 23 TRP HZ2 1 1 20 12142 1 1 23 TRP HZ3 H 12.667 -0.498 -0.597 1.00 . A A . 23 TRP HZ3 1 1 20 12143 1 1 23 TRP N N 5.537 -1.570 -3.074 1.00 . A A . 23 TRP N 1 1 20 12144 1 1 23 TRP NE1 N 10.484 0.471 -5.186 1.00 . A A . 23 TRP NE1 1 1 20 12145 1 1 23 TRP O O 7.227 -2.635 -5.709 1.00 . A A . 23 TRP O 1 1 20 12146 1 1 24 ARG C C 9.605 -4.236 -5.266 1.00 . A A . 24 ARG C 1 1 20 12147 1 1 24 ARG CA C 8.554 -4.551 -4.206 1.00 . A A . 24 ARG CA 1 1 20 12148 1 1 24 ARG CB C 7.482 -5.471 -4.793 1.00 . A A . 24 ARG CB 1 1 20 12149 1 1 24 ARG CD C 7.257 -7.742 -5.845 1.00 . A A . 24 ARG CD 1 1 20 12150 1 1 24 ARG CG C 7.817 -6.948 -4.676 1.00 . A A . 24 ARG CG 1 1 20 12151 1 1 24 ARG CZ C 9.325 -8.787 -6.683 1.00 . A A . 24 ARG CZ 1 1 20 12152 1 1 24 ARG H H 7.994 -3.135 -2.737 1.00 . A A . 24 ARG H 1 1 20 12153 1 1 24 ARG HA H 9.033 -5.054 -3.380 1.00 . A A . 24 ARG HA 1 1 20 12154 1 1 24 ARG HB2 H 6.550 -5.293 -4.277 1.00 . A A . 24 ARG HB2 1 1 20 12155 1 1 24 ARG HB3 H 7.354 -5.234 -5.839 1.00 . A A . 24 ARG HB3 1 1 20 12156 1 1 24 ARG HD2 H 6.883 -8.685 -5.477 1.00 . A A . 24 ARG HD2 1 1 20 12157 1 1 24 ARG HD3 H 6.445 -7.182 -6.287 1.00 . A A . 24 ARG HD3 1 1 20 12158 1 1 24 ARG HE H 8.155 -7.561 -7.737 1.00 . A A . 24 ARG HE 1 1 20 12159 1 1 24 ARG HG2 H 8.890 -7.064 -4.658 1.00 . A A . 24 ARG HG2 1 1 20 12160 1 1 24 ARG HG3 H 7.396 -7.331 -3.758 1.00 . A A . 24 ARG HG3 1 1 20 12161 1 1 24 ARG HH11 H 8.858 -9.265 -4.774 1.00 . A A . 24 ARG HH11 1 1 20 12162 1 1 24 ARG HH12 H 10.307 -9.988 -5.386 1.00 . A A . 24 ARG HH12 1 1 20 12163 1 1 24 ARG HH21 H 10.060 -8.511 -8.545 1.00 . A A . 24 ARG HH21 1 1 20 12164 1 1 24 ARG HH22 H 10.991 -9.560 -7.527 1.00 . A A . 24 ARG HH22 1 1 20 12165 1 1 24 ARG N N 7.947 -3.327 -3.695 1.00 . A A . 24 ARG N 1 1 20 12166 1 1 24 ARG NE N 8.268 -7.999 -6.867 1.00 . A A . 24 ARG NE 1 1 20 12167 1 1 24 ARG NH1 N 9.512 -9.397 -5.519 1.00 . A A . 24 ARG NH1 1 1 20 12168 1 1 24 ARG NH2 N 10.197 -8.968 -7.665 1.00 . A A . 24 ARG NH2 1 1 20 12169 1 1 24 ARG O O 9.306 -4.201 -6.460 1.00 . A A . 24 ARG O 1 1 20 12170 1 1 25 THR C C 12.537 -4.969 -6.312 1.00 . A A . 25 THR C 1 1 20 12171 1 1 25 THR CA C 11.932 -3.696 -5.733 1.00 . A A . 25 THR CA 1 1 20 12172 1 1 25 THR CB C 13.010 -2.887 -5.011 1.00 . A A . 25 THR CB 1 1 20 12173 1 1 25 THR CG2 C 13.511 -3.552 -3.747 1.00 . A A . 25 THR CG2 1 1 20 12174 1 1 25 THR H H 11.013 -4.049 -3.859 1.00 . A A . 25 THR H 1 1 20 12175 1 1 25 THR HA H 11.531 -3.104 -6.541 1.00 . A A . 25 THR HA 1 1 20 12176 1 1 25 THR HB H 12.601 -1.924 -4.739 1.00 . A A . 25 THR HB 1 1 20 12177 1 1 25 THR HG1 H 14.553 -3.512 -6.042 1.00 . A A . 25 THR HG1 1 1 20 12178 1 1 25 THR HG21 H 13.767 -4.579 -3.958 1.00 . A A . 25 THR HG21 1 1 20 12179 1 1 25 THR HG22 H 14.386 -3.029 -3.388 1.00 . A A . 25 THR HG22 1 1 20 12180 1 1 25 THR HG23 H 12.739 -3.520 -2.993 1.00 . A A . 25 THR HG23 1 1 20 12181 1 1 25 THR N N 10.837 -4.007 -4.822 1.00 . A A . 25 THR N 1 1 20 12182 1 1 25 THR O O 12.885 -5.024 -7.492 1.00 . A A . 25 THR O 1 1 20 12183 1 1 25 THR OG1 O 14.127 -2.673 -5.856 1.00 . A A . 25 THR OG1 1 1 20 12184 1 1 26 SER C C 13.237 -8.266 -4.745 1.00 . A A . 26 SER C 1 1 20 12185 1 1 26 SER CA C 13.221 -7.269 -5.898 1.00 . A A . 26 SER CA 1 1 20 12186 1 1 26 SER CB C 14.639 -7.074 -6.438 1.00 . A A . 26 SER CB 1 1 20 12187 1 1 26 SER H H 12.361 -5.884 -4.546 1.00 . A A . 26 SER H 1 1 20 12188 1 1 26 SER HA H 12.596 -7.660 -6.685 1.00 . A A . 26 SER HA 1 1 20 12189 1 1 26 SER HB2 H 15.227 -7.955 -6.225 1.00 . A A . 26 SER HB2 1 1 20 12190 1 1 26 SER HB3 H 14.597 -6.919 -7.506 1.00 . A A . 26 SER HB3 1 1 20 12191 1 1 26 SER HG H 16.214 -6.089 -5.817 1.00 . A A . 26 SER HG 1 1 20 12192 1 1 26 SER N N 12.658 -5.992 -5.473 1.00 . A A . 26 SER N 1 1 20 12193 1 1 26 SER O O 12.970 -9.453 -4.933 1.00 . A A . 26 SER O 1 1 20 12194 1 1 26 SER OG O 15.264 -5.953 -5.838 1.00 . A A . 26 SER OG 1 1 20 12195 1 1 27 VAL C C 12.622 -8.141 -1.304 1.00 . A A . 27 VAL C 1 1 20 12196 1 1 27 VAL CA C 13.605 -8.621 -2.366 1.00 . A A . 27 VAL CA 1 1 20 12197 1 1 27 VAL CB C 15.021 -8.652 -1.759 1.00 . A A . 27 VAL CB 1 1 20 12198 1 1 27 VAL CG1 C 15.100 -9.674 -0.635 1.00 . A A . 27 VAL CG1 1 1 20 12199 1 1 27 VAL CG2 C 16.059 -8.949 -2.832 1.00 . A A . 27 VAL CG2 1 1 20 12200 1 1 27 VAL H H 13.755 -6.821 -3.469 1.00 . A A . 27 VAL H 1 1 20 12201 1 1 27 VAL HA H 13.340 -9.624 -2.659 1.00 . A A . 27 VAL HA 1 1 20 12202 1 1 27 VAL HB H 15.234 -7.678 -1.343 1.00 . A A . 27 VAL HB 1 1 20 12203 1 1 27 VAL HG11 H 14.106 -9.876 -0.263 1.00 . A A . 27 VAL HG11 1 1 20 12204 1 1 27 VAL HG12 H 15.537 -10.588 -1.009 1.00 . A A . 27 VAL HG12 1 1 20 12205 1 1 27 VAL HG13 H 15.712 -9.284 0.165 1.00 . A A . 27 VAL HG13 1 1 20 12206 1 1 27 VAL HG21 H 15.626 -8.787 -3.808 1.00 . A A . 27 VAL HG21 1 1 20 12207 1 1 27 VAL HG22 H 16.908 -8.295 -2.702 1.00 . A A . 27 VAL HG22 1 1 20 12208 1 1 27 VAL HG23 H 16.380 -9.977 -2.748 1.00 . A A . 27 VAL HG23 1 1 20 12209 1 1 27 VAL N N 13.552 -7.775 -3.553 1.00 . A A . 27 VAL N 1 1 20 12210 1 1 27 VAL O O 11.965 -8.945 -0.643 1.00 . A A . 27 VAL O 1 1 20 12211 1 1 28 SER C C 10.209 -6.133 -0.722 1.00 . A A . 28 SER C 1 1 20 12212 1 1 28 SER CA C 11.627 -6.235 -0.167 1.00 . A A . 28 SER CA 1 1 20 12213 1 1 28 SER CB C 12.129 -4.849 0.245 1.00 . A A . 28 SER CB 1 1 20 12214 1 1 28 SER H H 13.080 -6.241 -1.706 1.00 . A A . 28 SER H 1 1 20 12215 1 1 28 SER HA H 11.615 -6.876 0.701 1.00 . A A . 28 SER HA 1 1 20 12216 1 1 28 SER HB2 H 12.833 -4.491 -0.491 1.00 . A A . 28 SER HB2 1 1 20 12217 1 1 28 SER HB3 H 11.293 -4.167 0.305 1.00 . A A . 28 SER HB3 1 1 20 12218 1 1 28 SER HG H 12.147 -5.178 2.176 1.00 . A A . 28 SER HG 1 1 20 12219 1 1 28 SER N N 12.528 -6.827 -1.148 1.00 . A A . 28 SER N 1 1 20 12220 1 1 28 SER O O 9.822 -5.106 -1.279 1.00 . A A . 28 SER O 1 1 20 12221 1 1 28 SER OG O 12.773 -4.894 1.507 1.00 . A A . 28 SER OG 1 1 20 12222 1 1 29 SER C C 7.086 -6.907 0.074 1.00 . A A . 29 SER C 1 1 20 12223 1 1 29 SER CA C 8.065 -7.237 -1.049 1.00 . A A . 29 SER CA 1 1 20 12224 1 1 29 SER CB C 7.741 -8.611 -1.637 1.00 . A A . 29 SER CB 1 1 20 12225 1 1 29 SER H H 9.805 -7.994 -0.112 1.00 . A A . 29 SER H 1 1 20 12226 1 1 29 SER HA H 7.969 -6.491 -1.824 1.00 . A A . 29 SER HA 1 1 20 12227 1 1 29 SER HB2 H 7.693 -9.339 -0.842 1.00 . A A . 29 SER HB2 1 1 20 12228 1 1 29 SER HB3 H 6.787 -8.568 -2.143 1.00 . A A . 29 SER HB3 1 1 20 12229 1 1 29 SER HG H 9.601 -8.921 -2.169 1.00 . A A . 29 SER HG 1 1 20 12230 1 1 29 SER N N 9.440 -7.205 -0.565 1.00 . A A . 29 SER N 1 1 20 12231 1 1 29 SER O O 6.468 -7.800 0.654 1.00 . A A . 29 SER O 1 1 20 12232 1 1 29 SER OG O 8.732 -9.016 -2.566 1.00 . A A . 29 SER OG 1 1 20 12233 1 1 30 HIS C C 4.592 -5.291 0.986 1.00 . A A . 30 HIS C 1 1 20 12234 1 1 30 HIS CA C 6.047 -5.172 1.428 1.00 . A A . 30 HIS CA 1 1 20 12235 1 1 30 HIS CB C 6.358 -3.725 1.814 1.00 . A A . 30 HIS CB 1 1 20 12236 1 1 30 HIS CD2 C 8.936 -3.964 1.974 1.00 . A A . 30 HIS CD2 1 1 20 12237 1 1 30 HIS CE1 C 9.245 -2.859 3.842 1.00 . A A . 30 HIS CE1 1 1 20 12238 1 1 30 HIS CG C 7.723 -3.543 2.402 1.00 . A A . 30 HIS CG 1 1 20 12239 1 1 30 HIS H H 7.471 -4.955 -0.124 1.00 . A A . 30 HIS H 1 1 20 12240 1 1 30 HIS HA H 6.202 -5.806 2.288 1.00 . A A . 30 HIS HA 1 1 20 12241 1 1 30 HIS HB2 H 6.291 -3.103 0.934 1.00 . A A . 30 HIS HB2 1 1 20 12242 1 1 30 HIS HB3 H 5.634 -3.391 2.542 1.00 . A A . 30 HIS HB3 1 1 20 12243 1 1 30 HIS HD1 H 7.266 -2.424 4.129 1.00 . A A . 30 HIS HD1 1 1 20 12244 1 1 30 HIS HD2 H 9.137 -4.539 1.080 1.00 . A A . 30 HIS HD2 1 1 20 12245 1 1 30 HIS HE1 H 9.716 -2.396 4.697 1.00 . A A . 30 HIS HE1 1 1 20 12246 1 1 30 HIS HE2 H 10.837 -3.607 2.793 1.00 . A A . 30 HIS HE2 1 1 20 12247 1 1 30 HIS N N 6.951 -5.620 0.374 1.00 . A A . 30 HIS N 1 1 20 12248 1 1 30 HIS ND1 N 7.951 -2.854 3.575 1.00 . A A . 30 HIS ND1 1 1 20 12249 1 1 30 HIS NE2 N 9.865 -3.526 2.886 1.00 . A A . 30 HIS NE2 1 1 20 12250 1 1 30 HIS O O 4.077 -4.427 0.276 1.00 . A A . 30 HIS O 1 1 20 12251 1 1 31 TYR C C 1.620 -5.675 1.854 1.00 . A A . 31 TYR C 1 1 20 12252 1 1 31 TYR CA C 2.539 -6.596 1.059 1.00 . A A . 31 TYR CA 1 1 20 12253 1 1 31 TYR CB C 2.162 -8.056 1.314 1.00 . A A . 31 TYR CB 1 1 20 12254 1 1 31 TYR CD1 C 1.982 -8.959 -1.037 1.00 . A A . 31 TYR CD1 1 1 20 12255 1 1 31 TYR CD2 C 3.612 -9.917 0.414 1.00 . A A . 31 TYR CD2 1 1 20 12256 1 1 31 TYR CE1 C 2.373 -9.815 -2.049 1.00 . A A . 31 TYR CE1 1 1 20 12257 1 1 31 TYR CE2 C 4.010 -10.776 -0.593 1.00 . A A . 31 TYR CE2 1 1 20 12258 1 1 31 TYR CG C 2.594 -8.995 0.209 1.00 . A A . 31 TYR CG 1 1 20 12259 1 1 31 TYR CZ C 3.387 -10.721 -1.822 1.00 . A A . 31 TYR CZ 1 1 20 12260 1 1 31 TYR H H 4.401 -7.018 1.975 1.00 . A A . 31 TYR H 1 1 20 12261 1 1 31 TYR HA H 2.422 -6.381 0.007 1.00 . A A . 31 TYR HA 1 1 20 12262 1 1 31 TYR HB2 H 2.628 -8.387 2.230 1.00 . A A . 31 TYR HB2 1 1 20 12263 1 1 31 TYR HB3 H 1.089 -8.131 1.414 1.00 . A A . 31 TYR HB3 1 1 20 12264 1 1 31 TYR HD1 H 1.188 -8.248 -1.212 1.00 . A A . 31 TYR HD1 1 1 20 12265 1 1 31 TYR HD2 H 4.098 -9.958 1.378 1.00 . A A . 31 TYR HD2 1 1 20 12266 1 1 31 TYR HE1 H 1.886 -9.772 -3.012 1.00 . A A . 31 TYR HE1 1 1 20 12267 1 1 31 TYR HE2 H 4.804 -11.486 -0.414 1.00 . A A . 31 TYR HE2 1 1 20 12268 1 1 31 TYR HH H 3.696 -12.484 -2.527 1.00 . A A . 31 TYR HH 1 1 20 12269 1 1 31 TYR N N 3.936 -6.365 1.410 1.00 . A A . 31 TYR N 1 1 20 12270 1 1 31 TYR O O 2.001 -5.158 2.905 1.00 . A A . 31 TYR O 1 1 20 12271 1 1 31 TYR OH O 3.780 -11.575 -2.826 1.00 . A A . 31 TYR OH 1 1 20 12272 1 1 32 CYS C C -1.554 -5.442 2.822 1.00 . A A . 32 CYS C 1 1 20 12273 1 1 32 CYS CA C -0.563 -4.615 2.011 1.00 . A A . 32 CYS CA 1 1 20 12274 1 1 32 CYS CB C -1.313 -3.768 0.982 1.00 . A A . 32 CYS CB 1 1 20 12275 1 1 32 CYS H H 0.161 -5.912 0.507 1.00 . A A . 32 CYS H 1 1 20 12276 1 1 32 CYS HA H -0.026 -3.960 2.680 1.00 . A A . 32 CYS HA 1 1 20 12277 1 1 32 CYS HB2 H -1.454 -4.348 0.083 1.00 . A A . 32 CYS HB2 1 1 20 12278 1 1 32 CYS HB3 H -2.278 -3.497 1.384 1.00 . A A . 32 CYS HB3 1 1 20 12279 1 1 32 CYS N N 0.408 -5.473 1.347 1.00 . A A . 32 CYS N 1 1 20 12280 1 1 32 CYS O O -1.793 -6.612 2.523 1.00 . A A . 32 CYS O 1 1 20 12281 1 1 32 CYS SG S -0.454 -2.230 0.517 1.00 . A A . 32 CYS SG 1 1 20 12282 1 1 33 THR C C -4.510 -4.976 4.456 1.00 . A A . 33 THR C 1 1 20 12283 1 1 33 THR CA C -3.097 -5.503 4.701 1.00 . A A . 33 THR CA 1 1 20 12284 1 1 33 THR CB C -2.722 -5.318 6.172 1.00 . A A . 33 THR CB 1 1 20 12285 1 1 33 THR CG2 C -2.421 -3.879 6.532 1.00 . A A . 33 THR CG2 1 1 20 12286 1 1 33 THR H H -1.898 -3.892 4.034 1.00 . A A . 33 THR H 1 1 20 12287 1 1 33 THR HA H -3.072 -6.556 4.463 1.00 . A A . 33 THR HA 1 1 20 12288 1 1 33 THR HB H -1.840 -5.904 6.385 1.00 . A A . 33 THR HB 1 1 20 12289 1 1 33 THR HG1 H -4.516 -5.165 6.946 1.00 . A A . 33 THR HG1 1 1 20 12290 1 1 33 THR HG21 H -2.780 -3.230 5.747 1.00 . A A . 33 THR HG21 1 1 20 12291 1 1 33 THR HG22 H -2.914 -3.629 7.460 1.00 . A A . 33 THR HG22 1 1 20 12292 1 1 33 THR HG23 H -1.355 -3.752 6.645 1.00 . A A . 33 THR HG23 1 1 20 12293 1 1 33 THR N N -2.129 -4.826 3.848 1.00 . A A . 33 THR N 1 1 20 12294 1 1 33 THR O O -5.421 -5.230 5.244 1.00 . A A . 33 THR O 1 1 20 12295 1 1 33 THR OG1 O -3.768 -5.764 7.017 1.00 . A A . 33 THR OG1 1 1 20 12296 1 1 34 GLY C C -6.633 -2.969 4.211 1.00 . A A . 34 GLY C 1 1 20 12297 1 1 34 GLY CA C -5.993 -3.689 3.037 1.00 . A A . 34 GLY CA 1 1 20 12298 1 1 34 GLY H H -3.926 -4.067 2.766 1.00 . A A . 34 GLY H 1 1 20 12299 1 1 34 GLY HA2 H -6.642 -4.494 2.726 1.00 . A A . 34 GLY HA2 1 1 20 12300 1 1 34 GLY HA3 H -5.884 -2.992 2.219 1.00 . A A . 34 GLY HA3 1 1 20 12301 1 1 34 GLY N N -4.687 -4.239 3.360 1.00 . A A . 34 GLY N 1 1 20 12302 1 1 34 GLY O O -7.858 -2.881 4.299 1.00 . A A . 34 GLY O 1 1 20 12303 1 1 35 ARG C C -6.092 -0.240 6.139 1.00 . A A . 35 ARG C 1 1 20 12304 1 1 35 ARG CA C -6.296 -1.744 6.288 1.00 . A A . 35 ARG CA 1 1 20 12305 1 1 35 ARG CB C -5.587 -2.244 7.548 1.00 . A A . 35 ARG CB 1 1 20 12306 1 1 35 ARG CD C -6.170 -3.112 9.833 1.00 . A A . 35 ARG CD 1 1 20 12307 1 1 35 ARG CG C -6.368 -1.990 8.826 1.00 . A A . 35 ARG CG 1 1 20 12308 1 1 35 ARG CZ C -7.964 -2.571 11.433 1.00 . A A . 35 ARG CZ 1 1 20 12309 1 1 35 ARG H H -4.837 -2.561 4.989 1.00 . A A . 35 ARG H 1 1 20 12310 1 1 35 ARG HA H -7.353 -1.945 6.377 1.00 . A A . 35 ARG HA 1 1 20 12311 1 1 35 ARG HB2 H -5.423 -3.307 7.457 1.00 . A A . 35 ARG HB2 1 1 20 12312 1 1 35 ARG HB3 H -4.632 -1.747 7.631 1.00 . A A . 35 ARG HB3 1 1 20 12313 1 1 35 ARG HD2 H -5.855 -4.000 9.305 1.00 . A A . 35 ARG HD2 1 1 20 12314 1 1 35 ARG HD3 H -5.402 -2.818 10.533 1.00 . A A . 35 ARG HD3 1 1 20 12315 1 1 35 ARG HE H -7.818 -4.280 10.413 1.00 . A A . 35 ARG HE 1 1 20 12316 1 1 35 ARG HG2 H -6.031 -1.063 9.265 1.00 . A A . 35 ARG HG2 1 1 20 12317 1 1 35 ARG HG3 H -7.419 -1.915 8.586 1.00 . A A . 35 ARG HG3 1 1 20 12318 1 1 35 ARG HH11 H -6.580 -1.114 11.201 1.00 . A A . 35 ARG HH11 1 1 20 12319 1 1 35 ARG HH12 H -7.852 -0.758 12.321 1.00 . A A . 35 ARG HH12 1 1 20 12320 1 1 35 ARG HH21 H -9.492 -3.813 11.885 1.00 . A A . 35 ARG HH21 1 1 20 12321 1 1 35 ARG HH22 H -9.505 -2.290 12.710 1.00 . A A . 35 ARG HH22 1 1 20 12322 1 1 35 ARG N N -5.803 -2.457 5.114 1.00 . A A . 35 ARG N 1 1 20 12323 1 1 35 ARG NE N -7.396 -3.409 10.570 1.00 . A A . 35 ARG NE 1 1 20 12324 1 1 35 ARG NH1 N -7.420 -1.383 11.671 1.00 . A A . 35 ARG NH1 1 1 20 12325 1 1 35 ARG NH2 N -9.079 -2.920 12.061 1.00 . A A . 35 ARG NH2 1 1 20 12326 1 1 35 ARG O O -6.875 0.557 6.656 1.00 . A A . 35 ARG O 1 1 20 12327 1 1 36 SER C C -4.010 1.751 3.880 1.00 . A A . 36 SER C 1 1 20 12328 1 1 36 SER CA C -4.730 1.551 5.210 1.00 . A A . 36 SER CA 1 1 20 12329 1 1 36 SER CB C -3.869 2.091 6.354 1.00 . A A . 36 SER CB 1 1 20 12330 1 1 36 SER H H -4.449 -0.540 5.040 1.00 . A A . 36 SER H 1 1 20 12331 1 1 36 SER HA H -5.662 2.094 5.186 1.00 . A A . 36 SER HA 1 1 20 12332 1 1 36 SER HB2 H -4.054 1.510 7.245 1.00 . A A . 36 SER HB2 1 1 20 12333 1 1 36 SER HB3 H -2.826 2.013 6.084 1.00 . A A . 36 SER HB3 1 1 20 12334 1 1 36 SER HG H -3.427 3.999 6.370 1.00 . A A . 36 SER HG 1 1 20 12335 1 1 36 SER N N -5.036 0.142 5.428 1.00 . A A . 36 SER N 1 1 20 12336 1 1 36 SER O O -3.633 0.785 3.217 1.00 . A A . 36 SER O 1 1 20 12337 1 1 36 SER OG O -4.171 3.449 6.624 1.00 . A A . 36 SER OG 1 1 20 12338 1 1 37 CYS C C -1.657 3.600 2.475 1.00 . A A . 37 CYS C 1 1 20 12339 1 1 37 CYS CA C -3.144 3.331 2.245 1.00 . A A . 37 CYS CA 1 1 20 12340 1 1 37 CYS CB C -3.798 4.545 1.583 1.00 . A A . 37 CYS CB 1 1 20 12341 1 1 37 CYS H H -4.142 3.738 4.067 1.00 . A A . 37 CYS H 1 1 20 12342 1 1 37 CYS HA H -3.244 2.480 1.588 1.00 . A A . 37 CYS HA 1 1 20 12343 1 1 37 CYS HB2 H -4.200 5.190 2.350 1.00 . A A . 37 CYS HB2 1 1 20 12344 1 1 37 CYS HB3 H -3.051 5.085 1.021 1.00 . A A . 37 CYS HB3 1 1 20 12345 1 1 37 CYS N N -3.821 3.009 3.496 1.00 . A A . 37 CYS N 1 1 20 12346 1 1 37 CYS O O -0.958 4.068 1.577 1.00 . A A . 37 CYS O 1 1 20 12347 1 1 37 CYS SG S -5.158 4.125 0.445 1.00 . A A . 37 CYS SG 1 1 20 12348 1 1 38 GLU C C 0.906 2.184 4.346 1.00 . A A . 38 GLU C 1 1 20 12349 1 1 38 GLU CA C 0.224 3.509 4.020 1.00 . A A . 38 GLU CA 1 1 20 12350 1 1 38 GLU CB C 0.346 4.464 5.209 1.00 . A A . 38 GLU CB 1 1 20 12351 1 1 38 GLU CD C 2.663 4.746 6.175 1.00 . A A . 38 GLU CD 1 1 20 12352 1 1 38 GLU CG C 1.628 5.280 5.204 1.00 . A A . 38 GLU CG 1 1 20 12353 1 1 38 GLU H H -1.783 2.928 4.357 1.00 . A A . 38 GLU H 1 1 20 12354 1 1 38 GLU HA H 0.710 3.950 3.164 1.00 . A A . 38 GLU HA 1 1 20 12355 1 1 38 GLU HB2 H -0.491 5.147 5.194 1.00 . A A . 38 GLU HB2 1 1 20 12356 1 1 38 GLU HB3 H 0.314 3.890 6.123 1.00 . A A . 38 GLU HB3 1 1 20 12357 1 1 38 GLU HG2 H 2.047 5.262 4.209 1.00 . A A . 38 GLU HG2 1 1 20 12358 1 1 38 GLU HG3 H 1.392 6.299 5.476 1.00 . A A . 38 GLU HG3 1 1 20 12359 1 1 38 GLU N N -1.179 3.300 3.681 1.00 . A A . 38 GLU N 1 1 20 12360 1 1 38 GLU O O 0.561 1.521 5.325 1.00 . A A . 38 GLU O 1 1 20 12361 1 1 38 GLU OE1 O 2.567 3.559 6.550 1.00 . A A . 38 GLU OE1 1 1 20 12362 1 1 38 GLU OE2 O 3.569 5.514 6.558 1.00 . A A . 38 GLU OE2 1 1 20 12363 1 1 39 CYS C C 3.293 0.537 5.080 1.00 . A A . 39 CYS C 1 1 20 12364 1 1 39 CYS CA C 2.603 0.555 3.717 1.00 . A A . 39 CYS CA 1 1 20 12365 1 1 39 CYS CB C 3.636 0.362 2.605 1.00 . A A . 39 CYS CB 1 1 20 12366 1 1 39 CYS H H 2.101 2.373 2.755 1.00 . A A . 39 CYS H 1 1 20 12367 1 1 39 CYS HA H 1.890 -0.255 3.677 1.00 . A A . 39 CYS HA 1 1 20 12368 1 1 39 CYS HB2 H 3.430 1.061 1.808 1.00 . A A . 39 CYS HB2 1 1 20 12369 1 1 39 CYS HB3 H 4.622 0.558 3.001 1.00 . A A . 39 CYS HB3 1 1 20 12370 1 1 39 CYS N N 1.873 1.802 3.518 1.00 . A A . 39 CYS N 1 1 20 12371 1 1 39 CYS O O 3.724 1.576 5.580 1.00 . A A . 39 CYS O 1 1 20 12372 1 1 39 CYS SG S 3.649 -1.310 1.883 1.00 . A A . 39 CYS SG 1 1 20 12373 1 1 40 PRO C C 5.451 -0.194 7.040 1.00 . A A . 40 PRO C 1 1 20 12374 1 1 40 PRO CA C 4.050 -0.796 7.012 1.00 . A A . 40 PRO CA 1 1 20 12375 1 1 40 PRO CB C 4.117 -2.312 7.212 1.00 . A A . 40 PRO CB 1 1 20 12376 1 1 40 PRO CD C 2.922 -1.940 5.177 1.00 . A A . 40 PRO CD 1 1 20 12377 1 1 40 PRO CG C 3.020 -2.856 6.364 1.00 . A A . 40 PRO CG 1 1 20 12378 1 1 40 PRO HA H 3.454 -0.352 7.796 1.00 . A A . 40 PRO HA 1 1 20 12379 1 1 40 PRO HB2 H 5.082 -2.678 6.893 1.00 . A A . 40 PRO HB2 1 1 20 12380 1 1 40 PRO HB3 H 3.963 -2.548 8.254 1.00 . A A . 40 PRO HB3 1 1 20 12381 1 1 40 PRO HD2 H 3.554 -2.293 4.375 1.00 . A A . 40 PRO HD2 1 1 20 12382 1 1 40 PRO HD3 H 1.898 -1.860 4.845 1.00 . A A . 40 PRO HD3 1 1 20 12383 1 1 40 PRO HG2 H 3.265 -3.859 6.046 1.00 . A A . 40 PRO HG2 1 1 20 12384 1 1 40 PRO HG3 H 2.092 -2.853 6.917 1.00 . A A . 40 PRO HG3 1 1 20 12385 1 1 40 PRO N N 3.408 -0.650 5.701 1.00 . A A . 40 PRO N 1 1 20 12386 1 1 40 PRO O O 5.945 0.301 6.027 1.00 . A A . 40 PRO O 1 1 20 12387 1 1 41 SER C C 8.458 -0.823 8.481 1.00 . A A . 41 SER C 1 1 20 12388 1 1 41 SER CA C 7.431 0.299 8.366 1.00 . A A . 41 SER CA 1 1 20 12389 1 1 41 SER CB C 7.499 1.197 9.602 1.00 . A A . 41 SER CB 1 1 20 12390 1 1 41 SER H H 5.640 -0.649 8.977 1.00 . A A . 41 SER H 1 1 20 12391 1 1 41 SER HA H 7.657 0.889 7.491 1.00 . A A . 41 SER HA 1 1 20 12392 1 1 41 SER HB2 H 7.055 0.684 10.442 1.00 . A A . 41 SER HB2 1 1 20 12393 1 1 41 SER HB3 H 8.531 1.424 9.824 1.00 . A A . 41 SER HB3 1 1 20 12394 1 1 41 SER HG H 7.242 2.921 8.708 1.00 . A A . 41 SER HG 1 1 20 12395 1 1 41 SER N N 6.086 -0.241 8.206 1.00 . A A . 41 SER N 1 1 20 12396 1 1 41 SER O O 9.477 -0.678 9.157 1.00 . A A . 41 SER O 1 1 20 12397 1 1 41 SER OG O 6.799 2.411 9.390 1.00 . A A . 41 SER OG 1 1 20 12398 1 1 42 TYR C C 8.795 -4.035 6.683 1.00 . A A . 42 TYR C 1 1 20 12399 1 1 42 TYR CA C 9.083 -3.088 7.845 1.00 . A A . 42 TYR CA 1 1 20 12400 1 1 42 TYR CB C 8.948 -3.836 9.173 1.00 . A A . 42 TYR CB 1 1 20 12401 1 1 42 TYR CD1 C 6.669 -4.875 8.852 1.00 . A A . 42 TYR CD1 1 1 20 12402 1 1 42 TYR CD2 C 7.007 -3.466 10.744 1.00 . A A . 42 TYR CD2 1 1 20 12403 1 1 42 TYR CE1 C 5.359 -5.085 9.237 1.00 . A A . 42 TYR CE1 1 1 20 12404 1 1 42 TYR CE2 C 5.698 -3.671 11.136 1.00 . A A . 42 TYR CE2 1 1 20 12405 1 1 42 TYR CG C 7.515 -4.063 9.598 1.00 . A A . 42 TYR CG 1 1 20 12406 1 1 42 TYR CZ C 4.878 -4.481 10.379 1.00 . A A . 42 TYR CZ 1 1 20 12407 1 1 42 TYR H H 7.355 -1.996 7.296 1.00 . A A . 42 TYR H 1 1 20 12408 1 1 42 TYR HA H 10.093 -2.719 7.752 1.00 . A A . 42 TYR HA 1 1 20 12409 1 1 42 TYR HB2 H 9.424 -4.801 9.084 1.00 . A A . 42 TYR HB2 1 1 20 12410 1 1 42 TYR HB3 H 9.439 -3.268 9.949 1.00 . A A . 42 TYR HB3 1 1 20 12411 1 1 42 TYR HD1 H 7.049 -5.347 7.958 1.00 . A A . 42 TYR HD1 1 1 20 12412 1 1 42 TYR HD2 H 7.651 -2.831 11.335 1.00 . A A . 42 TYR HD2 1 1 20 12413 1 1 42 TYR HE1 H 4.717 -5.720 8.644 1.00 . A A . 42 TYR HE1 1 1 20 12414 1 1 42 TYR HE2 H 5.322 -3.197 12.031 1.00 . A A . 42 TYR HE2 1 1 20 12415 1 1 42 TYR HH H 3.355 -5.618 10.672 1.00 . A A . 42 TYR HH 1 1 20 12416 1 1 42 TYR N N 8.183 -1.941 7.817 1.00 . A A . 42 TYR N 1 1 20 12417 1 1 42 TYR O O 7.694 -4.038 6.132 1.00 . A A . 42 TYR O 1 1 20 12418 1 1 42 TYR OH O 3.574 -4.688 10.766 1.00 . A A . 42 TYR OH 1 1 20 12419 1 1 43 PRO C C 8.687 -6.952 5.540 1.00 . A A . 43 PRO C 1 1 20 12420 1 1 43 PRO CA C 9.634 -5.809 5.189 1.00 . A A . 43 PRO CA 1 1 20 12421 1 1 43 PRO CB C 11.054 -6.336 4.975 1.00 . A A . 43 PRO CB 1 1 20 12422 1 1 43 PRO CD C 11.131 -4.916 6.895 1.00 . A A . 43 PRO CD 1 1 20 12423 1 1 43 PRO CG C 11.727 -6.157 6.291 1.00 . A A . 43 PRO CG 1 1 20 12424 1 1 43 PRO HA H 9.288 -5.320 4.290 1.00 . A A . 43 PRO HA 1 1 20 12425 1 1 43 PRO HB2 H 11.014 -7.378 4.689 1.00 . A A . 43 PRO HB2 1 1 20 12426 1 1 43 PRO HB3 H 11.542 -5.763 4.201 1.00 . A A . 43 PRO HB3 1 1 20 12427 1 1 43 PRO HD2 H 11.068 -5.012 7.969 1.00 . A A . 43 PRO HD2 1 1 20 12428 1 1 43 PRO HD3 H 11.714 -4.047 6.626 1.00 . A A . 43 PRO HD3 1 1 20 12429 1 1 43 PRO HG2 H 11.534 -7.011 6.923 1.00 . A A . 43 PRO HG2 1 1 20 12430 1 1 43 PRO HG3 H 12.790 -6.029 6.146 1.00 . A A . 43 PRO HG3 1 1 20 12431 1 1 43 PRO N N 9.786 -4.854 6.293 1.00 . A A . 43 PRO N 1 1 20 12432 1 1 43 PRO O O 8.353 -7.159 6.706 1.00 . A A . 43 PRO O 1 1 20 12433 1 1 44 GLY C C 7.985 -9.908 5.571 1.00 . A A . 44 GLY C 1 1 20 12434 1 1 44 GLY CA C 7.355 -8.805 4.743 1.00 . A A . 44 GLY CA 1 1 20 12435 1 1 44 GLY H H 8.559 -7.480 3.613 1.00 . A A . 44 GLY H 1 1 20 12436 1 1 44 GLY HA2 H 7.062 -9.211 3.786 1.00 . A A . 44 GLY HA2 1 1 20 12437 1 1 44 GLY HA3 H 6.475 -8.444 5.254 1.00 . A A . 44 GLY HA3 1 1 20 12438 1 1 44 GLY N N 8.259 -7.692 4.522 1.00 . A A . 44 GLY N 1 1 20 12439 1 1 44 GLY O O 9.022 -10.455 5.140 1.00 . A A . 44 GLY O 1 1 20 12440 1 1 44 GLY OXT O 7.442 -10.224 6.650 1.00 . A A . 44 GLY OXT 1 1 21 12441 1 1 1 ALA C C -11.823 16.659 3.417 1.00 . A A . 1 ALA C 1 1 21 12442 1 1 1 ALA CA C -11.441 18.036 3.950 1.00 . A A . 1 ALA CA 1 1 21 12443 1 1 1 ALA CB C -11.631 18.090 5.458 1.00 . A A . 1 ALA CB 1 1 21 12444 1 1 1 ALA H1 H -13.245 18.900 3.469 1.00 . A A . 1 ALA H1 1 1 21 12445 1 1 1 ALA H2 H -11.960 20.012 3.711 1.00 . A A . 1 ALA H2 1 1 21 12446 1 1 1 ALA H3 H -12.025 19.078 2.275 1.00 . A A . 1 ALA H3 1 1 21 12447 1 1 1 ALA HA H -10.397 18.214 3.737 1.00 . A A . 1 ALA HA 1 1 21 12448 1 1 1 ALA HB1 H -10.921 18.781 5.886 1.00 . A A . 1 ALA HB1 1 1 21 12449 1 1 1 ALA HB2 H -11.474 17.106 5.876 1.00 . A A . 1 ALA HB2 1 1 21 12450 1 1 1 ALA HB3 H -12.635 18.419 5.683 1.00 . A A . 1 ALA HB3 1 1 21 12451 1 1 1 ALA N N -12.240 19.102 3.292 1.00 . A A . 1 ALA N 1 1 21 12452 1 1 1 ALA O O -12.592 15.932 4.045 1.00 . A A . 1 ALA O 1 1 21 12453 1 1 2 MET C C -10.832 13.894 2.366 1.00 . A A . 2 MET C 1 1 21 12454 1 1 2 MET CA C -11.565 15.017 1.639 1.00 . A A . 2 MET CA 1 1 21 12455 1 1 2 MET CB C -11.162 15.034 0.164 1.00 . A A . 2 MET CB 1 1 21 12456 1 1 2 MET CE C -14.149 17.656 -0.476 1.00 . A A . 2 MET CE 1 1 21 12457 1 1 2 MET CG C -12.170 15.733 -0.734 1.00 . A A . 2 MET CG 1 1 21 12458 1 1 2 MET H H -10.675 16.931 1.804 1.00 . A A . 2 MET H 1 1 21 12459 1 1 2 MET HA H -12.628 14.843 1.711 1.00 . A A . 2 MET HA 1 1 21 12460 1 1 2 MET HB2 H -10.213 15.541 0.067 1.00 . A A . 2 MET HB2 1 1 21 12461 1 1 2 MET HB3 H -11.052 14.016 -0.179 1.00 . A A . 2 MET HB3 1 1 21 12462 1 1 2 MET HE1 H -14.589 16.697 -0.704 1.00 . A A . 2 MET HE1 1 1 21 12463 1 1 2 MET HE2 H -14.554 18.027 0.454 1.00 . A A . 2 MET HE2 1 1 21 12464 1 1 2 MET HE3 H -14.373 18.353 -1.270 1.00 . A A . 2 MET HE3 1 1 21 12465 1 1 2 MET HG2 H -11.834 15.657 -1.757 1.00 . A A . 2 MET HG2 1 1 21 12466 1 1 2 MET HG3 H -13.125 15.240 -0.632 1.00 . A A . 2 MET HG3 1 1 21 12467 1 1 2 MET N N -11.281 16.308 2.256 1.00 . A A . 2 MET N 1 1 21 12468 1 1 2 MET O O -9.929 14.143 3.164 1.00 . A A . 2 MET O 1 1 21 12469 1 1 2 MET SD S -12.373 17.477 -0.323 1.00 . A A . 2 MET SD 1 1 21 12470 1 1 3 ASP C C -10.342 10.400 1.682 1.00 . A A . 3 ASP C 1 1 21 12471 1 1 3 ASP CA C -10.609 11.495 2.710 1.00 . A A . 3 ASP CA 1 1 21 12472 1 1 3 ASP CB C -11.503 10.954 3.827 1.00 . A A . 3 ASP CB 1 1 21 12473 1 1 3 ASP CG C -12.941 10.775 3.381 1.00 . A A . 3 ASP CG 1 1 21 12474 1 1 3 ASP H H -11.953 12.522 1.438 1.00 . A A . 3 ASP H 1 1 21 12475 1 1 3 ASP HA H -9.667 11.810 3.134 1.00 . A A . 3 ASP HA 1 1 21 12476 1 1 3 ASP HB2 H -11.124 9.997 4.151 1.00 . A A . 3 ASP HB2 1 1 21 12477 1 1 3 ASP HB3 H -11.486 11.644 4.658 1.00 . A A . 3 ASP HB3 1 1 21 12478 1 1 3 ASP N N -11.228 12.657 2.083 1.00 . A A . 3 ASP N 1 1 21 12479 1 1 3 ASP O O -11.103 9.438 1.574 1.00 . A A . 3 ASP O 1 1 21 12480 1 1 3 ASP OD1 O -13.592 11.790 3.055 1.00 . A A . 3 ASP OD1 1 1 21 12481 1 1 3 ASP OD2 O -13.415 9.620 3.358 1.00 . A A . 3 ASP OD2 1 1 21 12482 1 1 4 CYS C C -7.724 8.712 0.376 1.00 . A A . 4 CYS C 1 1 21 12483 1 1 4 CYS CA C -8.891 9.577 -0.091 1.00 . A A . 4 CYS CA 1 1 21 12484 1 1 4 CYS CB C -8.524 10.285 -1.397 1.00 . A A . 4 CYS CB 1 1 21 12485 1 1 4 CYS H H -8.691 11.341 1.062 1.00 . A A . 4 CYS H 1 1 21 12486 1 1 4 CYS HA H -9.747 8.942 -0.264 1.00 . A A . 4 CYS HA 1 1 21 12487 1 1 4 CYS HB2 H -7.970 11.183 -1.167 1.00 . A A . 4 CYS HB2 1 1 21 12488 1 1 4 CYS HB3 H -7.905 9.629 -1.991 1.00 . A A . 4 CYS HB3 1 1 21 12489 1 1 4 CYS N N -9.258 10.553 0.929 1.00 . A A . 4 CYS N 1 1 21 12490 1 1 4 CYS O O -7.586 7.562 -0.042 1.00 . A A . 4 CYS O 1 1 21 12491 1 1 4 CYS SG S -9.959 10.766 -2.412 1.00 . A A . 4 CYS SG 1 1 21 12492 1 1 5 THR C C -4.766 8.187 0.639 1.00 . A A . 5 THR C 1 1 21 12493 1 1 5 THR CA C -5.730 8.549 1.764 1.00 . A A . 5 THR CA 1 1 21 12494 1 1 5 THR CB C -6.181 7.284 2.498 1.00 . A A . 5 THR CB 1 1 21 12495 1 1 5 THR CG2 C -5.320 6.947 3.696 1.00 . A A . 5 THR CG2 1 1 21 12496 1 1 5 THR H H -7.046 10.191 1.539 1.00 . A A . 5 THR H 1 1 21 12497 1 1 5 THR HA H -5.222 9.196 2.462 1.00 . A A . 5 THR HA 1 1 21 12498 1 1 5 THR HB H -6.138 6.448 1.814 1.00 . A A . 5 THR HB 1 1 21 12499 1 1 5 THR HG1 H -8.086 6.831 2.449 1.00 . A A . 5 THR HG1 1 1 21 12500 1 1 5 THR HG21 H -5.263 7.805 4.350 1.00 . A A . 5 THR HG21 1 1 21 12501 1 1 5 THR HG22 H -5.755 6.115 4.230 1.00 . A A . 5 THR HG22 1 1 21 12502 1 1 5 THR HG23 H -4.328 6.682 3.362 1.00 . A A . 5 THR HG23 1 1 21 12503 1 1 5 THR N N -6.885 9.271 1.243 1.00 . A A . 5 THR N 1 1 21 12504 1 1 5 THR O O -4.533 7.012 0.358 1.00 . A A . 5 THR O 1 1 21 12505 1 1 5 THR OG1 O -7.516 7.417 2.952 1.00 . A A . 5 THR OG1 1 1 21 12506 1 1 6 THR C C -2.008 8.293 -0.610 1.00 . A A . 6 THR C 1 1 21 12507 1 1 6 THR CA C -3.268 9.000 -1.099 1.00 . A A . 6 THR CA 1 1 21 12508 1 1 6 THR CB C -2.901 10.337 -1.744 1.00 . A A . 6 THR CB 1 1 21 12509 1 1 6 THR CG2 C -3.785 10.698 -2.918 1.00 . A A . 6 THR CG2 1 1 21 12510 1 1 6 THR H H -4.433 10.122 0.267 1.00 . A A . 6 THR H 1 1 21 12511 1 1 6 THR HA H -3.752 8.377 -1.836 1.00 . A A . 6 THR HA 1 1 21 12512 1 1 6 THR HB H -1.882 10.286 -2.101 1.00 . A A . 6 THR HB 1 1 21 12513 1 1 6 THR HG1 H -2.406 12.106 -1.063 1.00 . A A . 6 THR HG1 1 1 21 12514 1 1 6 THR HG21 H -4.206 9.798 -3.342 1.00 . A A . 6 THR HG21 1 1 21 12515 1 1 6 THR HG22 H -4.583 11.344 -2.583 1.00 . A A . 6 THR HG22 1 1 21 12516 1 1 6 THR HG23 H -3.198 11.208 -3.667 1.00 . A A . 6 THR HG23 1 1 21 12517 1 1 6 THR N N -4.208 9.208 -0.003 1.00 . A A . 6 THR N 1 1 21 12518 1 1 6 THR O O -1.486 8.604 0.461 1.00 . A A . 6 THR O 1 1 21 12519 1 1 6 THR OG1 O -2.989 11.390 -0.800 1.00 . A A . 6 THR OG1 1 1 21 12520 1 1 7 GLY C C -0.095 5.397 -1.921 1.00 . A A . 7 GLY C 1 1 21 12521 1 1 7 GLY CA C -0.330 6.606 -1.033 1.00 . A A . 7 GLY CA 1 1 21 12522 1 1 7 GLY H H -1.984 7.137 -2.243 1.00 . A A . 7 GLY H 1 1 21 12523 1 1 7 GLY HA2 H -0.426 6.273 -0.010 1.00 . A A . 7 GLY HA2 1 1 21 12524 1 1 7 GLY HA3 H 0.523 7.264 -1.108 1.00 . A A . 7 GLY HA3 1 1 21 12525 1 1 7 GLY N N -1.525 7.342 -1.402 1.00 . A A . 7 GLY N 1 1 21 12526 1 1 7 GLY O O -0.769 5.233 -2.939 1.00 . A A . 7 GLY O 1 1 21 12527 1 1 8 PRO C C 0.055 2.289 -2.281 1.00 . A A . 8 PRO C 1 1 21 12528 1 1 8 PRO CA C 1.172 3.325 -2.342 1.00 . A A . 8 PRO CA 1 1 21 12529 1 1 8 PRO CB C 2.440 2.784 -1.676 1.00 . A A . 8 PRO CB 1 1 21 12530 1 1 8 PRO CD C 1.713 4.642 -0.361 1.00 . A A . 8 PRO CD 1 1 21 12531 1 1 8 PRO CG C 2.384 3.299 -0.280 1.00 . A A . 8 PRO CG 1 1 21 12532 1 1 8 PRO HA H 1.380 3.568 -3.374 1.00 . A A . 8 PRO HA 1 1 21 12533 1 1 8 PRO HB2 H 2.429 1.703 -1.701 1.00 . A A . 8 PRO HB2 1 1 21 12534 1 1 8 PRO HB3 H 3.310 3.153 -2.198 1.00 . A A . 8 PRO HB3 1 1 21 12535 1 1 8 PRO HD2 H 1.116 4.819 0.521 1.00 . A A . 8 PRO HD2 1 1 21 12536 1 1 8 PRO HD3 H 2.447 5.424 -0.485 1.00 . A A . 8 PRO HD3 1 1 21 12537 1 1 8 PRO HG2 H 1.806 2.627 0.336 1.00 . A A . 8 PRO HG2 1 1 21 12538 1 1 8 PRO HG3 H 3.385 3.403 0.113 1.00 . A A . 8 PRO HG3 1 1 21 12539 1 1 8 PRO N N 0.861 4.525 -1.560 1.00 . A A . 8 PRO N 1 1 21 12540 1 1 8 PRO O O -0.128 1.503 -3.211 1.00 . A A . 8 PRO O 1 1 21 12541 1 1 9 CYS C C -3.125 2.008 -1.343 1.00 . A A . 9 CYS C 1 1 21 12542 1 1 9 CYS CA C -1.791 1.355 -0.998 1.00 . A A . 9 CYS CA 1 1 21 12543 1 1 9 CYS CB C -1.818 0.844 0.443 1.00 . A A . 9 CYS CB 1 1 21 12544 1 1 9 CYS H H -0.495 2.945 -0.475 1.00 . A A . 9 CYS H 1 1 21 12545 1 1 9 CYS HA H -1.629 0.520 -1.664 1.00 . A A . 9 CYS HA 1 1 21 12546 1 1 9 CYS HB2 H -1.659 1.674 1.115 1.00 . A A . 9 CYS HB2 1 1 21 12547 1 1 9 CYS HB3 H -2.785 0.406 0.643 1.00 . A A . 9 CYS HB3 1 1 21 12548 1 1 9 CYS N N -0.690 2.294 -1.181 1.00 . A A . 9 CYS N 1 1 21 12549 1 1 9 CYS O O -4.151 1.707 -0.733 1.00 . A A . 9 CYS O 1 1 21 12550 1 1 9 CYS SG S -0.553 -0.414 0.811 1.00 . A A . 9 CYS SG 1 1 21 12551 1 1 10 CYS C C -4.250 3.937 -4.235 1.00 . A A . 10 CYS C 1 1 21 12552 1 1 10 CYS CA C -4.310 3.604 -2.747 1.00 . A A . 10 CYS CA 1 1 21 12553 1 1 10 CYS CB C -4.493 4.885 -1.929 1.00 . A A . 10 CYS CB 1 1 21 12554 1 1 10 CYS H H -2.254 3.104 -2.769 1.00 . A A . 10 CYS H 1 1 21 12555 1 1 10 CYS HA H -5.151 2.951 -2.570 1.00 . A A . 10 CYS HA 1 1 21 12556 1 1 10 CYS HB2 H -3.711 4.943 -1.190 1.00 . A A . 10 CYS HB2 1 1 21 12557 1 1 10 CYS HB3 H -4.421 5.738 -2.588 1.00 . A A . 10 CYS HB3 1 1 21 12558 1 1 10 CYS N N -3.103 2.905 -2.322 1.00 . A A . 10 CYS N 1 1 21 12559 1 1 10 CYS O O -3.184 3.889 -4.850 1.00 . A A . 10 CYS O 1 1 21 12560 1 1 10 CYS SG S -6.088 4.993 -1.055 1.00 . A A . 10 CYS SG 1 1 21 12561 1 1 11 ARG C C -6.905 5.011 -6.602 1.00 . A A . 11 ARG C 1 1 21 12562 1 1 11 ARG CA C -5.482 4.618 -6.222 1.00 . A A . 11 ARG CA 1 1 21 12563 1 1 11 ARG CB C -5.019 3.441 -7.083 1.00 . A A . 11 ARG CB 1 1 21 12564 1 1 11 ARG CD C -5.329 1.035 -7.737 1.00 . A A . 11 ARG CD 1 1 21 12565 1 1 11 ARG CG C -5.868 2.192 -6.913 1.00 . A A . 11 ARG CG 1 1 21 12566 1 1 11 ARG CZ C -5.944 -0.145 -9.811 1.00 . A A . 11 ARG CZ 1 1 21 12567 1 1 11 ARG H H -6.216 4.296 -4.263 1.00 . A A . 11 ARG H 1 1 21 12568 1 1 11 ARG HA H -4.829 5.460 -6.398 1.00 . A A . 11 ARG HA 1 1 21 12569 1 1 11 ARG HB2 H -5.052 3.734 -8.122 1.00 . A A . 11 ARG HB2 1 1 21 12570 1 1 11 ARG HB3 H -4.000 3.196 -6.820 1.00 . A A . 11 ARG HB3 1 1 21 12571 1 1 11 ARG HD2 H -4.269 1.178 -7.885 1.00 . A A . 11 ARG HD2 1 1 21 12572 1 1 11 ARG HD3 H -5.494 0.115 -7.195 1.00 . A A . 11 ARG HD3 1 1 21 12573 1 1 11 ARG HE H -6.470 1.727 -9.360 1.00 . A A . 11 ARG HE 1 1 21 12574 1 1 11 ARG HG2 H -5.870 1.909 -5.871 1.00 . A A . 11 ARG HG2 1 1 21 12575 1 1 11 ARG HG3 H -6.878 2.409 -7.231 1.00 . A A . 11 ARG HG3 1 1 21 12576 1 1 11 ARG HH11 H -4.821 -1.234 -8.529 1.00 . A A . 11 ARG HH11 1 1 21 12577 1 1 11 ARG HH12 H -5.267 -2.041 -9.995 1.00 . A A . 11 ARG HH12 1 1 21 12578 1 1 11 ARG HH21 H -7.058 0.667 -11.289 1.00 . A A . 11 ARG HH21 1 1 21 12579 1 1 11 ARG HH22 H -6.537 -0.962 -11.562 1.00 . A A . 11 ARG HH22 1 1 21 12580 1 1 11 ARG N N -5.401 4.276 -4.807 1.00 . A A . 11 ARG N 1 1 21 12581 1 1 11 ARG NE N -5.980 0.940 -9.041 1.00 . A A . 11 ARG NE 1 1 21 12582 1 1 11 ARG NH1 N -5.290 -1.229 -9.412 1.00 . A A . 11 ARG NH1 1 1 21 12583 1 1 11 ARG NH2 N -6.564 -0.147 -10.984 1.00 . A A . 11 ARG NH2 1 1 21 12584 1 1 11 ARG O O -7.855 4.280 -6.323 1.00 . A A . 11 ARG O 1 1 21 12585 1 1 12 GLN C C -9.261 6.916 -6.446 1.00 . A A . 12 GLN C 1 1 21 12586 1 1 12 GLN CA C -8.359 6.662 -7.652 1.00 . A A . 12 GLN CA 1 1 21 12587 1 1 12 GLN CB C -9.023 5.655 -8.585 1.00 . A A . 12 GLN CB 1 1 21 12588 1 1 12 GLN CD C -9.258 4.802 -10.950 1.00 . A A . 12 GLN CD 1 1 21 12589 1 1 12 GLN CG C -8.767 5.925 -10.058 1.00 . A A . 12 GLN CG 1 1 21 12590 1 1 12 GLN H H -6.252 6.712 -7.429 1.00 . A A . 12 GLN H 1 1 21 12591 1 1 12 GLN HA H -8.215 7.592 -8.182 1.00 . A A . 12 GLN HA 1 1 21 12592 1 1 12 GLN HB2 H -8.650 4.671 -8.349 1.00 . A A . 12 GLN HB2 1 1 21 12593 1 1 12 GLN HB3 H -10.089 5.677 -8.415 1.00 . A A . 12 GLN HB3 1 1 21 12594 1 1 12 GLN HE21 H -11.141 5.388 -10.694 1.00 . A A . 12 GLN HE21 1 1 21 12595 1 1 12 GLN HE22 H -10.916 4.008 -11.709 1.00 . A A . 12 GLN HE22 1 1 21 12596 1 1 12 GLN HG2 H -9.275 6.835 -10.339 1.00 . A A . 12 GLN HG2 1 1 21 12597 1 1 12 GLN HG3 H -7.704 6.046 -10.209 1.00 . A A . 12 GLN HG3 1 1 21 12598 1 1 12 GLN N N -7.047 6.172 -7.237 1.00 . A A . 12 GLN N 1 1 21 12599 1 1 12 GLN NE2 N -10.571 4.725 -11.137 1.00 . A A . 12 GLN NE2 1 1 21 12600 1 1 12 GLN O O -10.477 7.046 -6.587 1.00 . A A . 12 GLN O 1 1 21 12601 1 1 12 GLN OE1 O -8.467 4.012 -11.467 1.00 . A A . 12 GLN OE1 1 1 21 12602 1 1 13 CYS C C -10.110 5.938 -3.575 1.00 . A A . 13 CYS C 1 1 21 12603 1 1 13 CYS CA C -9.395 7.208 -4.024 1.00 . A A . 13 CYS CA 1 1 21 12604 1 1 13 CYS CB C -10.405 8.348 -4.192 1.00 . A A . 13 CYS CB 1 1 21 12605 1 1 13 CYS H H -7.689 6.858 -5.224 1.00 . A A . 13 CYS H 1 1 21 12606 1 1 13 CYS HA H -8.679 7.485 -3.265 1.00 . A A . 13 CYS HA 1 1 21 12607 1 1 13 CYS HB2 H -9.943 9.150 -4.748 1.00 . A A . 13 CYS HB2 1 1 21 12608 1 1 13 CYS HB3 H -11.261 7.983 -4.740 1.00 . A A . 13 CYS HB3 1 1 21 12609 1 1 13 CYS N N -8.657 6.977 -5.265 1.00 . A A . 13 CYS N 1 1 21 12610 1 1 13 CYS O O -11.240 5.987 -3.088 1.00 . A A . 13 CYS O 1 1 21 12611 1 1 13 CYS SG S -11.009 9.041 -2.619 1.00 . A A . 13 CYS SG 1 1 21 12612 1 1 14 LYS C C -8.918 2.593 -2.816 1.00 . A A . 14 LYS C 1 1 21 12613 1 1 14 LYS CA C -10.006 3.516 -3.351 1.00 . A A . 14 LYS CA 1 1 21 12614 1 1 14 LYS CB C -10.711 2.862 -4.541 1.00 . A A . 14 LYS CB 1 1 21 12615 1 1 14 LYS CD C -12.213 0.904 -5.016 1.00 . A A . 14 LYS CD 1 1 21 12616 1 1 14 LYS CE C -12.820 -0.228 -4.203 1.00 . A A . 14 LYS CE 1 1 21 12617 1 1 14 LYS CG C -11.999 2.147 -4.166 1.00 . A A . 14 LYS CG 1 1 21 12618 1 1 14 LYS H H -8.543 4.827 -4.132 1.00 . A A . 14 LYS H 1 1 21 12619 1 1 14 LYS HA H -10.728 3.695 -2.568 1.00 . A A . 14 LYS HA 1 1 21 12620 1 1 14 LYS HB2 H -10.947 3.624 -5.268 1.00 . A A . 14 LYS HB2 1 1 21 12621 1 1 14 LYS HB3 H -10.042 2.142 -4.990 1.00 . A A . 14 LYS HB3 1 1 21 12622 1 1 14 LYS HD2 H -12.880 1.147 -5.830 1.00 . A A . 14 LYS HD2 1 1 21 12623 1 1 14 LYS HD3 H -11.261 0.582 -5.411 1.00 . A A . 14 LYS HD3 1 1 21 12624 1 1 14 LYS HE2 H -12.809 -1.128 -4.799 1.00 . A A . 14 LYS HE2 1 1 21 12625 1 1 14 LYS HE3 H -12.223 -0.377 -3.315 1.00 . A A . 14 LYS HE3 1 1 21 12626 1 1 14 LYS HG2 H -11.949 1.856 -3.128 1.00 . A A . 14 LYS HG2 1 1 21 12627 1 1 14 LYS HG3 H -12.830 2.821 -4.314 1.00 . A A . 14 LYS HG3 1 1 21 12628 1 1 14 LYS HZ1 H -14.373 1.096 -3.756 1.00 . A A . 14 LYS HZ1 1 1 21 12629 1 1 14 LYS HZ2 H -14.886 -0.340 -4.490 1.00 . A A . 14 LYS HZ2 1 1 21 12630 1 1 14 LYS HZ3 H -14.420 -0.341 -2.865 1.00 . A A . 14 LYS HZ3 1 1 21 12631 1 1 14 LYS N N -9.441 4.801 -3.740 1.00 . A A . 14 LYS N 1 1 21 12632 1 1 14 LYS NZ N -14.223 0.067 -3.800 1.00 . A A . 14 LYS NZ 1 1 21 12633 1 1 14 LYS O O -7.939 2.309 -3.506 1.00 . A A . 14 LYS O 1 1 21 12634 1 1 15 LEU C C -7.729 0.103 -1.892 1.00 . A A . 15 LEU C 1 1 21 12635 1 1 15 LEU CA C -8.120 1.240 -0.953 1.00 . A A . 15 LEU CA 1 1 21 12636 1 1 15 LEU CB C -8.685 0.672 0.349 1.00 . A A . 15 LEU CB 1 1 21 12637 1 1 15 LEU CD1 C -9.533 1.452 2.577 1.00 . A A . 15 LEU CD1 1 1 21 12638 1 1 15 LEU CD2 C -7.100 0.961 2.268 1.00 . A A . 15 LEU CD2 1 1 21 12639 1 1 15 LEU CG C -8.364 1.486 1.604 1.00 . A A . 15 LEU CG 1 1 21 12640 1 1 15 LEU H H -9.891 2.394 -1.081 1.00 . A A . 15 LEU H 1 1 21 12641 1 1 15 LEU HA H -7.239 1.820 -0.729 1.00 . A A . 15 LEU HA 1 1 21 12642 1 1 15 LEU HB2 H -9.758 0.605 0.252 1.00 . A A . 15 LEU HB2 1 1 21 12643 1 1 15 LEU HB3 H -8.290 -0.324 0.484 1.00 . A A . 15 LEU HB3 1 1 21 12644 1 1 15 LEU HD11 H -9.882 0.435 2.685 1.00 . A A . 15 LEU HD11 1 1 21 12645 1 1 15 LEU HD12 H -9.212 1.826 3.538 1.00 . A A . 15 LEU HD12 1 1 21 12646 1 1 15 LEU HD13 H -10.334 2.069 2.199 1.00 . A A . 15 LEU HD13 1 1 21 12647 1 1 15 LEU HD21 H -7.067 -0.115 2.181 1.00 . A A . 15 LEU HD21 1 1 21 12648 1 1 15 LEU HD22 H -6.235 1.388 1.783 1.00 . A A . 15 LEU HD22 1 1 21 12649 1 1 15 LEU HD23 H -7.100 1.238 3.312 1.00 . A A . 15 LEU HD23 1 1 21 12650 1 1 15 LEU HG H -8.193 2.515 1.323 1.00 . A A . 15 LEU HG 1 1 21 12651 1 1 15 LEU N N -9.092 2.130 -1.582 1.00 . A A . 15 LEU N 1 1 21 12652 1 1 15 LEU O O -8.557 -0.738 -2.245 1.00 . A A . 15 LEU O 1 1 21 12653 1 1 16 LYS C C -6.259 -2.341 -2.651 1.00 . A A . 16 LYS C 1 1 21 12654 1 1 16 LYS CA C -5.959 -0.945 -3.196 1.00 . A A . 16 LYS CA 1 1 21 12655 1 1 16 LYS CB C -4.452 -0.777 -3.403 1.00 . A A . 16 LYS CB 1 1 21 12656 1 1 16 LYS CD C -2.603 0.313 -4.709 1.00 . A A . 16 LYS CD 1 1 21 12657 1 1 16 LYS CE C -2.181 0.744 -6.104 1.00 . A A . 16 LYS CE 1 1 21 12658 1 1 16 LYS CG C -4.095 0.028 -4.642 1.00 . A A . 16 LYS CG 1 1 21 12659 1 1 16 LYS H H -5.852 0.785 -1.981 1.00 . A A . 16 LYS H 1 1 21 12660 1 1 16 LYS HA H -6.460 -0.825 -4.145 1.00 . A A . 16 LYS HA 1 1 21 12661 1 1 16 LYS HB2 H -4.036 -0.276 -2.542 1.00 . A A . 16 LYS HB2 1 1 21 12662 1 1 16 LYS HB3 H -4.001 -1.755 -3.493 1.00 . A A . 16 LYS HB3 1 1 21 12663 1 1 16 LYS HD2 H -2.366 1.103 -4.013 1.00 . A A . 16 LYS HD2 1 1 21 12664 1 1 16 LYS HD3 H -2.063 -0.582 -4.439 1.00 . A A . 16 LYS HD3 1 1 21 12665 1 1 16 LYS HE2 H -2.189 -0.120 -6.752 1.00 . A A . 16 LYS HE2 1 1 21 12666 1 1 16 LYS HE3 H -2.888 1.474 -6.471 1.00 . A A . 16 LYS HE3 1 1 21 12667 1 1 16 LYS HG2 H -4.384 -0.532 -5.519 1.00 . A A . 16 LYS HG2 1 1 21 12668 1 1 16 LYS HG3 H -4.631 0.965 -4.617 1.00 . A A . 16 LYS HG3 1 1 21 12669 1 1 16 LYS HZ1 H -0.192 0.815 -5.470 1.00 . A A . 16 LYS HZ1 1 1 21 12670 1 1 16 LYS HZ2 H -0.418 1.306 -7.072 1.00 . A A . 16 LYS HZ2 1 1 21 12671 1 1 16 LYS HZ3 H -0.860 2.333 -5.802 1.00 . A A . 16 LYS HZ3 1 1 21 12672 1 1 16 LYS N N -6.463 0.086 -2.295 1.00 . A A . 16 LYS N 1 1 21 12673 1 1 16 LYS NZ N -0.817 1.342 -6.113 1.00 . A A . 16 LYS NZ 1 1 21 12674 1 1 16 LYS O O -6.591 -2.499 -1.476 1.00 . A A . 16 LYS O 1 1 21 12675 1 1 17 PRO C C -5.412 -5.260 -2.056 1.00 . A A . 17 PRO C 1 1 21 12676 1 1 17 PRO CA C -6.408 -4.761 -3.097 1.00 . A A . 17 PRO CA 1 1 21 12677 1 1 17 PRO CB C -6.259 -5.554 -4.400 1.00 . A A . 17 PRO CB 1 1 21 12678 1 1 17 PRO CD C -5.757 -3.277 -4.919 1.00 . A A . 17 PRO CD 1 1 21 12679 1 1 17 PRO CG C -5.417 -4.695 -5.280 1.00 . A A . 17 PRO CG 1 1 21 12680 1 1 17 PRO HA H -7.412 -4.878 -2.715 1.00 . A A . 17 PRO HA 1 1 21 12681 1 1 17 PRO HB2 H -5.779 -6.500 -4.195 1.00 . A A . 17 PRO HB2 1 1 21 12682 1 1 17 PRO HB3 H -7.233 -5.725 -4.833 1.00 . A A . 17 PRO HB3 1 1 21 12683 1 1 17 PRO HD2 H -4.893 -2.640 -5.039 1.00 . A A . 17 PRO HD2 1 1 21 12684 1 1 17 PRO HD3 H -6.579 -2.920 -5.521 1.00 . A A . 17 PRO HD3 1 1 21 12685 1 1 17 PRO HG2 H -4.372 -4.890 -5.092 1.00 . A A . 17 PRO HG2 1 1 21 12686 1 1 17 PRO HG3 H -5.655 -4.885 -6.316 1.00 . A A . 17 PRO HG3 1 1 21 12687 1 1 17 PRO N N -6.146 -3.375 -3.501 1.00 . A A . 17 PRO N 1 1 21 12688 1 1 17 PRO O O -4.216 -4.983 -2.144 1.00 . A A . 17 PRO O 1 1 21 12689 1 1 18 ALA C C -3.971 -7.428 -0.588 1.00 . A A . 18 ALA C 1 1 21 12690 1 1 18 ALA CA C -5.067 -6.538 -0.013 1.00 . A A . 18 ALA CA 1 1 21 12691 1 1 18 ALA CB C -5.907 -7.313 0.991 1.00 . A A . 18 ALA CB 1 1 21 12692 1 1 18 ALA H H -6.875 -6.186 -1.055 1.00 . A A . 18 ALA H 1 1 21 12693 1 1 18 ALA HA H -4.608 -5.707 0.504 1.00 . A A . 18 ALA HA 1 1 21 12694 1 1 18 ALA HB1 H -6.906 -6.903 1.018 1.00 . A A . 18 ALA HB1 1 1 21 12695 1 1 18 ALA HB2 H -5.953 -8.351 0.696 1.00 . A A . 18 ALA HB2 1 1 21 12696 1 1 18 ALA HB3 H -5.460 -7.237 1.971 1.00 . A A . 18 ALA HB3 1 1 21 12697 1 1 18 ALA N N -5.913 -5.998 -1.071 1.00 . A A . 18 ALA N 1 1 21 12698 1 1 18 ALA O O -4.252 -8.404 -1.284 1.00 . A A . 18 ALA O 1 1 21 12699 1 1 19 GLY C C -0.887 -7.179 -1.943 1.00 . A A . 19 GLY C 1 1 21 12700 1 1 19 GLY CA C -1.602 -7.861 -0.792 1.00 . A A . 19 GLY CA 1 1 21 12701 1 1 19 GLY H H -2.559 -6.296 0.264 1.00 . A A . 19 GLY H 1 1 21 12702 1 1 19 GLY HA2 H -1.966 -8.821 -1.128 1.00 . A A . 19 GLY HA2 1 1 21 12703 1 1 19 GLY HA3 H -0.900 -8.016 0.013 1.00 . A A . 19 GLY HA3 1 1 21 12704 1 1 19 GLY N N -2.722 -7.084 -0.295 1.00 . A A . 19 GLY N 1 1 21 12705 1 1 19 GLY O O -0.211 -7.833 -2.737 1.00 . A A . 19 GLY O 1 1 21 12706 1 1 20 THR C C 0.977 -4.596 -2.651 1.00 . A A . 20 THR C 1 1 21 12707 1 1 20 THR CA C -0.397 -5.090 -3.092 1.00 . A A . 20 THR CA 1 1 21 12708 1 1 20 THR CB C -1.276 -3.902 -3.488 1.00 . A A . 20 THR CB 1 1 21 12709 1 1 20 THR CG2 C -0.699 -3.080 -4.620 1.00 . A A . 20 THR CG2 1 1 21 12710 1 1 20 THR H H -1.585 -5.394 -1.369 1.00 . A A . 20 THR H 1 1 21 12711 1 1 20 THR HA H -0.276 -5.738 -3.947 1.00 . A A . 20 THR HA 1 1 21 12712 1 1 20 THR HB H -1.391 -3.252 -2.632 1.00 . A A . 20 THR HB 1 1 21 12713 1 1 20 THR HG1 H -2.473 -5.085 -4.489 1.00 . A A . 20 THR HG1 1 1 21 12714 1 1 20 THR HG21 H -0.379 -3.738 -5.415 1.00 . A A . 20 THR HG21 1 1 21 12715 1 1 20 THR HG22 H -1.454 -2.404 -4.995 1.00 . A A . 20 THR HG22 1 1 21 12716 1 1 20 THR HG23 H 0.146 -2.513 -4.259 1.00 . A A . 20 THR HG23 1 1 21 12717 1 1 20 THR N N -1.035 -5.860 -2.032 1.00 . A A . 20 THR N 1 1 21 12718 1 1 20 THR O O 1.099 -3.866 -1.668 1.00 . A A . 20 THR O 1 1 21 12719 1 1 20 THR OG1 O -2.561 -4.342 -3.888 1.00 . A A . 20 THR OG1 1 1 21 12720 1 1 21 THR C C 3.561 -3.099 -3.262 1.00 . A A . 21 THR C 1 1 21 12721 1 1 21 THR CA C 3.375 -4.600 -3.065 1.00 . A A . 21 THR CA 1 1 21 12722 1 1 21 THR CB C 4.375 -5.372 -3.931 1.00 . A A . 21 THR CB 1 1 21 12723 1 1 21 THR CG2 C 5.305 -6.253 -3.125 1.00 . A A . 21 THR CG2 1 1 21 12724 1 1 21 THR H H 1.849 -5.583 -4.155 1.00 . A A . 21 THR H 1 1 21 12725 1 1 21 THR HA H 3.554 -4.838 -2.027 1.00 . A A . 21 THR HA 1 1 21 12726 1 1 21 THR HB H 4.983 -4.667 -4.480 1.00 . A A . 21 THR HB 1 1 21 12727 1 1 21 THR HG1 H 3.287 -6.932 -4.404 1.00 . A A . 21 THR HG1 1 1 21 12728 1 1 21 THR HG21 H 4.735 -6.796 -2.386 1.00 . A A . 21 THR HG21 1 1 21 12729 1 1 21 THR HG22 H 5.799 -6.952 -3.783 1.00 . A A . 21 THR HG22 1 1 21 12730 1 1 21 THR HG23 H 6.043 -5.639 -2.631 1.00 . A A . 21 THR HG23 1 1 21 12731 1 1 21 THR N N 2.009 -5.001 -3.383 1.00 . A A . 21 THR N 1 1 21 12732 1 1 21 THR O O 3.122 -2.535 -4.265 1.00 . A A . 21 THR O 1 1 21 12733 1 1 21 THR OG1 O 3.702 -6.199 -4.865 1.00 . A A . 21 THR OG1 1 1 21 12734 1 1 22 CYS C C 5.925 -0.733 -2.669 1.00 . A A . 22 CYS C 1 1 21 12735 1 1 22 CYS CA C 4.458 -1.021 -2.366 1.00 . A A . 22 CYS CA 1 1 21 12736 1 1 22 CYS CB C 4.056 -0.352 -1.050 1.00 . A A . 22 CYS CB 1 1 21 12737 1 1 22 CYS H H 4.539 -2.962 -1.524 1.00 . A A . 22 CYS H 1 1 21 12738 1 1 22 CYS HA H 3.852 -0.620 -3.164 1.00 . A A . 22 CYS HA 1 1 21 12739 1 1 22 CYS HB2 H 4.222 0.712 -1.131 1.00 . A A . 22 CYS HB2 1 1 21 12740 1 1 22 CYS HB3 H 3.006 -0.534 -0.869 1.00 . A A . 22 CYS HB3 1 1 21 12741 1 1 22 CYS N N 4.214 -2.457 -2.298 1.00 . A A . 22 CYS N 1 1 21 12742 1 1 22 CYS O O 6.251 0.260 -3.319 1.00 . A A . 22 CYS O 1 1 21 12743 1 1 22 CYS SG S 4.982 -0.948 0.401 1.00 . A A . 22 CYS SG 1 1 21 12744 1 1 23 TRP C C 8.946 -2.798 -2.385 1.00 . A A . 23 TRP C 1 1 21 12745 1 1 23 TRP CA C 8.237 -1.448 -2.414 1.00 . A A . 23 TRP CA 1 1 21 12746 1 1 23 TRP CB C 8.837 -0.521 -1.355 1.00 . A A . 23 TRP CB 1 1 21 12747 1 1 23 TRP CD1 C 10.050 1.253 -2.750 1.00 . A A . 23 TRP CD1 1 1 21 12748 1 1 23 TRP CD2 C 11.396 0.037 -1.437 1.00 . A A . 23 TRP CD2 1 1 21 12749 1 1 23 TRP CE2 C 12.181 0.967 -2.145 1.00 . A A . 23 TRP CE2 1 1 21 12750 1 1 23 TRP CE3 C 12.027 -0.838 -0.547 1.00 . A A . 23 TRP CE3 1 1 21 12751 1 1 23 TRP CG C 10.036 0.236 -1.839 1.00 . A A . 23 TRP CG 1 1 21 12752 1 1 23 TRP CH2 C 14.153 0.179 -1.112 1.00 . A A . 23 TRP CH2 1 1 21 12753 1 1 23 TRP CZ2 C 13.562 1.046 -1.990 1.00 . A A . 23 TRP CZ2 1 1 21 12754 1 1 23 TRP CZ3 C 13.398 -0.757 -0.395 1.00 . A A . 23 TRP CZ3 1 1 21 12755 1 1 23 TRP H H 6.483 -2.380 -1.683 1.00 . A A . 23 TRP H 1 1 21 12756 1 1 23 TRP HA H 8.375 -1.003 -3.388 1.00 . A A . 23 TRP HA 1 1 21 12757 1 1 23 TRP HB2 H 8.090 0.197 -1.050 1.00 . A A . 23 TRP HB2 1 1 21 12758 1 1 23 TRP HB3 H 9.135 -1.108 -0.499 1.00 . A A . 23 TRP HB3 1 1 21 12759 1 1 23 TRP HD1 H 9.171 1.640 -3.243 1.00 . A A . 23 TRP HD1 1 1 21 12760 1 1 23 TRP HE1 H 11.605 2.420 -3.545 1.00 . A A . 23 TRP HE1 1 1 21 12761 1 1 23 TRP HE3 H 11.461 -1.566 0.015 1.00 . A A . 23 TRP HE3 1 1 21 12762 1 1 23 TRP HH2 H 15.222 0.205 -0.962 1.00 . A A . 23 TRP HH2 1 1 21 12763 1 1 23 TRP HZ2 H 14.158 1.763 -2.536 1.00 . A A . 23 TRP HZ2 1 1 21 12764 1 1 23 TRP HZ3 H 13.903 -1.425 0.288 1.00 . A A . 23 TRP HZ3 1 1 21 12765 1 1 23 TRP N N 6.805 -1.608 -2.194 1.00 . A A . 23 TRP N 1 1 21 12766 1 1 23 TRP NE1 N 11.337 1.697 -2.940 1.00 . A A . 23 TRP NE1 1 1 21 12767 1 1 23 TRP O O 9.572 -3.162 -1.389 1.00 . A A . 23 TRP O 1 1 21 12768 1 1 24 ARG C C 10.862 -4.738 -4.211 1.00 . A A . 24 ARG C 1 1 21 12769 1 1 24 ARG CA C 9.475 -4.848 -3.586 1.00 . A A . 24 ARG CA 1 1 21 12770 1 1 24 ARG CB C 8.604 -5.795 -4.413 1.00 . A A . 24 ARG CB 1 1 21 12771 1 1 24 ARG CD C 10.075 -7.328 -5.754 1.00 . A A . 24 ARG CD 1 1 21 12772 1 1 24 ARG CG C 9.176 -7.198 -4.536 1.00 . A A . 24 ARG CG 1 1 21 12773 1 1 24 ARG CZ C 10.809 -9.071 -7.333 1.00 . A A . 24 ARG CZ 1 1 21 12774 1 1 24 ARG H H 8.332 -3.194 -4.246 1.00 . A A . 24 ARG H 1 1 21 12775 1 1 24 ARG HA H 9.575 -5.246 -2.587 1.00 . A A . 24 ARG HA 1 1 21 12776 1 1 24 ARG HB2 H 7.630 -5.865 -3.952 1.00 . A A . 24 ARG HB2 1 1 21 12777 1 1 24 ARG HB3 H 8.493 -5.387 -5.407 1.00 . A A . 24 ARG HB3 1 1 21 12778 1 1 24 ARG HD2 H 9.717 -6.660 -6.523 1.00 . A A . 24 ARG HD2 1 1 21 12779 1 1 24 ARG HD3 H 11.081 -7.049 -5.475 1.00 . A A . 24 ARG HD3 1 1 21 12780 1 1 24 ARG HE H 9.535 -9.358 -5.825 1.00 . A A . 24 ARG HE 1 1 21 12781 1 1 24 ARG HG2 H 9.752 -7.420 -3.650 1.00 . A A . 24 ARG HG2 1 1 21 12782 1 1 24 ARG HG3 H 8.361 -7.902 -4.623 1.00 . A A . 24 ARG HG3 1 1 21 12783 1 1 24 ARG HH11 H 11.611 -7.245 -7.669 1.00 . A A . 24 ARG HH11 1 1 21 12784 1 1 24 ARG HH12 H 12.112 -8.488 -8.766 1.00 . A A . 24 ARG HH12 1 1 21 12785 1 1 24 ARG HH21 H 10.192 -10.995 -7.266 1.00 . A A . 24 ARG HH21 1 1 21 12786 1 1 24 ARG HH22 H 11.306 -10.617 -8.538 1.00 . A A . 24 ARG HH22 1 1 21 12787 1 1 24 ARG N N 8.844 -3.538 -3.485 1.00 . A A . 24 ARG N 1 1 21 12788 1 1 24 ARG NE N 10.090 -8.691 -6.280 1.00 . A A . 24 ARG NE 1 1 21 12789 1 1 24 ARG NH1 N 11.573 -8.196 -7.975 1.00 . A A . 24 ARG NH1 1 1 21 12790 1 1 24 ARG NH2 N 10.765 -10.331 -7.746 1.00 . A A . 24 ARG NH2 1 1 21 12791 1 1 24 ARG O O 11.097 -3.898 -5.079 1.00 . A A . 24 ARG O 1 1 21 12792 1 1 25 THR C C 13.673 -7.015 -4.409 1.00 . A A . 25 THR C 1 1 21 12793 1 1 25 THR CA C 13.140 -5.592 -4.280 1.00 . A A . 25 THR CA 1 1 21 12794 1 1 25 THR CB C 14.053 -4.771 -3.366 1.00 . A A . 25 THR CB 1 1 21 12795 1 1 25 THR CG2 C 14.261 -3.351 -3.846 1.00 . A A . 25 THR CG2 1 1 21 12796 1 1 25 THR H H 11.528 -6.239 -3.071 1.00 . A A . 25 THR H 1 1 21 12797 1 1 25 THR HA H 13.124 -5.136 -5.259 1.00 . A A . 25 THR HA 1 1 21 12798 1 1 25 THR HB H 15.021 -5.249 -3.317 1.00 . A A . 25 THR HB 1 1 21 12799 1 1 25 THR HG1 H 13.225 -5.580 -1.785 1.00 . A A . 25 THR HG1 1 1 21 12800 1 1 25 THR HG21 H 14.395 -3.350 -4.918 1.00 . A A . 25 THR HG21 1 1 21 12801 1 1 25 THR HG22 H 13.397 -2.755 -3.591 1.00 . A A . 25 THR HG22 1 1 21 12802 1 1 25 THR HG23 H 15.138 -2.936 -3.373 1.00 . A A . 25 THR HG23 1 1 21 12803 1 1 25 THR N N 11.776 -5.592 -3.764 1.00 . A A . 25 THR N 1 1 21 12804 1 1 25 THR O O 12.947 -7.983 -4.184 1.00 . A A . 25 THR O 1 1 21 12805 1 1 25 THR OG1 O 13.522 -4.707 -2.054 1.00 . A A . 25 THR OG1 1 1 21 12806 1 1 26 SER C C 15.835 -9.090 -3.577 1.00 . A A . 26 SER C 1 1 21 12807 1 1 26 SER CA C 15.576 -8.440 -4.933 1.00 . A A . 26 SER CA 1 1 21 12808 1 1 26 SER CB C 16.890 -8.304 -5.705 1.00 . A A . 26 SER CB 1 1 21 12809 1 1 26 SER H H 15.474 -6.325 -4.938 1.00 . A A . 26 SER H 1 1 21 12810 1 1 26 SER HA H 14.901 -9.066 -5.496 1.00 . A A . 26 SER HA 1 1 21 12811 1 1 26 SER HB2 H 17.706 -8.195 -5.006 1.00 . A A . 26 SER HB2 1 1 21 12812 1 1 26 SER HB3 H 17.045 -9.188 -6.305 1.00 . A A . 26 SER HB3 1 1 21 12813 1 1 26 SER HG H 16.953 -7.456 -7.470 1.00 . A A . 26 SER HG 1 1 21 12814 1 1 26 SER N N 14.946 -7.134 -4.773 1.00 . A A . 26 SER N 1 1 21 12815 1 1 26 SER O O 15.815 -10.315 -3.452 1.00 . A A . 26 SER O 1 1 21 12816 1 1 26 SER OG O 16.866 -7.172 -6.557 1.00 . A A . 26 SER OG 1 1 21 12817 1 1 27 VAL C C 15.149 -8.520 -0.301 1.00 . A A . 27 VAL C 1 1 21 12818 1 1 27 VAL CA C 16.341 -8.760 -1.220 1.00 . A A . 27 VAL CA 1 1 21 12819 1 1 27 VAL CB C 17.587 -8.092 -0.609 1.00 . A A . 27 VAL CB 1 1 21 12820 1 1 27 VAL CG1 C 17.964 -8.764 0.703 1.00 . A A . 27 VAL CG1 1 1 21 12821 1 1 27 VAL CG2 C 18.750 -8.131 -1.590 1.00 . A A . 27 VAL CG2 1 1 21 12822 1 1 27 VAL H H 16.081 -7.297 -2.728 1.00 . A A . 27 VAL H 1 1 21 12823 1 1 27 VAL HA H 16.524 -9.823 -1.287 1.00 . A A . 27 VAL HA 1 1 21 12824 1 1 27 VAL HB H 17.352 -7.058 -0.403 1.00 . A A . 27 VAL HB 1 1 21 12825 1 1 27 VAL HG11 H 17.691 -9.808 0.664 1.00 . A A . 27 VAL HG11 1 1 21 12826 1 1 27 VAL HG12 H 19.029 -8.676 0.859 1.00 . A A . 27 VAL HG12 1 1 21 12827 1 1 27 VAL HG13 H 17.440 -8.284 1.516 1.00 . A A . 27 VAL HG13 1 1 21 12828 1 1 27 VAL HG21 H 18.469 -7.622 -2.500 1.00 . A A . 27 VAL HG21 1 1 21 12829 1 1 27 VAL HG22 H 19.607 -7.641 -1.152 1.00 . A A . 27 VAL HG22 1 1 21 12830 1 1 27 VAL HG23 H 18.998 -9.158 -1.813 1.00 . A A . 27 VAL HG23 1 1 21 12831 1 1 27 VAL N N 16.078 -8.264 -2.566 1.00 . A A . 27 VAL N 1 1 21 12832 1 1 27 VAL O O 14.885 -9.307 0.608 1.00 . A A . 27 VAL O 1 1 21 12833 1 1 28 SER C C 11.975 -7.326 -0.512 1.00 . A A . 28 SER C 1 1 21 12834 1 1 28 SER CA C 13.266 -7.085 0.264 1.00 . A A . 28 SER CA 1 1 21 12835 1 1 28 SER CB C 13.342 -5.624 0.710 1.00 . A A . 28 SER CB 1 1 21 12836 1 1 28 SER H H 14.691 -6.839 -1.282 1.00 . A A . 28 SER H 1 1 21 12837 1 1 28 SER HA H 13.270 -7.719 1.137 1.00 . A A . 28 SER HA 1 1 21 12838 1 1 28 SER HB2 H 14.363 -5.280 0.639 1.00 . A A . 28 SER HB2 1 1 21 12839 1 1 28 SER HB3 H 12.714 -5.020 0.071 1.00 . A A . 28 SER HB3 1 1 21 12840 1 1 28 SER HG H 11.964 -5.662 2.102 1.00 . A A . 28 SER HG 1 1 21 12841 1 1 28 SER N N 14.431 -7.428 -0.543 1.00 . A A . 28 SER N 1 1 21 12842 1 1 28 SER O O 12.000 -7.574 -1.718 1.00 . A A . 28 SER O 1 1 21 12843 1 1 28 SER OG O 12.904 -5.476 2.050 1.00 . A A . 28 SER OG 1 1 21 12844 1 1 29 SER C C 8.419 -7.190 0.556 1.00 . A A . 29 SER C 1 1 21 12845 1 1 29 SER CA C 9.545 -7.461 -0.435 1.00 . A A . 29 SER CA 1 1 21 12846 1 1 29 SER CB C 9.437 -8.889 -0.971 1.00 . A A . 29 SER CB 1 1 21 12847 1 1 29 SER H H 10.892 -7.050 1.145 1.00 . A A . 29 SER H 1 1 21 12848 1 1 29 SER HA H 9.457 -6.769 -1.260 1.00 . A A . 29 SER HA 1 1 21 12849 1 1 29 SER HB2 H 10.423 -9.256 -1.214 1.00 . A A . 29 SER HB2 1 1 21 12850 1 1 29 SER HB3 H 8.994 -9.522 -0.216 1.00 . A A . 29 SER HB3 1 1 21 12851 1 1 29 SER HG H 7.862 -9.487 -1.972 1.00 . A A . 29 SER HG 1 1 21 12852 1 1 29 SER N N 10.847 -7.251 0.187 1.00 . A A . 29 SER N 1 1 21 12853 1 1 29 SER O O 8.078 -8.046 1.373 1.00 . A A . 29 SER O 1 1 21 12854 1 1 29 SER OG O 8.632 -8.938 -2.136 1.00 . A A . 29 SER OG 1 1 21 12855 1 1 30 HIS C C 5.411 -5.693 0.657 1.00 . A A . 30 HIS C 1 1 21 12856 1 1 30 HIS CA C 6.756 -5.610 1.371 1.00 . A A . 30 HIS CA 1 1 21 12857 1 1 30 HIS CB C 6.978 -4.192 1.901 1.00 . A A . 30 HIS CB 1 1 21 12858 1 1 30 HIS CD2 C 9.572 -4.227 1.897 1.00 . A A . 30 HIS CD2 1 1 21 12859 1 1 30 HIS CE1 C 9.907 -3.317 3.863 1.00 . A A . 30 HIS CE1 1 1 21 12860 1 1 30 HIS CG C 8.358 -3.962 2.435 1.00 . A A . 30 HIS CG 1 1 21 12861 1 1 30 HIS H H 8.160 -5.354 -0.192 1.00 . A A . 30 HIS H 1 1 21 12862 1 1 30 HIS HA H 6.751 -6.298 2.203 1.00 . A A . 30 HIS HA 1 1 21 12863 1 1 30 HIS HB2 H 6.810 -3.486 1.101 1.00 . A A . 30 HIS HB2 1 1 21 12864 1 1 30 HIS HB3 H 6.275 -3.999 2.698 1.00 . A A . 30 HIS HB3 1 1 21 12865 1 1 30 HIS HD1 H 7.922 -3.088 4.302 1.00 . A A . 30 HIS HD1 1 1 21 12866 1 1 30 HIS HD2 H 9.762 -4.678 0.933 1.00 . A A . 30 HIS HD2 1 1 21 12867 1 1 30 HIS HE1 H 10.392 -2.916 4.741 1.00 . A A . 30 HIS HE1 1 1 21 12868 1 1 30 HIS HE2 H 11.485 -3.801 2.651 1.00 . A A . 30 HIS HE2 1 1 21 12869 1 1 30 HIS N N 7.844 -5.994 0.480 1.00 . A A . 30 HIS N 1 1 21 12870 1 1 30 HIS ND1 N 8.603 -3.393 3.667 1.00 . A A . 30 HIS ND1 1 1 21 12871 1 1 30 HIS NE2 N 10.517 -3.818 2.805 1.00 . A A . 30 HIS NE2 1 1 21 12872 1 1 30 HIS O O 5.304 -5.371 -0.527 1.00 . A A . 30 HIS O 1 1 21 12873 1 1 31 TYR C C 2.031 -5.480 1.659 1.00 . A A . 31 TYR C 1 1 21 12874 1 1 31 TYR CA C 3.046 -6.250 0.821 1.00 . A A . 31 TYR CA 1 1 21 12875 1 1 31 TYR CB C 2.642 -7.723 0.734 1.00 . A A . 31 TYR CB 1 1 21 12876 1 1 31 TYR CD1 C 2.683 -8.265 -1.731 1.00 . A A . 31 TYR CD1 1 1 21 12877 1 1 31 TYR CD2 C 4.307 -9.298 -0.325 1.00 . A A . 31 TYR CD2 1 1 21 12878 1 1 31 TYR CE1 C 3.210 -8.921 -2.828 1.00 . A A . 31 TYR CE1 1 1 21 12879 1 1 31 TYR CE2 C 4.840 -9.956 -1.417 1.00 . A A . 31 TYR CE2 1 1 21 12880 1 1 31 TYR CG C 3.222 -8.442 -0.463 1.00 . A A . 31 TYR CG 1 1 21 12881 1 1 31 TYR CZ C 4.288 -9.765 -2.665 1.00 . A A . 31 TYR CZ 1 1 21 12882 1 1 31 TYR H H 4.534 -6.366 2.322 1.00 . A A . 31 TYR H 1 1 21 12883 1 1 31 TYR HA H 3.065 -5.832 -0.175 1.00 . A A . 31 TYR HA 1 1 21 12884 1 1 31 TYR HB2 H 2.980 -8.235 1.623 1.00 . A A . 31 TYR HB2 1 1 21 12885 1 1 31 TYR HB3 H 1.565 -7.790 0.674 1.00 . A A . 31 TYR HB3 1 1 21 12886 1 1 31 TYR HD1 H 1.839 -7.603 -1.855 1.00 . A A . 31 TYR HD1 1 1 21 12887 1 1 31 TYR HD2 H 4.737 -9.446 0.655 1.00 . A A . 31 TYR HD2 1 1 21 12888 1 1 31 TYR HE1 H 2.777 -8.770 -3.806 1.00 . A A . 31 TYR HE1 1 1 21 12889 1 1 31 TYR HE2 H 5.684 -10.618 -1.289 1.00 . A A . 31 TYR HE2 1 1 21 12890 1 1 31 TYR HH H 4.806 -11.366 -3.596 1.00 . A A . 31 TYR HH 1 1 21 12891 1 1 31 TYR N N 4.386 -6.126 1.384 1.00 . A A . 31 TYR N 1 1 21 12892 1 1 31 TYR O O 2.249 -5.236 2.845 1.00 . A A . 31 TYR O 1 1 21 12893 1 1 31 TYR OH O 4.815 -10.419 -3.755 1.00 . A A . 31 TYR OH 1 1 21 12894 1 1 32 CYS C C -1.126 -5.306 2.379 1.00 . A A . 32 CYS C 1 1 21 12895 1 1 32 CYS CA C -0.127 -4.358 1.724 1.00 . A A . 32 CYS CA 1 1 21 12896 1 1 32 CYS CB C -0.852 -3.431 0.747 1.00 . A A . 32 CYS CB 1 1 21 12897 1 1 32 CYS H H 0.804 -5.324 0.087 1.00 . A A . 32 CYS H 1 1 21 12898 1 1 32 CYS HA H 0.341 -3.761 2.492 1.00 . A A . 32 CYS HA 1 1 21 12899 1 1 32 CYS HB2 H -0.147 -3.070 0.014 1.00 . A A . 32 CYS HB2 1 1 21 12900 1 1 32 CYS HB3 H -1.631 -3.987 0.246 1.00 . A A . 32 CYS HB3 1 1 21 12901 1 1 32 CYS N N 0.921 -5.100 1.034 1.00 . A A . 32 CYS N 1 1 21 12902 1 1 32 CYS O O -1.155 -6.499 2.076 1.00 . A A . 32 CYS O 1 1 21 12903 1 1 32 CYS SG S -1.623 -1.980 1.533 1.00 . A A . 32 CYS SG 1 1 21 12904 1 1 33 THR C C -4.357 -5.218 3.508 1.00 . A A . 33 THR C 1 1 21 12905 1 1 33 THR CA C -2.944 -5.564 3.977 1.00 . A A . 33 THR CA 1 1 21 12906 1 1 33 THR CB C -2.830 -5.345 5.486 1.00 . A A . 33 THR CB 1 1 21 12907 1 1 33 THR CG2 C -2.735 -3.884 5.870 1.00 . A A . 33 THR CG2 1 1 21 12908 1 1 33 THR H H -1.870 -3.810 3.476 1.00 . A A . 33 THR H 1 1 21 12909 1 1 33 THR HA H -2.751 -6.604 3.759 1.00 . A A . 33 THR HA 1 1 21 12910 1 1 33 THR HB H -1.939 -5.840 5.845 1.00 . A A . 33 THR HB 1 1 21 12911 1 1 33 THR HG1 H -4.729 -5.371 5.968 1.00 . A A . 33 THR HG1 1 1 21 12912 1 1 33 THR HG21 H -3.326 -3.293 5.186 1.00 . A A . 33 THR HG21 1 1 21 12913 1 1 33 THR HG22 H -3.107 -3.751 6.875 1.00 . A A . 33 THR HG22 1 1 21 12914 1 1 33 THR HG23 H -1.704 -3.566 5.823 1.00 . A A . 33 THR HG23 1 1 21 12915 1 1 33 THR N N -1.942 -4.767 3.278 1.00 . A A . 33 THR N 1 1 21 12916 1 1 33 THR O O -5.340 -5.676 4.089 1.00 . A A . 33 THR O 1 1 21 12917 1 1 33 THR OG1 O -3.948 -5.896 6.159 1.00 . A A . 33 THR OG1 1 1 21 12918 1 1 34 GLY C C -6.656 -3.419 2.995 1.00 . A A . 34 GLY C 1 1 21 12919 1 1 34 GLY CA C -5.754 -4.022 1.934 1.00 . A A . 34 GLY CA 1 1 21 12920 1 1 34 GLY H H -3.640 -4.072 2.027 1.00 . A A . 34 GLY H 1 1 21 12921 1 1 34 GLY HA2 H -6.238 -4.895 1.521 1.00 . A A . 34 GLY HA2 1 1 21 12922 1 1 34 GLY HA3 H -5.612 -3.297 1.146 1.00 . A A . 34 GLY HA3 1 1 21 12923 1 1 34 GLY N N -4.455 -4.409 2.455 1.00 . A A . 34 GLY N 1 1 21 12924 1 1 34 GLY O O -7.880 -3.458 2.873 1.00 . A A . 34 GLY O 1 1 21 12925 1 1 35 ARG C C -6.604 -0.738 5.146 1.00 . A A . 35 ARG C 1 1 21 12926 1 1 35 ARG CA C -6.810 -2.249 5.125 1.00 . A A . 35 ARG CA 1 1 21 12927 1 1 35 ARG CB C -6.395 -2.851 6.469 1.00 . A A . 35 ARG CB 1 1 21 12928 1 1 35 ARG CD C -7.205 -3.598 8.727 1.00 . A A . 35 ARG CD 1 1 21 12929 1 1 35 ARG CG C -7.413 -2.629 7.575 1.00 . A A . 35 ARG CG 1 1 21 12930 1 1 35 ARG CZ C -5.545 -2.401 10.099 1.00 . A A . 35 ARG CZ 1 1 21 12931 1 1 35 ARG H H -5.072 -2.861 4.082 1.00 . A A . 35 ARG H 1 1 21 12932 1 1 35 ARG HA H -7.855 -2.455 4.956 1.00 . A A . 35 ARG HA 1 1 21 12933 1 1 35 ARG HB2 H -6.255 -3.915 6.346 1.00 . A A . 35 ARG HB2 1 1 21 12934 1 1 35 ARG HB3 H -5.460 -2.407 6.776 1.00 . A A . 35 ARG HB3 1 1 21 12935 1 1 35 ARG HD2 H -7.965 -3.420 9.473 1.00 . A A . 35 ARG HD2 1 1 21 12936 1 1 35 ARG HD3 H -7.299 -4.607 8.353 1.00 . A A . 35 ARG HD3 1 1 21 12937 1 1 35 ARG HE H -5.229 -4.147 9.186 1.00 . A A . 35 ARG HE 1 1 21 12938 1 1 35 ARG HG2 H -7.314 -1.619 7.945 1.00 . A A . 35 ARG HG2 1 1 21 12939 1 1 35 ARG HG3 H -8.405 -2.771 7.171 1.00 . A A . 35 ARG HG3 1 1 21 12940 1 1 35 ARG HH11 H -7.333 -1.468 9.943 1.00 . A A . 35 ARG HH11 1 1 21 12941 1 1 35 ARG HH12 H -6.148 -0.647 10.902 1.00 . A A . 35 ARG HH12 1 1 21 12942 1 1 35 ARG HH21 H -3.670 -3.069 10.448 1.00 . A A . 35 ARG HH21 1 1 21 12943 1 1 35 ARG HH22 H -4.069 -1.555 11.189 1.00 . A A . 35 ARG HH22 1 1 21 12944 1 1 35 ARG N N -6.051 -2.862 4.040 1.00 . A A . 35 ARG N 1 1 21 12945 1 1 35 ARG NE N -5.890 -3.441 9.344 1.00 . A A . 35 ARG NE 1 1 21 12946 1 1 35 ARG NH1 N -6.414 -1.425 10.334 1.00 . A A . 35 ARG NH1 1 1 21 12947 1 1 35 ARG NH2 N -4.328 -2.336 10.622 1.00 . A A . 35 ARG NH2 1 1 21 12948 1 1 35 ARG O O -7.525 0.020 5.449 1.00 . A A . 35 ARG O 1 1 21 12949 1 1 36 SER C C -4.401 1.492 3.478 1.00 . A A . 36 SER C 1 1 21 12950 1 1 36 SER CA C -5.059 1.110 4.799 1.00 . A A . 36 SER CA 1 1 21 12951 1 1 36 SER CB C -4.131 1.457 5.964 1.00 . A A . 36 SER CB 1 1 21 12952 1 1 36 SER H H -4.700 -0.964 4.587 1.00 . A A . 36 SER H 1 1 21 12953 1 1 36 SER HA H -5.978 1.668 4.904 1.00 . A A . 36 SER HA 1 1 21 12954 1 1 36 SER HB2 H -3.534 0.593 6.215 1.00 . A A . 36 SER HB2 1 1 21 12955 1 1 36 SER HB3 H -3.482 2.271 5.674 1.00 . A A . 36 SER HB3 1 1 21 12956 1 1 36 SER HG H -4.794 2.796 7.230 1.00 . A A . 36 SER HG 1 1 21 12957 1 1 36 SER N N -5.390 -0.310 4.820 1.00 . A A . 36 SER N 1 1 21 12958 1 1 36 SER O O -4.092 0.630 2.655 1.00 . A A . 36 SER O 1 1 21 12959 1 1 36 SER OG O -4.871 1.847 7.108 1.00 . A A . 36 SER OG 1 1 21 12960 1 1 37 CYS C C -2.167 3.825 2.340 1.00 . A A . 37 CYS C 1 1 21 12961 1 1 37 CYS CA C -3.565 3.281 2.058 1.00 . A A . 37 CYS CA 1 1 21 12962 1 1 37 CYS CB C -4.433 4.367 1.421 1.00 . A A . 37 CYS CB 1 1 21 12963 1 1 37 CYS H H -4.455 3.429 3.973 1.00 . A A . 37 CYS H 1 1 21 12964 1 1 37 CYS HA H -3.482 2.452 1.372 1.00 . A A . 37 CYS HA 1 1 21 12965 1 1 37 CYS HB2 H -4.799 5.025 2.195 1.00 . A A . 37 CYS HB2 1 1 21 12966 1 1 37 CYS HB3 H -3.833 4.935 0.727 1.00 . A A . 37 CYS HB3 1 1 21 12967 1 1 37 CYS N N -4.189 2.789 3.280 1.00 . A A . 37 CYS N 1 1 21 12968 1 1 37 CYS O O -1.640 4.635 1.577 1.00 . A A . 37 CYS O 1 1 21 12969 1 1 37 CYS SG S -5.876 3.721 0.514 1.00 . A A . 37 CYS SG 1 1 21 12970 1 1 38 GLU C C 0.650 2.611 4.156 1.00 . A A . 38 GLU C 1 1 21 12971 1 1 38 GLU CA C -0.233 3.808 3.820 1.00 . A A . 38 GLU CA 1 1 21 12972 1 1 38 GLU CB C -0.306 4.757 5.018 1.00 . A A . 38 GLU CB 1 1 21 12973 1 1 38 GLU CD C 0.830 6.795 4.049 1.00 . A A . 38 GLU CD 1 1 21 12974 1 1 38 GLU CG C -0.448 6.219 4.628 1.00 . A A . 38 GLU CG 1 1 21 12975 1 1 38 GLU H H -2.041 2.726 4.006 1.00 . A A . 38 GLU H 1 1 21 12976 1 1 38 GLU HA H 0.196 4.334 2.980 1.00 . A A . 38 GLU HA 1 1 21 12977 1 1 38 GLU HB2 H -1.155 4.485 5.627 1.00 . A A . 38 GLU HB2 1 1 21 12978 1 1 38 GLU HB3 H 0.596 4.649 5.603 1.00 . A A . 38 GLU HB3 1 1 21 12979 1 1 38 GLU HG2 H -1.230 6.307 3.889 1.00 . A A . 38 GLU HG2 1 1 21 12980 1 1 38 GLU HG3 H -0.717 6.788 5.506 1.00 . A A . 38 GLU HG3 1 1 21 12981 1 1 38 GLU N N -1.571 3.372 3.438 1.00 . A A . 38 GLU N 1 1 21 12982 1 1 38 GLU O O 0.675 2.147 5.296 1.00 . A A . 38 GLU O 1 1 21 12983 1 1 38 GLU OE1 O 0.770 7.391 2.953 1.00 . A A . 38 GLU OE1 1 1 21 12984 1 1 38 GLU OE2 O 1.891 6.651 4.693 1.00 . A A . 38 GLU OE2 1 1 21 12985 1 1 39 CYS C C 3.222 1.201 4.504 1.00 . A A . 39 CYS C 1 1 21 12986 1 1 39 CYS CA C 2.256 0.968 3.341 1.00 . A A . 39 CYS CA 1 1 21 12987 1 1 39 CYS CB C 3.044 0.696 2.058 1.00 . A A . 39 CYS CB 1 1 21 12988 1 1 39 CYS H H 1.306 2.527 2.270 1.00 . A A . 39 CYS H 1 1 21 12989 1 1 39 CYS HA H 1.641 0.109 3.562 1.00 . A A . 39 CYS HA 1 1 21 12990 1 1 39 CYS HB2 H 2.427 0.943 1.207 1.00 . A A . 39 CYS HB2 1 1 21 12991 1 1 39 CYS HB3 H 3.927 1.318 2.049 1.00 . A A . 39 CYS HB3 1 1 21 12992 1 1 39 CYS N N 1.371 2.114 3.156 1.00 . A A . 39 CYS N 1 1 21 12993 1 1 39 CYS O O 4.155 1.997 4.392 1.00 . A A . 39 CYS O 1 1 21 12994 1 1 39 CYS SG S 3.581 -1.035 1.868 1.00 . A A . 39 CYS SG 1 1 21 12995 1 1 40 PRO C C 5.266 0.062 6.591 1.00 . A A . 40 PRO C 1 1 21 12996 1 1 40 PRO CA C 3.877 0.649 6.817 1.00 . A A . 40 PRO CA 1 1 21 12997 1 1 40 PRO CB C 3.135 -0.137 7.899 1.00 . A A . 40 PRO CB 1 1 21 12998 1 1 40 PRO CD C 1.928 -0.466 5.864 1.00 . A A . 40 PRO CD 1 1 21 12999 1 1 40 PRO CG C 2.321 -1.135 7.152 1.00 . A A . 40 PRO CG 1 1 21 13000 1 1 40 PRO HA H 3.969 1.682 7.117 1.00 . A A . 40 PRO HA 1 1 21 13001 1 1 40 PRO HB2 H 3.848 -0.617 8.553 1.00 . A A . 40 PRO HB2 1 1 21 13002 1 1 40 PRO HB3 H 2.509 0.533 8.470 1.00 . A A . 40 PRO HB3 1 1 21 13003 1 1 40 PRO HD2 H 1.885 -1.188 5.062 1.00 . A A . 40 PRO HD2 1 1 21 13004 1 1 40 PRO HD3 H 0.979 0.036 5.974 1.00 . A A . 40 PRO HD3 1 1 21 13005 1 1 40 PRO HG2 H 2.913 -2.016 6.951 1.00 . A A . 40 PRO HG2 1 1 21 13006 1 1 40 PRO HG3 H 1.442 -1.394 7.722 1.00 . A A . 40 PRO HG3 1 1 21 13007 1 1 40 PRO N N 3.015 0.507 5.639 1.00 . A A . 40 PRO N 1 1 21 13008 1 1 40 PRO O O 5.550 -0.499 5.532 1.00 . A A . 40 PRO O 1 1 21 13009 1 1 41 SER C C 7.580 -1.720 8.113 1.00 . A A . 41 SER C 1 1 21 13010 1 1 41 SER CA C 7.489 -0.324 7.505 1.00 . A A . 41 SER CA 1 1 21 13011 1 1 41 SER CB C 8.463 0.621 8.213 1.00 . A A . 41 SER CB 1 1 21 13012 1 1 41 SER H H 5.843 0.651 8.412 1.00 . A A . 41 SER H 1 1 21 13013 1 1 41 SER HA H 7.754 -0.381 6.459 1.00 . A A . 41 SER HA 1 1 21 13014 1 1 41 SER HB2 H 9.476 0.347 7.959 1.00 . A A . 41 SER HB2 1 1 21 13015 1 1 41 SER HB3 H 8.273 1.635 7.894 1.00 . A A . 41 SER HB3 1 1 21 13016 1 1 41 SER HG H 7.383 0.644 9.848 1.00 . A A . 41 SER HG 1 1 21 13017 1 1 41 SER N N 6.129 0.194 7.593 1.00 . A A . 41 SER N 1 1 21 13018 1 1 41 SER O O 8.489 -2.014 8.889 1.00 . A A . 41 SER O 1 1 21 13019 1 1 41 SER OG O 8.311 0.549 9.620 1.00 . A A . 41 SER OG 1 1 21 13020 1 1 42 TYR C C 6.842 -4.950 7.139 1.00 . A A . 42 TYR C 1 1 21 13021 1 1 42 TYR CA C 6.602 -3.945 8.263 1.00 . A A . 42 TYR CA 1 1 21 13022 1 1 42 TYR CB C 5.261 -4.231 8.940 1.00 . A A . 42 TYR CB 1 1 21 13023 1 1 42 TYR CD1 C 5.787 -2.803 10.955 1.00 . A A . 42 TYR CD1 1 1 21 13024 1 1 42 TYR CD2 C 3.609 -2.642 9.999 1.00 . A A . 42 TYR CD2 1 1 21 13025 1 1 42 TYR CE1 C 5.441 -1.867 11.911 1.00 . A A . 42 TYR CE1 1 1 21 13026 1 1 42 TYR CE2 C 3.256 -1.705 10.952 1.00 . A A . 42 TYR CE2 1 1 21 13027 1 1 42 TYR CG C 4.878 -3.206 9.984 1.00 . A A . 42 TYR CG 1 1 21 13028 1 1 42 TYR CZ C 4.175 -1.321 11.905 1.00 . A A . 42 TYR CZ 1 1 21 13029 1 1 42 TYR H H 5.932 -2.286 7.131 1.00 . A A . 42 TYR H 1 1 21 13030 1 1 42 TYR HA H 7.392 -4.043 8.993 1.00 . A A . 42 TYR HA 1 1 21 13031 1 1 42 TYR HB2 H 4.483 -4.246 8.191 1.00 . A A . 42 TYR HB2 1 1 21 13032 1 1 42 TYR HB3 H 5.308 -5.196 9.423 1.00 . A A . 42 TYR HB3 1 1 21 13033 1 1 42 TYR HD1 H 6.778 -3.232 10.957 1.00 . A A . 42 TYR HD1 1 1 21 13034 1 1 42 TYR HD2 H 2.891 -2.945 9.252 1.00 . A A . 42 TYR HD2 1 1 21 13035 1 1 42 TYR HE1 H 6.161 -1.567 12.658 1.00 . A A . 42 TYR HE1 1 1 21 13036 1 1 42 TYR HE2 H 2.264 -1.278 10.947 1.00 . A A . 42 TYR HE2 1 1 21 13037 1 1 42 TYR HH H 3.243 -0.793 13.502 1.00 . A A . 42 TYR HH 1 1 21 13038 1 1 42 TYR N N 6.631 -2.579 7.754 1.00 . A A . 42 TYR N 1 1 21 13039 1 1 42 TYR O O 5.897 -5.434 6.516 1.00 . A A . 42 TYR O 1 1 21 13040 1 1 42 TYR OH O 3.827 -0.389 12.855 1.00 . A A . 42 TYR OH 1 1 21 13041 1 1 43 PRO C C 7.717 -7.550 5.936 1.00 . A A . 43 PRO C 1 1 21 13042 1 1 43 PRO CA C 8.476 -6.233 5.810 1.00 . A A . 43 PRO CA 1 1 21 13043 1 1 43 PRO CB C 9.974 -6.457 6.027 1.00 . A A . 43 PRO CB 1 1 21 13044 1 1 43 PRO CD C 9.305 -4.750 7.560 1.00 . A A . 43 PRO CD 1 1 21 13045 1 1 43 PRO CG C 10.448 -5.217 6.702 1.00 . A A . 43 PRO CG 1 1 21 13046 1 1 43 PRO HA H 8.310 -5.817 4.827 1.00 . A A . 43 PRO HA 1 1 21 13047 1 1 43 PRO HB2 H 10.125 -7.328 6.647 1.00 . A A . 43 PRO HB2 1 1 21 13048 1 1 43 PRO HB3 H 10.462 -6.597 5.074 1.00 . A A . 43 PRO HB3 1 1 21 13049 1 1 43 PRO HD2 H 9.386 -5.164 8.555 1.00 . A A . 43 PRO HD2 1 1 21 13050 1 1 43 PRO HD3 H 9.279 -3.671 7.600 1.00 . A A . 43 PRO HD3 1 1 21 13051 1 1 43 PRO HG2 H 11.310 -5.439 7.314 1.00 . A A . 43 PRO HG2 1 1 21 13052 1 1 43 PRO HG3 H 10.693 -4.468 5.965 1.00 . A A . 43 PRO HG3 1 1 21 13053 1 1 43 PRO N N 8.117 -5.280 6.865 1.00 . A A . 43 PRO N 1 1 21 13054 1 1 43 PRO O O 7.654 -8.141 7.015 1.00 . A A . 43 PRO O 1 1 21 13055 1 1 44 GLY C C 5.035 -9.104 5.487 1.00 . A A . 44 GLY C 1 1 21 13056 1 1 44 GLY CA C 6.396 -9.249 4.836 1.00 . A A . 44 GLY CA 1 1 21 13057 1 1 44 GLY H H 7.227 -7.492 3.997 1.00 . A A . 44 GLY H 1 1 21 13058 1 1 44 GLY HA2 H 6.963 -9.993 5.376 1.00 . A A . 44 GLY HA2 1 1 21 13059 1 1 44 GLY HA3 H 6.263 -9.583 3.818 1.00 . A A . 44 GLY HA3 1 1 21 13060 1 1 44 GLY N N 7.143 -8.005 4.828 1.00 . A A . 44 GLY N 1 1 21 13061 1 1 44 GLY O O 4.306 -10.115 5.571 1.00 . A A . 44 GLY O 1 1 21 13062 1 1 44 GLY OXT O 4.697 -7.980 5.912 1.00 . A A . 44 GLY OXT 1 1 22 13063 1 1 1 ALA C C -15.704 14.358 2.159 1.00 . A A . 1 ALA C 1 1 22 13064 1 1 1 ALA CA C -16.124 15.453 3.135 1.00 . A A . 1 ALA CA 1 1 22 13065 1 1 1 ALA CB C -15.228 15.434 4.364 1.00 . A A . 1 ALA CB 1 1 22 13066 1 1 1 ALA H1 H -17.662 14.343 3.929 1.00 . A A . 1 ALA H1 1 1 22 13067 1 1 1 ALA H2 H -17.759 16.027 4.242 1.00 . A A . 1 ALA H2 1 1 22 13068 1 1 1 ALA H3 H -18.129 15.419 2.680 1.00 . A A . 1 ALA H3 1 1 22 13069 1 1 1 ALA HA H -16.009 16.412 2.652 1.00 . A A . 1 ALA HA 1 1 22 13070 1 1 1 ALA HB1 H -15.400 16.326 4.948 1.00 . A A . 1 ALA HB1 1 1 22 13071 1 1 1 ALA HB2 H -15.455 14.564 4.962 1.00 . A A . 1 ALA HB2 1 1 22 13072 1 1 1 ALA HB3 H -14.194 15.399 4.056 1.00 . A A . 1 ALA HB3 1 1 22 13073 1 1 1 ALA N N -17.547 15.296 3.532 1.00 . A A . 1 ALA N 1 1 22 13074 1 1 1 ALA O O -16.299 13.281 2.126 1.00 . A A . 1 ALA O 1 1 22 13075 1 1 2 MET C C -12.863 13.063 0.856 1.00 . A A . 2 MET C 1 1 22 13076 1 1 2 MET CA C -14.177 13.681 0.390 1.00 . A A . 2 MET CA 1 1 22 13077 1 1 2 MET CB C -13.982 14.357 -0.969 1.00 . A A . 2 MET CB 1 1 22 13078 1 1 2 MET CE C -15.402 15.243 -3.939 1.00 . A A . 2 MET CE 1 1 22 13079 1 1 2 MET CG C -14.282 13.448 -2.149 1.00 . A A . 2 MET CG 1 1 22 13080 1 1 2 MET H H -14.243 15.517 1.440 1.00 . A A . 2 MET H 1 1 22 13081 1 1 2 MET HA H -14.913 12.897 0.289 1.00 . A A . 2 MET HA 1 1 22 13082 1 1 2 MET HB2 H -14.635 15.215 -1.028 1.00 . A A . 2 MET HB2 1 1 22 13083 1 1 2 MET HB3 H -12.957 14.689 -1.049 1.00 . A A . 2 MET HB3 1 1 22 13084 1 1 2 MET HE1 H -16.104 15.023 -3.148 1.00 . A A . 2 MET HE1 1 1 22 13085 1 1 2 MET HE2 H -15.129 16.287 -3.896 1.00 . A A . 2 MET HE2 1 1 22 13086 1 1 2 MET HE3 H -15.857 15.029 -4.894 1.00 . A A . 2 MET HE3 1 1 22 13087 1 1 2 MET HG2 H -13.674 12.559 -2.065 1.00 . A A . 2 MET HG2 1 1 22 13088 1 1 2 MET HG3 H -15.326 13.173 -2.119 1.00 . A A . 2 MET HG3 1 1 22 13089 1 1 2 MET N N -14.676 14.642 1.366 1.00 . A A . 2 MET N 1 1 22 13090 1 1 2 MET O O -11.784 13.491 0.446 1.00 . A A . 2 MET O 1 1 22 13091 1 1 2 MET SD S -13.937 14.233 -3.735 1.00 . A A . 2 MET SD 1 1 22 13092 1 1 3 ASP C C -11.155 10.478 1.180 1.00 . A A . 3 ASP C 1 1 22 13093 1 1 3 ASP CA C -11.780 11.379 2.240 1.00 . A A . 3 ASP CA 1 1 22 13094 1 1 3 ASP CB C -12.144 10.555 3.476 1.00 . A A . 3 ASP CB 1 1 22 13095 1 1 3 ASP CG C -12.246 11.404 4.728 1.00 . A A . 3 ASP CG 1 1 22 13096 1 1 3 ASP H H -13.849 11.760 2.008 1.00 . A A . 3 ASP H 1 1 22 13097 1 1 3 ASP HA H -11.063 12.135 2.522 1.00 . A A . 3 ASP HA 1 1 22 13098 1 1 3 ASP HB2 H -13.097 10.073 3.312 1.00 . A A . 3 ASP HB2 1 1 22 13099 1 1 3 ASP HB3 H -11.387 9.801 3.635 1.00 . A A . 3 ASP HB3 1 1 22 13100 1 1 3 ASP N N -12.961 12.056 1.717 1.00 . A A . 3 ASP N 1 1 22 13101 1 1 3 ASP O O -11.857 9.761 0.468 1.00 . A A . 3 ASP O 1 1 22 13102 1 1 3 ASP OD1 O -13.329 11.415 5.351 1.00 . A A . 3 ASP OD1 1 1 22 13103 1 1 3 ASP OD2 O -11.243 12.057 5.086 1.00 . A A . 3 ASP OD2 1 1 22 13104 1 1 4 CYS C C -7.690 9.421 0.584 1.00 . A A . 4 CYS C 1 1 22 13105 1 1 4 CYS CA C -9.110 9.708 0.108 1.00 . A A . 4 CYS CA 1 1 22 13106 1 1 4 CYS CB C -9.071 10.414 -1.248 1.00 . A A . 4 CYS CB 1 1 22 13107 1 1 4 CYS H H -9.325 11.113 1.677 1.00 . A A . 4 CYS H 1 1 22 13108 1 1 4 CYS HA H -9.638 8.772 0.002 1.00 . A A . 4 CYS HA 1 1 22 13109 1 1 4 CYS HB2 H -8.761 11.438 -1.104 1.00 . A A . 4 CYS HB2 1 1 22 13110 1 1 4 CYS HB3 H -8.356 9.913 -1.885 1.00 . A A . 4 CYS HB3 1 1 22 13111 1 1 4 CYS N N -9.830 10.521 1.081 1.00 . A A . 4 CYS N 1 1 22 13112 1 1 4 CYS O O -7.295 9.828 1.676 1.00 . A A . 4 CYS O 1 1 22 13113 1 1 4 CYS SG S -10.669 10.438 -2.121 1.00 . A A . 4 CYS SG 1 1 22 13114 1 1 5 THR C C -4.654 8.467 -1.144 1.00 . A A . 5 THR C 1 1 22 13115 1 1 5 THR CA C -5.548 8.376 0.088 1.00 . A A . 5 THR CA 1 1 22 13116 1 1 5 THR CB C -5.479 6.968 0.680 1.00 . A A . 5 THR CB 1 1 22 13117 1 1 5 THR CG2 C -5.824 6.921 2.153 1.00 . A A . 5 THR CG2 1 1 22 13118 1 1 5 THR H H -7.297 8.422 -1.103 1.00 . A A . 5 THR H 1 1 22 13119 1 1 5 THR HA H -5.200 9.084 0.824 1.00 . A A . 5 THR HA 1 1 22 13120 1 1 5 THR HB H -4.475 6.588 0.563 1.00 . A A . 5 THR HB 1 1 22 13121 1 1 5 THR HG1 H -6.134 5.185 0.202 1.00 . A A . 5 THR HG1 1 1 22 13122 1 1 5 THR HG21 H -5.861 7.926 2.547 1.00 . A A . 5 THR HG21 1 1 22 13123 1 1 5 THR HG22 H -6.786 6.448 2.283 1.00 . A A . 5 THR HG22 1 1 22 13124 1 1 5 THR HG23 H -5.070 6.355 2.681 1.00 . A A . 5 THR HG23 1 1 22 13125 1 1 5 THR N N -6.926 8.718 -0.245 1.00 . A A . 5 THR N 1 1 22 13126 1 1 5 THR O O -4.792 7.683 -2.083 1.00 . A A . 5 THR O 1 1 22 13127 1 1 5 THR OG1 O -6.366 6.095 0.004 1.00 . A A . 5 THR OG1 1 1 22 13128 1 1 6 THR C C -1.446 9.042 -1.932 1.00 . A A . 6 THR C 1 1 22 13129 1 1 6 THR CA C -2.820 9.622 -2.251 1.00 . A A . 6 THR CA 1 1 22 13130 1 1 6 THR CB C -2.695 11.109 -2.585 1.00 . A A . 6 THR CB 1 1 22 13131 1 1 6 THR CG2 C -3.799 11.613 -3.489 1.00 . A A . 6 THR CG2 1 1 22 13132 1 1 6 THR H H -3.675 10.023 -0.357 1.00 . A A . 6 THR H 1 1 22 13133 1 1 6 THR HA H -3.226 9.103 -3.106 1.00 . A A . 6 THR HA 1 1 22 13134 1 1 6 THR HB H -1.753 11.277 -3.088 1.00 . A A . 6 THR HB 1 1 22 13135 1 1 6 THR HG1 H -2.018 12.551 -1.445 1.00 . A A . 6 THR HG1 1 1 22 13136 1 1 6 THR HG21 H -4.469 10.800 -3.728 1.00 . A A . 6 THR HG21 1 1 22 13137 1 1 6 THR HG22 H -4.347 12.396 -2.986 1.00 . A A . 6 THR HG22 1 1 22 13138 1 1 6 THR HG23 H -3.369 12.004 -4.400 1.00 . A A . 6 THR HG23 1 1 22 13139 1 1 6 THR N N -3.737 9.429 -1.134 1.00 . A A . 6 THR N 1 1 22 13140 1 1 6 THR O O -0.706 9.587 -1.112 1.00 . A A . 6 THR O 1 1 22 13141 1 1 6 THR OG1 O -2.715 11.892 -1.405 1.00 . A A . 6 THR OG1 1 1 22 13142 1 1 7 GLY C C 0.339 6.023 -3.166 1.00 . A A . 7 GLY C 1 1 22 13143 1 1 7 GLY CA C 0.168 7.293 -2.352 1.00 . A A . 7 GLY CA 1 1 22 13144 1 1 7 GLY H H -1.745 7.542 -3.221 1.00 . A A . 7 GLY H 1 1 22 13145 1 1 7 GLY HA2 H 0.254 7.049 -1.304 1.00 . A A . 7 GLY HA2 1 1 22 13146 1 1 7 GLY HA3 H 0.955 7.984 -2.616 1.00 . A A . 7 GLY HA3 1 1 22 13147 1 1 7 GLY N N -1.113 7.932 -2.582 1.00 . A A . 7 GLY N 1 1 22 13148 1 1 7 GLY O O -0.319 5.849 -4.192 1.00 . A A . 7 GLY O 1 1 22 13149 1 1 8 PRO C C 0.471 2.765 -3.087 1.00 . A A . 8 PRO C 1 1 22 13150 1 1 8 PRO CA C 1.480 3.856 -3.438 1.00 . A A . 8 PRO CA 1 1 22 13151 1 1 8 PRO CB C 2.871 3.473 -2.944 1.00 . A A . 8 PRO CB 1 1 22 13152 1 1 8 PRO CD C 2.063 5.239 -1.523 1.00 . A A . 8 PRO CD 1 1 22 13153 1 1 8 PRO CG C 2.934 4.006 -1.552 1.00 . A A . 8 PRO CG 1 1 22 13154 1 1 8 PRO HA H 1.500 3.998 -4.508 1.00 . A A . 8 PRO HA 1 1 22 13155 1 1 8 PRO HB2 H 2.981 2.399 -2.964 1.00 . A A . 8 PRO HB2 1 1 22 13156 1 1 8 PRO HB3 H 3.620 3.930 -3.574 1.00 . A A . 8 PRO HB3 1 1 22 13157 1 1 8 PRO HD2 H 1.452 5.247 -0.633 1.00 . A A . 8 PRO HD2 1 1 22 13158 1 1 8 PRO HD3 H 2.673 6.130 -1.569 1.00 . A A . 8 PRO HD3 1 1 22 13159 1 1 8 PRO HG2 H 2.556 3.267 -0.861 1.00 . A A . 8 PRO HG2 1 1 22 13160 1 1 8 PRO HG3 H 3.953 4.263 -1.305 1.00 . A A . 8 PRO HG3 1 1 22 13161 1 1 8 PRO N N 1.227 5.112 -2.733 1.00 . A A . 8 PRO N 1 1 22 13162 1 1 8 PRO O O -0.011 2.048 -3.963 1.00 . A A . 8 PRO O 1 1 22 13163 1 1 9 CYS C C -2.202 2.188 -1.259 1.00 . A A . 9 CYS C 1 1 22 13164 1 1 9 CYS CA C -0.782 1.628 -1.336 1.00 . A A . 9 CYS CA 1 1 22 13165 1 1 9 CYS CB C -0.349 1.092 0.032 1.00 . A A . 9 CYS CB 1 1 22 13166 1 1 9 CYS H H 0.583 3.236 -1.146 1.00 . A A . 9 CYS H 1 1 22 13167 1 1 9 CYS HA H -0.770 0.816 -2.047 1.00 . A A . 9 CYS HA 1 1 22 13168 1 1 9 CYS HB2 H 0.427 1.729 0.430 1.00 . A A . 9 CYS HB2 1 1 22 13169 1 1 9 CYS HB3 H -1.194 1.104 0.704 1.00 . A A . 9 CYS HB3 1 1 22 13170 1 1 9 CYS N N 0.162 2.640 -1.800 1.00 . A A . 9 CYS N 1 1 22 13171 1 1 9 CYS O O -2.913 1.978 -0.276 1.00 . A A . 9 CYS O 1 1 22 13172 1 1 9 CYS SG S 0.302 -0.609 -0.009 1.00 . A A . 9 CYS SG 1 1 22 13173 1 1 10 CYS C C -4.259 4.023 -3.743 1.00 . A A . 10 CYS C 1 1 22 13174 1 1 10 CYS CA C -3.950 3.476 -2.354 1.00 . A A . 10 CYS CA 1 1 22 13175 1 1 10 CYS CB C -4.093 4.582 -1.307 1.00 . A A . 10 CYS CB 1 1 22 13176 1 1 10 CYS H H -2.008 3.024 -3.063 1.00 . A A . 10 CYS H 1 1 22 13177 1 1 10 CYS HA H -4.657 2.693 -2.131 1.00 . A A . 10 CYS HA 1 1 22 13178 1 1 10 CYS HB2 H -5.005 5.129 -1.495 1.00 . A A . 10 CYS HB2 1 1 22 13179 1 1 10 CYS HB3 H -4.146 4.132 -0.326 1.00 . A A . 10 CYS HB3 1 1 22 13180 1 1 10 CYS N N -2.614 2.895 -2.305 1.00 . A A . 10 CYS N 1 1 22 13181 1 1 10 CYS O O -3.561 4.903 -4.247 1.00 . A A . 10 CYS O 1 1 22 13182 1 1 10 CYS SG S -2.723 5.782 -1.295 1.00 . A A . 10 CYS SG 1 1 22 13183 1 1 11 ARG C C -6.038 5.410 -5.711 1.00 . A A . 11 ARG C 1 1 22 13184 1 1 11 ARG CA C -5.726 3.915 -5.686 1.00 . A A . 11 ARG CA 1 1 22 13185 1 1 11 ARG CB C -6.949 3.112 -6.137 1.00 . A A . 11 ARG CB 1 1 22 13186 1 1 11 ARG CD C -7.857 0.825 -6.650 1.00 . A A . 11 ARG CD 1 1 22 13187 1 1 11 ARG CG C -6.841 1.623 -5.849 1.00 . A A . 11 ARG CG 1 1 22 13188 1 1 11 ARG CZ C -8.512 0.503 -9.003 1.00 . A A . 11 ARG CZ 1 1 22 13189 1 1 11 ARG H H -5.825 2.793 -3.896 1.00 . A A . 11 ARG H 1 1 22 13190 1 1 11 ARG HA H -4.909 3.719 -6.364 1.00 . A A . 11 ARG HA 1 1 22 13191 1 1 11 ARG HB2 H -7.823 3.492 -5.629 1.00 . A A . 11 ARG HB2 1 1 22 13192 1 1 11 ARG HB3 H -7.078 3.241 -7.201 1.00 . A A . 11 ARG HB3 1 1 22 13193 1 1 11 ARG HD2 H -7.732 -0.223 -6.423 1.00 . A A . 11 ARG HD2 1 1 22 13194 1 1 11 ARG HD3 H -8.849 1.139 -6.362 1.00 . A A . 11 ARG HD3 1 1 22 13195 1 1 11 ARG HE H -6.938 1.566 -8.389 1.00 . A A . 11 ARG HE 1 1 22 13196 1 1 11 ARG HG2 H -5.848 1.287 -6.109 1.00 . A A . 11 ARG HG2 1 1 22 13197 1 1 11 ARG HG3 H -7.014 1.457 -4.795 1.00 . A A . 11 ARG HG3 1 1 22 13198 1 1 11 ARG HH11 H -9.718 -0.416 -7.664 1.00 . A A . 11 ARG HH11 1 1 22 13199 1 1 11 ARG HH12 H -10.157 -0.627 -9.326 1.00 . A A . 11 ARG HH12 1 1 22 13200 1 1 11 ARG HH21 H -7.515 1.290 -10.575 1.00 . A A . 11 ARG HH21 1 1 22 13201 1 1 11 ARG HH22 H -8.906 0.341 -10.979 1.00 . A A . 11 ARG HH22 1 1 22 13202 1 1 11 ARG N N -5.312 3.491 -4.354 1.00 . A A . 11 ARG N 1 1 22 13203 1 1 11 ARG NE N -7.695 1.020 -8.088 1.00 . A A . 11 ARG NE 1 1 22 13204 1 1 11 ARG NH1 N -9.547 -0.241 -8.634 1.00 . A A . 11 ARG NH1 1 1 22 13205 1 1 11 ARG NH2 N -8.293 0.730 -10.291 1.00 . A A . 11 ARG NH2 1 1 22 13206 1 1 11 ARG O O -5.626 6.155 -4.822 1.00 . A A . 11 ARG O 1 1 22 13207 1 1 12 GLN C C -7.830 7.781 -5.641 1.00 . A A . 12 GLN C 1 1 22 13208 1 1 12 GLN CA C -7.125 7.248 -6.886 1.00 . A A . 12 GLN CA 1 1 22 13209 1 1 12 GLN CB C -8.022 7.435 -8.110 1.00 . A A . 12 GLN CB 1 1 22 13210 1 1 12 GLN CD C -7.852 8.587 -10.352 1.00 . A A . 12 GLN CD 1 1 22 13211 1 1 12 GLN CG C -7.781 8.744 -8.846 1.00 . A A . 12 GLN CG 1 1 22 13212 1 1 12 GLN H H -7.058 5.202 -7.418 1.00 . A A . 12 GLN H 1 1 22 13213 1 1 12 GLN HA H -6.214 7.808 -7.033 1.00 . A A . 12 GLN HA 1 1 22 13214 1 1 12 GLN HB2 H -7.846 6.622 -8.799 1.00 . A A . 12 GLN HB2 1 1 22 13215 1 1 12 GLN HB3 H -9.054 7.410 -7.793 1.00 . A A . 12 GLN HB3 1 1 22 13216 1 1 12 GLN HE21 H -6.068 7.708 -10.369 1.00 . A A . 12 GLN HE21 1 1 22 13217 1 1 12 GLN HE22 H -6.831 7.887 -11.909 1.00 . A A . 12 GLN HE22 1 1 22 13218 1 1 12 GLN HG2 H -8.531 9.458 -8.539 1.00 . A A . 12 GLN HG2 1 1 22 13219 1 1 12 GLN HG3 H -6.802 9.115 -8.583 1.00 . A A . 12 GLN HG3 1 1 22 13220 1 1 12 GLN N N -6.763 5.843 -6.738 1.00 . A A . 12 GLN N 1 1 22 13221 1 1 12 GLN NE2 N -6.812 8.002 -10.936 1.00 . A A . 12 GLN NE2 1 1 22 13222 1 1 12 GLN O O -7.776 8.977 -5.356 1.00 . A A . 12 GLN O 1 1 22 13223 1 1 12 GLN OE1 O -8.829 8.986 -10.985 1.00 . A A . 12 GLN OE1 1 1 22 13224 1 1 13 CYS C C -9.630 6.101 -2.852 1.00 . A A . 13 CYS C 1 1 22 13225 1 1 13 CYS CA C -9.211 7.304 -3.697 1.00 . A A . 13 CYS CA 1 1 22 13226 1 1 13 CYS CB C -10.446 8.127 -4.074 1.00 . A A . 13 CYS CB 1 1 22 13227 1 1 13 CYS H H -8.511 5.955 -5.176 1.00 . A A . 13 CYS H 1 1 22 13228 1 1 13 CYS HA H -8.545 7.922 -3.114 1.00 . A A . 13 CYS HA 1 1 22 13229 1 1 13 CYS HB2 H -10.749 7.868 -5.077 1.00 . A A . 13 CYS HB2 1 1 22 13230 1 1 13 CYS HB3 H -11.248 7.893 -3.390 1.00 . A A . 13 CYS HB3 1 1 22 13231 1 1 13 CYS N N -8.496 6.895 -4.903 1.00 . A A . 13 CYS N 1 1 22 13232 1 1 13 CYS O O -10.646 6.149 -2.159 1.00 . A A . 13 CYS O 1 1 22 13233 1 1 13 CYS SG S -10.185 9.930 -4.025 1.00 . A A . 13 CYS SG 1 1 22 13234 1 1 14 LYS C C -7.910 2.984 -1.928 1.00 . A A . 14 LYS C 1 1 22 13235 1 1 14 LYS CA C -9.158 3.830 -2.131 1.00 . A A . 14 LYS CA 1 1 22 13236 1 1 14 LYS CB C -10.240 3.008 -2.834 1.00 . A A . 14 LYS CB 1 1 22 13237 1 1 14 LYS CD C -11.773 3.105 -0.845 1.00 . A A . 14 LYS CD 1 1 22 13238 1 1 14 LYS CE C -13.212 2.839 -0.437 1.00 . A A . 14 LYS CE 1 1 22 13239 1 1 14 LYS CG C -11.648 3.309 -2.346 1.00 . A A . 14 LYS CG 1 1 22 13240 1 1 14 LYS H H -8.046 5.036 -3.469 1.00 . A A . 14 LYS H 1 1 22 13241 1 1 14 LYS HA H -9.527 4.145 -1.166 1.00 . A A . 14 LYS HA 1 1 22 13242 1 1 14 LYS HB2 H -10.199 3.211 -3.894 1.00 . A A . 14 LYS HB2 1 1 22 13243 1 1 14 LYS HB3 H -10.043 1.958 -2.671 1.00 . A A . 14 LYS HB3 1 1 22 13244 1 1 14 LYS HD2 H -11.165 2.262 -0.554 1.00 . A A . 14 LYS HD2 1 1 22 13245 1 1 14 LYS HD3 H -11.423 3.994 -0.341 1.00 . A A . 14 LYS HD3 1 1 22 13246 1 1 14 LYS HE2 H -13.788 3.740 -0.584 1.00 . A A . 14 LYS HE2 1 1 22 13247 1 1 14 LYS HE3 H -13.611 2.053 -1.062 1.00 . A A . 14 LYS HE3 1 1 22 13248 1 1 14 LYS HG2 H -11.888 4.335 -2.581 1.00 . A A . 14 LYS HG2 1 1 22 13249 1 1 14 LYS HG3 H -12.341 2.650 -2.849 1.00 . A A . 14 LYS HG3 1 1 22 13250 1 1 14 LYS HZ1 H -12.617 2.936 1.563 1.00 . A A . 14 LYS HZ1 1 1 22 13251 1 1 14 LYS HZ2 H -14.269 2.635 1.353 1.00 . A A . 14 LYS HZ2 1 1 22 13252 1 1 14 LYS HZ3 H -13.143 1.403 1.079 1.00 . A A . 14 LYS HZ3 1 1 22 13253 1 1 14 LYS N N -8.848 5.026 -2.904 1.00 . A A . 14 LYS N 1 1 22 13254 1 1 14 LYS NZ N -13.318 2.424 0.989 1.00 . A A . 14 LYS NZ 1 1 22 13255 1 1 14 LYS O O -7.211 2.660 -2.887 1.00 . A A . 14 LYS O 1 1 22 13256 1 1 15 LEU C C -6.310 0.668 -1.350 1.00 . A A . 15 LEU C 1 1 22 13257 1 1 15 LEU CA C -6.462 1.813 -0.353 1.00 . A A . 15 LEU CA 1 1 22 13258 1 1 15 LEU CB C -6.565 1.266 1.073 1.00 . A A . 15 LEU CB 1 1 22 13259 1 1 15 LEU CD1 C -7.084 -1.178 0.897 1.00 . A A . 15 LEU CD1 1 1 22 13260 1 1 15 LEU CD2 C -8.107 0.189 2.726 1.00 . A A . 15 LEU CD2 1 1 22 13261 1 1 15 LEU CG C -7.629 0.189 1.282 1.00 . A A . 15 LEU CG 1 1 22 13262 1 1 15 LEU H H -8.227 2.915 0.048 1.00 . A A . 15 LEU H 1 1 22 13263 1 1 15 LEU HA H -5.591 2.449 -0.421 1.00 . A A . 15 LEU HA 1 1 22 13264 1 1 15 LEU HB2 H -5.606 0.853 1.346 1.00 . A A . 15 LEU HB2 1 1 22 13265 1 1 15 LEU HB3 H -6.785 2.090 1.736 1.00 . A A . 15 LEU HB3 1 1 22 13266 1 1 15 LEU HD11 H -6.004 -1.148 0.900 1.00 . A A . 15 LEU HD11 1 1 22 13267 1 1 15 LEU HD12 H -7.425 -1.916 1.608 1.00 . A A . 15 LEU HD12 1 1 22 13268 1 1 15 LEU HD13 H -7.434 -1.441 -0.089 1.00 . A A . 15 LEU HD13 1 1 22 13269 1 1 15 LEU HD21 H -7.879 1.142 3.181 1.00 . A A . 15 LEU HD21 1 1 22 13270 1 1 15 LEU HD22 H -9.173 0.023 2.753 1.00 . A A . 15 LEU HD22 1 1 22 13271 1 1 15 LEU HD23 H -7.606 -0.598 3.271 1.00 . A A . 15 LEU HD23 1 1 22 13272 1 1 15 LEU HG H -8.478 0.400 0.647 1.00 . A A . 15 LEU HG 1 1 22 13273 1 1 15 LEU N N -7.632 2.626 -0.675 1.00 . A A . 15 LEU N 1 1 22 13274 1 1 15 LEU O O -7.293 0.036 -1.737 1.00 . A A . 15 LEU O 1 1 22 13275 1 1 16 LYS C C -5.248 -1.997 -2.207 1.00 . A A . 16 LYS C 1 1 22 13276 1 1 16 LYS CA C -4.810 -0.635 -2.744 1.00 . A A . 16 LYS CA 1 1 22 13277 1 1 16 LYS CB C -3.322 -0.667 -3.097 1.00 . A A . 16 LYS CB 1 1 22 13278 1 1 16 LYS CD C -1.843 -0.395 -5.111 1.00 . A A . 16 LYS CD 1 1 22 13279 1 1 16 LYS CE C -1.804 0.194 -6.511 1.00 . A A . 16 LYS CE 1 1 22 13280 1 1 16 LYS CG C -2.959 0.217 -4.280 1.00 . A A . 16 LYS CG 1 1 22 13281 1 1 16 LYS H H -4.336 0.963 -1.443 1.00 . A A . 16 LYS H 1 1 22 13282 1 1 16 LYS HA H -5.379 -0.410 -3.635 1.00 . A A . 16 LYS HA 1 1 22 13283 1 1 16 LYS HB2 H -2.753 -0.336 -2.241 1.00 . A A . 16 LYS HB2 1 1 22 13284 1 1 16 LYS HB3 H -3.042 -1.682 -3.335 1.00 . A A . 16 LYS HB3 1 1 22 13285 1 1 16 LYS HD2 H -0.899 -0.203 -4.624 1.00 . A A . 16 LYS HD2 1 1 22 13286 1 1 16 LYS HD3 H -2.004 -1.461 -5.182 1.00 . A A . 16 LYS HD3 1 1 22 13287 1 1 16 LYS HE2 H -2.736 -0.030 -7.008 1.00 . A A . 16 LYS HE2 1 1 22 13288 1 1 16 LYS HE3 H -1.685 1.265 -6.434 1.00 . A A . 16 LYS HE3 1 1 22 13289 1 1 16 LYS HG2 H -3.831 0.342 -4.904 1.00 . A A . 16 LYS HG2 1 1 22 13290 1 1 16 LYS HG3 H -2.636 1.180 -3.912 1.00 . A A . 16 LYS HG3 1 1 22 13291 1 1 16 LYS HZ1 H -0.510 -1.353 -7.055 1.00 . A A . 16 LYS HZ1 1 1 22 13292 1 1 16 LYS HZ2 H -0.913 -0.318 -8.330 1.00 . A A . 16 LYS HZ2 1 1 22 13293 1 1 16 LYS HZ3 H 0.186 0.186 -7.146 1.00 . A A . 16 LYS HZ3 1 1 22 13294 1 1 16 LYS N N -5.079 0.419 -1.777 1.00 . A A . 16 LYS N 1 1 22 13295 1 1 16 LYS NZ N -0.682 -0.362 -7.317 1.00 . A A . 16 LYS NZ 1 1 22 13296 1 1 16 LYS O O -5.406 -2.176 -1.000 1.00 . A A . 16 LYS O 1 1 22 13297 1 1 17 PRO C C -4.999 -4.915 -1.609 1.00 . A A . 17 PRO C 1 1 22 13298 1 1 17 PRO CA C -5.871 -4.329 -2.714 1.00 . A A . 17 PRO CA 1 1 22 13299 1 1 17 PRO CB C -5.712 -5.135 -4.004 1.00 . A A . 17 PRO CB 1 1 22 13300 1 1 17 PRO CD C -5.282 -2.850 -4.563 1.00 . A A . 17 PRO CD 1 1 22 13301 1 1 17 PRO CG C -5.855 -4.134 -5.097 1.00 . A A . 17 PRO CG 1 1 22 13302 1 1 17 PRO HA H -6.905 -4.345 -2.401 1.00 . A A . 17 PRO HA 1 1 22 13303 1 1 17 PRO HB2 H -4.738 -5.603 -4.021 1.00 . A A . 17 PRO HB2 1 1 22 13304 1 1 17 PRO HB3 H -6.482 -5.890 -4.057 1.00 . A A . 17 PRO HB3 1 1 22 13305 1 1 17 PRO HD2 H -4.237 -2.766 -4.825 1.00 . A A . 17 PRO HD2 1 1 22 13306 1 1 17 PRO HD3 H -5.836 -2.003 -4.941 1.00 . A A . 17 PRO HD3 1 1 22 13307 1 1 17 PRO HG2 H -5.303 -4.458 -5.966 1.00 . A A . 17 PRO HG2 1 1 22 13308 1 1 17 PRO HG3 H -6.899 -4.004 -5.341 1.00 . A A . 17 PRO HG3 1 1 22 13309 1 1 17 PRO N N -5.449 -2.979 -3.103 1.00 . A A . 17 PRO N 1 1 22 13310 1 1 17 PRO O O -3.777 -4.766 -1.623 1.00 . A A . 17 PRO O 1 1 22 13311 1 1 18 ALA C C -3.911 -7.226 -0.038 1.00 . A A . 18 ALA C 1 1 22 13312 1 1 18 ALA CA C -4.920 -6.197 0.460 1.00 . A A . 18 ALA CA 1 1 22 13313 1 1 18 ALA CB C -5.901 -6.846 1.424 1.00 . A A . 18 ALA CB 1 1 22 13314 1 1 18 ALA H H -6.611 -5.670 -0.698 1.00 . A A . 18 ALA H 1 1 22 13315 1 1 18 ALA HA H -4.393 -5.416 0.990 1.00 . A A . 18 ALA HA 1 1 22 13316 1 1 18 ALA HB1 H -6.793 -6.240 1.492 1.00 . A A . 18 ALA HB1 1 1 22 13317 1 1 18 ALA HB2 H -6.162 -7.830 1.065 1.00 . A A . 18 ALA HB2 1 1 22 13318 1 1 18 ALA HB3 H -5.446 -6.927 2.401 1.00 . A A . 18 ALA HB3 1 1 22 13319 1 1 18 ALA N N -5.636 -5.585 -0.653 1.00 . A A . 18 ALA N 1 1 22 13320 1 1 18 ALA O O -4.283 -8.324 -0.453 1.00 . A A . 18 ALA O 1 1 22 13321 1 1 19 GLY C C -0.844 -7.249 -1.651 1.00 . A A . 19 GLY C 1 1 22 13322 1 1 19 GLY CA C -1.591 -7.772 -0.440 1.00 . A A . 19 GLY CA 1 1 22 13323 1 1 19 GLY H H -2.394 -5.979 0.351 1.00 . A A . 19 GLY H 1 1 22 13324 1 1 19 GLY HA2 H -2.039 -8.722 -0.690 1.00 . A A . 19 GLY HA2 1 1 22 13325 1 1 19 GLY HA3 H -0.888 -7.920 0.366 1.00 . A A . 19 GLY HA3 1 1 22 13326 1 1 19 GLY N N -2.632 -6.866 0.008 1.00 . A A . 19 GLY N 1 1 22 13327 1 1 19 GLY O O -0.333 -8.027 -2.456 1.00 . A A . 19 GLY O 1 1 22 13328 1 1 20 THR C C 1.276 -4.773 -2.475 1.00 . A A . 20 THR C 1 1 22 13329 1 1 20 THR CA C -0.087 -5.306 -2.905 1.00 . A A . 20 THR CA 1 1 22 13330 1 1 20 THR CB C -0.928 -4.172 -3.491 1.00 . A A . 20 THR CB 1 1 22 13331 1 1 20 THR CG2 C -0.277 -3.501 -4.681 1.00 . A A . 20 THR CG2 1 1 22 13332 1 1 20 THR H H -1.206 -5.358 -1.109 1.00 . A A . 20 THR H 1 1 22 13333 1 1 20 THR HA H 0.060 -6.062 -3.662 1.00 . A A . 20 THR HA 1 1 22 13334 1 1 20 THR HB H -1.082 -3.420 -2.730 1.00 . A A . 20 THR HB 1 1 22 13335 1 1 20 THR HG1 H -2.706 -3.926 -4.274 1.00 . A A . 20 THR HG1 1 1 22 13336 1 1 20 THR HG21 H 0.747 -3.834 -4.766 1.00 . A A . 20 THR HG21 1 1 22 13337 1 1 20 THR HG22 H -0.816 -3.761 -5.580 1.00 . A A . 20 THR HG22 1 1 22 13338 1 1 20 THR HG23 H -0.297 -2.430 -4.546 1.00 . A A . 20 THR HG23 1 1 22 13339 1 1 20 THR N N -0.779 -5.928 -1.782 1.00 . A A . 20 THR N 1 1 22 13340 1 1 20 THR O O 1.367 -3.770 -1.768 1.00 . A A . 20 THR O 1 1 22 13341 1 1 20 THR OG1 O -2.195 -4.650 -3.906 1.00 . A A . 20 THR OG1 1 1 22 13342 1 1 21 THR C C 3.904 -3.553 -2.786 1.00 . A A . 21 THR C 1 1 22 13343 1 1 21 THR CA C 3.696 -5.050 -2.570 1.00 . A A . 21 THR CA 1 1 22 13344 1 1 21 THR CB C 4.698 -5.840 -3.412 1.00 . A A . 21 THR CB 1 1 22 13345 1 1 21 THR CG2 C 4.297 -5.948 -4.867 1.00 . A A . 21 THR CG2 1 1 22 13346 1 1 21 THR H H 2.194 -6.242 -3.468 1.00 . A A . 21 THR H 1 1 22 13347 1 1 21 THR HA H 3.860 -5.278 -1.528 1.00 . A A . 21 THR HA 1 1 22 13348 1 1 21 THR HB H 4.773 -6.842 -3.016 1.00 . A A . 21 THR HB 1 1 22 13349 1 1 21 THR HG1 H 6.379 -5.411 -2.504 1.00 . A A . 21 THR HG1 1 1 22 13350 1 1 21 THR HG21 H 3.320 -5.509 -5.004 1.00 . A A . 21 THR HG21 1 1 22 13351 1 1 21 THR HG22 H 5.017 -5.424 -5.479 1.00 . A A . 21 THR HG22 1 1 22 13352 1 1 21 THR HG23 H 4.268 -6.988 -5.156 1.00 . A A . 21 THR HG23 1 1 22 13353 1 1 21 THR N N 2.333 -5.451 -2.907 1.00 . A A . 21 THR N 1 1 22 13354 1 1 21 THR O O 3.802 -3.057 -3.907 1.00 . A A . 21 THR O 1 1 22 13355 1 1 21 THR OG1 O 5.980 -5.242 -3.361 1.00 . A A . 21 THR OG1 1 1 22 13356 1 1 22 CYS C C 5.724 -1.086 -2.492 1.00 . A A . 22 CYS C 1 1 22 13357 1 1 22 CYS CA C 4.418 -1.401 -1.770 1.00 . A A . 22 CYS CA 1 1 22 13358 1 1 22 CYS CB C 4.442 -0.802 -0.363 1.00 . A A . 22 CYS CB 1 1 22 13359 1 1 22 CYS H H 4.263 -3.294 -0.836 1.00 . A A . 22 CYS H 1 1 22 13360 1 1 22 CYS HA H 3.600 -0.965 -2.324 1.00 . A A . 22 CYS HA 1 1 22 13361 1 1 22 CYS HB2 H 3.578 -1.149 0.183 1.00 . A A . 22 CYS HB2 1 1 22 13362 1 1 22 CYS HB3 H 5.338 -1.130 0.145 1.00 . A A . 22 CYS HB3 1 1 22 13363 1 1 22 CYS N N 4.196 -2.840 -1.702 1.00 . A A . 22 CYS N 1 1 22 13364 1 1 22 CYS O O 5.757 -0.263 -3.406 1.00 . A A . 22 CYS O 1 1 22 13365 1 1 22 CYS SG S 4.421 1.020 -0.329 1.00 . A A . 22 CYS SG 1 1 22 13366 1 1 23 TRP C C 8.960 -2.800 -2.582 1.00 . A A . 23 TRP C 1 1 22 13367 1 1 23 TRP CA C 8.109 -1.538 -2.680 1.00 . A A . 23 TRP CA 1 1 22 13368 1 1 23 TRP CB C 8.827 -0.370 -2.003 1.00 . A A . 23 TRP CB 1 1 22 13369 1 1 23 TRP CD1 C 10.269 0.403 -3.974 1.00 . A A . 23 TRP CD1 1 1 22 13370 1 1 23 TRP CD2 C 11.415 0.030 -2.087 1.00 . A A . 23 TRP CD2 1 1 22 13371 1 1 23 TRP CE2 C 12.317 0.446 -3.085 1.00 . A A . 23 TRP CE2 1 1 22 13372 1 1 23 TRP CE3 C 11.909 -0.262 -0.813 1.00 . A A . 23 TRP CE3 1 1 22 13373 1 1 23 TRP CG C 10.110 0.009 -2.677 1.00 . A A . 23 TRP CG 1 1 22 13374 1 1 23 TRP CH2 C 14.138 0.285 -1.590 1.00 . A A . 23 TRP CH2 1 1 22 13375 1 1 23 TRP CZ2 C 13.683 0.577 -2.847 1.00 . A A . 23 TRP CZ2 1 1 22 13376 1 1 23 TRP CZ3 C 13.265 -0.132 -0.578 1.00 . A A . 23 TRP CZ3 1 1 22 13377 1 1 23 TRP H H 6.709 -2.391 -1.340 1.00 . A A . 23 TRP H 1 1 22 13378 1 1 23 TRP HA H 7.957 -1.301 -3.722 1.00 . A A . 23 TRP HA 1 1 22 13379 1 1 23 TRP HB2 H 8.180 0.494 -2.008 1.00 . A A . 23 TRP HB2 1 1 22 13380 1 1 23 TRP HB3 H 9.053 -0.639 -0.981 1.00 . A A . 23 TRP HB3 1 1 22 13381 1 1 23 TRP HD1 H 9.463 0.489 -4.687 1.00 . A A . 23 TRP HD1 1 1 22 13382 1 1 23 TRP HE1 H 11.960 0.967 -5.086 1.00 . A A . 23 TRP HE1 1 1 22 13383 1 1 23 TRP HE3 H 11.251 -0.585 -0.019 1.00 . A A . 23 TRP HE3 1 1 22 13384 1 1 23 TRP HH2 H 15.190 0.372 -1.362 1.00 . A A . 23 TRP HH2 1 1 22 13385 1 1 23 TRP HZ2 H 14.369 0.897 -3.617 1.00 . A A . 23 TRP HZ2 1 1 22 13386 1 1 23 TRP HZ3 H 13.665 -0.354 0.401 1.00 . A A . 23 TRP HZ3 1 1 22 13387 1 1 23 TRP N N 6.799 -1.747 -2.074 1.00 . A A . 23 TRP N 1 1 22 13388 1 1 23 TRP NE1 N 11.594 0.668 -4.228 1.00 . A A . 23 TRP NE1 1 1 22 13389 1 1 23 TRP O O 9.579 -3.064 -1.551 1.00 . A A . 23 TRP O 1 1 22 13390 1 1 24 ARG C C 10.965 -4.673 -4.622 1.00 . A A . 24 ARG C 1 1 22 13391 1 1 24 ARG CA C 9.762 -4.810 -3.696 1.00 . A A . 24 ARG CA 1 1 22 13392 1 1 24 ARG CB C 8.883 -5.976 -4.153 1.00 . A A . 24 ARG CB 1 1 22 13393 1 1 24 ARG CD C 9.125 -6.606 -6.575 1.00 . A A . 24 ARG CD 1 1 22 13394 1 1 24 ARG CG C 8.328 -5.805 -5.558 1.00 . A A . 24 ARG CG 1 1 22 13395 1 1 24 ARG CZ C 8.761 -8.596 -7.982 1.00 . A A . 24 ARG CZ 1 1 22 13396 1 1 24 ARG H H 8.472 -3.312 -4.452 1.00 . A A . 24 ARG H 1 1 22 13397 1 1 24 ARG HA H 10.114 -5.008 -2.695 1.00 . A A . 24 ARG HA 1 1 22 13398 1 1 24 ARG HB2 H 9.468 -6.884 -4.128 1.00 . A A . 24 ARG HB2 1 1 22 13399 1 1 24 ARG HB3 H 8.053 -6.075 -3.470 1.00 . A A . 24 ARG HB3 1 1 22 13400 1 1 24 ARG HD2 H 9.220 -6.023 -7.478 1.00 . A A . 24 ARG HD2 1 1 22 13401 1 1 24 ARG HD3 H 10.107 -6.802 -6.169 1.00 . A A . 24 ARG HD3 1 1 22 13402 1 1 24 ARG HE H 7.806 -8.214 -6.271 1.00 . A A . 24 ARG HE 1 1 22 13403 1 1 24 ARG HG2 H 7.303 -6.144 -5.573 1.00 . A A . 24 ARG HG2 1 1 22 13404 1 1 24 ARG HG3 H 8.367 -4.759 -5.825 1.00 . A A . 24 ARG HG3 1 1 22 13405 1 1 24 ARG HH11 H 10.150 -7.310 -8.693 1.00 . A A . 24 ARG HH11 1 1 22 13406 1 1 24 ARG HH12 H 9.875 -8.717 -9.664 1.00 . A A . 24 ARG HH12 1 1 22 13407 1 1 24 ARG HH21 H 7.443 -10.065 -7.547 1.00 . A A . 24 ARG HH21 1 1 22 13408 1 1 24 ARG HH22 H 8.338 -10.281 -9.014 1.00 . A A . 24 ARG HH22 1 1 22 13409 1 1 24 ARG N N 8.986 -3.576 -3.661 1.00 . A A . 24 ARG N 1 1 22 13410 1 1 24 ARG NE N 8.482 -7.878 -6.897 1.00 . A A . 24 ARG NE 1 1 22 13411 1 1 24 ARG NH1 N 9.670 -8.172 -8.851 1.00 . A A . 24 ARG NH1 1 1 22 13412 1 1 24 ARG NH2 N 8.129 -9.741 -8.199 1.00 . A A . 24 ARG NH2 1 1 22 13413 1 1 24 ARG O O 10.815 -4.572 -5.840 1.00 . A A . 24 ARG O 1 1 22 13414 1 1 25 THR C C 13.782 -5.889 -5.420 1.00 . A A . 25 THR C 1 1 22 13415 1 1 25 THR CA C 13.388 -4.547 -4.812 1.00 . A A . 25 THR CA 1 1 22 13416 1 1 25 THR CB C 14.521 -4.017 -3.930 1.00 . A A . 25 THR CB 1 1 22 13417 1 1 25 THR CG2 C 14.244 -2.642 -3.363 1.00 . A A . 25 THR CG2 1 1 22 13418 1 1 25 THR H H 12.214 -4.755 -3.063 1.00 . A A . 25 THR H 1 1 22 13419 1 1 25 THR HA H 13.208 -3.846 -5.609 1.00 . A A . 25 THR HA 1 1 22 13420 1 1 25 THR HB H 15.424 -3.956 -4.521 1.00 . A A . 25 THR HB 1 1 22 13421 1 1 25 THR HG1 H 14.021 -4.852 -2.230 1.00 . A A . 25 THR HG1 1 1 22 13422 1 1 25 THR HG21 H 13.242 -2.339 -3.627 1.00 . A A . 25 THR HG21 1 1 22 13423 1 1 25 THR HG22 H 14.342 -2.669 -2.288 1.00 . A A . 25 THR HG22 1 1 22 13424 1 1 25 THR HG23 H 14.953 -1.935 -3.771 1.00 . A A . 25 THR HG23 1 1 22 13425 1 1 25 THR N N 12.159 -4.671 -4.038 1.00 . A A . 25 THR N 1 1 22 13426 1 1 25 THR O O 13.568 -6.131 -6.608 1.00 . A A . 25 THR O 1 1 22 13427 1 1 25 THR OG1 O 14.760 -4.891 -2.841 1.00 . A A . 25 THR OG1 1 1 22 13428 1 1 26 SER C C 14.993 -9.016 -3.866 1.00 . A A . 26 SER C 1 1 22 13429 1 1 26 SER CA C 14.782 -8.075 -5.048 1.00 . A A . 26 SER CA 1 1 22 13430 1 1 26 SER CB C 16.071 -7.967 -5.864 1.00 . A A . 26 SER CB 1 1 22 13431 1 1 26 SER H H 14.499 -6.500 -3.662 1.00 . A A . 26 SER H 1 1 22 13432 1 1 26 SER HA H 14.002 -8.477 -5.677 1.00 . A A . 26 SER HA 1 1 22 13433 1 1 26 SER HB2 H 16.787 -7.366 -5.324 1.00 . A A . 26 SER HB2 1 1 22 13434 1 1 26 SER HB3 H 16.478 -8.955 -6.023 1.00 . A A . 26 SER HB3 1 1 22 13435 1 1 26 SER HG H 16.188 -6.475 -7.128 1.00 . A A . 26 SER HG 1 1 22 13436 1 1 26 SER N N 14.357 -6.755 -4.596 1.00 . A A . 26 SER N 1 1 22 13437 1 1 26 SER O O 15.813 -9.932 -3.929 1.00 . A A . 26 SER O 1 1 22 13438 1 1 26 SER OG O 15.829 -7.365 -7.124 1.00 . A A . 26 SER OG 1 1 22 13439 1 1 27 VAL C C 13.395 -9.132 -0.506 1.00 . A A . 27 VAL C 1 1 22 13440 1 1 27 VAL CA C 14.352 -9.613 -1.593 1.00 . A A . 27 VAL CA 1 1 22 13441 1 1 27 VAL CB C 15.790 -9.617 -1.035 1.00 . A A . 27 VAL CB 1 1 22 13442 1 1 27 VAL CG1 C 16.218 -8.211 -0.643 1.00 . A A . 27 VAL CG1 1 1 22 13443 1 1 27 VAL CG2 C 15.904 -10.567 0.148 1.00 . A A . 27 VAL CG2 1 1 22 13444 1 1 27 VAL H H 13.609 -8.041 -2.800 1.00 . A A . 27 VAL H 1 1 22 13445 1 1 27 VAL HA H 14.091 -10.624 -1.865 1.00 . A A . 27 VAL HA 1 1 22 13446 1 1 27 VAL HB H 16.454 -9.965 -1.812 1.00 . A A . 27 VAL HB 1 1 22 13447 1 1 27 VAL HG11 H 16.136 -7.557 -1.499 1.00 . A A . 27 VAL HG11 1 1 22 13448 1 1 27 VAL HG12 H 15.580 -7.848 0.149 1.00 . A A . 27 VAL HG12 1 1 22 13449 1 1 27 VAL HG13 H 17.242 -8.228 -0.300 1.00 . A A . 27 VAL HG13 1 1 22 13450 1 1 27 VAL HG21 H 15.129 -11.317 0.084 1.00 . A A . 27 VAL HG21 1 1 22 13451 1 1 27 VAL HG22 H 16.872 -11.046 0.133 1.00 . A A . 27 VAL HG22 1 1 22 13452 1 1 27 VAL HG23 H 15.792 -10.011 1.068 1.00 . A A . 27 VAL HG23 1 1 22 13453 1 1 27 VAL N N 14.247 -8.785 -2.789 1.00 . A A . 27 VAL N 1 1 22 13454 1 1 27 VAL O O 12.801 -9.936 0.212 1.00 . A A . 27 VAL O 1 1 22 13455 1 1 28 SER C C 10.929 -7.672 0.396 1.00 . A A . 28 SER C 1 1 22 13456 1 1 28 SER CA C 12.373 -7.225 0.608 1.00 . A A . 28 SER CA 1 1 22 13457 1 1 28 SER CB C 12.464 -5.698 0.559 1.00 . A A . 28 SER CB 1 1 22 13458 1 1 28 SER H H 13.757 -7.230 -0.994 1.00 . A A . 28 SER H 1 1 22 13459 1 1 28 SER HA H 12.699 -7.563 1.577 1.00 . A A . 28 SER HA 1 1 22 13460 1 1 28 SER HB2 H 12.752 -5.388 -0.434 1.00 . A A . 28 SER HB2 1 1 22 13461 1 1 28 SER HB3 H 11.501 -5.274 0.803 1.00 . A A . 28 SER HB3 1 1 22 13462 1 1 28 SER HG H 13.212 -4.308 1.719 1.00 . A A . 28 SER HG 1 1 22 13463 1 1 28 SER N N 13.255 -7.817 -0.392 1.00 . A A . 28 SER N 1 1 22 13464 1 1 28 SER O O 10.440 -8.569 1.082 1.00 . A A . 28 SER O 1 1 22 13465 1 1 28 SER OG O 13.423 -5.214 1.483 1.00 . A A . 28 SER OG 1 1 22 13466 1 1 29 SER C C 7.979 -7.162 0.366 1.00 . A A . 29 SER C 1 1 22 13467 1 1 29 SER CA C 8.866 -7.368 -0.858 1.00 . A A . 29 SER CA 1 1 22 13468 1 1 29 SER CB C 8.757 -8.814 -1.344 1.00 . A A . 29 SER CB 1 1 22 13469 1 1 29 SER H H 10.700 -6.332 -1.065 1.00 . A A . 29 SER H 1 1 22 13470 1 1 29 SER HA H 8.533 -6.707 -1.644 1.00 . A A . 29 SER HA 1 1 22 13471 1 1 29 SER HB2 H 9.108 -8.877 -2.363 1.00 . A A . 29 SER HB2 1 1 22 13472 1 1 29 SER HB3 H 9.364 -9.449 -0.715 1.00 . A A . 29 SER HB3 1 1 22 13473 1 1 29 SER HG H 6.962 -9.017 -2.102 1.00 . A A . 29 SER HG 1 1 22 13474 1 1 29 SER N N 10.254 -7.038 -0.555 1.00 . A A . 29 SER N 1 1 22 13475 1 1 29 SER O O 8.022 -7.944 1.315 1.00 . A A . 29 SER O 1 1 22 13476 1 1 29 SER OG O 7.416 -9.270 -1.295 1.00 . A A . 29 SER OG 1 1 22 13477 1 1 30 HIS C C 4.837 -5.661 0.958 1.00 . A A . 30 HIS C 1 1 22 13478 1 1 30 HIS CA C 6.277 -5.794 1.444 1.00 . A A . 30 HIS CA 1 1 22 13479 1 1 30 HIS CB C 6.715 -4.502 2.137 1.00 . A A . 30 HIS CB 1 1 22 13480 1 1 30 HIS CD2 C 9.279 -4.873 2.010 1.00 . A A . 30 HIS CD2 1 1 22 13481 1 1 30 HIS CE1 C 9.783 -4.334 4.075 1.00 . A A . 30 HIS CE1 1 1 22 13482 1 1 30 HIS CG C 8.126 -4.540 2.637 1.00 . A A . 30 HIS CG 1 1 22 13483 1 1 30 HIS H H 7.186 -5.516 -0.448 1.00 . A A . 30 HIS H 1 1 22 13484 1 1 30 HIS HA H 6.332 -6.608 2.152 1.00 . A A . 30 HIS HA 1 1 22 13485 1 1 30 HIS HB2 H 6.632 -3.682 1.439 1.00 . A A . 30 HIS HB2 1 1 22 13486 1 1 30 HIS HB3 H 6.067 -4.318 2.981 1.00 . A A . 30 HIS HB3 1 1 22 13487 1 1 30 HIS HD1 H 7.858 -3.921 4.633 1.00 . A A . 30 HIS HD1 1 1 22 13488 1 1 30 HIS HD2 H 9.382 -5.187 0.981 1.00 . A A . 30 HIS HD2 1 1 22 13489 1 1 30 HIS HE1 H 10.338 -4.142 4.981 1.00 . A A . 30 HIS HE1 1 1 22 13490 1 1 30 HIS HE2 H 11.250 -4.827 2.734 1.00 . A A . 30 HIS HE2 1 1 22 13491 1 1 30 HIS N N 7.175 -6.103 0.336 1.00 . A A . 30 HIS N 1 1 22 13492 1 1 30 HIS ND1 N 8.476 -4.208 3.929 1.00 . A A . 30 HIS ND1 1 1 22 13493 1 1 30 HIS NE2 N 10.293 -4.737 2.926 1.00 . A A . 30 HIS NE2 1 1 22 13494 1 1 30 HIS O O 4.412 -4.588 0.532 1.00 . A A . 30 HIS O 1 1 22 13495 1 1 31 TYR C C 1.857 -5.831 1.457 1.00 . A A . 31 TYR C 1 1 22 13496 1 1 31 TYR CA C 2.699 -6.767 0.595 1.00 . A A . 31 TYR CA 1 1 22 13497 1 1 31 TYR CB C 2.132 -8.186 0.659 1.00 . A A . 31 TYR CB 1 1 22 13498 1 1 31 TYR CD1 C 3.096 -10.288 -0.354 1.00 . A A . 31 TYR CD1 1 1 22 13499 1 1 31 TYR CD2 C 2.275 -8.603 -1.826 1.00 . A A . 31 TYR CD2 1 1 22 13500 1 1 31 TYR CE1 C 3.442 -11.073 -1.437 1.00 . A A . 31 TYR CE1 1 1 22 13501 1 1 31 TYR CE2 C 2.617 -9.383 -2.915 1.00 . A A . 31 TYR CE2 1 1 22 13502 1 1 31 TYR CG C 2.508 -9.042 -0.529 1.00 . A A . 31 TYR CG 1 1 22 13503 1 1 31 TYR CZ C 3.200 -10.616 -2.716 1.00 . A A . 31 TYR CZ 1 1 22 13504 1 1 31 TYR H H 4.488 -7.585 1.377 1.00 . A A . 31 TYR H 1 1 22 13505 1 1 31 TYR HA H 2.666 -6.421 -0.427 1.00 . A A . 31 TYR HA 1 1 22 13506 1 1 31 TYR HB2 H 2.502 -8.674 1.549 1.00 . A A . 31 TYR HB2 1 1 22 13507 1 1 31 TYR HB3 H 1.055 -8.134 0.704 1.00 . A A . 31 TYR HB3 1 1 22 13508 1 1 31 TYR HD1 H 3.284 -10.643 0.649 1.00 . A A . 31 TYR HD1 1 1 22 13509 1 1 31 TYR HD2 H 1.819 -7.636 -1.979 1.00 . A A . 31 TYR HD2 1 1 22 13510 1 1 31 TYR HE1 H 3.898 -12.039 -1.280 1.00 . A A . 31 TYR HE1 1 1 22 13511 1 1 31 TYR HE2 H 2.427 -9.024 -3.916 1.00 . A A . 31 TYR HE2 1 1 22 13512 1 1 31 TYR HH H 2.905 -12.107 -3.894 1.00 . A A . 31 TYR HH 1 1 22 13513 1 1 31 TYR N N 4.092 -6.759 1.027 1.00 . A A . 31 TYR N 1 1 22 13514 1 1 31 TYR O O 2.072 -5.723 2.665 1.00 . A A . 31 TYR O 1 1 22 13515 1 1 31 TYR OH O 3.542 -11.395 -3.797 1.00 . A A . 31 TYR OH 1 1 22 13516 1 1 32 CYS C C -0.919 -4.978 2.475 1.00 . A A . 32 CYS C 1 1 22 13517 1 1 32 CYS CA C 0.027 -4.230 1.544 1.00 . A A . 32 CYS CA 1 1 22 13518 1 1 32 CYS CB C -0.780 -3.387 0.555 1.00 . A A . 32 CYS CB 1 1 22 13519 1 1 32 CYS H H 0.775 -5.283 -0.134 1.00 . A A . 32 CYS H 1 1 22 13520 1 1 32 CYS HA H 0.651 -3.576 2.134 1.00 . A A . 32 CYS HA 1 1 22 13521 1 1 32 CYS HB2 H -0.264 -3.361 -0.391 1.00 . A A . 32 CYS HB2 1 1 22 13522 1 1 32 CYS HB3 H -1.751 -3.839 0.418 1.00 . A A . 32 CYS HB3 1 1 22 13523 1 1 32 CYS N N 0.899 -5.156 0.830 1.00 . A A . 32 CYS N 1 1 22 13524 1 1 32 CYS O O -1.175 -6.169 2.293 1.00 . A A . 32 CYS O 1 1 22 13525 1 1 32 CYS SG S -1.041 -1.664 1.089 1.00 . A A . 32 CYS SG 1 1 22 13526 1 1 33 THR C C -3.813 -4.578 4.049 1.00 . A A . 33 THR C 1 1 22 13527 1 1 33 THR CA C -2.361 -4.860 4.433 1.00 . A A . 33 THR CA 1 1 22 13528 1 1 33 THR CB C -2.082 -4.315 5.833 1.00 . A A . 33 THR CB 1 1 22 13529 1 1 33 THR CG2 C -1.976 -2.806 5.872 1.00 . A A . 33 THR CG2 1 1 22 13530 1 1 33 THR H H -1.196 -3.324 3.560 1.00 . A A . 33 THR H 1 1 22 13531 1 1 33 THR HA H -2.201 -5.928 4.434 1.00 . A A . 33 THR HA 1 1 22 13532 1 1 33 THR HB H -1.146 -4.722 6.188 1.00 . A A . 33 THR HB 1 1 22 13533 1 1 33 THR HG1 H -2.957 -4.284 7.587 1.00 . A A . 33 THR HG1 1 1 22 13534 1 1 33 THR HG21 H -2.375 -2.394 4.956 1.00 . A A . 33 THR HG21 1 1 22 13535 1 1 33 THR HG22 H -2.539 -2.427 6.712 1.00 . A A . 33 THR HG22 1 1 22 13536 1 1 33 THR HG23 H -0.940 -2.520 5.975 1.00 . A A . 33 THR HG23 1 1 22 13537 1 1 33 THR N N -1.438 -4.270 3.471 1.00 . A A . 33 THR N 1 1 22 13538 1 1 33 THR O O -4.736 -4.960 4.768 1.00 . A A . 33 THR O 1 1 22 13539 1 1 33 THR OG1 O -3.106 -4.699 6.734 1.00 . A A . 33 THR OG1 1 1 22 13540 1 1 34 GLY C C -6.171 -2.874 3.532 1.00 . A A . 34 GLY C 1 1 22 13541 1 1 34 GLY CA C -5.357 -3.588 2.470 1.00 . A A . 34 GLY CA 1 1 22 13542 1 1 34 GLY H H -3.241 -3.624 2.380 1.00 . A A . 34 GLY H 1 1 22 13543 1 1 34 GLY HA2 H -5.861 -4.503 2.201 1.00 . A A . 34 GLY HA2 1 1 22 13544 1 1 34 GLY HA3 H -5.293 -2.956 1.596 1.00 . A A . 34 GLY HA3 1 1 22 13545 1 1 34 GLY N N -4.012 -3.906 2.916 1.00 . A A . 34 GLY N 1 1 22 13546 1 1 34 GLY O O -7.395 -2.996 3.571 1.00 . A A . 34 GLY O 1 1 22 13547 1 1 35 ARG C C -5.921 0.105 5.327 1.00 . A A . 35 ARG C 1 1 22 13548 1 1 35 ARG CA C -6.159 -1.394 5.465 1.00 . A A . 35 ARG CA 1 1 22 13549 1 1 35 ARG CB C -5.667 -1.877 6.830 1.00 . A A . 35 ARG CB 1 1 22 13550 1 1 35 ARG CD C -6.181 -1.575 9.271 1.00 . A A . 35 ARG CD 1 1 22 13551 1 1 35 ARG CG C -6.750 -1.890 7.897 1.00 . A A . 35 ARG CG 1 1 22 13552 1 1 35 ARG CZ C -6.966 -1.649 11.606 1.00 . A A . 35 ARG CZ 1 1 22 13553 1 1 35 ARG H H -4.515 -2.071 4.315 1.00 . A A . 35 ARG H 1 1 22 13554 1 1 35 ARG HA H -7.217 -1.585 5.385 1.00 . A A . 35 ARG HA 1 1 22 13555 1 1 35 ARG HB2 H -5.282 -2.880 6.727 1.00 . A A . 35 ARG HB2 1 1 22 13556 1 1 35 ARG HB3 H -4.871 -1.227 7.164 1.00 . A A . 35 ARG HB3 1 1 22 13557 1 1 35 ARG HD2 H -5.208 -2.035 9.358 1.00 . A A . 35 ARG HD2 1 1 22 13558 1 1 35 ARG HD3 H -6.081 -0.504 9.369 1.00 . A A . 35 ARG HD3 1 1 22 13559 1 1 35 ARG HE H -7.701 -2.755 10.116 1.00 . A A . 35 ARG HE 1 1 22 13560 1 1 35 ARG HG2 H -7.495 -1.149 7.649 1.00 . A A . 35 ARG HG2 1 1 22 13561 1 1 35 ARG HG3 H -7.206 -2.869 7.922 1.00 . A A . 35 ARG HG3 1 1 22 13562 1 1 35 ARG HH11 H -5.462 -0.340 11.269 1.00 . A A . 35 ARG HH11 1 1 22 13563 1 1 35 ARG HH12 H -6.032 -0.411 12.903 1.00 . A A . 35 ARG HH12 1 1 22 13564 1 1 35 ARG HH21 H -8.453 -2.850 12.264 1.00 . A A . 35 ARG HH21 1 1 22 13565 1 1 35 ARG HH22 H -7.730 -1.837 13.468 1.00 . A A . 35 ARG HH22 1 1 22 13566 1 1 35 ARG N N -5.490 -2.128 4.397 1.00 . A A . 35 ARG N 1 1 22 13567 1 1 35 ARG NE N -7.038 -2.071 10.346 1.00 . A A . 35 ARG NE 1 1 22 13568 1 1 35 ARG NH1 N -6.081 -0.724 11.954 1.00 . A A . 35 ARG NH1 1 1 22 13569 1 1 35 ARG NH2 N -7.783 -2.153 12.521 1.00 . A A . 35 ARG NH2 1 1 22 13570 1 1 35 ARG O O -6.834 0.910 5.514 1.00 . A A . 35 ARG O 1 1 22 13571 1 1 36 SER C C -3.184 2.028 3.833 1.00 . A A . 36 SER C 1 1 22 13572 1 1 36 SER CA C -4.326 1.875 4.833 1.00 . A A . 36 SER CA 1 1 22 13573 1 1 36 SER CB C -3.925 2.481 6.179 1.00 . A A . 36 SER CB 1 1 22 13574 1 1 36 SER H H -4.007 -0.218 4.862 1.00 . A A . 36 SER H 1 1 22 13575 1 1 36 SER HA H -5.191 2.399 4.456 1.00 . A A . 36 SER HA 1 1 22 13576 1 1 36 SER HB2 H -3.195 3.261 6.017 1.00 . A A . 36 SER HB2 1 1 22 13577 1 1 36 SER HB3 H -4.798 2.899 6.657 1.00 . A A . 36 SER HB3 1 1 22 13578 1 1 36 SER HG H -3.829 1.499 7.871 1.00 . A A . 36 SER HG 1 1 22 13579 1 1 36 SER N N -4.689 0.472 4.998 1.00 . A A . 36 SER N 1 1 22 13580 1 1 36 SER O O -2.440 1.081 3.577 1.00 . A A . 36 SER O 1 1 22 13581 1 1 36 SER OG O -3.361 1.500 7.033 1.00 . A A . 36 SER OG 1 1 22 13582 1 1 37 CYS C C -0.635 3.584 2.976 1.00 . A A . 37 CYS C 1 1 22 13583 1 1 37 CYS CA C -1.999 3.499 2.299 1.00 . A A . 37 CYS CA 1 1 22 13584 1 1 37 CYS CB C -2.290 4.800 1.549 1.00 . A A . 37 CYS CB 1 1 22 13585 1 1 37 CYS H H -3.676 3.940 3.515 1.00 . A A . 37 CYS H 1 1 22 13586 1 1 37 CYS HA H -1.984 2.684 1.592 1.00 . A A . 37 CYS HA 1 1 22 13587 1 1 37 CYS HB2 H -3.343 4.847 1.317 1.00 . A A . 37 CYS HB2 1 1 22 13588 1 1 37 CYS HB3 H -2.028 5.637 2.180 1.00 . A A . 37 CYS HB3 1 1 22 13589 1 1 37 CYS N N -3.052 3.225 3.271 1.00 . A A . 37 CYS N 1 1 22 13590 1 1 37 CYS O O 0.397 3.372 2.340 1.00 . A A . 37 CYS O 1 1 22 13591 1 1 37 CYS SG S -1.370 4.974 -0.014 1.00 . A A . 37 CYS SG 1 1 22 13592 1 1 38 GLU C C 1.373 2.689 5.011 1.00 . A A . 38 GLU C 1 1 22 13593 1 1 38 GLU CA C 0.605 4.007 5.026 1.00 . A A . 38 GLU CA 1 1 22 13594 1 1 38 GLU CB C 0.312 4.424 6.468 1.00 . A A . 38 GLU CB 1 1 22 13595 1 1 38 GLU CD C 1.607 6.485 7.140 1.00 . A A . 38 GLU CD 1 1 22 13596 1 1 38 GLU CG C 0.277 5.930 6.671 1.00 . A A . 38 GLU CG 1 1 22 13597 1 1 38 GLU H H -1.489 4.054 4.723 1.00 . A A . 38 GLU H 1 1 22 13598 1 1 38 GLU HA H 1.212 4.768 4.557 1.00 . A A . 38 GLU HA 1 1 22 13599 1 1 38 GLU HB2 H -0.647 4.021 6.759 1.00 . A A . 38 GLU HB2 1 1 22 13600 1 1 38 GLU HB3 H 1.075 4.013 7.112 1.00 . A A . 38 GLU HB3 1 1 22 13601 1 1 38 GLU HG2 H 0.018 6.401 5.735 1.00 . A A . 38 GLU HG2 1 1 22 13602 1 1 38 GLU HG3 H -0.475 6.163 7.411 1.00 . A A . 38 GLU HG3 1 1 22 13603 1 1 38 GLU N N -0.636 3.896 4.268 1.00 . A A . 38 GLU N 1 1 22 13604 1 1 38 GLU O O 1.190 1.843 5.885 1.00 . A A . 38 GLU O 1 1 22 13605 1 1 38 GLU OE1 O 2.655 5.992 6.672 1.00 . A A . 38 GLU OE1 1 1 22 13606 1 1 38 GLU OE2 O 1.602 7.414 7.975 1.00 . A A . 38 GLU OE2 1 1 22 13607 1 1 39 CYS C C 3.885 1.078 5.125 1.00 . A A . 39 CYS C 1 1 22 13608 1 1 39 CYS CA C 3.029 1.307 3.879 1.00 . A A . 39 CYS CA 1 1 22 13609 1 1 39 CYS CB C 3.925 1.394 2.642 1.00 . A A . 39 CYS CB 1 1 22 13610 1 1 39 CYS H H 2.333 3.234 3.344 1.00 . A A . 39 CYS H 1 1 22 13611 1 1 39 CYS HA H 2.349 0.478 3.761 1.00 . A A . 39 CYS HA 1 1 22 13612 1 1 39 CYS HB2 H 4.532 2.285 2.708 1.00 . A A . 39 CYS HB2 1 1 22 13613 1 1 39 CYS HB3 H 4.570 0.527 2.613 1.00 . A A . 39 CYS HB3 1 1 22 13614 1 1 39 CYS N N 2.232 2.522 4.010 1.00 . A A . 39 CYS N 1 1 22 13615 1 1 39 CYS O O 4.842 1.812 5.370 1.00 . A A . 39 CYS O 1 1 22 13616 1 1 39 CYS SG S 3.013 1.462 1.066 1.00 . A A . 39 CYS SG 1 1 22 13617 1 1 40 PRO C C 5.797 -0.417 6.891 1.00 . A A . 40 PRO C 1 1 22 13618 1 1 40 PRO CA C 4.303 -0.260 7.154 1.00 . A A . 40 PRO CA 1 1 22 13619 1 1 40 PRO CB C 3.700 -1.589 7.614 1.00 . A A . 40 PRO CB 1 1 22 13620 1 1 40 PRO CD C 2.428 -0.878 5.722 1.00 . A A . 40 PRO CD 1 1 22 13621 1 1 40 PRO CG C 2.329 -1.605 7.034 1.00 . A A . 40 PRO CG 1 1 22 13622 1 1 40 PRO HA H 4.150 0.491 7.915 1.00 . A A . 40 PRO HA 1 1 22 13623 1 1 40 PRO HB2 H 4.298 -2.408 7.240 1.00 . A A . 40 PRO HB2 1 1 22 13624 1 1 40 PRO HB3 H 3.671 -1.621 8.693 1.00 . A A . 40 PRO HB3 1 1 22 13625 1 1 40 PRO HD2 H 2.645 -1.570 4.922 1.00 . A A . 40 PRO HD2 1 1 22 13626 1 1 40 PRO HD3 H 1.515 -0.338 5.519 1.00 . A A . 40 PRO HD3 1 1 22 13627 1 1 40 PRO HG2 H 2.009 -2.624 6.874 1.00 . A A . 40 PRO HG2 1 1 22 13628 1 1 40 PRO HG3 H 1.644 -1.094 7.694 1.00 . A A . 40 PRO HG3 1 1 22 13629 1 1 40 PRO N N 3.553 0.053 5.933 1.00 . A A . 40 PRO N 1 1 22 13630 1 1 40 PRO O O 6.249 -0.329 5.750 1.00 . A A . 40 PRO O 1 1 22 13631 1 1 41 SER C C 8.365 -2.289 7.664 1.00 . A A . 41 SER C 1 1 22 13632 1 1 41 SER CA C 8.002 -0.818 7.840 1.00 . A A . 41 SER CA 1 1 22 13633 1 1 41 SER CB C 8.704 -0.252 9.075 1.00 . A A . 41 SER CB 1 1 22 13634 1 1 41 SER H H 6.140 -0.709 8.839 1.00 . A A . 41 SER H 1 1 22 13635 1 1 41 SER HA H 8.331 -0.272 6.968 1.00 . A A . 41 SER HA 1 1 22 13636 1 1 41 SER HB2 H 8.079 -0.403 9.943 1.00 . A A . 41 SER HB2 1 1 22 13637 1 1 41 SER HB3 H 9.646 -0.761 9.217 1.00 . A A . 41 SER HB3 1 1 22 13638 1 1 41 SER HG H 9.513 1.283 8.164 1.00 . A A . 41 SER HG 1 1 22 13639 1 1 41 SER N N 6.559 -0.649 7.955 1.00 . A A . 41 SER N 1 1 22 13640 1 1 41 SER O O 9.352 -2.621 7.007 1.00 . A A . 41 SER O 1 1 22 13641 1 1 41 SER OG O 8.952 1.136 8.930 1.00 . A A . 41 SER OG 1 1 22 13642 1 1 42 TYR C C 7.214 -5.170 6.873 1.00 . A A . 42 TYR C 1 1 22 13643 1 1 42 TYR CA C 7.798 -4.603 8.165 1.00 . A A . 42 TYR CA 1 1 22 13644 1 1 42 TYR CB C 7.187 -5.319 9.371 1.00 . A A . 42 TYR CB 1 1 22 13645 1 1 42 TYR CD1 C 5.423 -3.949 10.548 1.00 . A A . 42 TYR CD1 1 1 22 13646 1 1 42 TYR CD2 C 4.709 -5.583 8.966 1.00 . A A . 42 TYR CD2 1 1 22 13647 1 1 42 TYR CE1 C 4.107 -3.603 10.791 1.00 . A A . 42 TYR CE1 1 1 22 13648 1 1 42 TYR CE2 C 3.391 -5.242 9.203 1.00 . A A . 42 TYR CE2 1 1 22 13649 1 1 42 TYR CG C 5.746 -4.943 9.633 1.00 . A A . 42 TYR CG 1 1 22 13650 1 1 42 TYR CZ C 3.095 -4.252 10.116 1.00 . A A . 42 TYR CZ 1 1 22 13651 1 1 42 TYR H H 6.790 -2.841 8.766 1.00 . A A . 42 TYR H 1 1 22 13652 1 1 42 TYR HA H 8.865 -4.763 8.164 1.00 . A A . 42 TYR HA 1 1 22 13653 1 1 42 TYR HB2 H 7.226 -6.385 9.206 1.00 . A A . 42 TYR HB2 1 1 22 13654 1 1 42 TYR HB3 H 7.761 -5.075 10.253 1.00 . A A . 42 TYR HB3 1 1 22 13655 1 1 42 TYR HD1 H 6.218 -3.442 11.075 1.00 . A A . 42 TYR HD1 1 1 22 13656 1 1 42 TYR HD2 H 4.944 -6.358 8.252 1.00 . A A . 42 TYR HD2 1 1 22 13657 1 1 42 TYR HE1 H 3.876 -2.827 11.506 1.00 . A A . 42 TYR HE1 1 1 22 13658 1 1 42 TYR HE2 H 2.598 -5.751 8.674 1.00 . A A . 42 TYR HE2 1 1 22 13659 1 1 42 TYR HH H 1.477 -4.353 11.149 1.00 . A A . 42 TYR HH 1 1 22 13660 1 1 42 TYR N N 7.561 -3.167 8.256 1.00 . A A . 42 TYR N 1 1 22 13661 1 1 42 TYR O O 6.241 -4.640 6.337 1.00 . A A . 42 TYR O 1 1 22 13662 1 1 42 TYR OH O 1.784 -3.910 10.355 1.00 . A A . 42 TYR OH 1 1 22 13663 1 1 43 PRO C C 5.994 -7.598 5.301 1.00 . A A . 43 PRO C 1 1 22 13664 1 1 43 PRO CA C 7.337 -6.899 5.120 1.00 . A A . 43 PRO CA 1 1 22 13665 1 1 43 PRO CB C 8.433 -7.921 4.810 1.00 . A A . 43 PRO CB 1 1 22 13666 1 1 43 PRO CD C 8.970 -6.957 6.931 1.00 . A A . 43 PRO CD 1 1 22 13667 1 1 43 PRO CG C 9.048 -8.228 6.132 1.00 . A A . 43 PRO CG 1 1 22 13668 1 1 43 PRO HA H 7.265 -6.188 4.310 1.00 . A A . 43 PRO HA 1 1 22 13669 1 1 43 PRO HB2 H 7.994 -8.800 4.363 1.00 . A A . 43 PRO HB2 1 1 22 13670 1 1 43 PRO HB3 H 9.153 -7.487 4.133 1.00 . A A . 43 PRO HB3 1 1 22 13671 1 1 43 PRO HD2 H 8.809 -7.178 7.976 1.00 . A A . 43 PRO HD2 1 1 22 13672 1 1 43 PRO HD3 H 9.869 -6.374 6.801 1.00 . A A . 43 PRO HD3 1 1 22 13673 1 1 43 PRO HG2 H 8.491 -9.014 6.621 1.00 . A A . 43 PRO HG2 1 1 22 13674 1 1 43 PRO HG3 H 10.078 -8.524 5.998 1.00 . A A . 43 PRO HG3 1 1 22 13675 1 1 43 PRO N N 7.804 -6.261 6.355 1.00 . A A . 43 PRO N 1 1 22 13676 1 1 43 PRO O O 5.398 -7.549 6.377 1.00 . A A . 43 PRO O 1 1 22 13677 1 1 44 GLY C C 3.098 -8.023 4.642 1.00 . A A . 44 GLY C 1 1 22 13678 1 1 44 GLY CA C 4.252 -8.946 4.306 1.00 . A A . 44 GLY CA 1 1 22 13679 1 1 44 GLY H H 6.041 -8.252 3.411 1.00 . A A . 44 GLY H 1 1 22 13680 1 1 44 GLY HA2 H 4.315 -9.716 5.062 1.00 . A A . 44 GLY HA2 1 1 22 13681 1 1 44 GLY HA3 H 4.061 -9.411 3.350 1.00 . A A . 44 GLY HA3 1 1 22 13682 1 1 44 GLY N N 5.522 -8.247 4.242 1.00 . A A . 44 GLY N 1 1 22 13683 1 1 44 GLY O O 1.960 -8.520 4.777 1.00 . A A . 44 GLY O 1 1 22 13684 1 1 44 GLY OXT O 3.332 -6.803 4.771 1.00 . A A . 44 GLY OXT 1 1 23 13685 1 1 1 ALA C C -12.390 16.436 1.844 1.00 . A A . 1 ALA C 1 1 23 13686 1 1 1 ALA CA C -12.576 17.730 2.629 1.00 . A A . 1 ALA CA 1 1 23 13687 1 1 1 ALA CB C -12.086 17.553 4.059 1.00 . A A . 1 ALA CB 1 1 23 13688 1 1 1 ALA H1 H -14.346 18.086 1.645 1.00 . A A . 1 ALA H1 1 1 23 13689 1 1 1 ALA H2 H -14.524 17.523 3.254 1.00 . A A . 1 ALA H2 1 1 23 13690 1 1 1 ALA H3 H -14.034 19.142 2.961 1.00 . A A . 1 ALA H3 1 1 23 13691 1 1 1 ALA HA H -11.984 18.506 2.166 1.00 . A A . 1 ALA HA 1 1 23 13692 1 1 1 ALA HB1 H -11.803 18.514 4.463 1.00 . A A . 1 ALA HB1 1 1 23 13693 1 1 1 ALA HB2 H -11.232 16.893 4.068 1.00 . A A . 1 ALA HB2 1 1 23 13694 1 1 1 ALA HB3 H -12.876 17.128 4.660 1.00 . A A . 1 ALA HB3 1 1 23 13695 1 1 1 ALA N N -13.998 18.159 2.621 1.00 . A A . 1 ALA N 1 1 23 13696 1 1 1 ALA O O -12.578 15.342 2.377 1.00 . A A . 1 ALA O 1 1 23 13697 1 1 2 MET C C -10.321 15.126 -0.461 1.00 . A A . 2 MET C 1 1 23 13698 1 1 2 MET CA C -11.809 15.409 -0.285 1.00 . A A . 2 MET CA 1 1 23 13699 1 1 2 MET CB C -12.462 15.634 -1.650 1.00 . A A . 2 MET CB 1 1 23 13700 1 1 2 MET CE C -15.084 12.517 -2.554 1.00 . A A . 2 MET CE 1 1 23 13701 1 1 2 MET CG C -13.043 14.370 -2.262 1.00 . A A . 2 MET CG 1 1 23 13702 1 1 2 MET H H -11.886 17.467 0.206 1.00 . A A . 2 MET H 1 1 23 13703 1 1 2 MET HA H -12.271 14.556 0.189 1.00 . A A . 2 MET HA 1 1 23 13704 1 1 2 MET HB2 H -13.260 16.354 -1.540 1.00 . A A . 2 MET HB2 1 1 23 13705 1 1 2 MET HB3 H -11.722 16.030 -2.330 1.00 . A A . 2 MET HB3 1 1 23 13706 1 1 2 MET HE1 H -14.269 12.271 -3.218 1.00 . A A . 2 MET HE1 1 1 23 13707 1 1 2 MET HE2 H -15.324 11.659 -1.945 1.00 . A A . 2 MET HE2 1 1 23 13708 1 1 2 MET HE3 H -15.949 12.799 -3.136 1.00 . A A . 2 MET HE3 1 1 23 13709 1 1 2 MET HG2 H -13.212 14.540 -3.315 1.00 . A A . 2 MET HG2 1 1 23 13710 1 1 2 MET HG3 H -12.332 13.566 -2.138 1.00 . A A . 2 MET HG3 1 1 23 13711 1 1 2 MET N N -12.020 16.568 0.574 1.00 . A A . 2 MET N 1 1 23 13712 1 1 2 MET O O -9.716 15.525 -1.457 1.00 . A A . 2 MET O 1 1 23 13713 1 1 2 MET SD S -14.603 13.883 -1.499 1.00 . A A . 2 MET SD 1 1 23 13714 1 1 3 ASP C C -8.083 12.847 -0.374 1.00 . A A . 3 ASP C 1 1 23 13715 1 1 3 ASP CA C -8.317 14.100 0.465 1.00 . A A . 3 ASP CA 1 1 23 13716 1 1 3 ASP CB C -7.774 13.890 1.879 1.00 . A A . 3 ASP CB 1 1 23 13717 1 1 3 ASP CG C -7.505 15.198 2.596 1.00 . A A . 3 ASP CG 1 1 23 13718 1 1 3 ASP H H -10.270 14.146 1.281 1.00 . A A . 3 ASP H 1 1 23 13719 1 1 3 ASP HA H -7.796 14.927 0.008 1.00 . A A . 3 ASP HA 1 1 23 13720 1 1 3 ASP HB2 H -8.493 13.327 2.455 1.00 . A A . 3 ASP HB2 1 1 23 13721 1 1 3 ASP HB3 H -6.849 13.334 1.824 1.00 . A A . 3 ASP HB3 1 1 23 13722 1 1 3 ASP N N -9.735 14.436 0.512 1.00 . A A . 3 ASP N 1 1 23 13723 1 1 3 ASP O O -7.101 12.757 -1.111 1.00 . A A . 3 ASP O 1 1 23 13724 1 1 3 ASP OD1 O -6.829 16.069 2.008 1.00 . A A . 3 ASP OD1 1 1 23 13725 1 1 3 ASP OD2 O -7.971 15.353 3.744 1.00 . A A . 3 ASP OD2 1 1 23 13726 1 1 4 CYS C C -7.638 9.860 -0.595 1.00 . A A . 4 CYS C 1 1 23 13727 1 1 4 CYS CA C -8.887 10.635 -1.003 1.00 . A A . 4 CYS CA 1 1 23 13728 1 1 4 CYS CB C -8.860 10.914 -2.508 1.00 . A A . 4 CYS CB 1 1 23 13729 1 1 4 CYS H H -9.753 12.017 0.347 1.00 . A A . 4 CYS H 1 1 23 13730 1 1 4 CYS HA H -9.757 10.039 -0.773 1.00 . A A . 4 CYS HA 1 1 23 13731 1 1 4 CYS HB2 H -8.453 11.900 -2.676 1.00 . A A . 4 CYS HB2 1 1 23 13732 1 1 4 CYS HB3 H -8.229 10.183 -2.991 1.00 . A A . 4 CYS HB3 1 1 23 13733 1 1 4 CYS N N -8.992 11.884 -0.256 1.00 . A A . 4 CYS N 1 1 23 13734 1 1 4 CYS O O -6.568 10.439 -0.409 1.00 . A A . 4 CYS O 1 1 23 13735 1 1 4 CYS SG S -10.497 10.850 -3.306 1.00 . A A . 4 CYS SG 1 1 23 13736 1 1 5 THR C C -5.614 7.641 -1.177 1.00 . A A . 5 THR C 1 1 23 13737 1 1 5 THR CA C -6.667 7.690 -0.074 1.00 . A A . 5 THR CA 1 1 23 13738 1 1 5 THR CB C -7.164 6.277 0.237 1.00 . A A . 5 THR CB 1 1 23 13739 1 1 5 THR CG2 C -8.123 6.224 1.406 1.00 . A A . 5 THR CG2 1 1 23 13740 1 1 5 THR H H -8.661 8.142 -0.622 1.00 . A A . 5 THR H 1 1 23 13741 1 1 5 THR HA H -6.220 8.108 0.815 1.00 . A A . 5 THR HA 1 1 23 13742 1 1 5 THR HB H -6.315 5.653 0.477 1.00 . A A . 5 THR HB 1 1 23 13743 1 1 5 THR HG1 H -8.648 6.186 -1.038 1.00 . A A . 5 THR HG1 1 1 23 13744 1 1 5 THR HG21 H -8.862 7.004 1.301 1.00 . A A . 5 THR HG21 1 1 23 13745 1 1 5 THR HG22 H -8.615 5.262 1.424 1.00 . A A . 5 THR HG22 1 1 23 13746 1 1 5 THR HG23 H -7.577 6.366 2.326 1.00 . A A . 5 THR HG23 1 1 23 13747 1 1 5 THR N N -7.783 8.545 -0.459 1.00 . A A . 5 THR N 1 1 23 13748 1 1 5 THR O O -5.513 6.657 -1.911 1.00 . A A . 5 THR O 1 1 23 13749 1 1 5 THR OG1 O -7.823 5.719 -0.886 1.00 . A A . 5 THR OG1 1 1 23 13750 1 1 6 THR C C -2.458 8.280 -1.755 1.00 . A A . 6 THR C 1 1 23 13751 1 1 6 THR CA C -3.787 8.790 -2.303 1.00 . A A . 6 THR CA 1 1 23 13752 1 1 6 THR CB C -3.631 10.230 -2.792 1.00 . A A . 6 THR CB 1 1 23 13753 1 1 6 THR CG2 C -4.886 10.784 -3.431 1.00 . A A . 6 THR CG2 1 1 23 13754 1 1 6 THR H H -4.961 9.463 -0.675 1.00 . A A . 6 THR H 1 1 23 13755 1 1 6 THR HA H -4.083 8.167 -3.133 1.00 . A A . 6 THR HA 1 1 23 13756 1 1 6 THR HB H -2.842 10.266 -3.529 1.00 . A A . 6 THR HB 1 1 23 13757 1 1 6 THR HG1 H -4.022 11.170 -1.119 1.00 . A A . 6 THR HG1 1 1 23 13758 1 1 6 THR HG21 H -5.356 10.016 -4.028 1.00 . A A . 6 THR HG21 1 1 23 13759 1 1 6 THR HG22 H -5.570 11.109 -2.660 1.00 . A A . 6 THR HG22 1 1 23 13760 1 1 6 THR HG23 H -4.630 11.623 -4.061 1.00 . A A . 6 THR HG23 1 1 23 13761 1 1 6 THR N N -4.832 8.710 -1.289 1.00 . A A . 6 THR N 1 1 23 13762 1 1 6 THR O O -1.835 8.924 -0.911 1.00 . A A . 6 THR O 1 1 23 13763 1 1 6 THR OG1 O -3.279 11.089 -1.722 1.00 . A A . 6 THR OG1 1 1 23 13764 1 1 7 GLY C C -0.425 5.267 -2.532 1.00 . A A . 7 GLY C 1 1 23 13765 1 1 7 GLY CA C -0.777 6.543 -1.790 1.00 . A A . 7 GLY CA 1 1 23 13766 1 1 7 GLY H H -2.569 6.651 -2.913 1.00 . A A . 7 GLY H 1 1 23 13767 1 1 7 GLY HA2 H -0.855 6.323 -0.735 1.00 . A A . 7 GLY HA2 1 1 23 13768 1 1 7 GLY HA3 H 0.013 7.264 -1.940 1.00 . A A . 7 GLY HA3 1 1 23 13769 1 1 7 GLY N N -2.030 7.120 -2.242 1.00 . A A . 7 GLY N 1 1 23 13770 1 1 7 GLY O O -1.132 4.870 -3.457 1.00 . A A . 7 GLY O 1 1 23 13771 1 1 8 PRO C C 0.174 2.187 -2.486 1.00 . A A . 8 PRO C 1 1 23 13772 1 1 8 PRO CA C 1.108 3.353 -2.789 1.00 . A A . 8 PRO CA 1 1 23 13773 1 1 8 PRO CB C 2.491 3.103 -2.184 1.00 . A A . 8 PRO CB 1 1 23 13774 1 1 8 PRO CD C 1.577 4.997 -1.049 1.00 . A A . 8 PRO CD 1 1 23 13775 1 1 8 PRO CG C 2.457 3.792 -0.864 1.00 . A A . 8 PRO CG 1 1 23 13776 1 1 8 PRO HA H 1.197 3.473 -3.859 1.00 . A A . 8 PRO HA 1 1 23 13777 1 1 8 PRO HB2 H 2.650 2.040 -2.072 1.00 . A A . 8 PRO HB2 1 1 23 13778 1 1 8 PRO HB3 H 3.250 3.521 -2.827 1.00 . A A . 8 PRO HB3 1 1 23 13779 1 1 8 PRO HD2 H 1.020 5.200 -0.145 1.00 . A A . 8 PRO HD2 1 1 23 13780 1 1 8 PRO HD3 H 2.167 5.856 -1.331 1.00 . A A . 8 PRO HD3 1 1 23 13781 1 1 8 PRO HG2 H 2.039 3.133 -0.117 1.00 . A A . 8 PRO HG2 1 1 23 13782 1 1 8 PRO HG3 H 3.454 4.096 -0.582 1.00 . A A . 8 PRO HG3 1 1 23 13783 1 1 8 PRO N N 0.674 4.597 -2.144 1.00 . A A . 8 PRO N 1 1 23 13784 1 1 8 PRO O O 0.057 1.251 -3.278 1.00 . A A . 8 PRO O 1 1 23 13785 1 1 9 CYS C C -2.856 1.684 -0.990 1.00 . A A . 9 CYS C 1 1 23 13786 1 1 9 CYS CA C -1.412 1.196 -0.928 1.00 . A A . 9 CYS CA 1 1 23 13787 1 1 9 CYS CB C -1.083 0.720 0.487 1.00 . A A . 9 CYS CB 1 1 23 13788 1 1 9 CYS H H -0.353 3.019 -0.747 1.00 . A A . 9 CYS H 1 1 23 13789 1 1 9 CYS HA H -1.295 0.369 -1.613 1.00 . A A . 9 CYS HA 1 1 23 13790 1 1 9 CYS HB2 H -0.964 1.579 1.130 1.00 . A A . 9 CYS HB2 1 1 23 13791 1 1 9 CYS HB3 H -1.898 0.113 0.854 1.00 . A A . 9 CYS HB3 1 1 23 13792 1 1 9 CYS N N -0.488 2.248 -1.336 1.00 . A A . 9 CYS N 1 1 23 13793 1 1 9 CYS O O -3.690 1.289 -0.175 1.00 . A A . 9 CYS O 1 1 23 13794 1 1 9 CYS SG S 0.442 -0.271 0.603 1.00 . A A . 9 CYS SG 1 1 23 13795 1 1 10 CYS C C -4.589 3.911 -3.406 1.00 . A A . 10 CYS C 1 1 23 13796 1 1 10 CYS CA C -4.487 3.087 -2.126 1.00 . A A . 10 CYS CA 1 1 23 13797 1 1 10 CYS CB C -4.866 3.949 -0.921 1.00 . A A . 10 CYS CB 1 1 23 13798 1 1 10 CYS H H -2.436 2.824 -2.579 1.00 . A A . 10 CYS H 1 1 23 13799 1 1 10 CYS HA H -5.174 2.256 -2.193 1.00 . A A . 10 CYS HA 1 1 23 13800 1 1 10 CYS HB2 H -5.738 4.536 -1.167 1.00 . A A . 10 CYS HB2 1 1 23 13801 1 1 10 CYS HB3 H -5.098 3.304 -0.086 1.00 . A A . 10 CYS HB3 1 1 23 13802 1 1 10 CYS N N -3.144 2.546 -1.960 1.00 . A A . 10 CYS N 1 1 23 13803 1 1 10 CYS O O -3.932 4.943 -3.547 1.00 . A A . 10 CYS O 1 1 23 13804 1 1 10 CYS SG S -3.558 5.100 -0.388 1.00 . A A . 10 CYS SG 1 1 23 13805 1 1 11 ARG C C -7.093 4.272 -5.930 1.00 . A A . 11 ARG C 1 1 23 13806 1 1 11 ARG CA C -5.609 4.140 -5.605 1.00 . A A . 11 ARG CA 1 1 23 13807 1 1 11 ARG CB C -4.891 3.394 -6.732 1.00 . A A . 11 ARG CB 1 1 23 13808 1 1 11 ARG CD C -3.662 3.554 -8.917 1.00 . A A . 11 ARG CD 1 1 23 13809 1 1 11 ARG CG C -4.582 4.265 -7.938 1.00 . A A . 11 ARG CG 1 1 23 13810 1 1 11 ARG CZ C -1.277 3.613 -9.533 1.00 . A A . 11 ARG CZ 1 1 23 13811 1 1 11 ARG H H -5.914 2.620 -4.164 1.00 . A A . 11 ARG H 1 1 23 13812 1 1 11 ARG HA H -5.184 5.128 -5.511 1.00 . A A . 11 ARG HA 1 1 23 13813 1 1 11 ARG HB2 H -3.961 3.000 -6.351 1.00 . A A . 11 ARG HB2 1 1 23 13814 1 1 11 ARG HB3 H -5.513 2.573 -7.057 1.00 . A A . 11 ARG HB3 1 1 23 13815 1 1 11 ARG HD2 H -3.816 2.489 -8.827 1.00 . A A . 11 ARG HD2 1 1 23 13816 1 1 11 ARG HD3 H -3.912 3.870 -9.920 1.00 . A A . 11 ARG HD3 1 1 23 13817 1 1 11 ARG HE H -2.027 4.253 -7.798 1.00 . A A . 11 ARG HE 1 1 23 13818 1 1 11 ARG HG2 H -5.506 4.510 -8.440 1.00 . A A . 11 ARG HG2 1 1 23 13819 1 1 11 ARG HG3 H -4.102 5.173 -7.601 1.00 . A A . 11 ARG HG3 1 1 23 13820 1 1 11 ARG HH11 H -2.491 2.842 -10.956 1.00 . A A . 11 ARG HH11 1 1 23 13821 1 1 11 ARG HH12 H -0.809 2.895 -11.364 1.00 . A A . 11 ARG HH12 1 1 23 13822 1 1 11 ARG HH21 H 0.186 4.323 -8.333 1.00 . A A . 11 ARG HH21 1 1 23 13823 1 1 11 ARG HH22 H 0.711 3.735 -9.876 1.00 . A A . 11 ARG HH22 1 1 23 13824 1 1 11 ARG N N -5.418 3.448 -4.336 1.00 . A A . 11 ARG N 1 1 23 13825 1 1 11 ARG NE N -2.255 3.853 -8.663 1.00 . A A . 11 ARG NE 1 1 23 13826 1 1 11 ARG NH1 N -1.548 3.072 -10.715 1.00 . A A . 11 ARG NH1 1 1 23 13827 1 1 11 ARG NH2 N -0.024 3.915 -9.222 1.00 . A A . 11 ARG NH2 1 1 23 13828 1 1 11 ARG O O -7.919 3.521 -5.411 1.00 . A A . 11 ARG O 1 1 23 13829 1 1 12 GLN C C -9.641 5.988 -6.012 1.00 . A A . 12 GLN C 1 1 23 13830 1 1 12 GLN CA C -8.815 5.458 -7.182 1.00 . A A . 12 GLN CA 1 1 23 13831 1 1 12 GLN CB C -9.436 4.164 -7.701 1.00 . A A . 12 GLN CB 1 1 23 13832 1 1 12 GLN CD C -11.336 3.157 -9.026 1.00 . A A . 12 GLN CD 1 1 23 13833 1 1 12 GLN CG C -10.463 4.376 -8.801 1.00 . A A . 12 GLN CG 1 1 23 13834 1 1 12 GLN H H -6.723 5.797 -7.171 1.00 . A A . 12 GLN H 1 1 23 13835 1 1 12 GLN HA H -8.821 6.192 -7.974 1.00 . A A . 12 GLN HA 1 1 23 13836 1 1 12 GLN HB2 H -8.650 3.532 -8.086 1.00 . A A . 12 GLN HB2 1 1 23 13837 1 1 12 GLN HB3 H -9.919 3.661 -6.877 1.00 . A A . 12 GLN HB3 1 1 23 13838 1 1 12 GLN HE21 H -12.975 4.268 -8.844 1.00 . A A . 12 GLN HE21 1 1 23 13839 1 1 12 GLN HE22 H -13.237 2.587 -9.146 1.00 . A A . 12 GLN HE22 1 1 23 13840 1 1 12 GLN HG2 H -11.096 5.208 -8.530 1.00 . A A . 12 GLN HG2 1 1 23 13841 1 1 12 GLN HG3 H -9.944 4.604 -9.721 1.00 . A A . 12 GLN HG3 1 1 23 13842 1 1 12 GLN N N -7.426 5.230 -6.791 1.00 . A A . 12 GLN N 1 1 23 13843 1 1 12 GLN NE2 N -12.649 3.357 -9.003 1.00 . A A . 12 GLN NE2 1 1 23 13844 1 1 12 GLN O O -10.870 6.015 -6.071 1.00 . A A . 12 GLN O 1 1 23 13845 1 1 12 GLN OE1 O -10.837 2.049 -9.220 1.00 . A A . 12 GLN OE1 1 1 23 13846 1 1 13 CYS C C -10.231 5.799 -2.933 1.00 . A A . 13 CYS C 1 1 23 13847 1 1 13 CYS CA C -9.623 6.928 -3.757 1.00 . A A . 13 CYS CA 1 1 23 13848 1 1 13 CYS CB C -10.707 7.940 -4.141 1.00 . A A . 13 CYS CB 1 1 23 13849 1 1 13 CYS H H -7.983 6.350 -4.962 1.00 . A A . 13 CYS H 1 1 23 13850 1 1 13 CYS HA H -8.875 7.428 -3.159 1.00 . A A . 13 CYS HA 1 1 23 13851 1 1 13 CYS HB2 H -10.339 8.567 -4.939 1.00 . A A . 13 CYS HB2 1 1 23 13852 1 1 13 CYS HB3 H -11.582 7.406 -4.484 1.00 . A A . 13 CYS HB3 1 1 23 13853 1 1 13 CYS N N -8.958 6.403 -4.948 1.00 . A A . 13 CYS N 1 1 23 13854 1 1 13 CYS O O -11.321 5.937 -2.378 1.00 . A A . 13 CYS O 1 1 23 13855 1 1 13 CYS SG S -11.223 9.030 -2.775 1.00 . A A . 13 CYS SG 1 1 23 13856 1 1 14 LYS C C -8.808 2.635 -1.698 1.00 . A A . 14 LYS C 1 1 23 13857 1 1 14 LYS CA C -9.980 3.525 -2.097 1.00 . A A . 14 LYS CA 1 1 23 13858 1 1 14 LYS CB C -10.992 2.723 -2.919 1.00 . A A . 14 LYS CB 1 1 23 13859 1 1 14 LYS CD C -13.026 2.049 -1.605 1.00 . A A . 14 LYS CD 1 1 23 13860 1 1 14 LYS CE C -14.460 2.399 -1.243 1.00 . A A . 14 LYS CE 1 1 23 13861 1 1 14 LYS CG C -12.439 3.049 -2.588 1.00 . A A . 14 LYS CG 1 1 23 13862 1 1 14 LYS H H -8.653 4.632 -3.318 1.00 . A A . 14 LYS H 1 1 23 13863 1 1 14 LYS HA H -10.463 3.888 -1.202 1.00 . A A . 14 LYS HA 1 1 23 13864 1 1 14 LYS HB2 H -10.830 2.927 -3.967 1.00 . A A . 14 LYS HB2 1 1 23 13865 1 1 14 LYS HB3 H -10.833 1.670 -2.737 1.00 . A A . 14 LYS HB3 1 1 23 13866 1 1 14 LYS HD2 H -13.008 1.066 -2.053 1.00 . A A . 14 LYS HD2 1 1 23 13867 1 1 14 LYS HD3 H -12.427 2.048 -0.707 1.00 . A A . 14 LYS HD3 1 1 23 13868 1 1 14 LYS HE2 H -14.565 3.474 -1.238 1.00 . A A . 14 LYS HE2 1 1 23 13869 1 1 14 LYS HE3 H -15.119 1.977 -1.988 1.00 . A A . 14 LYS HE3 1 1 23 13870 1 1 14 LYS HG2 H -12.485 4.036 -2.152 1.00 . A A . 14 LYS HG2 1 1 23 13871 1 1 14 LYS HG3 H -13.020 3.029 -3.499 1.00 . A A . 14 LYS HG3 1 1 23 13872 1 1 14 LYS HZ1 H -14.241 1.056 0.342 1.00 . A A . 14 LYS HZ1 1 1 23 13873 1 1 14 LYS HZ2 H -14.718 2.608 0.819 1.00 . A A . 14 LYS HZ2 1 1 23 13874 1 1 14 LYS HZ3 H -15.834 1.566 0.092 1.00 . A A . 14 LYS HZ3 1 1 23 13875 1 1 14 LYS N N -9.516 4.681 -2.855 1.00 . A A . 14 LYS N 1 1 23 13876 1 1 14 LYS NZ N -14.840 1.870 0.096 1.00 . A A . 14 LYS NZ 1 1 23 13877 1 1 14 LYS O O -7.881 2.426 -2.480 1.00 . A A . 14 LYS O 1 1 23 13878 1 1 15 LEU C C -7.560 0.070 -0.920 1.00 . A A . 15 LEU C 1 1 23 13879 1 1 15 LEU CA C -7.795 1.244 0.026 1.00 . A A . 15 LEU CA 1 1 23 13880 1 1 15 LEU CB C -8.147 0.732 1.425 1.00 . A A . 15 LEU CB 1 1 23 13881 1 1 15 LEU CD1 C -5.755 0.430 2.113 1.00 . A A . 15 LEU CD1 1 1 23 13882 1 1 15 LEU CD2 C -6.978 2.521 2.735 1.00 . A A . 15 LEU CD2 1 1 23 13883 1 1 15 LEU CG C -7.100 1.023 2.502 1.00 . A A . 15 LEU CG 1 1 23 13884 1 1 15 LEU H H -9.620 2.316 0.101 1.00 . A A . 15 LEU H 1 1 23 13885 1 1 15 LEU HA H -6.889 1.829 0.084 1.00 . A A . 15 LEU HA 1 1 23 13886 1 1 15 LEU HB2 H -9.079 1.187 1.727 1.00 . A A . 15 LEU HB2 1 1 23 13887 1 1 15 LEU HB3 H -8.289 -0.337 1.373 1.00 . A A . 15 LEU HB3 1 1 23 13888 1 1 15 LEU HD11 H -5.692 0.356 1.037 1.00 . A A . 15 LEU HD11 1 1 23 13889 1 1 15 LEU HD12 H -4.962 1.067 2.477 1.00 . A A . 15 LEU HD12 1 1 23 13890 1 1 15 LEU HD13 H -5.656 -0.553 2.548 1.00 . A A . 15 LEU HD13 1 1 23 13891 1 1 15 LEU HD21 H -7.881 3.012 2.403 1.00 . A A . 15 LEU HD21 1 1 23 13892 1 1 15 LEU HD22 H -6.831 2.712 3.787 1.00 . A A . 15 LEU HD22 1 1 23 13893 1 1 15 LEU HD23 H -6.135 2.904 2.179 1.00 . A A . 15 LEU HD23 1 1 23 13894 1 1 15 LEU HG H -7.411 0.564 3.430 1.00 . A A . 15 LEU HG 1 1 23 13895 1 1 15 LEU N N -8.855 2.113 -0.476 1.00 . A A . 15 LEU N 1 1 23 13896 1 1 15 LEU O O -8.470 -0.714 -1.191 1.00 . A A . 15 LEU O 1 1 23 13897 1 1 16 LYS C C -6.272 -2.487 -1.720 1.00 . A A . 16 LYS C 1 1 23 13898 1 1 16 LYS CA C -5.979 -1.121 -2.338 1.00 . A A . 16 LYS CA 1 1 23 13899 1 1 16 LYS CB C -4.500 -1.027 -2.718 1.00 . A A . 16 LYS CB 1 1 23 13900 1 1 16 LYS CD C -3.074 -0.550 -4.731 1.00 . A A . 16 LYS CD 1 1 23 13901 1 1 16 LYS CE C -2.993 -0.663 -6.245 1.00 . A A . 16 LYS CE 1 1 23 13902 1 1 16 LYS CG C -4.222 -1.374 -4.171 1.00 . A A . 16 LYS CG 1 1 23 13903 1 1 16 LYS H H -5.652 0.613 -1.168 1.00 . A A . 16 LYS H 1 1 23 13904 1 1 16 LYS HA H -6.578 -1.006 -3.229 1.00 . A A . 16 LYS HA 1 1 23 13905 1 1 16 LYS HB2 H -4.157 -0.018 -2.540 1.00 . A A . 16 LYS HB2 1 1 23 13906 1 1 16 LYS HB3 H -3.936 -1.705 -2.094 1.00 . A A . 16 LYS HB3 1 1 23 13907 1 1 16 LYS HD2 H -3.224 0.486 -4.466 1.00 . A A . 16 LYS HD2 1 1 23 13908 1 1 16 LYS HD3 H -2.147 -0.903 -4.302 1.00 . A A . 16 LYS HD3 1 1 23 13909 1 1 16 LYS HE2 H -2.250 0.032 -6.606 1.00 . A A . 16 LYS HE2 1 1 23 13910 1 1 16 LYS HE3 H -2.698 -1.670 -6.502 1.00 . A A . 16 LYS HE3 1 1 23 13911 1 1 16 LYS HG2 H -3.966 -2.421 -4.239 1.00 . A A . 16 LYS HG2 1 1 23 13912 1 1 16 LYS HG3 H -5.110 -1.181 -4.754 1.00 . A A . 16 LYS HG3 1 1 23 13913 1 1 16 LYS HZ1 H -4.706 0.507 -6.489 1.00 . A A . 16 LYS HZ1 1 1 23 13914 1 1 16 LYS HZ2 H -4.164 -0.219 -7.917 1.00 . A A . 16 LYS HZ2 1 1 23 13915 1 1 16 LYS HZ3 H -4.962 -1.146 -6.749 1.00 . A A . 16 LYS HZ3 1 1 23 13916 1 1 16 LYS N N -6.334 -0.044 -1.421 1.00 . A A . 16 LYS N 1 1 23 13917 1 1 16 LYS NZ N -4.298 -0.359 -6.895 1.00 . A A . 16 LYS NZ 1 1 23 13918 1 1 16 LYS O O -6.189 -2.657 -0.504 1.00 . A A . 16 LYS O 1 1 23 13919 1 1 17 PRO C C -5.813 -5.413 -1.215 1.00 . A A . 17 PRO C 1 1 23 13920 1 1 17 PRO CA C -6.928 -4.836 -2.081 1.00 . A A . 17 PRO CA 1 1 23 13921 1 1 17 PRO CB C -7.071 -5.643 -3.373 1.00 . A A . 17 PRO CB 1 1 23 13922 1 1 17 PRO CD C -6.745 -3.366 -4.018 1.00 . A A . 17 PRO CD 1 1 23 13923 1 1 17 PRO CG C -7.439 -4.640 -4.410 1.00 . A A . 17 PRO CG 1 1 23 13924 1 1 17 PRO HA H -7.858 -4.862 -1.532 1.00 . A A . 17 PRO HA 1 1 23 13925 1 1 17 PRO HB2 H -6.132 -6.126 -3.605 1.00 . A A . 17 PRO HB2 1 1 23 13926 1 1 17 PRO HB3 H -7.844 -6.387 -3.253 1.00 . A A . 17 PRO HB3 1 1 23 13927 1 1 17 PRO HD2 H -5.773 -3.307 -4.484 1.00 . A A . 17 PRO HD2 1 1 23 13928 1 1 17 PRO HD3 H -7.347 -2.510 -4.287 1.00 . A A . 17 PRO HD3 1 1 23 13929 1 1 17 PRO HG2 H -7.096 -4.971 -5.380 1.00 . A A . 17 PRO HG2 1 1 23 13930 1 1 17 PRO HG3 H -8.509 -4.497 -4.419 1.00 . A A . 17 PRO HG3 1 1 23 13931 1 1 17 PRO N N -6.622 -3.482 -2.553 1.00 . A A . 17 PRO N 1 1 23 13932 1 1 17 PRO O O -4.631 -5.199 -1.484 1.00 . A A . 17 PRO O 1 1 23 13933 1 1 18 ALA C C -4.347 -7.757 -0.009 1.00 . A A . 18 ALA C 1 1 23 13934 1 1 18 ALA CA C -5.229 -6.756 0.728 1.00 . A A . 18 ALA CA 1 1 23 13935 1 1 18 ALA CB C -5.944 -7.433 1.888 1.00 . A A . 18 ALA CB 1 1 23 13936 1 1 18 ALA H H -7.154 -6.283 -0.014 1.00 . A A . 18 ALA H 1 1 23 13937 1 1 18 ALA HA H -4.606 -5.969 1.129 1.00 . A A . 18 ALA HA 1 1 23 13938 1 1 18 ALA HB1 H -6.673 -6.755 2.306 1.00 . A A . 18 ALA HB1 1 1 23 13939 1 1 18 ALA HB2 H -5.224 -7.700 2.648 1.00 . A A . 18 ALA HB2 1 1 23 13940 1 1 18 ALA HB3 H -6.441 -8.324 1.534 1.00 . A A . 18 ALA HB3 1 1 23 13941 1 1 18 ALA N N -6.197 -6.147 -0.176 1.00 . A A . 18 ALA N 1 1 23 13942 1 1 18 ALA O O -4.831 -8.766 -0.522 1.00 . A A . 18 ALA O 1 1 23 13943 1 1 19 GLY C C -1.303 -7.652 -1.805 1.00 . A A . 19 GLY C 1 1 23 13944 1 1 19 GLY CA C -2.120 -8.358 -0.737 1.00 . A A . 19 GLY CA 1 1 23 13945 1 1 19 GLY H H -2.721 -6.654 0.368 1.00 . A A . 19 GLY H 1 1 23 13946 1 1 19 GLY HA2 H -2.677 -9.160 -1.198 1.00 . A A . 19 GLY HA2 1 1 23 13947 1 1 19 GLY HA3 H -1.446 -8.779 -0.006 1.00 . A A . 19 GLY HA3 1 1 23 13948 1 1 19 GLY N N -3.050 -7.472 -0.059 1.00 . A A . 19 GLY N 1 1 23 13949 1 1 19 GLY O O -0.501 -8.281 -2.494 1.00 . A A . 19 GLY O 1 1 23 13950 1 1 20 THR C C 0.680 -5.382 -2.519 1.00 . A A . 20 THR C 1 1 23 13951 1 1 20 THR CA C -0.774 -5.562 -2.936 1.00 . A A . 20 THR CA 1 1 23 13952 1 1 20 THR CB C -1.436 -4.197 -3.128 1.00 . A A . 20 THR CB 1 1 23 13953 1 1 20 THR CG2 C -1.187 -3.597 -4.495 1.00 . A A . 20 THR CG2 1 1 23 13954 1 1 20 THR H H -2.153 -5.893 -1.368 1.00 . A A . 20 THR H 1 1 23 13955 1 1 20 THR HA H -0.804 -6.101 -3.871 1.00 . A A . 20 THR HA 1 1 23 13956 1 1 20 THR HB H -1.044 -3.512 -2.390 1.00 . A A . 20 THR HB 1 1 23 13957 1 1 20 THR HG1 H -3.108 -3.711 -2.231 1.00 . A A . 20 THR HG1 1 1 23 13958 1 1 20 THR HG21 H -1.160 -4.384 -5.234 1.00 . A A . 20 THR HG21 1 1 23 13959 1 1 20 THR HG22 H -1.980 -2.905 -4.734 1.00 . A A . 20 THR HG22 1 1 23 13960 1 1 20 THR HG23 H -0.242 -3.074 -4.491 1.00 . A A . 20 THR HG23 1 1 23 13961 1 1 20 THR N N -1.503 -6.343 -1.945 1.00 . A A . 20 THR N 1 1 23 13962 1 1 20 THR O O 1.070 -5.754 -1.412 1.00 . A A . 20 THR O 1 1 23 13963 1 1 20 THR OG1 O -2.838 -4.289 -2.948 1.00 . A A . 20 THR OG1 1 1 23 13964 1 1 21 THR C C 3.172 -3.105 -2.891 1.00 . A A . 21 THR C 1 1 23 13965 1 1 21 THR CA C 2.893 -4.584 -3.134 1.00 . A A . 21 THR CA 1 1 23 13966 1 1 21 THR CB C 3.754 -5.097 -4.291 1.00 . A A . 21 THR CB 1 1 23 13967 1 1 21 THR CG2 C 4.581 -6.308 -3.922 1.00 . A A . 21 THR CG2 1 1 23 13968 1 1 21 THR H H 1.112 -4.537 -4.278 1.00 . A A . 21 THR H 1 1 23 13969 1 1 21 THR HA H 3.146 -5.135 -2.241 1.00 . A A . 21 THR HA 1 1 23 13970 1 1 21 THR HB H 4.433 -4.315 -4.599 1.00 . A A . 21 THR HB 1 1 23 13971 1 1 21 THR HG1 H 2.364 -6.170 -5.159 1.00 . A A . 21 THR HG1 1 1 23 13972 1 1 21 THR HG21 H 3.952 -7.036 -3.430 1.00 . A A . 21 THR HG21 1 1 23 13973 1 1 21 THR HG22 H 5.003 -6.742 -4.816 1.00 . A A . 21 THR HG22 1 1 23 13974 1 1 21 THR HG23 H 5.377 -6.010 -3.256 1.00 . A A . 21 THR HG23 1 1 23 13975 1 1 21 THR N N 1.480 -4.811 -3.412 1.00 . A A . 21 THR N 1 1 23 13976 1 1 21 THR O O 2.339 -2.248 -3.187 1.00 . A A . 21 THR O 1 1 23 13977 1 1 21 THR OG1 O 2.949 -5.449 -5.403 1.00 . A A . 21 THR OG1 1 1 23 13978 1 1 22 CYS C C 5.766 -0.943 -3.079 1.00 . A A . 22 CYS C 1 1 23 13979 1 1 22 CYS CA C 4.740 -1.439 -2.064 1.00 . A A . 22 CYS CA 1 1 23 13980 1 1 22 CYS CB C 5.309 -1.333 -0.647 1.00 . A A . 22 CYS CB 1 1 23 13981 1 1 22 CYS H H 4.970 -3.541 -2.135 1.00 . A A . 22 CYS H 1 1 23 13982 1 1 22 CYS HA H 3.856 -0.824 -2.134 1.00 . A A . 22 CYS HA 1 1 23 13983 1 1 22 CYS HB2 H 5.130 -2.261 -0.125 1.00 . A A . 22 CYS HB2 1 1 23 13984 1 1 22 CYS HB3 H 6.374 -1.159 -0.705 1.00 . A A . 22 CYS HB3 1 1 23 13985 1 1 22 CYS N N 4.349 -2.813 -2.349 1.00 . A A . 22 CYS N 1 1 23 13986 1 1 22 CYS O O 5.462 -0.099 -3.922 1.00 . A A . 22 CYS O 1 1 23 13987 1 1 22 CYS SG S 4.582 0.008 0.349 1.00 . A A . 22 CYS SG 1 1 23 13988 1 1 23 TRP C C 8.837 -2.303 -4.370 1.00 . A A . 23 TRP C 1 1 23 13989 1 1 23 TRP CA C 8.052 -1.084 -3.901 1.00 . A A . 23 TRP CA 1 1 23 13990 1 1 23 TRP CB C 8.991 -0.086 -3.221 1.00 . A A . 23 TRP CB 1 1 23 13991 1 1 23 TRP CD1 C 10.024 0.614 -5.460 1.00 . A A . 23 TRP CD1 1 1 23 13992 1 1 23 TRP CD2 C 11.434 0.720 -3.724 1.00 . A A . 23 TRP CD2 1 1 23 13993 1 1 23 TRP CE2 C 12.119 1.127 -4.884 1.00 . A A . 23 TRP CE2 1 1 23 13994 1 1 23 TRP CE3 C 12.120 0.706 -2.506 1.00 . A A . 23 TRP CE3 1 1 23 13995 1 1 23 TRP CG C 10.094 0.397 -4.114 1.00 . A A . 23 TRP CG 1 1 23 13996 1 1 23 TRP CH2 C 14.103 1.492 -3.656 1.00 . A A . 23 TRP CH2 1 1 23 13997 1 1 23 TRP CZ2 C 13.456 1.515 -4.861 1.00 . A A . 23 TRP CZ2 1 1 23 13998 1 1 23 TRP CZ3 C 13.447 1.092 -2.485 1.00 . A A . 23 TRP CZ3 1 1 23 13999 1 1 23 TRP H H 7.163 -2.141 -2.298 1.00 . A A . 23 TRP H 1 1 23 14000 1 1 23 TRP HA H 7.602 -0.613 -4.758 1.00 . A A . 23 TRP HA 1 1 23 14001 1 1 23 TRP HB2 H 8.421 0.774 -2.903 1.00 . A A . 23 TRP HB2 1 1 23 14002 1 1 23 TRP HB3 H 9.440 -0.554 -2.358 1.00 . A A . 23 TRP HB3 1 1 23 14003 1 1 23 TRP HD1 H 9.136 0.459 -6.055 1.00 . A A . 23 TRP HD1 1 1 23 14004 1 1 23 TRP HE1 H 11.438 1.279 -6.863 1.00 . A A . 23 TRP HE1 1 1 23 14005 1 1 23 TRP HE3 H 11.631 0.400 -1.593 1.00 . A A . 23 TRP HE3 1 1 23 14006 1 1 23 TRP HH2 H 15.141 1.785 -3.593 1.00 . A A . 23 TRP HH2 1 1 23 14007 1 1 23 TRP HZ2 H 13.976 1.827 -5.755 1.00 . A A . 23 TRP HZ2 1 1 23 14008 1 1 23 TRP HZ3 H 13.994 1.087 -1.554 1.00 . A A . 23 TRP HZ3 1 1 23 14009 1 1 23 TRP N N 6.981 -1.473 -2.991 1.00 . A A . 23 TRP N 1 1 23 14010 1 1 23 TRP NE1 N 11.237 1.054 -5.930 1.00 . A A . 23 TRP NE1 1 1 23 14011 1 1 23 TRP O O 8.743 -2.710 -5.528 1.00 . A A . 23 TRP O 1 1 23 14012 1 1 24 ARG C C 11.407 -3.753 -4.894 1.00 . A A . 24 ARG C 1 1 23 14013 1 1 24 ARG CA C 10.416 -4.055 -3.774 1.00 . A A . 24 ARG CA 1 1 23 14014 1 1 24 ARG CB C 9.516 -5.225 -4.176 1.00 . A A . 24 ARG CB 1 1 23 14015 1 1 24 ARG CD C 9.551 -7.390 -5.449 1.00 . A A . 24 ARG CD 1 1 23 14016 1 1 24 ARG CG C 10.275 -6.514 -4.440 1.00 . A A . 24 ARG CG 1 1 23 14017 1 1 24 ARG CZ C 9.498 -9.778 -6.058 1.00 . A A . 24 ARG CZ 1 1 23 14018 1 1 24 ARG H H 9.640 -2.507 -2.557 1.00 . A A . 24 ARG H 1 1 23 14019 1 1 24 ARG HA H 10.967 -4.325 -2.886 1.00 . A A . 24 ARG HA 1 1 23 14020 1 1 24 ARG HB2 H 8.805 -5.406 -3.383 1.00 . A A . 24 ARG HB2 1 1 23 14021 1 1 24 ARG HB3 H 8.978 -4.958 -5.074 1.00 . A A . 24 ARG HB3 1 1 23 14022 1 1 24 ARG HD2 H 8.513 -7.466 -5.163 1.00 . A A . 24 ARG HD2 1 1 23 14023 1 1 24 ARG HD3 H 9.622 -6.929 -6.423 1.00 . A A . 24 ARG HD3 1 1 23 14024 1 1 24 ARG HE H 11.017 -8.864 -5.142 1.00 . A A . 24 ARG HE 1 1 23 14025 1 1 24 ARG HG2 H 11.254 -6.272 -4.826 1.00 . A A . 24 ARG HG2 1 1 23 14026 1 1 24 ARG HG3 H 10.376 -7.058 -3.512 1.00 . A A . 24 ARG HG3 1 1 23 14027 1 1 24 ARG HH11 H 7.833 -8.746 -6.565 1.00 . A A . 24 ARG HH11 1 1 23 14028 1 1 24 ARG HH12 H 7.821 -10.427 -6.982 1.00 . A A . 24 ARG HH12 1 1 23 14029 1 1 24 ARG HH21 H 11.003 -11.075 -5.690 1.00 . A A . 24 ARG HH21 1 1 23 14030 1 1 24 ARG HH22 H 9.620 -11.749 -6.485 1.00 . A A . 24 ARG HH22 1 1 23 14031 1 1 24 ARG N N 9.611 -2.880 -3.461 1.00 . A A . 24 ARG N 1 1 23 14032 1 1 24 ARG NE N 10.122 -8.733 -5.518 1.00 . A A . 24 ARG NE 1 1 23 14033 1 1 24 ARG NH1 N 8.284 -9.638 -6.578 1.00 . A A . 24 ARG NH1 1 1 23 14034 1 1 24 ARG NH2 N 10.088 -10.965 -6.080 1.00 . A A . 24 ARG NH2 1 1 23 14035 1 1 24 ARG O O 11.023 -3.618 -6.056 1.00 . A A . 24 ARG O 1 1 23 14036 1 1 25 THR C C 14.548 -4.613 -5.812 1.00 . A A . 25 THR C 1 1 23 14037 1 1 25 THR CA C 13.728 -3.363 -5.511 1.00 . A A . 25 THR CA 1 1 23 14038 1 1 25 THR CB C 14.643 -2.250 -4.998 1.00 . A A . 25 THR CB 1 1 23 14039 1 1 25 THR CG2 C 15.548 -1.677 -6.067 1.00 . A A . 25 THR CG2 1 1 23 14040 1 1 25 THR H H 12.926 -3.766 -3.594 1.00 . A A . 25 THR H 1 1 23 14041 1 1 25 THR HA H 13.251 -3.033 -6.421 1.00 . A A . 25 THR HA 1 1 23 14042 1 1 25 THR HB H 15.270 -2.647 -4.212 1.00 . A A . 25 THR HB 1 1 23 14043 1 1 25 THR HG1 H 13.348 -1.504 -3.732 1.00 . A A . 25 THR HG1 1 1 23 14044 1 1 25 THR HG21 H 15.577 -2.350 -6.912 1.00 . A A . 25 THR HG21 1 1 23 14045 1 1 25 THR HG22 H 15.168 -0.718 -6.384 1.00 . A A . 25 THR HG22 1 1 23 14046 1 1 25 THR HG23 H 16.545 -1.556 -5.669 1.00 . A A . 25 THR HG23 1 1 23 14047 1 1 25 THR N N 12.683 -3.649 -4.536 1.00 . A A . 25 THR N 1 1 23 14048 1 1 25 THR O O 14.998 -4.816 -6.940 1.00 . A A . 25 THR O 1 1 23 14049 1 1 25 THR OG1 O 13.882 -1.182 -4.462 1.00 . A A . 25 THR OG1 1 1 23 14050 1 1 26 SER C C 15.527 -7.472 -3.648 1.00 . A A . 26 SER C 1 1 23 14051 1 1 26 SER CA C 15.503 -6.680 -4.950 1.00 . A A . 26 SER CA 1 1 23 14052 1 1 26 SER CB C 16.933 -6.366 -5.396 1.00 . A A . 26 SER CB 1 1 23 14053 1 1 26 SER H H 14.353 -5.230 -3.922 1.00 . A A . 26 SER H 1 1 23 14054 1 1 26 SER HA H 15.022 -7.275 -5.710 1.00 . A A . 26 SER HA 1 1 23 14055 1 1 26 SER HB2 H 16.947 -5.418 -5.912 1.00 . A A . 26 SER HB2 1 1 23 14056 1 1 26 SER HB3 H 17.574 -6.314 -4.529 1.00 . A A . 26 SER HB3 1 1 23 14057 1 1 26 SER HG H 18.344 -7.553 -6.057 1.00 . A A . 26 SER HG 1 1 23 14058 1 1 26 SER N N 14.738 -5.448 -4.796 1.00 . A A . 26 SER N 1 1 23 14059 1 1 26 SER O O 15.430 -8.700 -3.654 1.00 . A A . 26 SER O 1 1 23 14060 1 1 26 SER OG O 17.426 -7.367 -6.270 1.00 . A A . 26 SER OG 1 1 23 14061 1 1 27 VAL C C 14.451 -7.049 -0.409 1.00 . A A . 27 VAL C 1 1 23 14062 1 1 27 VAL CA C 15.694 -7.396 -1.222 1.00 . A A . 27 VAL CA 1 1 23 14063 1 1 27 VAL CB C 16.945 -6.974 -0.429 1.00 . A A . 27 VAL CB 1 1 23 14064 1 1 27 VAL CG1 C 17.071 -7.793 0.846 1.00 . A A . 27 VAL CG1 1 1 23 14065 1 1 27 VAL CG2 C 18.193 -7.115 -1.288 1.00 . A A . 27 VAL CG2 1 1 23 14066 1 1 27 VAL H H 15.729 -5.787 -2.598 1.00 . A A . 27 VAL H 1 1 23 14067 1 1 27 VAL HA H 15.729 -8.465 -1.369 1.00 . A A . 27 VAL HA 1 1 23 14068 1 1 27 VAL HB H 16.839 -5.935 -0.154 1.00 . A A . 27 VAL HB 1 1 23 14069 1 1 27 VAL HG11 H 16.892 -8.835 0.624 1.00 . A A . 27 VAL HG11 1 1 23 14070 1 1 27 VAL HG12 H 18.066 -7.677 1.251 1.00 . A A . 27 VAL HG12 1 1 23 14071 1 1 27 VAL HG13 H 16.346 -7.449 1.568 1.00 . A A . 27 VAL HG13 1 1 23 14072 1 1 27 VAL HG21 H 18.014 -6.676 -2.258 1.00 . A A . 27 VAL HG21 1 1 23 14073 1 1 27 VAL HG22 H 19.018 -6.607 -0.810 1.00 . A A . 27 VAL HG22 1 1 23 14074 1 1 27 VAL HG23 H 18.434 -8.161 -1.405 1.00 . A A . 27 VAL HG23 1 1 23 14075 1 1 27 VAL N N 15.657 -6.762 -2.535 1.00 . A A . 27 VAL N 1 1 23 14076 1 1 27 VAL O O 13.969 -7.860 0.382 1.00 . A A . 27 VAL O 1 1 23 14077 1 1 28 SER C C 11.500 -6.082 -0.420 1.00 . A A . 28 SER C 1 1 23 14078 1 1 28 SER CA C 12.751 -5.386 0.106 1.00 . A A . 28 SER CA 1 1 23 14079 1 1 28 SER CB C 12.599 -3.870 -0.027 1.00 . A A . 28 SER CB 1 1 23 14080 1 1 28 SER H H 14.367 -5.239 -1.252 1.00 . A A . 28 SER H 1 1 23 14081 1 1 28 SER HA H 12.876 -5.637 1.149 1.00 . A A . 28 SER HA 1 1 23 14082 1 1 28 SER HB2 H 13.419 -3.382 0.479 1.00 . A A . 28 SER HB2 1 1 23 14083 1 1 28 SER HB3 H 12.609 -3.599 -1.072 1.00 . A A . 28 SER HB3 1 1 23 14084 1 1 28 SER HG H 10.643 -3.770 0.039 1.00 . A A . 28 SER HG 1 1 23 14085 1 1 28 SER N N 13.938 -5.840 -0.609 1.00 . A A . 28 SER N 1 1 23 14086 1 1 28 SER O O 11.324 -6.235 -1.628 1.00 . A A . 28 SER O 1 1 23 14087 1 1 28 SER OG O 11.381 -3.427 0.548 1.00 . A A . 28 SER OG 1 1 23 14088 1 1 29 SER C C 8.233 -6.703 0.985 1.00 . A A . 29 SER C 1 1 23 14089 1 1 29 SER CA C 9.398 -7.182 0.125 1.00 . A A . 29 SER CA 1 1 23 14090 1 1 29 SER CB C 9.562 -8.697 0.266 1.00 . A A . 29 SER CB 1 1 23 14091 1 1 29 SER H H 10.829 -6.351 1.445 1.00 . A A . 29 SER H 1 1 23 14092 1 1 29 SER HA H 9.188 -6.947 -0.908 1.00 . A A . 29 SER HA 1 1 23 14093 1 1 29 SER HB2 H 9.912 -8.927 1.261 1.00 . A A . 29 SER HB2 1 1 23 14094 1 1 29 SER HB3 H 8.609 -9.177 0.100 1.00 . A A . 29 SER HB3 1 1 23 14095 1 1 29 SER HG H 10.398 -10.151 -0.746 1.00 . A A . 29 SER HG 1 1 23 14096 1 1 29 SER N N 10.633 -6.502 0.496 1.00 . A A . 29 SER N 1 1 23 14097 1 1 29 SER O O 7.832 -7.374 1.935 1.00 . A A . 29 SER O 1 1 23 14098 1 1 29 SER OG O 10.497 -9.199 -0.673 1.00 . A A . 29 SER OG 1 1 23 14099 1 1 30 HIS C C 5.265 -5.159 0.626 1.00 . A A . 30 HIS C 1 1 23 14100 1 1 30 HIS CA C 6.574 -4.968 1.385 1.00 . A A . 30 HIS CA 1 1 23 14101 1 1 30 HIS CB C 6.812 -3.479 1.646 1.00 . A A . 30 HIS CB 1 1 23 14102 1 1 30 HIS CD2 C 9.203 -3.626 2.642 1.00 . A A . 30 HIS CD2 1 1 23 14103 1 1 30 HIS CE1 C 8.888 -2.380 4.418 1.00 . A A . 30 HIS CE1 1 1 23 14104 1 1 30 HIS CG C 7.914 -3.213 2.625 1.00 . A A . 30 HIS CG 1 1 23 14105 1 1 30 HIS H H 8.056 -5.048 -0.124 1.00 . A A . 30 HIS H 1 1 23 14106 1 1 30 HIS HA H 6.506 -5.483 2.331 1.00 . A A . 30 HIS HA 1 1 23 14107 1 1 30 HIS HB2 H 7.070 -2.994 0.717 1.00 . A A . 30 HIS HB2 1 1 23 14108 1 1 30 HIS HB3 H 5.906 -3.040 2.037 1.00 . A A . 30 HIS HB3 1 1 23 14109 1 1 30 HIS HD1 H 6.919 -1.988 4.022 1.00 . A A . 30 HIS HD1 1 1 23 14110 1 1 30 HIS HD2 H 9.684 -4.256 1.907 1.00 . A A . 30 HIS HD2 1 1 23 14111 1 1 30 HIS HE1 H 9.055 -1.844 5.340 1.00 . A A . 30 HIS HE1 1 1 23 14112 1 1 30 HIS HE2 H 10.690 -3.295 4.087 1.00 . A A . 30 HIS HE2 1 1 23 14113 1 1 30 HIS N N 7.693 -5.537 0.644 1.00 . A A . 30 HIS N 1 1 23 14114 1 1 30 HIS ND1 N 7.748 -2.435 3.751 1.00 . A A . 30 HIS ND1 1 1 23 14115 1 1 30 HIS NE2 N 9.786 -3.095 3.766 1.00 . A A . 30 HIS NE2 1 1 23 14116 1 1 30 HIS O O 5.238 -5.118 -0.604 1.00 . A A . 30 HIS O 1 1 23 14117 1 1 31 TYR C C 1.802 -4.772 1.509 1.00 . A A . 31 TYR C 1 1 23 14118 1 1 31 TYR CA C 2.869 -5.566 0.763 1.00 . A A . 31 TYR CA 1 1 23 14119 1 1 31 TYR CB C 2.506 -7.052 0.758 1.00 . A A . 31 TYR CB 1 1 23 14120 1 1 31 TYR CD1 C 2.701 -8.431 -1.348 1.00 . A A . 31 TYR CD1 1 1 23 14121 1 1 31 TYR CD2 C 4.668 -8.079 -0.047 1.00 . A A . 31 TYR CD2 1 1 23 14122 1 1 31 TYR CE1 C 3.430 -9.178 -2.254 1.00 . A A . 31 TYR CE1 1 1 23 14123 1 1 31 TYR CE2 C 5.403 -8.825 -0.948 1.00 . A A . 31 TYR CE2 1 1 23 14124 1 1 31 TYR CG C 3.307 -7.869 -0.231 1.00 . A A . 31 TYR CG 1 1 23 14125 1 1 31 TYR CZ C 4.780 -9.372 -2.049 1.00 . A A . 31 TYR CZ 1 1 23 14126 1 1 31 TYR H H 4.267 -5.390 2.343 1.00 . A A . 31 TYR H 1 1 23 14127 1 1 31 TYR HA H 2.917 -5.213 -0.256 1.00 . A A . 31 TYR HA 1 1 23 14128 1 1 31 TYR HB2 H 2.679 -7.461 1.742 1.00 . A A . 31 TYR HB2 1 1 23 14129 1 1 31 TYR HB3 H 1.460 -7.159 0.508 1.00 . A A . 31 TYR HB3 1 1 23 14130 1 1 31 TYR HD1 H 1.644 -8.277 -1.505 1.00 . A A . 31 TYR HD1 1 1 23 14131 1 1 31 TYR HD2 H 5.153 -7.649 0.817 1.00 . A A . 31 TYR HD2 1 1 23 14132 1 1 31 TYR HE1 H 2.941 -9.607 -3.116 1.00 . A A . 31 TYR HE1 1 1 23 14133 1 1 31 TYR HE2 H 6.460 -8.976 -0.788 1.00 . A A . 31 TYR HE2 1 1 23 14134 1 1 31 TYR HH H 5.670 -9.595 -3.739 1.00 . A A . 31 TYR HH 1 1 23 14135 1 1 31 TYR N N 4.182 -5.368 1.367 1.00 . A A . 31 TYR N 1 1 23 14136 1 1 31 TYR O O 1.986 -4.402 2.668 1.00 . A A . 31 TYR O 1 1 23 14137 1 1 31 TYR OH O 5.508 -10.116 -2.949 1.00 . A A . 31 TYR OH 1 1 23 14138 1 1 32 CYS C C -1.438 -4.708 2.058 1.00 . A A . 32 CYS C 1 1 23 14139 1 1 32 CYS CA C -0.413 -3.766 1.435 1.00 . A A . 32 CYS CA 1 1 23 14140 1 1 32 CYS CB C -1.087 -2.882 0.384 1.00 . A A . 32 CYS CB 1 1 23 14141 1 1 32 CYS H H 0.597 -4.838 -0.085 1.00 . A A . 32 CYS H 1 1 23 14142 1 1 32 CYS HA H -0.001 -3.138 2.210 1.00 . A A . 32 CYS HA 1 1 23 14143 1 1 32 CYS HB2 H -1.635 -3.508 -0.304 1.00 . A A . 32 CYS HB2 1 1 23 14144 1 1 32 CYS HB3 H -1.775 -2.211 0.878 1.00 . A A . 32 CYS HB3 1 1 23 14145 1 1 32 CYS N N 0.685 -4.515 0.836 1.00 . A A . 32 CYS N 1 1 23 14146 1 1 32 CYS O O -1.825 -5.708 1.453 1.00 . A A . 32 CYS O 1 1 23 14147 1 1 32 CYS SG S 0.072 -1.870 -0.591 1.00 . A A . 32 CYS SG 1 1 23 14148 1 1 33 THR C C -4.276 -4.690 3.737 1.00 . A A . 33 THR C 1 1 23 14149 1 1 33 THR CA C -2.855 -5.200 3.975 1.00 . A A . 33 THR CA 1 1 23 14150 1 1 33 THR CB C -2.552 -5.212 5.475 1.00 . A A . 33 THR CB 1 1 23 14151 1 1 33 THR CG2 C -2.311 -3.833 6.048 1.00 . A A . 33 THR CG2 1 1 23 14152 1 1 33 THR H H -1.528 -3.573 3.701 1.00 . A A . 33 THR H 1 1 23 14153 1 1 33 THR HA H -2.779 -6.207 3.595 1.00 . A A . 33 THR HA 1 1 23 14154 1 1 33 THR HB H -1.662 -5.801 5.646 1.00 . A A . 33 THR HB 1 1 23 14155 1 1 33 THR HG1 H -4.380 -5.213 6.177 1.00 . A A . 33 THR HG1 1 1 23 14156 1 1 33 THR HG21 H -2.708 -3.088 5.373 1.00 . A A . 33 THR HG21 1 1 23 14157 1 1 33 THR HG22 H -2.804 -3.750 7.005 1.00 . A A . 33 THR HG22 1 1 23 14158 1 1 33 THR HG23 H -1.250 -3.675 6.174 1.00 . A A . 33 THR HG23 1 1 23 14159 1 1 33 THR N N -1.874 -4.382 3.270 1.00 . A A . 33 THR N 1 1 23 14160 1 1 33 THR O O -5.207 -5.072 4.446 1.00 . A A . 33 THR O 1 1 23 14161 1 1 33 THR OG1 O -3.619 -5.798 6.198 1.00 . A A . 33 THR OG1 1 1 23 14162 1 1 34 GLY C C -6.426 -2.666 3.636 1.00 . A A . 34 GLY C 1 1 23 14163 1 1 34 GLY CA C -5.751 -3.287 2.428 1.00 . A A . 34 GLY CA 1 1 23 14164 1 1 34 GLY H H -3.664 -3.558 2.200 1.00 . A A . 34 GLY H 1 1 23 14165 1 1 34 GLY HA2 H -6.376 -4.082 2.049 1.00 . A A . 34 GLY HA2 1 1 23 14166 1 1 34 GLY HA3 H -5.645 -2.532 1.663 1.00 . A A . 34 GLY HA3 1 1 23 14167 1 1 34 GLY N N -4.439 -3.828 2.735 1.00 . A A . 34 GLY N 1 1 23 14168 1 1 34 GLY O O -7.653 -2.587 3.696 1.00 . A A . 34 GLY O 1 1 23 14169 1 1 35 ARG C C -5.892 -0.109 5.818 1.00 . A A . 35 ARG C 1 1 23 14170 1 1 35 ARG CA C -6.154 -1.611 5.812 1.00 . A A . 35 ARG CA 1 1 23 14171 1 1 35 ARG CB C -5.528 -2.254 7.051 1.00 . A A . 35 ARG CB 1 1 23 14172 1 1 35 ARG CD C -7.509 -3.349 8.144 1.00 . A A . 35 ARG CD 1 1 23 14173 1 1 35 ARG CG C -6.449 -2.266 8.261 1.00 . A A . 35 ARG CG 1 1 23 14174 1 1 35 ARG CZ C -7.187 -4.755 10.142 1.00 . A A . 35 ARG CZ 1 1 23 14175 1 1 35 ARG H H -4.655 -2.317 4.496 1.00 . A A . 35 ARG H 1 1 23 14176 1 1 35 ARG HA H -7.220 -1.778 5.830 1.00 . A A . 35 ARG HA 1 1 23 14177 1 1 35 ARG HB2 H -5.263 -3.275 6.818 1.00 . A A . 35 ARG HB2 1 1 23 14178 1 1 35 ARG HB3 H -4.633 -1.710 7.312 1.00 . A A . 35 ARG HB3 1 1 23 14179 1 1 35 ARG HD2 H -8.378 -2.932 7.656 1.00 . A A . 35 ARG HD2 1 1 23 14180 1 1 35 ARG HD3 H -7.115 -4.157 7.546 1.00 . A A . 35 ARG HD3 1 1 23 14181 1 1 35 ARG HE H -8.747 -3.550 9.830 1.00 . A A . 35 ARG HE 1 1 23 14182 1 1 35 ARG HG2 H -5.860 -2.448 9.148 1.00 . A A . 35 ARG HG2 1 1 23 14183 1 1 35 ARG HG3 H -6.935 -1.305 8.340 1.00 . A A . 35 ARG HG3 1 1 23 14184 1 1 35 ARG HH11 H -5.708 -4.897 8.769 1.00 . A A . 35 ARG HH11 1 1 23 14185 1 1 35 ARG HH12 H -5.505 -5.876 10.183 1.00 . A A . 35 ARG HH12 1 1 23 14186 1 1 35 ARG HH21 H -8.482 -4.836 11.691 1.00 . A A . 35 ARG HH21 1 1 23 14187 1 1 35 ARG HH22 H -7.080 -5.842 11.842 1.00 . A A . 35 ARG HH22 1 1 23 14188 1 1 35 ARG N N -5.625 -2.226 4.601 1.00 . A A . 35 ARG N 1 1 23 14189 1 1 35 ARG NE N -7.904 -3.872 9.449 1.00 . A A . 35 ARG NE 1 1 23 14190 1 1 35 ARG NH1 N -6.039 -5.213 9.658 1.00 . A A . 35 ARG NH1 1 1 23 14191 1 1 35 ARG NH2 N -7.618 -5.179 11.321 1.00 . A A . 35 ARG NH2 1 1 23 14192 1 1 35 ARG O O -6.707 0.672 6.310 1.00 . A A . 35 ARG O 1 1 23 14193 1 1 36 SER C C -3.297 1.932 4.160 1.00 . A A . 36 SER C 1 1 23 14194 1 1 36 SER CA C -4.380 1.697 5.209 1.00 . A A . 36 SER CA 1 1 23 14195 1 1 36 SER CB C -3.892 2.176 6.578 1.00 . A A . 36 SER CB 1 1 23 14196 1 1 36 SER H H -4.142 -0.382 4.893 1.00 . A A . 36 SER H 1 1 23 14197 1 1 36 SER HA H -5.259 2.260 4.934 1.00 . A A . 36 SER HA 1 1 23 14198 1 1 36 SER HB2 H -4.553 1.801 7.345 1.00 . A A . 36 SER HB2 1 1 23 14199 1 1 36 SER HB3 H -2.893 1.804 6.752 1.00 . A A . 36 SER HB3 1 1 23 14200 1 1 36 SER HG H -2.962 3.900 6.603 1.00 . A A . 36 SER HG 1 1 23 14201 1 1 36 SER N N -4.750 0.288 5.268 1.00 . A A . 36 SER N 1 1 23 14202 1 1 36 SER O O -2.665 0.990 3.684 1.00 . A A . 36 SER O 1 1 23 14203 1 1 36 SER OG O -3.870 3.591 6.646 1.00 . A A . 36 SER OG 1 1 23 14204 1 1 37 CYS C C -0.676 3.373 3.376 1.00 . A A . 37 CYS C 1 1 23 14205 1 1 37 CYS CA C -2.082 3.556 2.814 1.00 . A A . 37 CYS CA 1 1 23 14206 1 1 37 CYS CB C -2.278 5.004 2.361 1.00 . A A . 37 CYS CB 1 1 23 14207 1 1 37 CYS H H -3.624 3.904 4.222 1.00 . A A . 37 CYS H 1 1 23 14208 1 1 37 CYS HA H -2.206 2.902 1.964 1.00 . A A . 37 CYS HA 1 1 23 14209 1 1 37 CYS HB2 H -2.178 5.657 3.215 1.00 . A A . 37 CYS HB2 1 1 23 14210 1 1 37 CYS HB3 H -1.517 5.251 1.635 1.00 . A A . 37 CYS HB3 1 1 23 14211 1 1 37 CYS N N -3.089 3.196 3.806 1.00 . A A . 37 CYS N 1 1 23 14212 1 1 37 CYS O O 0.268 3.100 2.635 1.00 . A A . 37 CYS O 1 1 23 14213 1 1 37 CYS SG S -3.900 5.333 1.600 1.00 . A A . 37 CYS SG 1 1 23 14214 1 1 38 GLU C C 1.282 1.960 5.191 1.00 . A A . 38 GLU C 1 1 23 14215 1 1 38 GLU CA C 0.747 3.379 5.350 1.00 . A A . 38 GLU CA 1 1 23 14216 1 1 38 GLU CB C 0.626 3.727 6.835 1.00 . A A . 38 GLU CB 1 1 23 14217 1 1 38 GLU CD C 0.250 5.524 8.570 1.00 . A A . 38 GLU CD 1 1 23 14218 1 1 38 GLU CG C 0.435 5.212 7.098 1.00 . A A . 38 GLU CG 1 1 23 14219 1 1 38 GLU H H -1.334 3.745 5.227 1.00 . A A . 38 GLU H 1 1 23 14220 1 1 38 GLU HA H 1.438 4.065 4.884 1.00 . A A . 38 GLU HA 1 1 23 14221 1 1 38 GLU HB2 H -0.219 3.199 7.249 1.00 . A A . 38 GLU HB2 1 1 23 14222 1 1 38 GLU HB3 H 1.524 3.406 7.342 1.00 . A A . 38 GLU HB3 1 1 23 14223 1 1 38 GLU HG2 H 1.305 5.743 6.740 1.00 . A A . 38 GLU HG2 1 1 23 14224 1 1 38 GLU HG3 H -0.438 5.550 6.560 1.00 . A A . 38 GLU HG3 1 1 23 14225 1 1 38 GLU N N -0.544 3.527 4.689 1.00 . A A . 38 GLU N 1 1 23 14226 1 1 38 GLU O O 0.711 1.007 5.722 1.00 . A A . 38 GLU O 1 1 23 14227 1 1 38 GLU OE1 O -0.620 4.893 9.206 1.00 . A A . 38 GLU OE1 1 1 23 14228 1 1 38 GLU OE2 O 0.976 6.399 9.087 1.00 . A A . 38 GLU OE2 1 1 23 14229 1 1 39 CYS C C 3.437 -0.108 5.548 1.00 . A A . 39 CYS C 1 1 23 14230 1 1 39 CYS CA C 2.994 0.523 4.229 1.00 . A A . 39 CYS CA 1 1 23 14231 1 1 39 CYS CB C 4.193 0.659 3.288 1.00 . A A . 39 CYS CB 1 1 23 14232 1 1 39 CYS H H 2.791 2.623 4.060 1.00 . A A . 39 CYS H 1 1 23 14233 1 1 39 CYS HA H 2.255 -0.114 3.766 1.00 . A A . 39 CYS HA 1 1 23 14234 1 1 39 CYS HB2 H 4.045 1.518 2.650 1.00 . A A . 39 CYS HB2 1 1 23 14235 1 1 39 CYS HB3 H 5.088 0.803 3.875 1.00 . A A . 39 CYS HB3 1 1 23 14236 1 1 39 CYS N N 2.382 1.826 4.457 1.00 . A A . 39 CYS N 1 1 23 14237 1 1 39 CYS O O 3.956 0.580 6.428 1.00 . A A . 39 CYS O 1 1 23 14238 1 1 39 CYS SG S 4.462 -0.787 2.213 1.00 . A A . 39 CYS SG 1 1 23 14239 1 1 40 PRO C C 5.079 -1.891 7.312 1.00 . A A . 40 PRO C 1 1 23 14240 1 1 40 PRO CA C 3.625 -2.142 6.929 1.00 . A A . 40 PRO CA 1 1 23 14241 1 1 40 PRO CB C 3.413 -3.614 6.567 1.00 . A A . 40 PRO CB 1 1 23 14242 1 1 40 PRO CD C 2.629 -2.331 4.711 1.00 . A A . 40 PRO CD 1 1 23 14243 1 1 40 PRO CG C 2.387 -3.595 5.488 1.00 . A A . 40 PRO CG 1 1 23 14244 1 1 40 PRO HA H 2.985 -1.877 7.759 1.00 . A A . 40 PRO HA 1 1 23 14245 1 1 40 PRO HB2 H 4.344 -4.039 6.221 1.00 . A A . 40 PRO HB2 1 1 23 14246 1 1 40 PRO HB3 H 3.064 -4.155 7.434 1.00 . A A . 40 PRO HB3 1 1 23 14247 1 1 40 PRO HD2 H 3.306 -2.516 3.891 1.00 . A A . 40 PRO HD2 1 1 23 14248 1 1 40 PRO HD3 H 1.695 -1.927 4.348 1.00 . A A . 40 PRO HD3 1 1 23 14249 1 1 40 PRO HG2 H 2.510 -4.457 4.850 1.00 . A A . 40 PRO HG2 1 1 23 14250 1 1 40 PRO HG3 H 1.398 -3.585 5.922 1.00 . A A . 40 PRO HG3 1 1 23 14251 1 1 40 PRO N N 3.240 -1.429 5.706 1.00 . A A . 40 PRO N 1 1 23 14252 1 1 40 PRO O O 5.836 -1.288 6.552 1.00 . A A . 40 PRO O 1 1 23 14253 1 1 41 SER C C 7.618 -3.484 8.857 1.00 . A A . 41 SER C 1 1 23 14254 1 1 41 SER CA C 6.828 -2.185 8.979 1.00 . A A . 41 SER CA 1 1 23 14255 1 1 41 SER CB C 6.820 -1.714 10.434 1.00 . A A . 41 SER CB 1 1 23 14256 1 1 41 SER H H 4.814 -2.831 9.057 1.00 . A A . 41 SER H 1 1 23 14257 1 1 41 SER HA H 7.302 -1.431 8.369 1.00 . A A . 41 SER HA 1 1 23 14258 1 1 41 SER HB2 H 7.835 -1.556 10.765 1.00 . A A . 41 SER HB2 1 1 23 14259 1 1 41 SER HB3 H 6.269 -0.788 10.508 1.00 . A A . 41 SER HB3 1 1 23 14260 1 1 41 SER HG H 5.298 -2.805 11.010 1.00 . A A . 41 SER HG 1 1 23 14261 1 1 41 SER N N 5.464 -2.359 8.495 1.00 . A A . 41 SER N 1 1 23 14262 1 1 41 SER O O 8.827 -3.468 8.624 1.00 . A A . 41 SER O 1 1 23 14263 1 1 41 SER OG O 6.210 -2.676 11.278 1.00 . A A . 41 SER OG 1 1 23 14264 1 1 42 TYR C C 7.311 -6.551 7.559 1.00 . A A . 42 TYR C 1 1 23 14265 1 1 42 TYR CA C 7.564 -5.916 8.925 1.00 . A A . 42 TYR CA 1 1 23 14266 1 1 42 TYR CB C 7.047 -6.837 10.031 1.00 . A A . 42 TYR CB 1 1 23 14267 1 1 42 TYR CD1 C 4.906 -5.969 11.050 1.00 . A A . 42 TYR CD1 1 1 23 14268 1 1 42 TYR CD2 C 4.755 -7.698 9.415 1.00 . A A . 42 TYR CD2 1 1 23 14269 1 1 42 TYR CE1 C 3.530 -5.964 11.178 1.00 . A A . 42 TYR CE1 1 1 23 14270 1 1 42 TYR CE2 C 3.378 -7.698 9.537 1.00 . A A . 42 TYR CE2 1 1 23 14271 1 1 42 TYR CG C 5.541 -6.835 10.168 1.00 . A A . 42 TYR CG 1 1 23 14272 1 1 42 TYR CZ C 2.771 -6.830 10.419 1.00 . A A . 42 TYR CZ 1 1 23 14273 1 1 42 TYR H H 5.966 -4.556 9.201 1.00 . A A . 42 TYR H 1 1 23 14274 1 1 42 TYR HA H 8.627 -5.777 9.052 1.00 . A A . 42 TYR HA 1 1 23 14275 1 1 42 TYR HB2 H 7.359 -7.850 9.822 1.00 . A A . 42 TYR HB2 1 1 23 14276 1 1 42 TYR HB3 H 7.468 -6.524 10.976 1.00 . A A . 42 TYR HB3 1 1 23 14277 1 1 42 TYR HD1 H 5.504 -5.292 11.643 1.00 . A A . 42 TYR HD1 1 1 23 14278 1 1 42 TYR HD2 H 5.234 -8.377 8.725 1.00 . A A . 42 TYR HD2 1 1 23 14279 1 1 42 TYR HE1 H 3.055 -5.284 11.869 1.00 . A A . 42 TYR HE1 1 1 23 14280 1 1 42 TYR HE2 H 2.784 -8.377 8.943 1.00 . A A . 42 TYR HE2 1 1 23 14281 1 1 42 TYR HH H 1.017 -6.289 9.848 1.00 . A A . 42 TYR HH 1 1 23 14282 1 1 42 TYR N N 6.927 -4.608 9.017 1.00 . A A . 42 TYR N 1 1 23 14283 1 1 42 TYR O O 6.324 -6.238 6.894 1.00 . A A . 42 TYR O 1 1 23 14284 1 1 42 TYR OH O 1.401 -6.828 10.543 1.00 . A A . 42 TYR OH 1 1 23 14285 1 1 43 PRO C C 6.915 -9.127 5.812 1.00 . A A . 43 PRO C 1 1 23 14286 1 1 43 PRO CA C 8.072 -8.134 5.829 1.00 . A A . 43 PRO CA 1 1 23 14287 1 1 43 PRO CB C 9.407 -8.866 5.674 1.00 . A A . 43 PRO CB 1 1 23 14288 1 1 43 PRO CD C 9.410 -7.887 7.854 1.00 . A A . 43 PRO CD 1 1 23 14289 1 1 43 PRO CG C 9.888 -9.076 7.067 1.00 . A A . 43 PRO CG 1 1 23 14290 1 1 43 PRO HA H 7.950 -7.427 5.022 1.00 . A A . 43 PRO HA 1 1 23 14291 1 1 43 PRO HB2 H 9.248 -9.805 5.164 1.00 . A A . 43 PRO HB2 1 1 23 14292 1 1 43 PRO HB3 H 10.093 -8.254 5.108 1.00 . A A . 43 PRO HB3 1 1 23 14293 1 1 43 PRO HD2 H 9.164 -8.178 8.865 1.00 . A A . 43 PRO HD2 1 1 23 14294 1 1 43 PRO HD3 H 10.159 -7.109 7.855 1.00 . A A . 43 PRO HD3 1 1 23 14295 1 1 43 PRO HG2 H 9.466 -9.986 7.469 1.00 . A A . 43 PRO HG2 1 1 23 14296 1 1 43 PRO HG3 H 10.967 -9.124 7.080 1.00 . A A . 43 PRO HG3 1 1 23 14297 1 1 43 PRO N N 8.204 -7.455 7.122 1.00 . A A . 43 PRO N 1 1 23 14298 1 1 43 PRO O O 6.338 -9.441 6.853 1.00 . A A . 43 PRO O 1 1 23 14299 1 1 44 GLY C C 5.819 -11.694 3.530 1.00 . A A . 44 GLY C 1 1 23 14300 1 1 44 GLY CA C 5.493 -10.570 4.493 1.00 . A A . 44 GLY CA 1 1 23 14301 1 1 44 GLY H H 7.076 -9.331 3.828 1.00 . A A . 44 GLY H 1 1 23 14302 1 1 44 GLY HA2 H 4.615 -10.050 4.139 1.00 . A A . 44 GLY HA2 1 1 23 14303 1 1 44 GLY HA3 H 5.281 -10.992 5.464 1.00 . A A . 44 GLY HA3 1 1 23 14304 1 1 44 GLY N N 6.580 -9.617 4.623 1.00 . A A . 44 GLY N 1 1 23 14305 1 1 44 GLY O O 5.025 -11.922 2.593 1.00 . A A . 44 GLY O 1 1 23 14306 1 1 44 GLY OXT O 6.868 -12.346 3.712 1.00 . A A . 44 GLY OXT 1 1 24 14307 1 1 1 ALA C C -9.897 15.553 -0.807 1.00 . A A . 1 ALA C 1 1 24 14308 1 1 1 ALA CA C -9.458 15.138 -2.207 1.00 . A A . 1 ALA CA 1 1 24 14309 1 1 1 ALA CB C -8.365 14.083 -2.126 1.00 . A A . 1 ALA CB 1 1 24 14310 1 1 1 ALA H1 H -8.194 16.740 -2.466 1.00 . A A . 1 ALA H1 1 1 24 14311 1 1 1 ALA H2 H -8.678 15.967 -3.920 1.00 . A A . 1 ALA H2 1 1 24 14312 1 1 1 ALA H3 H -9.779 16.975 -3.074 1.00 . A A . 1 ALA H3 1 1 24 14313 1 1 1 ALA HA H -10.303 14.706 -2.723 1.00 . A A . 1 ALA HA 1 1 24 14314 1 1 1 ALA HB1 H -8.368 13.492 -3.029 1.00 . A A . 1 ALA HB1 1 1 24 14315 1 1 1 ALA HB2 H -7.406 14.566 -2.015 1.00 . A A . 1 ALA HB2 1 1 24 14316 1 1 1 ALA HB3 H -8.546 13.442 -1.275 1.00 . A A . 1 ALA HB3 1 1 24 14317 1 1 1 ALA N N -8.985 16.311 -2.987 1.00 . A A . 1 ALA N 1 1 24 14318 1 1 1 ALA O O -9.123 16.143 -0.053 1.00 . A A . 1 ALA O 1 1 24 14319 1 1 2 MET C C -11.670 14.370 1.771 1.00 . A A . 2 MET C 1 1 24 14320 1 1 2 MET CA C -11.685 15.582 0.844 1.00 . A A . 2 MET CA 1 1 24 14321 1 1 2 MET CB C -13.112 16.116 0.706 1.00 . A A . 2 MET CB 1 1 24 14322 1 1 2 MET CE C -14.201 18.605 -2.277 1.00 . A A . 2 MET CE 1 1 24 14323 1 1 2 MET CG C -13.188 17.483 0.046 1.00 . A A . 2 MET CG 1 1 24 14324 1 1 2 MET H H -11.712 14.771 -1.111 1.00 . A A . 2 MET H 1 1 24 14325 1 1 2 MET HA H -11.061 16.353 1.271 1.00 . A A . 2 MET HA 1 1 24 14326 1 1 2 MET HB2 H -13.688 15.421 0.114 1.00 . A A . 2 MET HB2 1 1 24 14327 1 1 2 MET HB3 H -13.553 16.190 1.690 1.00 . A A . 2 MET HB3 1 1 24 14328 1 1 2 MET HE1 H -13.356 19.233 -2.036 1.00 . A A . 2 MET HE1 1 1 24 14329 1 1 2 MET HE2 H -13.908 17.877 -3.020 1.00 . A A . 2 MET HE2 1 1 24 14330 1 1 2 MET HE3 H -15.003 19.214 -2.666 1.00 . A A . 2 MET HE3 1 1 24 14331 1 1 2 MET HG2 H -13.067 18.242 0.805 1.00 . A A . 2 MET HG2 1 1 24 14332 1 1 2 MET HG3 H -12.387 17.565 -0.674 1.00 . A A . 2 MET HG3 1 1 24 14333 1 1 2 MET N N -11.143 15.241 -0.466 1.00 . A A . 2 MET N 1 1 24 14334 1 1 2 MET O O -11.477 14.502 2.979 1.00 . A A . 2 MET O 1 1 24 14335 1 1 2 MET SD S -14.757 17.759 -0.799 1.00 . A A . 2 MET SD 1 1 24 14336 1 1 3 ASP C C -11.322 10.796 1.153 1.00 . A A . 3 ASP C 1 1 24 14337 1 1 3 ASP CA C -11.886 11.954 1.970 1.00 . A A . 3 ASP CA 1 1 24 14338 1 1 3 ASP CB C -13.309 11.625 2.426 1.00 . A A . 3 ASP CB 1 1 24 14339 1 1 3 ASP CG C -13.333 10.818 3.709 1.00 . A A . 3 ASP CG 1 1 24 14340 1 1 3 ASP H H -12.024 13.149 0.228 1.00 . A A . 3 ASP H 1 1 24 14341 1 1 3 ASP HA H -11.264 12.103 2.839 1.00 . A A . 3 ASP HA 1 1 24 14342 1 1 3 ASP HB2 H -13.849 12.546 2.592 1.00 . A A . 3 ASP HB2 1 1 24 14343 1 1 3 ASP HB3 H -13.805 11.056 1.654 1.00 . A A . 3 ASP HB3 1 1 24 14344 1 1 3 ASP N N -11.876 13.190 1.196 1.00 . A A . 3 ASP N 1 1 24 14345 1 1 3 ASP O O -11.778 9.659 1.271 1.00 . A A . 3 ASP O 1 1 24 14346 1 1 3 ASP OD1 O -13.834 11.338 4.728 1.00 . A A . 3 ASP OD1 1 1 24 14347 1 1 3 ASP OD2 O -12.851 9.666 3.695 1.00 . A A . 3 ASP OD2 1 1 24 14348 1 1 4 CYS C C -8.322 9.702 0.027 1.00 . A A . 4 CYS C 1 1 24 14349 1 1 4 CYS CA C -9.699 10.077 -0.512 1.00 . A A . 4 CYS CA 1 1 24 14350 1 1 4 CYS CB C -9.576 10.577 -1.953 1.00 . A A . 4 CYS CB 1 1 24 14351 1 1 4 CYS H H -10.006 12.018 0.275 1.00 . A A . 4 CYS H 1 1 24 14352 1 1 4 CYS HA H -10.329 9.201 -0.498 1.00 . A A . 4 CYS HA 1 1 24 14353 1 1 4 CYS HB2 H -9.250 11.607 -1.942 1.00 . A A . 4 CYS HB2 1 1 24 14354 1 1 4 CYS HB3 H -8.841 9.979 -2.472 1.00 . A A . 4 CYS HB3 1 1 24 14355 1 1 4 CYS N N -10.326 11.093 0.324 1.00 . A A . 4 CYS N 1 1 24 14356 1 1 4 CYS O O -7.397 10.514 0.014 1.00 . A A . 4 CYS O 1 1 24 14357 1 1 4 CYS SG S -11.129 10.498 -2.902 1.00 . A A . 4 CYS SG 1 1 24 14358 1 1 5 THR C C -5.822 8.067 -0.007 1.00 . A A . 5 THR C 1 1 24 14359 1 1 5 THR CA C -6.929 7.983 1.040 1.00 . A A . 5 THR CA 1 1 24 14360 1 1 5 THR CB C -7.077 6.540 1.527 1.00 . A A . 5 THR CB 1 1 24 14361 1 1 5 THR CG2 C -8.076 6.389 2.654 1.00 . A A . 5 THR CG2 1 1 24 14362 1 1 5 THR H H -8.967 7.865 0.480 1.00 . A A . 5 THR H 1 1 24 14363 1 1 5 THR HA H -6.664 8.611 1.877 1.00 . A A . 5 THR HA 1 1 24 14364 1 1 5 THR HB H -6.119 6.192 1.885 1.00 . A A . 5 THR HB 1 1 24 14365 1 1 5 THR HG1 H -7.575 4.794 0.793 1.00 . A A . 5 THR HG1 1 1 24 14366 1 1 5 THR HG21 H -7.766 6.993 3.494 1.00 . A A . 5 THR HG21 1 1 24 14367 1 1 5 THR HG22 H -9.050 6.715 2.317 1.00 . A A . 5 THR HG22 1 1 24 14368 1 1 5 THR HG23 H -8.127 5.353 2.954 1.00 . A A . 5 THR HG23 1 1 24 14369 1 1 5 THR N N -8.193 8.466 0.498 1.00 . A A . 5 THR N 1 1 24 14370 1 1 5 THR O O -5.629 7.143 -0.796 1.00 . A A . 5 THR O 1 1 24 14371 1 1 5 THR OG1 O -7.491 5.694 0.469 1.00 . A A . 5 THR OG1 1 1 24 14372 1 1 6 THR C C -2.705 8.823 -0.423 1.00 . A A . 6 THR C 1 1 24 14373 1 1 6 THR CA C -4.015 9.389 -0.961 1.00 . A A . 6 THR CA 1 1 24 14374 1 1 6 THR CB C -3.854 10.878 -1.267 1.00 . A A . 6 THR CB 1 1 24 14375 1 1 6 THR CG2 C -4.728 11.352 -2.408 1.00 . A A . 6 THR CG2 1 1 24 14376 1 1 6 THR H H -5.304 9.885 0.644 1.00 . A A . 6 THR H 1 1 24 14377 1 1 6 THR HA H -4.271 8.869 -1.872 1.00 . A A . 6 THR HA 1 1 24 14378 1 1 6 THR HB H -2.825 11.070 -1.537 1.00 . A A . 6 THR HB 1 1 24 14379 1 1 6 THR HG1 H -3.507 12.347 -0.019 1.00 . A A . 6 THR HG1 1 1 24 14380 1 1 6 THR HG21 H -5.311 10.524 -2.783 1.00 . A A . 6 THR HG21 1 1 24 14381 1 1 6 THR HG22 H -5.390 12.129 -2.056 1.00 . A A . 6 THR HG22 1 1 24 14382 1 1 6 THR HG23 H -4.106 11.742 -3.201 1.00 . A A . 6 THR HG23 1 1 24 14383 1 1 6 THR N N -5.101 9.183 -0.009 1.00 . A A . 6 THR N 1 1 24 14384 1 1 6 THR O O -2.191 9.283 0.597 1.00 . A A . 6 THR O 1 1 24 14385 1 1 6 THR OG1 O -4.169 11.662 -0.130 1.00 . A A . 6 THR OG1 1 1 24 14386 1 1 7 GLY C C -0.497 6.077 -1.605 1.00 . A A . 7 GLY C 1 1 24 14387 1 1 7 GLY CA C -0.925 7.211 -0.693 1.00 . A A . 7 GLY CA 1 1 24 14388 1 1 7 GLY H H -2.625 7.499 -1.921 1.00 . A A . 7 GLY H 1 1 24 14389 1 1 7 GLY HA2 H -1.047 6.826 0.308 1.00 . A A . 7 GLY HA2 1 1 24 14390 1 1 7 GLY HA3 H -0.150 7.964 -0.686 1.00 . A A . 7 GLY HA3 1 1 24 14391 1 1 7 GLY N N -2.170 7.823 -1.116 1.00 . A A . 7 GLY N 1 1 24 14392 1 1 7 GLY O O -1.180 5.775 -2.584 1.00 . A A . 7 GLY O 1 1 24 14393 1 1 8 PRO C C 0.301 3.053 -1.975 1.00 . A A . 8 PRO C 1 1 24 14394 1 1 8 PRO CA C 1.148 4.313 -2.120 1.00 . A A . 8 PRO CA 1 1 24 14395 1 1 8 PRO CB C 2.553 4.081 -1.562 1.00 . A A . 8 PRO CB 1 1 24 14396 1 1 8 PRO CD C 1.518 5.718 -0.160 1.00 . A A . 8 PRO CD 1 1 24 14397 1 1 8 PRO CG C 2.486 4.566 -0.156 1.00 . A A . 8 PRO CG 1 1 24 14398 1 1 8 PRO HA H 1.212 4.584 -3.164 1.00 . A A . 8 PRO HA 1 1 24 14399 1 1 8 PRO HB2 H 2.791 3.028 -1.607 1.00 . A A . 8 PRO HB2 1 1 24 14400 1 1 8 PRO HB3 H 3.271 4.644 -2.140 1.00 . A A . 8 PRO HB3 1 1 24 14401 1 1 8 PRO HD2 H 0.954 5.740 0.761 1.00 . A A . 8 PRO HD2 1 1 24 14402 1 1 8 PRO HD3 H 2.043 6.651 -0.306 1.00 . A A . 8 PRO HD3 1 1 24 14403 1 1 8 PRO HG2 H 2.126 3.777 0.488 1.00 . A A . 8 PRO HG2 1 1 24 14404 1 1 8 PRO HG3 H 3.462 4.898 0.165 1.00 . A A . 8 PRO HG3 1 1 24 14405 1 1 8 PRO N N 0.640 5.424 -1.309 1.00 . A A . 8 PRO N 1 1 24 14406 1 1 8 PRO O O 0.260 2.215 -2.876 1.00 . A A . 8 PRO O 1 1 24 14407 1 1 9 CYS C C -2.642 1.983 -1.074 1.00 . A A . 9 CYS C 1 1 24 14408 1 1 9 CYS CA C -1.214 1.761 -0.575 1.00 . A A . 9 CYS CA 1 1 24 14409 1 1 9 CYS CB C -1.230 1.445 0.921 1.00 . A A . 9 CYS CB 1 1 24 14410 1 1 9 CYS H H -0.297 3.623 -0.154 1.00 . A A . 9 CYS H 1 1 24 14411 1 1 9 CYS HA H -0.790 0.921 -1.104 1.00 . A A . 9 CYS HA 1 1 24 14412 1 1 9 CYS HB2 H -0.243 1.608 1.326 1.00 . A A . 9 CYS HB2 1 1 24 14413 1 1 9 CYS HB3 H -1.928 2.105 1.413 1.00 . A A . 9 CYS HB3 1 1 24 14414 1 1 9 CYS N N -0.371 2.923 -0.836 1.00 . A A . 9 CYS N 1 1 24 14415 1 1 9 CYS O O -3.520 1.149 -0.852 1.00 . A A . 9 CYS O 1 1 24 14416 1 1 9 CYS SG S -1.714 -0.266 1.315 1.00 . A A . 9 CYS SG 1 1 24 14417 1 1 10 CYS C C -4.137 3.655 -3.783 1.00 . A A . 10 CYS C 1 1 24 14418 1 1 10 CYS CA C -4.195 3.424 -2.276 1.00 . A A . 10 CYS CA 1 1 24 14419 1 1 10 CYS CB C -4.761 4.663 -1.580 1.00 . A A . 10 CYS CB 1 1 24 14420 1 1 10 CYS H H -2.137 3.737 -1.899 1.00 . A A . 10 CYS H 1 1 24 14421 1 1 10 CYS HA H -4.842 2.583 -2.077 1.00 . A A . 10 CYS HA 1 1 24 14422 1 1 10 CYS HB2 H -4.151 5.518 -1.829 1.00 . A A . 10 CYS HB2 1 1 24 14423 1 1 10 CYS HB3 H -5.769 4.833 -1.929 1.00 . A A . 10 CYS HB3 1 1 24 14424 1 1 10 CYS N N -2.872 3.107 -1.750 1.00 . A A . 10 CYS N 1 1 24 14425 1 1 10 CYS O O -3.102 4.049 -4.320 1.00 . A A . 10 CYS O 1 1 24 14426 1 1 10 CYS SG S -4.817 4.534 0.236 1.00 . A A . 10 CYS SG 1 1 24 14427 1 1 11 ARG C C -5.673 5.030 -6.261 1.00 . A A . 11 ARG C 1 1 24 14428 1 1 11 ARG CA C -5.320 3.585 -5.907 1.00 . A A . 11 ARG CA 1 1 24 14429 1 1 11 ARG CB C -6.336 2.611 -6.517 1.00 . A A . 11 ARG CB 1 1 24 14430 1 1 11 ARG CD C -6.093 1.608 -8.812 1.00 . A A . 11 ARG CD 1 1 24 14431 1 1 11 ARG CG C -6.558 2.812 -8.009 1.00 . A A . 11 ARG CG 1 1 24 14432 1 1 11 ARG CZ C -6.705 0.434 -10.891 1.00 . A A . 11 ARG CZ 1 1 24 14433 1 1 11 ARG H H -6.046 3.091 -3.980 1.00 . A A . 11 ARG H 1 1 24 14434 1 1 11 ARG HA H -4.345 3.365 -6.308 1.00 . A A . 11 ARG HA 1 1 24 14435 1 1 11 ARG HB2 H -5.985 1.602 -6.360 1.00 . A A . 11 ARG HB2 1 1 24 14436 1 1 11 ARG HB3 H -7.283 2.734 -6.013 1.00 . A A . 11 ARG HB3 1 1 24 14437 1 1 11 ARG HD2 H -5.039 1.715 -9.020 1.00 . A A . 11 ARG HD2 1 1 24 14438 1 1 11 ARG HD3 H -6.254 0.716 -8.225 1.00 . A A . 11 ARG HD3 1 1 24 14439 1 1 11 ARG HE H -7.411 2.215 -10.332 1.00 . A A . 11 ARG HE 1 1 24 14440 1 1 11 ARG HG2 H -7.611 2.966 -8.188 1.00 . A A . 11 ARG HG2 1 1 24 14441 1 1 11 ARG HG3 H -6.006 3.683 -8.331 1.00 . A A . 11 ARG HG3 1 1 24 14442 1 1 11 ARG HH11 H -5.382 -0.559 -9.727 1.00 . A A . 11 ARG HH11 1 1 24 14443 1 1 11 ARG HH12 H -5.829 -1.363 -11.193 1.00 . A A . 11 ARG HH12 1 1 24 14444 1 1 11 ARG HH21 H -8.001 1.159 -12.262 1.00 . A A . 11 ARG HH21 1 1 24 14445 1 1 11 ARG HH22 H -7.315 -0.388 -12.633 1.00 . A A . 11 ARG HH22 1 1 24 14446 1 1 11 ARG N N -5.252 3.405 -4.461 1.00 . A A . 11 ARG N 1 1 24 14447 1 1 11 ARG NE N -6.814 1.481 -10.076 1.00 . A A . 11 ARG NE 1 1 24 14448 1 1 11 ARG NH1 N -5.906 -0.579 -10.578 1.00 . A A . 11 ARG NH1 1 1 24 14449 1 1 11 ARG NH2 N -7.397 0.398 -12.021 1.00 . A A . 11 ARG NH2 1 1 24 14450 1 1 11 ARG O O -4.786 5.867 -6.432 1.00 . A A . 11 ARG O 1 1 24 14451 1 1 12 GLN C C -8.226 7.269 -5.554 1.00 . A A . 12 GLN C 1 1 24 14452 1 1 12 GLN CA C -7.419 6.667 -6.700 1.00 . A A . 12 GLN CA 1 1 24 14453 1 1 12 GLN CB C -8.264 6.642 -7.975 1.00 . A A . 12 GLN CB 1 1 24 14454 1 1 12 GLN CD C -7.393 8.008 -9.913 1.00 . A A . 12 GLN CD 1 1 24 14455 1 1 12 GLN CG C -7.439 6.645 -9.252 1.00 . A A . 12 GLN CG 1 1 24 14456 1 1 12 GLN H H -7.630 4.618 -6.222 1.00 . A A . 12 GLN H 1 1 24 14457 1 1 12 GLN HA H -6.546 7.279 -6.870 1.00 . A A . 12 GLN HA 1 1 24 14458 1 1 12 GLN HB2 H -8.877 5.753 -7.970 1.00 . A A . 12 GLN HB2 1 1 24 14459 1 1 12 GLN HB3 H -8.906 7.511 -7.985 1.00 . A A . 12 GLN HB3 1 1 24 14460 1 1 12 GLN HE21 H -6.979 8.868 -8.168 1.00 . A A . 12 GLN HE21 1 1 24 14461 1 1 12 GLN HE22 H -7.091 9.935 -9.523 1.00 . A A . 12 GLN HE22 1 1 24 14462 1 1 12 GLN HG2 H -6.430 6.343 -9.014 1.00 . A A . 12 GLN HG2 1 1 24 14463 1 1 12 GLN HG3 H -7.871 5.939 -9.946 1.00 . A A . 12 GLN HG3 1 1 24 14464 1 1 12 GLN N N -6.966 5.322 -6.369 1.00 . A A . 12 GLN N 1 1 24 14465 1 1 12 GLN NE2 N -7.128 9.041 -9.121 1.00 . A A . 12 GLN NE2 1 1 24 14466 1 1 12 GLN O O -8.311 8.489 -5.417 1.00 . A A . 12 GLN O 1 1 24 14467 1 1 12 GLN OE1 O -7.592 8.132 -11.121 1.00 . A A . 12 GLN OE1 1 1 24 14468 1 1 13 CYS C C -10.157 5.665 -2.804 1.00 . A A . 13 CYS C 1 1 24 14469 1 1 13 CYS CA C -9.618 6.853 -3.597 1.00 . A A . 13 CYS CA 1 1 24 14470 1 1 13 CYS CB C -10.782 7.723 -4.079 1.00 . A A . 13 CYS CB 1 1 24 14471 1 1 13 CYS H H -8.711 5.444 -4.892 1.00 . A A . 13 CYS H 1 1 24 14472 1 1 13 CYS HA H -8.982 7.442 -2.954 1.00 . A A . 13 CYS HA 1 1 24 14473 1 1 13 CYS HB2 H -10.402 8.488 -4.739 1.00 . A A . 13 CYS HB2 1 1 24 14474 1 1 13 CYS HB3 H -11.484 7.105 -4.620 1.00 . A A . 13 CYS HB3 1 1 24 14475 1 1 13 CYS N N -8.817 6.405 -4.732 1.00 . A A . 13 CYS N 1 1 24 14476 1 1 13 CYS O O -11.275 5.706 -2.291 1.00 . A A . 13 CYS O 1 1 24 14477 1 1 13 CYS SG S -11.695 8.556 -2.739 1.00 . A A . 13 CYS SG 1 1 24 14478 1 1 14 LYS C C -8.552 2.555 -1.624 1.00 . A A . 14 LYS C 1 1 24 14479 1 1 14 LYS CA C -9.762 3.414 -1.972 1.00 . A A . 14 LYS CA 1 1 24 14480 1 1 14 LYS CB C -10.761 2.599 -2.795 1.00 . A A . 14 LYS CB 1 1 24 14481 1 1 14 LYS CD C -12.557 3.931 -3.945 1.00 . A A . 14 LYS CD 1 1 24 14482 1 1 14 LYS CE C -13.219 3.064 -5.003 1.00 . A A . 14 LYS CE 1 1 24 14483 1 1 14 LYS CG C -12.187 3.121 -2.712 1.00 . A A . 14 LYS CG 1 1 24 14484 1 1 14 LYS H H -8.476 4.629 -3.133 1.00 . A A . 14 LYS H 1 1 24 14485 1 1 14 LYS HA H -10.238 3.733 -1.057 1.00 . A A . 14 LYS HA 1 1 24 14486 1 1 14 LYS HB2 H -10.454 2.614 -3.830 1.00 . A A . 14 LYS HB2 1 1 24 14487 1 1 14 LYS HB3 H -10.754 1.579 -2.441 1.00 . A A . 14 LYS HB3 1 1 24 14488 1 1 14 LYS HD2 H -13.242 4.715 -3.657 1.00 . A A . 14 LYS HD2 1 1 24 14489 1 1 14 LYS HD3 H -11.660 4.368 -4.359 1.00 . A A . 14 LYS HD3 1 1 24 14490 1 1 14 LYS HE2 H -13.343 3.647 -5.903 1.00 . A A . 14 LYS HE2 1 1 24 14491 1 1 14 LYS HE3 H -12.579 2.218 -5.209 1.00 . A A . 14 LYS HE3 1 1 24 14492 1 1 14 LYS HG2 H -12.862 2.283 -2.629 1.00 . A A . 14 LYS HG2 1 1 24 14493 1 1 14 LYS HG3 H -12.279 3.749 -1.838 1.00 . A A . 14 LYS HG3 1 1 24 14494 1 1 14 LYS HZ1 H -14.982 3.241 -3.896 1.00 . A A . 14 LYS HZ1 1 1 24 14495 1 1 14 LYS HZ2 H -15.182 2.455 -5.380 1.00 . A A . 14 LYS HZ2 1 1 24 14496 1 1 14 LYS HZ3 H -14.450 1.646 -4.087 1.00 . A A . 14 LYS HZ3 1 1 24 14497 1 1 14 LYS N N -9.357 4.607 -2.705 1.00 . A A . 14 LYS N 1 1 24 14498 1 1 14 LYS NZ N -14.551 2.567 -4.561 1.00 . A A . 14 LYS NZ 1 1 24 14499 1 1 14 LYS O O -7.662 2.355 -2.451 1.00 . A A . 14 LYS O 1 1 24 14500 1 1 15 LEU C C -7.239 0.010 -0.868 1.00 . A A . 15 LEU C 1 1 24 14501 1 1 15 LEU CA C -7.426 1.206 0.060 1.00 . A A . 15 LEU CA 1 1 24 14502 1 1 15 LEU CB C -7.682 0.728 1.491 1.00 . A A . 15 LEU CB 1 1 24 14503 1 1 15 LEU CD1 C -7.362 1.133 3.944 1.00 . A A . 15 LEU CD1 1 1 24 14504 1 1 15 LEU CD2 C -5.373 0.814 2.459 1.00 . A A . 15 LEU CD2 1 1 24 14505 1 1 15 LEU CG C -6.788 1.366 2.555 1.00 . A A . 15 LEU CG 1 1 24 14506 1 1 15 LEU H H -9.266 2.241 0.217 1.00 . A A . 15 LEU H 1 1 24 14507 1 1 15 LEU HA H -6.526 1.803 0.044 1.00 . A A . 15 LEU HA 1 1 24 14508 1 1 15 LEU HB2 H -8.712 0.942 1.741 1.00 . A A . 15 LEU HB2 1 1 24 14509 1 1 15 LEU HB3 H -7.537 -0.341 1.526 1.00 . A A . 15 LEU HB3 1 1 24 14510 1 1 15 LEU HD11 H -8.428 1.302 3.925 1.00 . A A . 15 LEU HD11 1 1 24 14511 1 1 15 LEU HD12 H -7.164 0.117 4.250 1.00 . A A . 15 LEU HD12 1 1 24 14512 1 1 15 LEU HD13 H -6.901 1.816 4.642 1.00 . A A . 15 LEU HD13 1 1 24 14513 1 1 15 LEU HD21 H -5.395 -0.150 1.972 1.00 . A A . 15 LEU HD21 1 1 24 14514 1 1 15 LEU HD22 H -4.759 1.493 1.887 1.00 . A A . 15 LEU HD22 1 1 24 14515 1 1 15 LEU HD23 H -4.961 0.705 3.451 1.00 . A A . 15 LEU HD23 1 1 24 14516 1 1 15 LEU HG H -6.744 2.432 2.386 1.00 . A A . 15 LEU HG 1 1 24 14517 1 1 15 LEU N N -8.527 2.047 -0.397 1.00 . A A . 15 LEU N 1 1 24 14518 1 1 15 LEU O O -8.113 -0.850 -0.972 1.00 . A A . 15 LEU O 1 1 24 14519 1 1 16 LYS C C -5.979 -2.483 -1.790 1.00 . A A . 16 LYS C 1 1 24 14520 1 1 16 LYS CA C -5.794 -1.125 -2.467 1.00 . A A . 16 LYS CA 1 1 24 14521 1 1 16 LYS CB C -4.364 -0.993 -2.996 1.00 . A A . 16 LYS CB 1 1 24 14522 1 1 16 LYS CD C -4.019 0.290 -5.131 1.00 . A A . 16 LYS CD 1 1 24 14523 1 1 16 LYS CE C -2.533 0.579 -5.268 1.00 . A A . 16 LYS CE 1 1 24 14524 1 1 16 LYS CG C -4.266 -1.076 -4.511 1.00 . A A . 16 LYS CG 1 1 24 14525 1 1 16 LYS H H -5.438 0.681 -1.421 1.00 . A A . 16 LYS H 1 1 24 14526 1 1 16 LYS HA H -6.483 -1.051 -3.296 1.00 . A A . 16 LYS HA 1 1 24 14527 1 1 16 LYS HB2 H -3.964 -0.040 -2.683 1.00 . A A . 16 LYS HB2 1 1 24 14528 1 1 16 LYS HB3 H -3.760 -1.783 -2.574 1.00 . A A . 16 LYS HB3 1 1 24 14529 1 1 16 LYS HD2 H -4.472 0.317 -6.111 1.00 . A A . 16 LYS HD2 1 1 24 14530 1 1 16 LYS HD3 H -4.468 1.046 -4.504 1.00 . A A . 16 LYS HD3 1 1 24 14531 1 1 16 LYS HE2 H -2.138 -0.011 -6.082 1.00 . A A . 16 LYS HE2 1 1 24 14532 1 1 16 LYS HE3 H -2.402 1.628 -5.489 1.00 . A A . 16 LYS HE3 1 1 24 14533 1 1 16 LYS HG2 H -3.449 -1.731 -4.774 1.00 . A A . 16 LYS HG2 1 1 24 14534 1 1 16 LYS HG3 H -5.190 -1.476 -4.900 1.00 . A A . 16 LYS HG3 1 1 24 14535 1 1 16 LYS HZ1 H -2.183 0.775 -3.218 1.00 . A A . 16 LYS HZ1 1 1 24 14536 1 1 16 LYS HZ2 H -1.853 -0.769 -3.825 1.00 . A A . 16 LYS HZ2 1 1 24 14537 1 1 16 LYS HZ3 H -0.783 0.504 -4.130 1.00 . A A . 16 LYS HZ3 1 1 24 14538 1 1 16 LYS N N -6.095 -0.036 -1.544 1.00 . A A . 16 LYS N 1 1 24 14539 1 1 16 LYS NZ N -1.786 0.249 -4.023 1.00 . A A . 16 LYS NZ 1 1 24 14540 1 1 16 LYS O O -5.760 -2.620 -0.586 1.00 . A A . 16 LYS O 1 1 24 14541 1 1 17 PRO C C -5.392 -5.380 -1.258 1.00 . A A . 17 PRO C 1 1 24 14542 1 1 17 PRO CA C -6.604 -4.858 -2.023 1.00 . A A . 17 PRO CA 1 1 24 14543 1 1 17 PRO CB C -6.848 -5.703 -3.276 1.00 . A A . 17 PRO CB 1 1 24 14544 1 1 17 PRO CD C -6.674 -3.433 -4.002 1.00 . A A . 17 PRO CD 1 1 24 14545 1 1 17 PRO CG C -7.361 -4.739 -4.289 1.00 . A A . 17 PRO CG 1 1 24 14546 1 1 17 PRO HA H -7.474 -4.895 -1.385 1.00 . A A . 17 PRO HA 1 1 24 14547 1 1 17 PRO HB2 H -5.921 -6.156 -3.594 1.00 . A A . 17 PRO HB2 1 1 24 14548 1 1 17 PRO HB3 H -7.575 -6.471 -3.059 1.00 . A A . 17 PRO HB3 1 1 24 14549 1 1 17 PRO HD2 H -5.761 -3.354 -4.573 1.00 . A A . 17 PRO HD2 1 1 24 14550 1 1 17 PRO HD3 H -7.331 -2.605 -4.222 1.00 . A A . 17 PRO HD3 1 1 24 14551 1 1 17 PRO HG2 H -7.112 -5.084 -5.282 1.00 . A A . 17 PRO HG2 1 1 24 14552 1 1 17 PRO HG3 H -8.430 -4.631 -4.185 1.00 . A A . 17 PRO HG3 1 1 24 14553 1 1 17 PRO N N -6.389 -3.508 -2.557 1.00 . A A . 17 PRO N 1 1 24 14554 1 1 17 PRO O O -4.249 -5.125 -1.636 1.00 . A A . 17 PRO O 1 1 24 14555 1 1 18 ALA C C -3.701 -7.610 -0.179 1.00 . A A . 18 ALA C 1 1 24 14556 1 1 18 ALA CA C -4.583 -6.673 0.639 1.00 . A A . 18 ALA CA 1 1 24 14557 1 1 18 ALA CB C -5.167 -7.407 1.837 1.00 . A A . 18 ALA CB 1 1 24 14558 1 1 18 ALA H H -6.584 -6.282 0.071 1.00 . A A . 18 ALA H 1 1 24 14559 1 1 18 ALA HA H -3.980 -5.855 1.007 1.00 . A A . 18 ALA HA 1 1 24 14560 1 1 18 ALA HB1 H -6.086 -6.928 2.140 1.00 . A A . 18 ALA HB1 1 1 24 14561 1 1 18 ALA HB2 H -5.367 -8.433 1.568 1.00 . A A . 18 ALA HB2 1 1 24 14562 1 1 18 ALA HB3 H -4.461 -7.380 2.654 1.00 . A A . 18 ALA HB3 1 1 24 14563 1 1 18 ALA N N -5.652 -6.113 -0.179 1.00 . A A . 18 ALA N 1 1 24 14564 1 1 18 ALA O O -4.194 -8.533 -0.828 1.00 . A A . 18 ALA O 1 1 24 14565 1 1 19 GLY C C -0.748 -7.434 -1.989 1.00 . A A . 19 GLY C 1 1 24 14566 1 1 19 GLY CA C -1.466 -8.196 -0.889 1.00 . A A . 19 GLY CA 1 1 24 14567 1 1 19 GLY H H -2.060 -6.616 0.389 1.00 . A A . 19 GLY H 1 1 24 14568 1 1 19 GLY HA2 H -2.009 -9.018 -1.332 1.00 . A A . 19 GLY HA2 1 1 24 14569 1 1 19 GLY HA3 H -0.731 -8.595 -0.205 1.00 . A A . 19 GLY HA3 1 1 24 14570 1 1 19 GLY N N -2.395 -7.366 -0.145 1.00 . A A . 19 GLY N 1 1 24 14571 1 1 19 GLY O O 0.142 -7.976 -2.645 1.00 . A A . 19 GLY O 1 1 24 14572 1 1 20 THR C C 0.810 -4.771 -2.729 1.00 . A A . 20 THR C 1 1 24 14573 1 1 20 THR CA C -0.514 -5.347 -3.220 1.00 . A A . 20 THR CA 1 1 24 14574 1 1 20 THR CB C -1.458 -4.214 -3.625 1.00 . A A . 20 THR CB 1 1 24 14575 1 1 20 THR CG2 C -1.140 -3.626 -4.982 1.00 . A A . 20 THR CG2 1 1 24 14576 1 1 20 THR H H -1.844 -5.797 -1.639 1.00 . A A . 20 THR H 1 1 24 14577 1 1 20 THR HA H -0.325 -5.971 -4.080 1.00 . A A . 20 THR HA 1 1 24 14578 1 1 20 THR HB H -1.385 -3.420 -2.895 1.00 . A A . 20 THR HB 1 1 24 14579 1 1 20 THR HG1 H -3.264 -4.348 -2.878 1.00 . A A . 20 THR HG1 1 1 24 14580 1 1 20 THR HG21 H -0.133 -3.235 -4.978 1.00 . A A . 20 THR HG21 1 1 24 14581 1 1 20 THR HG22 H -1.225 -4.394 -5.737 1.00 . A A . 20 THR HG22 1 1 24 14582 1 1 20 THR HG23 H -1.834 -2.828 -5.201 1.00 . A A . 20 THR HG23 1 1 24 14583 1 1 20 THR N N -1.131 -6.176 -2.192 1.00 . A A . 20 THR N 1 1 24 14584 1 1 20 THR O O 0.838 -3.938 -1.823 1.00 . A A . 20 THR O 1 1 24 14585 1 1 20 THR OG1 O -2.800 -4.666 -3.656 1.00 . A A . 20 THR OG1 1 1 24 14586 1 1 21 THR C C 3.394 -3.267 -3.276 1.00 . A A . 21 THR C 1 1 24 14587 1 1 21 THR CA C 3.232 -4.749 -2.954 1.00 . A A . 21 THR CA 1 1 24 14588 1 1 21 THR CB C 4.313 -5.564 -3.669 1.00 . A A . 21 THR CB 1 1 24 14589 1 1 21 THR CG2 C 5.215 -6.320 -2.718 1.00 . A A . 21 THR CG2 1 1 24 14590 1 1 21 THR H H 1.819 -5.885 -4.047 1.00 . A A . 21 THR H 1 1 24 14591 1 1 21 THR HA H 3.338 -4.885 -1.888 1.00 . A A . 21 THR HA 1 1 24 14592 1 1 21 THR HB H 4.932 -4.895 -4.250 1.00 . A A . 21 THR HB 1 1 24 14593 1 1 21 THR HG1 H 3.922 -6.259 -5.459 1.00 . A A . 21 THR HG1 1 1 24 14594 1 1 21 THR HG21 H 4.612 -6.892 -2.029 1.00 . A A . 21 THR HG21 1 1 24 14595 1 1 21 THR HG22 H 5.852 -6.988 -3.280 1.00 . A A . 21 THR HG22 1 1 24 14596 1 1 21 THR HG23 H 5.825 -5.619 -2.168 1.00 . A A . 21 THR HG23 1 1 24 14597 1 1 21 THR N N 1.905 -5.220 -3.332 1.00 . A A . 21 THR N 1 1 24 14598 1 1 21 THR O O 2.825 -2.766 -4.246 1.00 . A A . 21 THR O 1 1 24 14599 1 1 21 THR OG1 O 3.732 -6.509 -4.552 1.00 . A A . 21 THR OG1 1 1 24 14600 1 1 22 CYS C C 5.651 -0.913 -3.512 1.00 . A A . 22 CYS C 1 1 24 14601 1 1 22 CYS CA C 4.412 -1.146 -2.653 1.00 . A A . 22 CYS CA 1 1 24 14602 1 1 22 CYS CB C 4.573 -0.443 -1.304 1.00 . A A . 22 CYS CB 1 1 24 14603 1 1 22 CYS H H 4.600 -3.026 -1.700 1.00 . A A . 22 CYS H 1 1 24 14604 1 1 22 CYS HA H 3.553 -0.735 -3.163 1.00 . A A . 22 CYS HA 1 1 24 14605 1 1 22 CYS HB2 H 5.184 -1.056 -0.658 1.00 . A A . 22 CYS HB2 1 1 24 14606 1 1 22 CYS HB3 H 5.061 0.508 -1.458 1.00 . A A . 22 CYS HB3 1 1 24 14607 1 1 22 CYS N N 4.174 -2.571 -2.456 1.00 . A A . 22 CYS N 1 1 24 14608 1 1 22 CYS O O 5.546 -0.565 -4.688 1.00 . A A . 22 CYS O 1 1 24 14609 1 1 22 CYS SG S 3.001 -0.127 -0.439 1.00 . A A . 22 CYS SG 1 1 24 14610 1 1 23 TRP C C 8.431 -2.155 -4.453 1.00 . A A . 23 TRP C 1 1 24 14611 1 1 23 TRP CA C 8.082 -0.920 -3.630 1.00 . A A . 23 TRP CA 1 1 24 14612 1 1 23 TRP CB C 9.210 -0.615 -2.643 1.00 . A A . 23 TRP CB 1 1 24 14613 1 1 23 TRP CD1 C 10.711 0.301 -4.506 1.00 . A A . 23 TRP CD1 1 1 24 14614 1 1 23 TRP CD2 C 11.824 -0.659 -2.817 1.00 . A A . 23 TRP CD2 1 1 24 14615 1 1 23 TRP CE2 C 12.757 -0.200 -3.767 1.00 . A A . 23 TRP CE2 1 1 24 14616 1 1 23 TRP CE3 C 12.293 -1.297 -1.666 1.00 . A A . 23 TRP CE3 1 1 24 14617 1 1 23 TRP CG C 10.521 -0.327 -3.309 1.00 . A A . 23 TRP CG 1 1 24 14618 1 1 23 TRP CH2 C 14.561 -0.989 -2.463 1.00 . A A . 23 TRP CH2 1 1 24 14619 1 1 23 TRP CZ2 C 14.130 -0.361 -3.599 1.00 . A A . 23 TRP CZ2 1 1 24 14620 1 1 23 TRP CZ3 C 13.657 -1.456 -1.501 1.00 . A A . 23 TRP CZ3 1 1 24 14621 1 1 23 TRP H H 6.842 -1.387 -1.978 1.00 . A A . 23 TRP H 1 1 24 14622 1 1 23 TRP HA H 7.962 -0.081 -4.296 1.00 . A A . 23 TRP HA 1 1 24 14623 1 1 23 TRP HB2 H 8.940 0.248 -2.053 1.00 . A A . 23 TRP HB2 1 1 24 14624 1 1 23 TRP HB3 H 9.347 -1.464 -1.989 1.00 . A A . 23 TRP HB3 1 1 24 14625 1 1 23 TRP HD1 H 9.913 0.675 -5.130 1.00 . A A . 23 TRP HD1 1 1 24 14626 1 1 23 TRP HE1 H 12.443 0.789 -5.590 1.00 . A A . 23 TRP HE1 1 1 24 14627 1 1 23 TRP HE3 H 11.611 -1.663 -0.913 1.00 . A A . 23 TRP HE3 1 1 24 14628 1 1 23 TRP HH2 H 15.617 -1.136 -2.293 1.00 . A A . 23 TRP HH2 1 1 24 14629 1 1 23 TRP HZ2 H 14.841 -0.007 -4.332 1.00 . A A . 23 TRP HZ2 1 1 24 14630 1 1 23 TRP HZ3 H 14.037 -1.947 -0.618 1.00 . A A . 23 TRP HZ3 1 1 24 14631 1 1 23 TRP N N 6.823 -1.109 -2.918 1.00 . A A . 23 TRP N 1 1 24 14632 1 1 23 TRP NE1 N 12.053 0.382 -4.789 1.00 . A A . 23 TRP NE1 1 1 24 14633 1 1 23 TRP O O 8.974 -2.047 -5.553 1.00 . A A . 23 TRP O 1 1 24 14634 1 1 24 ARG C C 9.887 -4.736 -4.873 1.00 . A A . 24 ARG C 1 1 24 14635 1 1 24 ARG CA C 8.394 -4.585 -4.597 1.00 . A A . 24 ARG CA 1 1 24 14636 1 1 24 ARG CB C 7.611 -4.661 -5.909 1.00 . A A . 24 ARG CB 1 1 24 14637 1 1 24 ARG CD C 8.185 -6.869 -6.962 1.00 . A A . 24 ARG CD 1 1 24 14638 1 1 24 ARG CG C 7.118 -6.059 -6.243 1.00 . A A . 24 ARG CG 1 1 24 14639 1 1 24 ARG CZ C 8.382 -9.010 -8.165 1.00 . A A . 24 ARG CZ 1 1 24 14640 1 1 24 ARG H H 7.684 -3.346 -3.034 1.00 . A A . 24 ARG H 1 1 24 14641 1 1 24 ARG HA H 8.076 -5.390 -3.952 1.00 . A A . 24 ARG HA 1 1 24 14642 1 1 24 ARG HB2 H 6.754 -4.007 -5.842 1.00 . A A . 24 ARG HB2 1 1 24 14643 1 1 24 ARG HB3 H 8.247 -4.325 -6.715 1.00 . A A . 24 ARG HB3 1 1 24 14644 1 1 24 ARG HD2 H 8.547 -6.296 -7.803 1.00 . A A . 24 ARG HD2 1 1 24 14645 1 1 24 ARG HD3 H 8.999 -7.056 -6.278 1.00 . A A . 24 ARG HD3 1 1 24 14646 1 1 24 ARG HE H 6.741 -8.373 -7.226 1.00 . A A . 24 ARG HE 1 1 24 14647 1 1 24 ARG HG2 H 6.853 -6.565 -5.327 1.00 . A A . 24 ARG HG2 1 1 24 14648 1 1 24 ARG HG3 H 6.248 -5.981 -6.879 1.00 . A A . 24 ARG HG3 1 1 24 14649 1 1 24 ARG HH11 H 10.060 -7.881 -8.184 1.00 . A A . 24 ARG HH11 1 1 24 14650 1 1 24 ARG HH12 H 10.173 -9.391 -9.023 1.00 . A A . 24 ARG HH12 1 1 24 14651 1 1 24 ARG HH21 H 6.887 -10.360 -8.329 1.00 . A A . 24 ARG HH21 1 1 24 14652 1 1 24 ARG HH22 H 8.372 -10.799 -9.106 1.00 . A A . 24 ARG HH22 1 1 24 14653 1 1 24 ARG N N 8.115 -3.327 -3.914 1.00 . A A . 24 ARG N 1 1 24 14654 1 1 24 ARG NE N 7.668 -8.146 -7.447 1.00 . A A . 24 ARG NE 1 1 24 14655 1 1 24 ARG NH1 N 9.642 -8.738 -8.484 1.00 . A A . 24 ARG NH1 1 1 24 14656 1 1 24 ARG NH2 N 7.836 -10.150 -8.566 1.00 . A A . 24 ARG NH2 1 1 24 14657 1 1 24 ARG O O 10.443 -4.048 -5.729 1.00 . A A . 24 ARG O 1 1 24 14658 1 1 25 THR C C 12.327 -7.293 -3.858 1.00 . A A . 25 THR C 1 1 24 14659 1 1 25 THR CA C 11.958 -5.884 -4.309 1.00 . A A . 25 THR CA 1 1 24 14660 1 1 25 THR CB C 12.766 -4.855 -3.518 1.00 . A A . 25 THR CB 1 1 24 14661 1 1 25 THR CG2 C 14.059 -4.458 -4.198 1.00 . A A . 25 THR CG2 1 1 24 14662 1 1 25 THR H H 10.031 -6.160 -3.477 1.00 . A A . 25 THR H 1 1 24 14663 1 1 25 THR HA H 12.191 -5.782 -5.358 1.00 . A A . 25 THR HA 1 1 24 14664 1 1 25 THR HB H 13.015 -5.273 -2.553 1.00 . A A . 25 THR HB 1 1 24 14665 1 1 25 THR HG1 H 11.875 -3.230 -4.150 1.00 . A A . 25 THR HG1 1 1 24 14666 1 1 25 THR HG21 H 14.170 -5.019 -5.114 1.00 . A A . 25 THR HG21 1 1 24 14667 1 1 25 THR HG22 H 14.038 -3.402 -4.422 1.00 . A A . 25 THR HG22 1 1 24 14668 1 1 25 THR HG23 H 14.890 -4.671 -3.542 1.00 . A A . 25 THR HG23 1 1 24 14669 1 1 25 THR N N 10.529 -5.642 -4.143 1.00 . A A . 25 THR N 1 1 24 14670 1 1 25 THR O O 11.566 -7.946 -3.144 1.00 . A A . 25 THR O 1 1 24 14671 1 1 25 THR OG1 O 12.010 -3.675 -3.311 1.00 . A A . 25 THR OG1 1 1 24 14672 1 1 26 SER C C 14.684 -9.067 -2.572 1.00 . A A . 26 SER C 1 1 24 14673 1 1 26 SER CA C 13.968 -9.089 -3.920 1.00 . A A . 26 SER CA 1 1 24 14674 1 1 26 SER CB C 14.904 -9.633 -5.002 1.00 . A A . 26 SER CB 1 1 24 14675 1 1 26 SER H H 14.061 -7.189 -4.848 1.00 . A A . 26 SER H 1 1 24 14676 1 1 26 SER HA H 13.106 -9.735 -3.845 1.00 . A A . 26 SER HA 1 1 24 14677 1 1 26 SER HB2 H 14.440 -9.510 -5.970 1.00 . A A . 26 SER HB2 1 1 24 14678 1 1 26 SER HB3 H 15.835 -9.086 -4.978 1.00 . A A . 26 SER HB3 1 1 24 14679 1 1 26 SER HG H 15.488 -11.398 -5.618 1.00 . A A . 26 SER HG 1 1 24 14680 1 1 26 SER N N 13.498 -7.757 -4.281 1.00 . A A . 26 SER N 1 1 24 14681 1 1 26 SER O O 15.844 -9.466 -2.466 1.00 . A A . 26 SER O 1 1 24 14682 1 1 26 SER OG O 15.176 -11.008 -4.798 1.00 . A A . 26 SER OG 1 1 24 14683 1 1 27 VAL C C 13.533 -7.983 0.795 1.00 . A A . 27 VAL C 1 1 24 14684 1 1 27 VAL CA C 14.551 -8.523 -0.204 1.00 . A A . 27 VAL CA 1 1 24 14685 1 1 27 VAL CB C 15.811 -7.635 -0.174 1.00 . A A . 27 VAL CB 1 1 24 14686 1 1 27 VAL CG1 C 15.474 -6.209 -0.586 1.00 . A A . 27 VAL CG1 1 1 24 14687 1 1 27 VAL CG2 C 16.455 -7.662 1.204 1.00 . A A . 27 VAL CG2 1 1 24 14688 1 1 27 VAL H H 13.064 -8.295 -1.692 1.00 . A A . 27 VAL H 1 1 24 14689 1 1 27 VAL HA H 14.834 -9.521 0.093 1.00 . A A . 27 VAL HA 1 1 24 14690 1 1 27 VAL HB H 16.521 -8.030 -0.886 1.00 . A A . 27 VAL HB 1 1 24 14691 1 1 27 VAL HG11 H 14.773 -6.228 -1.407 1.00 . A A . 27 VAL HG11 1 1 24 14692 1 1 27 VAL HG12 H 15.034 -5.688 0.252 1.00 . A A . 27 VAL HG12 1 1 24 14693 1 1 27 VAL HG13 H 16.375 -5.701 -0.894 1.00 . A A . 27 VAL HG13 1 1 24 14694 1 1 27 VAL HG21 H 15.722 -7.389 1.949 1.00 . A A . 27 VAL HG21 1 1 24 14695 1 1 27 VAL HG22 H 16.825 -8.656 1.410 1.00 . A A . 27 VAL HG22 1 1 24 14696 1 1 27 VAL HG23 H 17.276 -6.960 1.232 1.00 . A A . 27 VAL HG23 1 1 24 14697 1 1 27 VAL N N 13.984 -8.597 -1.545 1.00 . A A . 27 VAL N 1 1 24 14698 1 1 27 VAL O O 13.461 -8.442 1.935 1.00 . A A . 27 VAL O 1 1 24 14699 1 1 28 SER C C 10.405 -6.273 0.471 1.00 . A A . 28 SER C 1 1 24 14700 1 1 28 SER CA C 11.732 -6.400 1.212 1.00 . A A . 28 SER CA 1 1 24 14701 1 1 28 SER CB C 12.195 -5.024 1.693 1.00 . A A . 28 SER CB 1 1 24 14702 1 1 28 SER H H 12.855 -6.683 -0.561 1.00 . A A . 28 SER H 1 1 24 14703 1 1 28 SER HA H 11.593 -7.043 2.068 1.00 . A A . 28 SER HA 1 1 24 14704 1 1 28 SER HB2 H 11.456 -4.613 2.365 1.00 . A A . 28 SER HB2 1 1 24 14705 1 1 28 SER HB3 H 13.137 -5.124 2.211 1.00 . A A . 28 SER HB3 1 1 24 14706 1 1 28 SER HG H 12.926 -3.402 0.873 1.00 . A A . 28 SER HG 1 1 24 14707 1 1 28 SER N N 12.748 -7.005 0.358 1.00 . A A . 28 SER N 1 1 24 14708 1 1 28 SER O O 10.096 -5.224 -0.094 1.00 . A A . 28 SER O 1 1 24 14709 1 1 28 SER OG O 12.365 -4.133 0.604 1.00 . A A . 28 SER OG 1 1 24 14710 1 1 29 SER C C 7.272 -6.657 0.659 1.00 . A A . 29 SER C 1 1 24 14711 1 1 29 SER CA C 8.328 -7.356 -0.191 1.00 . A A . 29 SER CA 1 1 24 14712 1 1 29 SER CB C 7.893 -8.792 -0.487 1.00 . A A . 29 SER CB 1 1 24 14713 1 1 29 SER H H 9.924 -8.154 0.948 1.00 . A A . 29 SER H 1 1 24 14714 1 1 29 SER HA H 8.434 -6.822 -1.123 1.00 . A A . 29 SER HA 1 1 24 14715 1 1 29 SER HB2 H 8.767 -9.406 -0.643 1.00 . A A . 29 SER HB2 1 1 24 14716 1 1 29 SER HB3 H 7.329 -9.176 0.351 1.00 . A A . 29 SER HB3 1 1 24 14717 1 1 29 SER HG H 6.191 -8.566 -1.431 1.00 . A A . 29 SER HG 1 1 24 14718 1 1 29 SER N N 9.623 -7.348 0.480 1.00 . A A . 29 SER N 1 1 24 14719 1 1 29 SER O O 6.512 -7.305 1.379 1.00 . A A . 29 SER O 1 1 24 14720 1 1 29 SER OG O 7.082 -8.851 -1.648 1.00 . A A . 29 SER OG 1 1 24 14721 1 1 30 HIS C C 4.860 -4.709 0.764 1.00 . A A . 30 HIS C 1 1 24 14722 1 1 30 HIS CA C 6.266 -4.545 1.330 1.00 . A A . 30 HIS CA 1 1 24 14723 1 1 30 HIS CB C 6.663 -3.067 1.321 1.00 . A A . 30 HIS CB 1 1 24 14724 1 1 30 HIS CD2 C 9.034 -3.493 2.284 1.00 . A A . 30 HIS CD2 1 1 24 14725 1 1 30 HIS CE1 C 9.247 -1.643 3.441 1.00 . A A . 30 HIS CE1 1 1 24 14726 1 1 30 HIS CG C 7.898 -2.775 2.114 1.00 . A A . 30 HIS CG 1 1 24 14727 1 1 30 HIS H H 7.862 -4.872 -0.022 1.00 . A A . 30 HIS H 1 1 24 14728 1 1 30 HIS HA H 6.275 -4.904 2.348 1.00 . A A . 30 HIS HA 1 1 24 14729 1 1 30 HIS HB2 H 6.841 -2.756 0.303 1.00 . A A . 30 HIS HB2 1 1 24 14730 1 1 30 HIS HB3 H 5.854 -2.483 1.735 1.00 . A A . 30 HIS HB3 1 1 24 14731 1 1 30 HIS HD1 H 7.411 -0.895 2.933 1.00 . A A . 30 HIS HD1 1 1 24 14732 1 1 30 HIS HD2 H 9.253 -4.458 1.848 1.00 . A A . 30 HIS HD2 1 1 24 14733 1 1 30 HIS HE1 H 9.648 -0.872 4.082 1.00 . A A . 30 HIS HE1 1 1 24 14734 1 1 30 HIS HE2 H 10.776 -3.002 3.348 1.00 . A A . 30 HIS HE2 1 1 24 14735 1 1 30 HIS N N 7.230 -5.332 0.570 1.00 . A A . 30 HIS N 1 1 24 14736 1 1 30 HIS ND1 N 8.063 -1.621 2.853 1.00 . A A . 30 HIS ND1 1 1 24 14737 1 1 30 HIS NE2 N 9.854 -2.768 3.112 1.00 . A A . 30 HIS NE2 1 1 24 14738 1 1 30 HIS O O 4.465 -3.997 -0.159 1.00 . A A . 30 HIS O 1 1 24 14739 1 1 31 TYR C C 1.759 -4.979 1.575 1.00 . A A . 31 TYR C 1 1 24 14740 1 1 31 TYR CA C 2.745 -5.908 0.875 1.00 . A A . 31 TYR CA 1 1 24 14741 1 1 31 TYR CB C 2.365 -7.366 1.138 1.00 . A A . 31 TYR CB 1 1 24 14742 1 1 31 TYR CD1 C 2.616 -8.169 -1.242 1.00 . A A . 31 TYR CD1 1 1 24 14743 1 1 31 TYR CD2 C 3.709 -9.400 0.483 1.00 . A A . 31 TYR CD2 1 1 24 14744 1 1 31 TYR CE1 C 3.110 -9.048 -2.187 1.00 . A A . 31 TYR CE1 1 1 24 14745 1 1 31 TYR CE2 C 4.207 -10.283 -0.457 1.00 . A A . 31 TYR CE2 1 1 24 14746 1 1 31 TYR CG C 2.907 -8.330 0.107 1.00 . A A . 31 TYR CG 1 1 24 14747 1 1 31 TYR CZ C 3.904 -10.103 -1.790 1.00 . A A . 31 TYR CZ 1 1 24 14748 1 1 31 TYR H H 4.479 -6.186 2.056 1.00 . A A . 31 TYR H 1 1 24 14749 1 1 31 TYR HA H 2.705 -5.721 -0.188 1.00 . A A . 31 TYR HA 1 1 24 14750 1 1 31 TYR HB2 H 2.749 -7.662 2.103 1.00 . A A . 31 TYR HB2 1 1 24 14751 1 1 31 TYR HB3 H 1.288 -7.455 1.143 1.00 . A A . 31 TYR HB3 1 1 24 14752 1 1 31 TYR HD1 H 1.994 -7.342 -1.550 1.00 . A A . 31 TYR HD1 1 1 24 14753 1 1 31 TYR HD2 H 3.944 -9.539 1.528 1.00 . A A . 31 TYR HD2 1 1 24 14754 1 1 31 TYR HE1 H 2.873 -8.907 -3.232 1.00 . A A . 31 TYR HE1 1 1 24 14755 1 1 31 TYR HE2 H 4.829 -11.109 -0.145 1.00 . A A . 31 TYR HE2 1 1 24 14756 1 1 31 TYR HH H 3.668 -11.412 -3.178 1.00 . A A . 31 TYR HH 1 1 24 14757 1 1 31 TYR N N 4.108 -5.651 1.323 1.00 . A A . 31 TYR N 1 1 24 14758 1 1 31 TYR O O 2.031 -4.477 2.666 1.00 . A A . 31 TYR O 1 1 24 14759 1 1 31 TYR OH O 4.398 -10.980 -2.728 1.00 . A A . 31 TYR OH 1 1 24 14760 1 1 32 CYS C C -1.446 -4.696 2.276 1.00 . A A . 32 CYS C 1 1 24 14761 1 1 32 CYS CA C -0.413 -3.885 1.504 1.00 . A A . 32 CYS CA 1 1 24 14762 1 1 32 CYS CB C -1.099 -3.087 0.393 1.00 . A A . 32 CYS CB 1 1 24 14763 1 1 32 CYS H H 0.452 -5.181 0.075 1.00 . A A . 32 CYS H 1 1 24 14764 1 1 32 CYS HA H 0.070 -3.198 2.183 1.00 . A A . 32 CYS HA 1 1 24 14765 1 1 32 CYS HB2 H -0.965 -3.603 -0.546 1.00 . A A . 32 CYS HB2 1 1 24 14766 1 1 32 CYS HB3 H -2.155 -3.015 0.610 1.00 . A A . 32 CYS HB3 1 1 24 14767 1 1 32 CYS N N 0.613 -4.753 0.941 1.00 . A A . 32 CYS N 1 1 24 14768 1 1 32 CYS O O -1.902 -5.741 1.813 1.00 . A A . 32 CYS O 1 1 24 14769 1 1 32 CYS SG S -0.457 -1.395 0.189 1.00 . A A . 32 CYS SG 1 1 24 14770 1 1 33 THR C C -4.196 -4.310 4.068 1.00 . A A . 33 THR C 1 1 24 14771 1 1 33 THR CA C -2.798 -4.886 4.289 1.00 . A A . 33 THR CA 1 1 24 14772 1 1 33 THR CB C -2.414 -4.769 5.765 1.00 . A A . 33 THR CB 1 1 24 14773 1 1 33 THR CG2 C -0.940 -4.998 6.019 1.00 . A A . 33 THR CG2 1 1 24 14774 1 1 33 THR H H -1.418 -3.368 3.769 1.00 . A A . 33 THR H 1 1 24 14775 1 1 33 THR HA H -2.804 -5.929 4.010 1.00 . A A . 33 THR HA 1 1 24 14776 1 1 33 THR HB H -2.966 -5.506 6.329 1.00 . A A . 33 THR HB 1 1 24 14777 1 1 33 THR HG1 H -2.618 -3.474 7.220 1.00 . A A . 33 THR HG1 1 1 24 14778 1 1 33 THR HG21 H -0.482 -5.411 5.132 1.00 . A A . 33 THR HG21 1 1 24 14779 1 1 33 THR HG22 H -0.467 -4.059 6.265 1.00 . A A . 33 THR HG22 1 1 24 14780 1 1 33 THR HG23 H -0.820 -5.688 6.841 1.00 . A A . 33 THR HG23 1 1 24 14781 1 1 33 THR N N -1.815 -4.207 3.454 1.00 . A A . 33 THR N 1 1 24 14782 1 1 33 THR O O -5.116 -4.584 4.839 1.00 . A A . 33 THR O 1 1 24 14783 1 1 33 THR OG1 O -2.743 -3.486 6.268 1.00 . A A . 33 THR OG1 1 1 24 14784 1 1 34 GLY C C -6.300 -2.293 3.929 1.00 . A A . 34 GLY C 1 1 24 14785 1 1 34 GLY CA C -5.640 -2.913 2.711 1.00 . A A . 34 GLY CA 1 1 24 14786 1 1 34 GLY H H -3.582 -3.331 2.429 1.00 . A A . 34 GLY H 1 1 24 14787 1 1 34 GLY HA2 H -6.293 -3.675 2.311 1.00 . A A . 34 GLY HA2 1 1 24 14788 1 1 34 GLY HA3 H -5.501 -2.147 1.963 1.00 . A A . 34 GLY HA3 1 1 24 14789 1 1 34 GLY N N -4.350 -3.513 3.011 1.00 . A A . 34 GLY N 1 1 24 14790 1 1 34 GLY O O -7.526 -2.222 4.010 1.00 . A A . 34 GLY O 1 1 24 14791 1 1 35 ARG C C -5.597 0.235 6.192 1.00 . A A . 35 ARG C 1 1 24 14792 1 1 35 ARG CA C -5.999 -1.234 6.101 1.00 . A A . 35 ARG CA 1 1 24 14793 1 1 35 ARG CB C -5.488 -1.990 7.329 1.00 . A A . 35 ARG CB 1 1 24 14794 1 1 35 ARG CD C -7.339 -2.718 8.864 1.00 . A A . 35 ARG CD 1 1 24 14795 1 1 35 ARG CG C -6.389 -3.138 7.755 1.00 . A A . 35 ARG CG 1 1 24 14796 1 1 35 ARG CZ C -9.264 -4.227 8.562 1.00 . A A . 35 ARG CZ 1 1 24 14797 1 1 35 ARG H H -4.516 -1.933 4.760 1.00 . A A . 35 ARG H 1 1 24 14798 1 1 35 ARG HA H -7.076 -1.297 6.074 1.00 . A A . 35 ARG HA 1 1 24 14799 1 1 35 ARG HB2 H -4.510 -2.390 7.110 1.00 . A A . 35 ARG HB2 1 1 24 14800 1 1 35 ARG HB3 H -5.408 -1.298 8.155 1.00 . A A . 35 ARG HB3 1 1 24 14801 1 1 35 ARG HD2 H -6.759 -2.398 9.716 1.00 . A A . 35 ARG HD2 1 1 24 14802 1 1 35 ARG HD3 H -7.943 -1.895 8.511 1.00 . A A . 35 ARG HD3 1 1 24 14803 1 1 35 ARG HE H -8.020 -4.257 10.123 1.00 . A A . 35 ARG HE 1 1 24 14804 1 1 35 ARG HG2 H -6.967 -3.464 6.903 1.00 . A A . 35 ARG HG2 1 1 24 14805 1 1 35 ARG HG3 H -5.774 -3.953 8.108 1.00 . A A . 35 ARG HG3 1 1 24 14806 1 1 35 ARG HH11 H -9.003 -2.892 7.066 1.00 . A A . 35 ARG HH11 1 1 24 14807 1 1 35 ARG HH12 H -10.350 -3.964 6.878 1.00 . A A . 35 ARG HH12 1 1 24 14808 1 1 35 ARG HH21 H -9.791 -5.669 9.877 1.00 . A A . 35 ARG HH21 1 1 24 14809 1 1 35 ARG HH22 H -10.797 -5.540 8.474 1.00 . A A . 35 ARG HH22 1 1 24 14810 1 1 35 ARG N N -5.485 -1.846 4.881 1.00 . A A . 35 ARG N 1 1 24 14811 1 1 35 ARG NE N -8.219 -3.810 9.274 1.00 . A A . 35 ARG NE 1 1 24 14812 1 1 35 ARG NH1 N -9.563 -3.646 7.407 1.00 . A A . 35 ARG NH1 1 1 24 14813 1 1 35 ARG NH2 N -10.012 -5.227 9.008 1.00 . A A . 35 ARG NH2 1 1 24 14814 1 1 35 ARG O O -6.358 1.067 6.685 1.00 . A A . 35 ARG O 1 1 24 14815 1 1 36 SER C C -3.297 2.308 4.398 1.00 . A A . 36 SER C 1 1 24 14816 1 1 36 SER CA C -3.896 1.916 5.745 1.00 . A A . 36 SER CA 1 1 24 14817 1 1 36 SER CB C -2.846 2.071 6.846 1.00 . A A . 36 SER CB 1 1 24 14818 1 1 36 SER H H -3.836 -0.160 5.335 1.00 . A A . 36 SER H 1 1 24 14819 1 1 36 SER HA H -4.728 2.569 5.959 1.00 . A A . 36 SER HA 1 1 24 14820 1 1 36 SER HB2 H -2.360 1.121 7.014 1.00 . A A . 36 SER HB2 1 1 24 14821 1 1 36 SER HB3 H -2.111 2.801 6.541 1.00 . A A . 36 SER HB3 1 1 24 14822 1 1 36 SER HG H -3.686 3.424 7.986 1.00 . A A . 36 SER HG 1 1 24 14823 1 1 36 SER N N -4.397 0.547 5.715 1.00 . A A . 36 SER N 1 1 24 14824 1 1 36 SER O O -2.822 1.456 3.647 1.00 . A A . 36 SER O 1 1 24 14825 1 1 36 SER OG O -3.439 2.500 8.060 1.00 . A A . 36 SER OG 1 1 24 14826 1 1 37 CYS C C -1.253 4.029 2.839 1.00 . A A . 37 CYS C 1 1 24 14827 1 1 37 CYS CA C -2.777 4.108 2.844 1.00 . A A . 37 CYS CA 1 1 24 14828 1 1 37 CYS CB C -3.225 5.552 2.612 1.00 . A A . 37 CYS CB 1 1 24 14829 1 1 37 CYS H H -3.711 4.235 4.739 1.00 . A A . 37 CYS H 1 1 24 14830 1 1 37 CYS HA H -3.160 3.490 2.046 1.00 . A A . 37 CYS HA 1 1 24 14831 1 1 37 CYS HB2 H -4.144 5.727 3.150 1.00 . A A . 37 CYS HB2 1 1 24 14832 1 1 37 CYS HB3 H -2.463 6.221 2.983 1.00 . A A . 37 CYS HB3 1 1 24 14833 1 1 37 CYS N N -3.321 3.604 4.099 1.00 . A A . 37 CYS N 1 1 24 14834 1 1 37 CYS O O -0.628 3.973 1.780 1.00 . A A . 37 CYS O 1 1 24 14835 1 1 37 CYS SG S -3.522 5.967 0.862 1.00 . A A . 37 CYS SG 1 1 24 14836 1 1 38 GLU C C 1.242 2.504 4.356 1.00 . A A . 38 GLU C 1 1 24 14837 1 1 38 GLU CA C 0.790 3.947 4.160 1.00 . A A . 38 GLU CA 1 1 24 14838 1 1 38 GLU CB C 1.263 4.806 5.335 1.00 . A A . 38 GLU CB 1 1 24 14839 1 1 38 GLU CD C 0.326 6.728 6.679 1.00 . A A . 38 GLU CD 1 1 24 14840 1 1 38 GLU CG C 0.725 6.227 5.305 1.00 . A A . 38 GLU CG 1 1 24 14841 1 1 38 GLU H H -1.211 4.068 4.839 1.00 . A A . 38 GLU H 1 1 24 14842 1 1 38 GLU HA H 1.225 4.328 3.249 1.00 . A A . 38 GLU HA 1 1 24 14843 1 1 38 GLU HB2 H 0.944 4.342 6.256 1.00 . A A . 38 GLU HB2 1 1 24 14844 1 1 38 GLU HB3 H 2.342 4.852 5.321 1.00 . A A . 38 GLU HB3 1 1 24 14845 1 1 38 GLU HG2 H 1.489 6.879 4.909 1.00 . A A . 38 GLU HG2 1 1 24 14846 1 1 38 GLU HG3 H -0.142 6.257 4.661 1.00 . A A . 38 GLU HG3 1 1 24 14847 1 1 38 GLU N N -0.660 4.022 4.030 1.00 . A A . 38 GLU N 1 1 24 14848 1 1 38 GLU O O 0.773 1.813 5.260 1.00 . A A . 38 GLU O 1 1 24 14849 1 1 38 GLU OE1 O -0.853 7.098 6.857 1.00 . A A . 38 GLU OE1 1 1 24 14850 1 1 38 GLU OE2 O 1.194 6.750 7.578 1.00 . A A . 38 GLU OE2 1 1 24 14851 1 1 39 CYS C C 3.313 0.427 4.940 1.00 . A A . 39 CYS C 1 1 24 14852 1 1 39 CYS CA C 2.670 0.691 3.580 1.00 . A A . 39 CYS CA 1 1 24 14853 1 1 39 CYS CB C 3.685 0.443 2.461 1.00 . A A . 39 CYS CB 1 1 24 14854 1 1 39 CYS H H 2.491 2.651 2.801 1.00 . A A . 39 CYS H 1 1 24 14855 1 1 39 CYS HA H 1.837 0.016 3.452 1.00 . A A . 39 CYS HA 1 1 24 14856 1 1 39 CYS HB2 H 3.744 1.322 1.837 1.00 . A A . 39 CYS HB2 1 1 24 14857 1 1 39 CYS HB3 H 4.655 0.253 2.898 1.00 . A A . 39 CYS HB3 1 1 24 14858 1 1 39 CYS N N 2.156 2.054 3.501 1.00 . A A . 39 CYS N 1 1 24 14859 1 1 39 CYS O O 3.902 1.325 5.542 1.00 . A A . 39 CYS O 1 1 24 14860 1 1 39 CYS SG S 3.276 -0.971 1.387 1.00 . A A . 39 CYS SG 1 1 24 14861 1 1 40 PRO C C 5.304 -1.296 6.690 1.00 . A A . 40 PRO C 1 1 24 14862 1 1 40 PRO CA C 3.784 -1.192 6.739 1.00 . A A . 40 PRO CA 1 1 24 14863 1 1 40 PRO CB C 3.163 -2.562 7.014 1.00 . A A . 40 PRO CB 1 1 24 14864 1 1 40 PRO CD C 2.523 -1.948 4.793 1.00 . A A . 40 PRO CD 1 1 24 14865 1 1 40 PRO CG C 2.877 -3.123 5.665 1.00 . A A . 40 PRO CG 1 1 24 14866 1 1 40 PRO HA H 3.496 -0.500 7.517 1.00 . A A . 40 PRO HA 1 1 24 14867 1 1 40 PRO HB2 H 3.866 -3.176 7.558 1.00 . A A . 40 PRO HB2 1 1 24 14868 1 1 40 PRO HB3 H 2.259 -2.442 7.592 1.00 . A A . 40 PRO HB3 1 1 24 14869 1 1 40 PRO HD2 H 2.896 -2.098 3.790 1.00 . A A . 40 PRO HD2 1 1 24 14870 1 1 40 PRO HD3 H 1.454 -1.796 4.781 1.00 . A A . 40 PRO HD3 1 1 24 14871 1 1 40 PRO HG2 H 3.754 -3.624 5.282 1.00 . A A . 40 PRO HG2 1 1 24 14872 1 1 40 PRO HG3 H 2.046 -3.810 5.722 1.00 . A A . 40 PRO HG3 1 1 24 14873 1 1 40 PRO N N 3.209 -0.815 5.444 1.00 . A A . 40 PRO N 1 1 24 14874 1 1 40 PRO O O 5.915 -1.116 5.637 1.00 . A A . 40 PRO O 1 1 24 14875 1 1 41 SER C C 7.773 -3.184 7.950 1.00 . A A . 41 SER C 1 1 24 14876 1 1 41 SER CA C 7.359 -1.717 7.925 1.00 . A A . 41 SER CA 1 1 24 14877 1 1 41 SER CB C 7.879 -1.007 9.176 1.00 . A A . 41 SER CB 1 1 24 14878 1 1 41 SER H H 5.367 -1.720 8.643 1.00 . A A . 41 SER H 1 1 24 14879 1 1 41 SER HA H 7.787 -1.248 7.052 1.00 . A A . 41 SER HA 1 1 24 14880 1 1 41 SER HB2 H 7.213 -1.203 10.003 1.00 . A A . 41 SER HB2 1 1 24 14881 1 1 41 SER HB3 H 8.866 -1.377 9.413 1.00 . A A . 41 SER HB3 1 1 24 14882 1 1 41 SER HG H 8.576 0.584 8.269 1.00 . A A . 41 SER HG 1 1 24 14883 1 1 41 SER N N 5.909 -1.588 7.837 1.00 . A A . 41 SER N 1 1 24 14884 1 1 41 SER O O 8.753 -3.552 8.598 1.00 . A A . 41 SER O 1 1 24 14885 1 1 41 SER OG O 7.953 0.394 8.975 1.00 . A A . 41 SER OG 1 1 24 14886 1 1 42 TYR C C 7.921 -5.823 5.833 1.00 . A A . 42 TYR C 1 1 24 14887 1 1 42 TYR CA C 7.309 -5.446 7.181 1.00 . A A . 42 TYR CA 1 1 24 14888 1 1 42 TYR CB C 6.033 -6.256 7.418 1.00 . A A . 42 TYR CB 1 1 24 14889 1 1 42 TYR CD1 C 5.150 -5.649 9.704 1.00 . A A . 42 TYR CD1 1 1 24 14890 1 1 42 TYR CD2 C 6.163 -7.789 9.420 1.00 . A A . 42 TYR CD2 1 1 24 14891 1 1 42 TYR CE1 C 4.915 -5.933 11.036 1.00 . A A . 42 TYR CE1 1 1 24 14892 1 1 42 TYR CE2 C 5.930 -8.080 10.751 1.00 . A A . 42 TYR CE2 1 1 24 14893 1 1 42 TYR CG C 5.777 -6.571 8.875 1.00 . A A . 42 TYR CG 1 1 24 14894 1 1 42 TYR CZ C 5.306 -7.149 11.555 1.00 . A A . 42 TYR CZ 1 1 24 14895 1 1 42 TYR H H 6.252 -3.665 6.745 1.00 . A A . 42 TYR H 1 1 24 14896 1 1 42 TYR HA H 8.019 -5.674 7.961 1.00 . A A . 42 TYR HA 1 1 24 14897 1 1 42 TYR HB2 H 5.187 -5.698 7.046 1.00 . A A . 42 TYR HB2 1 1 24 14898 1 1 42 TYR HB3 H 6.104 -7.192 6.883 1.00 . A A . 42 TYR HB3 1 1 24 14899 1 1 42 TYR HD1 H 4.844 -4.698 9.296 1.00 . A A . 42 TYR HD1 1 1 24 14900 1 1 42 TYR HD2 H 6.652 -8.515 8.789 1.00 . A A . 42 TYR HD2 1 1 24 14901 1 1 42 TYR HE1 H 4.426 -5.204 11.665 1.00 . A A . 42 TYR HE1 1 1 24 14902 1 1 42 TYR HE2 H 6.237 -9.033 11.157 1.00 . A A . 42 TYR HE2 1 1 24 14903 1 1 42 TYR HH H 5.825 -7.911 13.242 1.00 . A A . 42 TYR HH 1 1 24 14904 1 1 42 TYR N N 7.020 -4.018 7.240 1.00 . A A . 42 TYR N 1 1 24 14905 1 1 42 TYR O O 7.207 -6.190 4.899 1.00 . A A . 42 TYR O 1 1 24 14906 1 1 42 TYR OH O 5.073 -7.435 12.880 1.00 . A A . 42 TYR OH 1 1 24 14907 1 1 43 PRO C C 9.924 -7.566 4.170 1.00 . A A . 43 PRO C 1 1 24 14908 1 1 43 PRO CA C 9.962 -6.072 4.473 1.00 . A A . 43 PRO CA 1 1 24 14909 1 1 43 PRO CB C 11.399 -5.618 4.745 1.00 . A A . 43 PRO CB 1 1 24 14910 1 1 43 PRO CD C 10.184 -5.309 6.779 1.00 . A A . 43 PRO CD 1 1 24 14911 1 1 43 PRO CG C 11.537 -5.664 6.227 1.00 . A A . 43 PRO CG 1 1 24 14912 1 1 43 PRO HA H 9.562 -5.525 3.632 1.00 . A A . 43 PRO HA 1 1 24 14913 1 1 43 PRO HB2 H 12.090 -6.294 4.261 1.00 . A A . 43 PRO HB2 1 1 24 14914 1 1 43 PRO HB3 H 11.541 -4.617 4.366 1.00 . A A . 43 PRO HB3 1 1 24 14915 1 1 43 PRO HD2 H 9.996 -5.851 7.695 1.00 . A A . 43 PRO HD2 1 1 24 14916 1 1 43 PRO HD3 H 10.112 -4.245 6.948 1.00 . A A . 43 PRO HD3 1 1 24 14917 1 1 43 PRO HG2 H 11.820 -6.658 6.539 1.00 . A A . 43 PRO HG2 1 1 24 14918 1 1 43 PRO HG3 H 12.274 -4.944 6.550 1.00 . A A . 43 PRO HG3 1 1 24 14919 1 1 43 PRO N N 9.257 -5.738 5.715 1.00 . A A . 43 PRO N 1 1 24 14920 1 1 43 PRO O O 10.730 -8.336 4.692 1.00 . A A . 43 PRO O 1 1 24 14921 1 1 44 GLY C C 7.688 -10.042 3.657 1.00 . A A . 44 GLY C 1 1 24 14922 1 1 44 GLY CA C 8.857 -9.369 2.965 1.00 . A A . 44 GLY CA 1 1 24 14923 1 1 44 GLY H H 8.368 -7.309 2.938 1.00 . A A . 44 GLY H 1 1 24 14924 1 1 44 GLY HA2 H 9.767 -9.882 3.238 1.00 . A A . 44 GLY HA2 1 1 24 14925 1 1 44 GLY HA3 H 8.720 -9.445 1.896 1.00 . A A . 44 GLY HA3 1 1 24 14926 1 1 44 GLY N N 8.983 -7.968 3.323 1.00 . A A . 44 GLY N 1 1 24 14927 1 1 44 GLY O O 6.997 -9.366 4.448 1.00 . A A . 44 GLY O 1 1 24 14928 1 1 44 GLY OXT O 7.464 -11.245 3.408 1.00 . A A . 44 GLY OXT 1 1 25 14929 1 1 1 ALA C C -11.610 14.336 4.134 1.00 . A A . 1 ALA C 1 1 25 14930 1 1 1 ALA CA C -12.628 15.260 3.474 1.00 . A A . 1 ALA CA 1 1 25 14931 1 1 1 ALA CB C -13.552 14.463 2.565 1.00 . A A . 1 ALA CB 1 1 25 14932 1 1 1 ALA H1 H -11.212 16.744 3.312 1.00 . A A . 1 ALA H1 1 1 25 14933 1 1 1 ALA H2 H -11.541 15.904 1.851 1.00 . A A . 1 ALA H2 1 1 25 14934 1 1 1 ALA H3 H -12.667 17.048 2.459 1.00 . A A . 1 ALA H3 1 1 25 14935 1 1 1 ALA HA H -13.230 15.720 4.244 1.00 . A A . 1 ALA HA 1 1 25 14936 1 1 1 ALA HB1 H -13.830 15.068 1.715 1.00 . A A . 1 ALA HB1 1 1 25 14937 1 1 1 ALA HB2 H -14.439 14.181 3.112 1.00 . A A . 1 ALA HB2 1 1 25 14938 1 1 1 ALA HB3 H -13.042 13.575 2.223 1.00 . A A . 1 ALA HB3 1 1 25 14939 1 1 1 ALA N N -11.951 16.336 2.705 1.00 . A A . 1 ALA N 1 1 25 14940 1 1 1 ALA O O -10.407 14.450 3.896 1.00 . A A . 1 ALA O 1 1 25 14941 1 1 2 MET C C -11.272 11.106 4.987 1.00 . A A . 2 MET C 1 1 25 14942 1 1 2 MET CA C -11.232 12.475 5.657 1.00 . A A . 2 MET CA 1 1 25 14943 1 1 2 MET CB C -11.649 12.351 7.124 1.00 . A A . 2 MET CB 1 1 25 14944 1 1 2 MET CE C -9.414 11.988 10.628 1.00 . A A . 2 MET CE 1 1 25 14945 1 1 2 MET CG C -10.479 12.163 8.075 1.00 . A A . 2 MET CG 1 1 25 14946 1 1 2 MET H H -13.067 13.378 5.112 1.00 . A A . 2 MET H 1 1 25 14947 1 1 2 MET HA H -10.223 12.856 5.610 1.00 . A A . 2 MET HA 1 1 25 14948 1 1 2 MET HB2 H -12.179 13.246 7.413 1.00 . A A . 2 MET HB2 1 1 25 14949 1 1 2 MET HB3 H -12.309 11.503 7.228 1.00 . A A . 2 MET HB3 1 1 25 14950 1 1 2 MET HE1 H -8.629 12.183 9.912 1.00 . A A . 2 MET HE1 1 1 25 14951 1 1 2 MET HE2 H -9.402 12.750 11.393 1.00 . A A . 2 MET HE2 1 1 25 14952 1 1 2 MET HE3 H -9.256 11.020 11.081 1.00 . A A . 2 MET HE3 1 1 25 14953 1 1 2 MET HG2 H -9.943 11.269 7.793 1.00 . A A . 2 MET HG2 1 1 25 14954 1 1 2 MET HG3 H -9.822 13.016 7.990 1.00 . A A . 2 MET HG3 1 1 25 14955 1 1 2 MET N N -12.100 13.420 4.963 1.00 . A A . 2 MET N 1 1 25 14956 1 1 2 MET O O -11.216 10.074 5.656 1.00 . A A . 2 MET O 1 1 25 14957 1 1 2 MET SD S -10.999 12.004 9.794 1.00 . A A . 2 MET SD 1 1 25 14958 1 1 3 ASP C C -10.397 9.878 1.767 1.00 . A A . 3 ASP C 1 1 25 14959 1 1 3 ASP CA C -11.418 9.861 2.900 1.00 . A A . 3 ASP CA 1 1 25 14960 1 1 3 ASP CB C -12.822 9.639 2.335 1.00 . A A . 3 ASP CB 1 1 25 14961 1 1 3 ASP CG C -13.884 9.620 3.416 1.00 . A A . 3 ASP CG 1 1 25 14962 1 1 3 ASP H H -11.411 11.959 3.184 1.00 . A A . 3 ASP H 1 1 25 14963 1 1 3 ASP HA H -11.177 9.051 3.572 1.00 . A A . 3 ASP HA 1 1 25 14964 1 1 3 ASP HB2 H -13.054 10.433 1.642 1.00 . A A . 3 ASP HB2 1 1 25 14965 1 1 3 ASP HB3 H -12.847 8.693 1.813 1.00 . A A . 3 ASP HB3 1 1 25 14966 1 1 3 ASP N N -11.370 11.104 3.661 1.00 . A A . 3 ASP N 1 1 25 14967 1 1 3 ASP O O -9.985 10.942 1.305 1.00 . A A . 3 ASP O 1 1 25 14968 1 1 3 ASP OD1 O -14.720 8.692 3.411 1.00 . A A . 3 ASP OD1 1 1 25 14969 1 1 3 ASP OD2 O -13.880 10.533 4.268 1.00 . A A . 3 ASP OD2 1 1 25 14970 1 1 4 CYS C C -7.701 9.232 0.621 1.00 . A A . 4 CYS C 1 1 25 14971 1 1 4 CYS CA C -9.021 8.570 0.243 1.00 . A A . 4 CYS CA 1 1 25 14972 1 1 4 CYS CB C -9.568 9.200 -1.038 1.00 . A A . 4 CYS CB 1 1 25 14973 1 1 4 CYS H H -10.359 7.879 1.731 1.00 . A A . 4 CYS H 1 1 25 14974 1 1 4 CYS HA H -8.847 7.519 0.070 1.00 . A A . 4 CYS HA 1 1 25 14975 1 1 4 CYS HB2 H -9.814 10.234 -0.846 1.00 . A A . 4 CYS HB2 1 1 25 14976 1 1 4 CYS HB3 H -8.808 9.153 -1.805 1.00 . A A . 4 CYS HB3 1 1 25 14977 1 1 4 CYS N N -9.994 8.692 1.323 1.00 . A A . 4 CYS N 1 1 25 14978 1 1 4 CYS O O -7.606 10.457 0.691 1.00 . A A . 4 CYS O 1 1 25 14979 1 1 4 CYS SG S -11.063 8.388 -1.689 1.00 . A A . 4 CYS SG 1 1 25 14980 1 1 5 THR C C -4.405 8.821 0.045 1.00 . A A . 5 THR C 1 1 25 14981 1 1 5 THR CA C -5.365 8.917 1.227 1.00 . A A . 5 THR CA 1 1 25 14982 1 1 5 THR CB C -4.809 8.141 2.424 1.00 . A A . 5 THR CB 1 1 25 14983 1 1 5 THR CG2 C -4.335 9.038 3.548 1.00 . A A . 5 THR CG2 1 1 25 14984 1 1 5 THR H H -6.821 7.446 0.785 1.00 . A A . 5 THR H 1 1 25 14985 1 1 5 THR HA H -5.474 9.954 1.502 1.00 . A A . 5 THR HA 1 1 25 14986 1 1 5 THR HB H -3.967 7.549 2.098 1.00 . A A . 5 THR HB 1 1 25 14987 1 1 5 THR HG1 H -5.361 6.473 3.290 1.00 . A A . 5 THR HG1 1 1 25 14988 1 1 5 THR HG21 H -4.945 9.929 3.579 1.00 . A A . 5 THR HG21 1 1 25 14989 1 1 5 THR HG22 H -4.418 8.512 4.488 1.00 . A A . 5 THR HG22 1 1 25 14990 1 1 5 THR HG23 H -3.305 9.313 3.379 1.00 . A A . 5 THR HG23 1 1 25 14991 1 1 5 THR N N -6.683 8.413 0.860 1.00 . A A . 5 THR N 1 1 25 14992 1 1 5 THR O O -3.735 7.806 -0.143 1.00 . A A . 5 THR O 1 1 25 14993 1 1 5 THR OG1 O -5.787 7.267 2.958 1.00 . A A . 5 THR OG1 1 1 25 14994 1 1 6 THR C C -2.081 9.388 -1.602 1.00 . A A . 6 THR C 1 1 25 14995 1 1 6 THR CA C -3.474 9.923 -1.926 1.00 . A A . 6 THR CA 1 1 25 14996 1 1 6 THR CB C -3.372 11.352 -2.462 1.00 . A A . 6 THR CB 1 1 25 14997 1 1 6 THR CG2 C -4.402 11.667 -3.525 1.00 . A A . 6 THR CG2 1 1 25 14998 1 1 6 THR H H -4.909 10.662 -0.554 1.00 . A A . 6 THR H 1 1 25 14999 1 1 6 THR HA H -3.916 9.297 -2.687 1.00 . A A . 6 THR HA 1 1 25 15000 1 1 6 THR HB H -2.393 11.493 -2.898 1.00 . A A . 6 THR HB 1 1 25 15001 1 1 6 THR HG1 H -2.962 13.049 -1.574 1.00 . A A . 6 THR HG1 1 1 25 15002 1 1 6 THR HG21 H -4.951 10.769 -3.772 1.00 . A A . 6 THR HG21 1 1 25 15003 1 1 6 THR HG22 H -5.085 12.416 -3.154 1.00 . A A . 6 THR HG22 1 1 25 15004 1 1 6 THR HG23 H -3.905 12.039 -4.409 1.00 . A A . 6 THR HG23 1 1 25 15005 1 1 6 THR N N -4.347 9.884 -0.754 1.00 . A A . 6 THR N 1 1 25 15006 1 1 6 THR O O -1.226 10.115 -1.096 1.00 . A A . 6 THR O 1 1 25 15007 1 1 6 THR OG1 O -3.532 12.293 -1.416 1.00 . A A . 6 THR OG1 1 1 25 15008 1 1 7 GLY C C -0.267 6.363 -2.599 1.00 . A A . 7 GLY C 1 1 25 15009 1 1 7 GLY CA C -0.577 7.494 -1.634 1.00 . A A . 7 GLY CA 1 1 25 15010 1 1 7 GLY H H -2.584 7.581 -2.301 1.00 . A A . 7 GLY H 1 1 25 15011 1 1 7 GLY HA2 H -0.577 7.103 -0.627 1.00 . A A . 7 GLY HA2 1 1 25 15012 1 1 7 GLY HA3 H 0.194 8.245 -1.718 1.00 . A A . 7 GLY HA3 1 1 25 15013 1 1 7 GLY N N -1.864 8.110 -1.899 1.00 . A A . 7 GLY N 1 1 25 15014 1 1 7 GLY O O -0.935 6.218 -3.622 1.00 . A A . 7 GLY O 1 1 25 15015 1 1 8 PRO C C 0.176 3.242 -3.061 1.00 . A A . 8 PRO C 1 1 25 15016 1 1 8 PRO CA C 1.143 4.419 -3.157 1.00 . A A . 8 PRO CA 1 1 25 15017 1 1 8 PRO CB C 2.516 4.026 -2.614 1.00 . A A . 8 PRO CB 1 1 25 15018 1 1 8 PRO CD C 1.607 5.643 -1.099 1.00 . A A . 8 PRO CD 1 1 25 15019 1 1 8 PRO CG C 2.474 4.414 -1.176 1.00 . A A . 8 PRO CG 1 1 25 15020 1 1 8 PRO HA H 1.235 4.724 -4.189 1.00 . A A . 8 PRO HA 1 1 25 15021 1 1 8 PRO HB2 H 2.663 2.963 -2.734 1.00 . A A . 8 PRO HB2 1 1 25 15022 1 1 8 PRO HB3 H 3.285 4.566 -3.145 1.00 . A A . 8 PRO HB3 1 1 25 15023 1 1 8 PRO HD2 H 1.011 5.627 -0.199 1.00 . A A . 8 PRO HD2 1 1 25 15024 1 1 8 PRO HD3 H 2.214 6.535 -1.134 1.00 . A A . 8 PRO HD3 1 1 25 15025 1 1 8 PRO HG2 H 2.043 3.614 -0.593 1.00 . A A . 8 PRO HG2 1 1 25 15026 1 1 8 PRO HG3 H 3.472 4.638 -0.828 1.00 . A A . 8 PRO HG3 1 1 25 15027 1 1 8 PRO N N 0.752 5.541 -2.298 1.00 . A A . 8 PRO N 1 1 25 15028 1 1 8 PRO O O 0.045 2.457 -3.999 1.00 . A A . 8 PRO O 1 1 25 15029 1 1 9 CYS C C -2.880 2.502 -1.965 1.00 . A A . 9 CYS C 1 1 25 15030 1 1 9 CYS CA C -1.449 2.038 -1.705 1.00 . A A . 9 CYS CA 1 1 25 15031 1 1 9 CYS CB C -1.320 1.497 -0.279 1.00 . A A . 9 CYS CB 1 1 25 15032 1 1 9 CYS H H -0.350 3.779 -1.207 1.00 . A A . 9 CYS H 1 1 25 15033 1 1 9 CYS HA H -1.209 1.248 -2.401 1.00 . A A . 9 CYS HA 1 1 25 15034 1 1 9 CYS HB2 H -0.764 2.204 0.317 1.00 . A A . 9 CYS HB2 1 1 25 15035 1 1 9 CYS HB3 H -2.306 1.375 0.145 1.00 . A A . 9 CYS HB3 1 1 25 15036 1 1 9 CYS N N -0.498 3.123 -1.920 1.00 . A A . 9 CYS N 1 1 25 15037 1 1 9 CYS O O -3.823 2.019 -1.338 1.00 . A A . 9 CYS O 1 1 25 15038 1 1 9 CYS SG S -0.468 -0.109 -0.167 1.00 . A A . 9 CYS SG 1 1 25 15039 1 1 10 CYS C C -4.320 4.608 -4.626 1.00 . A A . 10 CYS C 1 1 25 15040 1 1 10 CYS CA C -4.348 3.964 -3.244 1.00 . A A . 10 CYS CA 1 1 25 15041 1 1 10 CYS CB C -4.807 4.983 -2.200 1.00 . A A . 10 CYS CB 1 1 25 15042 1 1 10 CYS H H -2.243 3.779 -3.363 1.00 . A A . 10 CYS H 1 1 25 15043 1 1 10 CYS HA H -5.045 3.138 -3.258 1.00 . A A . 10 CYS HA 1 1 25 15044 1 1 10 CYS HB2 H -3.950 5.534 -1.843 1.00 . A A . 10 CYS HB2 1 1 25 15045 1 1 10 CYS HB3 H -5.503 5.669 -2.659 1.00 . A A . 10 CYS HB3 1 1 25 15046 1 1 10 CYS N N -3.033 3.437 -2.896 1.00 . A A . 10 CYS N 1 1 25 15047 1 1 10 CYS O O -3.703 5.656 -4.820 1.00 . A A . 10 CYS O 1 1 25 15048 1 1 10 CYS SG S -5.631 4.241 -0.754 1.00 . A A . 10 CYS SG 1 1 25 15049 1 1 11 ARG C C -5.510 5.936 -6.984 1.00 . A A . 11 ARG C 1 1 25 15050 1 1 11 ARG CA C -5.030 4.484 -6.953 1.00 . A A . 11 ARG CA 1 1 25 15051 1 1 11 ARG CB C -5.924 3.604 -7.840 1.00 . A A . 11 ARG CB 1 1 25 15052 1 1 11 ARG CD C -8.330 2.884 -7.988 1.00 . A A . 11 ARG CD 1 1 25 15053 1 1 11 ARG CG C -7.094 2.964 -7.106 1.00 . A A . 11 ARG CG 1 1 25 15054 1 1 11 ARG CZ C -9.584 1.134 -9.186 1.00 . A A . 11 ARG CZ 1 1 25 15055 1 1 11 ARG H H -5.454 3.140 -5.368 1.00 . A A . 11 ARG H 1 1 25 15056 1 1 11 ARG HA H -4.023 4.452 -7.341 1.00 . A A . 11 ARG HA 1 1 25 15057 1 1 11 ARG HB2 H -6.321 4.209 -8.641 1.00 . A A . 11 ARG HB2 1 1 25 15058 1 1 11 ARG HB3 H -5.321 2.815 -8.264 1.00 . A A . 11 ARG HB3 1 1 25 15059 1 1 11 ARG HD2 H -9.204 3.062 -7.379 1.00 . A A . 11 ARG HD2 1 1 25 15060 1 1 11 ARG HD3 H -8.262 3.647 -8.750 1.00 . A A . 11 ARG HD3 1 1 25 15061 1 1 11 ARG HE H -7.665 1.005 -8.656 1.00 . A A . 11 ARG HE 1 1 25 15062 1 1 11 ARG HG2 H -6.815 1.966 -6.804 1.00 . A A . 11 ARG HG2 1 1 25 15063 1 1 11 ARG HG3 H -7.325 3.556 -6.231 1.00 . A A . 11 ARG HG3 1 1 25 15064 1 1 11 ARG HH11 H -10.663 2.788 -8.749 1.00 . A A . 11 ARG HH11 1 1 25 15065 1 1 11 ARG HH12 H -11.522 1.543 -9.591 1.00 . A A . 11 ARG HH12 1 1 25 15066 1 1 11 ARG HH21 H -8.793 -0.634 -9.763 1.00 . A A . 11 ARG HH21 1 1 25 15067 1 1 11 ARG HH22 H -10.461 -0.400 -10.166 1.00 . A A . 11 ARG HH22 1 1 25 15068 1 1 11 ARG N N -4.986 3.973 -5.585 1.00 . A A . 11 ARG N 1 1 25 15069 1 1 11 ARG NE N -8.458 1.580 -8.633 1.00 . A A . 11 ARG NE 1 1 25 15070 1 1 11 ARG NH1 N -10.680 1.883 -9.174 1.00 . A A . 11 ARG NH1 1 1 25 15071 1 1 11 ARG NH2 N -9.615 -0.065 -9.751 1.00 . A A . 11 ARG NH2 1 1 25 15072 1 1 11 ARG O O -4.700 6.863 -6.945 1.00 . A A . 11 ARG O 1 1 25 15073 1 1 12 GLN C C -8.358 7.699 -5.928 1.00 . A A . 12 GLN C 1 1 25 15074 1 1 12 GLN CA C -7.393 7.474 -7.091 1.00 . A A . 12 GLN CA 1 1 25 15075 1 1 12 GLN CB C -8.116 7.707 -8.418 1.00 . A A . 12 GLN CB 1 1 25 15076 1 1 12 GLN CD C -9.148 10.011 -8.476 1.00 . A A . 12 GLN CD 1 1 25 15077 1 1 12 GLN CG C -8.001 9.132 -8.933 1.00 . A A . 12 GLN CG 1 1 25 15078 1 1 12 GLN H H -7.422 5.360 -7.085 1.00 . A A . 12 GLN H 1 1 25 15079 1 1 12 GLN HA H -6.580 8.181 -7.008 1.00 . A A . 12 GLN HA 1 1 25 15080 1 1 12 GLN HB2 H -7.701 7.043 -9.163 1.00 . A A . 12 GLN HB2 1 1 25 15081 1 1 12 GLN HB3 H -9.164 7.477 -8.289 1.00 . A A . 12 GLN HB3 1 1 25 15082 1 1 12 GLN HE21 H -8.519 11.487 -9.651 1.00 . A A . 12 GLN HE21 1 1 25 15083 1 1 12 GLN HE22 H -9.940 11.818 -8.726 1.00 . A A . 12 GLN HE22 1 1 25 15084 1 1 12 GLN HG2 H -7.076 9.558 -8.573 1.00 . A A . 12 GLN HG2 1 1 25 15085 1 1 12 GLN HG3 H -7.990 9.112 -10.013 1.00 . A A . 12 GLN HG3 1 1 25 15086 1 1 12 GLN N N -6.823 6.132 -7.055 1.00 . A A . 12 GLN N 1 1 25 15087 1 1 12 GLN NE2 N -9.209 11.228 -9.004 1.00 . A A . 12 GLN NE2 1 1 25 15088 1 1 12 GLN O O -8.659 8.839 -5.575 1.00 . A A . 12 GLN O 1 1 25 15089 1 1 12 GLN OE1 O -9.972 9.602 -7.657 1.00 . A A . 12 GLN OE1 1 1 25 15090 1 1 13 CYS C C -10.244 5.309 -3.783 1.00 . A A . 13 CYS C 1 1 25 15091 1 1 13 CYS CA C -9.777 6.697 -4.219 1.00 . A A . 13 CYS CA 1 1 25 15092 1 1 13 CYS CB C -10.986 7.557 -4.606 1.00 . A A . 13 CYS CB 1 1 25 15093 1 1 13 CYS H H -8.572 5.727 -5.661 1.00 . A A . 13 CYS H 1 1 25 15094 1 1 13 CYS HA H -9.262 7.166 -3.394 1.00 . A A . 13 CYS HA 1 1 25 15095 1 1 13 CYS HB2 H -10.883 7.865 -5.635 1.00 . A A . 13 CYS HB2 1 1 25 15096 1 1 13 CYS HB3 H -11.887 6.972 -4.500 1.00 . A A . 13 CYS HB3 1 1 25 15097 1 1 13 CYS N N -8.844 6.608 -5.338 1.00 . A A . 13 CYS N 1 1 25 15098 1 1 13 CYS O O -11.402 5.125 -3.409 1.00 . A A . 13 CYS O 1 1 25 15099 1 1 13 CYS SG S -11.182 9.063 -3.599 1.00 . A A . 13 CYS SG 1 1 25 15100 1 1 14 LYS C C -8.467 2.256 -2.855 1.00 . A A . 14 LYS C 1 1 25 15101 1 1 14 LYS CA C -9.679 2.970 -3.440 1.00 . A A . 14 LYS CA 1 1 25 15102 1 1 14 LYS CB C -10.215 2.189 -4.641 1.00 . A A . 14 LYS CB 1 1 25 15103 1 1 14 LYS CD C -12.383 1.568 -3.533 1.00 . A A . 14 LYS CD 1 1 25 15104 1 1 14 LYS CE C -13.469 0.507 -3.458 1.00 . A A . 14 LYS CE 1 1 25 15105 1 1 14 LYS CG C -11.151 1.054 -4.260 1.00 . A A . 14 LYS CG 1 1 25 15106 1 1 14 LYS H H -8.430 4.529 -4.137 1.00 . A A . 14 LYS H 1 1 25 15107 1 1 14 LYS HA H -10.448 3.024 -2.685 1.00 . A A . 14 LYS HA 1 1 25 15108 1 1 14 LYS HB2 H -10.752 2.869 -5.286 1.00 . A A . 14 LYS HB2 1 1 25 15109 1 1 14 LYS HB3 H -9.381 1.772 -5.186 1.00 . A A . 14 LYS HB3 1 1 25 15110 1 1 14 LYS HD2 H -12.104 1.854 -2.530 1.00 . A A . 14 LYS HD2 1 1 25 15111 1 1 14 LYS HD3 H -12.768 2.428 -4.061 1.00 . A A . 14 LYS HD3 1 1 25 15112 1 1 14 LYS HE2 H -13.173 -0.243 -2.741 1.00 . A A . 14 LYS HE2 1 1 25 15113 1 1 14 LYS HE3 H -14.388 0.973 -3.133 1.00 . A A . 14 LYS HE3 1 1 25 15114 1 1 14 LYS HG2 H -11.463 0.541 -5.157 1.00 . A A . 14 LYS HG2 1 1 25 15115 1 1 14 LYS HG3 H -10.623 0.367 -3.614 1.00 . A A . 14 LYS HG3 1 1 25 15116 1 1 14 LYS HZ1 H -13.591 0.547 -5.543 1.00 . A A . 14 LYS HZ1 1 1 25 15117 1 1 14 LYS HZ2 H -13.010 -0.914 -4.919 1.00 . A A . 14 LYS HZ2 1 1 25 15118 1 1 14 LYS HZ3 H -14.657 -0.546 -4.816 1.00 . A A . 14 LYS HZ3 1 1 25 15119 1 1 14 LYS N N -9.341 4.332 -3.832 1.00 . A A . 14 LYS N 1 1 25 15120 1 1 14 LYS NZ N -13.698 -0.147 -4.776 1.00 . A A . 14 LYS NZ 1 1 25 15121 1 1 14 LYS O O -7.443 2.101 -3.521 1.00 . A A . 14 LYS O 1 1 25 15122 1 1 15 LEU C C -6.936 0.015 -1.818 1.00 . A A . 15 LEU C 1 1 25 15123 1 1 15 LEU CA C -7.508 1.113 -0.928 1.00 . A A . 15 LEU CA 1 1 25 15124 1 1 15 LEU CB C -8.007 0.510 0.386 1.00 . A A . 15 LEU CB 1 1 25 15125 1 1 15 LEU CD1 C -8.954 0.874 2.678 1.00 . A A . 15 LEU CD1 1 1 25 15126 1 1 15 LEU CD2 C -6.831 2.014 2.008 1.00 . A A . 15 LEU CD2 1 1 25 15127 1 1 15 LEU CG C -8.184 1.509 1.530 1.00 . A A . 15 LEU CG 1 1 25 15128 1 1 15 LEU H H -9.433 1.969 -1.129 1.00 . A A . 15 LEU H 1 1 25 15129 1 1 15 LEU HA H -6.729 1.828 -0.714 1.00 . A A . 15 LEU HA 1 1 25 15130 1 1 15 LEU HB2 H -8.959 0.034 0.201 1.00 . A A . 15 LEU HB2 1 1 25 15131 1 1 15 LEU HB3 H -7.302 -0.244 0.703 1.00 . A A . 15 LEU HB3 1 1 25 15132 1 1 15 LEU HD11 H -8.818 -0.197 2.653 1.00 . A A . 15 LEU HD11 1 1 25 15133 1 1 15 LEU HD12 H -8.587 1.262 3.616 1.00 . A A . 15 LEU HD12 1 1 25 15134 1 1 15 LEU HD13 H -10.004 1.106 2.578 1.00 . A A . 15 LEU HD13 1 1 25 15135 1 1 15 LEU HD21 H -6.075 1.273 1.796 1.00 . A A . 15 LEU HD21 1 1 25 15136 1 1 15 LEU HD22 H -6.588 2.933 1.495 1.00 . A A . 15 LEU HD22 1 1 25 15137 1 1 15 LEU HD23 H -6.869 2.196 3.072 1.00 . A A . 15 LEU HD23 1 1 25 15138 1 1 15 LEU HG H -8.752 2.356 1.175 1.00 . A A . 15 LEU HG 1 1 25 15139 1 1 15 LEU N N -8.591 1.817 -1.606 1.00 . A A . 15 LEU N 1 1 25 15140 1 1 15 LEU O O -7.631 -0.941 -2.164 1.00 . A A . 15 LEU O 1 1 25 15141 1 1 16 LYS C C -5.263 -2.240 -2.556 1.00 . A A . 16 LYS C 1 1 25 15142 1 1 16 LYS CA C -5.006 -0.815 -3.049 1.00 . A A . 16 LYS CA 1 1 25 15143 1 1 16 LYS CB C -3.500 -0.542 -3.099 1.00 . A A . 16 LYS CB 1 1 25 15144 1 1 16 LYS CD C -1.668 -0.204 -4.785 1.00 . A A . 16 LYS CD 1 1 25 15145 1 1 16 LYS CE C -1.533 -0.181 -6.299 1.00 . A A . 16 LYS CE 1 1 25 15146 1 1 16 LYS CG C -3.061 0.213 -4.343 1.00 . A A . 16 LYS CG 1 1 25 15147 1 1 16 LYS H H -5.169 0.948 -1.887 1.00 . A A . 16 LYS H 1 1 25 15148 1 1 16 LYS HA H -5.415 -0.707 -4.043 1.00 . A A . 16 LYS HA 1 1 25 15149 1 1 16 LYS HB2 H -3.223 0.042 -2.234 1.00 . A A . 16 LYS HB2 1 1 25 15150 1 1 16 LYS HB3 H -2.973 -1.484 -3.071 1.00 . A A . 16 LYS HB3 1 1 25 15151 1 1 16 LYS HD2 H -0.947 0.478 -4.359 1.00 . A A . 16 LYS HD2 1 1 25 15152 1 1 16 LYS HD3 H -1.473 -1.205 -4.430 1.00 . A A . 16 LYS HD3 1 1 25 15153 1 1 16 LYS HE2 H -1.741 -1.169 -6.681 1.00 . A A . 16 LYS HE2 1 1 25 15154 1 1 16 LYS HE3 H -2.251 0.518 -6.701 1.00 . A A . 16 LYS HE3 1 1 25 15155 1 1 16 LYS HG2 H -3.758 0.006 -5.142 1.00 . A A . 16 LYS HG2 1 1 25 15156 1 1 16 LYS HG3 H -3.060 1.272 -4.129 1.00 . A A . 16 LYS HG3 1 1 25 15157 1 1 16 LYS HZ1 H 0.545 -0.394 -6.292 1.00 . A A . 16 LYS HZ1 1 1 25 15158 1 1 16 LYS HZ2 H -0.082 0.159 -7.763 1.00 . A A . 16 LYS HZ2 1 1 25 15159 1 1 16 LYS HZ3 H 0.021 1.207 -6.440 1.00 . A A . 16 LYS HZ3 1 1 25 15160 1 1 16 LYS N N -5.669 0.162 -2.191 1.00 . A A . 16 LYS N 1 1 25 15161 1 1 16 LYS NZ N -0.167 0.226 -6.728 1.00 . A A . 16 LYS NZ 1 1 25 15162 1 1 16 LYS O O -5.342 -2.483 -1.352 1.00 . A A . 16 LYS O 1 1 25 15163 1 1 17 PRO C C -4.683 -5.130 -2.083 1.00 . A A . 17 PRO C 1 1 25 15164 1 1 17 PRO CA C -5.655 -4.605 -3.135 1.00 . A A . 17 PRO CA 1 1 25 15165 1 1 17 PRO CB C -5.456 -5.341 -4.461 1.00 . A A . 17 PRO CB 1 1 25 15166 1 1 17 PRO CD C -5.325 -3.002 -4.944 1.00 . A A . 17 PRO CD 1 1 25 15167 1 1 17 PRO CG C -5.769 -4.326 -5.505 1.00 . A A . 17 PRO CG 1 1 25 15168 1 1 17 PRO HA H -6.668 -4.749 -2.789 1.00 . A A . 17 PRO HA 1 1 25 15169 1 1 17 PRO HB2 H -4.434 -5.684 -4.535 1.00 . A A . 17 PRO HB2 1 1 25 15170 1 1 17 PRO HB3 H -6.130 -6.182 -4.514 1.00 . A A . 17 PRO HB3 1 1 25 15171 1 1 17 PRO HD2 H -4.312 -2.784 -5.250 1.00 . A A . 17 PRO HD2 1 1 25 15172 1 1 17 PRO HD3 H -5.994 -2.216 -5.260 1.00 . A A . 17 PRO HD3 1 1 25 15173 1 1 17 PRO HG2 H -5.225 -4.551 -6.410 1.00 . A A . 17 PRO HG2 1 1 25 15174 1 1 17 PRO HG3 H -6.831 -4.314 -5.698 1.00 . A A . 17 PRO HG3 1 1 25 15175 1 1 17 PRO N N -5.401 -3.203 -3.484 1.00 . A A . 17 PRO N 1 1 25 15176 1 1 17 PRO O O -3.467 -5.013 -2.233 1.00 . A A . 17 PRO O 1 1 25 15177 1 1 18 ALA C C -3.384 -7.251 -0.480 1.00 . A A . 18 ALA C 1 1 25 15178 1 1 18 ALA CA C -4.411 -6.260 0.060 1.00 . A A . 18 ALA CA 1 1 25 15179 1 1 18 ALA CB C -5.293 -6.929 1.103 1.00 . A A . 18 ALA CB 1 1 25 15180 1 1 18 ALA H H -6.204 -5.777 -0.956 1.00 . A A . 18 ALA H 1 1 25 15181 1 1 18 ALA HA H -3.891 -5.440 0.535 1.00 . A A . 18 ALA HA 1 1 25 15182 1 1 18 ALA HB1 H -6.276 -6.481 1.084 1.00 . A A . 18 ALA HB1 1 1 25 15183 1 1 18 ALA HB2 H -5.374 -7.983 0.884 1.00 . A A . 18 ALA HB2 1 1 25 15184 1 1 18 ALA HB3 H -4.857 -6.797 2.082 1.00 . A A . 18 ALA HB3 1 1 25 15185 1 1 18 ALA N N -5.228 -5.713 -1.018 1.00 . A A . 18 ALA N 1 1 25 15186 1 1 18 ALA O O -3.711 -8.400 -0.778 1.00 . A A . 18 ALA O 1 1 25 15187 1 1 19 GLY C C -0.149 -6.914 -2.056 1.00 . A A . 19 GLY C 1 1 25 15188 1 1 19 GLY CA C -1.086 -7.649 -1.116 1.00 . A A . 19 GLY CA 1 1 25 15189 1 1 19 GLY H H -1.943 -5.869 -0.357 1.00 . A A . 19 GLY H 1 1 25 15190 1 1 19 GLY HA2 H -1.532 -8.478 -1.646 1.00 . A A . 19 GLY HA2 1 1 25 15191 1 1 19 GLY HA3 H -0.516 -8.032 -0.283 1.00 . A A . 19 GLY HA3 1 1 25 15192 1 1 19 GLY N N -2.143 -6.795 -0.607 1.00 . A A . 19 GLY N 1 1 25 15193 1 1 19 GLY O O 0.940 -7.400 -2.362 1.00 . A A . 19 GLY O 1 1 25 15194 1 1 20 THR C C 1.459 -4.374 -2.699 1.00 . A A . 20 THR C 1 1 25 15195 1 1 20 THR CA C 0.239 -4.935 -3.421 1.00 . A A . 20 THR CA 1 1 25 15196 1 1 20 THR CB C -0.594 -3.793 -4.004 1.00 . A A . 20 THR CB 1 1 25 15197 1 1 20 THR CG2 C 0.113 -3.037 -5.108 1.00 . A A . 20 THR CG2 1 1 25 15198 1 1 20 THR H H -1.446 -5.402 -2.234 1.00 . A A . 20 THR H 1 1 25 15199 1 1 20 THR HA H 0.572 -5.575 -4.225 1.00 . A A . 20 THR HA 1 1 25 15200 1 1 20 THR HB H -0.824 -3.090 -3.216 1.00 . A A . 20 THR HB 1 1 25 15201 1 1 20 THR HG1 H -1.634 -4.832 -5.298 1.00 . A A . 20 THR HG1 1 1 25 15202 1 1 20 THR HG21 H 0.634 -3.736 -5.746 1.00 . A A . 20 THR HG21 1 1 25 15203 1 1 20 THR HG22 H -0.612 -2.488 -5.690 1.00 . A A . 20 THR HG22 1 1 25 15204 1 1 20 THR HG23 H 0.823 -2.348 -4.675 1.00 . A A . 20 THR HG23 1 1 25 15205 1 1 20 THR N N -0.571 -5.738 -2.514 1.00 . A A . 20 THR N 1 1 25 15206 1 1 20 THR O O 1.334 -3.528 -1.814 1.00 . A A . 20 THR O 1 1 25 15207 1 1 20 THR OG1 O -1.814 -4.282 -4.532 1.00 . A A . 20 THR OG1 1 1 25 15208 1 1 21 THR C C 4.211 -2.976 -2.888 1.00 . A A . 21 THR C 1 1 25 15209 1 1 21 THR CA C 3.878 -4.403 -2.464 1.00 . A A . 21 THR CA 1 1 25 15210 1 1 21 THR CB C 5.029 -5.342 -2.831 1.00 . A A . 21 THR CB 1 1 25 15211 1 1 21 THR CG2 C 5.680 -5.980 -1.624 1.00 . A A . 21 THR CG2 1 1 25 15212 1 1 21 THR H H 2.672 -5.530 -3.789 1.00 . A A . 21 THR H 1 1 25 15213 1 1 21 THR HA H 3.740 -4.422 -1.394 1.00 . A A . 21 THR HA 1 1 25 15214 1 1 21 THR HB H 5.788 -4.781 -3.357 1.00 . A A . 21 THR HB 1 1 25 15215 1 1 21 THR HG1 H 4.446 -6.043 -4.564 1.00 . A A . 21 THR HG1 1 1 25 15216 1 1 21 THR HG21 H 4.927 -6.484 -1.035 1.00 . A A . 21 THR HG21 1 1 25 15217 1 1 21 THR HG22 H 6.422 -6.693 -1.949 1.00 . A A . 21 THR HG22 1 1 25 15218 1 1 21 THR HG23 H 6.152 -5.215 -1.025 1.00 . A A . 21 THR HG23 1 1 25 15219 1 1 21 THR N N 2.637 -4.854 -3.080 1.00 . A A . 21 THR N 1 1 25 15220 1 1 21 THR O O 3.983 -2.588 -4.034 1.00 . A A . 21 THR O 1 1 25 15221 1 1 21 THR OG1 O 4.580 -6.386 -3.678 1.00 . A A . 21 THR OG1 1 1 25 15222 1 1 22 CYS C C 6.418 -0.742 -3.019 1.00 . A A . 22 CYS C 1 1 25 15223 1 1 22 CYS CA C 5.116 -0.817 -2.228 1.00 . A A . 22 CYS CA 1 1 25 15224 1 1 22 CYS CB C 5.253 -0.035 -0.919 1.00 . A A . 22 CYS CB 1 1 25 15225 1 1 22 CYS H H 4.907 -2.568 -1.059 1.00 . A A . 22 CYS H 1 1 25 15226 1 1 22 CYS HA H 4.326 -0.378 -2.817 1.00 . A A . 22 CYS HA 1 1 25 15227 1 1 22 CYS HB2 H 4.770 -0.588 -0.127 1.00 . A A . 22 CYS HB2 1 1 25 15228 1 1 22 CYS HB3 H 6.301 0.079 -0.684 1.00 . A A . 22 CYS HB3 1 1 25 15229 1 1 22 CYS N N 4.751 -2.201 -1.954 1.00 . A A . 22 CYS N 1 1 25 15230 1 1 22 CYS O O 6.462 -0.172 -4.109 1.00 . A A . 22 CYS O 1 1 25 15231 1 1 22 CYS SG S 4.510 1.628 -0.964 1.00 . A A . 22 CYS SG 1 1 25 15232 1 1 23 TRP C C 9.112 -2.701 -3.673 1.00 . A A . 23 TRP C 1 1 25 15233 1 1 23 TRP CA C 8.780 -1.321 -3.117 1.00 . A A . 23 TRP CA 1 1 25 15234 1 1 23 TRP CB C 9.867 -0.875 -2.136 1.00 . A A . 23 TRP CB 1 1 25 15235 1 1 23 TRP CD1 C 11.527 -0.580 -4.064 1.00 . A A . 23 TRP CD1 1 1 25 15236 1 1 23 TRP CD2 C 12.485 -0.959 -2.076 1.00 . A A . 23 TRP CD2 1 1 25 15237 1 1 23 TRP CE2 C 13.499 -0.816 -3.043 1.00 . A A . 23 TRP CE2 1 1 25 15238 1 1 23 TRP CE3 C 12.849 -1.204 -0.749 1.00 . A A . 23 TRP CE3 1 1 25 15239 1 1 23 TRP CG C 11.231 -0.804 -2.751 1.00 . A A . 23 TRP CG 1 1 25 15240 1 1 23 TRP CH2 C 15.178 -1.150 -1.416 1.00 . A A . 23 TRP CH2 1 1 25 15241 1 1 23 TRP CZ2 C 14.851 -0.910 -2.723 1.00 . A A . 23 TRP CZ2 1 1 25 15242 1 1 23 TRP CZ3 C 14.192 -1.297 -0.433 1.00 . A A . 23 TRP CZ3 1 1 25 15243 1 1 23 TRP H H 7.379 -1.761 -1.592 1.00 . A A . 23 TRP H 1 1 25 15244 1 1 23 TRP HA H 8.739 -0.621 -3.934 1.00 . A A . 23 TRP HA 1 1 25 15245 1 1 23 TRP HB2 H 9.620 0.106 -1.758 1.00 . A A . 23 TRP HB2 1 1 25 15246 1 1 23 TRP HB3 H 9.907 -1.573 -1.312 1.00 . A A . 23 TRP HB3 1 1 25 15247 1 1 23 TRP HD1 H 10.789 -0.423 -4.836 1.00 . A A . 23 TRP HD1 1 1 25 15248 1 1 23 TRP HE1 H 13.349 -0.447 -5.103 1.00 . A A . 23 TRP HE1 1 1 25 15249 1 1 23 TRP HE3 H 12.103 -1.320 0.023 1.00 . A A . 23 TRP HE3 1 1 25 15250 1 1 23 TRP HH2 H 16.215 -1.231 -1.124 1.00 . A A . 23 TRP HH2 1 1 25 15251 1 1 23 TRP HZ2 H 15.624 -0.799 -3.469 1.00 . A A . 23 TRP HZ2 1 1 25 15252 1 1 23 TRP HZ3 H 14.492 -1.486 0.587 1.00 . A A . 23 TRP HZ3 1 1 25 15253 1 1 23 TRP N N 7.477 -1.322 -2.463 1.00 . A A . 23 TRP N 1 1 25 15254 1 1 23 TRP NE1 N 12.889 -0.586 -4.248 1.00 . A A . 23 TRP NE1 1 1 25 15255 1 1 23 TRP O O 9.104 -2.913 -4.885 1.00 . A A . 23 TRP O 1 1 25 15256 1 1 24 ARG C C 10.969 -5.017 -4.070 1.00 . A A . 24 ARG C 1 1 25 15257 1 1 24 ARG CA C 9.738 -4.997 -3.170 1.00 . A A . 24 ARG CA 1 1 25 15258 1 1 24 ARG CB C 8.555 -5.648 -3.890 1.00 . A A . 24 ARG CB 1 1 25 15259 1 1 24 ARG CD C 9.637 -7.453 -5.264 1.00 . A A . 24 ARG CD 1 1 25 15260 1 1 24 ARG CG C 8.717 -7.146 -4.094 1.00 . A A . 24 ARG CG 1 1 25 15261 1 1 24 ARG CZ C 8.443 -9.163 -6.575 1.00 . A A . 24 ARG CZ 1 1 25 15262 1 1 24 ARG H H 9.390 -3.399 -1.827 1.00 . A A . 24 ARG H 1 1 25 15263 1 1 24 ARG HA H 9.953 -5.557 -2.273 1.00 . A A . 24 ARG HA 1 1 25 15264 1 1 24 ARG HB2 H 7.659 -5.480 -3.311 1.00 . A A . 24 ARG HB2 1 1 25 15265 1 1 24 ARG HB3 H 8.440 -5.185 -4.859 1.00 . A A . 24 ARG HB3 1 1 25 15266 1 1 24 ARG HD2 H 9.436 -6.749 -6.058 1.00 . A A . 24 ARG HD2 1 1 25 15267 1 1 24 ARG HD3 H 10.661 -7.343 -4.938 1.00 . A A . 24 ARG HD3 1 1 25 15268 1 1 24 ARG HE H 10.092 -9.491 -5.500 1.00 . A A . 24 ARG HE 1 1 25 15269 1 1 24 ARG HG2 H 9.134 -7.578 -3.197 1.00 . A A . 24 ARG HG2 1 1 25 15270 1 1 24 ARG HG3 H 7.746 -7.579 -4.287 1.00 . A A . 24 ARG HG3 1 1 25 15271 1 1 24 ARG HH11 H 7.616 -7.319 -6.654 1.00 . A A . 24 ARG HH11 1 1 25 15272 1 1 24 ARG HH12 H 6.795 -8.540 -7.567 1.00 . A A . 24 ARG HH12 1 1 25 15273 1 1 24 ARG HH21 H 9.015 -11.098 -6.701 1.00 . A A . 24 ARG HH21 1 1 25 15274 1 1 24 ARG HH22 H 7.589 -10.685 -7.594 1.00 . A A . 24 ARG HH22 1 1 25 15275 1 1 24 ARG N N 9.402 -3.634 -2.776 1.00 . A A . 24 ARG N 1 1 25 15276 1 1 24 ARG NE N 9.443 -8.809 -5.772 1.00 . A A . 24 ARG NE 1 1 25 15277 1 1 24 ARG NH1 N 7.544 -8.267 -6.964 1.00 . A A . 24 ARG NH1 1 1 25 15278 1 1 24 ARG NH2 N 8.340 -10.418 -6.991 1.00 . A A . 24 ARG NH2 1 1 25 15279 1 1 24 ARG O O 10.873 -4.791 -5.276 1.00 . A A . 24 ARG O 1 1 25 15280 1 1 25 THR C C 13.703 -6.768 -4.643 1.00 . A A . 25 THR C 1 1 25 15281 1 1 25 THR CA C 13.377 -5.339 -4.223 1.00 . A A . 25 THR CA 1 1 25 15282 1 1 25 THR CB C 14.521 -4.768 -3.383 1.00 . A A . 25 THR CB 1 1 25 15283 1 1 25 THR CG2 C 15.540 -4.004 -4.201 1.00 . A A . 25 THR CG2 1 1 25 15284 1 1 25 THR H H 12.139 -5.461 -2.510 1.00 . A A . 25 THR H 1 1 25 15285 1 1 25 THR HA H 13.257 -4.735 -5.110 1.00 . A A . 25 THR HA 1 1 25 15286 1 1 25 THR HB H 15.034 -5.582 -2.892 1.00 . A A . 25 THR HB 1 1 25 15287 1 1 25 THR HG1 H 13.376 -3.299 -2.778 1.00 . A A . 25 THR HG1 1 1 25 15288 1 1 25 THR HG21 H 15.049 -3.537 -5.042 1.00 . A A . 25 THR HG21 1 1 25 15289 1 1 25 THR HG22 H 16.000 -3.246 -3.585 1.00 . A A . 25 THR HG22 1 1 25 15290 1 1 25 THR HG23 H 16.298 -4.686 -4.559 1.00 . A A . 25 THR HG23 1 1 25 15291 1 1 25 THR N N 12.126 -5.289 -3.475 1.00 . A A . 25 THR N 1 1 25 15292 1 1 25 THR O O 14.271 -6.998 -5.710 1.00 . A A . 25 THR O 1 1 25 15293 1 1 25 THR OG1 O 14.023 -3.891 -2.389 1.00 . A A . 25 THR OG1 1 1 25 15294 1 1 26 SER C C 13.036 -10.019 -2.967 1.00 . A A . 26 SER C 1 1 25 15295 1 1 26 SER CA C 13.590 -9.134 -4.078 1.00 . A A . 26 SER CA 1 1 25 15296 1 1 26 SER CB C 15.090 -9.384 -4.244 1.00 . A A . 26 SER CB 1 1 25 15297 1 1 26 SER H H 12.888 -7.478 -2.962 1.00 . A A . 26 SER H 1 1 25 15298 1 1 26 SER HA H 13.089 -9.381 -5.000 1.00 . A A . 26 SER HA 1 1 25 15299 1 1 26 SER HB2 H 15.284 -10.445 -4.201 1.00 . A A . 26 SER HB2 1 1 25 15300 1 1 26 SER HB3 H 15.414 -8.997 -5.199 1.00 . A A . 26 SER HB3 1 1 25 15301 1 1 26 SER HG H 16.378 -8.055 -3.601 1.00 . A A . 26 SER HG 1 1 25 15302 1 1 26 SER N N 13.338 -7.725 -3.796 1.00 . A A . 26 SER N 1 1 25 15303 1 1 26 SER O O 12.484 -11.088 -3.227 1.00 . A A . 26 SER O 1 1 25 15304 1 1 26 SER OG O 15.831 -8.744 -3.218 1.00 . A A . 26 SER OG 1 1 25 15305 1 1 27 VAL C C 11.868 -9.426 0.344 1.00 . A A . 27 VAL C 1 1 25 15306 1 1 27 VAL CA C 12.703 -10.312 -0.575 1.00 . A A . 27 VAL CA 1 1 25 15307 1 1 27 VAL CB C 13.870 -10.921 0.230 1.00 . A A . 27 VAL CB 1 1 25 15308 1 1 27 VAL CG1 C 14.770 -9.827 0.784 1.00 . A A . 27 VAL CG1 1 1 25 15309 1 1 27 VAL CG2 C 13.344 -11.810 1.348 1.00 . A A . 27 VAL CG2 1 1 25 15310 1 1 27 VAL H H 13.636 -8.705 -1.589 1.00 . A A . 27 VAL H 1 1 25 15311 1 1 27 VAL HA H 12.085 -11.117 -0.937 1.00 . A A . 27 VAL HA 1 1 25 15312 1 1 27 VAL HB H 14.458 -11.533 -0.439 1.00 . A A . 27 VAL HB 1 1 25 15313 1 1 27 VAL HG11 H 15.048 -9.152 -0.011 1.00 . A A . 27 VAL HG11 1 1 25 15314 1 1 27 VAL HG12 H 14.242 -9.281 1.552 1.00 . A A . 27 VAL HG12 1 1 25 15315 1 1 27 VAL HG13 H 15.659 -10.272 1.207 1.00 . A A . 27 VAL HG13 1 1 25 15316 1 1 27 VAL HG21 H 12.326 -11.533 1.580 1.00 . A A . 27 VAL HG21 1 1 25 15317 1 1 27 VAL HG22 H 13.373 -12.842 1.031 1.00 . A A . 27 VAL HG22 1 1 25 15318 1 1 27 VAL HG23 H 13.960 -11.686 2.226 1.00 . A A . 27 VAL HG23 1 1 25 15319 1 1 27 VAL N N 13.187 -9.564 -1.729 1.00 . A A . 27 VAL N 1 1 25 15320 1 1 27 VAL O O 10.806 -9.831 0.818 1.00 . A A . 27 VAL O 1 1 25 15321 1 1 28 SER C C 10.334 -6.838 0.825 1.00 . A A . 28 SER C 1 1 25 15322 1 1 28 SER CA C 11.657 -7.270 1.450 1.00 . A A . 28 SER CA 1 1 25 15323 1 1 28 SER CB C 12.535 -6.044 1.712 1.00 . A A . 28 SER CB 1 1 25 15324 1 1 28 SER H H 13.205 -7.956 0.180 1.00 . A A . 28 SER H 1 1 25 15325 1 1 28 SER HA H 11.454 -7.763 2.388 1.00 . A A . 28 SER HA 1 1 25 15326 1 1 28 SER HB2 H 13.499 -6.366 2.075 1.00 . A A . 28 SER HB2 1 1 25 15327 1 1 28 SER HB3 H 12.662 -5.493 0.792 1.00 . A A . 28 SER HB3 1 1 25 15328 1 1 28 SER HG H 11.491 -4.471 2.235 1.00 . A A . 28 SER HG 1 1 25 15329 1 1 28 SER N N 12.355 -8.217 0.588 1.00 . A A . 28 SER N 1 1 25 15330 1 1 28 SER O O 10.310 -6.034 -0.108 1.00 . A A . 28 SER O 1 1 25 15331 1 1 28 SER OG O 11.945 -5.192 2.678 1.00 . A A . 28 SER OG 1 1 25 15332 1 1 29 SER C C 6.963 -6.694 1.982 1.00 . A A . 29 SER C 1 1 25 15333 1 1 29 SER CA C 7.909 -7.046 0.838 1.00 . A A . 29 SER CA 1 1 25 15334 1 1 29 SER CB C 7.342 -8.216 0.033 1.00 . A A . 29 SER CB 1 1 25 15335 1 1 29 SER H H 9.320 -8.010 2.087 1.00 . A A . 29 SER H 1 1 25 15336 1 1 29 SER HA H 8.006 -6.188 0.190 1.00 . A A . 29 SER HA 1 1 25 15337 1 1 29 SER HB2 H 7.346 -9.107 0.645 1.00 . A A . 29 SER HB2 1 1 25 15338 1 1 29 SER HB3 H 6.329 -7.989 -0.263 1.00 . A A . 29 SER HB3 1 1 25 15339 1 1 29 SER HG H 8.069 -9.390 -1.356 1.00 . A A . 29 SER HG 1 1 25 15340 1 1 29 SER N N 9.236 -7.376 1.345 1.00 . A A . 29 SER N 1 1 25 15341 1 1 29 SER O O 6.656 -7.534 2.827 1.00 . A A . 29 SER O 1 1 25 15342 1 1 29 SER OG O 8.115 -8.459 -1.129 1.00 . A A . 29 SER OG 1 1 25 15343 1 1 30 HIS C C 4.177 -5.486 2.788 1.00 . A A . 30 HIS C 1 1 25 15344 1 1 30 HIS CA C 5.594 -4.983 3.042 1.00 . A A . 30 HIS CA 1 1 25 15345 1 1 30 HIS CB C 5.601 -3.455 3.112 1.00 . A A . 30 HIS CB 1 1 25 15346 1 1 30 HIS CD2 C 8.193 -3.444 3.235 1.00 . A A . 30 HIS CD2 1 1 25 15347 1 1 30 HIS CE1 C 8.515 -1.289 2.990 1.00 . A A . 30 HIS CE1 1 1 25 15348 1 1 30 HIS CG C 6.976 -2.863 3.106 1.00 . A A . 30 HIS CG 1 1 25 15349 1 1 30 HIS H H 6.787 -4.822 1.300 1.00 . A A . 30 HIS H 1 1 25 15350 1 1 30 HIS HA H 5.939 -5.380 3.983 1.00 . A A . 30 HIS HA 1 1 25 15351 1 1 30 HIS HB2 H 5.066 -3.060 2.262 1.00 . A A . 30 HIS HB2 1 1 25 15352 1 1 30 HIS HB3 H 5.107 -3.142 4.020 1.00 . A A . 30 HIS HB3 1 1 25 15353 1 1 30 HIS HD1 H 6.529 -0.821 2.839 1.00 . A A . 30 HIS HD1 1 1 25 15354 1 1 30 HIS HD2 H 8.388 -4.498 3.372 1.00 . A A . 30 HIS HD2 1 1 25 15355 1 1 30 HIS HE1 H 8.994 -0.326 2.897 1.00 . A A . 30 HIS HE1 1 1 25 15356 1 1 30 HIS HE2 H 10.102 -2.576 3.133 1.00 . A A . 30 HIS HE2 1 1 25 15357 1 1 30 HIS N N 6.505 -5.446 2.001 1.00 . A A . 30 HIS N 1 1 25 15358 1 1 30 HIS ND1 N 7.214 -1.512 2.955 1.00 . A A . 30 HIS ND1 1 1 25 15359 1 1 30 HIS NE2 N 9.131 -2.445 3.159 1.00 . A A . 30 HIS NE2 1 1 25 15360 1 1 30 HIS O O 3.456 -5.836 3.721 1.00 . A A . 30 HIS O 1 1 25 15361 1 1 31 TYR C C 1.376 -5.075 1.722 1.00 . A A . 31 TYR C 1 1 25 15362 1 1 31 TYR CA C 2.457 -5.977 1.133 1.00 . A A . 31 TYR CA 1 1 25 15363 1 1 31 TYR CB C 2.238 -7.421 1.591 1.00 . A A . 31 TYR CB 1 1 25 15364 1 1 31 TYR CD1 C 3.915 -9.306 1.688 1.00 . A A . 31 TYR CD1 1 1 25 15365 1 1 31 TYR CD2 C 3.297 -8.458 -0.452 1.00 . A A . 31 TYR CD2 1 1 25 15366 1 1 31 TYR CE1 C 4.766 -10.214 1.087 1.00 . A A . 31 TYR CE1 1 1 25 15367 1 1 31 TYR CE2 C 4.145 -9.364 -1.061 1.00 . A A . 31 TYR CE2 1 1 25 15368 1 1 31 TYR CG C 3.168 -8.414 0.930 1.00 . A A . 31 TYR CG 1 1 25 15369 1 1 31 TYR CZ C 4.877 -10.239 -0.287 1.00 . A A . 31 TYR CZ 1 1 25 15370 1 1 31 TYR H H 4.411 -5.226 0.821 1.00 . A A . 31 TYR H 1 1 25 15371 1 1 31 TYR HA H 2.393 -5.938 0.056 1.00 . A A . 31 TYR HA 1 1 25 15372 1 1 31 TYR HB2 H 2.395 -7.481 2.658 1.00 . A A . 31 TYR HB2 1 1 25 15373 1 1 31 TYR HB3 H 1.223 -7.713 1.364 1.00 . A A . 31 TYR HB3 1 1 25 15374 1 1 31 TYR HD1 H 3.826 -9.284 2.764 1.00 . A A . 31 TYR HD1 1 1 25 15375 1 1 31 TYR HD2 H 2.723 -7.770 -1.056 1.00 . A A . 31 TYR HD2 1 1 25 15376 1 1 31 TYR HE1 H 5.339 -10.900 1.693 1.00 . A A . 31 TYR HE1 1 1 25 15377 1 1 31 TYR HE2 H 4.232 -9.383 -2.137 1.00 . A A . 31 TYR HE2 1 1 25 15378 1 1 31 TYR HH H 5.300 -11.504 -1.672 1.00 . A A . 31 TYR HH 1 1 25 15379 1 1 31 TYR N N 3.788 -5.518 1.518 1.00 . A A . 31 TYR N 1 1 25 15380 1 1 31 TYR O O 1.353 -4.821 2.926 1.00 . A A . 31 TYR O 1 1 25 15381 1 1 31 TYR OH O 5.722 -11.143 -0.889 1.00 . A A . 31 TYR OH 1 1 25 15382 1 1 32 CYS C C -1.659 -4.509 2.063 1.00 . A A . 32 CYS C 1 1 25 15383 1 1 32 CYS CA C -0.601 -3.722 1.298 1.00 . A A . 32 CYS CA 1 1 25 15384 1 1 32 CYS CB C -1.239 -3.030 0.093 1.00 . A A . 32 CYS CB 1 1 25 15385 1 1 32 CYS H H 0.552 -4.833 -0.084 1.00 . A A . 32 CYS H 1 1 25 15386 1 1 32 CYS HA H -0.182 -2.973 1.953 1.00 . A A . 32 CYS HA 1 1 25 15387 1 1 32 CYS HB2 H -0.495 -2.912 -0.680 1.00 . A A . 32 CYS HB2 1 1 25 15388 1 1 32 CYS HB3 H -2.045 -3.644 -0.280 1.00 . A A . 32 CYS HB3 1 1 25 15389 1 1 32 CYS N N 0.482 -4.595 0.864 1.00 . A A . 32 CYS N 1 1 25 15390 1 1 32 CYS O O -1.988 -5.639 1.703 1.00 . A A . 32 CYS O 1 1 25 15391 1 1 32 CYS SG S -1.920 -1.381 0.460 1.00 . A A . 32 CYS SG 1 1 25 15392 1 1 33 THR C C -4.614 -4.135 3.482 1.00 . A A . 33 THR C 1 1 25 15393 1 1 33 THR CA C -3.214 -4.548 3.933 1.00 . A A . 33 THR CA 1 1 25 15394 1 1 33 THR CB C -3.016 -4.197 5.408 1.00 . A A . 33 THR CB 1 1 25 15395 1 1 33 THR CG2 C -1.578 -4.316 5.862 1.00 . A A . 33 THR CG2 1 1 25 15396 1 1 33 THR H H -1.888 -3.002 3.356 1.00 . A A . 33 THR H 1 1 25 15397 1 1 33 THR HA H -3.111 -5.615 3.809 1.00 . A A . 33 THR HA 1 1 25 15398 1 1 33 THR HB H -3.610 -4.870 6.010 1.00 . A A . 33 THR HB 1 1 25 15399 1 1 33 THR HG1 H -4.079 -2.877 6.388 1.00 . A A . 33 THR HG1 1 1 25 15400 1 1 33 THR HG21 H -1.000 -4.817 5.098 1.00 . A A . 33 THR HG21 1 1 25 15401 1 1 33 THR HG22 H -1.171 -3.330 6.031 1.00 . A A . 33 THR HG22 1 1 25 15402 1 1 33 THR HG23 H -1.535 -4.886 6.778 1.00 . A A . 33 THR HG23 1 1 25 15403 1 1 33 THR N N -2.190 -3.903 3.119 1.00 . A A . 33 THR N 1 1 25 15404 1 1 33 THR O O -5.593 -4.351 4.196 1.00 . A A . 33 THR O 1 1 25 15405 1 1 33 THR OG1 O -3.442 -2.872 5.670 1.00 . A A . 33 THR OG1 1 1 25 15406 1 1 34 GLY C C -6.814 -2.341 2.784 1.00 . A A . 34 GLY C 1 1 25 15407 1 1 34 GLY CA C -5.988 -3.110 1.768 1.00 . A A . 34 GLY CA 1 1 25 15408 1 1 34 GLY H H -3.889 -3.396 1.764 1.00 . A A . 34 GLY H 1 1 25 15409 1 1 34 GLY HA2 H -6.545 -3.981 1.455 1.00 . A A . 34 GLY HA2 1 1 25 15410 1 1 34 GLY HA3 H -5.819 -2.478 0.909 1.00 . A A . 34 GLY HA3 1 1 25 15411 1 1 34 GLY N N -4.703 -3.541 2.293 1.00 . A A . 34 GLY N 1 1 25 15412 1 1 34 GLY O O -8.044 -2.397 2.762 1.00 . A A . 34 GLY O 1 1 25 15413 1 1 35 ARG C C -6.077 0.455 5.004 1.00 . A A . 35 ARG C 1 1 25 15414 1 1 35 ARG CA C -6.824 -0.843 4.702 1.00 . A A . 35 ARG CA 1 1 25 15415 1 1 35 ARG CB C -6.970 -1.667 5.983 1.00 . A A . 35 ARG CB 1 1 25 15416 1 1 35 ARG CD C -8.383 -2.274 7.970 1.00 . A A . 35 ARG CD 1 1 25 15417 1 1 35 ARG CG C -8.248 -1.375 6.751 1.00 . A A . 35 ARG CG 1 1 25 15418 1 1 35 ARG CZ C -9.265 -4.387 7.061 1.00 . A A . 35 ARG CZ 1 1 25 15419 1 1 35 ARG H H -5.159 -1.617 3.645 1.00 . A A . 35 ARG H 1 1 25 15420 1 1 35 ARG HA H -7.807 -0.599 4.330 1.00 . A A . 35 ARG HA 1 1 25 15421 1 1 35 ARG HB2 H -6.963 -2.716 5.725 1.00 . A A . 35 ARG HB2 1 1 25 15422 1 1 35 ARG HB3 H -6.131 -1.459 6.629 1.00 . A A . 35 ARG HB3 1 1 25 15423 1 1 35 ARG HD2 H -7.600 -2.028 8.671 1.00 . A A . 35 ARG HD2 1 1 25 15424 1 1 35 ARG HD3 H -9.345 -2.094 8.429 1.00 . A A . 35 ARG HD3 1 1 25 15425 1 1 35 ARG HE H -7.433 -4.142 7.815 1.00 . A A . 35 ARG HE 1 1 25 15426 1 1 35 ARG HG2 H -8.234 -0.345 7.076 1.00 . A A . 35 ARG HG2 1 1 25 15427 1 1 35 ARG HG3 H -9.094 -1.538 6.099 1.00 . A A . 35 ARG HG3 1 1 25 15428 1 1 35 ARG HH11 H -10.566 -2.840 6.997 1.00 . A A . 35 ARG HH11 1 1 25 15429 1 1 35 ARG HH12 H -11.162 -4.338 6.364 1.00 . A A . 35 ARG HH12 1 1 25 15430 1 1 35 ARG HH21 H -8.215 -6.112 6.982 1.00 . A A . 35 ARG HH21 1 1 25 15431 1 1 35 ARG HH22 H -9.828 -6.196 6.355 1.00 . A A . 35 ARG HH22 1 1 25 15432 1 1 35 ARG N N -6.139 -1.623 3.676 1.00 . A A . 35 ARG N 1 1 25 15433 1 1 35 ARG NE N -8.280 -3.689 7.621 1.00 . A A . 35 ARG NE 1 1 25 15434 1 1 35 ARG NH1 N -10.426 -3.807 6.785 1.00 . A A . 35 ARG NH1 1 1 25 15435 1 1 35 ARG NH2 N -9.088 -5.670 6.776 1.00 . A A . 35 ARG NH2 1 1 25 15436 1 1 35 ARG O O -6.283 1.068 6.052 1.00 . A A . 35 ARG O 1 1 25 15437 1 1 36 SER C C -3.566 2.363 3.035 1.00 . A A . 36 SER C 1 1 25 15438 1 1 36 SER CA C -4.442 2.099 4.254 1.00 . A A . 36 SER CA 1 1 25 15439 1 1 36 SER CB C -3.572 2.009 5.510 1.00 . A A . 36 SER CB 1 1 25 15440 1 1 36 SER H H -5.092 0.345 3.265 1.00 . A A . 36 SER H 1 1 25 15441 1 1 36 SER HA H -5.139 2.916 4.367 1.00 . A A . 36 SER HA 1 1 25 15442 1 1 36 SER HB2 H -3.306 3.005 5.832 1.00 . A A . 36 SER HB2 1 1 25 15443 1 1 36 SER HB3 H -4.125 1.514 6.295 1.00 . A A . 36 SER HB3 1 1 25 15444 1 1 36 SER HG H -2.603 0.359 5.093 1.00 . A A . 36 SER HG 1 1 25 15445 1 1 36 SER N N -5.214 0.872 4.082 1.00 . A A . 36 SER N 1 1 25 15446 1 1 36 SER O O -2.928 1.452 2.509 1.00 . A A . 36 SER O 1 1 25 15447 1 1 36 SER OG O -2.384 1.279 5.257 1.00 . A A . 36 SER OG 1 1 25 15448 1 1 37 CYS C C -1.261 4.150 1.804 1.00 . A A . 37 CYS C 1 1 25 15449 1 1 37 CYS CA C -2.735 3.993 1.431 1.00 . A A . 37 CYS CA 1 1 25 15450 1 1 37 CYS CB C -3.258 5.295 0.823 1.00 . A A . 37 CYS CB 1 1 25 15451 1 1 37 CYS H H -4.066 4.302 3.049 1.00 . A A . 37 CYS H 1 1 25 15452 1 1 37 CYS HA H -2.825 3.206 0.699 1.00 . A A . 37 CYS HA 1 1 25 15453 1 1 37 CYS HB2 H -2.876 6.127 1.394 1.00 . A A . 37 CYS HB2 1 1 25 15454 1 1 37 CYS HB3 H -2.905 5.373 -0.195 1.00 . A A . 37 CYS HB3 1 1 25 15455 1 1 37 CYS N N -3.537 3.616 2.590 1.00 . A A . 37 CYS N 1 1 25 15456 1 1 37 CYS O O -0.407 4.310 0.933 1.00 . A A . 37 CYS O 1 1 25 15457 1 1 37 CYS SG S -5.076 5.431 0.793 1.00 . A A . 37 CYS SG 1 1 25 15458 1 1 38 GLU C C 1.038 2.873 3.811 1.00 . A A . 38 GLU C 1 1 25 15459 1 1 38 GLU CA C 0.405 4.241 3.577 1.00 . A A . 38 GLU CA 1 1 25 15460 1 1 38 GLU CB C 0.439 5.059 4.870 1.00 . A A . 38 GLU CB 1 1 25 15461 1 1 38 GLU CD C 2.106 6.911 4.458 1.00 . A A . 38 GLU CD 1 1 25 15462 1 1 38 GLU CG C 1.813 5.621 5.197 1.00 . A A . 38 GLU CG 1 1 25 15463 1 1 38 GLU H H -1.686 3.974 3.753 1.00 . A A . 38 GLU H 1 1 25 15464 1 1 38 GLU HA H 0.969 4.761 2.818 1.00 . A A . 38 GLU HA 1 1 25 15465 1 1 38 GLU HB2 H -0.251 5.884 4.778 1.00 . A A . 38 GLU HB2 1 1 25 15466 1 1 38 GLU HB3 H 0.127 4.429 5.689 1.00 . A A . 38 GLU HB3 1 1 25 15467 1 1 38 GLU HG2 H 1.865 5.813 6.259 1.00 . A A . 38 GLU HG2 1 1 25 15468 1 1 38 GLU HG3 H 2.561 4.890 4.927 1.00 . A A . 38 GLU HG3 1 1 25 15469 1 1 38 GLU N N -0.967 4.103 3.102 1.00 . A A . 38 GLU N 1 1 25 15470 1 1 38 GLU O O 0.907 2.293 4.888 1.00 . A A . 38 GLU O 1 1 25 15471 1 1 38 GLU OE1 O 2.523 7.889 5.113 1.00 . A A . 38 GLU OE1 1 1 25 15472 1 1 38 GLU OE2 O 1.919 6.944 3.223 1.00 . A A . 38 GLU OE2 1 1 25 15473 1 1 39 CYS C C 3.372 1.031 4.050 1.00 . A A . 39 CYS C 1 1 25 15474 1 1 39 CYS CA C 2.381 1.063 2.885 1.00 . A A . 39 CYS CA 1 1 25 15475 1 1 39 CYS CB C 3.107 0.744 1.577 1.00 . A A . 39 CYS CB 1 1 25 15476 1 1 39 CYS H H 1.794 2.875 1.960 1.00 . A A . 39 CYS H 1 1 25 15477 1 1 39 CYS HA H 1.617 0.319 3.052 1.00 . A A . 39 CYS HA 1 1 25 15478 1 1 39 CYS HB2 H 3.710 -0.141 1.716 1.00 . A A . 39 CYS HB2 1 1 25 15479 1 1 39 CYS HB3 H 2.376 0.557 0.805 1.00 . A A . 39 CYS HB3 1 1 25 15480 1 1 39 CYS N N 1.726 2.364 2.793 1.00 . A A . 39 CYS N 1 1 25 15481 1 1 39 CYS O O 4.419 1.676 3.998 1.00 . A A . 39 CYS O 1 1 25 15482 1 1 39 CYS SG S 4.205 2.075 0.992 1.00 . A A . 39 CYS SG 1 1 25 15483 1 1 40 PRO C C 5.356 -0.218 5.919 1.00 . A A . 40 PRO C 1 1 25 15484 1 1 40 PRO CA C 3.930 0.172 6.293 1.00 . A A . 40 PRO CA 1 1 25 15485 1 1 40 PRO CB C 3.277 -0.931 7.129 1.00 . A A . 40 PRO CB 1 1 25 15486 1 1 40 PRO CD C 1.829 -0.527 5.272 1.00 . A A . 40 PRO CD 1 1 25 15487 1 1 40 PRO CG C 1.844 -0.913 6.725 1.00 . A A . 40 PRO CG 1 1 25 15488 1 1 40 PRO HA H 3.947 1.093 6.857 1.00 . A A . 40 PRO HA 1 1 25 15489 1 1 40 PRO HB2 H 3.740 -1.880 6.902 1.00 . A A . 40 PRO HB2 1 1 25 15490 1 1 40 PRO HB3 H 3.393 -0.708 8.179 1.00 . A A . 40 PRO HB3 1 1 25 15491 1 1 40 PRO HD2 H 1.865 -1.408 4.648 1.00 . A A . 40 PRO HD2 1 1 25 15492 1 1 40 PRO HD3 H 0.952 0.061 5.047 1.00 . A A . 40 PRO HD3 1 1 25 15493 1 1 40 PRO HG2 H 1.412 -1.894 6.857 1.00 . A A . 40 PRO HG2 1 1 25 15494 1 1 40 PRO HG3 H 1.306 -0.183 7.312 1.00 . A A . 40 PRO HG3 1 1 25 15495 1 1 40 PRO N N 3.056 0.278 5.120 1.00 . A A . 40 PRO N 1 1 25 15496 1 1 40 PRO O O 5.656 -0.465 4.751 1.00 . A A . 40 PRO O 1 1 25 15497 1 1 41 SER C C 7.953 -1.972 7.342 1.00 . A A . 41 SER C 1 1 25 15498 1 1 41 SER CA C 7.627 -0.631 6.693 1.00 . A A . 41 SER CA 1 1 25 15499 1 1 41 SER CB C 8.551 0.455 7.247 1.00 . A A . 41 SER CB 1 1 25 15500 1 1 41 SER H H 5.932 -0.063 7.827 1.00 . A A . 41 SER H 1 1 25 15501 1 1 41 SER HA H 7.781 -0.713 5.628 1.00 . A A . 41 SER HA 1 1 25 15502 1 1 41 SER HB2 H 8.866 0.183 8.243 1.00 . A A . 41 SER HB2 1 1 25 15503 1 1 41 SER HB3 H 9.416 0.548 6.608 1.00 . A A . 41 SER HB3 1 1 25 15504 1 1 41 SER HG H 7.484 1.895 6.456 1.00 . A A . 41 SER HG 1 1 25 15505 1 1 41 SER N N 6.231 -0.271 6.917 1.00 . A A . 41 SER N 1 1 25 15506 1 1 41 SER O O 9.046 -2.167 7.874 1.00 . A A . 41 SER O 1 1 25 15507 1 1 41 SER OG O 7.889 1.707 7.305 1.00 . A A . 41 SER OG 1 1 25 15508 1 1 42 TYR C C 7.180 -5.296 6.794 1.00 . A A . 42 TYR C 1 1 25 15509 1 1 42 TYR CA C 7.183 -4.219 7.877 1.00 . A A . 42 TYR CA 1 1 25 15510 1 1 42 TYR CB C 6.084 -4.507 8.901 1.00 . A A . 42 TYR CB 1 1 25 15511 1 1 42 TYR CD1 C 6.759 -2.976 10.792 1.00 . A A . 42 TYR CD1 1 1 25 15512 1 1 42 TYR CD2 C 4.624 -2.646 9.784 1.00 . A A . 42 TYR CD2 1 1 25 15513 1 1 42 TYR CE1 C 6.519 -1.923 11.655 1.00 . A A . 42 TYR CE1 1 1 25 15514 1 1 42 TYR CE2 C 4.376 -1.592 10.643 1.00 . A A . 42 TYR CE2 1 1 25 15515 1 1 42 TYR CG C 5.817 -3.354 9.843 1.00 . A A . 42 TYR CG 1 1 25 15516 1 1 42 TYR CZ C 5.326 -1.235 11.576 1.00 . A A . 42 TYR CZ 1 1 25 15517 1 1 42 TYR H H 6.148 -2.681 6.855 1.00 . A A . 42 TYR H 1 1 25 15518 1 1 42 TYR HA H 8.140 -4.231 8.376 1.00 . A A . 42 TYR HA 1 1 25 15519 1 1 42 TYR HB2 H 5.165 -4.728 8.380 1.00 . A A . 42 TYR HB2 1 1 25 15520 1 1 42 TYR HB3 H 6.370 -5.363 9.495 1.00 . A A . 42 TYR HB3 1 1 25 15521 1 1 42 TYR HD1 H 7.692 -3.516 10.851 1.00 . A A . 42 TYR HD1 1 1 25 15522 1 1 42 TYR HD2 H 3.881 -2.928 9.052 1.00 . A A . 42 TYR HD2 1 1 25 15523 1 1 42 TYR HE1 H 7.263 -1.644 12.386 1.00 . A A . 42 TYR HE1 1 1 25 15524 1 1 42 TYR HE2 H 3.442 -1.053 10.581 1.00 . A A . 42 TYR HE2 1 1 25 15525 1 1 42 TYR HH H 4.640 0.520 11.958 1.00 . A A . 42 TYR HH 1 1 25 15526 1 1 42 TYR N N 6.998 -2.895 7.294 1.00 . A A . 42 TYR N 1 1 25 15527 1 1 42 TYR O O 6.138 -5.873 6.485 1.00 . A A . 42 TYR O 1 1 25 15528 1 1 42 TYR OH O 5.084 -0.186 12.434 1.00 . A A . 42 TYR OH 1 1 25 15529 1 1 43 PRO C C 7.883 -7.937 5.564 1.00 . A A . 43 PRO C 1 1 25 15530 1 1 43 PRO CA C 8.480 -6.596 5.151 1.00 . A A . 43 PRO CA 1 1 25 15531 1 1 43 PRO CB C 9.993 -6.722 4.958 1.00 . A A . 43 PRO CB 1 1 25 15532 1 1 43 PRO CD C 9.645 -4.941 6.513 1.00 . A A . 43 PRO CD 1 1 25 15533 1 1 43 PRO CG C 10.542 -5.411 5.402 1.00 . A A . 43 PRO CG 1 1 25 15534 1 1 43 PRO HA H 8.023 -6.268 4.229 1.00 . A A . 43 PRO HA 1 1 25 15535 1 1 43 PRO HB2 H 10.370 -7.534 5.563 1.00 . A A . 43 PRO HB2 1 1 25 15536 1 1 43 PRO HB3 H 10.212 -6.909 3.917 1.00 . A A . 43 PRO HB3 1 1 25 15537 1 1 43 PRO HD2 H 10.021 -5.275 7.469 1.00 . A A . 43 PRO HD2 1 1 25 15538 1 1 43 PRO HD3 H 9.554 -3.865 6.496 1.00 . A A . 43 PRO HD3 1 1 25 15539 1 1 43 PRO HG2 H 11.552 -5.539 5.764 1.00 . A A . 43 PRO HG2 1 1 25 15540 1 1 43 PRO HG3 H 10.522 -4.708 4.582 1.00 . A A . 43 PRO HG3 1 1 25 15541 1 1 43 PRO N N 8.353 -5.582 6.203 1.00 . A A . 43 PRO N 1 1 25 15542 1 1 43 PRO O O 7.314 -8.067 6.647 1.00 . A A . 43 PRO O 1 1 25 15543 1 1 44 GLY C C 8.392 -11.363 4.497 1.00 . A A . 44 GLY C 1 1 25 15544 1 1 44 GLY CA C 7.485 -10.250 4.985 1.00 . A A . 44 GLY CA 1 1 25 15545 1 1 44 GLY H H 8.480 -8.770 3.845 1.00 . A A . 44 GLY H 1 1 25 15546 1 1 44 GLY HA2 H 6.521 -10.351 4.508 1.00 . A A . 44 GLY HA2 1 1 25 15547 1 1 44 GLY HA3 H 7.358 -10.346 6.053 1.00 . A A . 44 GLY HA3 1 1 25 15548 1 1 44 GLY N N 8.017 -8.932 4.693 1.00 . A A . 44 GLY N 1 1 25 15549 1 1 44 GLY O O 7.868 -12.379 3.995 1.00 . A A . 44 GLY O 1 1 25 15550 1 1 44 GLY OXT O 9.627 -11.218 4.618 1.00 . A A . 44 GLY OXT 1 1 26 15551 1 1 1 ALA C C -7.379 16.805 2.182 1.00 . A A . 1 ALA C 1 1 26 15552 1 1 1 ALA CA C -7.693 18.124 2.880 1.00 . A A . 1 ALA CA 1 1 26 15553 1 1 1 ALA CB C -6.909 18.232 4.179 1.00 . A A . 1 ALA CB 1 1 26 15554 1 1 1 ALA H1 H -9.440 17.441 3.724 1.00 . A A . 1 ALA H1 1 1 26 15555 1 1 1 ALA H2 H -9.301 19.148 3.652 1.00 . A A . 1 ALA H2 1 1 26 15556 1 1 1 ALA H3 H -9.638 18.255 2.226 1.00 . A A . 1 ALA H3 1 1 26 15557 1 1 1 ALA HA H -7.390 18.939 2.238 1.00 . A A . 1 ALA HA 1 1 26 15558 1 1 1 ALA HB1 H -6.932 19.253 4.529 1.00 . A A . 1 ALA HB1 1 1 26 15559 1 1 1 ALA HB2 H -7.354 17.587 4.922 1.00 . A A . 1 ALA HB2 1 1 26 15560 1 1 1 ALA HB3 H -5.886 17.933 4.009 1.00 . A A . 1 ALA HB3 1 1 26 15561 1 1 1 ALA N N -9.149 18.254 3.144 1.00 . A A . 1 ALA N 1 1 26 15562 1 1 1 ALA O O -7.101 15.798 2.833 1.00 . A A . 1 ALA O 1 1 26 15563 1 1 2 MET C C -8.181 14.538 0.330 1.00 . A A . 2 MET C 1 1 26 15564 1 1 2 MET CA C -7.145 15.626 0.061 1.00 . A A . 2 MET CA 1 1 26 15565 1 1 2 MET CB C -5.739 15.101 0.366 1.00 . A A . 2 MET CB 1 1 26 15566 1 1 2 MET CE C -2.805 16.935 0.958 1.00 . A A . 2 MET CE 1 1 26 15567 1 1 2 MET CG C -4.678 15.609 -0.596 1.00 . A A . 2 MET CG 1 1 26 15568 1 1 2 MET H H -7.651 17.655 0.392 1.00 . A A . 2 MET H 1 1 26 15569 1 1 2 MET HA H -7.196 15.903 -0.981 1.00 . A A . 2 MET HA 1 1 26 15570 1 1 2 MET HB2 H -5.463 15.404 1.365 1.00 . A A . 2 MET HB2 1 1 26 15571 1 1 2 MET HB3 H -5.751 14.022 0.317 1.00 . A A . 2 MET HB3 1 1 26 15572 1 1 2 MET HE1 H -3.740 17.195 1.432 1.00 . A A . 2 MET HE1 1 1 26 15573 1 1 2 MET HE2 H -2.042 16.807 1.712 1.00 . A A . 2 MET HE2 1 1 26 15574 1 1 2 MET HE3 H -2.513 17.723 0.280 1.00 . A A . 2 MET HE3 1 1 26 15575 1 1 2 MET HG2 H -4.761 15.062 -1.524 1.00 . A A . 2 MET HG2 1 1 26 15576 1 1 2 MET HG3 H -4.853 16.659 -0.782 1.00 . A A . 2 MET HG3 1 1 26 15577 1 1 2 MET N N -7.424 16.820 0.853 1.00 . A A . 2 MET N 1 1 26 15578 1 1 2 MET O O -9.106 14.342 -0.458 1.00 . A A . 2 MET O 1 1 26 15579 1 1 2 MET SD S -3.005 15.407 0.045 1.00 . A A . 2 MET SD 1 1 26 15580 1 1 3 ASP C C -8.959 11.669 0.756 1.00 . A A . 3 ASP C 1 1 26 15581 1 1 3 ASP CA C -8.943 12.767 1.815 1.00 . A A . 3 ASP CA 1 1 26 15582 1 1 3 ASP CB C -10.354 13.327 2.006 1.00 . A A . 3 ASP CB 1 1 26 15583 1 1 3 ASP CG C -11.091 12.659 3.150 1.00 . A A . 3 ASP CG 1 1 26 15584 1 1 3 ASP H H -7.264 14.036 2.034 1.00 . A A . 3 ASP H 1 1 26 15585 1 1 3 ASP HA H -8.604 12.344 2.749 1.00 . A A . 3 ASP HA 1 1 26 15586 1 1 3 ASP HB2 H -10.289 14.385 2.214 1.00 . A A . 3 ASP HB2 1 1 26 15587 1 1 3 ASP HB3 H -10.920 13.176 1.099 1.00 . A A . 3 ASP HB3 1 1 26 15588 1 1 3 ASP N N -8.021 13.834 1.446 1.00 . A A . 3 ASP N 1 1 26 15589 1 1 3 ASP O O -8.187 11.708 -0.203 1.00 . A A . 3 ASP O 1 1 26 15590 1 1 3 ASP OD1 O -11.019 11.417 3.258 1.00 . A A . 3 ASP OD1 1 1 26 15591 1 1 3 ASP OD2 O -11.741 13.378 3.938 1.00 . A A . 3 ASP OD2 1 1 26 15592 1 1 4 CYS C C -8.733 8.671 0.037 1.00 . A A . 4 CYS C 1 1 26 15593 1 1 4 CYS CA C -9.965 9.576 -0.003 1.00 . A A . 4 CYS CA 1 1 26 15594 1 1 4 CYS CB C -10.180 10.101 -1.424 1.00 . A A . 4 CYS CB 1 1 26 15595 1 1 4 CYS H H -10.430 10.718 1.721 1.00 . A A . 4 CYS H 1 1 26 15596 1 1 4 CYS HA H -10.828 8.996 0.287 1.00 . A A . 4 CYS HA 1 1 26 15597 1 1 4 CYS HB2 H -9.932 11.150 -1.452 1.00 . A A . 4 CYS HB2 1 1 26 15598 1 1 4 CYS HB3 H -9.530 9.565 -2.099 1.00 . A A . 4 CYS HB3 1 1 26 15599 1 1 4 CYS N N -9.843 10.691 0.936 1.00 . A A . 4 CYS N 1 1 26 15600 1 1 4 CYS O O -8.591 7.770 -0.790 1.00 . A A . 4 CYS O 1 1 26 15601 1 1 4 CYS SG S -11.887 9.919 -2.034 1.00 . A A . 4 CYS SG 1 1 26 15602 1 1 5 THR C C -5.797 8.161 -0.135 1.00 . A A . 5 THR C 1 1 26 15603 1 1 5 THR CA C -6.635 8.109 1.139 1.00 . A A . 5 THR CA 1 1 26 15604 1 1 5 THR CB C -6.992 6.659 1.470 1.00 . A A . 5 THR CB 1 1 26 15605 1 1 5 THR CG2 C -6.030 6.015 2.446 1.00 . A A . 5 THR CG2 1 1 26 15606 1 1 5 THR H H -8.012 9.637 1.631 1.00 . A A . 5 THR H 1 1 26 15607 1 1 5 THR HA H -6.058 8.523 1.952 1.00 . A A . 5 THR HA 1 1 26 15608 1 1 5 THR HB H -6.977 6.078 0.560 1.00 . A A . 5 THR HB 1 1 26 15609 1 1 5 THR HG1 H -8.922 6.353 1.342 1.00 . A A . 5 THR HG1 1 1 26 15610 1 1 5 THR HG21 H -5.045 6.438 2.313 1.00 . A A . 5 THR HG21 1 1 26 15611 1 1 5 THR HG22 H -6.366 6.198 3.456 1.00 . A A . 5 THR HG22 1 1 26 15612 1 1 5 THR HG23 H -5.993 4.951 2.266 1.00 . A A . 5 THR HG23 1 1 26 15613 1 1 5 THR N N -7.848 8.909 0.999 1.00 . A A . 5 THR N 1 1 26 15614 1 1 5 THR O O -6.143 7.546 -1.144 1.00 . A A . 5 THR O 1 1 26 15615 1 1 5 THR OG1 O -8.291 6.577 2.030 1.00 . A A . 5 THR OG1 1 1 26 15616 1 1 6 THR C C -2.478 8.316 -0.975 1.00 . A A . 6 THR C 1 1 26 15617 1 1 6 THR CA C -3.802 9.027 -1.229 1.00 . A A . 6 THR CA 1 1 26 15618 1 1 6 THR CB C -3.550 10.504 -1.540 1.00 . A A . 6 THR CB 1 1 26 15619 1 1 6 THR CG2 C -4.648 11.137 -2.366 1.00 . A A . 6 THR CG2 1 1 26 15620 1 1 6 THR H H -4.468 9.363 0.752 1.00 . A A . 6 THR H 1 1 26 15621 1 1 6 THR HA H -4.287 8.568 -2.078 1.00 . A A . 6 THR HA 1 1 26 15622 1 1 6 THR HB H -2.626 10.591 -2.094 1.00 . A A . 6 THR HB 1 1 26 15623 1 1 6 THR HG1 H -2.917 12.050 -0.518 1.00 . A A . 6 THR HG1 1 1 26 15624 1 1 6 THR HG21 H -5.542 10.536 -2.299 1.00 . A A . 6 THR HG21 1 1 26 15625 1 1 6 THR HG22 H -4.852 12.130 -1.993 1.00 . A A . 6 THR HG22 1 1 26 15626 1 1 6 THR HG23 H -4.332 11.199 -3.398 1.00 . A A . 6 THR HG23 1 1 26 15627 1 1 6 THR N N -4.691 8.897 -0.081 1.00 . A A . 6 THR N 1 1 26 15628 1 1 6 THR O O -1.801 8.580 0.019 1.00 . A A . 6 THR O 1 1 26 15629 1 1 6 THR OG1 O -3.424 11.253 -0.345 1.00 . A A . 6 THR OG1 1 1 26 15630 1 1 7 GLY C C -0.777 5.496 -2.682 1.00 . A A . 7 GLY C 1 1 26 15631 1 1 7 GLY CA C -0.871 6.676 -1.732 1.00 . A A . 7 GLY CA 1 1 26 15632 1 1 7 GLY H H -2.693 7.242 -2.650 1.00 . A A . 7 GLY H 1 1 26 15633 1 1 7 GLY HA2 H -0.798 6.314 -0.717 1.00 . A A . 7 GLY HA2 1 1 26 15634 1 1 7 GLY HA3 H -0.045 7.345 -1.924 1.00 . A A . 7 GLY HA3 1 1 26 15635 1 1 7 GLY N N -2.113 7.411 -1.878 1.00 . A A . 7 GLY N 1 1 26 15636 1 1 7 GLY O O -1.512 5.430 -3.667 1.00 . A A . 7 GLY O 1 1 26 15637 1 1 8 PRO C C -0.751 2.296 -3.024 1.00 . A A . 8 PRO C 1 1 26 15638 1 1 8 PRO CA C 0.315 3.362 -3.259 1.00 . A A . 8 PRO CA 1 1 26 15639 1 1 8 PRO CB C 1.687 2.846 -2.831 1.00 . A A . 8 PRO CB 1 1 26 15640 1 1 8 PRO CD C 1.055 4.544 -1.260 1.00 . A A . 8 PRO CD 1 1 26 15641 1 1 8 PRO CG C 1.805 3.244 -1.400 1.00 . A A . 8 PRO CG 1 1 26 15642 1 1 8 PRO HA H 0.337 3.625 -4.306 1.00 . A A . 8 PRO HA 1 1 26 15643 1 1 8 PRO HB2 H 1.724 1.772 -2.949 1.00 . A A . 8 PRO HB2 1 1 26 15644 1 1 8 PRO HB3 H 2.454 3.308 -3.434 1.00 . A A . 8 PRO HB3 1 1 26 15645 1 1 8 PRO HD2 H 0.509 4.565 -0.329 1.00 . A A . 8 PRO HD2 1 1 26 15646 1 1 8 PRO HD3 H 1.738 5.379 -1.317 1.00 . A A . 8 PRO HD3 1 1 26 15647 1 1 8 PRO HG2 H 1.360 2.486 -0.772 1.00 . A A . 8 PRO HG2 1 1 26 15648 1 1 8 PRO HG3 H 2.845 3.382 -1.143 1.00 . A A . 8 PRO HG3 1 1 26 15649 1 1 8 PRO N N 0.131 4.542 -2.412 1.00 . A A . 8 PRO N 1 1 26 15650 1 1 8 PRO O O -1.251 1.687 -3.970 1.00 . A A . 8 PRO O 1 1 26 15651 1 1 9 CYS C C -3.505 1.655 -1.473 1.00 . A A . 9 CYS C 1 1 26 15652 1 1 9 CYS CA C -2.096 1.071 -1.404 1.00 . A A . 9 CYS CA 1 1 26 15653 1 1 9 CYS CB C -1.822 0.522 -0.003 1.00 . A A . 9 CYS CB 1 1 26 15654 1 1 9 CYS H H -0.657 2.584 -1.048 1.00 . A A . 9 CYS H 1 1 26 15655 1 1 9 CYS HA H -2.021 0.263 -2.116 1.00 . A A . 9 CYS HA 1 1 26 15656 1 1 9 CYS HB2 H -1.391 1.304 0.604 1.00 . A A . 9 CYS HB2 1 1 26 15657 1 1 9 CYS HB3 H -2.755 0.205 0.439 1.00 . A A . 9 CYS HB3 1 1 26 15658 1 1 9 CYS N N -1.092 2.070 -1.759 1.00 . A A . 9 CYS N 1 1 26 15659 1 1 9 CYS O O -4.265 1.589 -0.507 1.00 . A A . 9 CYS O 1 1 26 15660 1 1 9 CYS SG S -0.680 -0.897 0.031 1.00 . A A . 9 CYS SG 1 1 26 15661 1 1 10 CYS C C -5.284 3.397 -4.233 1.00 . A A . 10 CYS C 1 1 26 15662 1 1 10 CYS CA C -5.168 2.812 -2.830 1.00 . A A . 10 CYS CA 1 1 26 15663 1 1 10 CYS CB C -5.443 3.895 -1.782 1.00 . A A . 10 CYS CB 1 1 26 15664 1 1 10 CYS H H -3.203 2.236 -3.359 1.00 . A A . 10 CYS H 1 1 26 15665 1 1 10 CYS HA H -5.901 2.028 -2.723 1.00 . A A . 10 CYS HA 1 1 26 15666 1 1 10 CYS HB2 H -6.400 4.350 -1.990 1.00 . A A . 10 CYS HB2 1 1 26 15667 1 1 10 CYS HB3 H -5.476 3.437 -0.804 1.00 . A A . 10 CYS HB3 1 1 26 15668 1 1 10 CYS N N -3.850 2.221 -2.625 1.00 . A A . 10 CYS N 1 1 26 15669 1 1 10 CYS O O -4.422 4.157 -4.674 1.00 . A A . 10 CYS O 1 1 26 15670 1 1 10 CYS SG S -4.199 5.225 -1.731 1.00 . A A . 10 CYS SG 1 1 26 15671 1 1 11 ARG C C -6.572 5.036 -6.340 1.00 . A A . 11 ARG C 1 1 26 15672 1 1 11 ARG CA C -6.585 3.514 -6.291 1.00 . A A . 11 ARG CA 1 1 26 15673 1 1 11 ARG CB C -7.919 2.986 -6.822 1.00 . A A . 11 ARG CB 1 1 26 15674 1 1 11 ARG CD C -7.104 1.601 -8.753 1.00 . A A . 11 ARG CD 1 1 26 15675 1 1 11 ARG CG C -7.942 2.797 -8.330 1.00 . A A . 11 ARG CG 1 1 26 15676 1 1 11 ARG CZ C -4.903 1.166 -9.774 1.00 . A A . 11 ARG CZ 1 1 26 15677 1 1 11 ARG H H -7.005 2.420 -4.527 1.00 . A A . 11 ARG H 1 1 26 15678 1 1 11 ARG HA H -5.790 3.142 -6.913 1.00 . A A . 11 ARG HA 1 1 26 15679 1 1 11 ARG HB2 H -8.127 2.033 -6.358 1.00 . A A . 11 ARG HB2 1 1 26 15680 1 1 11 ARG HB3 H -8.700 3.683 -6.556 1.00 . A A . 11 ARG HB3 1 1 26 15681 1 1 11 ARG HD2 H -7.004 0.931 -7.912 1.00 . A A . 11 ARG HD2 1 1 26 15682 1 1 11 ARG HD3 H -7.609 1.091 -9.560 1.00 . A A . 11 ARG HD3 1 1 26 15683 1 1 11 ARG HE H -5.510 2.933 -9.073 1.00 . A A . 11 ARG HE 1 1 26 15684 1 1 11 ARG HG2 H -8.961 2.639 -8.648 1.00 . A A . 11 ARG HG2 1 1 26 15685 1 1 11 ARG HG3 H -7.549 3.686 -8.800 1.00 . A A . 11 ARG HG3 1 1 26 15686 1 1 11 ARG HH11 H -6.119 -0.448 -9.683 1.00 . A A . 11 ARG HH11 1 1 26 15687 1 1 11 ARG HH12 H -4.566 -0.728 -10.396 1.00 . A A . 11 ARG HH12 1 1 26 15688 1 1 11 ARG HH21 H -3.467 2.568 -10.011 1.00 . A A . 11 ARG HH21 1 1 26 15689 1 1 11 ARG HH22 H -3.060 0.984 -10.583 1.00 . A A . 11 ARG HH22 1 1 26 15690 1 1 11 ARG N N -6.355 3.031 -4.933 1.00 . A A . 11 ARG N 1 1 26 15691 1 1 11 ARG NE N -5.772 1.998 -9.203 1.00 . A A . 11 ARG NE 1 1 26 15692 1 1 11 ARG NH1 N -5.223 -0.108 -9.967 1.00 . A A . 11 ARG NH1 1 1 26 15693 1 1 11 ARG NH2 N -3.713 1.609 -10.154 1.00 . A A . 11 ARG NH2 1 1 26 15694 1 1 11 ARG O O -6.007 5.634 -7.256 1.00 . A A . 11 ARG O 1 1 26 15695 1 1 12 GLN C C -8.337 7.516 -4.241 1.00 . A A . 12 GLN C 1 1 26 15696 1 1 12 GLN CA C -7.278 7.106 -5.256 1.00 . A A . 12 GLN CA 1 1 26 15697 1 1 12 GLN CB C -7.603 7.722 -6.622 1.00 . A A . 12 GLN CB 1 1 26 15698 1 1 12 GLN CD C -6.439 8.187 -8.815 1.00 . A A . 12 GLN CD 1 1 26 15699 1 1 12 GLN CG C -6.399 8.347 -7.308 1.00 . A A . 12 GLN CG 1 1 26 15700 1 1 12 GLN H H -7.629 5.110 -4.651 1.00 . A A . 12 GLN H 1 1 26 15701 1 1 12 GLN HA H -6.317 7.469 -4.924 1.00 . A A . 12 GLN HA 1 1 26 15702 1 1 12 GLN HB2 H -7.997 6.951 -7.267 1.00 . A A . 12 GLN HB2 1 1 26 15703 1 1 12 GLN HB3 H -8.353 8.489 -6.492 1.00 . A A . 12 GLN HB3 1 1 26 15704 1 1 12 GLN HE21 H -5.049 9.594 -9.026 1.00 . A A . 12 GLN HE21 1 1 26 15705 1 1 12 GLN HE22 H -5.628 8.885 -10.491 1.00 . A A . 12 GLN HE22 1 1 26 15706 1 1 12 GLN HG2 H -6.374 9.401 -7.074 1.00 . A A . 12 GLN HG2 1 1 26 15707 1 1 12 GLN HG3 H -5.502 7.875 -6.934 1.00 . A A . 12 GLN HG3 1 1 26 15708 1 1 12 GLN N N -7.202 5.651 -5.347 1.00 . A A . 12 GLN N 1 1 26 15709 1 1 12 GLN NE2 N -5.623 8.968 -9.515 1.00 . A A . 12 GLN NE2 1 1 26 15710 1 1 12 GLN O O -8.236 8.569 -3.612 1.00 . A A . 12 GLN O 1 1 26 15711 1 1 12 GLN OE1 O -7.193 7.372 -9.345 1.00 . A A . 12 GLN OE1 1 1 26 15712 1 1 13 CYS C C -10.858 5.693 -2.389 1.00 . A A . 13 CYS C 1 1 26 15713 1 1 13 CYS CA C -10.438 6.950 -3.152 1.00 . A A . 13 CYS CA 1 1 26 15714 1 1 13 CYS CB C -11.642 7.534 -3.893 1.00 . A A . 13 CYS CB 1 1 26 15715 1 1 13 CYS H H -9.381 5.851 -4.623 1.00 . A A . 13 CYS H 1 1 26 15716 1 1 13 CYS HA H -10.080 7.680 -2.443 1.00 . A A . 13 CYS HA 1 1 26 15717 1 1 13 CYS HB2 H -11.645 7.164 -4.907 1.00 . A A . 13 CYS HB2 1 1 26 15718 1 1 13 CYS HB3 H -12.548 7.220 -3.397 1.00 . A A . 13 CYS HB3 1 1 26 15719 1 1 13 CYS N N -9.356 6.674 -4.089 1.00 . A A . 13 CYS N 1 1 26 15720 1 1 13 CYS O O -11.882 5.692 -1.706 1.00 . A A . 13 CYS O 1 1 26 15721 1 1 13 CYS SG S -11.654 9.355 -3.970 1.00 . A A . 13 CYS SG 1 1 26 15722 1 1 14 LYS C C -9.137 2.513 -1.683 1.00 . A A . 14 LYS C 1 1 26 15723 1 1 14 LYS CA C -10.381 3.380 -1.813 1.00 . A A . 14 LYS CA 1 1 26 15724 1 1 14 LYS CB C -11.475 2.617 -2.562 1.00 . A A . 14 LYS CB 1 1 26 15725 1 1 14 LYS CD C -13.883 1.915 -2.411 1.00 . A A . 14 LYS CD 1 1 26 15726 1 1 14 LYS CE C -14.101 1.088 -1.154 1.00 . A A . 14 LYS CE 1 1 26 15727 1 1 14 LYS CG C -12.883 3.035 -2.173 1.00 . A A . 14 LYS CG 1 1 26 15728 1 1 14 LYS H H -9.262 4.672 -3.057 1.00 . A A . 14 LYS H 1 1 26 15729 1 1 14 LYS HA H -10.738 3.628 -0.825 1.00 . A A . 14 LYS HA 1 1 26 15730 1 1 14 LYS HB2 H -11.352 2.783 -3.622 1.00 . A A . 14 LYS HB2 1 1 26 15731 1 1 14 LYS HB3 H -11.366 1.562 -2.357 1.00 . A A . 14 LYS HB3 1 1 26 15732 1 1 14 LYS HD2 H -14.825 2.344 -2.714 1.00 . A A . 14 LYS HD2 1 1 26 15733 1 1 14 LYS HD3 H -13.508 1.272 -3.194 1.00 . A A . 14 LYS HD3 1 1 26 15734 1 1 14 LYS HE2 H -14.360 1.751 -0.342 1.00 . A A . 14 LYS HE2 1 1 26 15735 1 1 14 LYS HE3 H -14.914 0.399 -1.329 1.00 . A A . 14 LYS HE3 1 1 26 15736 1 1 14 LYS HG2 H -12.895 3.298 -1.126 1.00 . A A . 14 LYS HG2 1 1 26 15737 1 1 14 LYS HG3 H -13.170 3.893 -2.765 1.00 . A A . 14 LYS HG3 1 1 26 15738 1 1 14 LYS HZ1 H -12.428 -0.069 -1.630 1.00 . A A . 14 LYS HZ1 1 1 26 15739 1 1 14 LYS HZ2 H -12.208 0.933 -0.285 1.00 . A A . 14 LYS HZ2 1 1 26 15740 1 1 14 LYS HZ3 H -13.140 -0.472 -0.150 1.00 . A A . 14 LYS HZ3 1 1 26 15741 1 1 14 LYS N N -10.070 4.625 -2.502 1.00 . A A . 14 LYS N 1 1 26 15742 1 1 14 LYS NZ N -12.884 0.316 -0.779 1.00 . A A . 14 LYS NZ 1 1 26 15743 1 1 14 LYS O O -8.391 2.334 -2.646 1.00 . A A . 14 LYS O 1 1 26 15744 1 1 15 LEU C C -7.623 0.064 -1.330 1.00 . A A . 15 LEU C 1 1 26 15745 1 1 15 LEU CA C -7.759 1.121 -0.237 1.00 . A A . 15 LEU CA 1 1 26 15746 1 1 15 LEU CB C -7.876 0.453 1.137 1.00 . A A . 15 LEU CB 1 1 26 15747 1 1 15 LEU CD1 C -8.048 -2.022 0.776 1.00 . A A . 15 LEU CD1 1 1 26 15748 1 1 15 LEU CD2 C -9.379 -0.928 2.592 1.00 . A A . 15 LEU CD2 1 1 26 15749 1 1 15 LEU CG C -8.799 -0.767 1.195 1.00 . A A . 15 LEU CG 1 1 26 15750 1 1 15 LEU H H -9.547 2.150 0.242 1.00 . A A . 15 LEU H 1 1 26 15751 1 1 15 LEU HA H -6.880 1.747 -0.249 1.00 . A A . 15 LEU HA 1 1 26 15752 1 1 15 LEU HB2 H -6.889 0.145 1.448 1.00 . A A . 15 LEU HB2 1 1 26 15753 1 1 15 LEU HB3 H -8.243 1.186 1.839 1.00 . A A . 15 LEU HB3 1 1 26 15754 1 1 15 LEU HD11 H -6.984 -1.836 0.819 1.00 . A A . 15 LEU HD11 1 1 26 15755 1 1 15 LEU HD12 H -8.299 -2.832 1.444 1.00 . A A . 15 LEU HD12 1 1 26 15756 1 1 15 LEU HD13 H -8.326 -2.288 -0.233 1.00 . A A . 15 LEU HD13 1 1 26 15757 1 1 15 LEU HD21 H -9.358 0.023 3.103 1.00 . A A . 15 LEU HD21 1 1 26 15758 1 1 15 LEU HD22 H -10.400 -1.275 2.520 1.00 . A A . 15 LEU HD22 1 1 26 15759 1 1 15 LEU HD23 H -8.793 -1.647 3.144 1.00 . A A . 15 LEU HD23 1 1 26 15760 1 1 15 LEU HG H -9.618 -0.623 0.505 1.00 . A A . 15 LEU HG 1 1 26 15761 1 1 15 LEU N N -8.916 1.973 -0.488 1.00 . A A . 15 LEU N 1 1 26 15762 1 1 15 LEU O O -8.593 -0.609 -1.679 1.00 . A A . 15 LEU O 1 1 26 15763 1 1 16 LYS C C -6.342 -2.464 -2.408 1.00 . A A . 16 LYS C 1 1 26 15764 1 1 16 LYS CA C -6.170 -1.039 -2.930 1.00 . A A . 16 LYS CA 1 1 26 15765 1 1 16 LYS CB C -4.763 -0.856 -3.501 1.00 . A A . 16 LYS CB 1 1 26 15766 1 1 16 LYS CD C -3.602 -0.458 -5.694 1.00 . A A . 16 LYS CD 1 1 26 15767 1 1 16 LYS CE C -3.435 0.501 -6.862 1.00 . A A . 16 LYS CE 1 1 26 15768 1 1 16 LYS CG C -4.726 -0.018 -4.769 1.00 . A A . 16 LYS CG 1 1 26 15769 1 1 16 LYS H H -5.686 0.497 -1.558 1.00 . A A . 16 LYS H 1 1 26 15770 1 1 16 LYS HA H -6.894 -0.861 -3.713 1.00 . A A . 16 LYS HA 1 1 26 15771 1 1 16 LYS HB2 H -4.145 -0.373 -2.759 1.00 . A A . 16 LYS HB2 1 1 26 15772 1 1 16 LYS HB3 H -4.347 -1.827 -3.726 1.00 . A A . 16 LYS HB3 1 1 26 15773 1 1 16 LYS HD2 H -2.680 -0.491 -5.134 1.00 . A A . 16 LYS HD2 1 1 26 15774 1 1 16 LYS HD3 H -3.829 -1.442 -6.077 1.00 . A A . 16 LYS HD3 1 1 26 15775 1 1 16 LYS HE2 H -2.648 0.133 -7.503 1.00 . A A . 16 LYS HE2 1 1 26 15776 1 1 16 LYS HE3 H -4.362 0.538 -7.416 1.00 . A A . 16 LYS HE3 1 1 26 15777 1 1 16 LYS HG2 H -5.667 -0.125 -5.287 1.00 . A A . 16 LYS HG2 1 1 26 15778 1 1 16 LYS HG3 H -4.575 1.017 -4.501 1.00 . A A . 16 LYS HG3 1 1 26 15779 1 1 16 LYS HZ1 H -2.494 1.829 -5.553 1.00 . A A . 16 LYS HZ1 1 1 26 15780 1 1 16 LYS HZ2 H -2.563 2.377 -7.153 1.00 . A A . 16 LYS HZ2 1 1 26 15781 1 1 16 LYS HZ3 H -3.951 2.410 -6.187 1.00 . A A . 16 LYS HZ3 1 1 26 15782 1 1 16 LYS N N -6.420 -0.070 -1.873 1.00 . A A . 16 LYS N 1 1 26 15783 1 1 16 LYS NZ N -3.086 1.875 -6.407 1.00 . A A . 16 LYS NZ 1 1 26 15784 1 1 16 LYS O O -6.292 -2.701 -1.202 1.00 . A A . 16 LYS O 1 1 26 15785 1 1 17 PRO C C -5.470 -5.425 -2.283 1.00 . A A . 17 PRO C 1 1 26 15786 1 1 17 PRO CA C -6.720 -4.842 -2.934 1.00 . A A . 17 PRO CA 1 1 26 15787 1 1 17 PRO CB C -7.008 -5.545 -4.265 1.00 . A A . 17 PRO CB 1 1 26 15788 1 1 17 PRO CD C -6.614 -3.245 -4.772 1.00 . A A . 17 PRO CD 1 1 26 15789 1 1 17 PRO CG C -6.450 -4.639 -5.307 1.00 . A A . 17 PRO CG 1 1 26 15790 1 1 17 PRO HA H -7.561 -4.968 -2.267 1.00 . A A . 17 PRO HA 1 1 26 15791 1 1 17 PRO HB2 H -6.522 -6.509 -4.277 1.00 . A A . 17 PRO HB2 1 1 26 15792 1 1 17 PRO HB3 H -8.074 -5.672 -4.384 1.00 . A A . 17 PRO HB3 1 1 26 15793 1 1 17 PRO HD2 H -5.811 -2.610 -5.118 1.00 . A A . 17 PRO HD2 1 1 26 15794 1 1 17 PRO HD3 H -7.571 -2.838 -5.063 1.00 . A A . 17 PRO HD3 1 1 26 15795 1 1 17 PRO HG2 H -5.404 -4.860 -5.464 1.00 . A A . 17 PRO HG2 1 1 26 15796 1 1 17 PRO HG3 H -7.001 -4.754 -6.228 1.00 . A A . 17 PRO HG3 1 1 26 15797 1 1 17 PRO N N -6.544 -3.436 -3.313 1.00 . A A . 17 PRO N 1 1 26 15798 1 1 17 PRO O O -4.353 -5.187 -2.741 1.00 . A A . 17 PRO O 1 1 26 15799 1 1 18 ALA C C -3.622 -7.545 -1.454 1.00 . A A . 18 ALA C 1 1 26 15800 1 1 18 ALA CA C -4.554 -6.808 -0.496 1.00 . A A . 18 ALA CA 1 1 26 15801 1 1 18 ALA CB C -5.078 -7.763 0.567 1.00 . A A . 18 ALA CB 1 1 26 15802 1 1 18 ALA H H -6.581 -6.342 -0.895 1.00 . A A . 18 ALA H 1 1 26 15803 1 1 18 ALA HA H -3.999 -6.024 0.001 1.00 . A A . 18 ALA HA 1 1 26 15804 1 1 18 ALA HB1 H -6.071 -7.460 0.864 1.00 . A A . 18 ALA HB1 1 1 26 15805 1 1 18 ALA HB2 H -5.113 -8.765 0.165 1.00 . A A . 18 ALA HB2 1 1 26 15806 1 1 18 ALA HB3 H -4.423 -7.741 1.425 1.00 . A A . 18 ALA HB3 1 1 26 15807 1 1 18 ALA N N -5.666 -6.190 -1.212 1.00 . A A . 18 ALA N 1 1 26 15808 1 1 18 ALA O O -4.023 -7.928 -2.553 1.00 . A A . 18 ALA O 1 1 26 15809 1 1 19 GLY C C -0.534 -7.474 -2.655 1.00 . A A . 19 GLY C 1 1 26 15810 1 1 19 GLY CA C -1.411 -8.428 -1.866 1.00 . A A . 19 GLY CA 1 1 26 15811 1 1 19 GLY H H -2.113 -7.411 -0.146 1.00 . A A . 19 GLY H 1 1 26 15812 1 1 19 GLY HA2 H -1.941 -9.067 -2.557 1.00 . A A . 19 GLY HA2 1 1 26 15813 1 1 19 GLY HA3 H -0.782 -9.040 -1.237 1.00 . A A . 19 GLY HA3 1 1 26 15814 1 1 19 GLY N N -2.377 -7.739 -1.031 1.00 . A A . 19 GLY N 1 1 26 15815 1 1 19 GLY O O 0.514 -7.867 -3.168 1.00 . A A . 19 GLY O 1 1 26 15816 1 1 20 THR C C 1.212 -5.083 -2.933 1.00 . A A . 20 THR C 1 1 26 15817 1 1 20 THR CA C -0.202 -5.208 -3.487 1.00 . A A . 20 THR CA 1 1 26 15818 1 1 20 THR CB C -0.913 -3.852 -3.419 1.00 . A A . 20 THR CB 1 1 26 15819 1 1 20 THR CG2 C -1.116 -3.216 -4.777 1.00 . A A . 20 THR CG2 1 1 26 15820 1 1 20 THR H H -1.802 -5.962 -2.324 1.00 . A A . 20 THR H 1 1 26 15821 1 1 20 THR HA H -0.143 -5.520 -4.518 1.00 . A A . 20 THR HA 1 1 26 15822 1 1 20 THR HB H -0.319 -3.174 -2.822 1.00 . A A . 20 THR HB 1 1 26 15823 1 1 20 THR HG1 H -2.754 -4.518 -3.367 1.00 . A A . 20 THR HG1 1 1 26 15824 1 1 20 THR HG21 H -1.355 -3.981 -5.501 1.00 . A A . 20 THR HG21 1 1 26 15825 1 1 20 THR HG22 H -1.927 -2.504 -4.724 1.00 . A A . 20 THR HG22 1 1 26 15826 1 1 20 THR HG23 H -0.211 -2.708 -5.076 1.00 . A A . 20 THR HG23 1 1 26 15827 1 1 20 THR N N -0.960 -6.217 -2.754 1.00 . A A . 20 THR N 1 1 26 15828 1 1 20 THR O O 1.558 -5.714 -1.935 1.00 . A A . 20 THR O 1 1 26 15829 1 1 20 THR OG1 O -2.186 -3.980 -2.811 1.00 . A A . 20 THR OG1 1 1 26 15830 1 1 21 THR C C 3.701 -2.571 -2.988 1.00 . A A . 21 THR C 1 1 26 15831 1 1 21 THR CA C 3.404 -4.058 -3.164 1.00 . A A . 21 THR CA 1 1 26 15832 1 1 21 THR CB C 4.375 -4.671 -4.178 1.00 . A A . 21 THR CB 1 1 26 15833 1 1 21 THR CG2 C 5.274 -5.729 -3.577 1.00 . A A . 21 THR CG2 1 1 26 15834 1 1 21 THR H H 1.691 -3.792 -4.380 1.00 . A A . 21 THR H 1 1 26 15835 1 1 21 THR HA H 3.533 -4.552 -2.212 1.00 . A A . 21 THR HA 1 1 26 15836 1 1 21 THR HB H 5.006 -3.890 -4.577 1.00 . A A . 21 THR HB 1 1 26 15837 1 1 21 THR HG1 H 3.094 -4.616 -5.658 1.00 . A A . 21 THR HG1 1 1 26 15838 1 1 21 THR HG21 H 4.672 -6.461 -3.058 1.00 . A A . 21 THR HG21 1 1 26 15839 1 1 21 THR HG22 H 5.834 -6.215 -4.362 1.00 . A A . 21 THR HG22 1 1 26 15840 1 1 21 THR HG23 H 5.958 -5.267 -2.880 1.00 . A A . 21 THR HG23 1 1 26 15841 1 1 21 THR N N 2.025 -4.266 -3.589 1.00 . A A . 21 THR N 1 1 26 15842 1 1 21 THR O O 3.372 -1.756 -3.850 1.00 . A A . 21 THR O 1 1 26 15843 1 1 21 THR OG1 O 3.671 -5.267 -5.253 1.00 . A A . 21 THR OG1 1 1 26 15844 1 1 22 CYS C C 6.102 -0.535 -1.982 1.00 . A A . 22 CYS C 1 1 26 15845 1 1 22 CYS CA C 4.664 -0.839 -1.575 1.00 . A A . 22 CYS CA 1 1 26 15846 1 1 22 CYS CB C 4.470 -0.544 -0.087 1.00 . A A . 22 CYS CB 1 1 26 15847 1 1 22 CYS H H 4.559 -2.922 -1.216 1.00 . A A . 22 CYS H 1 1 26 15848 1 1 22 CYS HA H 4.000 -0.208 -2.147 1.00 . A A . 22 CYS HA 1 1 26 15849 1 1 22 CYS HB2 H 3.625 -1.109 0.277 1.00 . A A . 22 CYS HB2 1 1 26 15850 1 1 22 CYS HB3 H 5.357 -0.847 0.451 1.00 . A A . 22 CYS HB3 1 1 26 15851 1 1 22 CYS N N 4.323 -2.226 -1.865 1.00 . A A . 22 CYS N 1 1 26 15852 1 1 22 CYS O O 6.423 0.586 -2.377 1.00 . A A . 22 CYS O 1 1 26 15853 1 1 22 CYS SG S 4.164 1.212 0.291 1.00 . A A . 22 CYS SG 1 1 26 15854 1 1 23 TRP C C 9.054 -2.739 -2.372 1.00 . A A . 23 TRP C 1 1 26 15855 1 1 23 TRP CA C 8.369 -1.382 -2.242 1.00 . A A . 23 TRP CA 1 1 26 15856 1 1 23 TRP CB C 9.091 -0.531 -1.196 1.00 . A A . 23 TRP CB 1 1 26 15857 1 1 23 TRP CD1 C 10.774 0.415 -2.880 1.00 . A A . 23 TRP CD1 1 1 26 15858 1 1 23 TRP CD2 C 11.636 -0.010 -0.858 1.00 . A A . 23 TRP CD2 1 1 26 15859 1 1 23 TRP CE2 C 12.656 0.501 -1.683 1.00 . A A . 23 TRP CE2 1 1 26 15860 1 1 23 TRP CE3 C 11.944 -0.350 0.462 1.00 . A A . 23 TRP CE3 1 1 26 15861 1 1 23 TRP CG C 10.439 -0.057 -1.643 1.00 . A A . 23 TRP CG 1 1 26 15862 1 1 23 TRP CH2 C 14.234 0.340 0.068 1.00 . A A . 23 TRP CH2 1 1 26 15863 1 1 23 TRP CZ2 C 13.961 0.680 -1.229 1.00 . A A . 23 TRP CZ2 1 1 26 15864 1 1 23 TRP CZ3 C 13.239 -0.172 0.911 1.00 . A A . 23 TRP CZ3 1 1 26 15865 1 1 23 TRP H H 6.649 -2.412 -1.563 1.00 . A A . 23 TRP H 1 1 26 15866 1 1 23 TRP HA H 8.413 -0.878 -3.196 1.00 . A A . 23 TRP HA 1 1 26 15867 1 1 23 TRP HB2 H 8.490 0.338 -0.972 1.00 . A A . 23 TRP HB2 1 1 26 15868 1 1 23 TRP HB3 H 9.222 -1.114 -0.296 1.00 . A A . 23 TRP HB3 1 1 26 15869 1 1 23 TRP HD1 H 10.082 0.504 -3.705 1.00 . A A . 23 TRP HD1 1 1 26 15870 1 1 23 TRP HE1 H 12.582 1.115 -3.687 1.00 . A A . 23 TRP HE1 1 1 26 15871 1 1 23 TRP HE3 H 11.191 -0.745 1.128 1.00 . A A . 23 TRP HE3 1 1 26 15872 1 1 23 TRP HH2 H 15.232 0.462 0.461 1.00 . A A . 23 TRP HH2 1 1 26 15873 1 1 23 TRP HZ2 H 14.739 1.074 -1.867 1.00 . A A . 23 TRP HZ2 1 1 26 15874 1 1 23 TRP HZ3 H 13.496 -0.429 1.928 1.00 . A A . 23 TRP HZ3 1 1 26 15875 1 1 23 TRP N N 6.964 -1.541 -1.884 1.00 . A A . 23 TRP N 1 1 26 15876 1 1 23 TRP NE1 N 12.105 0.753 -2.912 1.00 . A A . 23 TRP NE1 1 1 26 15877 1 1 23 TRP O O 9.702 -3.210 -1.437 1.00 . A A . 23 TRP O 1 1 26 15878 1 1 24 ARG C C 10.708 -4.538 -4.725 1.00 . A A . 24 ARG C 1 1 26 15879 1 1 24 ARG CA C 9.511 -4.665 -3.788 1.00 . A A . 24 ARG CA 1 1 26 15880 1 1 24 ARG CB C 8.479 -5.622 -4.387 1.00 . A A . 24 ARG CB 1 1 26 15881 1 1 24 ARG CD C 7.264 -6.089 -6.536 1.00 . A A . 24 ARG CD 1 1 26 15882 1 1 24 ARG CG C 7.691 -5.023 -5.540 1.00 . A A . 24 ARG CG 1 1 26 15883 1 1 24 ARG CZ C 8.215 -7.159 -8.542 1.00 . A A . 24 ARG CZ 1 1 26 15884 1 1 24 ARG H H 8.378 -2.936 -4.243 1.00 . A A . 24 ARG H 1 1 26 15885 1 1 24 ARG HA H 9.850 -5.061 -2.842 1.00 . A A . 24 ARG HA 1 1 26 15886 1 1 24 ARG HB2 H 8.989 -6.503 -4.747 1.00 . A A . 24 ARG HB2 1 1 26 15887 1 1 24 ARG HB3 H 7.782 -5.911 -3.614 1.00 . A A . 24 ARG HB3 1 1 26 15888 1 1 24 ARG HD2 H 6.889 -6.942 -5.992 1.00 . A A . 24 ARG HD2 1 1 26 15889 1 1 24 ARG HD3 H 6.479 -5.687 -7.160 1.00 . A A . 24 ARG HD3 1 1 26 15890 1 1 24 ARG HE H 9.281 -6.319 -7.080 1.00 . A A . 24 ARG HE 1 1 26 15891 1 1 24 ARG HG2 H 6.809 -4.538 -5.147 1.00 . A A . 24 ARG HG2 1 1 26 15892 1 1 24 ARG HG3 H 8.308 -4.295 -6.046 1.00 . A A . 24 ARG HG3 1 1 26 15893 1 1 24 ARG HH11 H 6.194 -7.182 -8.458 1.00 . A A . 24 ARG HH11 1 1 26 15894 1 1 24 ARG HH12 H 6.887 -7.928 -9.859 1.00 . A A . 24 ARG HH12 1 1 26 15895 1 1 24 ARG HH21 H 10.195 -7.299 -8.921 1.00 . A A . 24 ARG HH21 1 1 26 15896 1 1 24 ARG HH22 H 9.158 -7.995 -10.122 1.00 . A A . 24 ARG HH22 1 1 26 15897 1 1 24 ARG N N 8.907 -3.362 -3.536 1.00 . A A . 24 ARG N 1 1 26 15898 1 1 24 ARG NE N 8.372 -6.518 -7.386 1.00 . A A . 24 ARG NE 1 1 26 15899 1 1 24 ARG NH1 N 6.998 -7.446 -8.989 1.00 . A A . 24 ARG NH1 1 1 26 15900 1 1 24 ARG NH2 N 9.276 -7.513 -9.253 1.00 . A A . 24 ARG NH2 1 1 26 15901 1 1 24 ARG O O 10.548 -4.354 -5.931 1.00 . A A . 24 ARG O 1 1 26 15902 1 1 25 THR C C 13.951 -5.818 -4.849 1.00 . A A . 25 THR C 1 1 26 15903 1 1 25 THR CA C 13.132 -4.535 -4.946 1.00 . A A . 25 THR CA 1 1 26 15904 1 1 25 THR CB C 13.969 -3.346 -4.471 1.00 . A A . 25 THR CB 1 1 26 15905 1 1 25 THR CG2 C 14.985 -2.883 -5.492 1.00 . A A . 25 THR CG2 1 1 26 15906 1 1 25 THR H H 11.971 -4.785 -3.194 1.00 . A A . 25 THR H 1 1 26 15907 1 1 25 THR HA H 12.853 -4.378 -5.977 1.00 . A A . 25 THR HA 1 1 26 15908 1 1 25 THR HB H 14.504 -3.631 -3.577 1.00 . A A . 25 THR HB 1 1 26 15909 1 1 25 THR HG1 H 13.447 -1.827 -3.350 1.00 . A A . 25 THR HG1 1 1 26 15910 1 1 25 THR HG21 H 14.560 -2.957 -6.482 1.00 . A A . 25 THR HG21 1 1 26 15911 1 1 25 THR HG22 H 15.255 -1.857 -5.292 1.00 . A A . 25 THR HG22 1 1 26 15912 1 1 25 THR HG23 H 15.866 -3.506 -5.431 1.00 . A A . 25 THR HG23 1 1 26 15913 1 1 25 THR N N 11.908 -4.638 -4.161 1.00 . A A . 25 THR N 1 1 26 15914 1 1 25 THR O O 15.179 -5.791 -4.938 1.00 . A A . 25 THR O 1 1 26 15915 1 1 25 THR OG1 O 13.139 -2.241 -4.160 1.00 . A A . 25 THR OG1 1 1 26 15916 1 1 26 SER C C 14.915 -8.247 -3.396 1.00 . A A . 26 SER C 1 1 26 15917 1 1 26 SER CA C 13.928 -8.236 -4.559 1.00 . A A . 26 SER CA 1 1 26 15918 1 1 26 SER CB C 14.654 -8.570 -5.863 1.00 . A A . 26 SER CB 1 1 26 15919 1 1 26 SER H H 12.287 -6.899 -4.605 1.00 . A A . 26 SER H 1 1 26 15920 1 1 26 SER HA H 13.169 -8.983 -4.378 1.00 . A A . 26 SER HA 1 1 26 15921 1 1 26 SER HB2 H 15.465 -7.872 -6.010 1.00 . A A . 26 SER HB2 1 1 26 15922 1 1 26 SER HB3 H 15.050 -9.574 -5.805 1.00 . A A . 26 SER HB3 1 1 26 15923 1 1 26 SER HG H 13.725 -7.578 -7.274 1.00 . A A . 26 SER HG 1 1 26 15924 1 1 26 SER N N 13.264 -6.942 -4.667 1.00 . A A . 26 SER N 1 1 26 15925 1 1 26 SER O O 15.933 -8.938 -3.440 1.00 . A A . 26 SER O 1 1 26 15926 1 1 26 SER OG O 13.776 -8.488 -6.972 1.00 . A A . 26 SER OG 1 1 26 15927 1 1 27 VAL C C 14.677 -7.632 0.098 1.00 . A A . 27 VAL C 1 1 26 15928 1 1 27 VAL CA C 15.468 -7.399 -1.183 1.00 . A A . 27 VAL CA 1 1 26 15929 1 1 27 VAL CB C 16.176 -6.034 -1.094 1.00 . A A . 27 VAL CB 1 1 26 15930 1 1 27 VAL CG1 C 17.218 -6.043 0.014 1.00 . A A . 27 VAL CG1 1 1 26 15931 1 1 27 VAL CG2 C 16.811 -5.674 -2.429 1.00 . A A . 27 VAL CG2 1 1 26 15932 1 1 27 VAL H H 13.782 -6.949 -2.380 1.00 . A A . 27 VAL H 1 1 26 15933 1 1 27 VAL HA H 16.221 -8.166 -1.271 1.00 . A A . 27 VAL HA 1 1 26 15934 1 1 27 VAL HB H 15.437 -5.283 -0.857 1.00 . A A . 27 VAL HB 1 1 26 15935 1 1 27 VAL HG11 H 16.863 -6.646 0.837 1.00 . A A . 27 VAL HG11 1 1 26 15936 1 1 27 VAL HG12 H 18.142 -6.456 -0.363 1.00 . A A . 27 VAL HG12 1 1 26 15937 1 1 27 VAL HG13 H 17.388 -5.032 0.356 1.00 . A A . 27 VAL HG13 1 1 26 15938 1 1 27 VAL HG21 H 17.051 -6.578 -2.969 1.00 . A A . 27 VAL HG21 1 1 26 15939 1 1 27 VAL HG22 H 16.118 -5.082 -3.009 1.00 . A A . 27 VAL HG22 1 1 26 15940 1 1 27 VAL HG23 H 17.713 -5.106 -2.257 1.00 . A A . 27 VAL HG23 1 1 26 15941 1 1 27 VAL N N 14.607 -7.477 -2.357 1.00 . A A . 27 VAL N 1 1 26 15942 1 1 27 VAL O O 15.110 -8.368 0.984 1.00 . A A . 27 VAL O 1 1 26 15943 1 1 28 SER C C 11.346 -7.824 1.000 1.00 . A A . 28 SER C 1 1 26 15944 1 1 28 SER CA C 12.656 -7.133 1.359 1.00 . A A . 28 SER CA 1 1 26 15945 1 1 28 SER CB C 12.371 -5.759 1.969 1.00 . A A . 28 SER CB 1 1 26 15946 1 1 28 SER H H 13.227 -6.427 -0.553 1.00 . A A . 28 SER H 1 1 26 15947 1 1 28 SER HA H 13.179 -7.737 2.085 1.00 . A A . 28 SER HA 1 1 26 15948 1 1 28 SER HB2 H 11.795 -5.882 2.874 1.00 . A A . 28 SER HB2 1 1 26 15949 1 1 28 SER HB3 H 13.306 -5.270 2.200 1.00 . A A . 28 SER HB3 1 1 26 15950 1 1 28 SER HG H 12.232 -4.314 0.653 1.00 . A A . 28 SER HG 1 1 26 15951 1 1 28 SER N N 13.514 -6.999 0.187 1.00 . A A . 28 SER N 1 1 26 15952 1 1 28 SER O O 10.811 -8.610 1.782 1.00 . A A . 28 SER O 1 1 26 15953 1 1 28 SER OG O 11.640 -4.944 1.070 1.00 . A A . 28 SER OG 1 1 26 15954 1 1 29 SER C C 8.436 -7.777 0.290 1.00 . A A . 29 SER C 1 1 26 15955 1 1 29 SER CA C 9.584 -8.118 -0.654 1.00 . A A . 29 SER CA 1 1 26 15956 1 1 29 SER CB C 9.728 -9.636 -0.773 1.00 . A A . 29 SER CB 1 1 26 15957 1 1 29 SER H H 11.307 -6.893 -0.767 1.00 . A A . 29 SER H 1 1 26 15958 1 1 29 SER HA H 9.367 -7.709 -1.629 1.00 . A A . 29 SER HA 1 1 26 15959 1 1 29 SER HB2 H 10.430 -9.989 -0.031 1.00 . A A . 29 SER HB2 1 1 26 15960 1 1 29 SER HB3 H 8.767 -10.101 -0.609 1.00 . A A . 29 SER HB3 1 1 26 15961 1 1 29 SER HG H 9.725 -9.510 -2.728 1.00 . A A . 29 SER HG 1 1 26 15962 1 1 29 SER N N 10.833 -7.526 -0.189 1.00 . A A . 29 SER N 1 1 26 15963 1 1 29 SER O O 8.039 -8.593 1.122 1.00 . A A . 29 SER O 1 1 26 15964 1 1 29 SER OG O 10.201 -10.006 -2.057 1.00 . A A . 29 SER OG 1 1 26 15965 1 1 30 HIS C C 5.459 -6.412 0.336 1.00 . A A . 30 HIS C 1 1 26 15966 1 1 30 HIS CA C 6.802 -6.116 0.996 1.00 . A A . 30 HIS CA 1 1 26 15967 1 1 30 HIS CB C 6.925 -4.618 1.277 1.00 . A A . 30 HIS CB 1 1 26 15968 1 1 30 HIS CD2 C 9.244 -4.885 2.410 1.00 . A A . 30 HIS CD2 1 1 26 15969 1 1 30 HIS CE1 C 9.163 -3.129 3.721 1.00 . A A . 30 HIS CE1 1 1 26 15970 1 1 30 HIS CG C 8.055 -4.272 2.197 1.00 . A A . 30 HIS CG 1 1 26 15971 1 1 30 HIS H H 8.265 -5.960 -0.526 1.00 . A A . 30 HIS H 1 1 26 15972 1 1 30 HIS HA H 6.857 -6.654 1.930 1.00 . A A . 30 HIS HA 1 1 26 15973 1 1 30 HIS HB2 H 7.085 -4.096 0.346 1.00 . A A . 30 HIS HB2 1 1 26 15974 1 1 30 HIS HB3 H 6.009 -4.267 1.728 1.00 . A A . 30 HIS HB3 1 1 26 15975 1 1 30 HIS HD1 H 7.304 -2.529 3.113 1.00 . A A . 30 HIS HD1 1 1 26 15976 1 1 30 HIS HD2 H 9.599 -5.782 1.922 1.00 . A A . 30 HIS HD2 1 1 26 15977 1 1 30 HIS HE1 H 9.427 -2.381 4.453 1.00 . A A . 30 HIS HE1 1 1 26 15978 1 1 30 HIS HE2 H 10.835 -4.310 3.653 1.00 . A A . 30 HIS HE2 1 1 26 15979 1 1 30 HIS N N 7.905 -6.566 0.155 1.00 . A A . 30 HIS N 1 1 26 15980 1 1 30 HIS ND1 N 8.036 -3.176 3.034 1.00 . A A . 30 HIS ND1 1 1 26 15981 1 1 30 HIS NE2 N 9.913 -4.155 3.361 1.00 . A A . 30 HIS NE2 1 1 26 15982 1 1 30 HIS O O 5.391 -6.677 -0.864 1.00 . A A . 30 HIS O 1 1 26 15983 1 1 31 TYR C C 2.035 -5.685 1.259 1.00 . A A . 31 TYR C 1 1 26 15984 1 1 31 TYR CA C 3.051 -6.627 0.622 1.00 . A A . 31 TYR CA 1 1 26 15985 1 1 31 TYR CB C 2.656 -8.080 0.890 1.00 . A A . 31 TYR CB 1 1 26 15986 1 1 31 TYR CD1 C 3.168 -8.790 -1.478 1.00 . A A . 31 TYR CD1 1 1 26 15987 1 1 31 TYR CD2 C 3.806 -10.248 0.297 1.00 . A A . 31 TYR CD2 1 1 26 15988 1 1 31 TYR CE1 C 3.682 -9.681 -2.401 1.00 . A A . 31 TYR CE1 1 1 26 15989 1 1 31 TYR CE2 C 4.323 -11.144 -0.620 1.00 . A A . 31 TYR CE2 1 1 26 15990 1 1 31 TYR CG C 3.221 -9.058 -0.116 1.00 . A A . 31 TYR CG 1 1 26 15991 1 1 31 TYR CZ C 4.259 -10.855 -1.967 1.00 . A A . 31 TYR CZ 1 1 26 15992 1 1 31 TYR H H 4.512 -6.148 2.077 1.00 . A A . 31 TYR H 1 1 26 15993 1 1 31 TYR HA H 3.061 -6.457 -0.445 1.00 . A A . 31 TYR HA 1 1 26 15994 1 1 31 TYR HB2 H 3.013 -8.368 1.868 1.00 . A A . 31 TYR HB2 1 1 26 15995 1 1 31 TYR HB3 H 1.579 -8.163 0.867 1.00 . A A . 31 TYR HB3 1 1 26 15996 1 1 31 TYR HD1 H 2.715 -7.869 -1.815 1.00 . A A . 31 TYR HD1 1 1 26 15997 1 1 31 TYR HD2 H 3.855 -10.471 1.352 1.00 . A A . 31 TYR HD2 1 1 26 15998 1 1 31 TYR HE1 H 3.632 -9.454 -3.455 1.00 . A A . 31 TYR HE1 1 1 26 15999 1 1 31 TYR HE2 H 4.775 -12.064 -0.280 1.00 . A A . 31 TYR HE2 1 1 26 16000 1 1 31 TYR HH H 5.723 -11.626 -2.946 1.00 . A A . 31 TYR HH 1 1 26 16001 1 1 31 TYR N N 4.393 -6.365 1.129 1.00 . A A . 31 TYR N 1 1 26 16002 1 1 31 TYR O O 2.232 -5.209 2.378 1.00 . A A . 31 TYR O 1 1 26 16003 1 1 31 TYR OH O 4.772 -11.745 -2.882 1.00 . A A . 31 TYR OH 1 1 26 16004 1 1 32 CYS C C -1.056 -5.285 1.951 1.00 . A A . 32 CYS C 1 1 26 16005 1 1 32 CYS CA C -0.097 -4.535 1.035 1.00 . A A . 32 CYS CA 1 1 26 16006 1 1 32 CYS CB C -0.866 -3.920 -0.135 1.00 . A A . 32 CYS CB 1 1 26 16007 1 1 32 CYS H H 0.850 -5.828 -0.344 1.00 . A A . 32 CYS H 1 1 26 16008 1 1 32 CYS HA H 0.376 -3.745 1.598 1.00 . A A . 32 CYS HA 1 1 26 16009 1 1 32 CYS HB2 H -0.163 -3.587 -0.883 1.00 . A A . 32 CYS HB2 1 1 26 16010 1 1 32 CYS HB3 H -1.513 -4.670 -0.565 1.00 . A A . 32 CYS HB3 1 1 26 16011 1 1 32 CYS N N 0.950 -5.420 0.541 1.00 . A A . 32 CYS N 1 1 26 16012 1 1 32 CYS O O -1.519 -6.378 1.622 1.00 . A A . 32 CYS O 1 1 26 16013 1 1 32 CYS SG S -1.901 -2.492 0.325 1.00 . A A . 32 CYS SG 1 1 26 16014 1 1 33 THR C C -3.693 -5.322 3.539 1.00 . A A . 33 THR C 1 1 26 16015 1 1 33 THR CA C -2.259 -5.296 4.066 1.00 . A A . 33 THR CA 1 1 26 16016 1 1 33 THR CB C -2.210 -4.526 5.386 1.00 . A A . 33 THR CB 1 1 26 16017 1 1 33 THR CG2 C -2.657 -3.087 5.249 1.00 . A A . 33 THR CG2 1 1 26 16018 1 1 33 THR H H -0.951 -3.818 3.302 1.00 . A A . 33 THR H 1 1 26 16019 1 1 33 THR HA H -1.932 -6.310 4.239 1.00 . A A . 33 THR HA 1 1 26 16020 1 1 33 THR HB H -1.194 -4.524 5.753 1.00 . A A . 33 THR HB 1 1 26 16021 1 1 33 THR HG1 H -3.022 -4.625 7.166 1.00 . A A . 33 THR HG1 1 1 26 16022 1 1 33 THR HG21 H -2.987 -2.909 4.236 1.00 . A A . 33 THR HG21 1 1 26 16023 1 1 33 THR HG22 H -3.472 -2.897 5.932 1.00 . A A . 33 THR HG22 1 1 26 16024 1 1 33 THR HG23 H -1.832 -2.430 5.480 1.00 . A A . 33 THR HG23 1 1 26 16025 1 1 33 THR N N -1.352 -4.689 3.099 1.00 . A A . 33 THR N 1 1 26 16026 1 1 33 THR O O -4.558 -5.986 4.110 1.00 . A A . 33 THR O 1 1 26 16027 1 1 33 THR OG1 O -3.035 -5.144 6.358 1.00 . A A . 33 THR OG1 1 1 26 16028 1 1 34 GLY C C -6.305 -4.022 2.859 1.00 . A A . 34 GLY C 1 1 26 16029 1 1 34 GLY CA C -5.275 -4.554 1.882 1.00 . A A . 34 GLY CA 1 1 26 16030 1 1 34 GLY H H -3.217 -4.082 2.037 1.00 . A A . 34 GLY H 1 1 26 16031 1 1 34 GLY HA2 H -5.559 -5.552 1.583 1.00 . A A . 34 GLY HA2 1 1 26 16032 1 1 34 GLY HA3 H -5.261 -3.918 1.008 1.00 . A A . 34 GLY HA3 1 1 26 16033 1 1 34 GLY N N -3.942 -4.595 2.452 1.00 . A A . 34 GLY N 1 1 26 16034 1 1 34 GLY O O -7.476 -4.398 2.803 1.00 . A A . 34 GLY O 1 1 26 16035 1 1 35 ARG C C -6.795 -1.043 4.636 1.00 . A A . 35 ARG C 1 1 26 16036 1 1 35 ARG CA C -6.759 -2.564 4.757 1.00 . A A . 35 ARG CA 1 1 26 16037 1 1 35 ARG CB C -6.314 -2.964 6.165 1.00 . A A . 35 ARG CB 1 1 26 16038 1 1 35 ARG CD C -7.483 -1.586 7.912 1.00 . A A . 35 ARG CD 1 1 26 16039 1 1 35 ARG CG C -7.435 -2.924 7.191 1.00 . A A . 35 ARG CG 1 1 26 16040 1 1 35 ARG CZ C -8.841 -0.506 9.661 1.00 . A A . 35 ARG CZ 1 1 26 16041 1 1 35 ARG H H -4.923 -2.889 3.754 1.00 . A A . 35 ARG H 1 1 26 16042 1 1 35 ARG HA H -7.750 -2.949 4.580 1.00 . A A . 35 ARG HA 1 1 26 16043 1 1 35 ARG HB2 H -5.920 -3.969 6.133 1.00 . A A . 35 ARG HB2 1 1 26 16044 1 1 35 ARG HB3 H -5.535 -2.290 6.489 1.00 . A A . 35 ARG HB3 1 1 26 16045 1 1 35 ARG HD2 H -6.610 -1.500 8.541 1.00 . A A . 35 ARG HD2 1 1 26 16046 1 1 35 ARG HD3 H -7.475 -0.795 7.176 1.00 . A A . 35 ARG HD3 1 1 26 16047 1 1 35 ARG HE H -9.399 -2.103 8.603 1.00 . A A . 35 ARG HE 1 1 26 16048 1 1 35 ARG HG2 H -8.377 -3.084 6.688 1.00 . A A . 35 ARG HG2 1 1 26 16049 1 1 35 ARG HG3 H -7.274 -3.708 7.916 1.00 . A A . 35 ARG HG3 1 1 26 16050 1 1 35 ARG HH11 H -7.041 0.360 9.343 1.00 . A A . 35 ARG HH11 1 1 26 16051 1 1 35 ARG HH12 H -8.016 1.101 10.568 1.00 . A A . 35 ARG HH12 1 1 26 16052 1 1 35 ARG HH21 H -10.682 -1.130 10.213 1.00 . A A . 35 ARG HH21 1 1 26 16053 1 1 35 ARG HH22 H -10.083 0.255 11.062 1.00 . A A . 35 ARG HH22 1 1 26 16054 1 1 35 ARG N N -5.868 -3.147 3.760 1.00 . A A . 35 ARG N 1 1 26 16055 1 1 35 ARG NE N -8.679 -1.453 8.740 1.00 . A A . 35 ARG NE 1 1 26 16056 1 1 35 ARG NH1 N -7.887 0.392 9.875 1.00 . A A . 35 ARG NH1 1 1 26 16057 1 1 35 ARG NH2 N -9.960 -0.456 10.370 1.00 . A A . 35 ARG NH2 1 1 26 16058 1 1 35 ARG O O -7.846 -0.422 4.797 1.00 . A A . 35 ARG O 1 1 26 16059 1 1 36 SER C C -4.350 1.370 3.328 1.00 . A A . 36 SER C 1 1 26 16060 1 1 36 SER CA C -5.539 0.997 4.208 1.00 . A A . 36 SER CA 1 1 26 16061 1 1 36 SER CB C -5.400 1.659 5.580 1.00 . A A . 36 SER CB 1 1 26 16062 1 1 36 SER H H -4.840 -1.001 4.235 1.00 . A A . 36 SER H 1 1 26 16063 1 1 36 SER HA H -6.445 1.349 3.737 1.00 . A A . 36 SER HA 1 1 26 16064 1 1 36 SER HB2 H -4.373 1.596 5.906 1.00 . A A . 36 SER HB2 1 1 26 16065 1 1 36 SER HB3 H -5.693 2.696 5.508 1.00 . A A . 36 SER HB3 1 1 26 16066 1 1 36 SER HG H -6.181 1.500 7.370 1.00 . A A . 36 SER HG 1 1 26 16067 1 1 36 SER N N -5.641 -0.451 4.351 1.00 . A A . 36 SER N 1 1 26 16068 1 1 36 SER O O -3.425 0.578 3.150 1.00 . A A . 36 SER O 1 1 26 16069 1 1 36 SER OG O -6.222 1.018 6.541 1.00 . A A . 36 SER OG 1 1 26 16070 1 1 37 CYS C C -2.051 3.370 2.730 1.00 . A A . 37 CYS C 1 1 26 16071 1 1 37 CYS CA C -3.302 3.052 1.917 1.00 . A A . 37 CYS CA 1 1 26 16072 1 1 37 CYS CB C -3.744 4.287 1.130 1.00 . A A . 37 CYS CB 1 1 26 16073 1 1 37 CYS H H -5.144 3.169 2.956 1.00 . A A . 37 CYS H 1 1 26 16074 1 1 37 CYS HA H -3.069 2.260 1.222 1.00 . A A . 37 CYS HA 1 1 26 16075 1 1 37 CYS HB2 H -4.786 4.187 0.870 1.00 . A A . 37 CYS HB2 1 1 26 16076 1 1 37 CYS HB3 H -3.614 5.164 1.747 1.00 . A A . 37 CYS HB3 1 1 26 16077 1 1 37 CYS N N -4.380 2.581 2.778 1.00 . A A . 37 CYS N 1 1 26 16078 1 1 37 CYS O O -0.936 3.328 2.209 1.00 . A A . 37 CYS O 1 1 26 16079 1 1 37 CYS SG S -2.809 4.551 -0.413 1.00 . A A . 37 CYS SG 1 1 26 16080 1 1 38 GLU C C -0.142 2.844 4.969 1.00 . A A . 38 GLU C 1 1 26 16081 1 1 38 GLU CA C -1.122 4.011 4.886 1.00 . A A . 38 GLU CA 1 1 26 16082 1 1 38 GLU CB C -1.631 4.364 6.285 1.00 . A A . 38 GLU CB 1 1 26 16083 1 1 38 GLU CD C -0.699 6.708 6.426 1.00 . A A . 38 GLU CD 1 1 26 16084 1 1 38 GLU CG C -1.943 5.841 6.463 1.00 . A A . 38 GLU CG 1 1 26 16085 1 1 38 GLU H H -3.151 3.705 4.367 1.00 . A A . 38 GLU H 1 1 26 16086 1 1 38 GLU HA H -0.610 4.866 4.472 1.00 . A A . 38 GLU HA 1 1 26 16087 1 1 38 GLU HB2 H -2.532 3.802 6.480 1.00 . A A . 38 GLU HB2 1 1 26 16088 1 1 38 GLU HB3 H -0.880 4.087 7.010 1.00 . A A . 38 GLU HB3 1 1 26 16089 1 1 38 GLU HG2 H -2.605 6.155 5.670 1.00 . A A . 38 GLU HG2 1 1 26 16090 1 1 38 GLU HG3 H -2.433 5.980 7.416 1.00 . A A . 38 GLU HG3 1 1 26 16091 1 1 38 GLU N N -2.240 3.688 4.007 1.00 . A A . 38 GLU N 1 1 26 16092 1 1 38 GLU O O -0.257 1.985 5.843 1.00 . A A . 38 GLU O 1 1 26 16093 1 1 38 GLU OE1 O -0.218 7.102 7.509 1.00 . A A . 38 GLU OE1 1 1 26 16094 1 1 38 GLU OE2 O -0.206 6.991 5.314 1.00 . A A . 38 GLU OE2 1 1 26 16095 1 1 39 CYS C C 2.552 1.650 5.355 1.00 . A A . 39 CYS C 1 1 26 16096 1 1 39 CYS CA C 1.821 1.758 4.016 1.00 . A A . 39 CYS CA 1 1 26 16097 1 1 39 CYS CB C 2.827 2.017 2.893 1.00 . A A . 39 CYS CB 1 1 26 16098 1 1 39 CYS H H 0.857 3.533 3.380 1.00 . A A . 39 CYS H 1 1 26 16099 1 1 39 CYS HA H 1.309 0.829 3.819 1.00 . A A . 39 CYS HA 1 1 26 16100 1 1 39 CYS HB2 H 2.875 3.078 2.700 1.00 . A A . 39 CYS HB2 1 1 26 16101 1 1 39 CYS HB3 H 3.801 1.668 3.204 1.00 . A A . 39 CYS HB3 1 1 26 16102 1 1 39 CYS N N 0.820 2.820 4.051 1.00 . A A . 39 CYS N 1 1 26 16103 1 1 39 CYS O O 3.352 2.518 5.703 1.00 . A A . 39 CYS O 1 1 26 16104 1 1 39 CYS SG S 2.416 1.189 1.322 1.00 . A A . 39 CYS SG 1 1 26 16105 1 1 40 PRO C C 4.412 0.028 7.295 1.00 . A A . 40 PRO C 1 1 26 16106 1 1 40 PRO CA C 2.932 0.370 7.428 1.00 . A A . 40 PRO CA 1 1 26 16107 1 1 40 PRO CB C 2.162 -0.813 8.020 1.00 . A A . 40 PRO CB 1 1 26 16108 1 1 40 PRO CD C 1.350 -0.511 5.794 1.00 . A A . 40 PRO CD 1 1 26 16109 1 1 40 PRO CG C 1.639 -1.552 6.839 1.00 . A A . 40 PRO CG 1 1 26 16110 1 1 40 PRO HA H 2.819 1.233 8.068 1.00 . A A . 40 PRO HA 1 1 26 16111 1 1 40 PRO HB2 H 2.832 -1.425 8.606 1.00 . A A . 40 PRO HB2 1 1 26 16112 1 1 40 PRO HB3 H 1.360 -0.448 8.644 1.00 . A A . 40 PRO HB3 1 1 26 16113 1 1 40 PRO HD2 H 1.548 -0.902 4.806 1.00 . A A . 40 PRO HD2 1 1 26 16114 1 1 40 PRO HD3 H 0.328 -0.174 5.870 1.00 . A A . 40 PRO HD3 1 1 26 16115 1 1 40 PRO HG2 H 2.385 -2.247 6.480 1.00 . A A . 40 PRO HG2 1 1 26 16116 1 1 40 PRO HG3 H 0.734 -2.077 7.105 1.00 . A A . 40 PRO HG3 1 1 26 16117 1 1 40 PRO N N 2.290 0.578 6.126 1.00 . A A . 40 PRO N 1 1 26 16118 1 1 40 PRO O O 4.935 -0.092 6.187 1.00 . A A . 40 PRO O 1 1 26 16119 1 1 41 SER C C 6.716 -1.941 8.718 1.00 . A A . 41 SER C 1 1 26 16120 1 1 41 SER CA C 6.503 -0.456 8.444 1.00 . A A . 41 SER CA 1 1 26 16121 1 1 41 SER CB C 7.232 0.380 9.497 1.00 . A A . 41 SER CB 1 1 26 16122 1 1 41 SER H H 4.610 -0.019 9.284 1.00 . A A . 41 SER H 1 1 26 16123 1 1 41 SER HA H 6.905 -0.221 7.469 1.00 . A A . 41 SER HA 1 1 26 16124 1 1 41 SER HB2 H 7.207 1.421 9.209 1.00 . A A . 41 SER HB2 1 1 26 16125 1 1 41 SER HB3 H 6.742 0.259 10.452 1.00 . A A . 41 SER HB3 1 1 26 16126 1 1 41 SER HG H 8.824 -0.058 10.552 1.00 . A A . 41 SER HG 1 1 26 16127 1 1 41 SER N N 5.082 -0.127 8.432 1.00 . A A . 41 SER N 1 1 26 16128 1 1 41 SER O O 7.616 -2.323 9.465 1.00 . A A . 41 SER O 1 1 26 16129 1 1 41 SER OG O 8.585 -0.024 9.623 1.00 . A A . 41 SER OG 1 1 26 16130 1 1 42 TYR C C 6.582 -4.882 7.050 1.00 . A A . 42 TYR C 1 1 26 16131 1 1 42 TYR CA C 5.976 -4.220 8.285 1.00 . A A . 42 TYR CA 1 1 26 16132 1 1 42 TYR CB C 4.595 -4.812 8.569 1.00 . A A . 42 TYR CB 1 1 26 16133 1 1 42 TYR CD1 C 4.766 -4.766 11.088 1.00 . A A . 42 TYR CD1 1 1 26 16134 1 1 42 TYR CD2 C 2.828 -3.818 10.074 1.00 . A A . 42 TYR CD2 1 1 26 16135 1 1 42 TYR CE1 C 4.274 -4.446 12.339 1.00 . A A . 42 TYR CE1 1 1 26 16136 1 1 42 TYR CE2 C 2.329 -3.493 11.321 1.00 . A A . 42 TYR CE2 1 1 26 16137 1 1 42 TYR CG C 4.053 -4.459 9.936 1.00 . A A . 42 TYR CG 1 1 26 16138 1 1 42 TYR CZ C 3.056 -3.809 12.450 1.00 . A A . 42 TYR CZ 1 1 26 16139 1 1 42 TYR H H 5.182 -2.411 7.524 1.00 . A A . 42 TYR H 1 1 26 16140 1 1 42 TYR HA H 6.619 -4.407 9.132 1.00 . A A . 42 TYR HA 1 1 26 16141 1 1 42 TYR HB2 H 3.896 -4.447 7.831 1.00 . A A . 42 TYR HB2 1 1 26 16142 1 1 42 TYR HB3 H 4.652 -5.889 8.502 1.00 . A A . 42 TYR HB3 1 1 26 16143 1 1 42 TYR HD1 H 5.720 -5.265 10.997 1.00 . A A . 42 TYR HD1 1 1 26 16144 1 1 42 TYR HD2 H 2.261 -3.573 9.188 1.00 . A A . 42 TYR HD2 1 1 26 16145 1 1 42 TYR HE1 H 4.843 -4.693 13.222 1.00 . A A . 42 TYR HE1 1 1 26 16146 1 1 42 TYR HE2 H 1.375 -2.995 11.408 1.00 . A A . 42 TYR HE2 1 1 26 16147 1 1 42 TYR HH H 3.277 -3.167 14.248 1.00 . A A . 42 TYR HH 1 1 26 16148 1 1 42 TYR N N 5.880 -2.775 8.107 1.00 . A A . 42 TYR N 1 1 26 16149 1 1 42 TYR O O 5.862 -5.293 6.140 1.00 . A A . 42 TYR O 1 1 26 16150 1 1 42 TYR OH O 2.562 -3.488 13.694 1.00 . A A . 42 TYR OH 1 1 26 16151 1 1 43 PRO C C 8.380 -7.114 5.789 1.00 . A A . 43 PRO C 1 1 26 16152 1 1 43 PRO CA C 8.621 -5.611 5.869 1.00 . A A . 43 PRO CA 1 1 26 16153 1 1 43 PRO CB C 10.095 -5.320 6.159 1.00 . A A . 43 PRO CB 1 1 26 16154 1 1 43 PRO CD C 8.856 -4.531 8.044 1.00 . A A . 43 PRO CD 1 1 26 16155 1 1 43 PRO CG C 10.164 -5.150 7.637 1.00 . A A . 43 PRO CG 1 1 26 16156 1 1 43 PRO HA H 8.338 -5.152 4.933 1.00 . A A . 43 PRO HA 1 1 26 16157 1 1 43 PRO HB2 H 10.700 -6.151 5.827 1.00 . A A . 43 PRO HB2 1 1 26 16158 1 1 43 PRO HB3 H 10.396 -4.420 5.645 1.00 . A A . 43 PRO HB3 1 1 26 16159 1 1 43 PRO HD2 H 8.556 -4.888 9.018 1.00 . A A . 43 PRO HD2 1 1 26 16160 1 1 43 PRO HD3 H 8.931 -3.453 8.042 1.00 . A A . 43 PRO HD3 1 1 26 16161 1 1 43 PRO HG2 H 10.287 -6.112 8.112 1.00 . A A . 43 PRO HG2 1 1 26 16162 1 1 43 PRO HG3 H 10.984 -4.496 7.894 1.00 . A A . 43 PRO HG3 1 1 26 16163 1 1 43 PRO N N 7.921 -4.994 7.001 1.00 . A A . 43 PRO N 1 1 26 16164 1 1 43 PRO O O 8.783 -7.866 6.677 1.00 . A A . 43 PRO O 1 1 26 16165 1 1 44 GLY C C 6.469 -9.490 5.583 1.00 . A A . 44 GLY C 1 1 26 16166 1 1 44 GLY CA C 7.437 -8.959 4.544 1.00 . A A . 44 GLY CA 1 1 26 16167 1 1 44 GLY H H 7.423 -6.901 4.044 1.00 . A A . 44 GLY H 1 1 26 16168 1 1 44 GLY HA2 H 8.362 -9.511 4.613 1.00 . A A . 44 GLY HA2 1 1 26 16169 1 1 44 GLY HA3 H 7.012 -9.110 3.562 1.00 . A A . 44 GLY HA3 1 1 26 16170 1 1 44 GLY N N 7.720 -7.546 4.720 1.00 . A A . 44 GLY N 1 1 26 16171 1 1 44 GLY O O 5.587 -10.295 5.216 1.00 . A A . 44 GLY O 1 1 26 16172 1 1 44 GLY OXT O 6.594 -9.103 6.763 1.00 . A A . 44 GLY OXT 1 1 27 16173 1 1 1 ALA C C -13.502 14.806 3.305 1.00 . A A . 1 ALA C 1 1 27 16174 1 1 1 ALA CA C -13.943 15.362 4.654 1.00 . A A . 1 ALA CA 1 1 27 16175 1 1 1 ALA CB C -12.894 16.321 5.197 1.00 . A A . 1 ALA CB 1 1 27 16176 1 1 1 ALA H1 H -13.429 13.568 5.520 1.00 . A A . 1 ALA H1 1 1 27 16177 1 1 1 ALA H2 H -14.186 14.682 6.580 1.00 . A A . 1 ALA H2 1 1 27 16178 1 1 1 ALA H3 H -15.118 13.849 5.404 1.00 . A A . 1 ALA H3 1 1 27 16179 1 1 1 ALA HA H -14.863 15.913 4.521 1.00 . A A . 1 ALA HA 1 1 27 16180 1 1 1 ALA HB1 H -12.884 16.271 6.276 1.00 . A A . 1 ALA HB1 1 1 27 16181 1 1 1 ALA HB2 H -13.130 17.327 4.885 1.00 . A A . 1 ALA HB2 1 1 27 16182 1 1 1 ALA HB3 H -11.922 16.045 4.816 1.00 . A A . 1 ALA HB3 1 1 27 16183 1 1 1 ALA N N -14.191 14.267 5.627 1.00 . A A . 1 ALA N 1 1 27 16184 1 1 1 ALA O O -12.732 15.439 2.583 1.00 . A A . 1 ALA O 1 1 27 16185 1 1 2 MET C C -12.151 12.730 1.611 1.00 . A A . 2 MET C 1 1 27 16186 1 1 2 MET CA C -13.653 12.976 1.707 1.00 . A A . 2 MET CA 1 1 27 16187 1 1 2 MET CB C -14.117 13.838 0.531 1.00 . A A . 2 MET CB 1 1 27 16188 1 1 2 MET CE C -14.856 12.631 -3.390 1.00 . A A . 2 MET CE 1 1 27 16189 1 1 2 MET CG C -13.963 13.157 -0.820 1.00 . A A . 2 MET CG 1 1 27 16190 1 1 2 MET H H -14.606 13.163 3.588 1.00 . A A . 2 MET H 1 1 27 16191 1 1 2 MET HA H -14.165 12.026 1.669 1.00 . A A . 2 MET HA 1 1 27 16192 1 1 2 MET HB2 H -15.159 14.084 0.669 1.00 . A A . 2 MET HB2 1 1 27 16193 1 1 2 MET HB3 H -13.539 14.750 0.518 1.00 . A A . 2 MET HB3 1 1 27 16194 1 1 2 MET HE1 H -13.890 12.161 -3.278 1.00 . A A . 2 MET HE1 1 1 27 16195 1 1 2 MET HE2 H -15.629 11.877 -3.360 1.00 . A A . 2 MET HE2 1 1 27 16196 1 1 2 MET HE3 H -14.896 13.151 -4.335 1.00 . A A . 2 MET HE3 1 1 27 16197 1 1 2 MET HG2 H -12.954 13.312 -1.172 1.00 . A A . 2 MET HG2 1 1 27 16198 1 1 2 MET HG3 H -14.141 12.099 -0.697 1.00 . A A . 2 MET HG3 1 1 27 16199 1 1 2 MET N N -13.996 13.618 2.970 1.00 . A A . 2 MET N 1 1 27 16200 1 1 2 MET O O -11.428 13.489 0.966 1.00 . A A . 2 MET O 1 1 27 16201 1 1 2 MET SD S -15.109 13.798 -2.055 1.00 . A A . 2 MET SD 1 1 27 16202 1 1 3 ASP C C -9.970 10.301 1.150 1.00 . A A . 3 ASP C 1 1 27 16203 1 1 3 ASP CA C -10.272 11.319 2.245 1.00 . A A . 3 ASP CA 1 1 27 16204 1 1 3 ASP CB C -9.850 10.762 3.606 1.00 . A A . 3 ASP CB 1 1 27 16205 1 1 3 ASP CG C -10.722 9.606 4.053 1.00 . A A . 3 ASP CG 1 1 27 16206 1 1 3 ASP H H -12.315 11.098 2.754 1.00 . A A . 3 ASP H 1 1 27 16207 1 1 3 ASP HA H -9.713 12.221 2.046 1.00 . A A . 3 ASP HA 1 1 27 16208 1 1 3 ASP HB2 H -8.829 10.415 3.545 1.00 . A A . 3 ASP HB2 1 1 27 16209 1 1 3 ASP HB3 H -9.916 11.547 4.345 1.00 . A A . 3 ASP HB3 1 1 27 16210 1 1 3 ASP N N -11.689 11.665 2.257 1.00 . A A . 3 ASP N 1 1 27 16211 1 1 3 ASP O O -10.610 9.253 1.070 1.00 . A A . 3 ASP O 1 1 27 16212 1 1 3 ASP OD1 O -11.960 9.774 4.086 1.00 . A A . 3 ASP OD1 1 1 27 16213 1 1 3 ASP OD2 O -10.169 8.532 4.371 1.00 . A A . 3 ASP OD2 1 1 27 16214 1 1 4 CYS C C -7.275 9.045 -0.481 1.00 . A A . 4 CYS C 1 1 27 16215 1 1 4 CYS CA C -8.604 9.730 -0.781 1.00 . A A . 4 CYS CA 1 1 27 16216 1 1 4 CYS CB C -8.501 10.512 -2.092 1.00 . A A . 4 CYS CB 1 1 27 16217 1 1 4 CYS H H -8.517 11.467 0.424 1.00 . A A . 4 CYS H 1 1 27 16218 1 1 4 CYS HA H -9.369 8.975 -0.882 1.00 . A A . 4 CYS HA 1 1 27 16219 1 1 4 CYS HB2 H -8.332 11.555 -1.868 1.00 . A A . 4 CYS HB2 1 1 27 16220 1 1 4 CYS HB3 H -7.667 10.133 -2.665 1.00 . A A . 4 CYS HB3 1 1 27 16221 1 1 4 CYS N N -8.991 10.617 0.309 1.00 . A A . 4 CYS N 1 1 27 16222 1 1 4 CYS O O -7.055 7.898 -0.868 1.00 . A A . 4 CYS O 1 1 27 16223 1 1 4 CYS SG S -9.986 10.406 -3.142 1.00 . A A . 4 CYS SG 1 1 27 16224 1 1 5 THR C C -4.257 8.948 -0.695 1.00 . A A . 5 THR C 1 1 27 16225 1 1 5 THR CA C -5.081 9.222 0.560 1.00 . A A . 5 THR CA 1 1 27 16226 1 1 5 THR CB C -5.230 7.938 1.382 1.00 . A A . 5 THR CB 1 1 27 16227 1 1 5 THR CG2 C -4.320 7.894 2.590 1.00 . A A . 5 THR CG2 1 1 27 16228 1 1 5 THR H H -6.625 10.669 0.488 1.00 . A A . 5 THR H 1 1 27 16229 1 1 5 THR HA H -4.569 9.962 1.156 1.00 . A A . 5 THR HA 1 1 27 16230 1 1 5 THR HB H -4.989 7.090 0.756 1.00 . A A . 5 THR HB 1 1 27 16231 1 1 5 THR HG1 H -6.983 7.065 1.371 1.00 . A A . 5 THR HG1 1 1 27 16232 1 1 5 THR HG21 H -3.310 8.130 2.289 1.00 . A A . 5 THR HG21 1 1 27 16233 1 1 5 THR HG22 H -4.655 8.616 3.320 1.00 . A A . 5 THR HG22 1 1 27 16234 1 1 5 THR HG23 H -4.345 6.905 3.024 1.00 . A A . 5 THR HG23 1 1 27 16235 1 1 5 THR N N -6.391 9.759 0.210 1.00 . A A . 5 THR N 1 1 27 16236 1 1 5 THR O O -4.763 8.397 -1.673 1.00 . A A . 5 THR O 1 1 27 16237 1 1 5 THR OG1 O -6.561 7.787 1.843 1.00 . A A . 5 THR OG1 1 1 27 16238 1 1 6 THR C C -0.865 8.331 -1.389 1.00 . A A . 6 THR C 1 1 27 16239 1 1 6 THR CA C -2.096 9.133 -1.799 1.00 . A A . 6 THR CA 1 1 27 16240 1 1 6 THR CB C -1.672 10.479 -2.393 1.00 . A A . 6 THR CB 1 1 27 16241 1 1 6 THR CG2 C -1.711 10.502 -3.906 1.00 . A A . 6 THR CG2 1 1 27 16242 1 1 6 THR H H -2.640 9.772 0.145 1.00 . A A . 6 THR H 1 1 27 16243 1 1 6 THR HA H -2.639 8.576 -2.548 1.00 . A A . 6 THR HA 1 1 27 16244 1 1 6 THR HB H -0.658 10.694 -2.085 1.00 . A A . 6 THR HB 1 1 27 16245 1 1 6 THR HG1 H -2.241 11.775 -1.039 1.00 . A A . 6 THR HG1 1 1 27 16246 1 1 6 THR HG21 H -2.503 9.856 -4.255 1.00 . A A . 6 THR HG21 1 1 27 16247 1 1 6 THR HG22 H -1.894 11.511 -4.245 1.00 . A A . 6 THR HG22 1 1 27 16248 1 1 6 THR HG23 H -0.766 10.157 -4.296 1.00 . A A . 6 THR HG23 1 1 27 16249 1 1 6 THR N N -2.987 9.337 -0.662 1.00 . A A . 6 THR N 1 1 27 16250 1 1 6 THR O O -0.253 8.598 -0.355 1.00 . A A . 6 THR O 1 1 27 16251 1 1 6 THR OG1 O -2.510 11.521 -1.925 1.00 . A A . 6 THR OG1 1 1 27 16252 1 1 7 GLY C C 0.640 5.217 -2.696 1.00 . A A . 7 GLY C 1 1 27 16253 1 1 7 GLY CA C 0.646 6.517 -1.913 1.00 . A A . 7 GLY CA 1 1 27 16254 1 1 7 GLY H H -1.036 7.179 -3.016 1.00 . A A . 7 GLY H 1 1 27 16255 1 1 7 GLY HA2 H 0.652 6.290 -0.858 1.00 . A A . 7 GLY HA2 1 1 27 16256 1 1 7 GLY HA3 H 1.542 7.068 -2.158 1.00 . A A . 7 GLY HA3 1 1 27 16257 1 1 7 GLY N N -0.509 7.346 -2.207 1.00 . A A . 7 GLY N 1 1 27 16258 1 1 7 GLY O O -0.076 5.091 -3.688 1.00 . A A . 7 GLY O 1 1 27 16259 1 1 8 PRO C C 0.351 2.010 -2.600 1.00 . A A . 8 PRO C 1 1 27 16260 1 1 8 PRO CA C 1.519 2.928 -2.950 1.00 . A A . 8 PRO CA 1 1 27 16261 1 1 8 PRO CB C 2.830 2.348 -2.424 1.00 . A A . 8 PRO CB 1 1 27 16262 1 1 8 PRO CD C 2.334 4.287 -1.098 1.00 . A A . 8 PRO CD 1 1 27 16263 1 1 8 PRO CG C 2.970 2.920 -1.055 1.00 . A A . 8 PRO CG 1 1 27 16264 1 1 8 PRO HA H 1.577 3.045 -4.022 1.00 . A A . 8 PRO HA 1 1 27 16265 1 1 8 PRO HB2 H 2.766 1.270 -2.400 1.00 . A A . 8 PRO HB2 1 1 27 16266 1 1 8 PRO HB3 H 3.644 2.653 -3.064 1.00 . A A . 8 PRO HB3 1 1 27 16267 1 1 8 PRO HD2 H 1.770 4.468 -0.195 1.00 . A A . 8 PRO HD2 1 1 27 16268 1 1 8 PRO HD3 H 3.088 5.048 -1.231 1.00 . A A . 8 PRO HD3 1 1 27 16269 1 1 8 PRO HG2 H 2.457 2.292 -0.342 1.00 . A A . 8 PRO HG2 1 1 27 16270 1 1 8 PRO HG3 H 4.015 3.003 -0.798 1.00 . A A . 8 PRO HG3 1 1 27 16271 1 1 8 PRO N N 1.440 4.223 -2.271 1.00 . A A . 8 PRO N 1 1 27 16272 1 1 8 PRO O O -0.222 1.360 -3.474 1.00 . A A . 8 PRO O 1 1 27 16273 1 1 9 CYS C C -2.416 1.540 -1.475 1.00 . A A . 9 CYS C 1 1 27 16274 1 1 9 CYS CA C -1.089 1.114 -0.853 1.00 . A A . 9 CYS CA 1 1 27 16275 1 1 9 CYS CB C -1.185 1.161 0.674 1.00 . A A . 9 CYS CB 1 1 27 16276 1 1 9 CYS H H 0.504 2.496 -0.667 1.00 . A A . 9 CYS H 1 1 27 16277 1 1 9 CYS HA H -0.875 0.100 -1.157 1.00 . A A . 9 CYS HA 1 1 27 16278 1 1 9 CYS HB2 H -0.654 2.029 1.033 1.00 . A A . 9 CYS HB2 1 1 27 16279 1 1 9 CYS HB3 H -2.224 1.237 0.961 1.00 . A A . 9 CYS HB3 1 1 27 16280 1 1 9 CYS N N 0.007 1.958 -1.317 1.00 . A A . 9 CYS N 1 1 27 16281 1 1 9 CYS O O -3.322 0.725 -1.642 1.00 . A A . 9 CYS O 1 1 27 16282 1 1 9 CYS SG S -0.484 -0.300 1.506 1.00 . A A . 9 CYS SG 1 1 27 16283 1 1 10 CYS C C -3.500 3.742 -3.875 1.00 . A A . 10 CYS C 1 1 27 16284 1 1 10 CYS CA C -3.743 3.347 -2.422 1.00 . A A . 10 CYS CA 1 1 27 16285 1 1 10 CYS CB C -4.256 4.550 -1.628 1.00 . A A . 10 CYS CB 1 1 27 16286 1 1 10 CYS H H -1.769 3.423 -1.661 1.00 . A A . 10 CYS H 1 1 27 16287 1 1 10 CYS HA H -4.489 2.568 -2.396 1.00 . A A . 10 CYS HA 1 1 27 16288 1 1 10 CYS HB2 H -5.197 4.873 -2.046 1.00 . A A . 10 CYS HB2 1 1 27 16289 1 1 10 CYS HB3 H -4.407 4.255 -0.600 1.00 . A A . 10 CYS HB3 1 1 27 16290 1 1 10 CYS N N -2.525 2.820 -1.817 1.00 . A A . 10 CYS N 1 1 27 16291 1 1 10 CYS O O -2.554 4.468 -4.182 1.00 . A A . 10 CYS O 1 1 27 16292 1 1 10 CYS SG S -3.130 5.983 -1.633 1.00 . A A . 10 CYS SG 1 1 27 16293 1 1 11 ARG C C -4.285 5.054 -6.448 1.00 . A A . 11 ARG C 1 1 27 16294 1 1 11 ARG CA C -4.229 3.548 -6.190 1.00 . A A . 11 ARG CA 1 1 27 16295 1 1 11 ARG CB C -5.324 2.825 -6.983 1.00 . A A . 11 ARG CB 1 1 27 16296 1 1 11 ARG CD C -6.013 0.480 -7.566 1.00 . A A . 11 ARG CD 1 1 27 16297 1 1 11 ARG CG C -4.878 1.491 -7.559 1.00 . A A . 11 ARG CG 1 1 27 16298 1 1 11 ARG CZ C -6.652 0.271 -9.936 1.00 . A A . 11 ARG CZ 1 1 27 16299 1 1 11 ARG H H -5.086 2.675 -4.463 1.00 . A A . 11 ARG H 1 1 27 16300 1 1 11 ARG HA H -3.268 3.182 -6.514 1.00 . A A . 11 ARG HA 1 1 27 16301 1 1 11 ARG HB2 H -6.166 2.648 -6.331 1.00 . A A . 11 ARG HB2 1 1 27 16302 1 1 11 ARG HB3 H -5.639 3.458 -7.799 1.00 . A A . 11 ARG HB3 1 1 27 16303 1 1 11 ARG HD2 H -5.593 -0.513 -7.623 1.00 . A A . 11 ARG HD2 1 1 27 16304 1 1 11 ARG HD3 H -6.573 0.581 -6.648 1.00 . A A . 11 ARG HD3 1 1 27 16305 1 1 11 ARG HE H -7.764 1.139 -8.524 1.00 . A A . 11 ARG HE 1 1 27 16306 1 1 11 ARG HG2 H -4.539 1.643 -8.573 1.00 . A A . 11 ARG HG2 1 1 27 16307 1 1 11 ARG HG3 H -4.066 1.105 -6.960 1.00 . A A . 11 ARG HG3 1 1 27 16308 1 1 11 ARG HH11 H -4.849 -0.525 -9.481 1.00 . A A . 11 ARG HH11 1 1 27 16309 1 1 11 ARG HH12 H -5.322 -0.659 -11.141 1.00 . A A . 11 ARG HH12 1 1 27 16310 1 1 11 ARG HH21 H -8.387 0.963 -10.707 1.00 . A A . 11 ARG HH21 1 1 27 16311 1 1 11 ARG HH22 H -7.330 0.186 -11.838 1.00 . A A . 11 ARG HH22 1 1 27 16312 1 1 11 ARG N N -4.355 3.252 -4.768 1.00 . A A . 11 ARG N 1 1 27 16313 1 1 11 ARG NE N -6.916 0.678 -8.697 1.00 . A A . 11 ARG NE 1 1 27 16314 1 1 11 ARG NH1 N -5.514 -0.356 -10.208 1.00 . A A . 11 ARG NH1 1 1 27 16315 1 1 11 ARG NH2 N -7.528 0.491 -10.907 1.00 . A A . 11 ARG NH2 1 1 27 16316 1 1 11 ARG O O -3.256 5.729 -6.434 1.00 . A A . 11 ARG O 1 1 27 16317 1 1 12 GLN C C -6.643 7.633 -5.972 1.00 . A A . 12 GLN C 1 1 27 16318 1 1 12 GLN CA C -5.658 7.000 -6.952 1.00 . A A . 12 GLN CA 1 1 27 16319 1 1 12 GLN CB C -6.141 7.216 -8.387 1.00 . A A . 12 GLN CB 1 1 27 16320 1 1 12 GLN CD C -5.277 8.271 -10.513 1.00 . A A . 12 GLN CD 1 1 27 16321 1 1 12 GLN CG C -5.571 8.465 -9.039 1.00 . A A . 12 GLN CG 1 1 27 16322 1 1 12 GLN H H -6.270 4.991 -6.691 1.00 . A A . 12 GLN H 1 1 27 16323 1 1 12 GLN HA H -4.696 7.476 -6.832 1.00 . A A . 12 GLN HA 1 1 27 16324 1 1 12 GLN HB2 H -5.855 6.363 -8.983 1.00 . A A . 12 GLN HB2 1 1 27 16325 1 1 12 GLN HB3 H -7.218 7.298 -8.383 1.00 . A A . 12 GLN HB3 1 1 27 16326 1 1 12 GLN HE21 H -4.469 10.084 -10.617 1.00 . A A . 12 GLN HE21 1 1 27 16327 1 1 12 GLN HE22 H -4.480 9.182 -12.090 1.00 . A A . 12 GLN HE22 1 1 27 16328 1 1 12 GLN HG2 H -6.285 9.269 -8.933 1.00 . A A . 12 GLN HG2 1 1 27 16329 1 1 12 GLN HG3 H -4.653 8.732 -8.535 1.00 . A A . 12 GLN HG3 1 1 27 16330 1 1 12 GLN N N -5.485 5.576 -6.688 1.00 . A A . 12 GLN N 1 1 27 16331 1 1 12 GLN NE2 N -4.682 9.281 -11.136 1.00 . A A . 12 GLN NE2 1 1 27 16332 1 1 12 GLN O O -6.662 8.852 -5.803 1.00 . A A . 12 GLN O 1 1 27 16333 1 1 12 GLN OE1 O -5.581 7.224 -11.086 1.00 . A A . 12 GLN OE1 1 1 27 16334 1 1 13 CYS C C -9.122 6.159 -3.619 1.00 . A A . 13 CYS C 1 1 27 16335 1 1 13 CYS CA C -8.449 7.303 -4.376 1.00 . A A . 13 CYS CA 1 1 27 16336 1 1 13 CYS CB C -9.506 8.141 -5.100 1.00 . A A . 13 CYS CB 1 1 27 16337 1 1 13 CYS H H -7.410 5.844 -5.504 1.00 . A A . 13 CYS H 1 1 27 16338 1 1 13 CYS HA H -7.932 7.931 -3.666 1.00 . A A . 13 CYS HA 1 1 27 16339 1 1 13 CYS HB2 H -9.501 7.883 -6.149 1.00 . A A . 13 CYS HB2 1 1 27 16340 1 1 13 CYS HB3 H -10.479 7.919 -4.686 1.00 . A A . 13 CYS HB3 1 1 27 16341 1 1 13 CYS N N -7.464 6.805 -5.331 1.00 . A A . 13 CYS N 1 1 27 16342 1 1 13 CYS O O -10.275 6.276 -3.204 1.00 . A A . 13 CYS O 1 1 27 16343 1 1 13 CYS SG S -9.247 9.940 -4.973 1.00 . A A . 13 CYS SG 1 1 27 16344 1 1 14 LYS C C -7.859 2.877 -2.446 1.00 . A A . 14 LYS C 1 1 27 16345 1 1 14 LYS CA C -8.947 3.906 -2.728 1.00 . A A . 14 LYS CA 1 1 27 16346 1 1 14 LYS CB C -10.073 3.265 -3.540 1.00 . A A . 14 LYS CB 1 1 27 16347 1 1 14 LYS CD C -12.198 1.942 -3.319 1.00 . A A . 14 LYS CD 1 1 27 16348 1 1 14 LYS CE C -12.890 0.784 -2.617 1.00 . A A . 14 LYS CE 1 1 27 16349 1 1 14 LYS CG C -10.777 2.130 -2.814 1.00 . A A . 14 LYS CG 1 1 27 16350 1 1 14 LYS H H -7.487 5.011 -3.787 1.00 . A A . 14 LYS H 1 1 27 16351 1 1 14 LYS HA H -9.347 4.256 -1.788 1.00 . A A . 14 LYS HA 1 1 27 16352 1 1 14 LYS HB2 H -10.807 4.021 -3.776 1.00 . A A . 14 LYS HB2 1 1 27 16353 1 1 14 LYS HB3 H -9.662 2.875 -4.459 1.00 . A A . 14 LYS HB3 1 1 27 16354 1 1 14 LYS HD2 H -12.758 2.847 -3.135 1.00 . A A . 14 LYS HD2 1 1 27 16355 1 1 14 LYS HD3 H -12.169 1.743 -4.380 1.00 . A A . 14 LYS HD3 1 1 27 16356 1 1 14 LYS HE2 H -12.761 -0.109 -3.210 1.00 . A A . 14 LYS HE2 1 1 27 16357 1 1 14 LYS HE3 H -12.432 0.642 -1.649 1.00 . A A . 14 LYS HE3 1 1 27 16358 1 1 14 LYS HG2 H -10.225 1.215 -2.975 1.00 . A A . 14 LYS HG2 1 1 27 16359 1 1 14 LYS HG3 H -10.806 2.354 -1.758 1.00 . A A . 14 LYS HG3 1 1 27 16360 1 1 14 LYS HZ1 H -14.515 2.048 -2.265 1.00 . A A . 14 LYS HZ1 1 1 27 16361 1 1 14 LYS HZ2 H -14.869 0.744 -3.283 1.00 . A A . 14 LYS HZ2 1 1 27 16362 1 1 14 LYS HZ3 H -14.702 0.497 -1.619 1.00 . A A . 14 LYS HZ3 1 1 27 16363 1 1 14 LYS N N -8.402 5.055 -3.438 1.00 . A A . 14 LYS N 1 1 27 16364 1 1 14 LYS NZ N -14.346 1.036 -2.433 1.00 . A A . 14 LYS NZ 1 1 27 16365 1 1 14 LYS O O -7.203 2.386 -3.365 1.00 . A A . 14 LYS O 1 1 27 16366 1 1 15 LEU C C -6.756 0.321 -1.627 1.00 . A A . 15 LEU C 1 1 27 16367 1 1 15 LEU CA C -6.666 1.576 -0.766 1.00 . A A . 15 LEU CA 1 1 27 16368 1 1 15 LEU CB C -6.834 1.209 0.710 1.00 . A A . 15 LEU CB 1 1 27 16369 1 1 15 LEU CD1 C -8.498 -0.023 2.128 1.00 . A A . 15 LEU CD1 1 1 27 16370 1 1 15 LEU CD2 C -8.630 2.467 1.927 1.00 . A A . 15 LEU CD2 1 1 27 16371 1 1 15 LEU CG C -8.281 1.171 1.211 1.00 . A A . 15 LEU CG 1 1 27 16372 1 1 15 LEU H H -8.230 2.977 -0.483 1.00 . A A . 15 LEU H 1 1 27 16373 1 1 15 LEU HA H -5.695 2.026 -0.908 1.00 . A A . 15 LEU HA 1 1 27 16374 1 1 15 LEU HB2 H -6.393 0.236 0.868 1.00 . A A . 15 LEU HB2 1 1 27 16375 1 1 15 LEU HB3 H -6.291 1.931 1.302 1.00 . A A . 15 LEU HB3 1 1 27 16376 1 1 15 LEU HD11 H -7.548 -0.353 2.521 1.00 . A A . 15 LEU HD11 1 1 27 16377 1 1 15 LEU HD12 H -9.146 0.262 2.944 1.00 . A A . 15 LEU HD12 1 1 27 16378 1 1 15 LEU HD13 H -8.955 -0.827 1.571 1.00 . A A . 15 LEU HD13 1 1 27 16379 1 1 15 LEU HD21 H -7.962 3.250 1.599 1.00 . A A . 15 LEU HD21 1 1 27 16380 1 1 15 LEU HD22 H -9.649 2.743 1.695 1.00 . A A . 15 LEU HD22 1 1 27 16381 1 1 15 LEU HD23 H -8.528 2.329 2.993 1.00 . A A . 15 LEU HD23 1 1 27 16382 1 1 15 LEU HG H -8.944 1.065 0.365 1.00 . A A . 15 LEU HG 1 1 27 16383 1 1 15 LEU N N -7.674 2.552 -1.169 1.00 . A A . 15 LEU N 1 1 27 16384 1 1 15 LEU O O -7.760 -0.390 -1.602 1.00 . A A . 15 LEU O 1 1 27 16385 1 1 16 LYS C C -6.123 -2.364 -2.539 1.00 . A A . 16 LYS C 1 1 27 16386 1 1 16 LYS CA C -5.662 -1.105 -3.273 1.00 . A A . 16 LYS CA 1 1 27 16387 1 1 16 LYS CB C -4.246 -1.310 -3.817 1.00 . A A . 16 LYS CB 1 1 27 16388 1 1 16 LYS CD C -2.648 -0.989 -5.732 1.00 . A A . 16 LYS CD 1 1 27 16389 1 1 16 LYS CE C -1.861 0.227 -6.195 1.00 . A A . 16 LYS CE 1 1 27 16390 1 1 16 LYS CG C -3.990 -0.593 -5.133 1.00 . A A . 16 LYS CG 1 1 27 16391 1 1 16 LYS H H -4.934 0.667 -2.374 1.00 . A A . 16 LYS H 1 1 27 16392 1 1 16 LYS HA H -6.332 -0.915 -4.099 1.00 . A A . 16 LYS HA 1 1 27 16393 1 1 16 LYS HB2 H -3.537 -0.945 -3.090 1.00 . A A . 16 LYS HB2 1 1 27 16394 1 1 16 LYS HB3 H -4.080 -2.366 -3.970 1.00 . A A . 16 LYS HB3 1 1 27 16395 1 1 16 LYS HD2 H -2.072 -1.514 -4.985 1.00 . A A . 16 LYS HD2 1 1 27 16396 1 1 16 LYS HD3 H -2.821 -1.638 -6.578 1.00 . A A . 16 LYS HD3 1 1 27 16397 1 1 16 LYS HE2 H -2.261 1.105 -5.711 1.00 . A A . 16 LYS HE2 1 1 27 16398 1 1 16 LYS HE3 H -0.827 0.099 -5.912 1.00 . A A . 16 LYS HE3 1 1 27 16399 1 1 16 LYS HG2 H -4.773 -0.849 -5.830 1.00 . A A . 16 LYS HG2 1 1 27 16400 1 1 16 LYS HG3 H -3.996 0.473 -4.958 1.00 . A A . 16 LYS HG3 1 1 27 16401 1 1 16 LYS HZ1 H -2.796 -0.049 -8.043 1.00 . A A . 16 LYS HZ1 1 1 27 16402 1 1 16 LYS HZ2 H -1.973 1.423 -7.904 1.00 . A A . 16 LYS HZ2 1 1 27 16403 1 1 16 LYS HZ3 H -1.107 -0.012 -8.129 1.00 . A A . 16 LYS HZ3 1 1 27 16404 1 1 16 LYS N N -5.702 0.059 -2.395 1.00 . A A . 16 LYS N 1 1 27 16405 1 1 16 LYS NZ N -1.940 0.410 -7.671 1.00 . A A . 16 LYS NZ 1 1 27 16406 1 1 16 LYS O O -6.184 -2.387 -1.309 1.00 . A A . 16 LYS O 1 1 27 16407 1 1 17 PRO C C -5.901 -5.261 -1.697 1.00 . A A . 17 PRO C 1 1 27 16408 1 1 17 PRO CA C -6.906 -4.697 -2.695 1.00 . A A . 17 PRO CA 1 1 27 16409 1 1 17 PRO CB C -7.053 -5.636 -3.901 1.00 . A A . 17 PRO CB 1 1 27 16410 1 1 17 PRO CD C -6.408 -3.499 -4.752 1.00 . A A . 17 PRO CD 1 1 27 16411 1 1 17 PRO CG C -6.311 -4.973 -5.013 1.00 . A A . 17 PRO CG 1 1 27 16412 1 1 17 PRO HA H -7.864 -4.581 -2.209 1.00 . A A . 17 PRO HA 1 1 27 16413 1 1 17 PRO HB2 H -6.625 -6.599 -3.663 1.00 . A A . 17 PRO HB2 1 1 27 16414 1 1 17 PRO HB3 H -8.099 -5.754 -4.142 1.00 . A A . 17 PRO HB3 1 1 27 16415 1 1 17 PRO HD2 H -5.539 -2.987 -5.138 1.00 . A A . 17 PRO HD2 1 1 27 16416 1 1 17 PRO HD3 H -7.311 -3.095 -5.184 1.00 . A A . 17 PRO HD3 1 1 27 16417 1 1 17 PRO HG2 H -5.278 -5.288 -5.006 1.00 . A A . 17 PRO HG2 1 1 27 16418 1 1 17 PRO HG3 H -6.772 -5.217 -5.959 1.00 . A A . 17 PRO HG3 1 1 27 16419 1 1 17 PRO N N -6.452 -3.433 -3.284 1.00 . A A . 17 PRO N 1 1 27 16420 1 1 17 PRO O O -4.693 -5.234 -1.935 1.00 . A A . 17 PRO O 1 1 27 16421 1 1 18 ALA C C -4.639 -7.422 -0.115 1.00 . A A . 18 ALA C 1 1 27 16422 1 1 18 ALA CA C -5.555 -6.346 0.457 1.00 . A A . 18 ALA CA 1 1 27 16423 1 1 18 ALA CB C -6.406 -6.917 1.582 1.00 . A A . 18 ALA CB 1 1 27 16424 1 1 18 ALA H H -7.379 -5.766 -0.448 1.00 . A A . 18 ALA H 1 1 27 16425 1 1 18 ALA HA H -4.948 -5.550 0.866 1.00 . A A . 18 ALA HA 1 1 27 16426 1 1 18 ALA HB1 H -6.570 -6.157 2.331 1.00 . A A . 18 ALA HB1 1 1 27 16427 1 1 18 ALA HB2 H -5.895 -7.758 2.027 1.00 . A A . 18 ALA HB2 1 1 27 16428 1 1 18 ALA HB3 H -7.356 -7.243 1.185 1.00 . A A . 18 ALA HB3 1 1 27 16429 1 1 18 ALA N N -6.408 -5.773 -0.579 1.00 . A A . 18 ALA N 1 1 27 16430 1 1 18 ALA O O -5.105 -8.432 -0.642 1.00 . A A . 18 ALA O 1 1 27 16431 1 1 19 GLY C C -1.524 -7.592 -1.646 1.00 . A A . 19 GLY C 1 1 27 16432 1 1 19 GLY CA C -2.371 -8.156 -0.519 1.00 . A A . 19 GLY CA 1 1 27 16433 1 1 19 GLY H H -3.021 -6.375 0.422 1.00 . A A . 19 GLY H 1 1 27 16434 1 1 19 GLY HA2 H -2.902 -9.024 -0.884 1.00 . A A . 19 GLY HA2 1 1 27 16435 1 1 19 GLY HA3 H -1.720 -8.460 0.287 1.00 . A A . 19 GLY HA3 1 1 27 16436 1 1 19 GLY N N -3.334 -7.198 -0.008 1.00 . A A . 19 GLY N 1 1 27 16437 1 1 19 GLY O O -0.836 -8.336 -2.344 1.00 . A A . 19 GLY O 1 1 27 16438 1 1 20 THR C C 0.560 -5.175 -2.348 1.00 . A A . 20 THR C 1 1 27 16439 1 1 20 THR CA C -0.801 -5.618 -2.874 1.00 . A A . 20 THR CA 1 1 27 16440 1 1 20 THR CB C -1.567 -4.412 -3.420 1.00 . A A . 20 THR CB 1 1 27 16441 1 1 20 THR CG2 C -0.972 -3.852 -4.694 1.00 . A A . 20 THR CG2 1 1 27 16442 1 1 20 THR H H -2.137 -5.731 -1.238 1.00 . A A . 20 THR H 1 1 27 16443 1 1 20 THR HA H -0.651 -6.330 -3.671 1.00 . A A . 20 THR HA 1 1 27 16444 1 1 20 THR HB H -1.558 -3.626 -2.678 1.00 . A A . 20 THR HB 1 1 27 16445 1 1 20 THR HG1 H -3.315 -5.124 -2.899 1.00 . A A . 20 THR HG1 1 1 27 16446 1 1 20 THR HG21 H -0.451 -4.637 -5.223 1.00 . A A . 20 THR HG21 1 1 27 16447 1 1 20 THR HG22 H -1.762 -3.460 -5.318 1.00 . A A . 20 THR HG22 1 1 27 16448 1 1 20 THR HG23 H -0.279 -3.061 -4.451 1.00 . A A . 20 THR HG23 1 1 27 16449 1 1 20 THR N N -1.572 -6.274 -1.825 1.00 . A A . 20 THR N 1 1 27 16450 1 1 20 THR O O 0.647 -4.366 -1.424 1.00 . A A . 20 THR O 1 1 27 16451 1 1 20 THR OG1 O -2.915 -4.754 -3.690 1.00 . A A . 20 THR OG1 1 1 27 16452 1 1 21 THR C C 3.185 -3.864 -2.473 1.00 . A A . 21 THR C 1 1 27 16453 1 1 21 THR CA C 2.984 -5.376 -2.532 1.00 . A A . 21 THR CA 1 1 27 16454 1 1 21 THR CB C 3.995 -5.998 -3.495 1.00 . A A . 21 THR CB 1 1 27 16455 1 1 21 THR CG2 C 3.632 -5.800 -4.951 1.00 . A A . 21 THR CG2 1 1 27 16456 1 1 21 THR H H 1.489 -6.352 -3.671 1.00 . A A . 21 THR H 1 1 27 16457 1 1 21 THR HA H 3.143 -5.785 -1.546 1.00 . A A . 21 THR HA 1 1 27 16458 1 1 21 THR HB H 4.048 -7.061 -3.309 1.00 . A A . 21 THR HB 1 1 27 16459 1 1 21 THR HG1 H 5.894 -6.141 -3.038 1.00 . A A . 21 THR HG1 1 1 27 16460 1 1 21 THR HG21 H 2.654 -5.345 -5.018 1.00 . A A . 21 THR HG21 1 1 27 16461 1 1 21 THR HG22 H 4.361 -5.156 -5.419 1.00 . A A . 21 THR HG22 1 1 27 16462 1 1 21 THR HG23 H 3.620 -6.756 -5.452 1.00 . A A . 21 THR HG23 1 1 27 16463 1 1 21 THR N N 1.623 -5.712 -2.941 1.00 . A A . 21 THR N 1 1 27 16464 1 1 21 THR O O 2.705 -3.129 -3.336 1.00 . A A . 21 THR O 1 1 27 16465 1 1 21 THR OG1 O 5.284 -5.446 -3.295 1.00 . A A . 21 THR OG1 1 1 27 16466 1 1 22 CYS C C 5.649 -1.685 -1.451 1.00 . A A . 22 CYS C 1 1 27 16467 1 1 22 CYS CA C 4.164 -1.985 -1.272 1.00 . A A . 22 CYS CA 1 1 27 16468 1 1 22 CYS CB C 3.701 -1.527 0.112 1.00 . A A . 22 CYS CB 1 1 27 16469 1 1 22 CYS H H 4.253 -4.045 -0.792 1.00 . A A . 22 CYS H 1 1 27 16470 1 1 22 CYS HA H 3.606 -1.448 -2.025 1.00 . A A . 22 CYS HA 1 1 27 16471 1 1 22 CYS HB2 H 2.641 -1.709 0.207 1.00 . A A . 22 CYS HB2 1 1 27 16472 1 1 22 CYS HB3 H 4.227 -2.096 0.865 1.00 . A A . 22 CYS HB3 1 1 27 16473 1 1 22 CYS N N 3.897 -3.408 -1.448 1.00 . A A . 22 CYS N 1 1 27 16474 1 1 22 CYS O O 6.453 -1.917 -0.549 1.00 . A A . 22 CYS O 1 1 27 16475 1 1 22 CYS SG S 3.991 0.240 0.448 1.00 . A A . 22 CYS SG 1 1 27 16476 1 1 23 TRP C C 8.278 -2.073 -2.845 1.00 . A A . 23 TRP C 1 1 27 16477 1 1 23 TRP CA C 7.394 -0.833 -2.919 1.00 . A A . 23 TRP CA 1 1 27 16478 1 1 23 TRP CB C 7.904 0.231 -1.945 1.00 . A A . 23 TRP CB 1 1 27 16479 1 1 23 TRP CD1 C 9.707 1.524 -3.228 1.00 . A A . 23 TRP CD1 1 1 27 16480 1 1 23 TRP CD2 C 10.490 0.300 -1.524 1.00 . A A . 23 TRP CD2 1 1 27 16481 1 1 23 TRP CE2 C 11.572 0.955 -2.141 1.00 . A A . 23 TRP CE2 1 1 27 16482 1 1 23 TRP CE3 C 10.740 -0.527 -0.426 1.00 . A A . 23 TRP CE3 1 1 27 16483 1 1 23 TRP CG C 9.305 0.677 -2.235 1.00 . A A . 23 TRP CG 1 1 27 16484 1 1 23 TRP CH2 C 13.099 -0.007 -0.618 1.00 . A A . 23 TRP CH2 1 1 27 16485 1 1 23 TRP CZ2 C 12.884 0.808 -1.695 1.00 . A A . 23 TRP CZ2 1 1 27 16486 1 1 23 TRP CZ3 C 12.042 -0.673 0.015 1.00 . A A . 23 TRP CZ3 1 1 27 16487 1 1 23 TRP H H 5.319 -1.003 -3.302 1.00 . A A . 23 TRP H 1 1 27 16488 1 1 23 TRP HA H 7.432 -0.438 -3.923 1.00 . A A . 23 TRP HA 1 1 27 16489 1 1 23 TRP HB2 H 7.261 1.096 -1.998 1.00 . A A . 23 TRP HB2 1 1 27 16490 1 1 23 TRP HB3 H 7.881 -0.169 -0.942 1.00 . A A . 23 TRP HB3 1 1 27 16491 1 1 23 TRP HD1 H 9.040 1.983 -3.942 1.00 . A A . 23 TRP HD1 1 1 27 16492 1 1 23 TRP HE1 H 11.594 2.258 -3.786 1.00 . A A . 23 TRP HE1 1 1 27 16493 1 1 23 TRP HE3 H 9.938 -1.048 0.076 1.00 . A A . 23 TRP HE3 1 1 27 16494 1 1 23 TRP HH2 H 14.101 -0.151 -0.240 1.00 . A A . 23 TRP HH2 1 1 27 16495 1 1 23 TRP HZ2 H 13.710 1.314 -2.173 1.00 . A A . 23 TRP HZ2 1 1 27 16496 1 1 23 TRP HZ3 H 12.255 -1.308 0.862 1.00 . A A . 23 TRP HZ3 1 1 27 16497 1 1 23 TRP N N 6.005 -1.166 -2.622 1.00 . A A . 23 TRP N 1 1 27 16498 1 1 23 TRP NE1 N 11.069 1.696 -3.178 1.00 . A A . 23 TRP NE1 1 1 27 16499 1 1 23 TRP O O 8.742 -2.454 -1.770 1.00 . A A . 23 TRP O 1 1 27 16500 1 1 24 ARG C C 10.605 -3.637 -4.868 1.00 . A A . 24 ARG C 1 1 27 16501 1 1 24 ARG CA C 9.337 -3.897 -4.061 1.00 . A A . 24 ARG CA 1 1 27 16502 1 1 24 ARG CB C 8.552 -5.053 -4.683 1.00 . A A . 24 ARG CB 1 1 27 16503 1 1 24 ARG CD C 9.105 -5.370 -7.113 1.00 . A A . 24 ARG CD 1 1 27 16504 1 1 24 ARG CG C 8.116 -4.791 -6.115 1.00 . A A . 24 ARG CG 1 1 27 16505 1 1 24 ARG CZ C 9.234 -7.333 -8.597 1.00 . A A . 24 ARG CZ 1 1 27 16506 1 1 24 ARG H H 8.110 -2.348 -4.819 1.00 . A A . 24 ARG H 1 1 27 16507 1 1 24 ARG HA H 9.615 -4.164 -3.052 1.00 . A A . 24 ARG HA 1 1 27 16508 1 1 24 ARG HB2 H 9.169 -5.939 -4.674 1.00 . A A . 24 ARG HB2 1 1 27 16509 1 1 24 ARG HB3 H 7.669 -5.235 -4.088 1.00 . A A . 24 ARG HB3 1 1 27 16510 1 1 24 ARG HD2 H 9.125 -4.738 -7.989 1.00 . A A . 24 ARG HD2 1 1 27 16511 1 1 24 ARG HD3 H 10.086 -5.386 -6.660 1.00 . A A . 24 ARG HD3 1 1 27 16512 1 1 24 ARG HE H 8.108 -7.213 -6.953 1.00 . A A . 24 ARG HE 1 1 27 16513 1 1 24 ARG HG2 H 7.150 -5.247 -6.276 1.00 . A A . 24 ARG HG2 1 1 27 16514 1 1 24 ARG HG3 H 8.043 -3.725 -6.270 1.00 . A A . 24 ARG HG3 1 1 27 16515 1 1 24 ARG HH11 H 10.390 -5.774 -9.168 1.00 . A A . 24 ARG HH11 1 1 27 16516 1 1 24 ARG HH12 H 10.462 -7.167 -10.194 1.00 . A A . 24 ARG HH12 1 1 27 16517 1 1 24 ARG HH21 H 8.203 -9.046 -8.302 1.00 . A A . 24 ARG HH21 1 1 27 16518 1 1 24 ARG HH22 H 9.220 -9.024 -9.703 1.00 . A A . 24 ARG HH22 1 1 27 16519 1 1 24 ARG N N 8.508 -2.700 -3.995 1.00 . A A . 24 ARG N 1 1 27 16520 1 1 24 ARG NE N 8.746 -6.727 -7.517 1.00 . A A . 24 ARG NE 1 1 27 16521 1 1 24 ARG NH1 N 10.100 -6.706 -9.384 1.00 . A A . 24 ARG NH1 1 1 27 16522 1 1 24 ARG NH2 N 8.855 -8.569 -8.891 1.00 . A A . 24 ARG NH2 1 1 27 16523 1 1 24 ARG O O 10.545 -3.158 -6.000 1.00 . A A . 24 ARG O 1 1 27 16524 1 1 25 THR C C 13.457 -5.013 -5.698 1.00 . A A . 25 THR C 1 1 27 16525 1 1 25 THR CA C 13.035 -3.758 -4.942 1.00 . A A . 25 THR CA 1 1 27 16526 1 1 25 THR CB C 14.108 -3.374 -3.921 1.00 . A A . 25 THR CB 1 1 27 16527 1 1 25 THR CG2 C 14.168 -1.887 -3.646 1.00 . A A . 25 THR CG2 1 1 27 16528 1 1 25 THR H H 11.736 -4.336 -3.374 1.00 . A A . 25 THR H 1 1 27 16529 1 1 25 THR HA H 12.920 -2.952 -5.648 1.00 . A A . 25 THR HA 1 1 27 16530 1 1 25 THR HB H 15.074 -3.680 -4.297 1.00 . A A . 25 THR HB 1 1 27 16531 1 1 25 THR HG1 H 14.646 -3.912 -2.116 1.00 . A A . 25 THR HG1 1 1 27 16532 1 1 25 THR HG21 H 13.278 -1.413 -4.033 1.00 . A A . 25 THR HG21 1 1 27 16533 1 1 25 THR HG22 H 14.230 -1.720 -2.581 1.00 . A A . 25 THR HG22 1 1 27 16534 1 1 25 THR HG23 H 15.038 -1.466 -4.128 1.00 . A A . 25 THR HG23 1 1 27 16535 1 1 25 THR N N 11.752 -3.957 -4.278 1.00 . A A . 25 THR N 1 1 27 16536 1 1 25 THR O O 13.320 -5.092 -6.918 1.00 . A A . 25 THR O 1 1 27 16537 1 1 25 THR OG1 O 13.883 -4.030 -2.686 1.00 . A A . 25 THR OG1 1 1 27 16538 1 1 26 SER C C 14.898 -8.218 -4.487 1.00 . A A . 26 SER C 1 1 27 16539 1 1 26 SER CA C 14.415 -7.246 -5.560 1.00 . A A . 26 SER CA 1 1 27 16540 1 1 26 SER CB C 15.534 -6.986 -6.570 1.00 . A A . 26 SER CB 1 1 27 16541 1 1 26 SER H H 14.054 -5.865 -3.996 1.00 . A A . 26 SER H 1 1 27 16542 1 1 26 SER HA H 13.573 -7.684 -6.073 1.00 . A A . 26 SER HA 1 1 27 16543 1 1 26 SER HB2 H 15.447 -5.980 -6.951 1.00 . A A . 26 SER HB2 1 1 27 16544 1 1 26 SER HB3 H 16.491 -7.105 -6.083 1.00 . A A . 26 SER HB3 1 1 27 16545 1 1 26 SER HG H 15.498 -7.405 -8.484 1.00 . A A . 26 SER HG 1 1 27 16546 1 1 26 SER N N 13.971 -5.991 -4.963 1.00 . A A . 26 SER N 1 1 27 16547 1 1 26 SER O O 15.867 -8.949 -4.689 1.00 . A A . 26 SER O 1 1 27 16548 1 1 26 SER OG O 15.461 -7.892 -7.657 1.00 . A A . 26 SER OG 1 1 27 16549 1 1 27 VAL C C 13.610 -8.935 -1.072 1.00 . A A . 27 VAL C 1 1 27 16550 1 1 27 VAL CA C 14.572 -9.103 -2.244 1.00 . A A . 27 VAL CA 1 1 27 16551 1 1 27 VAL CB C 16.013 -8.841 -1.760 1.00 . A A . 27 VAL CB 1 1 27 16552 1 1 27 VAL CG1 C 16.157 -7.417 -1.246 1.00 . A A . 27 VAL CG1 1 1 27 16553 1 1 27 VAL CG2 C 16.409 -9.846 -0.688 1.00 . A A . 27 VAL CG2 1 1 27 16554 1 1 27 VAL H H 13.450 -7.615 -3.247 1.00 . A A . 27 VAL H 1 1 27 16555 1 1 27 VAL HA H 14.513 -10.120 -2.599 1.00 . A A . 27 VAL HA 1 1 27 16556 1 1 27 VAL HB H 16.680 -8.964 -2.601 1.00 . A A . 27 VAL HB 1 1 27 16557 1 1 27 VAL HG11 H 15.738 -6.730 -1.966 1.00 . A A . 27 VAL HG11 1 1 27 16558 1 1 27 VAL HG12 H 15.632 -7.318 -0.307 1.00 . A A . 27 VAL HG12 1 1 27 16559 1 1 27 VAL HG13 H 17.203 -7.191 -1.099 1.00 . A A . 27 VAL HG13 1 1 27 16560 1 1 27 VAL HG21 H 15.722 -9.778 0.142 1.00 . A A . 27 VAL HG21 1 1 27 16561 1 1 27 VAL HG22 H 16.378 -10.844 -1.101 1.00 . A A . 27 VAL HG22 1 1 27 16562 1 1 27 VAL HG23 H 17.410 -9.630 -0.345 1.00 . A A . 27 VAL HG23 1 1 27 16563 1 1 27 VAL N N 14.214 -8.220 -3.348 1.00 . A A . 27 VAL N 1 1 27 16564 1 1 27 VAL O O 13.240 -9.908 -0.415 1.00 . A A . 27 VAL O 1 1 27 16565 1 1 28 SER C C 10.853 -7.693 -0.127 1.00 . A A . 28 SER C 1 1 27 16566 1 1 28 SER CA C 12.293 -7.397 0.276 1.00 . A A . 28 SER CA 1 1 27 16567 1 1 28 SER CB C 12.428 -5.932 0.698 1.00 . A A . 28 SER CB 1 1 27 16568 1 1 28 SER H H 13.543 -6.963 -1.376 1.00 . A A . 28 SER H 1 1 27 16569 1 1 28 SER HA H 12.555 -8.026 1.110 1.00 . A A . 28 SER HA 1 1 27 16570 1 1 28 SER HB2 H 11.742 -5.727 1.506 1.00 . A A . 28 SER HB2 1 1 27 16571 1 1 28 SER HB3 H 13.440 -5.747 1.030 1.00 . A A . 28 SER HB3 1 1 27 16572 1 1 28 SER HG H 12.839 -5.108 -1.031 1.00 . A A . 28 SER HG 1 1 27 16573 1 1 28 SER N N 13.211 -7.695 -0.816 1.00 . A A . 28 SER N 1 1 27 16574 1 1 28 SER O O 10.289 -8.720 0.252 1.00 . A A . 28 SER O 1 1 27 16575 1 1 28 SER OG O 12.135 -5.061 -0.380 1.00 . A A . 28 SER OG 1 1 27 16576 1 1 29 SER C C 7.929 -7.031 -0.173 1.00 . A A . 29 SER C 1 1 27 16577 1 1 29 SER CA C 8.889 -6.947 -1.355 1.00 . A A . 29 SER CA 1 1 27 16578 1 1 29 SER CB C 8.760 -8.201 -2.222 1.00 . A A . 29 SER CB 1 1 27 16579 1 1 29 SER H H 10.768 -5.992 -1.164 1.00 . A A . 29 SER H 1 1 27 16580 1 1 29 SER HA H 8.635 -6.082 -1.949 1.00 . A A . 29 SER HA 1 1 27 16581 1 1 29 SER HB2 H 9.183 -8.008 -3.196 1.00 . A A . 29 SER HB2 1 1 27 16582 1 1 29 SER HB3 H 9.294 -9.016 -1.754 1.00 . A A . 29 SER HB3 1 1 27 16583 1 1 29 SER HG H 7.214 -9.339 -1.829 1.00 . A A . 29 SER HG 1 1 27 16584 1 1 29 SER N N 10.264 -6.787 -0.897 1.00 . A A . 29 SER N 1 1 27 16585 1 1 29 SER O O 7.899 -8.029 0.546 1.00 . A A . 29 SER O 1 1 27 16586 1 1 29 SER OG O 7.403 -8.576 -2.380 1.00 . A A . 29 SER OG 1 1 27 16587 1 1 30 HIS C C 4.813 -6.419 0.656 1.00 . A A . 30 HIS C 1 1 27 16588 1 1 30 HIS CA C 6.182 -5.929 1.116 1.00 . A A . 30 HIS CA 1 1 27 16589 1 1 30 HIS CB C 6.072 -4.505 1.665 1.00 . A A . 30 HIS CB 1 1 27 16590 1 1 30 HIS CD2 C 8.653 -4.373 1.893 1.00 . A A . 30 HIS CD2 1 1 27 16591 1 1 30 HIS CE1 C 8.813 -2.273 2.502 1.00 . A A . 30 HIS CE1 1 1 27 16592 1 1 30 HIS CG C 7.397 -3.867 1.944 1.00 . A A . 30 HIS CG 1 1 27 16593 1 1 30 HIS H H 7.215 -5.209 -0.586 1.00 . A A . 30 HIS H 1 1 27 16594 1 1 30 HIS HA H 6.540 -6.581 1.899 1.00 . A A . 30 HIS HA 1 1 27 16595 1 1 30 HIS HB2 H 5.552 -3.889 0.947 1.00 . A A . 30 HIS HB2 1 1 27 16596 1 1 30 HIS HB3 H 5.511 -4.525 2.588 1.00 . A A . 30 HIS HB3 1 1 27 16597 1 1 30 HIS HD1 H 6.799 -1.912 2.457 1.00 . A A . 30 HIS HD1 1 1 27 16598 1 1 30 HIS HD2 H 8.926 -5.384 1.625 1.00 . A A . 30 HIS HD2 1 1 27 16599 1 1 30 HIS HE1 H 9.217 -1.318 2.805 1.00 . A A . 30 HIS HE1 1 1 27 16600 1 1 30 HIS HE2 H 10.478 -3.458 2.382 1.00 . A A . 30 HIS HE2 1 1 27 16601 1 1 30 HIS N N 7.145 -5.975 0.021 1.00 . A A . 30 HIS N 1 1 27 16602 1 1 30 HIS ND1 N 7.532 -2.550 2.329 1.00 . A A . 30 HIS ND1 1 1 27 16603 1 1 30 HIS NE2 N 9.513 -3.362 2.244 1.00 . A A . 30 HIS NE2 1 1 27 16604 1 1 30 HIS O O 4.676 -6.975 -0.433 1.00 . A A . 30 HIS O 1 1 27 16605 1 1 31 TYR C C 1.419 -5.743 1.875 1.00 . A A . 31 TYR C 1 1 27 16606 1 1 31 TYR CA C 2.443 -6.628 1.171 1.00 . A A . 31 TYR CA 1 1 27 16607 1 1 31 TYR CB C 2.231 -8.089 1.569 1.00 . A A . 31 TYR CB 1 1 27 16608 1 1 31 TYR CD1 C 3.550 -10.068 0.721 1.00 . A A . 31 TYR CD1 1 1 27 16609 1 1 31 TYR CD2 C 2.024 -9.009 -0.774 1.00 . A A . 31 TYR CD2 1 1 27 16610 1 1 31 TYR CE1 C 3.898 -10.970 -0.267 1.00 . A A . 31 TYR CE1 1 1 27 16611 1 1 31 TYR CE2 C 2.367 -9.907 -1.767 1.00 . A A . 31 TYR CE2 1 1 27 16612 1 1 31 TYR CG C 2.609 -9.074 0.485 1.00 . A A . 31 TYR CG 1 1 27 16613 1 1 31 TYR CZ C 3.304 -10.885 -1.508 1.00 . A A . 31 TYR CZ 1 1 27 16614 1 1 31 TYR H H 3.973 -5.759 2.347 1.00 . A A . 31 TYR H 1 1 27 16615 1 1 31 TYR HA H 2.310 -6.532 0.104 1.00 . A A . 31 TYR HA 1 1 27 16616 1 1 31 TYR HB2 H 2.831 -8.309 2.439 1.00 . A A . 31 TYR HB2 1 1 27 16617 1 1 31 TYR HB3 H 1.188 -8.242 1.808 1.00 . A A . 31 TYR HB3 1 1 27 16618 1 1 31 TYR HD1 H 4.013 -10.132 1.694 1.00 . A A . 31 TYR HD1 1 1 27 16619 1 1 31 TYR HD2 H 1.291 -8.241 -0.973 1.00 . A A . 31 TYR HD2 1 1 27 16620 1 1 31 TYR HE1 H 4.632 -11.736 -0.064 1.00 . A A . 31 TYR HE1 1 1 27 16621 1 1 31 TYR HE2 H 1.901 -9.840 -2.739 1.00 . A A . 31 TYR HE2 1 1 27 16622 1 1 31 TYR HH H 2.857 -12.068 -2.956 1.00 . A A . 31 TYR HH 1 1 27 16623 1 1 31 TYR N N 3.802 -6.208 1.493 1.00 . A A . 31 TYR N 1 1 27 16624 1 1 31 TYR O O 1.301 -5.768 3.100 1.00 . A A . 31 TYR O 1 1 27 16625 1 1 31 TYR OH O 3.648 -11.781 -2.495 1.00 . A A . 31 TYR OH 1 1 27 16626 1 1 32 CYS C C -1.470 -4.866 2.275 1.00 . A A . 32 CYS C 1 1 27 16627 1 1 32 CYS CA C -0.333 -4.070 1.642 1.00 . A A . 32 CYS CA 1 1 27 16628 1 1 32 CYS CB C -0.883 -3.153 0.548 1.00 . A A . 32 CYS CB 1 1 27 16629 1 1 32 CYS H H 0.822 -4.987 0.123 1.00 . A A . 32 CYS H 1 1 27 16630 1 1 32 CYS HA H 0.136 -3.466 2.404 1.00 . A A . 32 CYS HA 1 1 27 16631 1 1 32 CYS HB2 H -0.059 -2.747 -0.019 1.00 . A A . 32 CYS HB2 1 1 27 16632 1 1 32 CYS HB3 H -1.517 -3.730 -0.109 1.00 . A A . 32 CYS HB3 1 1 27 16633 1 1 32 CYS N N 0.681 -4.962 1.093 1.00 . A A . 32 CYS N 1 1 27 16634 1 1 32 CYS O O -1.849 -5.927 1.781 1.00 . A A . 32 CYS O 1 1 27 16635 1 1 32 CYS SG S -1.864 -1.752 1.177 1.00 . A A . 32 CYS SG 1 1 27 16636 1 1 33 THR C C -4.462 -4.539 3.554 1.00 . A A . 33 THR C 1 1 27 16637 1 1 33 THR CA C -3.103 -5.007 4.074 1.00 . A A . 33 THR CA 1 1 27 16638 1 1 33 THR CB C -3.005 -4.738 5.577 1.00 . A A . 33 THR CB 1 1 27 16639 1 1 33 THR CG2 C -2.801 -3.276 5.910 1.00 . A A . 33 THR CG2 1 1 27 16640 1 1 33 THR H H -1.663 -3.496 3.717 1.00 . A A . 33 THR H 1 1 27 16641 1 1 33 THR HA H -3.012 -6.069 3.902 1.00 . A A . 33 THR HA 1 1 27 16642 1 1 33 THR HB H -2.166 -5.289 5.977 1.00 . A A . 33 THR HB 1 1 27 16643 1 1 33 THR HG1 H -4.910 -4.593 6.009 1.00 . A A . 33 THR HG1 1 1 27 16644 1 1 33 THR HG21 H -3.203 -2.667 5.113 1.00 . A A . 33 THR HG21 1 1 27 16645 1 1 33 THR HG22 H -3.310 -3.043 6.833 1.00 . A A . 33 THR HG22 1 1 27 16646 1 1 33 THR HG23 H -1.746 -3.076 6.020 1.00 . A A . 33 THR HG23 1 1 27 16647 1 1 33 THR N N -2.009 -4.345 3.372 1.00 . A A . 33 THR N 1 1 27 16648 1 1 33 THR O O -5.497 -4.839 4.148 1.00 . A A . 33 THR O 1 1 27 16649 1 1 33 THR OG1 O -4.179 -5.171 6.241 1.00 . A A . 33 THR OG1 1 1 27 16650 1 1 34 GLY C C -6.578 -2.616 2.892 1.00 . A A . 34 GLY C 1 1 27 16651 1 1 34 GLY CA C -5.697 -3.313 1.871 1.00 . A A . 34 GLY CA 1 1 27 16652 1 1 34 GLY H H -3.604 -3.595 2.008 1.00 . A A . 34 GLY H 1 1 27 16653 1 1 34 GLY HA2 H -6.242 -4.146 1.452 1.00 . A A . 34 GLY HA2 1 1 27 16654 1 1 34 GLY HA3 H -5.464 -2.616 1.079 1.00 . A A . 34 GLY HA3 1 1 27 16655 1 1 34 GLY N N -4.456 -3.804 2.443 1.00 . A A . 34 GLY N 1 1 27 16656 1 1 34 GLY O O -7.802 -2.607 2.763 1.00 . A A . 34 GLY O 1 1 27 16657 1 1 35 ARG C C -6.612 0.175 4.767 1.00 . A A . 35 ARG C 1 1 27 16658 1 1 35 ARG CA C -6.688 -1.335 4.960 1.00 . A A . 35 ARG CA 1 1 27 16659 1 1 35 ARG CB C -6.137 -1.714 6.336 1.00 . A A . 35 ARG CB 1 1 27 16660 1 1 35 ARG CD C -7.928 -2.740 7.769 1.00 . A A . 35 ARG CD 1 1 27 16661 1 1 35 ARG CG C -6.717 -3.005 6.889 1.00 . A A . 35 ARG CG 1 1 27 16662 1 1 35 ARG CZ C -9.900 -3.988 8.560 1.00 . A A . 35 ARG CZ 1 1 27 16663 1 1 35 ARG H H -4.975 -2.077 3.960 1.00 . A A . 35 ARG H 1 1 27 16664 1 1 35 ARG HA H -7.721 -1.641 4.899 1.00 . A A . 35 ARG HA 1 1 27 16665 1 1 35 ARG HB2 H -5.066 -1.827 6.264 1.00 . A A . 35 ARG HB2 1 1 27 16666 1 1 35 ARG HB3 H -6.360 -0.918 7.031 1.00 . A A . 35 ARG HB3 1 1 27 16667 1 1 35 ARG HD2 H -7.599 -2.646 8.793 1.00 . A A . 35 ARG HD2 1 1 27 16668 1 1 35 ARG HD3 H -8.391 -1.816 7.453 1.00 . A A . 35 ARG HD3 1 1 27 16669 1 1 35 ARG HE H -8.833 -4.445 6.936 1.00 . A A . 35 ARG HE 1 1 27 16670 1 1 35 ARG HG2 H -7.015 -3.637 6.066 1.00 . A A . 35 ARG HG2 1 1 27 16671 1 1 35 ARG HG3 H -5.960 -3.506 7.475 1.00 . A A . 35 ARG HG3 1 1 27 16672 1 1 35 ARG HH11 H -9.400 -2.398 9.705 1.00 . A A . 35 ARG HH11 1 1 27 16673 1 1 35 ARG HH12 H -10.783 -3.292 10.240 1.00 . A A . 35 ARG HH12 1 1 27 16674 1 1 35 ARG HH21 H -10.652 -5.622 7.638 1.00 . A A . 35 ARG HH21 1 1 27 16675 1 1 35 ARG HH22 H -11.494 -5.122 9.067 1.00 . A A . 35 ARG HH22 1 1 27 16676 1 1 35 ARG N N -5.953 -2.034 3.911 1.00 . A A . 35 ARG N 1 1 27 16677 1 1 35 ARG NE N -8.912 -3.816 7.684 1.00 . A A . 35 ARG NE 1 1 27 16678 1 1 35 ARG NH1 N -10.039 -3.157 9.586 1.00 . A A . 35 ARG NH1 1 1 27 16679 1 1 35 ARG NH2 N -10.752 -4.993 8.409 1.00 . A A . 35 ARG NH2 1 1 27 16680 1 1 35 ARG O O -7.571 0.896 5.045 1.00 . A A . 35 ARG O 1 1 27 16681 1 1 36 SER C C -4.017 2.322 3.219 1.00 . A A . 36 SER C 1 1 27 16682 1 1 36 SER CA C -5.266 2.075 4.060 1.00 . A A . 36 SER CA 1 1 27 16683 1 1 36 SER CB C -5.151 2.817 5.393 1.00 . A A . 36 SER CB 1 1 27 16684 1 1 36 SER H H -4.739 0.024 4.088 1.00 . A A . 36 SER H 1 1 27 16685 1 1 36 SER HA H -6.125 2.448 3.524 1.00 . A A . 36 SER HA 1 1 27 16686 1 1 36 SER HB2 H -4.718 2.159 6.132 1.00 . A A . 36 SER HB2 1 1 27 16687 1 1 36 SER HB3 H -4.518 3.683 5.267 1.00 . A A . 36 SER HB3 1 1 27 16688 1 1 36 SER HG H -6.774 2.595 6.468 1.00 . A A . 36 SER HG 1 1 27 16689 1 1 36 SER N N -5.466 0.649 4.290 1.00 . A A . 36 SER N 1 1 27 16690 1 1 36 SER O O -3.244 1.401 2.953 1.00 . A A . 36 SER O 1 1 27 16691 1 1 36 SER OG O -6.423 3.242 5.852 1.00 . A A . 36 SER OG 1 1 27 16692 1 1 37 CYS C C -1.402 3.991 2.838 1.00 . A A . 37 CYS C 1 1 27 16693 1 1 37 CYS CA C -2.671 3.936 1.992 1.00 . A A . 37 CYS CA 1 1 27 16694 1 1 37 CYS CB C -2.903 5.288 1.316 1.00 . A A . 37 CYS CB 1 1 27 16695 1 1 37 CYS H H -4.477 4.261 3.047 1.00 . A A . 37 CYS H 1 1 27 16696 1 1 37 CYS HA H -2.548 3.181 1.231 1.00 . A A . 37 CYS HA 1 1 27 16697 1 1 37 CYS HB2 H -3.927 5.344 0.979 1.00 . A A . 37 CYS HB2 1 1 27 16698 1 1 37 CYS HB3 H -2.721 6.076 2.032 1.00 . A A . 37 CYS HB3 1 1 27 16699 1 1 37 CYS N N -3.826 3.570 2.803 1.00 . A A . 37 CYS N 1 1 27 16700 1 1 37 CYS O O -0.296 3.814 2.326 1.00 . A A . 37 CYS O 1 1 27 16701 1 1 37 CYS SG S -1.829 5.589 -0.125 1.00 . A A . 37 CYS SG 1 1 27 16702 1 1 38 GLU C C 0.360 3.012 5.046 1.00 . A A . 38 GLU C 1 1 27 16703 1 1 38 GLU CA C -0.431 4.317 5.047 1.00 . A A . 38 GLU CA 1 1 27 16704 1 1 38 GLU CB C -0.910 4.635 6.464 1.00 . A A . 38 GLU CB 1 1 27 16705 1 1 38 GLU CD C -1.613 6.670 7.785 1.00 . A A . 38 GLU CD 1 1 27 16706 1 1 38 GLU CG C -1.835 5.839 6.537 1.00 . A A . 38 GLU CG 1 1 27 16707 1 1 38 GLU H H -2.471 4.373 4.485 1.00 . A A . 38 GLU H 1 1 27 16708 1 1 38 GLU HA H 0.213 5.114 4.706 1.00 . A A . 38 GLU HA 1 1 27 16709 1 1 38 GLU HB2 H -1.437 3.778 6.855 1.00 . A A . 38 GLU HB2 1 1 27 16710 1 1 38 GLU HB3 H -0.049 4.832 7.087 1.00 . A A . 38 GLU HB3 1 1 27 16711 1 1 38 GLU HG2 H -1.663 6.462 5.673 1.00 . A A . 38 GLU HG2 1 1 27 16712 1 1 38 GLU HG3 H -2.858 5.491 6.531 1.00 . A A . 38 GLU HG3 1 1 27 16713 1 1 38 GLU N N -1.566 4.239 4.134 1.00 . A A . 38 GLU N 1 1 27 16714 1 1 38 GLU O O 0.105 2.119 5.854 1.00 . A A . 38 GLU O 1 1 27 16715 1 1 38 GLU OE1 O -2.484 6.643 8.680 1.00 . A A . 38 GLU OE1 1 1 27 16716 1 1 38 GLU OE2 O -0.567 7.349 7.868 1.00 . A A . 38 GLU OE2 1 1 27 16717 1 1 39 CYS C C 2.912 1.461 5.325 1.00 . A A . 39 CYS C 1 1 27 16718 1 1 39 CYS CA C 2.150 1.716 4.024 1.00 . A A . 39 CYS CA 1 1 27 16719 1 1 39 CYS CB C 3.137 1.864 2.864 1.00 . A A . 39 CYS CB 1 1 27 16720 1 1 39 CYS H H 1.475 3.657 3.517 1.00 . A A . 39 CYS H 1 1 27 16721 1 1 39 CYS HA H 1.500 0.878 3.826 1.00 . A A . 39 CYS HA 1 1 27 16722 1 1 39 CYS HB2 H 2.596 2.155 1.977 1.00 . A A . 39 CYS HB2 1 1 27 16723 1 1 39 CYS HB3 H 3.857 2.631 3.109 1.00 . A A . 39 CYS HB3 1 1 27 16724 1 1 39 CYS N N 1.321 2.910 4.133 1.00 . A A . 39 CYS N 1 1 27 16725 1 1 39 CYS O O 3.823 2.212 5.673 1.00 . A A . 39 CYS O 1 1 27 16726 1 1 39 CYS SG S 4.060 0.342 2.474 1.00 . A A . 39 CYS SG 1 1 27 16727 1 1 40 PRO C C 4.728 -0.039 7.180 1.00 . A A . 40 PRO C 1 1 27 16728 1 1 40 PRO CA C 3.213 0.054 7.327 1.00 . A A . 40 PRO CA 1 1 27 16729 1 1 40 PRO CB C 2.626 -1.315 7.681 1.00 . A A . 40 PRO CB 1 1 27 16730 1 1 40 PRO CD C 1.477 -0.560 5.728 1.00 . A A . 40 PRO CD 1 1 27 16731 1 1 40 PRO CG C 1.305 -1.349 6.995 1.00 . A A . 40 PRO CG 1 1 27 16732 1 1 40 PRO HA H 2.972 0.764 8.104 1.00 . A A . 40 PRO HA 1 1 27 16733 1 1 40 PRO HB2 H 3.281 -2.094 7.319 1.00 . A A . 40 PRO HB2 1 1 27 16734 1 1 40 PRO HB3 H 2.517 -1.397 8.752 1.00 . A A . 40 PRO HB3 1 1 27 16735 1 1 40 PRO HD2 H 1.776 -1.208 4.917 1.00 . A A . 40 PRO HD2 1 1 27 16736 1 1 40 PRO HD3 H 0.564 -0.039 5.480 1.00 . A A . 40 PRO HD3 1 1 27 16737 1 1 40 PRO HG2 H 1.036 -2.370 6.768 1.00 . A A . 40 PRO HG2 1 1 27 16738 1 1 40 PRO HG3 H 0.554 -0.892 7.622 1.00 . A A . 40 PRO HG3 1 1 27 16739 1 1 40 PRO N N 2.552 0.395 6.063 1.00 . A A . 40 PRO N 1 1 27 16740 1 1 40 PRO O O 5.266 0.111 6.083 1.00 . A A . 40 PRO O 1 1 27 16741 1 1 41 SER C C 7.312 -1.716 8.920 1.00 . A A . 41 SER C 1 1 27 16742 1 1 41 SER CA C 6.866 -0.401 8.287 1.00 . A A . 41 SER CA 1 1 27 16743 1 1 41 SER CB C 7.493 0.779 9.033 1.00 . A A . 41 SER CB 1 1 27 16744 1 1 41 SER H H 4.927 -0.398 9.137 1.00 . A A . 41 SER H 1 1 27 16745 1 1 41 SER HA H 7.196 -0.381 7.259 1.00 . A A . 41 SER HA 1 1 27 16746 1 1 41 SER HB2 H 7.668 0.501 10.061 1.00 . A A . 41 SER HB2 1 1 27 16747 1 1 41 SER HB3 H 8.431 1.040 8.566 1.00 . A A . 41 SER HB3 1 1 27 16748 1 1 41 SER HG H 6.779 2.398 8.191 1.00 . A A . 41 SER HG 1 1 27 16749 1 1 41 SER N N 5.412 -0.288 8.292 1.00 . A A . 41 SER N 1 1 27 16750 1 1 41 SER O O 7.948 -1.727 9.974 1.00 . A A . 41 SER O 1 1 27 16751 1 1 41 SER OG O 6.640 1.911 9.006 1.00 . A A . 41 SER OG 1 1 27 16752 1 1 42 TYR C C 7.725 -5.072 7.618 1.00 . A A . 42 TYR C 1 1 27 16753 1 1 42 TYR CA C 7.337 -4.145 8.767 1.00 . A A . 42 TYR CA 1 1 27 16754 1 1 42 TYR CB C 6.178 -4.752 9.559 1.00 . A A . 42 TYR CB 1 1 27 16755 1 1 42 TYR CD1 C 3.818 -4.174 8.874 1.00 . A A . 42 TYR CD1 1 1 27 16756 1 1 42 TYR CD2 C 4.879 -6.023 7.806 1.00 . A A . 42 TYR CD2 1 1 27 16757 1 1 42 TYR CE1 C 2.680 -4.385 8.119 1.00 . A A . 42 TYR CE1 1 1 27 16758 1 1 42 TYR CE2 C 3.744 -6.240 7.047 1.00 . A A . 42 TYR CE2 1 1 27 16759 1 1 42 TYR CG C 4.935 -4.987 8.731 1.00 . A A . 42 TYR CG 1 1 27 16760 1 1 42 TYR CZ C 2.648 -5.419 7.207 1.00 . A A . 42 TYR CZ 1 1 27 16761 1 1 42 TYR H H 6.465 -2.751 7.434 1.00 . A A . 42 TYR H 1 1 27 16762 1 1 42 TYR HA H 8.187 -4.028 9.423 1.00 . A A . 42 TYR HA 1 1 27 16763 1 1 42 TYR HB2 H 6.488 -5.703 9.967 1.00 . A A . 42 TYR HB2 1 1 27 16764 1 1 42 TYR HB3 H 5.917 -4.087 10.369 1.00 . A A . 42 TYR HB3 1 1 27 16765 1 1 42 TYR HD1 H 3.846 -3.364 9.588 1.00 . A A . 42 TYR HD1 1 1 27 16766 1 1 42 TYR HD2 H 5.738 -6.665 7.684 1.00 . A A . 42 TYR HD2 1 1 27 16767 1 1 42 TYR HE1 H 1.822 -3.742 8.244 1.00 . A A . 42 TYR HE1 1 1 27 16768 1 1 42 TYR HE2 H 3.720 -7.051 6.334 1.00 . A A . 42 TYR HE2 1 1 27 16769 1 1 42 TYR HH H 0.921 -6.217 6.928 1.00 . A A . 42 TYR HH 1 1 27 16770 1 1 42 TYR N N 6.972 -2.824 8.269 1.00 . A A . 42 TYR N 1 1 27 16771 1 1 42 TYR O O 7.213 -4.944 6.506 1.00 . A A . 42 TYR O 1 1 27 16772 1 1 42 TYR OH O 1.517 -5.633 6.453 1.00 . A A . 42 TYR OH 1 1 27 16773 1 1 43 PRO C C 7.933 -7.690 6.170 1.00 . A A . 43 PRO C 1 1 27 16774 1 1 43 PRO CA C 9.094 -6.975 6.853 1.00 . A A . 43 PRO CA 1 1 27 16775 1 1 43 PRO CB C 9.942 -7.972 7.647 1.00 . A A . 43 PRO CB 1 1 27 16776 1 1 43 PRO CD C 9.300 -6.248 9.172 1.00 . A A . 43 PRO CD 1 1 27 16777 1 1 43 PRO CG C 10.407 -7.209 8.839 1.00 . A A . 43 PRO CG 1 1 27 16778 1 1 43 PRO HA H 9.706 -6.491 6.107 1.00 . A A . 43 PRO HA 1 1 27 16779 1 1 43 PRO HB2 H 9.335 -8.819 7.931 1.00 . A A . 43 PRO HB2 1 1 27 16780 1 1 43 PRO HB3 H 10.773 -8.303 7.043 1.00 . A A . 43 PRO HB3 1 1 27 16781 1 1 43 PRO HD2 H 8.617 -6.691 9.882 1.00 . A A . 43 PRO HD2 1 1 27 16782 1 1 43 PRO HD3 H 9.705 -5.326 9.562 1.00 . A A . 43 PRO HD3 1 1 27 16783 1 1 43 PRO HG2 H 10.579 -7.885 9.664 1.00 . A A . 43 PRO HG2 1 1 27 16784 1 1 43 PRO HG3 H 11.312 -6.670 8.600 1.00 . A A . 43 PRO HG3 1 1 27 16785 1 1 43 PRO N N 8.639 -6.024 7.873 1.00 . A A . 43 PRO N 1 1 27 16786 1 1 43 PRO O O 7.067 -8.262 6.832 1.00 . A A . 43 PRO O 1 1 27 16787 1 1 44 GLY C C 6.789 -9.792 4.361 1.00 . A A . 44 GLY C 1 1 27 16788 1 1 44 GLY CA C 6.863 -8.303 4.091 1.00 . A A . 44 GLY CA 1 1 27 16789 1 1 44 GLY H H 8.639 -7.184 4.367 1.00 . A A . 44 GLY H 1 1 27 16790 1 1 44 GLY HA2 H 7.038 -8.148 3.036 1.00 . A A . 44 GLY HA2 1 1 27 16791 1 1 44 GLY HA3 H 5.919 -7.852 4.359 1.00 . A A . 44 GLY HA3 1 1 27 16792 1 1 44 GLY N N 7.922 -7.654 4.842 1.00 . A A . 44 GLY N 1 1 27 16793 1 1 44 GLY O O 6.053 -10.492 3.634 1.00 . A A . 44 GLY O 1 1 27 16794 1 1 44 GLY OXT O 7.467 -10.260 5.300 1.00 . A A . 44 GLY OXT 1 1 28 16795 1 1 1 ALA C C -10.212 15.684 -3.029 1.00 . A A . 1 ALA C 1 1 28 16796 1 1 1 ALA CA C -10.345 14.946 -4.356 1.00 . A A . 1 ALA CA 1 1 28 16797 1 1 1 ALA CB C -8.971 14.699 -4.962 1.00 . A A . 1 ALA CB 1 1 28 16798 1 1 1 ALA H1 H -10.902 16.703 -5.269 1.00 . A A . 1 ALA H1 1 1 28 16799 1 1 1 ALA H2 H -11.050 15.306 -6.255 1.00 . A A . 1 ALA H2 1 1 28 16800 1 1 1 ALA H3 H -12.186 15.595 -5.004 1.00 . A A . 1 ALA H3 1 1 28 16801 1 1 1 ALA HA H -10.808 13.987 -4.176 1.00 . A A . 1 ALA HA 1 1 28 16802 1 1 1 ALA HB1 H -8.316 14.283 -4.211 1.00 . A A . 1 ALA HB1 1 1 28 16803 1 1 1 ALA HB2 H -8.563 15.633 -5.320 1.00 . A A . 1 ALA HB2 1 1 28 16804 1 1 1 ALA HB3 H -9.060 14.006 -5.786 1.00 . A A . 1 ALA HB3 1 1 28 16805 1 1 1 ALA N N -11.197 15.706 -5.307 1.00 . A A . 1 ALA N 1 1 28 16806 1 1 1 ALA O O -9.686 16.796 -2.975 1.00 . A A . 1 ALA O 1 1 28 16807 1 1 2 MET C C -10.743 14.590 0.453 1.00 . A A . 2 MET C 1 1 28 16808 1 1 2 MET CA C -10.627 15.657 -0.631 1.00 . A A . 2 MET CA 1 1 28 16809 1 1 2 MET CB C -11.737 16.696 -0.461 1.00 . A A . 2 MET CB 1 1 28 16810 1 1 2 MET CE C -13.646 19.382 0.635 1.00 . A A . 2 MET CE 1 1 28 16811 1 1 2 MET CG C -11.651 17.470 0.844 1.00 . A A . 2 MET CG 1 1 28 16812 1 1 2 MET H H -11.100 14.174 -2.065 1.00 . A A . 2 MET H 1 1 28 16813 1 1 2 MET HA H -9.669 16.147 -0.535 1.00 . A A . 2 MET HA 1 1 28 16814 1 1 2 MET HB2 H -11.682 17.401 -1.278 1.00 . A A . 2 MET HB2 1 1 28 16815 1 1 2 MET HB3 H -12.692 16.194 -0.495 1.00 . A A . 2 MET HB3 1 1 28 16816 1 1 2 MET HE1 H -12.833 20.082 0.758 1.00 . A A . 2 MET HE1 1 1 28 16817 1 1 2 MET HE2 H -13.776 19.161 -0.414 1.00 . A A . 2 MET HE2 1 1 28 16818 1 1 2 MET HE3 H -14.555 19.814 1.027 1.00 . A A . 2 MET HE3 1 1 28 16819 1 1 2 MET HG2 H -11.113 16.874 1.566 1.00 . A A . 2 MET HG2 1 1 28 16820 1 1 2 MET HG3 H -11.113 18.390 0.666 1.00 . A A . 2 MET HG3 1 1 28 16821 1 1 2 MET N N -10.692 15.059 -1.959 1.00 . A A . 2 MET N 1 1 28 16822 1 1 2 MET O O -9.905 14.508 1.350 1.00 . A A . 2 MET O 1 1 28 16823 1 1 2 MET SD S -13.273 17.871 1.521 1.00 . A A . 2 MET SD 1 1 28 16824 1 1 3 ASP C C -11.707 11.345 0.731 1.00 . A A . 3 ASP C 1 1 28 16825 1 1 3 ASP CA C -12.015 12.712 1.336 1.00 . A A . 3 ASP CA 1 1 28 16826 1 1 3 ASP CB C -13.461 12.747 1.834 1.00 . A A . 3 ASP CB 1 1 28 16827 1 1 3 ASP CG C -14.465 12.624 0.705 1.00 . A A . 3 ASP CG 1 1 28 16828 1 1 3 ASP H H -12.423 13.889 -0.376 1.00 . A A . 3 ASP H 1 1 28 16829 1 1 3 ASP HA H -11.352 12.880 2.171 1.00 . A A . 3 ASP HA 1 1 28 16830 1 1 3 ASP HB2 H -13.619 11.930 2.521 1.00 . A A . 3 ASP HB2 1 1 28 16831 1 1 3 ASP HB3 H -13.635 13.682 2.346 1.00 . A A . 3 ASP HB3 1 1 28 16832 1 1 3 ASP N N -11.789 13.774 0.363 1.00 . A A . 3 ASP N 1 1 28 16833 1 1 3 ASP O O -12.323 10.343 1.093 1.00 . A A . 3 ASP O 1 1 28 16834 1 1 3 ASP OD1 O -14.530 11.542 0.084 1.00 . A A . 3 ASP OD1 1 1 28 16835 1 1 3 ASP OD2 O -15.186 13.609 0.441 1.00 . A A . 3 ASP OD2 1 1 28 16836 1 1 4 CYS C C -8.961 9.643 -0.412 1.00 . A A . 4 CYS C 1 1 28 16837 1 1 4 CYS CA C -10.360 10.070 -0.845 1.00 . A A . 4 CYS CA 1 1 28 16838 1 1 4 CYS CB C -10.412 10.232 -2.366 1.00 . A A . 4 CYS CB 1 1 28 16839 1 1 4 CYS H H -10.295 12.146 -0.436 1.00 . A A . 4 CYS H 1 1 28 16840 1 1 4 CYS HA H -11.063 9.306 -0.549 1.00 . A A . 4 CYS HA 1 1 28 16841 1 1 4 CYS HB2 H -10.426 11.284 -2.608 1.00 . A A . 4 CYS HB2 1 1 28 16842 1 1 4 CYS HB3 H -9.533 9.780 -2.801 1.00 . A A . 4 CYS HB3 1 1 28 16843 1 1 4 CYS N N -10.750 11.314 -0.190 1.00 . A A . 4 CYS N 1 1 28 16844 1 1 4 CYS O O -7.986 10.364 -0.627 1.00 . A A . 4 CYS O 1 1 28 16845 1 1 4 CYS SG S -11.872 9.468 -3.144 1.00 . A A . 4 CYS SG 1 1 28 16846 1 1 5 THR C C -6.647 7.694 -0.508 1.00 . A A . 5 THR C 1 1 28 16847 1 1 5 THR CA C -7.590 7.943 0.665 1.00 . A A . 5 THR CA 1 1 28 16848 1 1 5 THR CB C -7.801 6.648 1.449 1.00 . A A . 5 THR CB 1 1 28 16849 1 1 5 THR CG2 C -8.564 6.848 2.741 1.00 . A A . 5 THR CG2 1 1 28 16850 1 1 5 THR H H -9.682 7.939 0.343 1.00 . A A . 5 THR H 1 1 28 16851 1 1 5 THR HA H -7.147 8.681 1.317 1.00 . A A . 5 THR HA 1 1 28 16852 1 1 5 THR HB H -6.837 6.228 1.697 1.00 . A A . 5 THR HB 1 1 28 16853 1 1 5 THR HG1 H -7.943 5.366 -0.025 1.00 . A A . 5 THR HG1 1 1 28 16854 1 1 5 THR HG21 H -9.146 7.755 2.678 1.00 . A A . 5 THR HG21 1 1 28 16855 1 1 5 THR HG22 H -9.223 6.008 2.903 1.00 . A A . 5 THR HG22 1 1 28 16856 1 1 5 THR HG23 H -7.867 6.923 3.563 1.00 . A A . 5 THR HG23 1 1 28 16857 1 1 5 THR N N -8.869 8.467 0.200 1.00 . A A . 5 THR N 1 1 28 16858 1 1 5 THR O O -6.857 6.778 -1.302 1.00 . A A . 5 THR O 1 1 28 16859 1 1 5 THR OG1 O -8.512 5.701 0.672 1.00 . A A . 5 THR OG1 1 1 28 16860 1 1 6 THR C C -3.246 8.068 -1.132 1.00 . A A . 6 THR C 1 1 28 16861 1 1 6 THR CA C -4.631 8.385 -1.687 1.00 . A A . 6 THR CA 1 1 28 16862 1 1 6 THR CB C -4.580 9.670 -2.514 1.00 . A A . 6 THR CB 1 1 28 16863 1 1 6 THR CG2 C -3.798 9.521 -3.802 1.00 . A A . 6 THR CG2 1 1 28 16864 1 1 6 THR H H -5.493 9.228 0.054 1.00 . A A . 6 THR H 1 1 28 16865 1 1 6 THR HA H -4.946 7.571 -2.322 1.00 . A A . 6 THR HA 1 1 28 16866 1 1 6 THR HB H -4.106 10.445 -1.928 1.00 . A A . 6 THR HB 1 1 28 16867 1 1 6 THR HG1 H -6.276 9.486 -3.475 1.00 . A A . 6 THR HG1 1 1 28 16868 1 1 6 THR HG21 H -3.714 8.474 -4.053 1.00 . A A . 6 THR HG21 1 1 28 16869 1 1 6 THR HG22 H -4.312 10.042 -4.597 1.00 . A A . 6 THR HG22 1 1 28 16870 1 1 6 THR HG23 H -2.812 9.942 -3.675 1.00 . A A . 6 THR HG23 1 1 28 16871 1 1 6 THR N N -5.607 8.516 -0.610 1.00 . A A . 6 THR N 1 1 28 16872 1 1 6 THR O O -2.941 8.380 0.019 1.00 . A A . 6 THR O 1 1 28 16873 1 1 6 THR OG1 O -5.886 10.102 -2.852 1.00 . A A . 6 THR OG1 1 1 28 16874 1 1 7 GLY C C -0.558 5.835 -2.202 1.00 . A A . 7 GLY C 1 1 28 16875 1 1 7 GLY CA C -1.069 7.098 -1.534 1.00 . A A . 7 GLY CA 1 1 28 16876 1 1 7 GLY H H -2.710 7.224 -2.865 1.00 . A A . 7 GLY H 1 1 28 16877 1 1 7 GLY HA2 H -1.068 6.952 -0.464 1.00 . A A . 7 GLY HA2 1 1 28 16878 1 1 7 GLY HA3 H -0.404 7.914 -1.775 1.00 . A A . 7 GLY HA3 1 1 28 16879 1 1 7 GLY N N -2.412 7.447 -1.959 1.00 . A A . 7 GLY N 1 1 28 16880 1 1 7 GLY O O -1.175 5.335 -3.142 1.00 . A A . 7 GLY O 1 1 28 16881 1 1 8 PRO C C 0.351 2.827 -1.971 1.00 . A A . 8 PRO C 1 1 28 16882 1 1 8 PRO CA C 1.164 4.073 -2.304 1.00 . A A . 8 PRO CA 1 1 28 16883 1 1 8 PRO CB C 2.543 4.002 -1.647 1.00 . A A . 8 PRO CB 1 1 28 16884 1 1 8 PRO CD C 1.383 5.821 -0.617 1.00 . A A . 8 PRO CD 1 1 28 16885 1 1 8 PRO CG C 2.384 4.729 -0.357 1.00 . A A . 8 PRO CG 1 1 28 16886 1 1 8 PRO HA H 1.276 4.152 -3.376 1.00 . A A . 8 PRO HA 1 1 28 16887 1 1 8 PRO HB2 H 2.817 2.969 -1.488 1.00 . A A . 8 PRO HB2 1 1 28 16888 1 1 8 PRO HB3 H 3.274 4.481 -2.282 1.00 . A A . 8 PRO HB3 1 1 28 16889 1 1 8 PRO HD2 H 0.768 5.984 0.256 1.00 . A A . 8 PRO HD2 1 1 28 16890 1 1 8 PRO HD3 H 1.884 6.734 -0.902 1.00 . A A . 8 PRO HD3 1 1 28 16891 1 1 8 PRO HG2 H 2.016 4.055 0.402 1.00 . A A . 8 PRO HG2 1 1 28 16892 1 1 8 PRO HG3 H 3.331 5.154 -0.056 1.00 . A A . 8 PRO HG3 1 1 28 16893 1 1 8 PRO N N 0.579 5.291 -1.735 1.00 . A A . 8 PRO N 1 1 28 16894 1 1 8 PRO O O 0.220 1.921 -2.793 1.00 . A A . 8 PRO O 1 1 28 16895 1 1 9 CYS C C -2.485 1.959 -0.429 1.00 . A A . 9 CYS C 1 1 28 16896 1 1 9 CYS CA C -0.994 1.652 -0.316 1.00 . A A . 9 CYS CA 1 1 28 16897 1 1 9 CYS CB C -0.639 1.284 1.127 1.00 . A A . 9 CYS CB 1 1 28 16898 1 1 9 CYS H H -0.053 3.541 -0.147 1.00 . A A . 9 CYS H 1 1 28 16899 1 1 9 CYS HA H -0.763 0.815 -0.958 1.00 . A A . 9 CYS HA 1 1 28 16900 1 1 9 CYS HB2 H -0.110 2.108 1.580 1.00 . A A . 9 CYS HB2 1 1 28 16901 1 1 9 CYS HB3 H -1.549 1.100 1.680 1.00 . A A . 9 CYS HB3 1 1 28 16902 1 1 9 CYS N N -0.194 2.788 -0.759 1.00 . A A . 9 CYS N 1 1 28 16903 1 1 9 CYS O O -3.292 1.467 0.359 1.00 . A A . 9 CYS O 1 1 28 16904 1 1 9 CYS SG S 0.411 -0.197 1.278 1.00 . A A . 9 CYS SG 1 1 28 16905 1 1 10 CYS C C -4.529 3.299 -3.122 1.00 . A A . 10 CYS C 1 1 28 16906 1 1 10 CYS CA C -4.234 3.148 -1.633 1.00 . A A . 10 CYS CA 1 1 28 16907 1 1 10 CYS CB C -4.556 4.451 -0.899 1.00 . A A . 10 CYS CB 1 1 28 16908 1 1 10 CYS H H -2.152 3.135 -2.011 1.00 . A A . 10 CYS H 1 1 28 16909 1 1 10 CYS HA H -4.855 2.359 -1.235 1.00 . A A . 10 CYS HA 1 1 28 16910 1 1 10 CYS HB2 H -3.758 5.159 -1.071 1.00 . A A . 10 CYS HB2 1 1 28 16911 1 1 10 CYS HB3 H -5.479 4.855 -1.287 1.00 . A A . 10 CYS HB3 1 1 28 16912 1 1 10 CYS N N -2.842 2.775 -1.415 1.00 . A A . 10 CYS N 1 1 28 16913 1 1 10 CYS O O -3.616 3.459 -3.932 1.00 . A A . 10 CYS O 1 1 28 16914 1 1 10 CYS SG S -4.746 4.259 0.903 1.00 . A A . 10 CYS SG 1 1 28 16915 1 1 11 ARG C C -6.642 4.807 -5.184 1.00 . A A . 11 ARG C 1 1 28 16916 1 1 11 ARG CA C -6.222 3.375 -4.869 1.00 . A A . 11 ARG CA 1 1 28 16917 1 1 11 ARG CB C -7.374 2.415 -5.171 1.00 . A A . 11 ARG CB 1 1 28 16918 1 1 11 ARG CD C -6.898 0.919 -7.132 1.00 . A A . 11 ARG CD 1 1 28 16919 1 1 11 ARG CG C -6.916 1.036 -5.617 1.00 . A A . 11 ARG CG 1 1 28 16920 1 1 11 ARG CZ C -8.582 -0.839 -7.515 1.00 . A A . 11 ARG CZ 1 1 28 16921 1 1 11 ARG H H -6.491 3.115 -2.785 1.00 . A A . 11 ARG H 1 1 28 16922 1 1 11 ARG HA H -5.378 3.116 -5.490 1.00 . A A . 11 ARG HA 1 1 28 16923 1 1 11 ARG HB2 H -7.975 2.301 -4.281 1.00 . A A . 11 ARG HB2 1 1 28 16924 1 1 11 ARG HB3 H -7.985 2.839 -5.954 1.00 . A A . 11 ARG HB3 1 1 28 16925 1 1 11 ARG HD2 H -7.561 1.663 -7.547 1.00 . A A . 11 ARG HD2 1 1 28 16926 1 1 11 ARG HD3 H -5.892 1.100 -7.482 1.00 . A A . 11 ARG HD3 1 1 28 16927 1 1 11 ARG HE H -6.643 -0.996 -7.960 1.00 . A A . 11 ARG HE 1 1 28 16928 1 1 11 ARG HG2 H -5.920 0.859 -5.240 1.00 . A A . 11 ARG HG2 1 1 28 16929 1 1 11 ARG HG3 H -7.593 0.296 -5.215 1.00 . A A . 11 ARG HG3 1 1 28 16930 1 1 11 ARG HH11 H -9.312 0.855 -6.684 1.00 . A A . 11 ARG HH11 1 1 28 16931 1 1 11 ARG HH12 H -10.476 -0.396 -6.964 1.00 . A A . 11 ARG HH12 1 1 28 16932 1 1 11 ARG HH21 H -8.173 -2.643 -8.329 1.00 . A A . 11 ARG HH21 1 1 28 16933 1 1 11 ARG HH22 H -9.830 -2.382 -7.897 1.00 . A A . 11 ARG HH22 1 1 28 16934 1 1 11 ARG N N -5.809 3.246 -3.476 1.00 . A A . 11 ARG N 1 1 28 16935 1 1 11 ARG NE N -7.326 -0.403 -7.585 1.00 . A A . 11 ARG NE 1 1 28 16936 1 1 11 ARG NH1 N -9.535 -0.063 -7.013 1.00 . A A . 11 ARG NH1 1 1 28 16937 1 1 11 ARG NH2 N -8.886 -2.054 -7.949 1.00 . A A . 11 ARG NH2 1 1 28 16938 1 1 11 ARG O O -7.520 5.037 -6.016 1.00 . A A . 11 ARG O 1 1 28 16939 1 1 12 GLN C C -7.697 7.541 -4.175 1.00 . A A . 12 GLN C 1 1 28 16940 1 1 12 GLN CA C -6.317 7.181 -4.723 1.00 . A A . 12 GLN CA 1 1 28 16941 1 1 12 GLN CB C -6.251 7.523 -6.212 1.00 . A A . 12 GLN CB 1 1 28 16942 1 1 12 GLN CD C -4.384 9.070 -6.919 1.00 . A A . 12 GLN CD 1 1 28 16943 1 1 12 GLN CG C -5.833 8.958 -6.489 1.00 . A A . 12 GLN CG 1 1 28 16944 1 1 12 GLN H H -5.320 5.521 -3.865 1.00 . A A . 12 GLN H 1 1 28 16945 1 1 12 GLN HA H -5.573 7.761 -4.199 1.00 . A A . 12 GLN HA 1 1 28 16946 1 1 12 GLN HB2 H -5.541 6.864 -6.689 1.00 . A A . 12 GLN HB2 1 1 28 16947 1 1 12 GLN HB3 H -7.226 7.364 -6.646 1.00 . A A . 12 GLN HB3 1 1 28 16948 1 1 12 GLN HE21 H -4.753 10.815 -7.797 1.00 . A A . 12 GLN HE21 1 1 28 16949 1 1 12 GLN HE22 H -3.122 10.255 -7.899 1.00 . A A . 12 GLN HE22 1 1 28 16950 1 1 12 GLN HG2 H -6.457 9.355 -7.276 1.00 . A A . 12 GLN HG2 1 1 28 16951 1 1 12 GLN HG3 H -5.974 9.541 -5.591 1.00 . A A . 12 GLN HG3 1 1 28 16952 1 1 12 GLN N N -6.010 5.768 -4.514 1.00 . A A . 12 GLN N 1 1 28 16953 1 1 12 GLN NE2 N -4.053 10.156 -7.608 1.00 . A A . 12 GLN NE2 1 1 28 16954 1 1 12 GLN O O -8.197 8.641 -4.410 1.00 . A A . 12 GLN O 1 1 28 16955 1 1 12 GLN OE1 O -3.570 8.191 -6.636 1.00 . A A . 12 GLN OE1 1 1 28 16956 1 1 13 CYS C C -9.947 5.828 -1.780 1.00 . A A . 13 CYS C 1 1 28 16957 1 1 13 CYS CA C -9.630 6.847 -2.871 1.00 . A A . 13 CYS CA 1 1 28 16958 1 1 13 CYS CB C -10.700 6.792 -3.963 1.00 . A A . 13 CYS CB 1 1 28 16959 1 1 13 CYS H H -7.866 5.757 -3.289 1.00 . A A . 13 CYS H 1 1 28 16960 1 1 13 CYS HA H -9.629 7.834 -2.433 1.00 . A A . 13 CYS HA 1 1 28 16961 1 1 13 CYS HB2 H -10.357 6.148 -4.759 1.00 . A A . 13 CYS HB2 1 1 28 16962 1 1 13 CYS HB3 H -11.610 6.386 -3.546 1.00 . A A . 13 CYS HB3 1 1 28 16963 1 1 13 CYS N N -8.310 6.614 -3.444 1.00 . A A . 13 CYS N 1 1 28 16964 1 1 13 CYS O O -10.506 6.175 -0.739 1.00 . A A . 13 CYS O 1 1 28 16965 1 1 13 CYS SG S -11.099 8.412 -4.696 1.00 . A A . 13 CYS SG 1 1 28 16966 1 1 14 LYS C C -8.571 2.721 -0.763 1.00 . A A . 14 LYS C 1 1 28 16967 1 1 14 LYS CA C -9.843 3.508 -1.055 1.00 . A A . 14 LYS CA 1 1 28 16968 1 1 14 LYS CB C -10.931 2.567 -1.574 1.00 . A A . 14 LYS CB 1 1 28 16969 1 1 14 LYS CD C -13.041 2.382 -2.927 1.00 . A A . 14 LYS CD 1 1 28 16970 1 1 14 LYS CE C -14.115 3.170 -3.658 1.00 . A A . 14 LYS CE 1 1 28 16971 1 1 14 LYS CG C -12.177 3.287 -2.064 1.00 . A A . 14 LYS CG 1 1 28 16972 1 1 14 LYS H H -9.149 4.350 -2.868 1.00 . A A . 14 LYS H 1 1 28 16973 1 1 14 LYS HA H -10.185 3.968 -0.140 1.00 . A A . 14 LYS HA 1 1 28 16974 1 1 14 LYS HB2 H -10.530 1.989 -2.393 1.00 . A A . 14 LYS HB2 1 1 28 16975 1 1 14 LYS HB3 H -11.220 1.895 -0.779 1.00 . A A . 14 LYS HB3 1 1 28 16976 1 1 14 LYS HD2 H -12.414 1.888 -3.654 1.00 . A A . 14 LYS HD2 1 1 28 16977 1 1 14 LYS HD3 H -13.514 1.644 -2.296 1.00 . A A . 14 LYS HD3 1 1 28 16978 1 1 14 LYS HE2 H -13.783 4.192 -3.768 1.00 . A A . 14 LYS HE2 1 1 28 16979 1 1 14 LYS HE3 H -14.262 2.733 -4.635 1.00 . A A . 14 LYS HE3 1 1 28 16980 1 1 14 LYS HG2 H -12.753 3.610 -1.210 1.00 . A A . 14 LYS HG2 1 1 28 16981 1 1 14 LYS HG3 H -11.878 4.147 -2.645 1.00 . A A . 14 LYS HG3 1 1 28 16982 1 1 14 LYS HZ1 H -15.734 2.180 -2.783 1.00 . A A . 14 LYS HZ1 1 1 28 16983 1 1 14 LYS HZ2 H -15.297 3.611 -1.993 1.00 . A A . 14 LYS HZ2 1 1 28 16984 1 1 14 LYS HZ3 H -16.132 3.677 -3.462 1.00 . A A . 14 LYS HZ3 1 1 28 16985 1 1 14 LYS N N -9.590 4.570 -2.021 1.00 . A A . 14 LYS N 1 1 28 16986 1 1 14 LYS NZ N -15.410 3.159 -2.922 1.00 . A A . 14 LYS NZ 1 1 28 16987 1 1 14 LYS O O -7.627 2.732 -1.553 1.00 . A A . 14 LYS O 1 1 28 16988 1 1 15 LEU C C -7.093 0.171 -0.269 1.00 . A A . 15 LEU C 1 1 28 16989 1 1 15 LEU CA C -7.399 1.241 0.773 1.00 . A A . 15 LEU CA 1 1 28 16990 1 1 15 LEU CB C -7.649 0.586 2.133 1.00 . A A . 15 LEU CB 1 1 28 16991 1 1 15 LEU CD1 C -8.419 0.788 4.509 1.00 . A A . 15 LEU CD1 1 1 28 16992 1 1 15 LEU CD2 C -6.825 2.468 3.565 1.00 . A A . 15 LEU CD2 1 1 28 16993 1 1 15 LEU CG C -8.002 1.553 3.263 1.00 . A A . 15 LEU CG 1 1 28 16994 1 1 15 LEU H H -9.338 2.067 0.963 1.00 . A A . 15 LEU H 1 1 28 16995 1 1 15 LEU HA H -6.551 1.904 0.853 1.00 . A A . 15 LEU HA 1 1 28 16996 1 1 15 LEU HB2 H -8.459 -0.121 2.025 1.00 . A A . 15 LEU HB2 1 1 28 16997 1 1 15 LEU HB3 H -6.758 0.046 2.417 1.00 . A A . 15 LEU HB3 1 1 28 16998 1 1 15 LEU HD11 H -7.764 -0.059 4.647 1.00 . A A . 15 LEU HD11 1 1 28 16999 1 1 15 LEU HD12 H -8.355 1.438 5.369 1.00 . A A . 15 LEU HD12 1 1 28 17000 1 1 15 LEU HD13 H -9.436 0.441 4.395 1.00 . A A . 15 LEU HD13 1 1 28 17001 1 1 15 LEU HD21 H -5.905 1.907 3.491 1.00 . A A . 15 LEU HD21 1 1 28 17002 1 1 15 LEU HD22 H -6.809 3.281 2.855 1.00 . A A . 15 LEU HD22 1 1 28 17003 1 1 15 LEU HD23 H -6.925 2.864 4.565 1.00 . A A . 15 LEU HD23 1 1 28 17004 1 1 15 LEU HG H -8.835 2.168 2.954 1.00 . A A . 15 LEU HG 1 1 28 17005 1 1 15 LEU N N -8.554 2.037 0.376 1.00 . A A . 15 LEU N 1 1 28 17006 1 1 15 LEU O O -7.988 -0.541 -0.723 1.00 . A A . 15 LEU O 1 1 28 17007 1 1 16 LYS C C -5.743 -2.336 -1.165 1.00 . A A . 16 LYS C 1 1 28 17008 1 1 16 LYS CA C -5.401 -0.923 -1.631 1.00 . A A . 16 LYS CA 1 1 28 17009 1 1 16 LYS CB C -3.898 -0.804 -1.893 1.00 . A A . 16 LYS CB 1 1 28 17010 1 1 16 LYS CD C -2.073 0.195 -3.302 1.00 . A A . 16 LYS CD 1 1 28 17011 1 1 16 LYS CE C -1.681 0.569 -4.722 1.00 . A A . 16 LYS CE 1 1 28 17012 1 1 16 LYS CG C -3.562 -0.093 -3.193 1.00 . A A . 16 LYS CG 1 1 28 17013 1 1 16 LYS H H -5.153 0.658 -0.245 1.00 . A A . 16 LYS H 1 1 28 17014 1 1 16 LYS HA H -5.935 -0.720 -2.548 1.00 . A A . 16 LYS HA 1 1 28 17015 1 1 16 LYS HB2 H -3.445 -0.255 -1.080 1.00 . A A . 16 LYS HB2 1 1 28 17016 1 1 16 LYS HB3 H -3.469 -1.795 -1.929 1.00 . A A . 16 LYS HB3 1 1 28 17017 1 1 16 LYS HD2 H -1.825 1.014 -2.644 1.00 . A A . 16 LYS HD2 1 1 28 17018 1 1 16 LYS HD3 H -1.523 -0.687 -3.006 1.00 . A A . 16 LYS HD3 1 1 28 17019 1 1 16 LYS HE2 H -2.370 0.099 -5.408 1.00 . A A . 16 LYS HE2 1 1 28 17020 1 1 16 LYS HE3 H -1.743 1.642 -4.829 1.00 . A A . 16 LYS HE3 1 1 28 17021 1 1 16 LYS HG2 H -3.858 -0.718 -4.022 1.00 . A A . 16 LYS HG2 1 1 28 17022 1 1 16 LYS HG3 H -4.104 0.841 -3.232 1.00 . A A . 16 LYS HG3 1 1 28 17023 1 1 16 LYS HZ1 H -0.039 -0.699 -4.477 1.00 . A A . 16 LYS HZ1 1 1 28 17024 1 1 16 LYS HZ2 H -0.232 -0.127 -6.057 1.00 . A A . 16 LYS HZ2 1 1 28 17025 1 1 16 LYS HZ3 H 0.378 0.896 -4.855 1.00 . A A . 16 LYS HZ3 1 1 28 17026 1 1 16 LYS N N -5.823 0.063 -0.643 1.00 . A A . 16 LYS N 1 1 28 17027 1 1 16 LYS NZ N -0.296 0.129 -5.051 1.00 . A A . 16 LYS NZ 1 1 28 17028 1 1 16 LYS O O -5.764 -2.614 0.034 1.00 . A A . 16 LYS O 1 1 28 17029 1 1 17 PRO C C -5.344 -5.285 -0.849 1.00 . A A . 17 PRO C 1 1 28 17030 1 1 17 PRO CA C -6.359 -4.640 -1.787 1.00 . A A . 17 PRO CA 1 1 28 17031 1 1 17 PRO CB C -6.344 -5.336 -3.149 1.00 . A A . 17 PRO CB 1 1 28 17032 1 1 17 PRO CD C -6.015 -3.004 -3.564 1.00 . A A . 17 PRO CD 1 1 28 17033 1 1 17 PRO CG C -6.629 -4.254 -4.132 1.00 . A A . 17 PRO CG 1 1 28 17034 1 1 17 PRO HA H -7.345 -4.713 -1.353 1.00 . A A . 17 PRO HA 1 1 28 17035 1 1 17 PRO HB2 H -5.374 -5.780 -3.319 1.00 . A A . 17 PRO HB2 1 1 28 17036 1 1 17 PRO HB3 H -7.105 -6.101 -3.174 1.00 . A A . 17 PRO HB3 1 1 28 17037 1 1 17 PRO HD2 H -5.007 -2.878 -3.932 1.00 . A A . 17 PRO HD2 1 1 28 17038 1 1 17 PRO HD3 H -6.618 -2.143 -3.809 1.00 . A A . 17 PRO HD3 1 1 28 17039 1 1 17 PRO HG2 H -6.178 -4.494 -5.083 1.00 . A A . 17 PRO HG2 1 1 28 17040 1 1 17 PRO HG3 H -7.696 -4.130 -4.242 1.00 . A A . 17 PRO HG3 1 1 28 17041 1 1 17 PRO N N -6.017 -3.251 -2.110 1.00 . A A . 17 PRO N 1 1 28 17042 1 1 17 PRO O O -4.155 -5.359 -1.162 1.00 . A A . 17 PRO O 1 1 28 17043 1 1 18 ALA C C -4.104 -7.486 0.640 1.00 . A A . 18 ALA C 1 1 28 17044 1 1 18 ALA CA C -4.954 -6.395 1.285 1.00 . A A . 18 ALA CA 1 1 28 17045 1 1 18 ALA CB C -5.786 -6.974 2.420 1.00 . A A . 18 ALA CB 1 1 28 17046 1 1 18 ALA H H -6.777 -5.665 0.493 1.00 . A A . 18 ALA H 1 1 28 17047 1 1 18 ALA HA H -4.301 -5.640 1.698 1.00 . A A . 18 ALA HA 1 1 28 17048 1 1 18 ALA HB1 H -6.012 -6.195 3.134 1.00 . A A . 18 ALA HB1 1 1 28 17049 1 1 18 ALA HB2 H -5.230 -7.760 2.909 1.00 . A A . 18 ALA HB2 1 1 28 17050 1 1 18 ALA HB3 H -6.706 -7.377 2.024 1.00 . A A . 18 ALA HB3 1 1 28 17051 1 1 18 ALA N N -5.820 -5.753 0.301 1.00 . A A . 18 ALA N 1 1 28 17052 1 1 18 ALA O O -4.614 -8.536 0.251 1.00 . A A . 18 ALA O 1 1 28 17053 1 1 19 GLY C C -1.289 -7.680 -1.364 1.00 . A A . 19 GLY C 1 1 28 17054 1 1 19 GLY CA C -1.905 -8.189 -0.075 1.00 . A A . 19 GLY CA 1 1 28 17055 1 1 19 GLY H H -2.459 -6.369 0.854 1.00 . A A . 19 GLY H 1 1 28 17056 1 1 19 GLY HA2 H -2.452 -9.097 -0.284 1.00 . A A . 19 GLY HA2 1 1 28 17057 1 1 19 GLY HA3 H -1.113 -8.412 0.626 1.00 . A A . 19 GLY HA3 1 1 28 17058 1 1 19 GLY N N -2.807 -7.225 0.528 1.00 . A A . 19 GLY N 1 1 28 17059 1 1 19 GLY O O -0.873 -8.466 -2.214 1.00 . A A . 19 GLY O 1 1 28 17060 1 1 20 THR C C 0.761 -5.264 -2.426 1.00 . A A . 20 THR C 1 1 28 17061 1 1 20 THR CA C -0.660 -5.743 -2.699 1.00 . A A . 20 THR CA 1 1 28 17062 1 1 20 THR CB C -1.528 -4.571 -3.159 1.00 . A A . 20 THR CB 1 1 28 17063 1 1 20 THR CG2 C -1.083 -3.977 -4.478 1.00 . A A . 20 THR CG2 1 1 28 17064 1 1 20 THR H H -1.575 -5.784 -0.796 1.00 . A A . 20 THR H 1 1 28 17065 1 1 20 THR HA H -0.633 -6.489 -3.479 1.00 . A A . 20 THR HA 1 1 28 17066 1 1 20 THR HB H -1.484 -3.790 -2.413 1.00 . A A . 20 THR HB 1 1 28 17067 1 1 20 THR HG1 H -2.948 -5.613 -4.015 1.00 . A A . 20 THR HG1 1 1 28 17068 1 1 20 THR HG21 H -1.114 -4.738 -5.244 1.00 . A A . 20 THR HG21 1 1 28 17069 1 1 20 THR HG22 H -1.744 -3.166 -4.749 1.00 . A A . 20 THR HG22 1 1 28 17070 1 1 20 THR HG23 H -0.075 -3.603 -4.383 1.00 . A A . 20 THR HG23 1 1 28 17071 1 1 20 THR N N -1.230 -6.359 -1.508 1.00 . A A . 20 THR N 1 1 28 17072 1 1 20 THR O O 1.007 -4.539 -1.463 1.00 . A A . 20 THR O 1 1 28 17073 1 1 20 THR OG1 O -2.878 -4.973 -3.303 1.00 . A A . 20 THR OG1 1 1 28 17074 1 1 21 THR C C 3.241 -3.790 -2.931 1.00 . A A . 21 THR C 1 1 28 17075 1 1 21 THR CA C 3.094 -5.297 -3.122 1.00 . A A . 21 THR CA 1 1 28 17076 1 1 21 THR CB C 3.904 -5.751 -4.336 1.00 . A A . 21 THR CB 1 1 28 17077 1 1 21 THR CG2 C 4.698 -7.012 -4.081 1.00 . A A . 21 THR CG2 1 1 28 17078 1 1 21 THR H H 1.437 -6.259 -4.022 1.00 . A A . 21 THR H 1 1 28 17079 1 1 21 THR HA H 3.475 -5.794 -2.242 1.00 . A A . 21 THR HA 1 1 28 17080 1 1 21 THR HB H 4.602 -4.971 -4.606 1.00 . A A . 21 THR HB 1 1 28 17081 1 1 21 THR HG1 H 3.493 -5.708 -6.251 1.00 . A A . 21 THR HG1 1 1 28 17082 1 1 21 THR HG21 H 4.195 -7.607 -3.333 1.00 . A A . 21 THR HG21 1 1 28 17083 1 1 21 THR HG22 H 4.780 -7.578 -4.997 1.00 . A A . 21 THR HG22 1 1 28 17084 1 1 21 THR HG23 H 5.685 -6.749 -3.729 1.00 . A A . 21 THR HG23 1 1 28 17085 1 1 21 THR N N 1.694 -5.678 -3.276 1.00 . A A . 21 THR N 1 1 28 17086 1 1 21 THR O O 2.321 -3.024 -3.217 1.00 . A A . 21 THR O 1 1 28 17087 1 1 21 THR OG1 O 3.056 -5.994 -5.445 1.00 . A A . 21 THR OG1 1 1 28 17088 1 1 22 CYS C C 6.171 -1.671 -2.277 1.00 . A A . 22 CYS C 1 1 28 17089 1 1 22 CYS CA C 4.674 -1.962 -2.212 1.00 . A A . 22 CYS CA 1 1 28 17090 1 1 22 CYS CB C 4.116 -1.534 -0.854 1.00 . A A . 22 CYS CB 1 1 28 17091 1 1 22 CYS H H 5.100 -4.034 -2.234 1.00 . A A . 22 CYS H 1 1 28 17092 1 1 22 CYS HA H 4.177 -1.401 -2.989 1.00 . A A . 22 CYS HA 1 1 28 17093 1 1 22 CYS HB2 H 3.048 -1.695 -0.845 1.00 . A A . 22 CYS HB2 1 1 28 17094 1 1 22 CYS HB3 H 4.570 -2.137 -0.081 1.00 . A A . 22 CYS HB3 1 1 28 17095 1 1 22 CYS N N 4.406 -3.375 -2.444 1.00 . A A . 22 CYS N 1 1 28 17096 1 1 22 CYS O O 6.598 -0.705 -2.910 1.00 . A A . 22 CYS O 1 1 28 17097 1 1 22 CYS SG S 4.413 0.216 -0.440 1.00 . A A . 22 CYS SG 1 1 28 17098 1 1 23 TRP C C 9.093 -3.483 -0.862 1.00 . A A . 23 TRP C 1 1 28 17099 1 1 23 TRP CA C 8.411 -2.335 -1.599 1.00 . A A . 23 TRP CA 1 1 28 17100 1 1 23 TRP CB C 8.774 -1.006 -0.936 1.00 . A A . 23 TRP CB 1 1 28 17101 1 1 23 TRP CD1 C 11.048 0.171 -0.859 1.00 . A A . 23 TRP CD1 1 1 28 17102 1 1 23 TRP CD2 C 10.251 -0.152 -2.926 1.00 . A A . 23 TRP CD2 1 1 28 17103 1 1 23 TRP CE2 C 11.496 0.498 -3.022 1.00 . A A . 23 TRP CE2 1 1 28 17104 1 1 23 TRP CE3 C 9.560 -0.461 -4.101 1.00 . A A . 23 TRP CE3 1 1 28 17105 1 1 23 TRP CG C 9.983 -0.352 -1.533 1.00 . A A . 23 TRP CG 1 1 28 17106 1 1 23 TRP CH2 C 11.364 0.531 -5.379 1.00 . A A . 23 TRP CH2 1 1 28 17107 1 1 23 TRP CZ2 C 12.063 0.845 -4.246 1.00 . A A . 23 TRP CZ2 1 1 28 17108 1 1 23 TRP CZ3 C 10.124 -0.115 -5.315 1.00 . A A . 23 TRP CZ3 1 1 28 17109 1 1 23 TRP H H 6.566 -3.259 -1.127 1.00 . A A . 23 TRP H 1 1 28 17110 1 1 23 TRP HA H 8.757 -2.323 -2.622 1.00 . A A . 23 TRP HA 1 1 28 17111 1 1 23 TRP HB2 H 7.943 -0.324 -1.036 1.00 . A A . 23 TRP HB2 1 1 28 17112 1 1 23 TRP HB3 H 8.969 -1.177 0.112 1.00 . A A . 23 TRP HB3 1 1 28 17113 1 1 23 TRP HD1 H 11.145 0.175 0.217 1.00 . A A . 23 TRP HD1 1 1 28 17114 1 1 23 TRP HE1 H 12.810 1.114 -1.507 1.00 . A A . 23 TRP HE1 1 1 28 17115 1 1 23 TRP HE3 H 8.602 -0.959 -4.072 1.00 . A A . 23 TRP HE3 1 1 28 17116 1 1 23 TRP HH2 H 11.767 0.782 -6.350 1.00 . A A . 23 TRP HH2 1 1 28 17117 1 1 23 TRP HZ2 H 13.019 1.343 -4.312 1.00 . A A . 23 TRP HZ2 1 1 28 17118 1 1 23 TRP HZ3 H 9.604 -0.345 -6.234 1.00 . A A . 23 TRP HZ3 1 1 28 17119 1 1 23 TRP N N 6.963 -2.509 -1.616 1.00 . A A . 23 TRP N 1 1 28 17120 1 1 23 TRP NE1 N 11.962 0.685 -1.747 1.00 . A A . 23 TRP NE1 1 1 28 17121 1 1 23 TRP O O 8.433 -4.410 -0.394 1.00 . A A . 23 TRP O 1 1 28 17122 1 1 24 ARG C C 12.697 -4.156 -0.214 1.00 . A A . 24 ARG C 1 1 28 17123 1 1 24 ARG CA C 11.203 -4.436 -0.079 1.00 . A A . 24 ARG CA 1 1 28 17124 1 1 24 ARG CB C 10.885 -5.825 -0.642 1.00 . A A . 24 ARG CB 1 1 28 17125 1 1 24 ARG CD C 10.823 -8.147 0.328 1.00 . A A . 24 ARG CD 1 1 28 17126 1 1 24 ARG CG C 11.693 -6.943 -0.002 1.00 . A A . 24 ARG CG 1 1 28 17127 1 1 24 ARG CZ C 12.541 -9.912 0.250 1.00 . A A . 24 ARG CZ 1 1 28 17128 1 1 24 ARG H H 10.882 -2.641 -1.154 1.00 . A A . 24 ARG H 1 1 28 17129 1 1 24 ARG HA H 10.939 -4.413 0.968 1.00 . A A . 24 ARG HA 1 1 28 17130 1 1 24 ARG HB2 H 9.838 -6.033 -0.485 1.00 . A A . 24 ARG HB2 1 1 28 17131 1 1 24 ARG HB3 H 11.088 -5.825 -1.701 1.00 . A A . 24 ARG HB3 1 1 28 17132 1 1 24 ARG HD2 H 10.725 -8.221 1.401 1.00 . A A . 24 ARG HD2 1 1 28 17133 1 1 24 ARG HD3 H 9.848 -8.003 -0.113 1.00 . A A . 24 ARG HD3 1 1 28 17134 1 1 24 ARG HE H 10.898 -9.864 -0.882 1.00 . A A . 24 ARG HE 1 1 28 17135 1 1 24 ARG HG2 H 12.469 -7.251 -0.687 1.00 . A A . 24 ARG HG2 1 1 28 17136 1 1 24 ARG HG3 H 12.141 -6.574 0.910 1.00 . A A . 24 ARG HG3 1 1 28 17137 1 1 24 ARG HH11 H 12.909 -8.443 1.591 1.00 . A A . 24 ARG HH11 1 1 28 17138 1 1 24 ARG HH12 H 14.102 -9.696 1.517 1.00 . A A . 24 ARG HH12 1 1 28 17139 1 1 24 ARG HH21 H 12.465 -11.514 -0.980 1.00 . A A . 24 ARG HH21 1 1 28 17140 1 1 24 ARG HH22 H 13.850 -11.439 0.057 1.00 . A A . 24 ARG HH22 1 1 28 17141 1 1 24 ARG N N 10.418 -3.409 -0.761 1.00 . A A . 24 ARG N 1 1 28 17142 1 1 24 ARG NE N 11.395 -9.391 -0.181 1.00 . A A . 24 ARG NE 1 1 28 17143 1 1 24 ARG NH1 N 13.241 -9.299 1.197 1.00 . A A . 24 ARG NH1 1 1 28 17144 1 1 24 ARG NH2 N 12.989 -11.048 -0.266 1.00 . A A . 24 ARG NH2 1 1 28 17145 1 1 24 ARG O O 13.478 -4.451 0.690 1.00 . A A . 24 ARG O 1 1 28 17146 1 1 25 THR C C 15.279 -4.531 -1.948 1.00 . A A . 25 THR C 1 1 28 17147 1 1 25 THR CA C 14.489 -3.269 -1.616 1.00 . A A . 25 THR CA 1 1 28 17148 1 1 25 THR CB C 15.118 -2.556 -0.414 1.00 . A A . 25 THR CB 1 1 28 17149 1 1 25 THR CG2 C 16.169 -1.540 -0.804 1.00 . A A . 25 THR CG2 1 1 28 17150 1 1 25 THR H H 12.418 -3.381 -2.036 1.00 . A A . 25 THR H 1 1 28 17151 1 1 25 THR HA H 14.521 -2.608 -2.469 1.00 . A A . 25 THR HA 1 1 28 17152 1 1 25 THR HB H 15.588 -3.293 0.222 1.00 . A A . 25 THR HB 1 1 28 17153 1 1 25 THR HG1 H 13.995 -2.340 1.176 1.00 . A A . 25 THR HG1 1 1 28 17154 1 1 25 THR HG21 H 15.831 -0.984 -1.666 1.00 . A A . 25 THR HG21 1 1 28 17155 1 1 25 THR HG22 H 16.337 -0.862 0.020 1.00 . A A . 25 THR HG22 1 1 28 17156 1 1 25 THR HG23 H 17.091 -2.050 -1.043 1.00 . A A . 25 THR HG23 1 1 28 17157 1 1 25 THR N N 13.088 -3.588 -1.353 1.00 . A A . 25 THR N 1 1 28 17158 1 1 25 THR O O 16.352 -4.771 -1.394 1.00 . A A . 25 THR O 1 1 28 17159 1 1 25 THR OG1 O 14.128 -1.882 0.343 1.00 . A A . 25 THR OG1 1 1 28 17160 1 1 26 SER C C 14.564 -7.280 -4.341 1.00 . A A . 26 SER C 1 1 28 17161 1 1 26 SER CA C 15.384 -6.574 -3.270 1.00 . A A . 26 SER CA 1 1 28 17162 1 1 26 SER CB C 15.579 -7.499 -2.067 1.00 . A A . 26 SER CB 1 1 28 17163 1 1 26 SER H H 13.880 -5.086 -3.263 1.00 . A A . 26 SER H 1 1 28 17164 1 1 26 SER HA H 16.348 -6.324 -3.680 1.00 . A A . 26 SER HA 1 1 28 17165 1 1 26 SER HB2 H 14.805 -7.308 -1.339 1.00 . A A . 26 SER HB2 1 1 28 17166 1 1 26 SER HB3 H 15.520 -8.527 -2.393 1.00 . A A . 26 SER HB3 1 1 28 17167 1 1 26 SER HG H 16.714 -7.021 -0.543 1.00 . A A . 26 SER HG 1 1 28 17168 1 1 26 SER N N 14.737 -5.334 -2.858 1.00 . A A . 26 SER N 1 1 28 17169 1 1 26 SER O O 14.943 -7.314 -5.511 1.00 . A A . 26 SER O 1 1 28 17170 1 1 26 SER OG O 16.840 -7.285 -1.457 1.00 . A A . 26 SER OG 1 1 28 17171 1 1 27 VAL C C 11.132 -7.979 -4.816 1.00 . A A . 27 VAL C 1 1 28 17172 1 1 27 VAL CA C 12.551 -8.552 -4.845 1.00 . A A . 27 VAL CA 1 1 28 17173 1 1 27 VAL CB C 12.494 -10.057 -4.514 1.00 . A A . 27 VAL CB 1 1 28 17174 1 1 27 VAL CG1 C 11.934 -10.280 -3.117 1.00 . A A . 27 VAL CG1 1 1 28 17175 1 1 27 VAL CG2 C 11.670 -10.804 -5.553 1.00 . A A . 27 VAL CG2 1 1 28 17176 1 1 27 VAL H H 13.194 -7.779 -2.981 1.00 . A A . 27 VAL H 1 1 28 17177 1 1 27 VAL HA H 12.950 -8.442 -5.843 1.00 . A A . 27 VAL HA 1 1 28 17178 1 1 27 VAL HB H 13.501 -10.447 -4.539 1.00 . A A . 27 VAL HB 1 1 28 17179 1 1 27 VAL HG11 H 11.009 -9.734 -3.009 1.00 . A A . 27 VAL HG11 1 1 28 17180 1 1 27 VAL HG12 H 11.751 -11.334 -2.967 1.00 . A A . 27 VAL HG12 1 1 28 17181 1 1 27 VAL HG13 H 12.646 -9.930 -2.384 1.00 . A A . 27 VAL HG13 1 1 28 17182 1 1 27 VAL HG21 H 11.630 -10.226 -6.465 1.00 . A A . 27 VAL HG21 1 1 28 17183 1 1 27 VAL HG22 H 12.125 -11.762 -5.753 1.00 . A A . 27 VAL HG22 1 1 28 17184 1 1 27 VAL HG23 H 10.668 -10.953 -5.178 1.00 . A A . 27 VAL HG23 1 1 28 17185 1 1 27 VAL N N 13.436 -7.843 -3.928 1.00 . A A . 27 VAL N 1 1 28 17186 1 1 27 VAL O O 10.266 -8.416 -5.573 1.00 . A A . 27 VAL O 1 1 28 17187 1 1 28 SER C C 8.514 -7.413 -3.499 1.00 . A A . 28 SER C 1 1 28 17188 1 1 28 SER CA C 9.586 -6.376 -3.823 1.00 . A A . 28 SER CA 1 1 28 17189 1 1 28 SER CB C 9.227 -5.641 -5.115 1.00 . A A . 28 SER CB 1 1 28 17190 1 1 28 SER H H 11.626 -6.692 -3.365 1.00 . A A . 28 SER H 1 1 28 17191 1 1 28 SER HA H 9.632 -5.662 -3.015 1.00 . A A . 28 SER HA 1 1 28 17192 1 1 28 SER HB2 H 8.472 -4.898 -4.906 1.00 . A A . 28 SER HB2 1 1 28 17193 1 1 28 SER HB3 H 10.110 -5.157 -5.507 1.00 . A A . 28 SER HB3 1 1 28 17194 1 1 28 SER HG H 8.201 -6.051 -6.732 1.00 . A A . 28 SER HG 1 1 28 17195 1 1 28 SER N N 10.900 -7.001 -3.942 1.00 . A A . 28 SER N 1 1 28 17196 1 1 28 SER O O 8.122 -8.205 -4.356 1.00 . A A . 28 SER O 1 1 28 17197 1 1 28 SER OG O 8.726 -6.537 -6.092 1.00 . A A . 28 SER OG 1 1 28 17198 1 1 29 SER C C 6.590 -8.069 -0.382 1.00 . A A . 29 SER C 1 1 28 17199 1 1 29 SER CA C 7.016 -8.342 -1.822 1.00 . A A . 29 SER CA 1 1 28 17200 1 1 29 SER CB C 7.526 -9.779 -1.950 1.00 . A A . 29 SER CB 1 1 28 17201 1 1 29 SER H H 8.393 -6.747 -1.617 1.00 . A A . 29 SER H 1 1 28 17202 1 1 29 SER HA H 6.159 -8.217 -2.467 1.00 . A A . 29 SER HA 1 1 28 17203 1 1 29 SER HB2 H 7.724 -9.998 -2.989 1.00 . A A . 29 SER HB2 1 1 28 17204 1 1 29 SER HB3 H 8.437 -9.887 -1.380 1.00 . A A . 29 SER HB3 1 1 28 17205 1 1 29 SER HG H 6.959 -11.582 -1.436 1.00 . A A . 29 SER HG 1 1 28 17206 1 1 29 SER N N 8.042 -7.402 -2.256 1.00 . A A . 29 SER N 1 1 28 17207 1 1 29 SER O O 6.300 -8.997 0.374 1.00 . A A . 29 SER O 1 1 28 17208 1 1 29 SER OG O 6.570 -10.705 -1.464 1.00 . A A . 29 SER OG 1 1 28 17209 1 1 30 HIS C C 4.693 -6.769 1.601 1.00 . A A . 30 HIS C 1 1 28 17210 1 1 30 HIS CA C 6.154 -6.412 1.344 1.00 . A A . 30 HIS CA 1 1 28 17211 1 1 30 HIS CB C 6.374 -4.913 1.561 1.00 . A A . 30 HIS CB 1 1 28 17212 1 1 30 HIS CD2 C 8.881 -5.073 2.206 1.00 . A A . 30 HIS CD2 1 1 28 17213 1 1 30 HIS CE1 C 8.881 -3.629 3.855 1.00 . A A . 30 HIS CE1 1 1 28 17214 1 1 30 HIS CG C 7.619 -4.598 2.330 1.00 . A A . 30 HIS CG 1 1 28 17215 1 1 30 HIS H H 6.789 -6.095 -0.652 1.00 . A A . 30 HIS H 1 1 28 17216 1 1 30 HIS HA H 6.773 -6.961 2.037 1.00 . A A . 30 HIS HA 1 1 28 17217 1 1 30 HIS HB2 H 6.443 -4.423 0.601 1.00 . A A . 30 HIS HB2 1 1 28 17218 1 1 30 HIS HB3 H 5.534 -4.507 2.106 1.00 . A A . 30 HIS HB3 1 1 28 17219 1 1 30 HIS HD1 H 6.890 -3.180 3.708 1.00 . A A . 30 HIS HD1 1 1 28 17220 1 1 30 HIS HD2 H 9.224 -5.801 1.483 1.00 . A A . 30 HIS HD2 1 1 28 17221 1 1 30 HIS HE1 H 9.205 -3.006 4.676 1.00 . A A . 30 HIS HE1 1 1 28 17222 1 1 30 HIS HE2 H 10.579 -4.667 3.372 1.00 . A A . 30 HIS HE2 1 1 28 17223 1 1 30 HIS N N 6.550 -6.794 -0.007 1.00 . A A . 30 HIS N 1 1 28 17224 1 1 30 HIS ND1 N 7.653 -3.696 3.373 1.00 . A A . 30 HIS ND1 1 1 28 17225 1 1 30 HIS NE2 N 9.645 -4.456 3.165 1.00 . A A . 30 HIS NE2 1 1 28 17226 1 1 30 HIS O O 4.304 -7.055 2.734 1.00 . A A . 30 HIS O 1 1 28 17227 1 1 31 TYR C C 1.766 -6.118 1.604 1.00 . A A . 31 TYR C 1 1 28 17228 1 1 31 TYR CA C 2.473 -7.077 0.652 1.00 . A A . 31 TYR CA 1 1 28 17229 1 1 31 TYR CB C 2.294 -8.517 1.136 1.00 . A A . 31 TYR CB 1 1 28 17230 1 1 31 TYR CD1 C 2.084 -9.423 -1.211 1.00 . A A . 31 TYR CD1 1 1 28 17231 1 1 31 TYR CD2 C 3.375 -10.664 0.363 1.00 . A A . 31 TYR CD2 1 1 28 17232 1 1 31 TYR CE1 C 2.352 -10.369 -2.183 1.00 . A A . 31 TYR CE1 1 1 28 17233 1 1 31 TYR CE2 C 3.648 -11.614 -0.603 1.00 . A A . 31 TYR CE2 1 1 28 17234 1 1 31 TYR CG C 2.590 -9.554 0.076 1.00 . A A . 31 TYR CG 1 1 28 17235 1 1 31 TYR CZ C 3.134 -11.462 -1.874 1.00 . A A . 31 TYR CZ 1 1 28 17236 1 1 31 TYR H H 4.259 -6.519 -0.335 1.00 . A A . 31 TYR H 1 1 28 17237 1 1 31 TYR HA H 2.033 -6.980 -0.329 1.00 . A A . 31 TYR HA 1 1 28 17238 1 1 31 TYR HB2 H 2.959 -8.695 1.968 1.00 . A A . 31 TYR HB2 1 1 28 17239 1 1 31 TYR HB3 H 1.273 -8.656 1.462 1.00 . A A . 31 TYR HB3 1 1 28 17240 1 1 31 TYR HD1 H 1.472 -8.566 -1.450 1.00 . A A . 31 TYR HD1 1 1 28 17241 1 1 31 TYR HD2 H 3.775 -10.781 1.359 1.00 . A A . 31 TYR HD2 1 1 28 17242 1 1 31 TYR HE1 H 1.950 -10.249 -3.178 1.00 . A A . 31 TYR HE1 1 1 28 17243 1 1 31 TYR HE2 H 4.260 -12.469 -0.361 1.00 . A A . 31 TYR HE2 1 1 28 17244 1 1 31 TYR HH H 4.353 -12.524 -2.914 1.00 . A A . 31 TYR HH 1 1 28 17245 1 1 31 TYR N N 3.890 -6.753 0.542 1.00 . A A . 31 TYR N 1 1 28 17246 1 1 31 TYR O O 1.925 -6.206 2.822 1.00 . A A . 31 TYR O 1 1 28 17247 1 1 31 TYR OH O 3.404 -12.405 -2.838 1.00 . A A . 31 TYR OH 1 1 28 17248 1 1 32 CYS C C -0.878 -4.901 2.613 1.00 . A A . 32 CYS C 1 1 28 17249 1 1 32 CYS CA C 0.251 -4.229 1.840 1.00 . A A . 32 CYS CA 1 1 28 17250 1 1 32 CYS CB C -0.315 -3.125 0.944 1.00 . A A . 32 CYS CB 1 1 28 17251 1 1 32 CYS H H 0.896 -5.184 0.066 1.00 . A A . 32 CYS H 1 1 28 17252 1 1 32 CYS HA H 0.942 -3.790 2.544 1.00 . A A . 32 CYS HA 1 1 28 17253 1 1 32 CYS HB2 H 0.450 -2.807 0.251 1.00 . A A . 32 CYS HB2 1 1 28 17254 1 1 32 CYS HB3 H -1.155 -3.517 0.390 1.00 . A A . 32 CYS HB3 1 1 28 17255 1 1 32 CYS N N 0.984 -5.203 1.041 1.00 . A A . 32 CYS N 1 1 28 17256 1 1 32 CYS O O -1.318 -5.996 2.262 1.00 . A A . 32 CYS O 1 1 28 17257 1 1 32 CYS SG S -0.885 -1.651 1.851 1.00 . A A . 32 CYS SG 1 1 28 17258 1 1 33 THR C C -3.762 -4.132 4.144 1.00 . A A . 33 THR C 1 1 28 17259 1 1 33 THR CA C -2.420 -4.777 4.492 1.00 . A A . 33 THR CA 1 1 28 17260 1 1 33 THR CB C -2.108 -4.558 5.973 1.00 . A A . 33 THR CB 1 1 28 17261 1 1 33 THR CG2 C -1.647 -3.151 6.285 1.00 . A A . 33 THR CG2 1 1 28 17262 1 1 33 THR H H -0.950 -3.372 3.899 1.00 . A A . 33 THR H 1 1 28 17263 1 1 33 THR HA H -2.485 -5.837 4.301 1.00 . A A . 33 THR HA 1 1 28 17264 1 1 33 THR HB H -1.320 -5.237 6.268 1.00 . A A . 33 THR HB 1 1 28 17265 1 1 33 THR HG1 H -3.904 -4.140 6.633 1.00 . A A . 33 THR HG1 1 1 28 17266 1 1 33 THR HG21 H -1.871 -2.505 5.448 1.00 . A A . 33 THR HG21 1 1 28 17267 1 1 33 THR HG22 H -2.160 -2.790 7.164 1.00 . A A . 33 THR HG22 1 1 28 17268 1 1 33 THR HG23 H -0.582 -3.152 6.464 1.00 . A A . 33 THR HG23 1 1 28 17269 1 1 33 THR N N -1.342 -4.240 3.668 1.00 . A A . 33 THR N 1 1 28 17270 1 1 33 THR O O -4.761 -4.361 4.826 1.00 . A A . 33 THR O 1 1 28 17271 1 1 33 THR OG1 O -3.247 -4.826 6.771 1.00 . A A . 33 THR OG1 1 1 28 17272 1 1 34 GLY C C -5.743 -2.013 3.829 1.00 . A A . 34 GLY C 1 1 28 17273 1 1 34 GLY CA C -5.011 -2.667 2.671 1.00 . A A . 34 GLY CA 1 1 28 17274 1 1 34 GLY H H -2.959 -3.180 2.572 1.00 . A A . 34 GLY H 1 1 28 17275 1 1 34 GLY HA2 H -5.662 -3.398 2.215 1.00 . A A . 34 GLY HA2 1 1 28 17276 1 1 34 GLY HA3 H -4.771 -1.910 1.940 1.00 . A A . 34 GLY HA3 1 1 28 17277 1 1 34 GLY N N -3.782 -3.326 3.082 1.00 . A A . 34 GLY N 1 1 28 17278 1 1 34 GLY O O -6.973 -2.008 3.870 1.00 . A A . 34 GLY O 1 1 28 17279 1 1 35 ARG C C -5.403 0.704 5.860 1.00 . A A . 35 ARG C 1 1 28 17280 1 1 35 ARG CA C -5.572 -0.809 5.938 1.00 . A A . 35 ARG CA 1 1 28 17281 1 1 35 ARG CB C -4.931 -1.339 7.222 1.00 . A A . 35 ARG CB 1 1 28 17282 1 1 35 ARG CD C -6.787 -2.296 8.621 1.00 . A A . 35 ARG CD 1 1 28 17283 1 1 35 ARG CG C -5.582 -2.608 7.748 1.00 . A A . 35 ARG CG 1 1 28 17284 1 1 35 ARG CZ C -7.200 -1.557 10.935 1.00 . A A . 35 ARG CZ 1 1 28 17285 1 1 35 ARG H H -4.010 -1.502 4.687 1.00 . A A . 35 ARG H 1 1 28 17286 1 1 35 ARG HA H -6.625 -1.040 5.951 1.00 . A A . 35 ARG HA 1 1 28 17287 1 1 35 ARG HB2 H -3.889 -1.547 7.032 1.00 . A A . 35 ARG HB2 1 1 28 17288 1 1 35 ARG HB3 H -5.004 -0.580 7.987 1.00 . A A . 35 ARG HB3 1 1 28 17289 1 1 35 ARG HD2 H -7.449 -1.639 8.077 1.00 . A A . 35 ARG HD2 1 1 28 17290 1 1 35 ARG HD3 H -7.301 -3.219 8.846 1.00 . A A . 35 ARG HD3 1 1 28 17291 1 1 35 ARG HE H -5.503 -1.263 9.926 1.00 . A A . 35 ARG HE 1 1 28 17292 1 1 35 ARG HG2 H -5.903 -3.210 6.911 1.00 . A A . 35 ARG HG2 1 1 28 17293 1 1 35 ARG HG3 H -4.858 -3.157 8.332 1.00 . A A . 35 ARG HG3 1 1 28 17294 1 1 35 ARG HH11 H -8.754 -2.525 10.074 1.00 . A A . 35 ARG HH11 1 1 28 17295 1 1 35 ARG HH12 H -9.019 -1.995 11.701 1.00 . A A . 35 ARG HH12 1 1 28 17296 1 1 35 ARG HH21 H -5.850 -0.566 12.066 1.00 . A A . 35 ARG HH21 1 1 28 17297 1 1 35 ARG HH22 H -7.371 -0.883 12.832 1.00 . A A . 35 ARG HH22 1 1 28 17298 1 1 35 ARG N N -4.986 -1.464 4.774 1.00 . A A . 35 ARG N 1 1 28 17299 1 1 35 ARG NE N -6.403 -1.649 9.873 1.00 . A A . 35 ARG NE 1 1 28 17300 1 1 35 ARG NH1 N -8.425 -2.068 10.900 1.00 . A A . 35 ARG NH1 1 1 28 17301 1 1 35 ARG NH2 N -6.772 -0.952 12.035 1.00 . A A . 35 ARG NH2 1 1 28 17302 1 1 35 ARG O O -6.292 1.459 6.252 1.00 . A A . 35 ARG O 1 1 28 17303 1 1 36 SER C C -2.989 2.824 4.086 1.00 . A A . 36 SER C 1 1 28 17304 1 1 36 SER CA C -3.969 2.565 5.225 1.00 . A A . 36 SER CA 1 1 28 17305 1 1 36 SER CB C -3.401 3.111 6.536 1.00 . A A . 36 SER CB 1 1 28 17306 1 1 36 SER H H -3.586 0.489 5.059 1.00 . A A . 36 SER H 1 1 28 17307 1 1 36 SER HA H -4.897 3.071 5.008 1.00 . A A . 36 SER HA 1 1 28 17308 1 1 36 SER HB2 H -3.102 4.139 6.395 1.00 . A A . 36 SER HB2 1 1 28 17309 1 1 36 SER HB3 H -4.158 3.058 7.304 1.00 . A A . 36 SER HB3 1 1 28 17310 1 1 36 SER HG H -1.611 2.363 6.259 1.00 . A A . 36 SER HG 1 1 28 17311 1 1 36 SER N N -4.256 1.140 5.353 1.00 . A A . 36 SER N 1 1 28 17312 1 1 36 SER O O -2.295 1.914 3.632 1.00 . A A . 36 SER O 1 1 28 17313 1 1 36 SER OG O -2.273 2.362 6.954 1.00 . A A . 36 SER OG 1 1 28 17314 1 1 37 CYS C C -0.587 4.437 3.015 1.00 . A A . 37 CYS C 1 1 28 17315 1 1 37 CYS CA C -2.038 4.450 2.546 1.00 . A A . 37 CYS CA 1 1 28 17316 1 1 37 CYS CB C -2.400 5.838 2.013 1.00 . A A . 37 CYS CB 1 1 28 17317 1 1 37 CYS H H -3.512 4.753 4.034 1.00 . A A . 37 CYS H 1 1 28 17318 1 1 37 CYS HA H -2.154 3.727 1.751 1.00 . A A . 37 CYS HA 1 1 28 17319 1 1 37 CYS HB2 H -2.123 6.580 2.747 1.00 . A A . 37 CYS HB2 1 1 28 17320 1 1 37 CYS HB3 H -1.851 6.019 1.101 1.00 . A A . 37 CYS HB3 1 1 28 17321 1 1 37 CYS N N -2.936 4.071 3.630 1.00 . A A . 37 CYS N 1 1 28 17322 1 1 37 CYS O O 0.330 4.208 2.225 1.00 . A A . 37 CYS O 1 1 28 17323 1 1 37 CYS SG S -4.172 6.058 1.648 1.00 . A A . 37 CYS SG 1 1 28 17324 1 1 38 GLU C C 1.609 3.326 4.769 1.00 . A A . 38 GLU C 1 1 28 17325 1 1 38 GLU CA C 0.954 4.699 4.880 1.00 . A A . 38 GLU CA 1 1 28 17326 1 1 38 GLU CB C 0.898 5.133 6.346 1.00 . A A . 38 GLU CB 1 1 28 17327 1 1 38 GLU CD C -0.907 6.805 6.915 1.00 . A A . 38 GLU CD 1 1 28 17328 1 1 38 GLU CG C 0.545 6.600 6.533 1.00 . A A . 38 GLU CG 1 1 28 17329 1 1 38 GLU H H -1.156 4.858 4.885 1.00 . A A . 38 GLU H 1 1 28 17330 1 1 38 GLU HA H 1.545 5.412 4.325 1.00 . A A . 38 GLU HA 1 1 28 17331 1 1 38 GLU HB2 H 0.156 4.538 6.857 1.00 . A A . 38 GLU HB2 1 1 28 17332 1 1 38 GLU HB3 H 1.863 4.957 6.799 1.00 . A A . 38 GLU HB3 1 1 28 17333 1 1 38 GLU HG2 H 1.168 7.010 7.314 1.00 . A A . 38 GLU HG2 1 1 28 17334 1 1 38 GLU HG3 H 0.737 7.123 5.608 1.00 . A A . 38 GLU HG3 1 1 28 17335 1 1 38 GLU N N -0.385 4.683 4.305 1.00 . A A . 38 GLU N 1 1 28 17336 1 1 38 GLU O O 1.560 2.527 5.703 1.00 . A A . 38 GLU O 1 1 28 17337 1 1 38 GLU OE1 O -1.380 6.118 7.845 1.00 . A A . 38 GLU OE1 1 1 28 17338 1 1 38 GLU OE2 O -1.572 7.654 6.285 1.00 . A A . 38 GLU OE2 1 1 28 17339 1 1 39 CYS C C 3.919 1.491 4.471 1.00 . A A . 39 CYS C 1 1 28 17340 1 1 39 CYS CA C 2.886 1.783 3.380 1.00 . A A . 39 CYS CA 1 1 28 17341 1 1 39 CYS CB C 3.567 1.792 2.010 1.00 . A A . 39 CYS CB 1 1 28 17342 1 1 39 CYS H H 2.224 3.739 2.912 1.00 . A A . 39 CYS H 1 1 28 17343 1 1 39 CYS HA H 2.134 1.010 3.392 1.00 . A A . 39 CYS HA 1 1 28 17344 1 1 39 CYS HB2 H 2.823 1.974 1.249 1.00 . A A . 39 CYS HB2 1 1 28 17345 1 1 39 CYS HB3 H 4.299 2.586 1.986 1.00 . A A . 39 CYS HB3 1 1 28 17346 1 1 39 CYS N N 2.221 3.060 3.619 1.00 . A A . 39 CYS N 1 1 28 17347 1 1 39 CYS O O 4.971 2.128 4.523 1.00 . A A . 39 CYS O 1 1 28 17348 1 1 39 CYS SG S 4.418 0.237 1.590 1.00 . A A . 39 CYS SG 1 1 28 17349 1 1 40 PRO C C 5.787 -0.573 5.941 1.00 . A A . 40 PRO C 1 1 28 17350 1 1 40 PRO CA C 4.547 0.156 6.447 1.00 . A A . 40 PRO CA 1 1 28 17351 1 1 40 PRO CB C 3.704 -0.769 7.324 1.00 . A A . 40 PRO CB 1 1 28 17352 1 1 40 PRO CD C 2.402 -0.293 5.377 1.00 . A A . 40 PRO CD 1 1 28 17353 1 1 40 PRO CG C 2.702 -1.360 6.395 1.00 . A A . 40 PRO CG 1 1 28 17354 1 1 40 PRO HA H 4.849 1.023 7.017 1.00 . A A . 40 PRO HA 1 1 28 17355 1 1 40 PRO HB2 H 4.335 -1.529 7.762 1.00 . A A . 40 PRO HB2 1 1 28 17356 1 1 40 PRO HB3 H 3.227 -0.195 8.105 1.00 . A A . 40 PRO HB3 1 1 28 17357 1 1 40 PRO HD2 H 2.220 -0.737 4.409 1.00 . A A . 40 PRO HD2 1 1 28 17358 1 1 40 PRO HD3 H 1.554 0.297 5.689 1.00 . A A . 40 PRO HD3 1 1 28 17359 1 1 40 PRO HG2 H 3.118 -2.232 5.912 1.00 . A A . 40 PRO HG2 1 1 28 17360 1 1 40 PRO HG3 H 1.806 -1.621 6.938 1.00 . A A . 40 PRO HG3 1 1 28 17361 1 1 40 PRO N N 3.633 0.521 5.360 1.00 . A A . 40 PRO N 1 1 28 17362 1 1 40 PRO O O 5.920 -0.837 4.746 1.00 . A A . 40 PRO O 1 1 28 17363 1 1 41 SER C C 7.891 -3.037 7.010 1.00 . A A . 41 SER C 1 1 28 17364 1 1 41 SER CA C 7.922 -1.597 6.506 1.00 . A A . 41 SER CA 1 1 28 17365 1 1 41 SER CB C 9.133 -0.864 7.086 1.00 . A A . 41 SER CB 1 1 28 17366 1 1 41 SER H H 6.529 -0.659 7.795 1.00 . A A . 41 SER H 1 1 28 17367 1 1 41 SER HA H 8.000 -1.606 5.429 1.00 . A A . 41 SER HA 1 1 28 17368 1 1 41 SER HB2 H 8.890 -0.494 8.071 1.00 . A A . 41 SER HB2 1 1 28 17369 1 1 41 SER HB3 H 9.966 -1.548 7.155 1.00 . A A . 41 SER HB3 1 1 28 17370 1 1 41 SER HG H 10.284 -0.004 5.754 1.00 . A A . 41 SER HG 1 1 28 17371 1 1 41 SER N N 6.692 -0.897 6.858 1.00 . A A . 41 SER N 1 1 28 17372 1 1 41 SER O O 8.789 -3.475 7.729 1.00 . A A . 41 SER O 1 1 28 17373 1 1 41 SER OG O 9.508 0.231 6.268 1.00 . A A . 41 SER OG 1 1 28 17374 1 1 42 TYR C C 7.010 -6.108 5.881 1.00 . A A . 42 TYR C 1 1 28 17375 1 1 42 TYR CA C 6.701 -5.160 7.038 1.00 . A A . 42 TYR CA 1 1 28 17376 1 1 42 TYR CB C 5.283 -5.412 7.554 1.00 . A A . 42 TYR CB 1 1 28 17377 1 1 42 TYR CD1 C 4.550 -5.662 9.957 1.00 . A A . 42 TYR CD1 1 1 28 17378 1 1 42 TYR CD2 C 5.278 -3.515 9.220 1.00 . A A . 42 TYR CD2 1 1 28 17379 1 1 42 TYR CE1 C 4.319 -5.155 11.221 1.00 . A A . 42 TYR CE1 1 1 28 17380 1 1 42 TYR CE2 C 5.050 -3.000 10.482 1.00 . A A . 42 TYR CE2 1 1 28 17381 1 1 42 TYR CG C 5.032 -4.853 8.936 1.00 . A A . 42 TYR CG 1 1 28 17382 1 1 42 TYR CZ C 4.570 -3.824 11.479 1.00 . A A . 42 TYR CZ 1 1 28 17383 1 1 42 TYR H H 6.166 -3.365 6.053 1.00 . A A . 42 TYR H 1 1 28 17384 1 1 42 TYR HA H 7.403 -5.346 7.837 1.00 . A A . 42 TYR HA 1 1 28 17385 1 1 42 TYR HB2 H 4.576 -4.955 6.878 1.00 . A A . 42 TYR HB2 1 1 28 17386 1 1 42 TYR HB3 H 5.104 -6.477 7.588 1.00 . A A . 42 TYR HB3 1 1 28 17387 1 1 42 TYR HD1 H 4.354 -6.705 9.752 1.00 . A A . 42 TYR HD1 1 1 28 17388 1 1 42 TYR HD2 H 5.652 -2.872 8.437 1.00 . A A . 42 TYR HD2 1 1 28 17389 1 1 42 TYR HE1 H 3.944 -5.800 12.002 1.00 . A A . 42 TYR HE1 1 1 28 17390 1 1 42 TYR HE2 H 5.247 -1.958 10.683 1.00 . A A . 42 TYR HE2 1 1 28 17391 1 1 42 TYR HH H 5.177 -3.224 13.202 1.00 . A A . 42 TYR HH 1 1 28 17392 1 1 42 TYR N N 6.850 -3.769 6.626 1.00 . A A . 42 TYR N 1 1 28 17393 1 1 42 TYR O O 6.112 -6.509 5.141 1.00 . A A . 42 TYR O 1 1 28 17394 1 1 42 TYR OH O 4.342 -3.315 12.736 1.00 . A A . 42 TYR OH 1 1 28 17395 1 1 43 PRO C C 8.223 -8.811 4.856 1.00 . A A . 43 PRO C 1 1 28 17396 1 1 43 PRO CA C 8.713 -7.384 4.636 1.00 . A A . 43 PRO CA 1 1 28 17397 1 1 43 PRO CB C 10.241 -7.328 4.703 1.00 . A A . 43 PRO CB 1 1 28 17398 1 1 43 PRO CD C 9.424 -6.047 6.549 1.00 . A A . 43 PRO CD 1 1 28 17399 1 1 43 PRO CG C 10.544 -6.950 6.111 1.00 . A A . 43 PRO CG 1 1 28 17400 1 1 43 PRO HA H 8.378 -7.035 3.671 1.00 . A A . 43 PRO HA 1 1 28 17401 1 1 43 PRO HB2 H 10.650 -8.296 4.455 1.00 . A A . 43 PRO HB2 1 1 28 17402 1 1 43 PRO HB3 H 10.607 -6.587 4.009 1.00 . A A . 43 PRO HB3 1 1 28 17403 1 1 43 PRO HD2 H 9.207 -6.195 7.596 1.00 . A A . 43 PRO HD2 1 1 28 17404 1 1 43 PRO HD3 H 9.674 -5.015 6.355 1.00 . A A . 43 PRO HD3 1 1 28 17405 1 1 43 PRO HG2 H 10.576 -7.835 6.730 1.00 . A A . 43 PRO HG2 1 1 28 17406 1 1 43 PRO HG3 H 11.487 -6.425 6.156 1.00 . A A . 43 PRO HG3 1 1 28 17407 1 1 43 PRO N N 8.290 -6.479 5.710 1.00 . A A . 43 PRO N 1 1 28 17408 1 1 43 PRO O O 8.465 -9.407 5.905 1.00 . A A . 43 PRO O 1 1 28 17409 1 1 44 GLY C C 7.164 -11.484 2.670 1.00 . A A . 44 GLY C 1 1 28 17410 1 1 44 GLY CA C 7.018 -10.707 3.964 1.00 . A A . 44 GLY CA 1 1 28 17411 1 1 44 GLY H H 7.368 -8.831 3.046 1.00 . A A . 44 GLY H 1 1 28 17412 1 1 44 GLY HA2 H 5.972 -10.664 4.228 1.00 . A A . 44 GLY HA2 1 1 28 17413 1 1 44 GLY HA3 H 7.555 -11.225 4.744 1.00 . A A . 44 GLY HA3 1 1 28 17414 1 1 44 GLY N N 7.531 -9.354 3.859 1.00 . A A . 44 GLY N 1 1 28 17415 1 1 44 GLY O O 7.898 -11.016 1.776 1.00 . A A . 44 GLY O 1 1 28 17416 1 1 44 GLY OXT O 6.544 -12.562 2.552 1.00 . A A . 44 GLY OXT 1 1 29 17417 1 1 1 ALA C C -15.424 12.059 1.697 1.00 . A A . 1 ALA C 1 1 29 17418 1 1 1 ALA CA C -16.816 12.652 1.511 1.00 . A A . 1 ALA CA 1 1 29 17419 1 1 1 ALA CB C -16.733 14.167 1.396 1.00 . A A . 1 ALA CB 1 1 29 17420 1 1 1 ALA H1 H -17.269 12.591 3.517 1.00 . A A . 1 ALA H1 1 1 29 17421 1 1 1 ALA H2 H -18.629 12.740 2.480 1.00 . A A . 1 ALA H2 1 1 29 17422 1 1 1 ALA H3 H -17.814 11.236 2.620 1.00 . A A . 1 ALA H3 1 1 29 17423 1 1 1 ALA HA H -17.239 12.269 0.593 1.00 . A A . 1 ALA HA 1 1 29 17424 1 1 1 ALA HB1 H -17.601 14.612 1.858 1.00 . A A . 1 ALA HB1 1 1 29 17425 1 1 1 ALA HB2 H -16.697 14.447 0.353 1.00 . A A . 1 ALA HB2 1 1 29 17426 1 1 1 ALA HB3 H -15.841 14.517 1.893 1.00 . A A . 1 ALA HB3 1 1 29 17427 1 1 1 ALA N N -17.713 12.271 2.633 1.00 . A A . 1 ALA N 1 1 29 17428 1 1 1 ALA O O -14.999 11.195 0.930 1.00 . A A . 1 ALA O 1 1 29 17429 1 1 2 MET C C -12.438 12.307 1.832 1.00 . A A . 2 MET C 1 1 29 17430 1 1 2 MET CA C -13.373 12.044 3.008 1.00 . A A . 2 MET CA 1 1 29 17431 1 1 2 MET CB C -13.404 10.547 3.324 1.00 . A A . 2 MET CB 1 1 29 17432 1 1 2 MET CE C -13.985 7.657 5.710 1.00 . A A . 2 MET CE 1 1 29 17433 1 1 2 MET CG C -14.051 10.221 4.661 1.00 . A A . 2 MET CG 1 1 29 17434 1 1 2 MET H H -15.112 13.216 3.297 1.00 . A A . 2 MET H 1 1 29 17435 1 1 2 MET HA H -13.006 12.577 3.871 1.00 . A A . 2 MET HA 1 1 29 17436 1 1 2 MET HB2 H -13.956 10.038 2.548 1.00 . A A . 2 MET HB2 1 1 29 17437 1 1 2 MET HB3 H -12.391 10.173 3.338 1.00 . A A . 2 MET HB3 1 1 29 17438 1 1 2 MET HE1 H -12.956 7.682 5.383 1.00 . A A . 2 MET HE1 1 1 29 17439 1 1 2 MET HE2 H -14.052 8.035 6.719 1.00 . A A . 2 MET HE2 1 1 29 17440 1 1 2 MET HE3 H -14.348 6.640 5.681 1.00 . A A . 2 MET HE3 1 1 29 17441 1 1 2 MET HG2 H -13.277 10.141 5.409 1.00 . A A . 2 MET HG2 1 1 29 17442 1 1 2 MET HG3 H -14.724 11.024 4.925 1.00 . A A . 2 MET HG3 1 1 29 17443 1 1 2 MET N N -14.718 12.528 2.721 1.00 . A A . 2 MET N 1 1 29 17444 1 1 2 MET O O -12.885 12.603 0.724 1.00 . A A . 2 MET O 1 1 29 17445 1 1 2 MET SD S -14.980 8.677 4.624 1.00 . A A . 2 MET SD 1 1 29 17446 1 1 3 ASP C C -10.049 11.226 0.104 1.00 . A A . 3 ASP C 1 1 29 17447 1 1 3 ASP CA C -10.138 12.424 1.044 1.00 . A A . 3 ASP CA 1 1 29 17448 1 1 3 ASP CB C -8.771 12.695 1.674 1.00 . A A . 3 ASP CB 1 1 29 17449 1 1 3 ASP CG C -8.794 13.882 2.617 1.00 . A A . 3 ASP CG 1 1 29 17450 1 1 3 ASP H H -10.842 11.958 2.985 1.00 . A A . 3 ASP H 1 1 29 17451 1 1 3 ASP HA H -10.441 13.290 0.475 1.00 . A A . 3 ASP HA 1 1 29 17452 1 1 3 ASP HB2 H -8.457 11.824 2.230 1.00 . A A . 3 ASP HB2 1 1 29 17453 1 1 3 ASP HB3 H -8.054 12.895 0.890 1.00 . A A . 3 ASP HB3 1 1 29 17454 1 1 3 ASP N N -11.137 12.197 2.082 1.00 . A A . 3 ASP N 1 1 29 17455 1 1 3 ASP O O -10.808 10.265 0.233 1.00 . A A . 3 ASP O 1 1 29 17456 1 1 3 ASP OD1 O -8.979 13.670 3.833 1.00 . A A . 3 ASP OD1 1 1 29 17457 1 1 3 ASP OD2 O -8.626 15.024 2.138 1.00 . A A . 3 ASP OD2 1 1 29 17458 1 1 4 CYS C C -7.809 9.263 -1.366 1.00 . A A . 4 CYS C 1 1 29 17459 1 1 4 CYS CA C -8.928 10.209 -1.803 1.00 . A A . 4 CYS CA 1 1 29 17460 1 1 4 CYS CB C -8.612 10.782 -3.186 1.00 . A A . 4 CYS CB 1 1 29 17461 1 1 4 CYS H H -8.542 12.081 -0.893 1.00 . A A . 4 CYS H 1 1 29 17462 1 1 4 CYS HA H -9.851 9.651 -1.858 1.00 . A A . 4 CYS HA 1 1 29 17463 1 1 4 CYS HB2 H -8.153 11.752 -3.068 1.00 . A A . 4 CYS HB2 1 1 29 17464 1 1 4 CYS HB3 H -7.921 10.122 -3.691 1.00 . A A . 4 CYS HB3 1 1 29 17465 1 1 4 CYS N N -9.116 11.289 -0.841 1.00 . A A . 4 CYS N 1 1 29 17466 1 1 4 CYS O O -7.430 8.357 -2.108 1.00 . A A . 4 CYS O 1 1 29 17467 1 1 4 CYS SG S -10.070 10.986 -4.260 1.00 . A A . 4 CYS SG 1 1 29 17468 1 1 5 THR C C -5.078 8.490 -0.658 1.00 . A A . 5 THR C 1 1 29 17469 1 1 5 THR CA C -6.203 8.642 0.363 1.00 . A A . 5 THR CA 1 1 29 17470 1 1 5 THR CB C -6.742 7.265 0.757 1.00 . A A . 5 THR CB 1 1 29 17471 1 1 5 THR CG2 C -7.440 7.258 2.100 1.00 . A A . 5 THR CG2 1 1 29 17472 1 1 5 THR H H -7.618 10.216 0.385 1.00 . A A . 5 THR H 1 1 29 17473 1 1 5 THR HA H -5.808 9.127 1.243 1.00 . A A . 5 THR HA 1 1 29 17474 1 1 5 THR HB H -5.918 6.568 0.810 1.00 . A A . 5 THR HB 1 1 29 17475 1 1 5 THR HG1 H -7.698 5.831 -0.174 1.00 . A A . 5 THR HG1 1 1 29 17476 1 1 5 THR HG21 H -6.747 7.568 2.868 1.00 . A A . 5 THR HG21 1 1 29 17477 1 1 5 THR HG22 H -8.277 7.939 2.074 1.00 . A A . 5 THR HG22 1 1 29 17478 1 1 5 THR HG23 H -7.794 6.261 2.317 1.00 . A A . 5 THR HG23 1 1 29 17479 1 1 5 THR N N -7.279 9.478 -0.162 1.00 . A A . 5 THR N 1 1 29 17480 1 1 5 THR O O -4.895 7.421 -1.241 1.00 . A A . 5 THR O 1 1 29 17481 1 1 5 THR OG1 O -7.664 6.790 -0.208 1.00 . A A . 5 THR OG1 1 1 29 17482 1 1 6 THR C C -1.967 8.973 -1.189 1.00 . A A . 6 THR C 1 1 29 17483 1 1 6 THR CA C -3.226 9.554 -1.824 1.00 . A A . 6 THR CA 1 1 29 17484 1 1 6 THR CB C -2.948 10.969 -2.335 1.00 . A A . 6 THR CB 1 1 29 17485 1 1 6 THR CG2 C -3.739 11.322 -3.576 1.00 . A A . 6 THR CG2 1 1 29 17486 1 1 6 THR H H -4.526 10.391 -0.379 1.00 . A A . 6 THR H 1 1 29 17487 1 1 6 THR HA H -3.514 8.931 -2.657 1.00 . A A . 6 THR HA 1 1 29 17488 1 1 6 THR HB H -1.898 11.054 -2.576 1.00 . A A . 6 THR HB 1 1 29 17489 1 1 6 THR HG1 H -2.551 12.580 -1.295 1.00 . A A . 6 THR HG1 1 1 29 17490 1 1 6 THR HG21 H -4.346 10.478 -3.868 1.00 . A A . 6 THR HG21 1 1 29 17491 1 1 6 THR HG22 H -4.376 12.169 -3.368 1.00 . A A . 6 THR HG22 1 1 29 17492 1 1 6 THR HG23 H -3.059 11.572 -4.377 1.00 . A A . 6 THR HG23 1 1 29 17493 1 1 6 THR N N -4.330 9.567 -0.872 1.00 . A A . 6 THR N 1 1 29 17494 1 1 6 THR O O -1.789 9.032 0.028 1.00 . A A . 6 THR O 1 1 29 17495 1 1 6 THR OG1 O -3.256 11.930 -1.341 1.00 . A A . 6 THR OG1 1 1 29 17496 1 1 7 GLY C C 0.638 6.695 -2.401 1.00 . A A . 7 GLY C 1 1 29 17497 1 1 7 GLY CA C 0.134 7.825 -1.522 1.00 . A A . 7 GLY CA 1 1 29 17498 1 1 7 GLY H H -1.291 8.392 -2.981 1.00 . A A . 7 GLY H 1 1 29 17499 1 1 7 GLY HA2 H -0.040 7.443 -0.527 1.00 . A A . 7 GLY HA2 1 1 29 17500 1 1 7 GLY HA3 H 0.892 8.593 -1.473 1.00 . A A . 7 GLY HA3 1 1 29 17501 1 1 7 GLY N N -1.096 8.411 -2.021 1.00 . A A . 7 GLY N 1 1 29 17502 1 1 7 GLY O O 0.194 6.548 -3.540 1.00 . A A . 7 GLY O 1 1 29 17503 1 1 8 PRO C C 1.182 3.565 -2.737 1.00 . A A . 8 PRO C 1 1 29 17504 1 1 8 PRO CA C 2.135 4.753 -2.655 1.00 . A A . 8 PRO CA 1 1 29 17505 1 1 8 PRO CB C 3.384 4.383 -1.856 1.00 . A A . 8 PRO CB 1 1 29 17506 1 1 8 PRO CD C 2.165 5.979 -0.547 1.00 . A A . 8 PRO CD 1 1 29 17507 1 1 8 PRO CG C 3.063 4.772 -0.455 1.00 . A A . 8 PRO CG 1 1 29 17508 1 1 8 PRO HA H 2.419 5.054 -3.653 1.00 . A A . 8 PRO HA 1 1 29 17509 1 1 8 PRO HB2 H 3.567 3.321 -1.941 1.00 . A A . 8 PRO HB2 1 1 29 17510 1 1 8 PRO HB3 H 4.233 4.933 -2.234 1.00 . A A . 8 PRO HB3 1 1 29 17511 1 1 8 PRO HD2 H 1.399 5.936 0.212 1.00 . A A . 8 PRO HD2 1 1 29 17512 1 1 8 PRO HD3 H 2.743 6.886 -0.450 1.00 . A A . 8 PRO HD3 1 1 29 17513 1 1 8 PRO HG2 H 2.551 3.962 0.043 1.00 . A A . 8 PRO HG2 1 1 29 17514 1 1 8 PRO HG3 H 3.972 5.022 0.073 1.00 . A A . 8 PRO HG3 1 1 29 17515 1 1 8 PRO N N 1.575 5.874 -1.896 1.00 . A A . 8 PRO N 1 1 29 17516 1 1 8 PRO O O 0.999 2.977 -3.802 1.00 . A A . 8 PRO O 1 1 29 17517 1 1 9 CYS C C -1.794 2.568 -1.710 1.00 . A A . 9 CYS C 1 1 29 17518 1 1 9 CYS CA C -0.352 2.092 -1.552 1.00 . A A . 9 CYS CA 1 1 29 17519 1 1 9 CYS CB C -0.192 1.332 -0.233 1.00 . A A . 9 CYS CB 1 1 29 17520 1 1 9 CYS H H 0.766 3.719 -0.786 1.00 . A A . 9 CYS H 1 1 29 17521 1 1 9 CYS HA H -0.114 1.428 -2.369 1.00 . A A . 9 CYS HA 1 1 29 17522 1 1 9 CYS HB2 H 0.774 1.560 0.190 1.00 . A A . 9 CYS HB2 1 1 29 17523 1 1 9 CYS HB3 H -0.964 1.651 0.453 1.00 . A A . 9 CYS HB3 1 1 29 17524 1 1 9 CYS N N 0.579 3.214 -1.605 1.00 . A A . 9 CYS N 1 1 29 17525 1 1 9 CYS O O -2.659 2.246 -0.896 1.00 . A A . 9 CYS O 1 1 29 17526 1 1 9 CYS SG S -0.311 -0.478 -0.401 1.00 . A A . 9 CYS SG 1 1 29 17527 1 1 10 CYS C C -3.762 3.642 -4.494 1.00 . A A . 10 CYS C 1 1 29 17528 1 1 10 CYS CA C -3.380 3.854 -3.033 1.00 . A A . 10 CYS CA 1 1 29 17529 1 1 10 CYS CB C -3.456 5.345 -2.689 1.00 . A A . 10 CYS CB 1 1 29 17530 1 1 10 CYS H H -1.313 3.556 -3.379 1.00 . A A . 10 CYS H 1 1 29 17531 1 1 10 CYS HA H -4.077 3.314 -2.409 1.00 . A A . 10 CYS HA 1 1 29 17532 1 1 10 CYS HB2 H -3.116 5.919 -3.537 1.00 . A A . 10 CYS HB2 1 1 29 17533 1 1 10 CYS HB3 H -4.482 5.604 -2.474 1.00 . A A . 10 CYS HB3 1 1 29 17534 1 1 10 CYS N N -2.044 3.335 -2.766 1.00 . A A . 10 CYS N 1 1 29 17535 1 1 10 CYS O O -2.913 3.705 -5.383 1.00 . A A . 10 CYS O 1 1 29 17536 1 1 10 CYS SG S -2.447 5.836 -1.251 1.00 . A A . 10 CYS SG 1 1 29 17537 1 1 11 ARG C C -6.303 4.393 -6.593 1.00 . A A . 11 ARG C 1 1 29 17538 1 1 11 ARG CA C -5.539 3.172 -6.090 1.00 . A A . 11 ARG CA 1 1 29 17539 1 1 11 ARG CB C -6.438 1.934 -6.133 1.00 . A A . 11 ARG CB 1 1 29 17540 1 1 11 ARG CD C -6.022 0.375 -8.060 1.00 . A A . 11 ARG CD 1 1 29 17541 1 1 11 ARG CG C -5.722 0.678 -6.601 1.00 . A A . 11 ARG CG 1 1 29 17542 1 1 11 ARG CZ C -6.108 -1.589 -9.546 1.00 . A A . 11 ARG CZ 1 1 29 17543 1 1 11 ARG H H -5.674 3.355 -3.985 1.00 . A A . 11 ARG H 1 1 29 17544 1 1 11 ARG HA H -4.685 3.008 -6.731 1.00 . A A . 11 ARG HA 1 1 29 17545 1 1 11 ARG HB2 H -6.828 1.753 -5.142 1.00 . A A . 11 ARG HB2 1 1 29 17546 1 1 11 ARG HB3 H -7.263 2.125 -6.805 1.00 . A A . 11 ARG HB3 1 1 29 17547 1 1 11 ARG HD2 H -6.981 0.802 -8.313 1.00 . A A . 11 ARG HD2 1 1 29 17548 1 1 11 ARG HD3 H -5.256 0.826 -8.673 1.00 . A A . 11 ARG HD3 1 1 29 17549 1 1 11 ARG HE H -6.046 -1.664 -7.552 1.00 . A A . 11 ARG HE 1 1 29 17550 1 1 11 ARG HG2 H -4.658 0.818 -6.485 1.00 . A A . 11 ARG HG2 1 1 29 17551 1 1 11 ARG HG3 H -6.046 -0.156 -5.995 1.00 . A A . 11 ARG HG3 1 1 29 17552 1 1 11 ARG HH11 H -6.104 0.190 -10.508 1.00 . A A . 11 ARG HH11 1 1 29 17553 1 1 11 ARG HH12 H -6.164 -1.206 -11.530 1.00 . A A . 11 ARG HH12 1 1 29 17554 1 1 11 ARG HH21 H -6.124 -3.502 -8.895 1.00 . A A . 11 ARG HH21 1 1 29 17555 1 1 11 ARG HH22 H -6.176 -3.303 -10.615 1.00 . A A . 11 ARG HH22 1 1 29 17556 1 1 11 ARG N N -5.045 3.392 -4.736 1.00 . A A . 11 ARG N 1 1 29 17557 1 1 11 ARG NE N -6.059 -1.061 -8.325 1.00 . A A . 11 ARG NE 1 1 29 17558 1 1 11 ARG NH1 N -6.127 -0.804 -10.616 1.00 . A A . 11 ARG NH1 1 1 29 17559 1 1 11 ARG NH2 N -6.138 -2.906 -9.698 1.00 . A A . 11 ARG NH2 1 1 29 17560 1 1 11 ARG O O -7.532 4.381 -6.669 1.00 . A A . 11 ARG O 1 1 29 17561 1 1 12 GLN C C -6.940 7.393 -6.325 1.00 . A A . 12 GLN C 1 1 29 17562 1 1 12 GLN CA C -6.170 6.680 -7.430 1.00 . A A . 12 GLN CA 1 1 29 17563 1 1 12 GLN CB C -7.101 6.385 -8.610 1.00 . A A . 12 GLN CB 1 1 29 17564 1 1 12 GLN CD C -7.513 8.800 -9.229 1.00 . A A . 12 GLN CD 1 1 29 17565 1 1 12 GLN CG C -7.046 7.438 -9.705 1.00 . A A . 12 GLN CG 1 1 29 17566 1 1 12 GLN H H -4.591 5.394 -6.851 1.00 . A A . 12 GLN H 1 1 29 17567 1 1 12 GLN HA H -5.376 7.324 -7.766 1.00 . A A . 12 GLN HA 1 1 29 17568 1 1 12 GLN HB2 H -6.827 5.434 -9.041 1.00 . A A . 12 GLN HB2 1 1 29 17569 1 1 12 GLN HB3 H -8.117 6.327 -8.247 1.00 . A A . 12 GLN HB3 1 1 29 17570 1 1 12 GLN HE21 H -5.632 9.436 -9.128 1.00 . A A . 12 GLN HE21 1 1 29 17571 1 1 12 GLN HE22 H -6.839 10.587 -8.679 1.00 . A A . 12 GLN HE22 1 1 29 17572 1 1 12 GLN HG2 H -6.028 7.525 -10.053 1.00 . A A . 12 GLN HG2 1 1 29 17573 1 1 12 GLN HG3 H -7.679 7.122 -10.522 1.00 . A A . 12 GLN HG3 1 1 29 17574 1 1 12 GLN N N -5.566 5.447 -6.935 1.00 . A A . 12 GLN N 1 1 29 17575 1 1 12 GLN NE2 N -6.565 9.698 -8.988 1.00 . A A . 12 GLN NE2 1 1 29 17576 1 1 12 GLN O O -6.546 8.467 -5.871 1.00 . A A . 12 GLN O 1 1 29 17577 1 1 12 GLN OE1 O -8.711 9.041 -9.080 1.00 . A A . 12 GLN OE1 1 1 29 17578 1 1 13 CYS C C -9.458 6.257 -3.962 1.00 . A A . 13 CYS C 1 1 29 17579 1 1 13 CYS CA C -8.870 7.355 -4.845 1.00 . A A . 13 CYS CA 1 1 29 17580 1 1 13 CYS CB C -9.994 8.195 -5.454 1.00 . A A . 13 CYS CB 1 1 29 17581 1 1 13 CYS H H -8.294 5.932 -6.303 1.00 . A A . 13 CYS H 1 1 29 17582 1 1 13 CYS HA H -8.245 7.992 -4.238 1.00 . A A . 13 CYS HA 1 1 29 17583 1 1 13 CYS HB2 H -9.570 8.892 -6.161 1.00 . A A . 13 CYS HB2 1 1 29 17584 1 1 13 CYS HB3 H -10.682 7.542 -5.971 1.00 . A A . 13 CYS HB3 1 1 29 17585 1 1 13 CYS N N -8.038 6.785 -5.898 1.00 . A A . 13 CYS N 1 1 29 17586 1 1 13 CYS O O -10.549 6.406 -3.413 1.00 . A A . 13 CYS O 1 1 29 17587 1 1 13 CYS SG S -10.951 9.158 -4.237 1.00 . A A . 13 CYS SG 1 1 29 17588 1 1 14 LYS C C -7.994 3.248 -2.469 1.00 . A A . 14 LYS C 1 1 29 17589 1 1 14 LYS CA C -9.180 4.035 -3.012 1.00 . A A . 14 LYS CA 1 1 29 17590 1 1 14 LYS CB C -10.089 3.114 -3.828 1.00 . A A . 14 LYS CB 1 1 29 17591 1 1 14 LYS CD C -11.682 4.350 -5.328 1.00 . A A . 14 LYS CD 1 1 29 17592 1 1 14 LYS CE C -13.107 4.219 -5.841 1.00 . A A . 14 LYS CE 1 1 29 17593 1 1 14 LYS CG C -11.504 3.646 -3.993 1.00 . A A . 14 LYS CG 1 1 29 17594 1 1 14 LYS H H -7.865 5.090 -4.290 1.00 . A A . 14 LYS H 1 1 29 17595 1 1 14 LYS HA H -9.741 4.437 -2.182 1.00 . A A . 14 LYS HA 1 1 29 17596 1 1 14 LYS HB2 H -9.660 2.983 -4.811 1.00 . A A . 14 LYS HB2 1 1 29 17597 1 1 14 LYS HB3 H -10.143 2.154 -3.337 1.00 . A A . 14 LYS HB3 1 1 29 17598 1 1 14 LYS HD2 H -11.450 5.398 -5.205 1.00 . A A . 14 LYS HD2 1 1 29 17599 1 1 14 LYS HD3 H -11.007 3.912 -6.048 1.00 . A A . 14 LYS HD3 1 1 29 17600 1 1 14 LYS HE2 H -13.292 3.185 -6.093 1.00 . A A . 14 LYS HE2 1 1 29 17601 1 1 14 LYS HE3 H -13.787 4.525 -5.059 1.00 . A A . 14 LYS HE3 1 1 29 17602 1 1 14 LYS HG2 H -12.197 2.820 -3.938 1.00 . A A . 14 LYS HG2 1 1 29 17603 1 1 14 LYS HG3 H -11.710 4.345 -3.196 1.00 . A A . 14 LYS HG3 1 1 29 17604 1 1 14 LYS HZ1 H -13.148 6.059 -6.829 1.00 . A A . 14 LYS HZ1 1 1 29 17605 1 1 14 LYS HZ2 H -12.721 4.758 -7.822 1.00 . A A . 14 LYS HZ2 1 1 29 17606 1 1 14 LYS HZ3 H -14.333 4.971 -7.356 1.00 . A A . 14 LYS HZ3 1 1 29 17607 1 1 14 LYS N N -8.728 5.154 -3.829 1.00 . A A . 14 LYS N 1 1 29 17608 1 1 14 LYS NZ N -13.344 5.061 -7.046 1.00 . A A . 14 LYS NZ 1 1 29 17609 1 1 14 LYS O O -7.090 2.874 -3.217 1.00 . A A . 14 LYS O 1 1 29 17610 1 1 15 LEU C C -6.638 0.954 -1.269 1.00 . A A . 15 LEU C 1 1 29 17611 1 1 15 LEU CA C -6.926 2.251 -0.520 1.00 . A A . 15 LEU CA 1 1 29 17612 1 1 15 LEU CB C -7.290 1.946 0.935 1.00 . A A . 15 LEU CB 1 1 29 17613 1 1 15 LEU CD1 C -6.648 2.684 3.244 1.00 . A A . 15 LEU CD1 1 1 29 17614 1 1 15 LEU CD2 C -5.464 0.758 2.174 1.00 . A A . 15 LEU CD2 1 1 29 17615 1 1 15 LEU CG C -6.142 2.099 1.935 1.00 . A A . 15 LEU CG 1 1 29 17616 1 1 15 LEU H H -8.751 3.320 -0.620 1.00 . A A . 15 LEU H 1 1 29 17617 1 1 15 LEU HA H -6.039 2.867 -0.538 1.00 . A A . 15 LEU HA 1 1 29 17618 1 1 15 LEU HB2 H -8.089 2.610 1.230 1.00 . A A . 15 LEU HB2 1 1 29 17619 1 1 15 LEU HB3 H -7.651 0.929 0.989 1.00 . A A . 15 LEU HB3 1 1 29 17620 1 1 15 LEU HD11 H -7.590 3.184 3.076 1.00 . A A . 15 LEU HD11 1 1 29 17621 1 1 15 LEU HD12 H -6.784 1.891 3.965 1.00 . A A . 15 LEU HD12 1 1 29 17622 1 1 15 LEU HD13 H -5.927 3.394 3.623 1.00 . A A . 15 LEU HD13 1 1 29 17623 1 1 15 LEU HD21 H -6.213 0.004 2.365 1.00 . A A . 15 LEU HD21 1 1 29 17624 1 1 15 LEU HD22 H -4.891 0.483 1.301 1.00 . A A . 15 LEU HD22 1 1 29 17625 1 1 15 LEU HD23 H -4.805 0.835 3.027 1.00 . A A . 15 LEU HD23 1 1 29 17626 1 1 15 LEU HG H -5.407 2.778 1.528 1.00 . A A . 15 LEU HG 1 1 29 17627 1 1 15 LEU N N -8.002 2.997 -1.164 1.00 . A A . 15 LEU N 1 1 29 17628 1 1 15 LEU O O -7.522 0.113 -1.436 1.00 . A A . 15 LEU O 1 1 29 17629 1 1 16 LYS C C -5.369 -1.663 -1.691 1.00 . A A . 16 LYS C 1 1 29 17630 1 1 16 LYS CA C -4.996 -0.394 -2.459 1.00 . A A . 16 LYS CA 1 1 29 17631 1 1 16 LYS CB C -3.490 -0.368 -2.731 1.00 . A A . 16 LYS CB 1 1 29 17632 1 1 16 LYS CD C -1.948 0.615 -4.456 1.00 . A A . 16 LYS CD 1 1 29 17633 1 1 16 LYS CE C -1.353 0.391 -5.837 1.00 . A A . 16 LYS CE 1 1 29 17634 1 1 16 LYS CG C -3.140 -0.296 -4.208 1.00 . A A . 16 LYS CG 1 1 29 17635 1 1 16 LYS H H -4.738 1.506 -1.560 1.00 . A A . 16 LYS H 1 1 29 17636 1 1 16 LYS HA H -5.523 -0.390 -3.402 1.00 . A A . 16 LYS HA 1 1 29 17637 1 1 16 LYS HB2 H -3.062 0.493 -2.239 1.00 . A A . 16 LYS HB2 1 1 29 17638 1 1 16 LYS HB3 H -3.044 -1.263 -2.321 1.00 . A A . 16 LYS HB3 1 1 29 17639 1 1 16 LYS HD2 H -2.269 1.642 -4.376 1.00 . A A . 16 LYS HD2 1 1 29 17640 1 1 16 LYS HD3 H -1.192 0.412 -3.711 1.00 . A A . 16 LYS HD3 1 1 29 17641 1 1 16 LYS HE2 H -2.136 0.056 -6.502 1.00 . A A . 16 LYS HE2 1 1 29 17642 1 1 16 LYS HE3 H -0.951 1.326 -6.198 1.00 . A A . 16 LYS HE3 1 1 29 17643 1 1 16 LYS HG2 H -2.901 -1.288 -4.561 1.00 . A A . 16 LYS HG2 1 1 29 17644 1 1 16 LYS HG3 H -3.992 0.086 -4.751 1.00 . A A . 16 LYS HG3 1 1 29 17645 1 1 16 LYS HZ1 H 0.354 -0.471 -4.998 1.00 . A A . 16 LYS HZ1 1 1 29 17646 1 1 16 LYS HZ2 H -0.675 -1.583 -5.751 1.00 . A A . 16 LYS HZ2 1 1 29 17647 1 1 16 LYS HZ3 H 0.299 -0.564 -6.685 1.00 . A A . 16 LYS HZ3 1 1 29 17648 1 1 16 LYS N N -5.398 0.799 -1.722 1.00 . A A . 16 LYS N 1 1 29 17649 1 1 16 LYS NZ N -0.268 -0.628 -5.816 1.00 . A A . 16 LYS NZ 1 1 29 17650 1 1 16 LYS O O -5.504 -1.640 -0.468 1.00 . A A . 16 LYS O 1 1 29 17651 1 1 17 PRO C C -4.806 -4.596 -0.862 1.00 . A A . 17 PRO C 1 1 29 17652 1 1 17 PRO CA C -5.901 -4.070 -1.782 1.00 . A A . 17 PRO CA 1 1 29 17653 1 1 17 PRO CB C -6.093 -5.011 -2.976 1.00 . A A . 17 PRO CB 1 1 29 17654 1 1 17 PRO CD C -5.401 -2.905 -3.865 1.00 . A A . 17 PRO CD 1 1 29 17655 1 1 17 PRO CG C -5.316 -4.389 -4.085 1.00 . A A . 17 PRO CG 1 1 29 17656 1 1 17 PRO HA H -6.826 -3.993 -1.229 1.00 . A A . 17 PRO HA 1 1 29 17657 1 1 17 PRO HB2 H -5.712 -5.991 -2.728 1.00 . A A . 17 PRO HB2 1 1 29 17658 1 1 17 PRO HB3 H -7.143 -5.078 -3.220 1.00 . A A . 17 PRO HB3 1 1 29 17659 1 1 17 PRO HD2 H -4.497 -2.421 -4.206 1.00 . A A . 17 PRO HD2 1 1 29 17660 1 1 17 PRO HD3 H -6.264 -2.497 -4.369 1.00 . A A . 17 PRO HD3 1 1 29 17661 1 1 17 PRO HG2 H -4.288 -4.717 -4.042 1.00 . A A . 17 PRO HG2 1 1 29 17662 1 1 17 PRO HG3 H -5.756 -4.653 -5.035 1.00 . A A . 17 PRO HG3 1 1 29 17663 1 1 17 PRO N N -5.542 -2.790 -2.403 1.00 . A A . 17 PRO N 1 1 29 17664 1 1 17 PRO O O -3.617 -4.419 -1.130 1.00 . A A . 17 PRO O 1 1 29 17665 1 1 18 ALA C C -3.330 -6.795 0.516 1.00 . A A . 18 ALA C 1 1 29 17666 1 1 18 ALA CA C -4.271 -5.800 1.186 1.00 . A A . 18 ALA CA 1 1 29 17667 1 1 18 ALA CB C -5.016 -6.464 2.333 1.00 . A A . 18 ALA CB 1 1 29 17668 1 1 18 ALA H H -6.177 -5.353 0.381 1.00 . A A . 18 ALA H 1 1 29 17669 1 1 18 ALA HA H -3.688 -4.985 1.590 1.00 . A A . 18 ALA HA 1 1 29 17670 1 1 18 ALA HB1 H -5.881 -5.872 2.591 1.00 . A A . 18 ALA HB1 1 1 29 17671 1 1 18 ALA HB2 H -4.363 -6.540 3.190 1.00 . A A . 18 ALA HB2 1 1 29 17672 1 1 18 ALA HB3 H -5.332 -7.452 2.033 1.00 . A A . 18 ALA HB3 1 1 29 17673 1 1 18 ALA N N -5.215 -5.244 0.224 1.00 . A A . 18 ALA N 1 1 29 17674 1 1 18 ALA O O -3.576 -7.240 -0.605 1.00 . A A . 18 ALA O 1 1 29 17675 1 1 19 GLY C C -0.641 -7.579 -0.611 1.00 . A A . 19 GLY C 1 1 29 17676 1 1 19 GLY CA C -1.289 -8.081 0.665 1.00 . A A . 19 GLY CA 1 1 29 17677 1 1 19 GLY H H -2.106 -6.754 2.099 1.00 . A A . 19 GLY H 1 1 29 17678 1 1 19 GLY HA2 H -1.793 -9.013 0.457 1.00 . A A . 19 GLY HA2 1 1 29 17679 1 1 19 GLY HA3 H -0.519 -8.257 1.401 1.00 . A A . 19 GLY HA3 1 1 29 17680 1 1 19 GLY N N -2.251 -7.141 1.210 1.00 . A A . 19 GLY N 1 1 29 17681 1 1 19 GLY O O -0.063 -8.358 -1.368 1.00 . A A . 19 GLY O 1 1 29 17682 1 1 20 THR C C 1.041 -4.795 -1.682 1.00 . A A . 20 THR C 1 1 29 17683 1 1 20 THR CA C -0.151 -5.673 -2.045 1.00 . A A . 20 THR CA 1 1 29 17684 1 1 20 THR CB C -1.199 -4.846 -2.793 1.00 . A A . 20 THR CB 1 1 29 17685 1 1 20 THR CG2 C -0.666 -4.209 -4.058 1.00 . A A . 20 THR CG2 1 1 29 17686 1 1 20 THR H H -1.207 -5.701 -0.212 1.00 . A A . 20 THR H 1 1 29 17687 1 1 20 THR HA H 0.188 -6.472 -2.687 1.00 . A A . 20 THR HA 1 1 29 17688 1 1 20 THR HB H -1.547 -4.055 -2.145 1.00 . A A . 20 THR HB 1 1 29 17689 1 1 20 THR HG1 H -2.035 -6.307 -3.794 1.00 . A A . 20 THR HG1 1 1 29 17690 1 1 20 THR HG21 H 0.414 -4.235 -4.046 1.00 . A A . 20 THR HG21 1 1 29 17691 1 1 20 THR HG22 H -1.030 -4.754 -4.917 1.00 . A A . 20 THR HG22 1 1 29 17692 1 1 20 THR HG23 H -1.001 -3.184 -4.114 1.00 . A A . 20 THR HG23 1 1 29 17693 1 1 20 THR N N -0.736 -6.273 -0.852 1.00 . A A . 20 THR N 1 1 29 17694 1 1 20 THR O O 0.885 -3.746 -1.056 1.00 . A A . 20 THR O 1 1 29 17695 1 1 20 THR OG1 O -2.309 -5.649 -3.151 1.00 . A A . 20 THR OG1 1 1 29 17696 1 1 21 THR C C 3.373 -3.067 -2.345 1.00 . A A . 21 THR C 1 1 29 17697 1 1 21 THR CA C 3.454 -4.487 -1.793 1.00 . A A . 21 THR CA 1 1 29 17698 1 1 21 THR CB C 4.661 -5.210 -2.390 1.00 . A A . 21 THR CB 1 1 29 17699 1 1 21 THR CG2 C 4.445 -5.646 -3.823 1.00 . A A . 21 THR CG2 1 1 29 17700 1 1 21 THR H H 2.291 -6.075 -2.572 1.00 . A A . 21 THR H 1 1 29 17701 1 1 21 THR HA H 3.570 -4.438 -0.721 1.00 . A A . 21 THR HA 1 1 29 17702 1 1 21 THR HB H 4.865 -6.093 -1.803 1.00 . A A . 21 THR HB 1 1 29 17703 1 1 21 THR HG1 H 6.598 -4.925 -2.332 1.00 . A A . 21 THR HG1 1 1 29 17704 1 1 21 THR HG21 H 3.417 -5.466 -4.102 1.00 . A A . 21 THR HG21 1 1 29 17705 1 1 21 THR HG22 H 5.099 -5.085 -4.473 1.00 . A A . 21 THR HG22 1 1 29 17706 1 1 21 THR HG23 H 4.663 -6.700 -3.914 1.00 . A A . 21 THR HG23 1 1 29 17707 1 1 21 THR N N 2.232 -5.231 -2.077 1.00 . A A . 21 THR N 1 1 29 17708 1 1 21 THR O O 2.483 -2.746 -3.132 1.00 . A A . 21 THR O 1 1 29 17709 1 1 21 THR OG1 O 5.808 -4.379 -2.362 1.00 . A A . 21 THR OG1 1 1 29 17710 1 1 22 CYS C C 5.500 -0.609 -3.347 1.00 . A A . 22 CYS C 1 1 29 17711 1 1 22 CYS CA C 4.345 -0.835 -2.378 1.00 . A A . 22 CYS CA 1 1 29 17712 1 1 22 CYS CB C 4.476 0.109 -1.182 1.00 . A A . 22 CYS CB 1 1 29 17713 1 1 22 CYS H H 4.992 -2.537 -1.298 1.00 . A A . 22 CYS H 1 1 29 17714 1 1 22 CYS HA H 3.416 -0.629 -2.888 1.00 . A A . 22 CYS HA 1 1 29 17715 1 1 22 CYS HB2 H 5.329 -0.187 -0.590 1.00 . A A . 22 CYS HB2 1 1 29 17716 1 1 22 CYS HB3 H 4.627 1.116 -1.543 1.00 . A A . 22 CYS HB3 1 1 29 17717 1 1 22 CYS N N 4.309 -2.221 -1.926 1.00 . A A . 22 CYS N 1 1 29 17718 1 1 22 CYS O O 5.348 0.071 -4.362 1.00 . A A . 22 CYS O 1 1 29 17719 1 1 22 CYS SG S 3.021 0.125 -0.084 1.00 . A A . 22 CYS SG 1 1 29 17720 1 1 23 TRP C C 8.452 -2.408 -4.174 1.00 . A A . 23 TRP C 1 1 29 17721 1 1 23 TRP CA C 7.837 -1.046 -3.870 1.00 . A A . 23 TRP CA 1 1 29 17722 1 1 23 TRP CB C 8.872 -0.147 -3.190 1.00 . A A . 23 TRP CB 1 1 29 17723 1 1 23 TRP CD1 C 10.144 0.721 -5.238 1.00 . A A . 23 TRP CD1 1 1 29 17724 1 1 23 TRP CD2 C 11.435 -0.289 -3.713 1.00 . A A . 23 TRP CD2 1 1 29 17725 1 1 23 TRP CE2 C 12.250 0.138 -4.779 1.00 . A A . 23 TRP CE2 1 1 29 17726 1 1 23 TRP CE3 C 12.030 -0.950 -2.635 1.00 . A A . 23 TRP CE3 1 1 29 17727 1 1 23 TRP CG C 10.091 0.094 -4.026 1.00 . A A . 23 TRP CG 1 1 29 17728 1 1 23 TRP CH2 C 14.181 -0.725 -3.729 1.00 . A A . 23 TRP CH2 1 1 29 17729 1 1 23 TRP CZ2 C 13.626 -0.075 -4.797 1.00 . A A . 23 TRP CZ2 1 1 29 17730 1 1 23 TRP CZ3 C 13.396 -1.162 -2.654 1.00 . A A . 23 TRP CZ3 1 1 29 17731 1 1 23 TRP H H 6.714 -1.714 -2.205 1.00 . A A . 23 TRP H 1 1 29 17732 1 1 23 TRP HA H 7.531 -0.588 -4.799 1.00 . A A . 23 TRP HA 1 1 29 17733 1 1 23 TRP HB2 H 8.421 0.810 -2.975 1.00 . A A . 23 TRP HB2 1 1 29 17734 1 1 23 TRP HB3 H 9.186 -0.608 -2.265 1.00 . A A . 23 TRP HB3 1 1 29 17735 1 1 23 TRP HD1 H 9.284 1.129 -5.749 1.00 . A A . 23 TRP HD1 1 1 29 17736 1 1 23 TRP HE1 H 11.732 1.149 -6.544 1.00 . A A . 23 TRP HE1 1 1 29 17737 1 1 23 TRP HE3 H 11.441 -1.294 -1.797 1.00 . A A . 23 TRP HE3 1 1 29 17738 1 1 23 TRP HH2 H 15.244 -0.913 -3.702 1.00 . A A . 23 TRP HH2 1 1 29 17739 1 1 23 TRP HZ2 H 14.245 0.256 -5.618 1.00 . A A . 23 TRP HZ2 1 1 29 17740 1 1 23 TRP HZ3 H 13.872 -1.672 -1.830 1.00 . A A . 23 TRP HZ3 1 1 29 17741 1 1 23 TRP N N 6.655 -1.184 -3.028 1.00 . A A . 23 TRP N 1 1 29 17742 1 1 23 TRP NE1 N 11.438 0.752 -5.697 1.00 . A A . 23 TRP NE1 1 1 29 17743 1 1 23 TRP O O 9.388 -2.842 -3.502 1.00 . A A . 23 TRP O 1 1 29 17744 1 1 24 ARG C C 9.879 -4.318 -6.003 1.00 . A A . 24 ARG C 1 1 29 17745 1 1 24 ARG CA C 8.415 -4.393 -5.582 1.00 . A A . 24 ARG CA 1 1 29 17746 1 1 24 ARG CB C 7.572 -4.959 -6.726 1.00 . A A . 24 ARG CB 1 1 29 17747 1 1 24 ARG CD C 7.173 -4.638 -9.186 1.00 . A A . 24 ARG CD 1 1 29 17748 1 1 24 ARG CG C 7.298 -3.955 -7.834 1.00 . A A . 24 ARG CG 1 1 29 17749 1 1 24 ARG CZ C 7.807 -4.154 -11.518 1.00 . A A . 24 ARG CZ 1 1 29 17750 1 1 24 ARG H H 7.174 -2.681 -5.687 1.00 . A A . 24 ARG H 1 1 29 17751 1 1 24 ARG HA H 8.332 -5.048 -4.727 1.00 . A A . 24 ARG HA 1 1 29 17752 1 1 24 ARG HB2 H 8.090 -5.804 -7.156 1.00 . A A . 24 ARG HB2 1 1 29 17753 1 1 24 ARG HB3 H 6.625 -5.292 -6.329 1.00 . A A . 24 ARG HB3 1 1 29 17754 1 1 24 ARG HD2 H 7.838 -5.488 -9.209 1.00 . A A . 24 ARG HD2 1 1 29 17755 1 1 24 ARG HD3 H 6.154 -4.976 -9.311 1.00 . A A . 24 ARG HD3 1 1 29 17756 1 1 24 ARG HE H 7.526 -2.779 -10.100 1.00 . A A . 24 ARG HE 1 1 29 17757 1 1 24 ARG HG2 H 6.377 -3.436 -7.617 1.00 . A A . 24 ARG HG2 1 1 29 17758 1 1 24 ARG HG3 H 8.112 -3.246 -7.873 1.00 . A A . 24 ARG HG3 1 1 29 17759 1 1 24 ARG HH11 H 7.576 -6.121 -11.103 1.00 . A A . 24 ARG HH11 1 1 29 17760 1 1 24 ARG HH12 H 8.022 -5.754 -12.735 1.00 . A A . 24 ARG HH12 1 1 29 17761 1 1 24 ARG HH21 H 8.111 -2.294 -12.247 1.00 . A A . 24 ARG HH21 1 1 29 17762 1 1 24 ARG HH22 H 8.326 -3.582 -13.385 1.00 . A A . 24 ARG HH22 1 1 29 17763 1 1 24 ARG N N 7.919 -3.079 -5.189 1.00 . A A . 24 ARG N 1 1 29 17764 1 1 24 ARG NE N 7.514 -3.740 -10.287 1.00 . A A . 24 ARG NE 1 1 29 17765 1 1 24 ARG NH1 N 7.801 -5.449 -11.809 1.00 . A A . 24 ARG NH1 1 1 29 17766 1 1 24 ARG NH2 N 8.106 -3.271 -12.460 1.00 . A A . 24 ARG NH2 1 1 29 17767 1 1 24 ARG O O 10.283 -3.404 -6.721 1.00 . A A . 24 ARG O 1 1 29 17768 1 1 25 THR C C 12.717 -6.639 -5.414 1.00 . A A . 25 THR C 1 1 29 17769 1 1 25 THR CA C 12.090 -5.328 -5.879 1.00 . A A . 25 THR CA 1 1 29 17770 1 1 25 THR CB C 12.820 -4.146 -5.240 1.00 . A A . 25 THR CB 1 1 29 17771 1 1 25 THR CG2 C 12.520 -3.984 -3.765 1.00 . A A . 25 THR CG2 1 1 29 17772 1 1 25 THR H H 10.290 -5.986 -4.980 1.00 . A A . 25 THR H 1 1 29 17773 1 1 25 THR HA H 12.183 -5.260 -6.953 1.00 . A A . 25 THR HA 1 1 29 17774 1 1 25 THR HB H 12.517 -3.237 -5.740 1.00 . A A . 25 THR HB 1 1 29 17775 1 1 25 THR HG1 H 14.528 -5.012 -4.834 1.00 . A A . 25 THR HG1 1 1 29 17776 1 1 25 THR HG21 H 12.262 -4.944 -3.343 1.00 . A A . 25 THR HG21 1 1 29 17777 1 1 25 THR HG22 H 13.391 -3.592 -3.262 1.00 . A A . 25 THR HG22 1 1 29 17778 1 1 25 THR HG23 H 11.693 -3.301 -3.638 1.00 . A A . 25 THR HG23 1 1 29 17779 1 1 25 THR N N 10.670 -5.285 -5.550 1.00 . A A . 25 THR N 1 1 29 17780 1 1 25 THR O O 12.159 -7.340 -4.571 1.00 . A A . 25 THR O 1 1 29 17781 1 1 25 THR OG1 O 14.222 -4.286 -5.381 1.00 . A A . 25 THR OG1 1 1 29 17782 1 1 26 SER C C 15.510 -7.957 -4.422 1.00 . A A . 26 SER C 1 1 29 17783 1 1 26 SER CA C 14.583 -8.189 -5.612 1.00 . A A . 26 SER CA 1 1 29 17784 1 1 26 SER CB C 15.384 -8.709 -6.808 1.00 . A A . 26 SER CB 1 1 29 17785 1 1 26 SER H H 14.275 -6.363 -6.637 1.00 . A A . 26 SER H 1 1 29 17786 1 1 26 SER HA H 13.843 -8.926 -5.338 1.00 . A A . 26 SER HA 1 1 29 17787 1 1 26 SER HB2 H 16.288 -8.128 -6.913 1.00 . A A . 26 SER HB2 1 1 29 17788 1 1 26 SER HB3 H 15.640 -9.746 -6.644 1.00 . A A . 26 SER HB3 1 1 29 17789 1 1 26 SER HG H 14.724 -9.420 -8.509 1.00 . A A . 26 SER HG 1 1 29 17790 1 1 26 SER N N 13.880 -6.963 -5.970 1.00 . A A . 26 SER N 1 1 29 17791 1 1 26 SER O O 16.705 -8.248 -4.485 1.00 . A A . 26 SER O 1 1 29 17792 1 1 26 SER OG O 14.636 -8.607 -8.007 1.00 . A A . 26 SER OG 1 1 29 17793 1 1 27 VAL C C 14.850 -7.232 -0.887 1.00 . A A . 27 VAL C 1 1 29 17794 1 1 27 VAL CA C 15.726 -7.162 -2.132 1.00 . A A . 27 VAL CA 1 1 29 17795 1 1 27 VAL CB C 16.399 -5.778 -2.195 1.00 . A A . 27 VAL CB 1 1 29 17796 1 1 27 VAL CG1 C 17.359 -5.597 -1.029 1.00 . A A . 27 VAL CG1 1 1 29 17797 1 1 27 VAL CG2 C 17.119 -5.594 -3.522 1.00 . A A . 27 VAL CG2 1 1 29 17798 1 1 27 VAL H H 13.993 -7.222 -3.347 1.00 . A A . 27 VAL H 1 1 29 17799 1 1 27 VAL HA H 16.496 -7.911 -2.058 1.00 . A A . 27 VAL HA 1 1 29 17800 1 1 27 VAL HB H 15.631 -5.022 -2.119 1.00 . A A . 27 VAL HB 1 1 29 17801 1 1 27 VAL HG11 H 17.798 -6.550 -0.773 1.00 . A A . 27 VAL HG11 1 1 29 17802 1 1 27 VAL HG12 H 18.140 -4.906 -1.310 1.00 . A A . 27 VAL HG12 1 1 29 17803 1 1 27 VAL HG13 H 16.822 -5.207 -0.177 1.00 . A A . 27 VAL HG13 1 1 29 17804 1 1 27 VAL HG21 H 17.795 -6.421 -3.682 1.00 . A A . 27 VAL HG21 1 1 29 17805 1 1 27 VAL HG22 H 16.395 -5.560 -4.323 1.00 . A A . 27 VAL HG22 1 1 29 17806 1 1 27 VAL HG23 H 17.679 -4.671 -3.503 1.00 . A A . 27 VAL HG23 1 1 29 17807 1 1 27 VAL N N 14.950 -7.432 -3.337 1.00 . A A . 27 VAL N 1 1 29 17808 1 1 27 VAL O O 15.223 -7.841 0.115 1.00 . A A . 27 VAL O 1 1 29 17809 1 1 28 SER C C 11.379 -6.087 -0.282 1.00 . A A . 28 SER C 1 1 29 17810 1 1 28 SER CA C 12.750 -6.590 0.160 1.00 . A A . 28 SER CA 1 1 29 17811 1 1 28 SER CB C 13.288 -5.713 1.291 1.00 . A A . 28 SER CB 1 1 29 17812 1 1 28 SER H H 13.447 -6.136 -1.787 1.00 . A A . 28 SER H 1 1 29 17813 1 1 28 SER HA H 12.649 -7.603 0.519 1.00 . A A . 28 SER HA 1 1 29 17814 1 1 28 SER HB2 H 14.357 -5.844 1.368 1.00 . A A . 28 SER HB2 1 1 29 17815 1 1 28 SER HB3 H 13.068 -4.677 1.077 1.00 . A A . 28 SER HB3 1 1 29 17816 1 1 28 SER HG H 12.976 -6.941 2.785 1.00 . A A . 28 SER HG 1 1 29 17817 1 1 28 SER N N 13.685 -6.603 -0.960 1.00 . A A . 28 SER N 1 1 29 17818 1 1 28 SER O O 11.275 -5.104 -1.016 1.00 . A A . 28 SER O 1 1 29 17819 1 1 28 SER OG O 12.696 -6.058 2.531 1.00 . A A . 28 SER OG 1 1 29 17820 1 1 29 SER C C 8.180 -5.983 1.064 1.00 . A A . 29 SER C 1 1 29 17821 1 1 29 SER CA C 8.966 -6.389 -0.178 1.00 . A A . 29 SER CA 1 1 29 17822 1 1 29 SER CB C 8.260 -7.545 -0.888 1.00 . A A . 29 SER CB 1 1 29 17823 1 1 29 SER H H 10.478 -7.542 0.752 1.00 . A A . 29 SER H 1 1 29 17824 1 1 29 SER HA H 9.017 -5.544 -0.849 1.00 . A A . 29 SER HA 1 1 29 17825 1 1 29 SER HB2 H 7.230 -7.277 -1.071 1.00 . A A . 29 SER HB2 1 1 29 17826 1 1 29 SER HB3 H 8.752 -7.742 -1.829 1.00 . A A . 29 SER HB3 1 1 29 17827 1 1 29 SER HG H 9.065 -9.242 -0.331 1.00 . A A . 29 SER HG 1 1 29 17828 1 1 29 SER N N 10.331 -6.767 0.170 1.00 . A A . 29 SER N 1 1 29 17829 1 1 29 SER O O 8.430 -6.485 2.160 1.00 . A A . 29 SER O 1 1 29 17830 1 1 29 SER OG O 8.291 -8.723 -0.100 1.00 . A A . 29 SER OG 1 1 29 17831 1 1 30 HIS C C 4.923 -4.702 1.649 1.00 . A A . 30 HIS C 1 1 29 17832 1 1 30 HIS CA C 6.405 -4.599 1.992 1.00 . A A . 30 HIS CA 1 1 29 17833 1 1 30 HIS CB C 6.762 -3.152 2.338 1.00 . A A . 30 HIS CB 1 1 29 17834 1 1 30 HIS CD2 C 9.331 -3.119 1.985 1.00 . A A . 30 HIS CD2 1 1 29 17835 1 1 30 HIS CE1 C 9.923 -2.486 3.999 1.00 . A A . 30 HIS CE1 1 1 29 17836 1 1 30 HIS CG C 8.199 -2.963 2.712 1.00 . A A . 30 HIS CG 1 1 29 17837 1 1 30 HIS H H 7.077 -4.710 -0.012 1.00 . A A . 30 HIS H 1 1 29 17838 1 1 30 HIS HA H 6.609 -5.225 2.848 1.00 . A A . 30 HIS HA 1 1 29 17839 1 1 30 HIS HB2 H 6.555 -2.524 1.485 1.00 . A A . 30 HIS HB2 1 1 29 17840 1 1 30 HIS HB3 H 6.155 -2.829 3.172 1.00 . A A . 30 HIS HB3 1 1 29 17841 1 1 30 HIS HD1 H 8.013 -2.372 4.726 1.00 . A A . 30 HIS HD1 1 1 29 17842 1 1 30 HIS HD2 H 9.392 -3.425 0.950 1.00 . A A . 30 HIS HD2 1 1 29 17843 1 1 30 HIS HE1 H 10.519 -2.199 4.853 1.00 . A A . 30 HIS HE1 1 1 29 17844 1 1 30 HIS HE2 H 11.326 -2.756 2.532 1.00 . A A . 30 HIS HE2 1 1 29 17845 1 1 30 HIS N N 7.229 -5.072 0.885 1.00 . A A . 30 HIS N 1 1 29 17846 1 1 30 HIS ND1 N 8.604 -2.567 3.969 1.00 . A A . 30 HIS ND1 1 1 29 17847 1 1 30 HIS NE2 N 10.388 -2.816 2.809 1.00 . A A . 30 HIS NE2 1 1 29 17848 1 1 30 HIS O O 4.291 -3.713 1.277 1.00 . A A . 30 HIS O 1 1 29 17849 1 1 31 TYR C C 2.071 -5.282 2.373 1.00 . A A . 31 TYR C 1 1 29 17850 1 1 31 TYR CA C 2.964 -6.138 1.480 1.00 . A A . 31 TYR CA 1 1 29 17851 1 1 31 TYR CB C 2.620 -7.617 1.664 1.00 . A A . 31 TYR CB 1 1 29 17852 1 1 31 TYR CD1 C 3.930 -9.557 0.718 1.00 . A A . 31 TYR CD1 1 1 29 17853 1 1 31 TYR CD2 C 2.615 -8.249 -0.780 1.00 . A A . 31 TYR CD2 1 1 29 17854 1 1 31 TYR CE1 C 4.337 -10.357 -0.333 1.00 . A A . 31 TYR CE1 1 1 29 17855 1 1 31 TYR CE2 C 3.017 -9.045 -1.835 1.00 . A A . 31 TYR CE2 1 1 29 17856 1 1 31 TYR CG C 3.063 -8.490 0.512 1.00 . A A . 31 TYR CG 1 1 29 17857 1 1 31 TYR CZ C 3.878 -10.098 -1.606 1.00 . A A . 31 TYR CZ 1 1 29 17858 1 1 31 TYR H H 4.928 -6.655 2.077 1.00 . A A . 31 TYR H 1 1 29 17859 1 1 31 TYR HA H 2.793 -5.863 0.450 1.00 . A A . 31 TYR HA 1 1 29 17860 1 1 31 TYR HB2 H 3.100 -7.982 2.560 1.00 . A A . 31 TYR HB2 1 1 29 17861 1 1 31 TYR HB3 H 1.550 -7.720 1.768 1.00 . A A . 31 TYR HB3 1 1 29 17862 1 1 31 TYR HD1 H 4.287 -9.757 1.717 1.00 . A A . 31 TYR HD1 1 1 29 17863 1 1 31 TYR HD2 H 1.941 -7.423 -0.956 1.00 . A A . 31 TYR HD2 1 1 29 17864 1 1 31 TYR HE1 H 5.011 -11.182 -0.153 1.00 . A A . 31 TYR HE1 1 1 29 17865 1 1 31 TYR HE2 H 2.657 -8.841 -2.833 1.00 . A A . 31 TYR HE2 1 1 29 17866 1 1 31 TYR HH H 4.799 -10.371 -3.272 1.00 . A A . 31 TYR HH 1 1 29 17867 1 1 31 TYR N N 4.373 -5.905 1.777 1.00 . A A . 31 TYR N 1 1 29 17868 1 1 31 TYR O O 2.260 -5.229 3.588 1.00 . A A . 31 TYR O 1 1 29 17869 1 1 31 TYR OH O 4.281 -10.893 -2.655 1.00 . A A . 31 TYR OH 1 1 29 17870 1 1 32 CYS C C -0.861 -4.600 3.244 1.00 . A A . 32 CYS C 1 1 29 17871 1 1 32 CYS CA C 0.174 -3.763 2.501 1.00 . A A . 32 CYS CA 1 1 29 17872 1 1 32 CYS CB C -0.526 -2.788 1.553 1.00 . A A . 32 CYS CB 1 1 29 17873 1 1 32 CYS H H 0.997 -4.699 0.791 1.00 . A A . 32 CYS H 1 1 29 17874 1 1 32 CYS HA H 0.747 -3.200 3.223 1.00 . A A . 32 CYS HA 1 1 29 17875 1 1 32 CYS HB2 H -0.568 -3.225 0.566 1.00 . A A . 32 CYS HB2 1 1 29 17876 1 1 32 CYS HB3 H -1.531 -2.613 1.906 1.00 . A A . 32 CYS HB3 1 1 29 17877 1 1 32 CYS N N 1.098 -4.615 1.762 1.00 . A A . 32 CYS N 1 1 29 17878 1 1 32 CYS O O -0.926 -5.818 3.076 1.00 . A A . 32 CYS O 1 1 29 17879 1 1 32 CYS SG S 0.301 -1.172 1.406 1.00 . A A . 32 CYS SG 1 1 29 17880 1 1 33 THR C C -4.098 -4.148 4.432 1.00 . A A . 33 THR C 1 1 29 17881 1 1 33 THR CA C -2.703 -4.622 4.836 1.00 . A A . 33 THR CA 1 1 29 17882 1 1 33 THR CB C -2.489 -4.389 6.333 1.00 . A A . 33 THR CB 1 1 29 17883 1 1 33 THR CG2 C -1.034 -4.453 6.748 1.00 . A A . 33 THR CG2 1 1 29 17884 1 1 33 THR H H -1.567 -2.968 4.156 1.00 . A A . 33 THR H 1 1 29 17885 1 1 33 THR HA H -2.623 -5.679 4.631 1.00 . A A . 33 THR HA 1 1 29 17886 1 1 33 THR HB H -3.024 -5.149 6.885 1.00 . A A . 33 THR HB 1 1 29 17887 1 1 33 THR HG1 H -3.230 -3.143 7.649 1.00 . A A . 33 THR HG1 1 1 29 17888 1 1 33 THR HG21 H -0.555 -5.283 6.252 1.00 . A A . 33 THR HG21 1 1 29 17889 1 1 33 THR HG22 H -0.540 -3.533 6.471 1.00 . A A . 33 THR HG22 1 1 29 17890 1 1 33 THR HG23 H -0.971 -4.588 7.818 1.00 . A A . 33 THR HG23 1 1 29 17891 1 1 33 THR N N -1.669 -3.939 4.065 1.00 . A A . 33 THR N 1 1 29 17892 1 1 33 THR O O -5.075 -4.404 5.135 1.00 . A A . 33 THR O 1 1 29 17893 1 1 33 THR OG1 O -2.990 -3.122 6.720 1.00 . A A . 33 THR OG1 1 1 29 17894 1 1 34 GLY C C -6.214 -2.165 3.881 1.00 . A A . 34 GLY C 1 1 29 17895 1 1 34 GLY CA C -5.470 -2.963 2.826 1.00 . A A . 34 GLY CA 1 1 29 17896 1 1 34 GLY H H -3.377 -3.282 2.774 1.00 . A A . 34 GLY H 1 1 29 17897 1 1 34 GLY HA2 H -6.080 -3.805 2.531 1.00 . A A . 34 GLY HA2 1 1 29 17898 1 1 34 GLY HA3 H -5.305 -2.333 1.965 1.00 . A A . 34 GLY HA3 1 1 29 17899 1 1 34 GLY N N -4.187 -3.458 3.297 1.00 . A A . 34 GLY N 1 1 29 17900 1 1 34 GLY O O -7.439 -2.060 3.839 1.00 . A A . 34 GLY O 1 1 29 17901 1 1 35 ARG C C -5.642 0.649 5.805 1.00 . A A . 35 ARG C 1 1 29 17902 1 1 35 ARG CA C -6.070 -0.812 5.901 1.00 . A A . 35 ARG CA 1 1 29 17903 1 1 35 ARG CB C -5.676 -1.382 7.265 1.00 . A A . 35 ARG CB 1 1 29 17904 1 1 35 ARG CD C -6.674 -2.703 9.155 1.00 . A A . 35 ARG CD 1 1 29 17905 1 1 35 ARG CG C -6.458 -2.627 7.653 1.00 . A A . 35 ARG CG 1 1 29 17906 1 1 35 ARG CZ C -5.054 -4.430 9.836 1.00 . A A . 35 ARG CZ 1 1 29 17907 1 1 35 ARG H H -4.500 -1.723 4.812 1.00 . A A . 35 ARG H 1 1 29 17908 1 1 35 ARG HA H -7.143 -0.868 5.794 1.00 . A A . 35 ARG HA 1 1 29 17909 1 1 35 ARG HB2 H -4.626 -1.634 7.248 1.00 . A A . 35 ARG HB2 1 1 29 17910 1 1 35 ARG HB3 H -5.845 -0.628 8.019 1.00 . A A . 35 ARG HB3 1 1 29 17911 1 1 35 ARG HD2 H -6.932 -1.720 9.519 1.00 . A A . 35 ARG HD2 1 1 29 17912 1 1 35 ARG HD3 H -7.488 -3.385 9.355 1.00 . A A . 35 ARG HD3 1 1 29 17913 1 1 35 ARG HE H -4.971 -2.510 10.372 1.00 . A A . 35 ARG HE 1 1 29 17914 1 1 35 ARG HG2 H -7.420 -2.604 7.162 1.00 . A A . 35 ARG HG2 1 1 29 17915 1 1 35 ARG HG3 H -5.909 -3.500 7.332 1.00 . A A . 35 ARG HG3 1 1 29 17916 1 1 35 ARG HH11 H -6.545 -5.103 8.646 1.00 . A A . 35 ARG HH11 1 1 29 17917 1 1 35 ARG HH12 H -5.393 -6.298 9.138 1.00 . A A . 35 ARG HH12 1 1 29 17918 1 1 35 ARG HH21 H -3.454 -4.080 11.020 1.00 . A A . 35 ARG HH21 1 1 29 17919 1 1 35 ARG HH22 H -3.638 -5.718 10.486 1.00 . A A . 35 ARG HH22 1 1 29 17920 1 1 35 ARG N N -5.472 -1.603 4.831 1.00 . A A . 35 ARG N 1 1 29 17921 1 1 35 ARG NE N -5.481 -3.170 9.857 1.00 . A A . 35 ARG NE 1 1 29 17922 1 1 35 ARG NH1 N -5.719 -5.352 9.150 1.00 . A A . 35 ARG NH1 1 1 29 17923 1 1 35 ARG NH2 N -3.959 -4.771 10.502 1.00 . A A . 35 ARG NH2 1 1 29 17924 1 1 35 ARG O O -6.406 1.552 6.146 1.00 . A A . 35 ARG O 1 1 29 17925 1 1 36 SER C C -3.043 2.350 3.938 1.00 . A A . 36 SER C 1 1 29 17926 1 1 36 SER CA C -3.889 2.225 5.201 1.00 . A A . 36 SER CA 1 1 29 17927 1 1 36 SER CB C -3.053 2.597 6.427 1.00 . A A . 36 SER CB 1 1 29 17928 1 1 36 SER H H -3.856 0.112 5.086 1.00 . A A . 36 SER H 1 1 29 17929 1 1 36 SER HA H -4.726 2.903 5.129 1.00 . A A . 36 SER HA 1 1 29 17930 1 1 36 SER HB2 H -2.621 1.702 6.850 1.00 . A A . 36 SER HB2 1 1 29 17931 1 1 36 SER HB3 H -2.264 3.272 6.131 1.00 . A A . 36 SER HB3 1 1 29 17932 1 1 36 SER HG H -3.845 4.178 7.269 1.00 . A A . 36 SER HG 1 1 29 17933 1 1 36 SER N N -4.418 0.873 5.341 1.00 . A A . 36 SER N 1 1 29 17934 1 1 36 SER O O -2.519 1.360 3.430 1.00 . A A . 36 SER O 1 1 29 17935 1 1 36 SER OG O -3.849 3.229 7.415 1.00 . A A . 36 SER OG 1 1 29 17936 1 1 37 CYS C C -0.638 3.647 2.515 1.00 . A A . 37 CYS C 1 1 29 17937 1 1 37 CYS CA C -2.127 3.829 2.237 1.00 . A A . 37 CYS CA 1 1 29 17938 1 1 37 CYS CB C -2.394 5.244 1.719 1.00 . A A . 37 CYS CB 1 1 29 17939 1 1 37 CYS H H -3.351 4.326 3.890 1.00 . A A . 37 CYS H 1 1 29 17940 1 1 37 CYS HA H -2.430 3.117 1.484 1.00 . A A . 37 CYS HA 1 1 29 17941 1 1 37 CYS HB2 H -2.784 5.847 2.525 1.00 . A A . 37 CYS HB2 1 1 29 17942 1 1 37 CYS HB3 H -1.466 5.674 1.371 1.00 . A A . 37 CYS HB3 1 1 29 17943 1 1 37 CYS N N -2.912 3.575 3.439 1.00 . A A . 37 CYS N 1 1 29 17944 1 1 37 CYS O O 0.138 3.328 1.614 1.00 . A A . 37 CYS O 1 1 29 17945 1 1 37 CYS SG S -3.588 5.318 0.345 1.00 . A A . 37 CYS SG 1 1 29 17946 1 1 38 GLU C C 1.581 2.244 4.115 1.00 . A A . 38 GLU C 1 1 29 17947 1 1 38 GLU CA C 1.149 3.707 4.166 1.00 . A A . 38 GLU CA 1 1 29 17948 1 1 38 GLU CB C 1.361 4.264 5.575 1.00 . A A . 38 GLU CB 1 1 29 17949 1 1 38 GLU CD C 2.671 6.144 6.636 1.00 . A A . 38 GLU CD 1 1 29 17950 1 1 38 GLU CG C 1.631 5.760 5.603 1.00 . A A . 38 GLU CG 1 1 29 17951 1 1 38 GLU H H -0.911 4.102 4.443 1.00 . A A . 38 GLU H 1 1 29 17952 1 1 38 GLU HA H 1.752 4.272 3.470 1.00 . A A . 38 GLU HA 1 1 29 17953 1 1 38 GLU HB2 H 0.477 4.069 6.163 1.00 . A A . 38 GLU HB2 1 1 29 17954 1 1 38 GLU HB3 H 2.202 3.760 6.026 1.00 . A A . 38 GLU HB3 1 1 29 17955 1 1 38 GLU HG2 H 1.983 6.067 4.629 1.00 . A A . 38 GLU HG2 1 1 29 17956 1 1 38 GLU HG3 H 0.710 6.275 5.831 1.00 . A A . 38 GLU HG3 1 1 29 17957 1 1 38 GLU N N -0.246 3.850 3.769 1.00 . A A . 38 GLU N 1 1 29 17958 1 1 38 GLU O O 0.749 1.339 4.177 1.00 . A A . 38 GLU O 1 1 29 17959 1 1 38 GLU OE1 O 2.431 7.112 7.389 1.00 . A A . 38 GLU OE1 1 1 29 17960 1 1 38 GLU OE2 O 3.726 5.478 6.693 1.00 . A A . 38 GLU OE2 1 1 29 17961 1 1 39 CYS C C 4.290 0.373 5.169 1.00 . A A . 39 CYS C 1 1 29 17962 1 1 39 CYS CA C 3.428 0.669 3.941 1.00 . A A . 39 CYS CA 1 1 29 17963 1 1 39 CYS CB C 4.254 0.486 2.665 1.00 . A A . 39 CYS CB 1 1 29 17964 1 1 39 CYS H H 3.499 2.784 3.956 1.00 . A A . 39 CYS H 1 1 29 17965 1 1 39 CYS HA H 2.598 -0.021 3.923 1.00 . A A . 39 CYS HA 1 1 29 17966 1 1 39 CYS HB2 H 4.231 1.404 2.097 1.00 . A A . 39 CYS HB2 1 1 29 17967 1 1 39 CYS HB3 H 5.276 0.261 2.933 1.00 . A A . 39 CYS HB3 1 1 29 17968 1 1 39 CYS N N 2.886 2.021 4.001 1.00 . A A . 39 CYS N 1 1 29 17969 1 1 39 CYS O O 5.485 0.667 5.182 1.00 . A A . 39 CYS O 1 1 29 17970 1 1 39 CYS SG S 3.658 -0.850 1.579 1.00 . A A . 39 CYS SG 1 1 29 17971 1 1 40 PRO C C 5.447 -1.651 7.238 1.00 . A A . 40 PRO C 1 1 29 17972 1 1 40 PRO CA C 4.416 -0.548 7.453 1.00 . A A . 40 PRO CA 1 1 29 17973 1 1 40 PRO CB C 3.313 -1.024 8.401 1.00 . A A . 40 PRO CB 1 1 29 17974 1 1 40 PRO CD C 2.271 -0.603 6.293 1.00 . A A . 40 PRO CD 1 1 29 17975 1 1 40 PRO CG C 2.214 -1.485 7.508 1.00 . A A . 40 PRO CG 1 1 29 17976 1 1 40 PRO HA H 4.904 0.320 7.871 1.00 . A A . 40 PRO HA 1 1 29 17977 1 1 40 PRO HB2 H 3.687 -1.829 9.017 1.00 . A A . 40 PRO HB2 1 1 29 17978 1 1 40 PRO HB3 H 2.993 -0.204 9.027 1.00 . A A . 40 PRO HB3 1 1 29 17979 1 1 40 PRO HD2 H 1.976 -1.154 5.412 1.00 . A A . 40 PRO HD2 1 1 29 17980 1 1 40 PRO HD3 H 1.642 0.265 6.426 1.00 . A A . 40 PRO HD3 1 1 29 17981 1 1 40 PRO HG2 H 2.375 -2.517 7.230 1.00 . A A . 40 PRO HG2 1 1 29 17982 1 1 40 PRO HG3 H 1.263 -1.374 8.007 1.00 . A A . 40 PRO HG3 1 1 29 17983 1 1 40 PRO N N 3.693 -0.216 6.221 1.00 . A A . 40 PRO N 1 1 29 17984 1 1 40 PRO O O 5.581 -2.184 6.137 1.00 . A A . 40 PRO O 1 1 29 17985 1 1 41 SER C C 6.579 -4.409 8.425 1.00 . A A . 41 SER C 1 1 29 17986 1 1 41 SER CA C 7.195 -3.026 8.228 1.00 . A A . 41 SER CA 1 1 29 17987 1 1 41 SER CB C 8.276 -2.778 9.282 1.00 . A A . 41 SER CB 1 1 29 17988 1 1 41 SER H H 6.020 -1.524 9.148 1.00 . A A . 41 SER H 1 1 29 17989 1 1 41 SER HA H 7.644 -2.982 7.247 1.00 . A A . 41 SER HA 1 1 29 17990 1 1 41 SER HB2 H 7.918 -3.105 10.247 1.00 . A A . 41 SER HB2 1 1 29 17991 1 1 41 SER HB3 H 9.164 -3.335 9.021 1.00 . A A . 41 SER HB3 1 1 29 17992 1 1 41 SER HG H 7.962 -0.949 9.908 1.00 . A A . 41 SER HG 1 1 29 17993 1 1 41 SER N N 6.174 -1.987 8.299 1.00 . A A . 41 SER N 1 1 29 17994 1 1 41 SER O O 6.971 -5.154 9.323 1.00 . A A . 41 SER O 1 1 29 17995 1 1 41 SER OG O 8.607 -1.402 9.361 1.00 . A A . 41 SER OG 1 1 29 17996 1 1 42 TYR C C 5.048 -6.787 6.328 1.00 . A A . 42 TYR C 1 1 29 17997 1 1 42 TYR CA C 4.943 -6.038 7.655 1.00 . A A . 42 TYR CA 1 1 29 17998 1 1 42 TYR CB C 3.472 -5.852 8.034 1.00 . A A . 42 TYR CB 1 1 29 17999 1 1 42 TYR CD1 C 2.819 -4.527 10.082 1.00 . A A . 42 TYR CD1 1 1 29 18000 1 1 42 TYR CD2 C 3.446 -6.809 10.371 1.00 . A A . 42 TYR CD2 1 1 29 18001 1 1 42 TYR CE1 C 2.608 -4.409 11.443 1.00 . A A . 42 TYR CE1 1 1 29 18002 1 1 42 TYR CE2 C 3.237 -6.699 11.732 1.00 . A A . 42 TYR CE2 1 1 29 18003 1 1 42 TYR CG C 3.242 -5.727 9.524 1.00 . A A . 42 TYR CG 1 1 29 18004 1 1 42 TYR CZ C 2.818 -5.497 12.263 1.00 . A A . 42 TYR CZ 1 1 29 18005 1 1 42 TYR H H 5.344 -4.110 6.881 1.00 . A A . 42 TYR H 1 1 29 18006 1 1 42 TYR HA H 5.432 -6.620 8.422 1.00 . A A . 42 TYR HA 1 1 29 18007 1 1 42 TYR HB2 H 3.098 -4.955 7.565 1.00 . A A . 42 TYR HB2 1 1 29 18008 1 1 42 TYR HB3 H 2.906 -6.701 7.680 1.00 . A A . 42 TYR HB3 1 1 29 18009 1 1 42 TYR HD1 H 2.656 -3.677 9.437 1.00 . A A . 42 TYR HD1 1 1 29 18010 1 1 42 TYR HD2 H 3.775 -7.749 9.952 1.00 . A A . 42 TYR HD2 1 1 29 18011 1 1 42 TYR HE1 H 2.279 -3.467 11.858 1.00 . A A . 42 TYR HE1 1 1 29 18012 1 1 42 TYR HE2 H 3.401 -7.551 12.374 1.00 . A A . 42 TYR HE2 1 1 29 18013 1 1 42 TYR HH H 3.453 -5.321 14.069 1.00 . A A . 42 TYR HH 1 1 29 18014 1 1 42 TYR N N 5.613 -4.745 7.577 1.00 . A A . 42 TYR N 1 1 29 18015 1 1 42 TYR O O 4.089 -6.841 5.558 1.00 . A A . 42 TYR O 1 1 29 18016 1 1 42 TYR OH O 2.608 -5.383 13.618 1.00 . A A . 42 TYR OH 1 1 29 18017 1 1 43 PRO C C 5.671 -9.434 4.763 1.00 . A A . 43 PRO C 1 1 29 18018 1 1 43 PRO CA C 6.450 -8.124 4.802 1.00 . A A . 43 PRO CA 1 1 29 18019 1 1 43 PRO CB C 7.955 -8.397 4.821 1.00 . A A . 43 PRO CB 1 1 29 18020 1 1 43 PRO CD C 7.418 -7.360 6.906 1.00 . A A . 43 PRO CD 1 1 29 18021 1 1 43 PRO CG C 8.327 -8.371 6.263 1.00 . A A . 43 PRO CG 1 1 29 18022 1 1 43 PRO HA H 6.199 -7.533 3.934 1.00 . A A . 43 PRO HA 1 1 29 18023 1 1 43 PRO HB2 H 8.155 -9.361 4.377 1.00 . A A . 43 PRO HB2 1 1 29 18024 1 1 43 PRO HB3 H 8.471 -7.626 4.268 1.00 . A A . 43 PRO HB3 1 1 29 18025 1 1 43 PRO HD2 H 7.171 -7.662 7.913 1.00 . A A . 43 PRO HD2 1 1 29 18026 1 1 43 PRO HD3 H 7.880 -6.384 6.906 1.00 . A A . 43 PRO HD3 1 1 29 18027 1 1 43 PRO HG2 H 8.171 -9.347 6.699 1.00 . A A . 43 PRO HG2 1 1 29 18028 1 1 43 PRO HG3 H 9.358 -8.070 6.371 1.00 . A A . 43 PRO HG3 1 1 29 18029 1 1 43 PRO N N 6.222 -7.376 6.043 1.00 . A A . 43 PRO N 1 1 29 18030 1 1 43 PRO O O 5.334 -9.936 3.691 1.00 . A A . 43 PRO O 1 1 29 18031 1 1 44 GLY C C 3.237 -11.039 6.525 1.00 . A A . 44 GLY C 1 1 29 18032 1 1 44 GLY CA C 4.652 -11.232 6.018 1.00 . A A . 44 GLY CA 1 1 29 18033 1 1 44 GLY H H 5.683 -9.539 6.761 1.00 . A A . 44 GLY H 1 1 29 18034 1 1 44 GLY HA2 H 5.173 -11.903 6.684 1.00 . A A . 44 GLY HA2 1 1 29 18035 1 1 44 GLY HA3 H 4.613 -11.676 5.034 1.00 . A A . 44 GLY HA3 1 1 29 18036 1 1 44 GLY N N 5.389 -9.984 5.940 1.00 . A A . 44 GLY N 1 1 29 18037 1 1 44 GLY O O 2.583 -12.049 6.860 1.00 . A A . 44 GLY O 1 1 29 18038 1 1 44 GLY OXT O 2.782 -9.877 6.588 1.00 . A A . 44 GLY OXT 1 1 30 18039 1 1 1 ALA C C -15.101 13.193 2.331 1.00 . A A . 1 ALA C 1 1 30 18040 1 1 1 ALA CA C -15.847 13.916 3.447 1.00 . A A . 1 ALA CA 1 1 30 18041 1 1 1 ALA CB C -14.982 13.991 4.696 1.00 . A A . 1 ALA CB 1 1 30 18042 1 1 1 ALA H1 H -17.588 12.999 2.847 1.00 . A A . 1 ALA H1 1 1 30 18043 1 1 1 ALA H2 H -16.922 12.386 4.305 1.00 . A A . 1 ALA H2 1 1 30 18044 1 1 1 ALA H3 H -17.719 13.904 4.300 1.00 . A A . 1 ALA H3 1 1 30 18045 1 1 1 ALA HA H -16.061 14.925 3.126 1.00 . A A . 1 ALA HA 1 1 30 18046 1 1 1 ALA HB1 H -15.210 14.898 5.237 1.00 . A A . 1 ALA HB1 1 1 30 18047 1 1 1 ALA HB2 H -15.184 13.136 5.325 1.00 . A A . 1 ALA HB2 1 1 30 18048 1 1 1 ALA HB3 H -13.940 13.993 4.413 1.00 . A A . 1 ALA HB3 1 1 30 18049 1 1 1 ALA N N -17.135 13.240 3.752 1.00 . A A . 1 ALA N 1 1 30 18050 1 1 1 ALA O O -15.051 11.963 2.299 1.00 . A A . 1 ALA O 1 1 30 18051 1 1 2 MET C C -12.286 13.341 0.610 1.00 . A A . 2 MET C 1 1 30 18052 1 1 2 MET CA C -13.778 13.397 0.298 1.00 . A A . 2 MET CA 1 1 30 18053 1 1 2 MET CB C -14.015 14.220 -0.969 1.00 . A A . 2 MET CB 1 1 30 18054 1 1 2 MET CE C -14.851 12.334 -3.979 1.00 . A A . 2 MET CE 1 1 30 18055 1 1 2 MET CG C -15.294 13.853 -1.703 1.00 . A A . 2 MET CG 1 1 30 18056 1 1 2 MET H H -14.597 14.938 1.496 1.00 . A A . 2 MET H 1 1 30 18057 1 1 2 MET HA H -14.138 12.392 0.136 1.00 . A A . 2 MET HA 1 1 30 18058 1 1 2 MET HB2 H -14.067 15.265 -0.701 1.00 . A A . 2 MET HB2 1 1 30 18059 1 1 2 MET HB3 H -13.184 14.071 -1.642 1.00 . A A . 2 MET HB3 1 1 30 18060 1 1 2 MET HE1 H -15.228 11.670 -3.215 1.00 . A A . 2 MET HE1 1 1 30 18061 1 1 2 MET HE2 H -15.357 12.135 -4.912 1.00 . A A . 2 MET HE2 1 1 30 18062 1 1 2 MET HE3 H -13.790 12.174 -4.103 1.00 . A A . 2 MET HE3 1 1 30 18063 1 1 2 MET HG2 H -15.539 12.825 -1.479 1.00 . A A . 2 MET HG2 1 1 30 18064 1 1 2 MET HG3 H -16.090 14.495 -1.355 1.00 . A A . 2 MET HG3 1 1 30 18065 1 1 2 MET N N -14.522 13.964 1.417 1.00 . A A . 2 MET N 1 1 30 18066 1 1 2 MET O O -11.524 14.220 0.208 1.00 . A A . 2 MET O 1 1 30 18067 1 1 2 MET SD S -15.145 14.032 -3.491 1.00 . A A . 2 MET SD 1 1 30 18068 1 1 3 ASP C C -9.817 11.051 0.841 1.00 . A A . 3 ASP C 1 1 30 18069 1 1 3 ASP CA C -10.475 12.130 1.696 1.00 . A A . 3 ASP CA 1 1 30 18070 1 1 3 ASP CB C -10.353 11.768 3.177 1.00 . A A . 3 ASP CB 1 1 30 18071 1 1 3 ASP CG C -8.911 11.706 3.641 1.00 . A A . 3 ASP CG 1 1 30 18072 1 1 3 ASP H H -12.531 11.634 1.622 1.00 . A A . 3 ASP H 1 1 30 18073 1 1 3 ASP HA H -9.970 13.068 1.521 1.00 . A A . 3 ASP HA 1 1 30 18074 1 1 3 ASP HB2 H -10.869 12.512 3.766 1.00 . A A . 3 ASP HB2 1 1 30 18075 1 1 3 ASP HB3 H -10.809 10.803 3.344 1.00 . A A . 3 ASP HB3 1 1 30 18076 1 1 3 ASP N N -11.876 12.301 1.330 1.00 . A A . 3 ASP N 1 1 30 18077 1 1 3 ASP O O -10.178 9.877 0.920 1.00 . A A . 3 ASP O 1 1 30 18078 1 1 3 ASP OD1 O -8.347 12.770 3.971 1.00 . A A . 3 ASP OD1 1 1 30 18079 1 1 3 ASP OD2 O -8.346 10.592 3.673 1.00 . A A . 3 ASP OD2 1 1 30 18080 1 1 4 CYS C C -6.741 10.242 -0.312 1.00 . A A . 4 CYS C 1 1 30 18081 1 1 4 CYS CA C -8.141 10.526 -0.844 1.00 . A A . 4 CYS CA 1 1 30 18082 1 1 4 CYS CB C -8.054 11.086 -2.265 1.00 . A A . 4 CYS CB 1 1 30 18083 1 1 4 CYS H H -8.607 12.407 0.007 1.00 . A A . 4 CYS H 1 1 30 18084 1 1 4 CYS HA H -8.699 9.602 -0.865 1.00 . A A . 4 CYS HA 1 1 30 18085 1 1 4 CYS HB2 H -7.800 12.134 -2.215 1.00 . A A . 4 CYS HB2 1 1 30 18086 1 1 4 CYS HB3 H -7.280 10.559 -2.804 1.00 . A A . 4 CYS HB3 1 1 30 18087 1 1 4 CYS N N -8.850 11.458 0.025 1.00 . A A . 4 CYS N 1 1 30 18088 1 1 4 CYS O O -5.875 11.117 -0.317 1.00 . A A . 4 CYS O 1 1 30 18089 1 1 4 CYS SG S -9.597 10.936 -3.222 1.00 . A A . 4 CYS SG 1 1 30 18090 1 1 5 THR C C -4.205 8.461 -0.445 1.00 . A A . 5 THR C 1 1 30 18091 1 1 5 THR CA C -5.227 8.613 0.678 1.00 . A A . 5 THR CA 1 1 30 18092 1 1 5 THR CB C -5.354 7.300 1.453 1.00 . A A . 5 THR CB 1 1 30 18093 1 1 5 THR CG2 C -6.099 6.225 0.692 1.00 . A A . 5 THR CG2 1 1 30 18094 1 1 5 THR H H -7.254 8.359 0.121 1.00 . A A . 5 THR H 1 1 30 18095 1 1 5 THR HA H -4.892 9.387 1.352 1.00 . A A . 5 THR HA 1 1 30 18096 1 1 5 THR HB H -5.892 7.487 2.372 1.00 . A A . 5 THR HB 1 1 30 18097 1 1 5 THR HG1 H -3.969 6.780 2.736 1.00 . A A . 5 THR HG1 1 1 30 18098 1 1 5 THR HG21 H -5.850 6.288 -0.357 1.00 . A A . 5 THR HG21 1 1 30 18099 1 1 5 THR HG22 H -5.816 5.254 1.070 1.00 . A A . 5 THR HG22 1 1 30 18100 1 1 5 THR HG23 H -7.162 6.364 0.819 1.00 . A A . 5 THR HG23 1 1 30 18101 1 1 5 THR N N -6.525 9.013 0.145 1.00 . A A . 5 THR N 1 1 30 18102 1 1 5 THR O O -3.709 7.365 -0.703 1.00 . A A . 5 THR O 1 1 30 18103 1 1 5 THR OG1 O -4.076 6.786 1.782 1.00 . A A . 5 THR OG1 1 1 30 18104 1 1 6 THR C C -1.584 9.028 -1.748 1.00 . A A . 6 THR C 1 1 30 18105 1 1 6 THR CA C -2.937 9.561 -2.209 1.00 . A A . 6 THR CA 1 1 30 18106 1 1 6 THR CB C -2.775 10.969 -2.783 1.00 . A A . 6 THR CB 1 1 30 18107 1 1 6 THR CG2 C -3.712 11.256 -3.937 1.00 . A A . 6 THR CG2 1 1 30 18108 1 1 6 THR H H -4.327 10.413 -0.860 1.00 . A A . 6 THR H 1 1 30 18109 1 1 6 THR HA H -3.322 8.910 -2.980 1.00 . A A . 6 THR HA 1 1 30 18110 1 1 6 THR HB H -1.762 11.086 -3.143 1.00 . A A . 6 THR HB 1 1 30 18111 1 1 6 THR HG1 H -2.195 12.423 -1.606 1.00 . A A . 6 THR HG1 1 1 30 18112 1 1 6 THR HG21 H -4.087 10.325 -4.336 1.00 . A A . 6 THR HG21 1 1 30 18113 1 1 6 THR HG22 H -4.538 11.857 -3.588 1.00 . A A . 6 THR HG22 1 1 30 18114 1 1 6 THR HG23 H -3.179 11.790 -4.710 1.00 . A A . 6 THR HG23 1 1 30 18115 1 1 6 THR N N -3.897 9.570 -1.111 1.00 . A A . 6 THR N 1 1 30 18116 1 1 6 THR O O -0.862 9.695 -1.007 1.00 . A A . 6 THR O 1 1 30 18117 1 1 6 THR OG1 O -3.009 11.948 -1.786 1.00 . A A . 6 THR OG1 1 1 30 18118 1 1 7 GLY C C 0.417 6.084 -2.741 1.00 . A A . 7 GLY C 1 1 30 18119 1 1 7 GLY CA C 0.017 7.219 -1.816 1.00 . A A . 7 GLY CA 1 1 30 18120 1 1 7 GLY H H -1.864 7.337 -2.780 1.00 . A A . 7 GLY H 1 1 30 18121 1 1 7 GLY HA2 H -0.063 6.837 -0.809 1.00 . A A . 7 GLY HA2 1 1 30 18122 1 1 7 GLY HA3 H 0.786 7.977 -1.842 1.00 . A A . 7 GLY HA3 1 1 30 18123 1 1 7 GLY N N -1.248 7.821 -2.192 1.00 . A A . 7 GLY N 1 1 30 18124 1 1 7 GLY O O -0.114 5.965 -3.845 1.00 . A A . 7 GLY O 1 1 30 18125 1 1 8 PRO C C 0.830 2.944 -3.149 1.00 . A A . 8 PRO C 1 1 30 18126 1 1 8 PRO CA C 1.827 4.099 -3.125 1.00 . A A . 8 PRO CA 1 1 30 18127 1 1 8 PRO CB C 3.115 3.676 -2.420 1.00 . A A . 8 PRO CB 1 1 30 18128 1 1 8 PRO CD C 2.052 5.296 -1.012 1.00 . A A . 8 PRO CD 1 1 30 18129 1 1 8 PRO CG C 2.903 4.054 -0.995 1.00 . A A . 8 PRO CG 1 1 30 18130 1 1 8 PRO HA H 2.049 4.402 -4.137 1.00 . A A . 8 PRO HA 1 1 30 18131 1 1 8 PRO HB2 H 3.257 2.611 -2.532 1.00 . A A . 8 PRO HB2 1 1 30 18132 1 1 8 PRO HB3 H 3.953 4.205 -2.848 1.00 . A A . 8 PRO HB3 1 1 30 18133 1 1 8 PRO HD2 H 1.342 5.278 -0.199 1.00 . A A . 8 PRO HD2 1 1 30 18134 1 1 8 PRO HD3 H 2.673 6.178 -0.953 1.00 . A A . 8 PRO HD3 1 1 30 18135 1 1 8 PRO HG2 H 2.391 3.256 -0.477 1.00 . A A . 8 PRO HG2 1 1 30 18136 1 1 8 PRO HG3 H 3.853 4.258 -0.525 1.00 . A A . 8 PRO HG3 1 1 30 18137 1 1 8 PRO N N 1.361 5.227 -2.315 1.00 . A A . 8 PRO N 1 1 30 18138 1 1 8 PRO O O 0.708 2.238 -4.150 1.00 . A A . 8 PRO O 1 1 30 18139 1 1 9 CYS C C -2.281 2.211 -2.100 1.00 . A A . 9 CYS C 1 1 30 18140 1 1 9 CYS CA C -0.861 1.679 -1.938 1.00 . A A . 9 CYS CA 1 1 30 18141 1 1 9 CYS CB C -0.724 0.962 -0.594 1.00 . A A . 9 CYS CB 1 1 30 18142 1 1 9 CYS H H 0.263 3.346 -1.273 1.00 . A A . 9 CYS H 1 1 30 18143 1 1 9 CYS HA H -0.662 0.974 -2.731 1.00 . A A . 9 CYS HA 1 1 30 18144 1 1 9 CYS HB2 H 0.313 0.969 -0.294 1.00 . A A . 9 CYS HB2 1 1 30 18145 1 1 9 CYS HB3 H -1.310 1.487 0.146 1.00 . A A . 9 CYS HB3 1 1 30 18146 1 1 9 CYS N N 0.121 2.753 -2.040 1.00 . A A . 9 CYS N 1 1 30 18147 1 1 9 CYS O O -3.229 1.659 -1.541 1.00 . A A . 9 CYS O 1 1 30 18148 1 1 9 CYS SG S -1.282 -0.772 -0.617 1.00 . A A . 9 CYS SG 1 1 30 18149 1 1 10 CYS C C -3.816 4.481 -4.507 1.00 . A A . 10 CYS C 1 1 30 18150 1 1 10 CYS CA C -3.732 3.889 -3.104 1.00 . A A . 10 CYS CA 1 1 30 18151 1 1 10 CYS CB C -4.011 4.975 -2.064 1.00 . A A . 10 CYS CB 1 1 30 18152 1 1 10 CYS H H -1.632 3.682 -3.289 1.00 . A A . 10 CYS H 1 1 30 18153 1 1 10 CYS HA H -4.477 3.113 -3.008 1.00 . A A . 10 CYS HA 1 1 30 18154 1 1 10 CYS HB2 H -3.398 5.837 -2.284 1.00 . A A . 10 CYS HB2 1 1 30 18155 1 1 10 CYS HB3 H -5.052 5.256 -2.119 1.00 . A A . 10 CYS HB3 1 1 30 18156 1 1 10 CYS N N -2.424 3.286 -2.869 1.00 . A A . 10 CYS N 1 1 30 18157 1 1 10 CYS O O -3.188 5.498 -4.800 1.00 . A A . 10 CYS O 1 1 30 18158 1 1 10 CYS SG S -3.661 4.470 -0.350 1.00 . A A . 10 CYS SG 1 1 30 18159 1 1 11 ARG C C -6.230 4.629 -7.022 1.00 . A A . 11 ARG C 1 1 30 18160 1 1 11 ARG CA C -4.768 4.303 -6.740 1.00 . A A . 11 ARG CA 1 1 30 18161 1 1 11 ARG CB C -4.270 3.243 -7.725 1.00 . A A . 11 ARG CB 1 1 30 18162 1 1 11 ARG CD C -3.706 2.663 -10.104 1.00 . A A . 11 ARG CD 1 1 30 18163 1 1 11 ARG CG C -4.024 3.782 -9.125 1.00 . A A . 11 ARG CG 1 1 30 18164 1 1 11 ARG CZ C -3.141 3.843 -12.192 1.00 . A A . 11 ARG CZ 1 1 30 18165 1 1 11 ARG H H -5.074 3.034 -5.073 1.00 . A A . 11 ARG H 1 1 30 18166 1 1 11 ARG HA H -4.180 5.200 -6.862 1.00 . A A . 11 ARG HA 1 1 30 18167 1 1 11 ARG HB2 H -3.344 2.829 -7.353 1.00 . A A . 11 ARG HB2 1 1 30 18168 1 1 11 ARG HB3 H -5.006 2.455 -7.790 1.00 . A A . 11 ARG HB3 1 1 30 18169 1 1 11 ARG HD2 H -2.666 2.394 -9.998 1.00 . A A . 11 ARG HD2 1 1 30 18170 1 1 11 ARG HD3 H -4.324 1.809 -9.867 1.00 . A A . 11 ARG HD3 1 1 30 18171 1 1 11 ARG HE H -4.771 2.725 -11.915 1.00 . A A . 11 ARG HE 1 1 30 18172 1 1 11 ARG HG2 H -4.909 4.300 -9.461 1.00 . A A . 11 ARG HG2 1 1 30 18173 1 1 11 ARG HG3 H -3.191 4.469 -9.094 1.00 . A A . 11 ARG HG3 1 1 30 18174 1 1 11 ARG HH11 H -1.794 4.084 -10.702 1.00 . A A . 11 ARG HH11 1 1 30 18175 1 1 11 ARG HH12 H -1.419 4.903 -12.181 1.00 . A A . 11 ARG HH12 1 1 30 18176 1 1 11 ARG HH21 H -4.280 3.802 -13.861 1.00 . A A . 11 ARG HH21 1 1 30 18177 1 1 11 ARG HH22 H -2.830 4.744 -13.974 1.00 . A A . 11 ARG HH22 1 1 30 18178 1 1 11 ARG N N -4.598 3.839 -5.368 1.00 . A A . 11 ARG N 1 1 30 18179 1 1 11 ARG NE N -3.955 3.060 -11.488 1.00 . A A . 11 ARG NE 1 1 30 18180 1 1 11 ARG NH1 N -2.026 4.315 -11.647 1.00 . A A . 11 ARG NH1 1 1 30 18181 1 1 11 ARG NH2 N -3.442 4.155 -13.445 1.00 . A A . 11 ARG NH2 1 1 30 18182 1 1 11 ARG O O -7.130 3.907 -6.593 1.00 . A A . 11 ARG O 1 1 30 18183 1 1 12 GLN C C -8.611 6.521 -6.830 1.00 . A A . 12 GLN C 1 1 30 18184 1 1 12 GLN CA C -7.818 6.146 -8.081 1.00 . A A . 12 GLN CA 1 1 30 18185 1 1 12 GLN CB C -8.544 5.034 -8.834 1.00 . A A . 12 GLN CB 1 1 30 18186 1 1 12 GLN CD C -7.175 4.811 -10.945 1.00 . A A . 12 GLN CD 1 1 30 18187 1 1 12 GLN CG C -8.512 5.197 -10.345 1.00 . A A . 12 GLN CG 1 1 30 18188 1 1 12 GLN H H -5.702 6.259 -8.055 1.00 . A A . 12 GLN H 1 1 30 18189 1 1 12 GLN HA H -7.746 7.013 -8.720 1.00 . A A . 12 GLN HA 1 1 30 18190 1 1 12 GLN HB2 H -8.082 4.092 -8.584 1.00 . A A . 12 GLN HB2 1 1 30 18191 1 1 12 GLN HB3 H -9.575 5.015 -8.515 1.00 . A A . 12 GLN HB3 1 1 30 18192 1 1 12 GLN HE21 H -6.567 6.702 -10.870 1.00 . A A . 12 GLN HE21 1 1 30 18193 1 1 12 GLN HE22 H -5.429 5.573 -11.515 1.00 . A A . 12 GLN HE22 1 1 30 18194 1 1 12 GLN HG2 H -9.278 4.571 -10.778 1.00 . A A . 12 GLN HG2 1 1 30 18195 1 1 12 GLN HG3 H -8.714 6.230 -10.586 1.00 . A A . 12 GLN HG3 1 1 30 18196 1 1 12 GLN N N -6.461 5.723 -7.743 1.00 . A A . 12 GLN N 1 1 30 18197 1 1 12 GLN NE2 N -6.302 5.795 -11.129 1.00 . A A . 12 GLN NE2 1 1 30 18198 1 1 12 GLN O O -9.835 6.637 -6.874 1.00 . A A . 12 GLN O 1 1 30 18199 1 1 12 GLN OE1 O -6.928 3.641 -11.239 1.00 . A A . 12 GLN OE1 1 1 30 18200 1 1 13 CYS C C -9.290 5.871 -3.864 1.00 . A A . 13 CYS C 1 1 30 18201 1 1 13 CYS CA C -8.535 7.060 -4.450 1.00 . A A . 13 CYS CA 1 1 30 18202 1 1 13 CYS CB C -9.484 8.249 -4.630 1.00 . A A . 13 CYS CB 1 1 30 18203 1 1 13 CYS H H -6.936 6.590 -5.752 1.00 . A A . 13 CYS H 1 1 30 18204 1 1 13 CYS HA H -7.750 7.341 -3.764 1.00 . A A . 13 CYS HA 1 1 30 18205 1 1 13 CYS HB2 H -8.975 9.028 -5.177 1.00 . A A . 13 CYS HB2 1 1 30 18206 1 1 13 CYS HB3 H -10.349 7.929 -5.192 1.00 . A A . 13 CYS HB3 1 1 30 18207 1 1 13 CYS N N -7.906 6.702 -5.720 1.00 . A A . 13 CYS N 1 1 30 18208 1 1 13 CYS O O -10.456 5.988 -3.485 1.00 . A A . 13 CYS O 1 1 30 18209 1 1 13 CYS SG S -10.076 8.969 -3.064 1.00 . A A . 13 CYS SG 1 1 30 18210 1 1 14 LYS C C -8.169 2.662 -2.549 1.00 . A A . 14 LYS C 1 1 30 18211 1 1 14 LYS CA C -9.220 3.520 -3.243 1.00 . A A . 14 LYS CA 1 1 30 18212 1 1 14 LYS CB C -9.901 2.719 -4.354 1.00 . A A . 14 LYS CB 1 1 30 18213 1 1 14 LYS CD C -10.975 0.616 -3.497 1.00 . A A . 14 LYS CD 1 1 30 18214 1 1 14 LYS CE C -12.277 -0.169 -3.481 1.00 . A A . 14 LYS CE 1 1 30 18215 1 1 14 LYS CG C -11.199 2.058 -3.919 1.00 . A A . 14 LYS CG 1 1 30 18216 1 1 14 LYS H H -7.688 4.697 -4.101 1.00 . A A . 14 LYS H 1 1 30 18217 1 1 14 LYS HA H -9.962 3.818 -2.517 1.00 . A A . 14 LYS HA 1 1 30 18218 1 1 14 LYS HB2 H -10.118 3.382 -5.179 1.00 . A A . 14 LYS HB2 1 1 30 18219 1 1 14 LYS HB3 H -9.225 1.947 -4.692 1.00 . A A . 14 LYS HB3 1 1 30 18220 1 1 14 LYS HD2 H -10.294 0.148 -4.192 1.00 . A A . 14 LYS HD2 1 1 30 18221 1 1 14 LYS HD3 H -10.545 0.604 -2.505 1.00 . A A . 14 LYS HD3 1 1 30 18222 1 1 14 LYS HE2 H -12.802 0.011 -4.407 1.00 . A A . 14 LYS HE2 1 1 30 18223 1 1 14 LYS HE3 H -12.048 -1.221 -3.396 1.00 . A A . 14 LYS HE3 1 1 30 18224 1 1 14 LYS HG2 H -11.609 2.607 -3.086 1.00 . A A . 14 LYS HG2 1 1 30 18225 1 1 14 LYS HG3 H -11.895 2.079 -4.745 1.00 . A A . 14 LYS HG3 1 1 30 18226 1 1 14 LYS HZ1 H -12.929 1.201 -2.044 1.00 . A A . 14 LYS HZ1 1 1 30 18227 1 1 14 LYS HZ2 H -14.151 0.189 -2.629 1.00 . A A . 14 LYS HZ2 1 1 30 18228 1 1 14 LYS HZ3 H -13.006 -0.412 -1.538 1.00 . A A . 14 LYS HZ3 1 1 30 18229 1 1 14 LYS N N -8.616 4.729 -3.787 1.00 . A A . 14 LYS N 1 1 30 18230 1 1 14 LYS NZ N -13.152 0.230 -2.344 1.00 . A A . 14 LYS NZ 1 1 30 18231 1 1 14 LYS O O -7.306 2.074 -3.202 1.00 . A A . 14 LYS O 1 1 30 18232 1 1 15 LEU C C -7.078 0.436 -1.057 1.00 . A A . 15 LEU C 1 1 30 18233 1 1 15 LEU CA C -7.299 1.811 -0.434 1.00 . A A . 15 LEU CA 1 1 30 18234 1 1 15 LEU CB C -7.803 1.660 1.003 1.00 . A A . 15 LEU CB 1 1 30 18235 1 1 15 LEU CD1 C -8.012 2.674 3.286 1.00 . A A . 15 LEU CD1 1 1 30 18236 1 1 15 LEU CD2 C -5.749 2.231 2.318 1.00 . A A . 15 LEU CD2 1 1 30 18237 1 1 15 LEU CG C -7.184 2.629 2.011 1.00 . A A . 15 LEU CG 1 1 30 18238 1 1 15 LEU H H -8.954 3.090 -0.761 1.00 . A A . 15 LEU H 1 1 30 18239 1 1 15 LEU HA H -6.359 2.341 -0.421 1.00 . A A . 15 LEU HA 1 1 30 18240 1 1 15 LEU HB2 H -8.873 1.807 1.004 1.00 . A A . 15 LEU HB2 1 1 30 18241 1 1 15 LEU HB3 H -7.595 0.653 1.334 1.00 . A A . 15 LEU HB3 1 1 30 18242 1 1 15 LEU HD11 H -8.100 1.678 3.693 1.00 . A A . 15 LEU HD11 1 1 30 18243 1 1 15 LEU HD12 H -7.528 3.316 4.007 1.00 . A A . 15 LEU HD12 1 1 30 18244 1 1 15 LEU HD13 H -8.995 3.061 3.063 1.00 . A A . 15 LEU HD13 1 1 30 18245 1 1 15 LEU HD21 H -5.625 1.171 2.150 1.00 . A A . 15 LEU HD21 1 1 30 18246 1 1 15 LEU HD22 H -5.077 2.778 1.673 1.00 . A A . 15 LEU HD22 1 1 30 18247 1 1 15 LEU HD23 H -5.524 2.460 3.349 1.00 . A A . 15 LEU HD23 1 1 30 18248 1 1 15 LEU HG H -7.173 3.622 1.585 1.00 . A A . 15 LEU HG 1 1 30 18249 1 1 15 LEU N N -8.245 2.597 -1.222 1.00 . A A . 15 LEU N 1 1 30 18250 1 1 15 LEU O O -7.928 -0.449 -0.953 1.00 . A A . 15 LEU O 1 1 30 18251 1 1 16 LYS C C -5.865 -2.181 -1.433 1.00 . A A . 16 LYS C 1 1 30 18252 1 1 16 LYS CA C -5.596 -0.996 -2.361 1.00 . A A . 16 LYS CA 1 1 30 18253 1 1 16 LYS CB C -4.129 -0.996 -2.794 1.00 . A A . 16 LYS CB 1 1 30 18254 1 1 16 LYS CD C -3.997 -1.238 -5.291 1.00 . A A . 16 LYS CD 1 1 30 18255 1 1 16 LYS CE C -3.011 -0.882 -6.393 1.00 . A A . 16 LYS CE 1 1 30 18256 1 1 16 LYS CG C -3.885 -0.283 -4.114 1.00 . A A . 16 LYS CG 1 1 30 18257 1 1 16 LYS H H -5.298 1.013 -1.763 1.00 . A A . 16 LYS H 1 1 30 18258 1 1 16 LYS HA H -6.220 -1.089 -3.238 1.00 . A A . 16 LYS HA 1 1 30 18259 1 1 16 LYS HB2 H -3.541 -0.507 -2.031 1.00 . A A . 16 LYS HB2 1 1 30 18260 1 1 16 LYS HB3 H -3.795 -2.018 -2.894 1.00 . A A . 16 LYS HB3 1 1 30 18261 1 1 16 LYS HD2 H -3.792 -2.241 -4.950 1.00 . A A . 16 LYS HD2 1 1 30 18262 1 1 16 LYS HD3 H -5.000 -1.188 -5.688 1.00 . A A . 16 LYS HD3 1 1 30 18263 1 1 16 LYS HE2 H -3.520 -0.282 -7.133 1.00 . A A . 16 LYS HE2 1 1 30 18264 1 1 16 LYS HE3 H -2.201 -0.312 -5.963 1.00 . A A . 16 LYS HE3 1 1 30 18265 1 1 16 LYS HG2 H -4.617 0.502 -4.229 1.00 . A A . 16 LYS HG2 1 1 30 18266 1 1 16 LYS HG3 H -2.893 0.145 -4.102 1.00 . A A . 16 LYS HG3 1 1 30 18267 1 1 16 LYS HZ1 H -2.435 -2.890 -6.383 1.00 . A A . 16 LYS HZ1 1 1 30 18268 1 1 16 LYS HZ2 H -3.041 -2.359 -7.870 1.00 . A A . 16 LYS HZ2 1 1 30 18269 1 1 16 LYS HZ3 H -1.485 -1.910 -7.381 1.00 . A A . 16 LYS HZ3 1 1 30 18270 1 1 16 LYS N N -5.932 0.267 -1.712 1.00 . A A . 16 LYS N 1 1 30 18271 1 1 16 LYS NZ N -2.454 -2.095 -7.053 1.00 . A A . 16 LYS NZ 1 1 30 18272 1 1 16 LYS O O -5.765 -2.059 -0.213 1.00 . A A . 16 LYS O 1 1 30 18273 1 1 17 PRO C C -5.264 -5.073 -0.487 1.00 . A A . 17 PRO C 1 1 30 18274 1 1 17 PRO CA C -6.496 -4.555 -1.221 1.00 . A A . 17 PRO CA 1 1 30 18275 1 1 17 PRO CB C -6.957 -5.569 -2.273 1.00 . A A . 17 PRO CB 1 1 30 18276 1 1 17 PRO CD C -6.355 -3.581 -3.452 1.00 . A A . 17 PRO CD 1 1 30 18277 1 1 17 PRO CG C -6.379 -5.079 -3.556 1.00 . A A . 17 PRO CG 1 1 30 18278 1 1 17 PRO HA H -7.290 -4.385 -0.509 1.00 . A A . 17 PRO HA 1 1 30 18279 1 1 17 PRO HB2 H -6.583 -6.550 -2.019 1.00 . A A . 17 PRO HB2 1 1 30 18280 1 1 17 PRO HB3 H -8.036 -5.588 -2.309 1.00 . A A . 17 PRO HB3 1 1 30 18281 1 1 17 PRO HD2 H -5.511 -3.178 -3.993 1.00 . A A . 17 PRO HD2 1 1 30 18282 1 1 17 PRO HD3 H -7.278 -3.161 -3.821 1.00 . A A . 17 PRO HD3 1 1 30 18283 1 1 17 PRO HG2 H -5.377 -5.464 -3.678 1.00 . A A . 17 PRO HG2 1 1 30 18284 1 1 17 PRO HG3 H -7.004 -5.387 -4.381 1.00 . A A . 17 PRO HG3 1 1 30 18285 1 1 17 PRO N N -6.212 -3.347 -2.004 1.00 . A A . 17 PRO N 1 1 30 18286 1 1 17 PRO O O -4.147 -5.001 -1.000 1.00 . A A . 17 PRO O 1 1 30 18287 1 1 18 ALA C C -3.595 -7.184 0.756 1.00 . A A . 18 ALA C 1 1 30 18288 1 1 18 ALA CA C -4.382 -6.128 1.524 1.00 . A A . 18 ALA CA 1 1 30 18289 1 1 18 ALA CB C -4.921 -6.710 2.822 1.00 . A A . 18 ALA CB 1 1 30 18290 1 1 18 ALA H H -6.388 -5.625 1.072 1.00 . A A . 18 ALA H 1 1 30 18291 1 1 18 ALA HA H -3.721 -5.309 1.772 1.00 . A A . 18 ALA HA 1 1 30 18292 1 1 18 ALA HB1 H -5.424 -5.936 3.383 1.00 . A A . 18 ALA HB1 1 1 30 18293 1 1 18 ALA HB2 H -4.103 -7.104 3.407 1.00 . A A . 18 ALA HB2 1 1 30 18294 1 1 18 ALA HB3 H -5.618 -7.504 2.599 1.00 . A A . 18 ALA HB3 1 1 30 18295 1 1 18 ALA N N -5.475 -5.596 0.717 1.00 . A A . 18 ALA N 1 1 30 18296 1 1 18 ALA O O -4.119 -7.817 -0.160 1.00 . A A . 18 ALA O 1 1 30 18297 1 1 19 GLY C C -0.812 -7.785 -0.770 1.00 . A A . 19 GLY C 1 1 30 18298 1 1 19 GLY CA C -1.496 -8.344 0.464 1.00 . A A . 19 GLY CA 1 1 30 18299 1 1 19 GLY H H -1.968 -6.831 1.867 1.00 . A A . 19 GLY H 1 1 30 18300 1 1 19 GLY HA2 H -2.108 -9.185 0.173 1.00 . A A . 19 GLY HA2 1 1 30 18301 1 1 19 GLY HA3 H -0.740 -8.686 1.156 1.00 . A A . 19 GLY HA3 1 1 30 18302 1 1 19 GLY N N -2.334 -7.366 1.132 1.00 . A A . 19 GLY N 1 1 30 18303 1 1 19 GLY O O 0.021 -8.455 -1.381 1.00 . A A . 19 GLY O 1 1 30 18304 1 1 20 THR C C 0.638 -5.073 -1.915 1.00 . A A . 20 THR C 1 1 30 18305 1 1 20 THR CA C -0.572 -5.913 -2.310 1.00 . A A . 20 THR CA 1 1 30 18306 1 1 20 THR CB C -1.610 -5.036 -3.013 1.00 . A A . 20 THR CB 1 1 30 18307 1 1 20 THR CG2 C -1.078 -4.361 -4.258 1.00 . A A . 20 THR CG2 1 1 30 18308 1 1 20 THR H H -1.830 -6.068 -0.617 1.00 . A A . 20 THR H 1 1 30 18309 1 1 20 THR HA H -0.251 -6.690 -2.988 1.00 . A A . 20 THR HA 1 1 30 18310 1 1 20 THR HB H -1.934 -4.264 -2.330 1.00 . A A . 20 THR HB 1 1 30 18311 1 1 20 THR HG1 H -2.461 -6.539 -3.936 1.00 . A A . 20 THR HG1 1 1 30 18312 1 1 20 THR HG21 H -0.001 -4.300 -4.203 1.00 . A A . 20 THR HG21 1 1 30 18313 1 1 20 THR HG22 H -1.362 -4.935 -5.128 1.00 . A A . 20 THR HG22 1 1 30 18314 1 1 20 THR HG23 H -1.492 -3.366 -4.333 1.00 . A A . 20 THR HG23 1 1 30 18315 1 1 20 THR N N -1.162 -6.555 -1.141 1.00 . A A . 20 THR N 1 1 30 18316 1 1 20 THR O O 0.508 -4.071 -1.212 1.00 . A A . 20 THR O 1 1 30 18317 1 1 20 THR OG1 O -2.741 -5.802 -3.389 1.00 . A A . 20 THR OG1 1 1 30 18318 1 1 21 THR C C 2.983 -3.335 -2.564 1.00 . A A . 21 THR C 1 1 30 18319 1 1 21 THR CA C 3.049 -4.775 -2.068 1.00 . A A . 21 THR CA 1 1 30 18320 1 1 21 THR CB C 4.243 -5.491 -2.700 1.00 . A A . 21 THR CB 1 1 30 18321 1 1 21 THR CG2 C 4.014 -5.870 -4.147 1.00 . A A . 21 THR CG2 1 1 30 18322 1 1 21 THR H H 1.853 -6.295 -2.928 1.00 . A A . 21 THR H 1 1 30 18323 1 1 21 THR HA H 3.171 -4.769 -0.995 1.00 . A A . 21 THR HA 1 1 30 18324 1 1 21 THR HB H 4.439 -6.398 -2.147 1.00 . A A . 21 THR HB 1 1 30 18325 1 1 21 THR HG1 H 6.180 -5.220 -2.788 1.00 . A A . 21 THR HG1 1 1 30 18326 1 1 21 THR HG21 H 2.997 -5.633 -4.424 1.00 . A A . 21 THR HG21 1 1 30 18327 1 1 21 THR HG22 H 4.697 -5.319 -4.776 1.00 . A A . 21 THR HG22 1 1 30 18328 1 1 21 THR HG23 H 4.183 -6.930 -4.272 1.00 . A A . 21 THR HG23 1 1 30 18329 1 1 21 THR N N 1.814 -5.489 -2.372 1.00 . A A . 21 THR N 1 1 30 18330 1 1 21 THR O O 2.083 -2.968 -3.319 1.00 . A A . 21 THR O 1 1 30 18331 1 1 21 THR OG1 O 5.401 -4.678 -2.646 1.00 . A A . 21 THR OG1 1 1 30 18332 1 1 22 CYS C C 5.426 -0.594 -2.484 1.00 . A A . 22 CYS C 1 1 30 18333 1 1 22 CYS CA C 3.996 -1.122 -2.537 1.00 . A A . 22 CYS CA 1 1 30 18334 1 1 22 CYS CB C 3.095 -0.277 -1.634 1.00 . A A . 22 CYS CB 1 1 30 18335 1 1 22 CYS H H 4.634 -2.874 -1.535 1.00 . A A . 22 CYS H 1 1 30 18336 1 1 22 CYS HA H 3.638 -1.054 -3.553 1.00 . A A . 22 CYS HA 1 1 30 18337 1 1 22 CYS HB2 H 3.336 0.766 -1.772 1.00 . A A . 22 CYS HB2 1 1 30 18338 1 1 22 CYS HB3 H 2.064 -0.443 -1.911 1.00 . A A . 22 CYS HB3 1 1 30 18339 1 1 22 CYS N N 3.944 -2.523 -2.136 1.00 . A A . 22 CYS N 1 1 30 18340 1 1 22 CYS O O 5.654 0.585 -2.212 1.00 . A A . 22 CYS O 1 1 30 18341 1 1 22 CYS SG S 3.260 -0.651 0.142 1.00 . A A . 22 CYS SG 1 1 30 18342 1 1 23 TRP C C 8.673 -2.252 -3.198 1.00 . A A . 23 TRP C 1 1 30 18343 1 1 23 TRP CA C 7.795 -1.097 -2.727 1.00 . A A . 23 TRP CA 1 1 30 18344 1 1 23 TRP CB C 8.211 -0.666 -1.320 1.00 . A A . 23 TRP CB 1 1 30 18345 1 1 23 TRP CD1 C 10.080 0.977 -1.932 1.00 . A A . 23 TRP CD1 1 1 30 18346 1 1 23 TRP CD2 C 10.690 -0.608 -0.473 1.00 . A A . 23 TRP CD2 1 1 30 18347 1 1 23 TRP CE2 C 11.799 0.222 -0.724 1.00 . A A . 23 TRP CE2 1 1 30 18348 1 1 23 TRP CE3 C 10.837 -1.677 0.415 1.00 . A A . 23 TRP CE3 1 1 30 18349 1 1 23 TRP CG C 9.600 -0.108 -1.256 1.00 . A A . 23 TRP CG 1 1 30 18350 1 1 23 TRP CH2 C 13.150 -1.037 0.748 1.00 . A A . 23 TRP CH2 1 1 30 18351 1 1 23 TRP CZ2 C 13.036 0.016 -0.118 1.00 . A A . 23 TRP CZ2 1 1 30 18352 1 1 23 TRP CZ3 C 12.065 -1.881 1.016 1.00 . A A . 23 TRP CZ3 1 1 30 18353 1 1 23 TRP H H 6.142 -2.400 -2.955 1.00 . A A . 23 TRP H 1 1 30 18354 1 1 23 TRP HA H 7.924 -0.265 -3.402 1.00 . A A . 23 TRP HA 1 1 30 18355 1 1 23 TRP HB2 H 7.530 0.094 -0.968 1.00 . A A . 23 TRP HB2 1 1 30 18356 1 1 23 TRP HB3 H 8.163 -1.520 -0.660 1.00 . A A . 23 TRP HB3 1 1 30 18357 1 1 23 TRP HD1 H 9.494 1.577 -2.612 1.00 . A A . 23 TRP HD1 1 1 30 18358 1 1 23 TRP HE1 H 11.966 1.899 -1.974 1.00 . A A . 23 TRP HE1 1 1 30 18359 1 1 23 TRP HE3 H 10.011 -2.338 0.635 1.00 . A A . 23 TRP HE3 1 1 30 18360 1 1 23 TRP HH2 H 14.091 -1.234 1.239 1.00 . A A . 23 TRP HH2 1 1 30 18361 1 1 23 TRP HZ2 H 13.882 0.658 -0.314 1.00 . A A . 23 TRP HZ2 1 1 30 18362 1 1 23 TRP HZ3 H 12.196 -2.702 1.705 1.00 . A A . 23 TRP HZ3 1 1 30 18363 1 1 23 TRP N N 6.387 -1.475 -2.745 1.00 . A A . 23 TRP N 1 1 30 18364 1 1 23 TRP NE1 N 11.401 1.182 -1.617 1.00 . A A . 23 TRP NE1 1 1 30 18365 1 1 23 TRP O O 9.185 -3.026 -2.389 1.00 . A A . 23 TRP O 1 1 30 18366 1 1 24 ARG C C 11.007 -2.881 -5.555 1.00 . A A . 24 ARG C 1 1 30 18367 1 1 24 ARG CA C 9.660 -3.423 -5.090 1.00 . A A . 24 ARG CA 1 1 30 18368 1 1 24 ARG CB C 8.927 -4.077 -6.263 1.00 . A A . 24 ARG CB 1 1 30 18369 1 1 24 ARG CD C 7.973 -6.299 -6.946 1.00 . A A . 24 ARG CD 1 1 30 18370 1 1 24 ARG CG C 8.043 -5.243 -5.854 1.00 . A A . 24 ARG CG 1 1 30 18371 1 1 24 ARG CZ C 8.074 -8.755 -7.130 1.00 . A A . 24 ARG CZ 1 1 30 18372 1 1 24 ARG H H 8.409 -1.715 -5.106 1.00 . A A . 24 ARG H 1 1 30 18373 1 1 24 ARG HA H 9.829 -4.166 -4.325 1.00 . A A . 24 ARG HA 1 1 30 18374 1 1 24 ARG HB2 H 8.307 -3.335 -6.744 1.00 . A A . 24 ARG HB2 1 1 30 18375 1 1 24 ARG HB3 H 9.657 -4.438 -6.972 1.00 . A A . 24 ARG HB3 1 1 30 18376 1 1 24 ARG HD2 H 7.083 -6.133 -7.534 1.00 . A A . 24 ARG HD2 1 1 30 18377 1 1 24 ARG HD3 H 8.844 -6.203 -7.577 1.00 . A A . 24 ARG HD3 1 1 30 18378 1 1 24 ARG HE H 7.791 -7.745 -5.431 1.00 . A A . 24 ARG HE 1 1 30 18379 1 1 24 ARG HG2 H 8.446 -5.692 -4.959 1.00 . A A . 24 ARG HG2 1 1 30 18380 1 1 24 ARG HG3 H 7.046 -4.875 -5.657 1.00 . A A . 24 ARG HG3 1 1 30 18381 1 1 24 ARG HH11 H 8.305 -7.773 -8.883 1.00 . A A . 24 ARG HH11 1 1 30 18382 1 1 24 ARG HH12 H 8.371 -9.500 -8.985 1.00 . A A . 24 ARG HH12 1 1 30 18383 1 1 24 ARG HH21 H 7.879 -10.017 -5.564 1.00 . A A . 24 ARG HH21 1 1 30 18384 1 1 24 ARG HH22 H 8.129 -10.775 -7.101 1.00 . A A . 24 ARG HH22 1 1 30 18385 1 1 24 ARG N N 8.843 -2.363 -4.511 1.00 . A A . 24 ARG N 1 1 30 18386 1 1 24 ARG NE N 7.932 -7.652 -6.397 1.00 . A A . 24 ARG NE 1 1 30 18387 1 1 24 ARG NH1 N 8.266 -8.668 -8.440 1.00 . A A . 24 ARG NH1 1 1 30 18388 1 1 24 ARG NH2 N 8.023 -9.946 -6.551 1.00 . A A . 24 ARG NH2 1 1 30 18389 1 1 24 ARG O O 11.069 -1.956 -6.365 1.00 . A A . 24 ARG O 1 1 30 18390 1 1 25 THR C C 14.434 -4.168 -5.183 1.00 . A A . 25 THR C 1 1 30 18391 1 1 25 THR CA C 13.431 -3.040 -5.402 1.00 . A A . 25 THR CA 1 1 30 18392 1 1 25 THR CB C 13.839 -1.813 -4.585 1.00 . A A . 25 THR CB 1 1 30 18393 1 1 25 THR CG2 C 15.124 -1.174 -5.066 1.00 . A A . 25 THR CG2 1 1 30 18394 1 1 25 THR H H 11.970 -4.197 -4.399 1.00 . A A . 25 THR H 1 1 30 18395 1 1 25 THR HA H 13.425 -2.778 -6.449 1.00 . A A . 25 THR HA 1 1 30 18396 1 1 25 THR HB H 13.983 -2.110 -3.556 1.00 . A A . 25 THR HB 1 1 30 18397 1 1 25 THR HG1 H 12.594 -0.567 -3.730 1.00 . A A . 25 THR HG1 1 1 30 18398 1 1 25 THR HG21 H 15.159 -1.203 -6.145 1.00 . A A . 25 THR HG21 1 1 30 18399 1 1 25 THR HG22 H 15.162 -0.147 -4.733 1.00 . A A . 25 THR HG22 1 1 30 18400 1 1 25 THR HG23 H 15.968 -1.715 -4.664 1.00 . A A . 25 THR HG23 1 1 30 18401 1 1 25 THR N N 12.084 -3.464 -5.039 1.00 . A A . 25 THR N 1 1 30 18402 1 1 25 THR O O 15.601 -3.923 -4.874 1.00 . A A . 25 THR O 1 1 30 18403 1 1 25 THR OG1 O 12.826 -0.824 -4.625 1.00 . A A . 25 THR OG1 1 1 30 18404 1 1 26 SER C C 15.399 -6.615 -3.750 1.00 . A A . 26 SER C 1 1 30 18405 1 1 26 SER CA C 14.829 -6.570 -5.164 1.00 . A A . 26 SER CA 1 1 30 18406 1 1 26 SER CB C 15.969 -6.554 -6.185 1.00 . A A . 26 SER CB 1 1 30 18407 1 1 26 SER H H 13.033 -5.534 -5.591 1.00 . A A . 26 SER H 1 1 30 18408 1 1 26 SER HA H 14.227 -7.451 -5.325 1.00 . A A . 26 SER HA 1 1 30 18409 1 1 26 SER HB2 H 16.536 -5.642 -6.074 1.00 . A A . 26 SER HB2 1 1 30 18410 1 1 26 SER HB3 H 16.614 -7.403 -6.014 1.00 . A A . 26 SER HB3 1 1 30 18411 1 1 26 SER HG H 16.187 -6.821 -8.114 1.00 . A A . 26 SER HG 1 1 30 18412 1 1 26 SER N N 13.972 -5.403 -5.344 1.00 . A A . 26 SER N 1 1 30 18413 1 1 26 SER O O 16.497 -7.126 -3.529 1.00 . A A . 26 SER O 1 1 30 18414 1 1 26 SER OG O 15.468 -6.619 -7.509 1.00 . A A . 26 SER OG 1 1 30 18415 1 1 27 VAL C C 14.143 -6.881 -0.524 1.00 . A A . 27 VAL C 1 1 30 18416 1 1 27 VAL CA C 15.078 -6.057 -1.403 1.00 . A A . 27 VAL CA 1 1 30 18417 1 1 27 VAL CB C 15.143 -4.619 -0.855 1.00 . A A . 27 VAL CB 1 1 30 18418 1 1 27 VAL CG1 C 16.346 -3.884 -1.426 1.00 . A A . 27 VAL CG1 1 1 30 18419 1 1 27 VAL CG2 C 13.855 -3.872 -1.164 1.00 . A A . 27 VAL CG2 1 1 30 18420 1 1 27 VAL H H 13.781 -5.685 -3.033 1.00 . A A . 27 VAL H 1 1 30 18421 1 1 27 VAL HA H 16.068 -6.484 -1.354 1.00 . A A . 27 VAL HA 1 1 30 18422 1 1 27 VAL HB H 15.256 -4.669 0.218 1.00 . A A . 27 VAL HB 1 1 30 18423 1 1 27 VAL HG11 H 17.089 -4.601 -1.744 1.00 . A A . 27 VAL HG11 1 1 30 18424 1 1 27 VAL HG12 H 16.035 -3.288 -2.271 1.00 . A A . 27 VAL HG12 1 1 30 18425 1 1 27 VAL HG13 H 16.768 -3.241 -0.668 1.00 . A A . 27 VAL HG13 1 1 30 18426 1 1 27 VAL HG21 H 13.022 -4.385 -0.707 1.00 . A A . 27 VAL HG21 1 1 30 18427 1 1 27 VAL HG22 H 13.919 -2.867 -0.772 1.00 . A A . 27 VAL HG22 1 1 30 18428 1 1 27 VAL HG23 H 13.710 -3.831 -2.234 1.00 . A A . 27 VAL HG23 1 1 30 18429 1 1 27 VAL N N 14.647 -6.078 -2.795 1.00 . A A . 27 VAL N 1 1 30 18430 1 1 27 VAL O O 14.582 -7.555 0.407 1.00 . A A . 27 VAL O 1 1 30 18431 1 1 28 SER C C 10.462 -7.370 -0.666 1.00 . A A . 28 SER C 1 1 30 18432 1 1 28 SER CA C 11.851 -7.561 -0.068 1.00 . A A . 28 SER CA 1 1 30 18433 1 1 28 SER CB C 11.855 -7.111 1.394 1.00 . A A . 28 SER CB 1 1 30 18434 1 1 28 SER H H 12.565 -6.266 -1.583 1.00 . A A . 28 SER H 1 1 30 18435 1 1 28 SER HA H 12.109 -8.609 -0.113 1.00 . A A . 28 SER HA 1 1 30 18436 1 1 28 SER HB2 H 12.851 -7.219 1.799 1.00 . A A . 28 SER HB2 1 1 30 18437 1 1 28 SER HB3 H 11.555 -6.075 1.450 1.00 . A A . 28 SER HB3 1 1 30 18438 1 1 28 SER HG H 11.204 -7.827 3.098 1.00 . A A . 28 SER HG 1 1 30 18439 1 1 28 SER N N 12.852 -6.821 -0.828 1.00 . A A . 28 SER N 1 1 30 18440 1 1 28 SER O O 10.316 -6.827 -1.761 1.00 . A A . 28 SER O 1 1 30 18441 1 1 28 SER OG O 10.961 -7.889 2.171 1.00 . A A . 28 SER OG 1 1 30 18442 1 1 29 SER C C 7.173 -7.127 0.697 1.00 . A A . 29 SER C 1 1 30 18443 1 1 29 SER CA C 8.064 -7.699 -0.401 1.00 . A A . 29 SER CA 1 1 30 18444 1 1 29 SER CB C 7.532 -9.062 -0.847 1.00 . A A . 29 SER CB 1 1 30 18445 1 1 29 SER H H 9.623 -8.245 0.924 1.00 . A A . 29 SER H 1 1 30 18446 1 1 29 SER HA H 8.055 -7.025 -1.244 1.00 . A A . 29 SER HA 1 1 30 18447 1 1 29 SER HB2 H 8.360 -9.699 -1.118 1.00 . A A . 29 SER HB2 1 1 30 18448 1 1 29 SER HB3 H 6.981 -9.514 -0.035 1.00 . A A . 29 SER HB3 1 1 30 18449 1 1 29 SER HG H 6.070 -8.198 -1.824 1.00 . A A . 29 SER HG 1 1 30 18450 1 1 29 SER N N 9.443 -7.821 0.059 1.00 . A A . 29 SER N 1 1 30 18451 1 1 29 SER O O 6.555 -7.870 1.459 1.00 . A A . 29 SER O 1 1 30 18452 1 1 29 SER OG O 6.672 -8.932 -1.966 1.00 . A A . 29 SER OG 1 1 30 18453 1 1 30 HIS C C 4.822 -5.156 1.387 1.00 . A A . 30 HIS C 1 1 30 18454 1 1 30 HIS CA C 6.297 -5.129 1.776 1.00 . A A . 30 HIS CA 1 1 30 18455 1 1 30 HIS CB C 6.761 -3.683 1.956 1.00 . A A . 30 HIS CB 1 1 30 18456 1 1 30 HIS CD2 C 9.286 -4.073 2.406 1.00 . A A . 30 HIS CD2 1 1 30 18457 1 1 30 HIS CE1 C 9.465 -2.910 4.256 1.00 . A A . 30 HIS CE1 1 1 30 18458 1 1 30 HIS CG C 8.064 -3.559 2.684 1.00 . A A . 30 HIS CG 1 1 30 18459 1 1 30 HIS H H 7.628 -5.262 0.135 1.00 . A A . 30 HIS H 1 1 30 18460 1 1 30 HIS HA H 6.420 -5.656 2.710 1.00 . A A . 30 HIS HA 1 1 30 18461 1 1 30 HIS HB2 H 6.879 -3.226 0.985 1.00 . A A . 30 HIS HB2 1 1 30 18462 1 1 30 HIS HB3 H 6.014 -3.139 2.516 1.00 . A A . 30 HIS HB3 1 1 30 18463 1 1 30 HIS HD1 H 7.500 -2.343 4.309 1.00 . A A . 30 HIS HD1 1 1 30 18464 1 1 30 HIS HD2 H 9.543 -4.696 1.561 1.00 . A A . 30 HIS HD2 1 1 30 18465 1 1 30 HIS HE1 H 9.871 -2.442 5.141 1.00 . A A . 30 HIS HE1 1 1 30 18466 1 1 30 HIS HE2 H 11.068 -3.943 3.509 1.00 . A A . 30 HIS HE2 1 1 30 18467 1 1 30 HIS N N 7.112 -5.801 0.771 1.00 . A A . 30 HIS N 1 1 30 18468 1 1 30 HIS ND1 N 8.210 -2.837 3.849 1.00 . A A . 30 HIS ND1 1 1 30 18469 1 1 30 HIS NE2 N 10.138 -3.654 3.398 1.00 . A A . 30 HIS NE2 1 1 30 18470 1 1 30 HIS O O 4.290 -4.179 0.859 1.00 . A A . 30 HIS O 1 1 30 18471 1 1 31 TYR C C 1.898 -5.482 2.154 1.00 . A A . 31 TYR C 1 1 30 18472 1 1 31 TYR CA C 2.753 -6.438 1.328 1.00 . A A . 31 TYR CA 1 1 30 18473 1 1 31 TYR CB C 2.309 -7.881 1.574 1.00 . A A . 31 TYR CB 1 1 30 18474 1 1 31 TYR CD1 C 2.691 -8.667 -0.794 1.00 . A A . 31 TYR CD1 1 1 30 18475 1 1 31 TYR CD2 C 3.563 -9.992 0.986 1.00 . A A . 31 TYR CD2 1 1 30 18476 1 1 31 TYR CE1 C 3.197 -9.564 -1.715 1.00 . A A . 31 TYR CE1 1 1 30 18477 1 1 31 TYR CE2 C 4.073 -10.893 0.071 1.00 . A A . 31 TYR CE2 1 1 30 18478 1 1 31 TYR CG C 2.865 -8.865 0.570 1.00 . A A . 31 TYR CG 1 1 30 18479 1 1 31 TYR CZ C 3.887 -10.675 -1.278 1.00 . A A . 31 TYR CZ 1 1 30 18480 1 1 31 TYR H H 4.646 -7.026 2.072 1.00 . A A . 31 TYR H 1 1 30 18481 1 1 31 TYR HA H 2.625 -6.204 0.282 1.00 . A A . 31 TYR HA 1 1 30 18482 1 1 31 TYR HB2 H 2.637 -8.188 2.556 1.00 . A A . 31 TYR HB2 1 1 30 18483 1 1 31 TYR HB3 H 1.231 -7.931 1.528 1.00 . A A . 31 TYR HB3 1 1 30 18484 1 1 31 TYR HD1 H 2.150 -7.796 -1.133 1.00 . A A . 31 TYR HD1 1 1 30 18485 1 1 31 TYR HD2 H 3.706 -10.160 2.043 1.00 . A A . 31 TYR HD2 1 1 30 18486 1 1 31 TYR HE1 H 3.051 -9.393 -2.771 1.00 . A A . 31 TYR HE1 1 1 30 18487 1 1 31 TYR HE2 H 4.613 -11.763 0.414 1.00 . A A . 31 TYR HE2 1 1 30 18488 1 1 31 TYR HH H 4.829 -11.093 -2.901 1.00 . A A . 31 TYR HH 1 1 30 18489 1 1 31 TYR N N 4.167 -6.282 1.651 1.00 . A A . 31 TYR N 1 1 30 18490 1 1 31 TYR O O 2.163 -5.260 3.335 1.00 . A A . 31 TYR O 1 1 30 18491 1 1 31 TYR OH O 4.392 -11.571 -2.192 1.00 . A A . 31 TYR OH 1 1 30 18492 1 1 32 CYS C C -0.986 -4.732 3.122 1.00 . A A . 32 CYS C 1 1 30 18493 1 1 32 CYS CA C -0.023 -3.990 2.202 1.00 . A A . 32 CYS CA 1 1 30 18494 1 1 32 CYS CB C -0.810 -3.170 1.179 1.00 . A A . 32 CYS CB 1 1 30 18495 1 1 32 CYS H H 0.711 -5.138 0.582 1.00 . A A . 32 CYS H 1 1 30 18496 1 1 32 CYS HA H 0.582 -3.322 2.797 1.00 . A A . 32 CYS HA 1 1 30 18497 1 1 32 CYS HB2 H -1.077 -3.805 0.348 1.00 . A A . 32 CYS HB2 1 1 30 18498 1 1 32 CYS HB3 H -1.712 -2.798 1.644 1.00 . A A . 32 CYS HB3 1 1 30 18499 1 1 32 CYS N N 0.871 -4.921 1.525 1.00 . A A . 32 CYS N 1 1 30 18500 1 1 32 CYS O O -1.125 -5.952 3.038 1.00 . A A . 32 CYS O 1 1 30 18501 1 1 32 CYS SG S 0.100 -1.740 0.511 1.00 . A A . 32 CYS SG 1 1 30 18502 1 1 33 THR C C -4.038 -4.196 4.574 1.00 . A A . 33 THR C 1 1 30 18503 1 1 33 THR CA C -2.603 -4.575 4.935 1.00 . A A . 33 THR CA 1 1 30 18504 1 1 33 THR CB C -2.290 -4.124 6.363 1.00 . A A . 33 THR CB 1 1 30 18505 1 1 33 THR CG2 C -0.817 -4.187 6.702 1.00 . A A . 33 THR CG2 1 1 30 18506 1 1 33 THR H H -1.498 -3.020 4.018 1.00 . A A . 33 THR H 1 1 30 18507 1 1 33 THR HA H -2.502 -5.649 4.878 1.00 . A A . 33 THR HA 1 1 30 18508 1 1 33 THR HB H -2.817 -4.766 7.055 1.00 . A A . 33 THR HB 1 1 30 18509 1 1 33 THR HG1 H -2.265 -2.206 5.967 1.00 . A A . 33 THR HG1 1 1 30 18510 1 1 33 THR HG21 H -0.239 -3.818 5.867 1.00 . A A . 33 THR HG21 1 1 30 18511 1 1 33 THR HG22 H -0.621 -3.577 7.572 1.00 . A A . 33 THR HG22 1 1 30 18512 1 1 33 THR HG23 H -0.538 -5.210 6.909 1.00 . A A . 33 THR HG23 1 1 30 18513 1 1 33 THR N N -1.650 -3.988 3.999 1.00 . A A . 33 THR N 1 1 30 18514 1 1 33 THR O O -4.962 -4.425 5.355 1.00 . A A . 33 THR O 1 1 30 18515 1 1 33 THR OG1 O -2.723 -2.792 6.574 1.00 . A A . 33 THR OG1 1 1 30 18516 1 1 34 GLY C C -6.276 -2.375 3.982 1.00 . A A . 34 GLY C 1 1 30 18517 1 1 34 GLY CA C -5.550 -3.221 2.953 1.00 . A A . 34 GLY CA 1 1 30 18518 1 1 34 GLY H H -3.452 -3.460 2.804 1.00 . A A . 34 GLY H 1 1 30 18519 1 1 34 GLY HA2 H -6.133 -4.109 2.758 1.00 . A A . 34 GLY HA2 1 1 30 18520 1 1 34 GLY HA3 H -5.461 -2.655 2.037 1.00 . A A . 34 GLY HA3 1 1 30 18521 1 1 34 GLY N N -4.222 -3.618 3.388 1.00 . A A . 34 GLY N 1 1 30 18522 1 1 34 GLY O O -7.421 -2.660 4.332 1.00 . A A . 34 GLY O 1 1 30 18523 1 1 35 ARG C C -5.633 0.964 5.347 1.00 . A A . 35 ARG C 1 1 30 18524 1 1 35 ARG CA C -6.200 -0.446 5.464 1.00 . A A . 35 ARG CA 1 1 30 18525 1 1 35 ARG CB C -5.955 -0.991 6.872 1.00 . A A . 35 ARG CB 1 1 30 18526 1 1 35 ARG CD C -6.943 -2.458 8.657 1.00 . A A . 35 ARG CD 1 1 30 18527 1 1 35 ARG CG C -6.708 -2.278 7.166 1.00 . A A . 35 ARG CG 1 1 30 18528 1 1 35 ARG CZ C -9.401 -2.626 8.672 1.00 . A A . 35 ARG CZ 1 1 30 18529 1 1 35 ARG H H -4.699 -1.157 4.151 1.00 . A A . 35 ARG H 1 1 30 18530 1 1 35 ARG HA H -7.261 -0.408 5.283 1.00 . A A . 35 ARG HA 1 1 30 18531 1 1 35 ARG HB2 H -4.899 -1.181 6.994 1.00 . A A . 35 ARG HB2 1 1 30 18532 1 1 35 ARG HB3 H -6.263 -0.247 7.592 1.00 . A A . 35 ARG HB3 1 1 30 18533 1 1 35 ARG HD2 H -6.827 -3.504 8.903 1.00 . A A . 35 ARG HD2 1 1 30 18534 1 1 35 ARG HD3 H -6.208 -1.879 9.196 1.00 . A A . 35 ARG HD3 1 1 30 18535 1 1 35 ARG HE H -8.343 -1.240 9.643 1.00 . A A . 35 ARG HE 1 1 30 18536 1 1 35 ARG HG2 H -7.663 -2.248 6.662 1.00 . A A . 35 ARG HG2 1 1 30 18537 1 1 35 ARG HG3 H -6.130 -3.113 6.797 1.00 . A A . 35 ARG HG3 1 1 30 18538 1 1 35 ARG HH11 H -8.472 -4.042 7.566 1.00 . A A . 35 ARG HH11 1 1 30 18539 1 1 35 ARG HH12 H -10.201 -4.137 7.594 1.00 . A A . 35 ARG HH12 1 1 30 18540 1 1 35 ARG HH21 H -10.617 -1.365 9.681 1.00 . A A . 35 ARG HH21 1 1 30 18541 1 1 35 ARG HH22 H -11.419 -2.618 8.794 1.00 . A A . 35 ARG HH22 1 1 30 18542 1 1 35 ARG N N -5.609 -1.333 4.468 1.00 . A A . 35 ARG N 1 1 30 18543 1 1 35 ARG NE N -8.279 -2.023 9.057 1.00 . A A . 35 ARG NE 1 1 30 18544 1 1 35 ARG NH1 N -9.354 -3.689 7.879 1.00 . A A . 35 ARG NH1 1 1 30 18545 1 1 35 ARG NH2 N -10.575 -2.165 9.083 1.00 . A A . 35 ARG NH2 1 1 30 18546 1 1 35 ARG O O -6.375 1.947 5.365 1.00 . A A . 35 ARG O 1 1 30 18547 1 1 36 SER C C -2.590 2.310 4.008 1.00 . A A . 36 SER C 1 1 30 18548 1 1 36 SER CA C -3.645 2.344 5.109 1.00 . A A . 36 SER CA 1 1 30 18549 1 1 36 SER CB C -2.996 2.730 6.439 1.00 . A A . 36 SER CB 1 1 30 18550 1 1 36 SER H H -3.781 0.235 5.221 1.00 . A A . 36 SER H 1 1 30 18551 1 1 36 SER HA H -4.390 3.083 4.854 1.00 . A A . 36 SER HA 1 1 30 18552 1 1 36 SER HB2 H -3.763 2.852 7.189 1.00 . A A . 36 SER HB2 1 1 30 18553 1 1 36 SER HB3 H -2.315 1.949 6.745 1.00 . A A . 36 SER HB3 1 1 30 18554 1 1 36 SER HG H -2.341 4.435 7.146 1.00 . A A . 36 SER HG 1 1 30 18555 1 1 36 SER N N -4.316 1.055 5.228 1.00 . A A . 36 SER N 1 1 30 18556 1 1 36 SER O O -2.036 1.255 3.697 1.00 . A A . 36 SER O 1 1 30 18557 1 1 36 SER OG O -2.276 3.944 6.323 1.00 . A A . 36 SER OG 1 1 30 18558 1 1 37 CYS C C 0.086 3.384 2.907 1.00 . A A . 37 CYS C 1 1 30 18559 1 1 37 CYS CA C -1.325 3.574 2.357 1.00 . A A . 37 CYS CA 1 1 30 18560 1 1 37 CYS CB C -1.437 4.931 1.659 1.00 . A A . 37 CYS CB 1 1 30 18561 1 1 37 CYS H H -2.788 4.278 3.714 1.00 . A A . 37 CYS H 1 1 30 18562 1 1 37 CYS HA H -1.527 2.793 1.640 1.00 . A A . 37 CYS HA 1 1 30 18563 1 1 37 CYS HB2 H -2.281 5.468 2.066 1.00 . A A . 37 CYS HB2 1 1 30 18564 1 1 37 CYS HB3 H -0.536 5.499 1.839 1.00 . A A . 37 CYS HB3 1 1 30 18565 1 1 37 CYS N N -2.315 3.471 3.422 1.00 . A A . 37 CYS N 1 1 30 18566 1 1 37 CYS O O 0.997 2.987 2.181 1.00 . A A . 37 CYS O 1 1 30 18567 1 1 37 CYS SG S -1.672 4.818 -0.143 1.00 . A A . 37 CYS SG 1 1 30 18568 1 1 38 GLU C C 2.067 2.100 4.744 1.00 . A A . 38 GLU C 1 1 30 18569 1 1 38 GLU CA C 1.560 3.535 4.839 1.00 . A A . 38 GLU CA 1 1 30 18570 1 1 38 GLU CB C 1.471 3.961 6.306 1.00 . A A . 38 GLU CB 1 1 30 18571 1 1 38 GLU CD C 2.406 5.816 7.743 1.00 . A A . 38 GLU CD 1 1 30 18572 1 1 38 GLU CG C 1.596 5.462 6.512 1.00 . A A . 38 GLU CG 1 1 30 18573 1 1 38 GLU H H -0.505 3.986 4.720 1.00 . A A . 38 GLU H 1 1 30 18574 1 1 38 GLU HA H 2.254 4.184 4.327 1.00 . A A . 38 GLU HA 1 1 30 18575 1 1 38 GLU HB2 H 0.520 3.642 6.705 1.00 . A A . 38 GLU HB2 1 1 30 18576 1 1 38 GLU HB3 H 2.264 3.477 6.858 1.00 . A A . 38 GLU HB3 1 1 30 18577 1 1 38 GLU HG2 H 2.077 5.893 5.647 1.00 . A A . 38 GLU HG2 1 1 30 18578 1 1 38 GLU HG3 H 0.605 5.881 6.617 1.00 . A A . 38 GLU HG3 1 1 30 18579 1 1 38 GLU N N 0.259 3.673 4.193 1.00 . A A . 38 GLU N 1 1 30 18580 1 1 38 GLU O O 1.580 1.211 5.443 1.00 . A A . 38 GLU O 1 1 30 18581 1 1 38 GLU OE1 O 2.121 6.864 8.360 1.00 . A A . 38 GLU OE1 1 1 30 18582 1 1 38 GLU OE2 O 3.325 5.045 8.091 1.00 . A A . 38 GLU OE2 1 1 30 18583 1 1 39 CYS C C 4.293 0.065 4.973 1.00 . A A . 39 CYS C 1 1 30 18584 1 1 39 CYS CA C 3.624 0.554 3.688 1.00 . A A . 39 CYS CA 1 1 30 18585 1 1 39 CYS CB C 4.642 0.576 2.547 1.00 . A A . 39 CYS CB 1 1 30 18586 1 1 39 CYS H H 3.395 2.631 3.347 1.00 . A A . 39 CYS H 1 1 30 18587 1 1 39 CYS HA H 2.822 -0.120 3.430 1.00 . A A . 39 CYS HA 1 1 30 18588 1 1 39 CYS HB2 H 5.434 1.266 2.795 1.00 . A A . 39 CYS HB2 1 1 30 18589 1 1 39 CYS HB3 H 5.059 -0.414 2.428 1.00 . A A . 39 CYS HB3 1 1 30 18590 1 1 39 CYS N N 3.049 1.881 3.875 1.00 . A A . 39 CYS N 1 1 30 18591 1 1 39 CYS O O 5.318 0.605 5.388 1.00 . A A . 39 CYS O 1 1 30 18592 1 1 39 CYS SG S 3.948 1.083 0.941 1.00 . A A . 39 CYS SG 1 1 30 18593 1 1 40 PRO C C 5.756 -1.874 6.728 1.00 . A A . 40 PRO C 1 1 30 18594 1 1 40 PRO CA C 4.280 -1.519 6.863 1.00 . A A . 40 PRO CA 1 1 30 18595 1 1 40 PRO CB C 3.447 -2.781 7.098 1.00 . A A . 40 PRO CB 1 1 30 18596 1 1 40 PRO CD C 2.499 -1.677 5.203 1.00 . A A . 40 PRO CD 1 1 30 18597 1 1 40 PRO CG C 2.158 -2.520 6.400 1.00 . A A . 40 PRO CG 1 1 30 18598 1 1 40 PRO HA H 4.149 -0.838 7.691 1.00 . A A . 40 PRO HA 1 1 30 18599 1 1 40 PRO HB2 H 3.957 -3.636 6.679 1.00 . A A . 40 PRO HB2 1 1 30 18600 1 1 40 PRO HB3 H 3.299 -2.926 8.158 1.00 . A A . 40 PRO HB3 1 1 30 18601 1 1 40 PRO HD2 H 2.692 -2.303 4.344 1.00 . A A . 40 PRO HD2 1 1 30 18602 1 1 40 PRO HD3 H 1.703 -0.979 4.993 1.00 . A A . 40 PRO HD3 1 1 30 18603 1 1 40 PRO HG2 H 1.713 -3.453 6.088 1.00 . A A . 40 PRO HG2 1 1 30 18604 1 1 40 PRO HG3 H 1.487 -1.984 7.056 1.00 . A A . 40 PRO HG3 1 1 30 18605 1 1 40 PRO N N 3.724 -0.968 5.622 1.00 . A A . 40 PRO N 1 1 30 18606 1 1 40 PRO O O 6.264 -2.049 5.620 1.00 . A A . 40 PRO O 1 1 30 18607 1 1 41 SER C C 8.069 -3.792 8.174 1.00 . A A . 41 SER C 1 1 30 18608 1 1 41 SER CA C 7.860 -2.312 7.870 1.00 . A A . 41 SER CA 1 1 30 18609 1 1 41 SER CB C 8.601 -1.459 8.902 1.00 . A A . 41 SER CB 1 1 30 18610 1 1 41 SER H H 5.981 -1.827 8.714 1.00 . A A . 41 SER H 1 1 30 18611 1 1 41 SER HA H 8.257 -2.098 6.889 1.00 . A A . 41 SER HA 1 1 30 18612 1 1 41 SER HB2 H 7.978 -1.332 9.775 1.00 . A A . 41 SER HB2 1 1 30 18613 1 1 41 SER HB3 H 9.518 -1.954 9.184 1.00 . A A . 41 SER HB3 1 1 30 18614 1 1 41 SER HG H 8.119 0.355 8.342 1.00 . A A . 41 SER HG 1 1 30 18615 1 1 41 SER N N 6.441 -1.978 7.862 1.00 . A A . 41 SER N 1 1 30 18616 1 1 41 SER O O 9.068 -4.177 8.782 1.00 . A A . 41 SER O 1 1 30 18617 1 1 41 SER OG O 8.914 -0.181 8.377 1.00 . A A . 41 SER OG 1 1 30 18618 1 1 42 TYR C C 6.528 -6.824 6.835 1.00 . A A . 42 TYR C 1 1 30 18619 1 1 42 TYR CA C 7.201 -6.057 7.971 1.00 . A A . 42 TYR CA 1 1 30 18620 1 1 42 TYR CB C 6.548 -6.422 9.305 1.00 . A A . 42 TYR CB 1 1 30 18621 1 1 42 TYR CD1 C 4.076 -6.336 8.797 1.00 . A A . 42 TYR CD1 1 1 30 18622 1 1 42 TYR CD2 C 4.961 -4.760 10.352 1.00 . A A . 42 TYR CD2 1 1 30 18623 1 1 42 TYR CE1 C 2.815 -5.795 8.962 1.00 . A A . 42 TYR CE1 1 1 30 18624 1 1 42 TYR CE2 C 3.703 -4.215 10.522 1.00 . A A . 42 TYR CE2 1 1 30 18625 1 1 42 TYR CG C 5.169 -5.828 9.488 1.00 . A A . 42 TYR CG 1 1 30 18626 1 1 42 TYR CZ C 2.634 -4.736 9.825 1.00 . A A . 42 TYR CZ 1 1 30 18627 1 1 42 TYR H H 6.348 -4.252 7.266 1.00 . A A . 42 TYR H 1 1 30 18628 1 1 42 TYR HA H 8.245 -6.329 8.004 1.00 . A A . 42 TYR HA 1 1 30 18629 1 1 42 TYR HB2 H 6.457 -7.496 9.372 1.00 . A A . 42 TYR HB2 1 1 30 18630 1 1 42 TYR HB3 H 7.173 -6.068 10.112 1.00 . A A . 42 TYR HB3 1 1 30 18631 1 1 42 TYR HD1 H 4.221 -7.166 8.122 1.00 . A A . 42 TYR HD1 1 1 30 18632 1 1 42 TYR HD2 H 5.801 -4.354 10.896 1.00 . A A . 42 TYR HD2 1 1 30 18633 1 1 42 TYR HE1 H 1.978 -6.204 8.416 1.00 . A A . 42 TYR HE1 1 1 30 18634 1 1 42 TYR HE2 H 3.561 -3.385 11.199 1.00 . A A . 42 TYR HE2 1 1 30 18635 1 1 42 TYR HH H 1.227 -4.021 10.924 1.00 . A A . 42 TYR HH 1 1 30 18636 1 1 42 TYR N N 7.120 -4.618 7.745 1.00 . A A . 42 TYR N 1 1 30 18637 1 1 42 TYR O O 5.609 -6.318 6.191 1.00 . A A . 42 TYR O 1 1 30 18638 1 1 42 TYR OH O 1.379 -4.196 9.992 1.00 . A A . 42 TYR OH 1 1 30 18639 1 1 43 PRO C C 5.005 -9.380 5.837 1.00 . A A . 43 PRO C 1 1 30 18640 1 1 43 PRO CA C 6.415 -8.901 5.511 1.00 . A A . 43 PRO CA 1 1 30 18641 1 1 43 PRO CB C 7.380 -10.087 5.443 1.00 . A A . 43 PRO CB 1 1 30 18642 1 1 43 PRO CD C 8.071 -8.745 7.296 1.00 . A A . 43 PRO CD 1 1 30 18643 1 1 43 PRO CG C 7.984 -10.162 6.802 1.00 . A A . 43 PRO CG 1 1 30 18644 1 1 43 PRO HA H 6.408 -8.384 4.563 1.00 . A A . 43 PRO HA 1 1 30 18645 1 1 43 PRO HB2 H 6.832 -10.987 5.202 1.00 . A A . 43 PRO HB2 1 1 30 18646 1 1 43 PRO HB3 H 8.130 -9.902 4.688 1.00 . A A . 43 PRO HB3 1 1 30 18647 1 1 43 PRO HD2 H 7.911 -8.706 8.363 1.00 . A A . 43 PRO HD2 1 1 30 18648 1 1 43 PRO HD3 H 9.028 -8.314 7.040 1.00 . A A . 43 PRO HD3 1 1 30 18649 1 1 43 PRO HG2 H 7.351 -10.748 7.453 1.00 . A A . 43 PRO HG2 1 1 30 18650 1 1 43 PRO HG3 H 8.969 -10.599 6.742 1.00 . A A . 43 PRO HG3 1 1 30 18651 1 1 43 PRO N N 6.979 -8.064 6.575 1.00 . A A . 43 PRO N 1 1 30 18652 1 1 43 PRO O O 4.717 -9.772 6.968 1.00 . A A . 43 PRO O 1 1 30 18653 1 1 44 GLY C C 2.649 -11.272 5.267 1.00 . A A . 44 GLY C 1 1 30 18654 1 1 44 GLY CA C 2.758 -9.777 5.040 1.00 . A A . 44 GLY CA 1 1 30 18655 1 1 44 GLY H H 4.414 -9.022 3.958 1.00 . A A . 44 GLY H 1 1 30 18656 1 1 44 GLY HA2 H 2.177 -9.513 4.168 1.00 . A A . 44 GLY HA2 1 1 30 18657 1 1 44 GLY HA3 H 2.352 -9.263 5.899 1.00 . A A . 44 GLY HA3 1 1 30 18658 1 1 44 GLY N N 4.128 -9.344 4.839 1.00 . A A . 44 GLY N 1 1 30 18659 1 1 44 GLY O O 3.681 -11.902 5.580 1.00 . A A . 44 GLY O 1 1 30 18660 1 1 44 GLY OXT O 1.531 -11.813 5.132 1.00 . A A . 44 GLY OXT 1 1 31 18661 1 1 1 ALA C C -12.508 13.489 5.873 1.00 . A A . 1 ALA C 1 1 31 18662 1 1 1 ALA CA C -13.761 13.430 6.739 1.00 . A A . 1 ALA CA 1 1 31 18663 1 1 1 ALA CB C -15.003 13.645 5.887 1.00 . A A . 1 ALA CB 1 1 31 18664 1 1 1 ALA H1 H -12.842 14.260 8.381 1.00 . A A . 1 ALA H1 1 1 31 18665 1 1 1 ALA H2 H -13.679 15.380 7.387 1.00 . A A . 1 ALA H2 1 1 31 18666 1 1 1 ALA H3 H -14.555 14.321 8.415 1.00 . A A . 1 ALA H3 1 1 31 18667 1 1 1 ALA HA H -13.829 12.449 7.188 1.00 . A A . 1 ALA HA 1 1 31 18668 1 1 1 ALA HB1 H -15.861 13.781 6.528 1.00 . A A . 1 ALA HB1 1 1 31 18669 1 1 1 ALA HB2 H -15.159 12.783 5.254 1.00 . A A . 1 ALA HB2 1 1 31 18670 1 1 1 ALA HB3 H -14.870 14.523 5.272 1.00 . A A . 1 ALA HB3 1 1 31 18671 1 1 1 ALA N N -13.704 14.438 7.829 1.00 . A A . 1 ALA N 1 1 31 18672 1 1 1 ALA O O -11.551 14.193 6.194 1.00 . A A . 1 ALA O 1 1 31 18673 1 1 2 MET C C -11.852 12.543 2.415 1.00 . A A . 2 MET C 1 1 31 18674 1 1 2 MET CA C -11.385 12.712 3.858 1.00 . A A . 2 MET CA 1 1 31 18675 1 1 2 MET CB C -10.433 11.576 4.235 1.00 . A A . 2 MET CB 1 1 31 18676 1 1 2 MET CE C -8.745 10.185 7.366 1.00 . A A . 2 MET CE 1 1 31 18677 1 1 2 MET CG C -9.460 11.941 5.344 1.00 . A A . 2 MET CG 1 1 31 18678 1 1 2 MET H H -13.313 12.204 4.569 1.00 . A A . 2 MET H 1 1 31 18679 1 1 2 MET HA H -10.862 13.653 3.946 1.00 . A A . 2 MET HA 1 1 31 18680 1 1 2 MET HB2 H -11.015 10.727 4.560 1.00 . A A . 2 MET HB2 1 1 31 18681 1 1 2 MET HB3 H -9.861 11.297 3.362 1.00 . A A . 2 MET HB3 1 1 31 18682 1 1 2 MET HE1 H -7.788 10.548 7.020 1.00 . A A . 2 MET HE1 1 1 31 18683 1 1 2 MET HE2 H -8.710 10.041 8.436 1.00 . A A . 2 MET HE2 1 1 31 18684 1 1 2 MET HE3 H -8.970 9.246 6.883 1.00 . A A . 2 MET HE3 1 1 31 18685 1 1 2 MET HG2 H -8.505 11.485 5.131 1.00 . A A . 2 MET HG2 1 1 31 18686 1 1 2 MET HG3 H -9.348 13.015 5.368 1.00 . A A . 2 MET HG3 1 1 31 18687 1 1 2 MET N N -12.521 12.744 4.771 1.00 . A A . 2 MET N 1 1 31 18688 1 1 2 MET O O -13.016 12.234 2.161 1.00 . A A . 2 MET O 1 1 31 18689 1 1 2 MET SD S -10.016 11.382 6.966 1.00 . A A . 2 MET SD 1 1 31 18690 1 1 3 ASP C C -10.167 11.834 -0.674 1.00 . A A . 3 ASP C 1 1 31 18691 1 1 3 ASP CA C -11.253 12.617 0.057 1.00 . A A . 3 ASP CA 1 1 31 18692 1 1 3 ASP CB C -11.418 13.998 -0.579 1.00 . A A . 3 ASP CB 1 1 31 18693 1 1 3 ASP CG C -12.469 14.009 -1.672 1.00 . A A . 3 ASP CG 1 1 31 18694 1 1 3 ASP H H -10.024 12.991 1.740 1.00 . A A . 3 ASP H 1 1 31 18695 1 1 3 ASP HA H -12.185 12.079 -0.025 1.00 . A A . 3 ASP HA 1 1 31 18696 1 1 3 ASP HB2 H -11.711 14.706 0.183 1.00 . A A . 3 ASP HB2 1 1 31 18697 1 1 3 ASP HB3 H -10.476 14.305 -1.007 1.00 . A A . 3 ASP HB3 1 1 31 18698 1 1 3 ASP N N -10.935 12.747 1.475 1.00 . A A . 3 ASP N 1 1 31 18699 1 1 3 ASP O O -9.085 12.356 -0.941 1.00 . A A . 3 ASP O 1 1 31 18700 1 1 3 ASP OD1 O -13.672 13.941 -1.340 1.00 . A A . 3 ASP OD1 1 1 31 18701 1 1 3 ASP OD2 O -12.090 14.087 -2.859 1.00 . A A . 3 ASP OD2 1 1 31 18702 1 1 4 CYS C C -8.243 9.534 -0.874 1.00 . A A . 4 CYS C 1 1 31 18703 1 1 4 CYS CA C -9.513 9.724 -1.696 1.00 . A A . 4 CYS CA 1 1 31 18704 1 1 4 CYS CB C -9.167 10.321 -3.061 1.00 . A A . 4 CYS CB 1 1 31 18705 1 1 4 CYS H H -11.344 10.220 -0.755 1.00 . A A . 4 CYS H 1 1 31 18706 1 1 4 CYS HA H -9.980 8.761 -1.842 1.00 . A A . 4 CYS HA 1 1 31 18707 1 1 4 CYS HB2 H -9.083 11.393 -2.966 1.00 . A A . 4 CYS HB2 1 1 31 18708 1 1 4 CYS HB3 H -8.220 9.919 -3.391 1.00 . A A . 4 CYS HB3 1 1 31 18709 1 1 4 CYS N N -10.464 10.579 -0.995 1.00 . A A . 4 CYS N 1 1 31 18710 1 1 4 CYS O O -7.478 10.476 -0.668 1.00 . A A . 4 CYS O 1 1 31 18711 1 1 4 CYS SG S -10.399 9.976 -4.358 1.00 . A A . 4 CYS SG 1 1 31 18712 1 1 5 THR C C -5.583 8.030 -0.464 1.00 . A A . 5 THR C 1 1 31 18713 1 1 5 THR CA C -6.845 7.996 0.392 1.00 . A A . 5 THR CA 1 1 31 18714 1 1 5 THR CB C -6.996 6.620 1.044 1.00 . A A . 5 THR CB 1 1 31 18715 1 1 5 THR CG2 C -6.168 6.459 2.300 1.00 . A A . 5 THR CG2 1 1 31 18716 1 1 5 THR H H -8.670 7.599 -0.605 1.00 . A A . 5 THR H 1 1 31 18717 1 1 5 THR HA H -6.761 8.743 1.166 1.00 . A A . 5 THR HA 1 1 31 18718 1 1 5 THR HB H -6.680 5.863 0.340 1.00 . A A . 5 THR HB 1 1 31 18719 1 1 5 THR HG1 H -8.460 5.444 1.598 1.00 . A A . 5 THR HG1 1 1 31 18720 1 1 5 THR HG21 H -5.201 6.916 2.155 1.00 . A A . 5 THR HG21 1 1 31 18721 1 1 5 THR HG22 H -6.672 6.937 3.127 1.00 . A A . 5 THR HG22 1 1 31 18722 1 1 5 THR HG23 H -6.041 5.408 2.515 1.00 . A A . 5 THR HG23 1 1 31 18723 1 1 5 THR N N -8.024 8.309 -0.407 1.00 . A A . 5 THR N 1 1 31 18724 1 1 5 THR O O -5.315 7.104 -1.229 1.00 . A A . 5 THR O 1 1 31 18725 1 1 5 THR OG1 O -8.348 6.373 1.385 1.00 . A A . 5 THR OG1 1 1 31 18726 1 1 6 THR C C -2.421 8.537 -0.403 1.00 . A A . 6 THR C 1 1 31 18727 1 1 6 THR CA C -3.577 9.257 -1.090 1.00 . A A . 6 THR CA 1 1 31 18728 1 1 6 THR CB C -3.240 10.739 -1.262 1.00 . A A . 6 THR CB 1 1 31 18729 1 1 6 THR CG2 C -3.823 11.342 -2.522 1.00 . A A . 6 THR CG2 1 1 31 18730 1 1 6 THR H H -5.078 9.808 0.297 1.00 . A A . 6 THR H 1 1 31 18731 1 1 6 THR HA H -3.732 8.817 -2.064 1.00 . A A . 6 THR HA 1 1 31 18732 1 1 6 THR HB H -2.167 10.851 -1.308 1.00 . A A . 6 THR HB 1 1 31 18733 1 1 6 THR HG1 H -2.985 11.940 0.263 1.00 . A A . 6 THR HG1 1 1 31 18734 1 1 6 THR HG21 H -4.328 10.574 -3.089 1.00 . A A . 6 THR HG21 1 1 31 18735 1 1 6 THR HG22 H -4.529 12.116 -2.257 1.00 . A A . 6 THR HG22 1 1 31 18736 1 1 6 THR HG23 H -3.030 11.767 -3.118 1.00 . A A . 6 THR HG23 1 1 31 18737 1 1 6 THR N N -4.811 9.103 -0.329 1.00 . A A . 6 THR N 1 1 31 18738 1 1 6 THR O O -2.463 8.282 0.800 1.00 . A A . 6 THR O 1 1 31 18739 1 1 6 THR OG1 O -3.719 11.493 -0.163 1.00 . A A . 6 THR OG1 1 1 31 18740 1 1 7 GLY C C 0.323 6.477 -1.574 1.00 . A A . 7 GLY C 1 1 31 18741 1 1 7 GLY CA C -0.240 7.519 -0.625 1.00 . A A . 7 GLY CA 1 1 31 18742 1 1 7 GLY H H -1.414 8.436 -2.130 1.00 . A A . 7 GLY H 1 1 31 18743 1 1 7 GLY HA2 H -0.532 7.033 0.294 1.00 . A A . 7 GLY HA2 1 1 31 18744 1 1 7 GLY HA3 H 0.529 8.245 -0.407 1.00 . A A . 7 GLY HA3 1 1 31 18745 1 1 7 GLY N N -1.391 8.209 -1.177 1.00 . A A . 7 GLY N 1 1 31 18746 1 1 7 GLY O O -0.062 6.427 -2.742 1.00 . A A . 7 GLY O 1 1 31 18747 1 1 8 PRO C C 0.913 3.413 -2.188 1.00 . A A . 8 PRO C 1 1 31 18748 1 1 8 PRO CA C 1.859 4.580 -1.923 1.00 . A A . 8 PRO CA 1 1 31 18749 1 1 8 PRO CB C 3.049 4.123 -1.081 1.00 . A A . 8 PRO CB 1 1 31 18750 1 1 8 PRO CD C 1.766 5.614 0.285 1.00 . A A . 8 PRO CD 1 1 31 18751 1 1 8 PRO CG C 2.639 4.388 0.326 1.00 . A A . 8 PRO CG 1 1 31 18752 1 1 8 PRO HA H 2.211 4.977 -2.864 1.00 . A A . 8 PRO HA 1 1 31 18753 1 1 8 PRO HB2 H 3.230 3.071 -1.250 1.00 . A A . 8 PRO HB2 1 1 31 18754 1 1 8 PRO HB3 H 3.925 4.693 -1.350 1.00 . A A . 8 PRO HB3 1 1 31 18755 1 1 8 PRO HD2 H 0.960 5.527 0.998 1.00 . A A . 8 PRO HD2 1 1 31 18756 1 1 8 PRO HD3 H 2.351 6.500 0.481 1.00 . A A . 8 PRO HD3 1 1 31 18757 1 1 8 PRO HG2 H 2.083 3.545 0.711 1.00 . A A . 8 PRO HG2 1 1 31 18758 1 1 8 PRO HG3 H 3.512 4.571 0.934 1.00 . A A . 8 PRO HG3 1 1 31 18759 1 1 8 PRO N N 1.245 5.624 -1.097 1.00 . A A . 8 PRO N 1 1 31 18760 1 1 8 PRO O O 0.806 2.933 -3.317 1.00 . A A . 8 PRO O 1 1 31 18761 1 1 9 CYS C C -2.087 2.334 -1.681 1.00 . A A . 9 CYS C 1 1 31 18762 1 1 9 CYS CA C -0.703 1.844 -1.265 1.00 . A A . 9 CYS CA 1 1 31 18763 1 1 9 CYS CB C -0.790 1.077 0.057 1.00 . A A . 9 CYS CB 1 1 31 18764 1 1 9 CYS H H 0.360 3.379 -0.267 1.00 . A A . 9 CYS H 1 1 31 18765 1 1 9 CYS HA H -0.326 1.181 -2.029 1.00 . A A . 9 CYS HA 1 1 31 18766 1 1 9 CYS HB2 H 0.196 0.731 0.329 1.00 . A A . 9 CYS HB2 1 1 31 18767 1 1 9 CYS HB3 H -1.158 1.740 0.826 1.00 . A A . 9 CYS HB3 1 1 31 18768 1 1 9 CYS N N 0.231 2.958 -1.142 1.00 . A A . 9 CYS N 1 1 31 18769 1 1 9 CYS O O -3.077 2.100 -0.987 1.00 . A A . 9 CYS O 1 1 31 18770 1 1 9 CYS SG S -1.889 -0.376 0.004 1.00 . A A . 9 CYS SG 1 1 31 18771 1 1 10 CYS C C -3.527 3.279 -4.835 1.00 . A A . 10 CYS C 1 1 31 18772 1 1 10 CYS CA C -3.410 3.537 -3.336 1.00 . A A . 10 CYS CA 1 1 31 18773 1 1 10 CYS CB C -3.524 5.039 -3.057 1.00 . A A . 10 CYS CB 1 1 31 18774 1 1 10 CYS H H -1.325 3.167 -3.329 1.00 . A A . 10 CYS H 1 1 31 18775 1 1 10 CYS HA H -4.214 3.023 -2.829 1.00 . A A . 10 CYS HA 1 1 31 18776 1 1 10 CYS HB2 H -3.013 5.581 -3.839 1.00 . A A . 10 CYS HB2 1 1 31 18777 1 1 10 CYS HB3 H -4.567 5.317 -3.057 1.00 . A A . 10 CYS HB3 1 1 31 18778 1 1 10 CYS N N -2.148 3.014 -2.821 1.00 . A A . 10 CYS N 1 1 31 18779 1 1 10 CYS O O -2.580 3.503 -5.589 1.00 . A A . 10 CYS O 1 1 31 18780 1 1 10 CYS SG S -2.809 5.565 -1.465 1.00 . A A . 10 CYS SG 1 1 31 18781 1 1 11 ARG C C -4.806 3.781 -7.513 1.00 . A A . 11 ARG C 1 1 31 18782 1 1 11 ARG CA C -4.931 2.517 -6.671 1.00 . A A . 11 ARG CA 1 1 31 18783 1 1 11 ARG CB C -6.317 1.899 -6.861 1.00 . A A . 11 ARG CB 1 1 31 18784 1 1 11 ARG CD C -7.083 1.894 -9.254 1.00 . A A . 11 ARG CD 1 1 31 18785 1 1 11 ARG CG C -6.450 1.082 -8.136 1.00 . A A . 11 ARG CG 1 1 31 18786 1 1 11 ARG CZ C -5.461 1.725 -11.101 1.00 . A A . 11 ARG CZ 1 1 31 18787 1 1 11 ARG H H -5.411 2.647 -4.613 1.00 . A A . 11 ARG H 1 1 31 18788 1 1 11 ARG HA H -4.185 1.812 -6.994 1.00 . A A . 11 ARG HA 1 1 31 18789 1 1 11 ARG HB2 H -6.528 1.252 -6.022 1.00 . A A . 11 ARG HB2 1 1 31 18790 1 1 11 ARG HB3 H -7.051 2.690 -6.888 1.00 . A A . 11 ARG HB3 1 1 31 18791 1 1 11 ARG HD2 H -7.753 1.256 -9.810 1.00 . A A . 11 ARG HD2 1 1 31 18792 1 1 11 ARG HD3 H -7.643 2.709 -8.818 1.00 . A A . 11 ARG HD3 1 1 31 18793 1 1 11 ARG HE H -5.864 3.393 -10.083 1.00 . A A . 11 ARG HE 1 1 31 18794 1 1 11 ARG HG2 H -5.468 0.761 -8.451 1.00 . A A . 11 ARG HG2 1 1 31 18795 1 1 11 ARG HG3 H -7.066 0.218 -7.936 1.00 . A A . 11 ARG HG3 1 1 31 18796 1 1 11 ARG HH11 H -6.406 -0.007 -10.654 1.00 . A A . 11 ARG HH11 1 1 31 18797 1 1 11 ARG HH12 H -5.260 -0.100 -11.949 1.00 . A A . 11 ARG HH12 1 1 31 18798 1 1 11 ARG HH21 H -4.357 3.273 -11.786 1.00 . A A . 11 ARG HH21 1 1 31 18799 1 1 11 ARG HH22 H -4.096 1.762 -12.592 1.00 . A A . 11 ARG HH22 1 1 31 18800 1 1 11 ARG N N -4.694 2.806 -5.261 1.00 . A A . 11 ARG N 1 1 31 18801 1 1 11 ARG NE N -6.083 2.441 -10.168 1.00 . A A . 11 ARG NE 1 1 31 18802 1 1 11 ARG NH1 N -5.731 0.433 -11.246 1.00 . A A . 11 ARG NH1 1 1 31 18803 1 1 11 ARG NH2 N -4.565 2.301 -11.891 1.00 . A A . 11 ARG NH2 1 1 31 18804 1 1 11 ARG O O -4.349 3.737 -8.656 1.00 . A A . 11 ARG O 1 1 31 18805 1 1 12 GLN C C -6.022 7.213 -6.869 1.00 . A A . 12 GLN C 1 1 31 18806 1 1 12 GLN CA C -5.166 6.196 -7.614 1.00 . A A . 12 GLN CA 1 1 31 18807 1 1 12 GLN CB C -5.648 6.074 -9.064 1.00 . A A . 12 GLN CB 1 1 31 18808 1 1 12 GLN CD C -4.790 7.000 -11.253 1.00 . A A . 12 GLN CD 1 1 31 18809 1 1 12 GLN CG C -4.519 6.075 -10.082 1.00 . A A . 12 GLN CG 1 1 31 18810 1 1 12 GLN H H -5.571 4.862 -6.023 1.00 . A A . 12 GLN H 1 1 31 18811 1 1 12 GLN HA H -4.140 6.533 -7.609 1.00 . A A . 12 GLN HA 1 1 31 18812 1 1 12 GLN HB2 H -6.199 5.151 -9.171 1.00 . A A . 12 GLN HB2 1 1 31 18813 1 1 12 GLN HB3 H -6.305 6.902 -9.286 1.00 . A A . 12 GLN HB3 1 1 31 18814 1 1 12 GLN HE21 H -2.974 7.791 -11.079 1.00 . A A . 12 GLN HE21 1 1 31 18815 1 1 12 GLN HE22 H -3.954 8.434 -12.348 1.00 . A A . 12 GLN HE22 1 1 31 18816 1 1 12 GLN HG2 H -3.611 6.395 -9.593 1.00 . A A . 12 GLN HG2 1 1 31 18817 1 1 12 GLN HG3 H -4.390 5.071 -10.458 1.00 . A A . 12 GLN HG3 1 1 31 18818 1 1 12 GLN N N -5.219 4.903 -6.936 1.00 . A A . 12 GLN N 1 1 31 18819 1 1 12 GLN NE2 N -3.807 7.825 -11.594 1.00 . A A . 12 GLN NE2 1 1 31 18820 1 1 12 GLN O O -5.736 8.410 -6.875 1.00 . A A . 12 GLN O 1 1 31 18821 1 1 12 GLN OE1 O -5.870 6.974 -11.843 1.00 . A A . 12 GLN OE1 1 1 31 18822 1 1 13 CYS C C -8.696 6.782 -4.379 1.00 . A A . 13 CYS C 1 1 31 18823 1 1 13 CYS CA C -7.982 7.576 -5.469 1.00 . A A . 13 CYS CA 1 1 31 18824 1 1 13 CYS CB C -9.007 8.220 -6.405 1.00 . A A . 13 CYS CB 1 1 31 18825 1 1 13 CYS H H -7.248 5.755 -6.259 1.00 . A A . 13 CYS H 1 1 31 18826 1 1 13 CYS HA H -7.393 8.353 -5.005 1.00 . A A . 13 CYS HA 1 1 31 18827 1 1 13 CYS HB2 H -8.658 8.135 -7.423 1.00 . A A . 13 CYS HB2 1 1 31 18828 1 1 13 CYS HB3 H -9.949 7.700 -6.308 1.00 . A A . 13 CYS HB3 1 1 31 18829 1 1 13 CYS N N -7.076 6.721 -6.225 1.00 . A A . 13 CYS N 1 1 31 18830 1 1 13 CYS O O -9.799 7.136 -3.962 1.00 . A A . 13 CYS O 1 1 31 18831 1 1 13 CYS SG S -9.311 9.986 -6.072 1.00 . A A . 13 CYS SG 1 1 31 18832 1 1 14 LYS C C -7.642 3.802 -2.426 1.00 . A A . 14 LYS C 1 1 31 18833 1 1 14 LYS CA C -8.638 4.863 -2.882 1.00 . A A . 14 LYS CA 1 1 31 18834 1 1 14 LYS CB C -9.917 4.194 -3.389 1.00 . A A . 14 LYS CB 1 1 31 18835 1 1 14 LYS CD C -12.281 3.588 -2.790 1.00 . A A . 14 LYS CD 1 1 31 18836 1 1 14 LYS CE C -13.115 4.838 -2.563 1.00 . A A . 14 LYS CE 1 1 31 18837 1 1 14 LYS CG C -10.861 3.765 -2.277 1.00 . A A . 14 LYS CG 1 1 31 18838 1 1 14 LYS H H -7.185 5.472 -4.293 1.00 . A A . 14 LYS H 1 1 31 18839 1 1 14 LYS HA H -8.882 5.495 -2.041 1.00 . A A . 14 LYS HA 1 1 31 18840 1 1 14 LYS HB2 H -10.442 4.886 -4.031 1.00 . A A . 14 LYS HB2 1 1 31 18841 1 1 14 LYS HB3 H -9.649 3.318 -3.962 1.00 . A A . 14 LYS HB3 1 1 31 18842 1 1 14 LYS HD2 H -12.248 3.378 -3.849 1.00 . A A . 14 LYS HD2 1 1 31 18843 1 1 14 LYS HD3 H -12.740 2.760 -2.271 1.00 . A A . 14 LYS HD3 1 1 31 18844 1 1 14 LYS HE2 H -14.100 4.679 -2.976 1.00 . A A . 14 LYS HE2 1 1 31 18845 1 1 14 LYS HE3 H -13.196 5.013 -1.500 1.00 . A A . 14 LYS HE3 1 1 31 18846 1 1 14 LYS HG2 H -10.518 2.827 -1.868 1.00 . A A . 14 LYS HG2 1 1 31 18847 1 1 14 LYS HG3 H -10.858 4.520 -1.505 1.00 . A A . 14 LYS HG3 1 1 31 18848 1 1 14 LYS HZ1 H -12.224 5.813 -4.181 1.00 . A A . 14 LYS HZ1 1 1 31 18849 1 1 14 LYS HZ2 H -13.195 6.817 -3.227 1.00 . A A . 14 LYS HZ2 1 1 31 18850 1 1 14 LYS HZ3 H -11.669 6.341 -2.673 1.00 . A A . 14 LYS HZ3 1 1 31 18851 1 1 14 LYS N N -8.061 5.705 -3.922 1.00 . A A . 14 LYS N 1 1 31 18852 1 1 14 LYS NZ N -12.508 6.036 -3.206 1.00 . A A . 14 LYS NZ 1 1 31 18853 1 1 14 LYS O O -6.593 3.614 -3.044 1.00 . A A . 14 LYS O 1 1 31 18854 1 1 15 LEU C C -6.897 0.954 -1.819 1.00 . A A . 15 LEU C 1 1 31 18855 1 1 15 LEU CA C -7.113 2.069 -0.801 1.00 . A A . 15 LEU CA 1 1 31 18856 1 1 15 LEU CB C -7.719 1.490 0.479 1.00 . A A . 15 LEU CB 1 1 31 18857 1 1 15 LEU CD1 C -8.406 1.798 2.869 1.00 . A A . 15 LEU CD1 1 1 31 18858 1 1 15 LEU CD2 C -6.169 2.608 2.099 1.00 . A A . 15 LEU CD2 1 1 31 18859 1 1 15 LEU CG C -7.624 2.394 1.709 1.00 . A A . 15 LEU CG 1 1 31 18860 1 1 15 LEU H H -8.825 3.308 -0.894 1.00 . A A . 15 LEU H 1 1 31 18861 1 1 15 LEU HA H -6.159 2.516 -0.566 1.00 . A A . 15 LEU HA 1 1 31 18862 1 1 15 LEU HB2 H -8.762 1.278 0.294 1.00 . A A . 15 LEU HB2 1 1 31 18863 1 1 15 LEU HB3 H -7.215 0.562 0.703 1.00 . A A . 15 LEU HB3 1 1 31 18864 1 1 15 LEU HD11 H -8.454 0.725 2.758 1.00 . A A . 15 LEU HD11 1 1 31 18865 1 1 15 LEU HD12 H -7.913 2.042 3.799 1.00 . A A . 15 LEU HD12 1 1 31 18866 1 1 15 LEU HD13 H -9.407 2.205 2.875 1.00 . A A . 15 LEU HD13 1 1 31 18867 1 1 15 LEU HD21 H -5.713 1.656 2.326 1.00 . A A . 15 LEU HD21 1 1 31 18868 1 1 15 LEU HD22 H -5.642 3.074 1.280 1.00 . A A . 15 LEU HD22 1 1 31 18869 1 1 15 LEU HD23 H -6.120 3.247 2.968 1.00 . A A . 15 LEU HD23 1 1 31 18870 1 1 15 LEU HG H -8.054 3.356 1.475 1.00 . A A . 15 LEU HG 1 1 31 18871 1 1 15 LEU N N -7.976 3.111 -1.342 1.00 . A A . 15 LEU N 1 1 31 18872 1 1 15 LEU O O -7.833 0.528 -2.495 1.00 . A A . 15 LEU O 1 1 31 18873 1 1 16 LYS C C -5.885 -1.920 -2.362 1.00 . A A . 16 LYS C 1 1 31 18874 1 1 16 LYS CA C -5.322 -0.587 -2.851 1.00 . A A . 16 LYS CA 1 1 31 18875 1 1 16 LYS CB C -3.804 -0.687 -3.019 1.00 . A A . 16 LYS CB 1 1 31 18876 1 1 16 LYS CD C -1.795 0.062 -4.329 1.00 . A A . 16 LYS CD 1 1 31 18877 1 1 16 LYS CE C -1.290 0.589 -5.663 1.00 . A A . 16 LYS CE 1 1 31 18878 1 1 16 LYS CG C -3.300 -0.151 -4.349 1.00 . A A . 16 LYS CG 1 1 31 18879 1 1 16 LYS H H -4.955 0.861 -1.351 1.00 . A A . 16 LYS H 1 1 31 18880 1 1 16 LYS HA H -5.767 -0.348 -3.806 1.00 . A A . 16 LYS HA 1 1 31 18881 1 1 16 LYS HB2 H -3.329 -0.127 -2.227 1.00 . A A . 16 LYS HB2 1 1 31 18882 1 1 16 LYS HB3 H -3.510 -1.724 -2.939 1.00 . A A . 16 LYS HB3 1 1 31 18883 1 1 16 LYS HD2 H -1.552 0.776 -3.557 1.00 . A A . 16 LYS HD2 1 1 31 18884 1 1 16 LYS HD3 H -1.311 -0.880 -4.118 1.00 . A A . 16 LYS HD3 1 1 31 18885 1 1 16 LYS HE2 H -2.069 1.180 -6.120 1.00 . A A . 16 LYS HE2 1 1 31 18886 1 1 16 LYS HE3 H -0.425 1.210 -5.485 1.00 . A A . 16 LYS HE3 1 1 31 18887 1 1 16 LYS HG2 H -3.543 -0.858 -5.127 1.00 . A A . 16 LYS HG2 1 1 31 18888 1 1 16 LYS HG3 H -3.785 0.792 -4.552 1.00 . A A . 16 LYS HG3 1 1 31 18889 1 1 16 LYS HZ1 H -0.232 -1.151 -6.129 1.00 . A A . 16 LYS HZ1 1 1 31 18890 1 1 16 LYS HZ2 H -1.757 -1.062 -6.856 1.00 . A A . 16 LYS HZ2 1 1 31 18891 1 1 16 LYS HZ3 H -0.481 -0.125 -7.451 1.00 . A A . 16 LYS HZ3 1 1 31 18892 1 1 16 LYS N N -5.659 0.483 -1.919 1.00 . A A . 16 LYS N 1 1 31 18893 1 1 16 LYS NZ N -0.914 -0.514 -6.590 1.00 . A A . 16 LYS NZ 1 1 31 18894 1 1 16 LYS O O -6.112 -2.105 -1.167 1.00 . A A . 16 LYS O 1 1 31 18895 1 1 17 PRO C C -5.762 -4.932 -1.942 1.00 . A A . 17 PRO C 1 1 31 18896 1 1 17 PRO CA C -6.653 -4.191 -2.934 1.00 . A A . 17 PRO CA 1 1 31 18897 1 1 17 PRO CB C -6.698 -4.938 -4.274 1.00 . A A . 17 PRO CB 1 1 31 18898 1 1 17 PRO CD C -5.873 -2.741 -4.727 1.00 . A A . 17 PRO CD 1 1 31 18899 1 1 17 PRO CG C -5.802 -4.169 -5.185 1.00 . A A . 17 PRO CG 1 1 31 18900 1 1 17 PRO HA H -7.651 -4.115 -2.528 1.00 . A A . 17 PRO HA 1 1 31 18901 1 1 17 PRO HB2 H -6.344 -5.949 -4.136 1.00 . A A . 17 PRO HB2 1 1 31 18902 1 1 17 PRO HB3 H -7.713 -4.955 -4.644 1.00 . A A . 17 PRO HB3 1 1 31 18903 1 1 17 PRO HD2 H -4.938 -2.236 -4.918 1.00 . A A . 17 PRO HD2 1 1 31 18904 1 1 17 PRO HD3 H -6.690 -2.228 -5.211 1.00 . A A . 17 PRO HD3 1 1 31 18905 1 1 17 PRO HG2 H -4.791 -4.539 -5.104 1.00 . A A . 17 PRO HG2 1 1 31 18906 1 1 17 PRO HG3 H -6.153 -4.253 -6.203 1.00 . A A . 17 PRO HG3 1 1 31 18907 1 1 17 PRO N N -6.116 -2.872 -3.282 1.00 . A A . 17 PRO N 1 1 31 18908 1 1 17 PRO O O -4.555 -5.058 -2.150 1.00 . A A . 17 PRO O 1 1 31 18909 1 1 18 ALA C C -4.789 -7.267 -0.443 1.00 . A A . 18 ALA C 1 1 31 18910 1 1 18 ALA CA C -5.629 -6.148 0.166 1.00 . A A . 18 ALA CA 1 1 31 18911 1 1 18 ALA CB C -6.590 -6.713 1.202 1.00 . A A . 18 ALA CB 1 1 31 18912 1 1 18 ALA H H -7.330 -5.285 -0.752 1.00 . A A . 18 ALA H 1 1 31 18913 1 1 18 ALA HA H -4.972 -5.449 0.664 1.00 . A A . 18 ALA HA 1 1 31 18914 1 1 18 ALA HB1 H -7.477 -6.098 1.243 1.00 . A A . 18 ALA HB1 1 1 31 18915 1 1 18 ALA HB2 H -6.863 -7.721 0.927 1.00 . A A . 18 ALA HB2 1 1 31 18916 1 1 18 ALA HB3 H -6.112 -6.721 2.170 1.00 . A A . 18 ALA HB3 1 1 31 18917 1 1 18 ALA N N -6.366 -5.419 -0.862 1.00 . A A . 18 ALA N 1 1 31 18918 1 1 18 ALA O O -5.322 -8.206 -1.034 1.00 . A A . 18 ALA O 1 1 31 18919 1 1 19 GLY C C -1.734 -7.632 -1.982 1.00 . A A . 19 GLY C 1 1 31 18920 1 1 19 GLY CA C -2.578 -8.162 -0.839 1.00 . A A . 19 GLY CA 1 1 31 18921 1 1 19 GLY H H -3.105 -6.385 0.183 1.00 . A A . 19 GLY H 1 1 31 18922 1 1 19 GLY HA2 H -3.164 -8.996 -1.196 1.00 . A A . 19 GLY HA2 1 1 31 18923 1 1 19 GLY HA3 H -1.923 -8.507 -0.052 1.00 . A A . 19 GLY HA3 1 1 31 18924 1 1 19 GLY N N -3.473 -7.157 -0.297 1.00 . A A . 19 GLY N 1 1 31 18925 1 1 19 GLY O O -1.239 -8.402 -2.806 1.00 . A A . 19 GLY O 1 1 31 18926 1 1 20 THR C C 0.490 -5.060 -2.510 1.00 . A A . 20 THR C 1 1 31 18927 1 1 20 THR CA C -0.780 -5.681 -3.084 1.00 . A A . 20 THR CA 1 1 31 18928 1 1 20 THR CB C -1.608 -4.611 -3.797 1.00 . A A . 20 THR CB 1 1 31 18929 1 1 20 THR CG2 C -0.863 -3.926 -4.922 1.00 . A A . 20 THR CG2 1 1 31 18930 1 1 20 THR H H -1.988 -5.752 -1.349 1.00 . A A . 20 THR H 1 1 31 18931 1 1 20 THR HA H -0.503 -6.444 -3.796 1.00 . A A . 20 THR HA 1 1 31 18932 1 1 20 THR HB H -1.893 -3.854 -3.080 1.00 . A A . 20 THR HB 1 1 31 18933 1 1 20 THR HG1 H -2.555 -5.816 -5.017 1.00 . A A . 20 THR HG1 1 1 31 18934 1 1 20 THR HG21 H 0.172 -3.796 -4.642 1.00 . A A . 20 THR HG21 1 1 31 18935 1 1 20 THR HG22 H -0.922 -4.532 -5.814 1.00 . A A . 20 THR HG22 1 1 31 18936 1 1 20 THR HG23 H -1.308 -2.960 -5.113 1.00 . A A . 20 THR HG23 1 1 31 18937 1 1 20 THR N N -1.569 -6.314 -2.034 1.00 . A A . 20 THR N 1 1 31 18938 1 1 20 THR O O 0.430 -4.130 -1.706 1.00 . A A . 20 THR O 1 1 31 18939 1 1 20 THR OG1 O -2.788 -5.173 -4.343 1.00 . A A . 20 THR OG1 1 1 31 18940 1 1 21 THR C C 3.092 -3.603 -2.800 1.00 . A A . 21 THR C 1 1 31 18941 1 1 21 THR CA C 2.923 -5.079 -2.455 1.00 . A A . 21 THR CA 1 1 31 18942 1 1 21 THR CB C 4.066 -5.892 -3.065 1.00 . A A . 21 THR CB 1 1 31 18943 1 1 21 THR CG2 C 3.931 -6.084 -4.560 1.00 . A A . 21 THR CG2 1 1 31 18944 1 1 21 THR H H 1.622 -6.322 -3.570 1.00 . A A . 21 THR H 1 1 31 18945 1 1 21 THR HA H 2.948 -5.191 -1.382 1.00 . A A . 21 THR HA 1 1 31 18946 1 1 21 THR HB H 4.084 -6.870 -2.606 1.00 . A A . 21 THR HB 1 1 31 18947 1 1 21 THR HG1 H 5.373 -4.458 -3.341 1.00 . A A . 21 THR HG1 1 1 31 18948 1 1 21 THR HG21 H 2.982 -5.688 -4.890 1.00 . A A . 21 THR HG21 1 1 31 18949 1 1 21 THR HG22 H 4.733 -5.565 -5.064 1.00 . A A . 21 THR HG22 1 1 31 18950 1 1 21 THR HG23 H 3.982 -7.137 -4.794 1.00 . A A . 21 THR HG23 1 1 31 18951 1 1 21 THR N N 1.639 -5.582 -2.928 1.00 . A A . 21 THR N 1 1 31 18952 1 1 21 THR O O 2.626 -3.141 -3.842 1.00 . A A . 21 THR O 1 1 31 18953 1 1 21 THR OG1 O 5.313 -5.264 -2.823 1.00 . A A . 21 THR OG1 1 1 31 18954 1 1 22 CYS C C 5.229 -1.217 -2.997 1.00 . A A . 22 CYS C 1 1 31 18955 1 1 22 CYS CA C 3.995 -1.444 -2.130 1.00 . A A . 22 CYS CA 1 1 31 18956 1 1 22 CYS CB C 4.162 -0.729 -0.788 1.00 . A A . 22 CYS CB 1 1 31 18957 1 1 22 CYS H H 4.111 -3.294 -1.108 1.00 . A A . 22 CYS H 1 1 31 18958 1 1 22 CYS HA H 3.133 -1.040 -2.639 1.00 . A A . 22 CYS HA 1 1 31 18959 1 1 22 CYS HB2 H 4.980 -1.180 -0.248 1.00 . A A . 22 CYS HB2 1 1 31 18960 1 1 22 CYS HB3 H 4.388 0.312 -0.970 1.00 . A A . 22 CYS HB3 1 1 31 18961 1 1 22 CYS N N 3.763 -2.868 -1.919 1.00 . A A . 22 CYS N 1 1 31 18962 1 1 22 CYS O O 5.128 -0.739 -4.127 1.00 . A A . 22 CYS O 1 1 31 18963 1 1 22 CYS SG S 2.688 -0.799 0.281 1.00 . A A . 22 CYS SG 1 1 31 18964 1 1 23 TRP C C 8.188 -2.747 -3.653 1.00 . A A . 23 TRP C 1 1 31 18965 1 1 23 TRP CA C 7.650 -1.399 -3.184 1.00 . A A . 23 TRP CA 1 1 31 18966 1 1 23 TRP CB C 8.685 -0.702 -2.299 1.00 . A A . 23 TRP CB 1 1 31 18967 1 1 23 TRP CD1 C 10.167 0.204 -4.183 1.00 . A A . 23 TRP CD1 1 1 31 18968 1 1 23 TRP CD2 C 11.290 -0.835 -2.548 1.00 . A A . 23 TRP CD2 1 1 31 18969 1 1 23 TRP CE2 C 12.213 -0.389 -3.512 1.00 . A A . 23 TRP CE2 1 1 31 18970 1 1 23 TRP CE3 C 11.766 -1.517 -1.424 1.00 . A A . 23 TRP CE3 1 1 31 18971 1 1 23 TRP CG C 9.986 -0.446 -2.996 1.00 . A A . 23 TRP CG 1 1 31 18972 1 1 23 TRP CH2 C 14.021 -1.273 -2.277 1.00 . A A . 23 TRP CH2 1 1 31 18973 1 1 23 TRP CZ2 C 13.583 -0.603 -3.387 1.00 . A A . 23 TRP CZ2 1 1 31 18974 1 1 23 TRP CZ3 C 13.127 -1.729 -1.301 1.00 . A A . 23 TRP CZ3 1 1 31 18975 1 1 23 TRP H H 6.411 -1.941 -1.556 1.00 . A A . 23 TRP H 1 1 31 18976 1 1 23 TRP HA H 7.455 -0.782 -4.049 1.00 . A A . 23 TRP HA 1 1 31 18977 1 1 23 TRP HB2 H 8.289 0.248 -1.974 1.00 . A A . 23 TRP HB2 1 1 31 18978 1 1 23 TRP HB3 H 8.883 -1.319 -1.435 1.00 . A A . 23 TRP HB3 1 1 31 18979 1 1 23 TRP HD1 H 9.367 0.621 -4.776 1.00 . A A . 23 TRP HD1 1 1 31 18980 1 1 23 TRP HE1 H 11.886 0.655 -5.303 1.00 . A A . 23 TRP HE1 1 1 31 18981 1 1 23 TRP HE3 H 11.092 -1.877 -0.661 1.00 . A A . 23 TRP HE3 1 1 31 18982 1 1 23 TRP HH2 H 15.076 -1.461 -2.140 1.00 . A A . 23 TRP HH2 1 1 31 18983 1 1 23 TRP HZ2 H 14.286 -0.257 -4.130 1.00 . A A . 23 TRP HZ2 1 1 31 18984 1 1 23 TRP HZ3 H 13.513 -2.255 -0.440 1.00 . A A . 23 TRP HZ3 1 1 31 18985 1 1 23 TRP N N 6.395 -1.564 -2.460 1.00 . A A . 23 TRP N 1 1 31 18986 1 1 23 TRP NE1 N 11.504 0.243 -4.500 1.00 . A A . 23 TRP NE1 1 1 31 18987 1 1 23 TRP O O 8.011 -3.764 -2.983 1.00 . A A . 23 TRP O 1 1 31 18988 1 1 24 ARG C C 10.936 -3.924 -5.344 1.00 . A A . 24 ARG C 1 1 31 18989 1 1 24 ARG CA C 9.411 -3.969 -5.366 1.00 . A A . 24 ARG CA 1 1 31 18990 1 1 24 ARG CB C 8.916 -4.177 -6.799 1.00 . A A . 24 ARG CB 1 1 31 18991 1 1 24 ARG CD C 7.077 -4.987 -8.307 1.00 . A A . 24 ARG CD 1 1 31 18992 1 1 24 ARG CG C 7.617 -4.960 -6.886 1.00 . A A . 24 ARG CG 1 1 31 18993 1 1 24 ARG CZ C 4.865 -5.049 -9.389 1.00 . A A . 24 ARG CZ 1 1 31 18994 1 1 24 ARG H H 8.955 -1.903 -5.295 1.00 . A A . 24 ARG H 1 1 31 18995 1 1 24 ARG HA H 9.079 -4.796 -4.757 1.00 . A A . 24 ARG HA 1 1 31 18996 1 1 24 ARG HB2 H 8.761 -3.211 -7.257 1.00 . A A . 24 ARG HB2 1 1 31 18997 1 1 24 ARG HB3 H 9.672 -4.711 -7.355 1.00 . A A . 24 ARG HB3 1 1 31 18998 1 1 24 ARG HD2 H 7.236 -4.019 -8.757 1.00 . A A . 24 ARG HD2 1 1 31 18999 1 1 24 ARG HD3 H 7.615 -5.737 -8.868 1.00 . A A . 24 ARG HD3 1 1 31 19000 1 1 24 ARG HE H 5.257 -5.716 -7.550 1.00 . A A . 24 ARG HE 1 1 31 19001 1 1 24 ARG HG2 H 7.797 -5.974 -6.561 1.00 . A A . 24 ARG HG2 1 1 31 19002 1 1 24 ARG HG3 H 6.885 -4.498 -6.240 1.00 . A A . 24 ARG HG3 1 1 31 19003 1 1 24 ARG HH11 H 6.332 -4.245 -10.526 1.00 . A A . 24 ARG HH11 1 1 31 19004 1 1 24 ARG HH12 H 4.766 -4.300 -11.265 1.00 . A A . 24 ARG HH12 1 1 31 19005 1 1 24 ARG HH21 H 3.198 -5.790 -8.519 1.00 . A A . 24 ARG HH21 1 1 31 19006 1 1 24 ARG HH22 H 2.987 -5.176 -10.126 1.00 . A A . 24 ARG HH22 1 1 31 19007 1 1 24 ARG N N 8.847 -2.746 -4.808 1.00 . A A . 24 ARG N 1 1 31 19008 1 1 24 ARG NE N 5.650 -5.299 -8.344 1.00 . A A . 24 ARG NE 1 1 31 19009 1 1 24 ARG NH1 N 5.362 -4.485 -10.483 1.00 . A A . 24 ARG NH1 1 1 31 19010 1 1 24 ARG NH2 N 3.578 -5.364 -9.341 1.00 . A A . 24 ARG NH2 1 1 31 19011 1 1 24 ARG O O 11.539 -2.873 -5.561 1.00 . A A . 24 ARG O 1 1 31 19012 1 1 25 THR C C 13.453 -6.602 -4.790 1.00 . A A . 25 THR C 1 1 31 19013 1 1 25 THR CA C 13.007 -5.163 -5.031 1.00 . A A . 25 THR CA 1 1 31 19014 1 1 25 THR CB C 13.559 -4.255 -3.931 1.00 . A A . 25 THR CB 1 1 31 19015 1 1 25 THR CG2 C 12.842 -4.415 -2.607 1.00 . A A . 25 THR CG2 1 1 31 19016 1 1 25 THR H H 11.017 -5.876 -4.917 1.00 . A A . 25 THR H 1 1 31 19017 1 1 25 THR HA H 13.393 -4.835 -5.984 1.00 . A A . 25 THR HA 1 1 31 19018 1 1 25 THR HB H 13.453 -3.225 -4.242 1.00 . A A . 25 THR HB 1 1 31 19019 1 1 25 THR HG1 H 15.036 -5.374 -3.297 1.00 . A A . 25 THR HG1 1 1 31 19020 1 1 25 THR HG21 H 12.482 -5.429 -2.513 1.00 . A A . 25 THR HG21 1 1 31 19021 1 1 25 THR HG22 H 13.525 -4.198 -1.800 1.00 . A A . 25 THR HG22 1 1 31 19022 1 1 25 THR HG23 H 12.007 -3.731 -2.565 1.00 . A A . 25 THR HG23 1 1 31 19023 1 1 25 THR N N 11.553 -5.071 -5.081 1.00 . A A . 25 THR N 1 1 31 19024 1 1 25 THR O O 12.664 -7.443 -4.359 1.00 . A A . 25 THR O 1 1 31 19025 1 1 25 THR OG1 O 14.934 -4.513 -3.709 1.00 . A A . 25 THR OG1 1 1 31 19026 1 1 26 SER C C 15.868 -8.368 -3.486 1.00 . A A . 26 SER C 1 1 31 19027 1 1 26 SER CA C 15.273 -8.215 -4.884 1.00 . A A . 26 SER CA 1 1 31 19028 1 1 26 SER CB C 16.341 -8.501 -5.942 1.00 . A A . 26 SER CB 1 1 31 19029 1 1 26 SER H H 15.302 -6.165 -5.411 1.00 . A A . 26 SER H 1 1 31 19030 1 1 26 SER HA H 14.467 -8.924 -4.998 1.00 . A A . 26 SER HA 1 1 31 19031 1 1 26 SER HB2 H 16.060 -8.028 -6.871 1.00 . A A . 26 SER HB2 1 1 31 19032 1 1 26 SER HB3 H 17.289 -8.106 -5.609 1.00 . A A . 26 SER HB3 1 1 31 19033 1 1 26 SER HG H 16.173 -10.109 -7.048 1.00 . A A . 26 SER HG 1 1 31 19034 1 1 26 SER N N 14.722 -6.878 -5.070 1.00 . A A . 26 SER N 1 1 31 19035 1 1 26 SER O O 17.012 -8.795 -3.329 1.00 . A A . 26 SER O 1 1 31 19036 1 1 26 SER OG O 16.479 -9.894 -6.164 1.00 . A A . 26 SER OG 1 1 31 19037 1 1 27 VAL C C 14.354 -8.332 -0.145 1.00 . A A . 27 VAL C 1 1 31 19038 1 1 27 VAL CA C 15.530 -8.114 -1.090 1.00 . A A . 27 VAL CA 1 1 31 19039 1 1 27 VAL CB C 16.296 -6.851 -0.655 1.00 . A A . 27 VAL CB 1 1 31 19040 1 1 27 VAL CG1 C 16.925 -7.052 0.715 1.00 . A A . 27 VAL CG1 1 1 31 19041 1 1 27 VAL CG2 C 17.352 -6.486 -1.687 1.00 . A A . 27 VAL CG2 1 1 31 19042 1 1 27 VAL H H 14.180 -7.683 -2.662 1.00 . A A . 27 VAL H 1 1 31 19043 1 1 27 VAL HA H 16.196 -8.958 -1.015 1.00 . A A . 27 VAL HA 1 1 31 19044 1 1 27 VAL HB H 15.593 -6.034 -0.586 1.00 . A A . 27 VAL HB 1 1 31 19045 1 1 27 VAL HG11 H 16.347 -7.772 1.275 1.00 . A A . 27 VAL HG11 1 1 31 19046 1 1 27 VAL HG12 H 17.935 -7.414 0.598 1.00 . A A . 27 VAL HG12 1 1 31 19047 1 1 27 VAL HG13 H 16.939 -6.111 1.246 1.00 . A A . 27 VAL HG13 1 1 31 19048 1 1 27 VAL HG21 H 17.999 -7.334 -1.855 1.00 . A A . 27 VAL HG21 1 1 31 19049 1 1 27 VAL HG22 H 16.871 -6.210 -2.613 1.00 . A A . 27 VAL HG22 1 1 31 19050 1 1 27 VAL HG23 H 17.937 -5.653 -1.324 1.00 . A A . 27 VAL HG23 1 1 31 19051 1 1 27 VAL N N 15.082 -8.016 -2.474 1.00 . A A . 27 VAL N 1 1 31 19052 1 1 27 VAL O O 14.406 -9.183 0.743 1.00 . A A . 27 VAL O 1 1 31 19053 1 1 28 SER C C 10.877 -7.135 -0.250 1.00 . A A . 28 SER C 1 1 31 19054 1 1 28 SER CA C 12.104 -7.659 0.489 1.00 . A A . 28 SER CA 1 1 31 19055 1 1 28 SER CB C 12.298 -6.884 1.793 1.00 . A A . 28 SER CB 1 1 31 19056 1 1 28 SER H H 13.320 -6.898 -1.067 1.00 . A A . 28 SER H 1 1 31 19057 1 1 28 SER HA H 11.951 -8.703 0.721 1.00 . A A . 28 SER HA 1 1 31 19058 1 1 28 SER HB2 H 12.844 -5.974 1.591 1.00 . A A . 28 SER HB2 1 1 31 19059 1 1 28 SER HB3 H 11.333 -6.638 2.211 1.00 . A A . 28 SER HB3 1 1 31 19060 1 1 28 SER HG H 13.900 -7.273 2.853 1.00 . A A . 28 SER HG 1 1 31 19061 1 1 28 SER N N 13.297 -7.556 -0.343 1.00 . A A . 28 SER N 1 1 31 19062 1 1 28 SER O O 10.971 -6.698 -1.397 1.00 . A A . 28 SER O 1 1 31 19063 1 1 28 SER OG O 13.024 -7.649 2.740 1.00 . A A . 28 SER OG 1 1 31 19064 1 1 29 SER C C 7.529 -6.193 0.896 1.00 . A A . 29 SER C 1 1 31 19065 1 1 29 SER CA C 8.482 -6.710 -0.178 1.00 . A A . 29 SER CA 1 1 31 19066 1 1 29 SER CB C 7.813 -7.834 -0.971 1.00 . A A . 29 SER CB 1 1 31 19067 1 1 29 SER H H 9.717 -7.539 1.328 1.00 . A A . 29 SER H 1 1 31 19068 1 1 29 SER HA H 8.720 -5.899 -0.850 1.00 . A A . 29 SER HA 1 1 31 19069 1 1 29 SER HB2 H 8.544 -8.301 -1.615 1.00 . A A . 29 SER HB2 1 1 31 19070 1 1 29 SER HB3 H 7.416 -8.568 -0.286 1.00 . A A . 29 SER HB3 1 1 31 19071 1 1 29 SER HG H 6.492 -8.004 -2.407 1.00 . A A . 29 SER HG 1 1 31 19072 1 1 29 SER N N 9.728 -7.181 0.416 1.00 . A A . 29 SER N 1 1 31 19073 1 1 29 SER O O 7.503 -6.705 2.015 1.00 . A A . 29 SER O 1 1 31 19074 1 1 29 SER OG O 6.755 -7.335 -1.770 1.00 . A A . 29 SER OG 1 1 31 19075 1 1 30 HIS C C 4.361 -4.933 1.082 1.00 . A A . 30 HIS C 1 1 31 19076 1 1 30 HIS CA C 5.793 -4.591 1.481 1.00 . A A . 30 HIS CA 1 1 31 19077 1 1 30 HIS CB C 5.970 -3.072 1.538 1.00 . A A . 30 HIS CB 1 1 31 19078 1 1 30 HIS CD2 C 8.489 -2.558 1.879 1.00 . A A . 30 HIS CD2 1 1 31 19079 1 1 30 HIS CE1 C 8.403 -1.910 3.972 1.00 . A A . 30 HIS CE1 1 1 31 19080 1 1 30 HIS CG C 7.198 -2.640 2.277 1.00 . A A . 30 HIS CG 1 1 31 19081 1 1 30 HIS H H 6.814 -4.812 -0.360 1.00 . A A . 30 HIS H 1 1 31 19082 1 1 30 HIS HA H 5.990 -5.004 2.459 1.00 . A A . 30 HIS HA 1 1 31 19083 1 1 30 HIS HB2 H 6.036 -2.687 0.531 1.00 . A A . 30 HIS HB2 1 1 31 19084 1 1 30 HIS HB3 H 5.113 -2.636 2.030 1.00 . A A . 30 HIS HB3 1 1 31 19085 1 1 30 HIS HD1 H 6.384 -2.175 4.165 1.00 . A A . 30 HIS HD1 1 1 31 19086 1 1 30 HIS HD2 H 8.875 -2.805 0.900 1.00 . A A . 30 HIS HD2 1 1 31 19087 1 1 30 HIS HE1 H 8.690 -1.555 4.950 1.00 . A A . 30 HIS HE1 1 1 31 19088 1 1 30 HIS HE2 H 10.194 -2.027 2.984 1.00 . A A . 30 HIS HE2 1 1 31 19089 1 1 30 HIS N N 6.748 -5.177 0.547 1.00 . A A . 30 HIS N 1 1 31 19090 1 1 30 HIS ND1 N 7.178 -2.228 3.593 1.00 . A A . 30 HIS ND1 1 1 31 19091 1 1 30 HIS NE2 N 9.217 -2.102 2.950 1.00 . A A . 30 HIS NE2 1 1 31 19092 1 1 30 HIS O O 3.671 -4.127 0.457 1.00 . A A . 30 HIS O 1 1 31 19093 1 1 31 TYR C C 1.531 -5.769 1.891 1.00 . A A . 31 TYR C 1 1 31 19094 1 1 31 TYR CA C 2.571 -6.581 1.126 1.00 . A A . 31 TYR CA 1 1 31 19095 1 1 31 TYR CB C 2.414 -8.067 1.453 1.00 . A A . 31 TYR CB 1 1 31 19096 1 1 31 TYR CD1 C 3.953 -9.836 0.517 1.00 . A A . 31 TYR CD1 1 1 31 19097 1 1 31 TYR CD2 C 2.219 -8.996 -0.887 1.00 . A A . 31 TYR CD2 1 1 31 19098 1 1 31 TYR CE1 C 4.374 -10.675 -0.497 1.00 . A A . 31 TYR CE1 1 1 31 19099 1 1 31 TYR CE2 C 2.634 -9.832 -1.906 1.00 . A A . 31 TYR CE2 1 1 31 19100 1 1 31 TYR CG C 2.871 -8.984 0.340 1.00 . A A . 31 TYR CG 1 1 31 19101 1 1 31 TYR CZ C 3.711 -10.669 -1.706 1.00 . A A . 31 TYR CZ 1 1 31 19102 1 1 31 TYR H H 4.518 -6.730 1.943 1.00 . A A . 31 TYR H 1 1 31 19103 1 1 31 TYR HA H 2.416 -6.437 0.068 1.00 . A A . 31 TYR HA 1 1 31 19104 1 1 31 TYR HB2 H 2.995 -8.299 2.333 1.00 . A A . 31 TYR HB2 1 1 31 19105 1 1 31 TYR HB3 H 1.372 -8.277 1.650 1.00 . A A . 31 TYR HB3 1 1 31 19106 1 1 31 TYR HD1 H 4.470 -9.838 1.466 1.00 . A A . 31 TYR HD1 1 1 31 19107 1 1 31 TYR HD2 H 1.376 -8.338 -1.040 1.00 . A A . 31 TYR HD2 1 1 31 19108 1 1 31 TYR HE1 H 5.218 -11.331 -0.340 1.00 . A A . 31 TYR HE1 1 1 31 19109 1 1 31 TYR HE2 H 2.115 -9.827 -2.853 1.00 . A A . 31 TYR HE2 1 1 31 19110 1 1 31 TYR HH H 3.362 -11.897 -3.144 1.00 . A A . 31 TYR HH 1 1 31 19111 1 1 31 TYR N N 3.921 -6.133 1.447 1.00 . A A . 31 TYR N 1 1 31 19112 1 1 31 TYR O O 1.431 -5.865 3.114 1.00 . A A . 31 TYR O 1 1 31 19113 1 1 31 TYR OH O 4.127 -11.503 -2.719 1.00 . A A . 31 TYR OH 1 1 31 19114 1 1 32 CYS C C -1.453 -4.996 2.232 1.00 . A A . 32 CYS C 1 1 31 19115 1 1 32 CYS CA C -0.275 -4.143 1.772 1.00 . A A . 32 CYS CA 1 1 31 19116 1 1 32 CYS CB C -0.756 -3.079 0.784 1.00 . A A . 32 CYS CB 1 1 31 19117 1 1 32 CYS H H 0.886 -4.938 0.190 1.00 . A A . 32 CYS H 1 1 31 19118 1 1 32 CYS HA H 0.157 -3.654 2.632 1.00 . A A . 32 CYS HA 1 1 31 19119 1 1 32 CYS HB2 H 0.042 -2.855 0.091 1.00 . A A . 32 CYS HB2 1 1 31 19120 1 1 32 CYS HB3 H -1.603 -3.464 0.236 1.00 . A A . 32 CYS HB3 1 1 31 19121 1 1 32 CYS N N 0.758 -4.971 1.162 1.00 . A A . 32 CYS N 1 1 31 19122 1 1 32 CYS O O -1.780 -6.007 1.610 1.00 . A A . 32 CYS O 1 1 31 19123 1 1 32 CYS SG S -1.265 -1.514 1.565 1.00 . A A . 32 CYS SG 1 1 31 19124 1 1 33 THR C C -4.548 -4.724 3.376 1.00 . A A . 33 THR C 1 1 31 19125 1 1 33 THR CA C -3.226 -5.312 3.869 1.00 . A A . 33 THR CA 1 1 31 19126 1 1 33 THR CB C -3.186 -5.290 5.398 1.00 . A A . 33 THR CB 1 1 31 19127 1 1 33 THR CG2 C -2.979 -3.905 5.971 1.00 . A A . 33 THR CG2 1 1 31 19128 1 1 33 THR H H -1.778 -3.770 3.778 1.00 . A A . 33 THR H 1 1 31 19129 1 1 33 THR HA H -3.155 -6.335 3.533 1.00 . A A . 33 THR HA 1 1 31 19130 1 1 33 THR HB H -2.370 -5.913 5.735 1.00 . A A . 33 THR HB 1 1 31 19131 1 1 33 THR HG1 H -5.108 -5.190 5.764 1.00 . A A . 33 THR HG1 1 1 31 19132 1 1 33 THR HG21 H -3.685 -3.221 5.523 1.00 . A A . 33 THR HG21 1 1 31 19133 1 1 33 THR HG22 H -3.132 -3.930 7.039 1.00 . A A . 33 THR HG22 1 1 31 19134 1 1 33 THR HG23 H -1.973 -3.574 5.758 1.00 . A A . 33 THR HG23 1 1 31 19135 1 1 33 THR N N -2.085 -4.583 3.326 1.00 . A A . 33 THR N 1 1 31 19136 1 1 33 THR O O -5.612 -5.043 3.906 1.00 . A A . 33 THR O 1 1 31 19137 1 1 33 THR OG1 O -4.391 -5.804 5.939 1.00 . A A . 33 THR OG1 1 1 31 19138 1 1 34 GLY C C -6.530 -2.591 2.886 1.00 . A A . 34 GLY C 1 1 31 19139 1 1 34 GLY CA C -5.678 -3.253 1.820 1.00 . A A . 34 GLY CA 1 1 31 19140 1 1 34 GLY H H -3.604 -3.647 1.974 1.00 . A A . 34 GLY H 1 1 31 19141 1 1 34 GLY HA2 H -6.265 -4.015 1.328 1.00 . A A . 34 GLY HA2 1 1 31 19142 1 1 34 GLY HA3 H -5.392 -2.509 1.091 1.00 . A A . 34 GLY HA3 1 1 31 19143 1 1 34 GLY N N -4.477 -3.866 2.361 1.00 . A A . 34 GLY N 1 1 31 19144 1 1 34 GLY O O -7.741 -2.444 2.720 1.00 . A A . 34 GLY O 1 1 31 19145 1 1 35 ARG C C -6.288 -0.050 5.128 1.00 . A A . 35 ARG C 1 1 31 19146 1 1 35 ARG CA C -6.607 -1.541 5.081 1.00 . A A . 35 ARG CA 1 1 31 19147 1 1 35 ARG CB C -6.238 -2.195 6.414 1.00 . A A . 35 ARG CB 1 1 31 19148 1 1 35 ARG CD C -6.852 -2.628 8.812 1.00 . A A . 35 ARG CD 1 1 31 19149 1 1 35 ARG CG C -7.295 -2.019 7.491 1.00 . A A . 35 ARG CG 1 1 31 19150 1 1 35 ARG CZ C -8.632 -1.945 10.373 1.00 . A A . 35 ARG CZ 1 1 31 19151 1 1 35 ARG H H -4.931 -2.334 4.060 1.00 . A A . 35 ARG H 1 1 31 19152 1 1 35 ARG HA H -7.665 -1.665 4.910 1.00 . A A . 35 ARG HA 1 1 31 19153 1 1 35 ARG HB2 H -6.091 -3.253 6.254 1.00 . A A . 35 ARG HB2 1 1 31 19154 1 1 35 ARG HB3 H -5.315 -1.763 6.771 1.00 . A A . 35 ARG HB3 1 1 31 19155 1 1 35 ARG HD2 H -7.212 -3.645 8.863 1.00 . A A . 35 ARG HD2 1 1 31 19156 1 1 35 ARG HD3 H -5.773 -2.626 8.850 1.00 . A A . 35 ARG HD3 1 1 31 19157 1 1 35 ARG HE H -6.742 -1.310 10.445 1.00 . A A . 35 ARG HE 1 1 31 19158 1 1 35 ARG HG2 H -7.476 -0.964 7.636 1.00 . A A . 35 ARG HG2 1 1 31 19159 1 1 35 ARG HG3 H -8.207 -2.501 7.170 1.00 . A A . 35 ARG HG3 1 1 31 19160 1 1 35 ARG HH11 H -9.225 -3.249 8.945 1.00 . A A . 35 ARG HH11 1 1 31 19161 1 1 35 ARG HH12 H -10.458 -2.753 10.055 1.00 . A A . 35 ARG HH12 1 1 31 19162 1 1 35 ARG HH21 H -8.362 -0.657 11.907 1.00 . A A . 35 ARG HH21 1 1 31 19163 1 1 35 ARG HH22 H -9.968 -1.282 11.737 1.00 . A A . 35 ARG HH22 1 1 31 19164 1 1 35 ARG N N -5.897 -2.190 3.985 1.00 . A A . 35 ARG N 1 1 31 19165 1 1 35 ARG NE N -7.369 -1.885 9.958 1.00 . A A . 35 ARG NE 1 1 31 19166 1 1 35 ARG NH1 N -9.510 -2.712 9.739 1.00 . A A . 35 ARG NH1 1 1 31 19167 1 1 35 ARG NH2 N -9.019 -1.237 11.425 1.00 . A A . 35 ARG NH2 1 1 31 19168 1 1 35 ARG O O -7.141 0.767 5.477 1.00 . A A . 35 ARG O 1 1 31 19169 1 1 36 SER C C -3.621 1.947 3.655 1.00 . A A . 36 SER C 1 1 31 19170 1 1 36 SER CA C -4.623 1.689 4.775 1.00 . A A . 36 SER CA 1 1 31 19171 1 1 36 SER CB C -4.001 2.051 6.125 1.00 . A A . 36 SER CB 1 1 31 19172 1 1 36 SER H H -4.422 -0.400 4.505 1.00 . A A . 36 SER H 1 1 31 19173 1 1 36 SER HA H -5.494 2.307 4.613 1.00 . A A . 36 SER HA 1 1 31 19174 1 1 36 SER HB2 H -3.497 3.003 6.044 1.00 . A A . 36 SER HB2 1 1 31 19175 1 1 36 SER HB3 H -4.780 2.119 6.871 1.00 . A A . 36 SER HB3 1 1 31 19176 1 1 36 SER HG H -2.198 1.288 6.176 1.00 . A A . 36 SER HG 1 1 31 19177 1 1 36 SER N N -5.056 0.297 4.774 1.00 . A A . 36 SER N 1 1 31 19178 1 1 36 SER O O -2.886 1.048 3.247 1.00 . A A . 36 SER O 1 1 31 19179 1 1 36 SER OG O -3.062 1.072 6.534 1.00 . A A . 36 SER OG 1 1 31 19180 1 1 37 CYS C C -1.245 3.639 2.599 1.00 . A A . 37 CYS C 1 1 31 19181 1 1 37 CYS CA C -2.682 3.555 2.089 1.00 . A A . 37 CYS CA 1 1 31 19182 1 1 37 CYS CB C -3.101 4.893 1.477 1.00 . A A . 37 CYS CB 1 1 31 19183 1 1 37 CYS H H -4.204 3.855 3.529 1.00 . A A . 37 CYS H 1 1 31 19184 1 1 37 CYS HA H -2.736 2.791 1.329 1.00 . A A . 37 CYS HA 1 1 31 19185 1 1 37 CYS HB2 H -3.722 5.425 2.182 1.00 . A A . 37 CYS HB2 1 1 31 19186 1 1 37 CYS HB3 H -2.217 5.480 1.270 1.00 . A A . 37 CYS HB3 1 1 31 19187 1 1 37 CYS N N -3.595 3.181 3.162 1.00 . A A . 37 CYS N 1 1 31 19188 1 1 37 CYS O O -0.295 3.531 1.824 1.00 . A A . 37 CYS O 1 1 31 19189 1 1 37 CYS SG S -4.038 4.737 -0.078 1.00 . A A . 37 CYS SG 1 1 31 19190 1 1 38 GLU C C 0.813 2.541 4.766 1.00 . A A . 38 GLU C 1 1 31 19191 1 1 38 GLU CA C 0.230 3.928 4.514 1.00 . A A . 38 GLU CA 1 1 31 19192 1 1 38 GLU CB C 0.155 4.709 5.828 1.00 . A A . 38 GLU CB 1 1 31 19193 1 1 38 GLU CD C 0.641 6.913 6.962 1.00 . A A . 38 GLU CD 1 1 31 19194 1 1 38 GLU CG C 0.335 6.208 5.655 1.00 . A A . 38 GLU CG 1 1 31 19195 1 1 38 GLU H H -1.886 3.910 4.475 1.00 . A A . 38 GLU H 1 1 31 19196 1 1 38 GLU HA H 0.873 4.457 3.827 1.00 . A A . 38 GLU HA 1 1 31 19197 1 1 38 GLU HB2 H -0.808 4.533 6.283 1.00 . A A . 38 GLU HB2 1 1 31 19198 1 1 38 GLU HB3 H 0.928 4.349 6.491 1.00 . A A . 38 GLU HB3 1 1 31 19199 1 1 38 GLU HG2 H 1.151 6.383 4.970 1.00 . A A . 38 GLU HG2 1 1 31 19200 1 1 38 GLU HG3 H -0.574 6.622 5.243 1.00 . A A . 38 GLU HG3 1 1 31 19201 1 1 38 GLU N N -1.092 3.832 3.906 1.00 . A A . 38 GLU N 1 1 31 19202 1 1 38 GLU O O 0.435 1.862 5.721 1.00 . A A . 38 GLU O 1 1 31 19203 1 1 38 GLU OE1 O 1.531 6.438 7.698 1.00 . A A . 38 GLU OE1 1 1 31 19204 1 1 38 GLU OE2 O -0.010 7.939 7.249 1.00 . A A . 38 GLU OE2 1 1 31 19205 1 1 39 CYS C C 3.082 0.687 5.374 1.00 . A A . 39 CYS C 1 1 31 19206 1 1 39 CYS CA C 2.369 0.819 4.030 1.00 . A A . 39 CYS CA 1 1 31 19207 1 1 39 CYS CB C 3.363 0.597 2.889 1.00 . A A . 39 CYS CB 1 1 31 19208 1 1 39 CYS H H 1.993 2.712 3.161 1.00 . A A . 39 CYS H 1 1 31 19209 1 1 39 CYS HA H 1.595 0.068 3.972 1.00 . A A . 39 CYS HA 1 1 31 19210 1 1 39 CYS HB2 H 4.230 1.221 3.051 1.00 . A A . 39 CYS HB2 1 1 31 19211 1 1 39 CYS HB3 H 3.668 -0.439 2.883 1.00 . A A . 39 CYS HB3 1 1 31 19212 1 1 39 CYS N N 1.734 2.126 3.902 1.00 . A A . 39 CYS N 1 1 31 19213 1 1 39 CYS O O 3.565 1.674 5.929 1.00 . A A . 39 CYS O 1 1 31 19214 1 1 39 CYS SG S 2.700 0.991 1.238 1.00 . A A . 39 CYS SG 1 1 31 19215 1 1 40 PRO C C 5.332 -0.653 7.113 1.00 . A A . 40 PRO C 1 1 31 19216 1 1 40 PRO CA C 3.817 -0.798 7.200 1.00 . A A . 40 PRO CA 1 1 31 19217 1 1 40 PRO CB C 3.435 -2.246 7.512 1.00 . A A . 40 PRO CB 1 1 31 19218 1 1 40 PRO CD C 2.609 -1.774 5.319 1.00 . A A . 40 PRO CD 1 1 31 19219 1 1 40 PRO CG C 3.182 -2.865 6.181 1.00 . A A . 40 PRO CG 1 1 31 19220 1 1 40 PRO HA H 3.439 -0.148 7.976 1.00 . A A . 40 PRO HA 1 1 31 19221 1 1 40 PRO HB2 H 4.251 -2.733 8.027 1.00 . A A . 40 PRO HB2 1 1 31 19222 1 1 40 PRO HB3 H 2.550 -2.264 8.129 1.00 . A A . 40 PRO HB3 1 1 31 19223 1 1 40 PRO HD2 H 2.940 -1.887 4.297 1.00 . A A . 40 PRO HD2 1 1 31 19224 1 1 40 PRO HD3 H 1.531 -1.779 5.371 1.00 . A A . 40 PRO HD3 1 1 31 19225 1 1 40 PRO HG2 H 4.110 -3.226 5.762 1.00 . A A . 40 PRO HG2 1 1 31 19226 1 1 40 PRO HG3 H 2.474 -3.674 6.281 1.00 . A A . 40 PRO HG3 1 1 31 19227 1 1 40 PRO N N 3.158 -0.541 5.916 1.00 . A A . 40 PRO N 1 1 31 19228 1 1 40 PRO O O 5.881 -0.395 6.042 1.00 . A A . 40 PRO O 1 1 31 19229 1 1 41 SER C C 8.117 -2.054 8.011 1.00 . A A . 41 SER C 1 1 31 19230 1 1 41 SER CA C 7.457 -0.710 8.300 1.00 . A A . 41 SER CA 1 1 31 19231 1 1 41 SER CB C 7.901 -0.195 9.670 1.00 . A A . 41 SER CB 1 1 31 19232 1 1 41 SER H H 5.510 -1.026 9.069 1.00 . A A . 41 SER H 1 1 31 19233 1 1 41 SER HA H 7.762 -0.003 7.543 1.00 . A A . 41 SER HA 1 1 31 19234 1 1 41 SER HB2 H 8.960 0.013 9.648 1.00 . A A . 41 SER HB2 1 1 31 19235 1 1 41 SER HB3 H 7.361 0.712 9.903 1.00 . A A . 41 SER HB3 1 1 31 19236 1 1 41 SER HG H 6.749 -1.484 10.591 1.00 . A A . 41 SER HG 1 1 31 19237 1 1 41 SER N N 6.004 -0.821 8.248 1.00 . A A . 41 SER N 1 1 31 19238 1 1 41 SER O O 9.213 -2.112 7.453 1.00 . A A . 41 SER O 1 1 31 19239 1 1 41 SER OG O 7.645 -1.152 10.683 1.00 . A A . 41 SER OG 1 1 31 19240 1 1 42 TYR C C 7.585 -4.991 6.790 1.00 . A A . 42 TYR C 1 1 31 19241 1 1 42 TYR CA C 7.965 -4.478 8.177 1.00 . A A . 42 TYR CA 1 1 31 19242 1 1 42 TYR CB C 7.437 -5.432 9.249 1.00 . A A . 42 TYR CB 1 1 31 19243 1 1 42 TYR CD1 C 5.225 -6.288 8.382 1.00 . A A . 42 TYR CD1 1 1 31 19244 1 1 42 TYR CD2 C 5.206 -4.817 10.258 1.00 . A A . 42 TYR CD2 1 1 31 19245 1 1 42 TYR CE1 C 3.846 -6.365 8.423 1.00 . A A . 42 TYR CE1 1 1 31 19246 1 1 42 TYR CE2 C 3.826 -4.890 10.306 1.00 . A A . 42 TYR CE2 1 1 31 19247 1 1 42 TYR CG C 5.927 -5.514 9.297 1.00 . A A . 42 TYR CG 1 1 31 19248 1 1 42 TYR CZ C 3.151 -5.665 9.387 1.00 . A A . 42 TYR CZ 1 1 31 19249 1 1 42 TYR H H 6.574 -3.023 8.835 1.00 . A A . 42 TYR H 1 1 31 19250 1 1 42 TYR HA H 9.041 -4.430 8.248 1.00 . A A . 42 TYR HA 1 1 31 19251 1 1 42 TYR HB2 H 7.816 -6.425 9.056 1.00 . A A . 42 TYR HB2 1 1 31 19252 1 1 42 TYR HB3 H 7.783 -5.102 10.217 1.00 . A A . 42 TYR HB3 1 1 31 19253 1 1 42 TYR HD1 H 5.772 -6.836 7.629 1.00 . A A . 42 TYR HD1 1 1 31 19254 1 1 42 TYR HD2 H 5.737 -4.210 10.976 1.00 . A A . 42 TYR HD2 1 1 31 19255 1 1 42 TYR HE1 H 3.318 -6.973 7.703 1.00 . A A . 42 TYR HE1 1 1 31 19256 1 1 42 TYR HE2 H 3.283 -4.340 11.060 1.00 . A A . 42 TYR HE2 1 1 31 19257 1 1 42 TYR HH H 1.503 -6.652 9.319 1.00 . A A . 42 TYR HH 1 1 31 19258 1 1 42 TYR N N 7.443 -3.133 8.395 1.00 . A A . 42 TYR N 1 1 31 19259 1 1 42 TYR O O 6.536 -4.635 6.253 1.00 . A A . 42 TYR O 1 1 31 19260 1 1 42 TYR OH O 1.778 -5.739 9.431 1.00 . A A . 42 TYR OH 1 1 31 19261 1 1 43 PRO C C 6.821 -7.069 4.761 1.00 . A A . 43 PRO C 1 1 31 19262 1 1 43 PRO CA C 8.186 -6.402 4.858 1.00 . A A . 43 PRO CA 1 1 31 19263 1 1 43 PRO CB C 9.301 -7.437 4.689 1.00 . A A . 43 PRO CB 1 1 31 19264 1 1 43 PRO CD C 9.712 -6.317 6.759 1.00 . A A . 43 PRO CD 1 1 31 19265 1 1 43 PRO CG C 10.392 -6.971 5.589 1.00 . A A . 43 PRO CG 1 1 31 19266 1 1 43 PRO HA H 8.270 -5.651 4.091 1.00 . A A . 43 PRO HA 1 1 31 19267 1 1 43 PRO HB2 H 8.938 -8.412 4.979 1.00 . A A . 43 PRO HB2 1 1 31 19268 1 1 43 PRO HB3 H 9.623 -7.459 3.659 1.00 . A A . 43 PRO HB3 1 1 31 19269 1 1 43 PRO HD2 H 9.538 -7.036 7.546 1.00 . A A . 43 PRO HD2 1 1 31 19270 1 1 43 PRO HD3 H 10.303 -5.490 7.126 1.00 . A A . 43 PRO HD3 1 1 31 19271 1 1 43 PRO HG2 H 10.980 -7.815 5.921 1.00 . A A . 43 PRO HG2 1 1 31 19272 1 1 43 PRO HG3 H 11.017 -6.258 5.072 1.00 . A A . 43 PRO HG3 1 1 31 19273 1 1 43 PRO N N 8.438 -5.840 6.189 1.00 . A A . 43 PRO N 1 1 31 19274 1 1 43 PRO O O 5.967 -6.654 3.977 1.00 . A A . 43 PRO O 1 1 31 19275 1 1 44 GLY C C 5.173 -9.670 6.801 1.00 . A A . 44 GLY C 1 1 31 19276 1 1 44 GLY CA C 5.363 -8.822 5.559 1.00 . A A . 44 GLY CA 1 1 31 19277 1 1 44 GLY H H 7.345 -8.386 6.163 1.00 . A A . 44 GLY H 1 1 31 19278 1 1 44 GLY HA2 H 5.328 -9.462 4.690 1.00 . A A . 44 GLY HA2 1 1 31 19279 1 1 44 GLY HA3 H 4.556 -8.106 5.498 1.00 . A A . 44 GLY HA3 1 1 31 19280 1 1 44 GLY N N 6.625 -8.106 5.563 1.00 . A A . 44 GLY N 1 1 31 19281 1 1 44 GLY O O 5.221 -9.109 7.916 1.00 . A A . 44 GLY O 1 1 31 19282 1 1 44 GLY OXT O 4.975 -10.895 6.659 1.00 . A A . 44 GLY OXT 1 1 32 19283 1 1 1 ALA C C -12.903 13.754 4.772 1.00 . A A . 1 ALA C 1 1 32 19284 1 1 1 ALA CA C -13.969 14.425 5.633 1.00 . A A . 1 ALA CA 1 1 32 19285 1 1 1 ALA CB C -14.587 15.598 4.887 1.00 . A A . 1 ALA CB 1 1 32 19286 1 1 1 ALA H1 H -12.604 15.516 6.718 1.00 . A A . 1 ALA H1 1 1 32 19287 1 1 1 ALA H2 H -14.152 15.378 7.446 1.00 . A A . 1 ALA H2 1 1 32 19288 1 1 1 ALA H3 H -13.079 14.039 7.447 1.00 . A A . 1 ALA H3 1 1 32 19289 1 1 1 ALA HA H -14.751 13.709 5.839 1.00 . A A . 1 ALA HA 1 1 32 19290 1 1 1 ALA HB1 H -14.849 16.374 5.591 1.00 . A A . 1 ALA HB1 1 1 32 19291 1 1 1 ALA HB2 H -15.474 15.267 4.368 1.00 . A A . 1 ALA HB2 1 1 32 19292 1 1 1 ALA HB3 H -13.876 15.985 4.172 1.00 . A A . 1 ALA HB3 1 1 32 19293 1 1 1 ALA N N -13.400 14.881 6.928 1.00 . A A . 1 ALA N 1 1 32 19294 1 1 1 ALA O O -11.718 14.068 4.878 1.00 . A A . 1 ALA O 1 1 32 19295 1 1 2 MET C C -11.889 13.031 1.943 1.00 . A A . 2 MET C 1 1 32 19296 1 1 2 MET CA C -12.416 12.114 3.042 1.00 . A A . 2 MET CA 1 1 32 19297 1 1 2 MET CB C -13.112 10.901 2.421 1.00 . A A . 2 MET CB 1 1 32 19298 1 1 2 MET CE C -11.024 7.885 0.508 1.00 . A A . 2 MET CE 1 1 32 19299 1 1 2 MET CG C -12.198 9.700 2.242 1.00 . A A . 2 MET CG 1 1 32 19300 1 1 2 MET H H -14.291 12.622 3.883 1.00 . A A . 2 MET H 1 1 32 19301 1 1 2 MET HA H -11.584 11.772 3.639 1.00 . A A . 2 MET HA 1 1 32 19302 1 1 2 MET HB2 H -13.935 10.609 3.056 1.00 . A A . 2 MET HB2 1 1 32 19303 1 1 2 MET HB3 H -13.499 11.180 1.452 1.00 . A A . 2 MET HB3 1 1 32 19304 1 1 2 MET HE1 H -10.603 7.632 1.470 1.00 . A A . 2 MET HE1 1 1 32 19305 1 1 2 MET HE2 H -11.207 6.981 -0.053 1.00 . A A . 2 MET HE2 1 1 32 19306 1 1 2 MET HE3 H -10.331 8.512 -0.034 1.00 . A A . 2 MET HE3 1 1 32 19307 1 1 2 MET HG2 H -11.177 10.047 2.191 1.00 . A A . 2 MET HG2 1 1 32 19308 1 1 2 MET HG3 H -12.313 9.048 3.095 1.00 . A A . 2 MET HG3 1 1 32 19309 1 1 2 MET N N -13.333 12.829 3.921 1.00 . A A . 2 MET N 1 1 32 19310 1 1 2 MET O O -12.466 14.084 1.670 1.00 . A A . 2 MET O 1 1 32 19311 1 1 2 MET SD S -12.566 8.765 0.745 1.00 . A A . 2 MET SD 1 1 32 19312 1 1 3 ASP C C -9.278 12.541 -0.620 1.00 . A A . 3 ASP C 1 1 32 19313 1 1 3 ASP CA C -10.187 13.408 0.244 1.00 . A A . 3 ASP CA 1 1 32 19314 1 1 3 ASP CB C -9.392 14.577 0.828 1.00 . A A . 3 ASP CB 1 1 32 19315 1 1 3 ASP CG C -8.309 14.120 1.785 1.00 . A A . 3 ASP CG 1 1 32 19316 1 1 3 ASP H H -10.378 11.774 1.576 1.00 . A A . 3 ASP H 1 1 32 19317 1 1 3 ASP HA H -10.984 13.797 -0.371 1.00 . A A . 3 ASP HA 1 1 32 19318 1 1 3 ASP HB2 H -8.927 15.126 0.022 1.00 . A A . 3 ASP HB2 1 1 32 19319 1 1 3 ASP HB3 H -10.066 15.232 1.361 1.00 . A A . 3 ASP HB3 1 1 32 19320 1 1 3 ASP N N -10.792 12.623 1.314 1.00 . A A . 3 ASP N 1 1 32 19321 1 1 3 ASP O O -8.239 12.997 -1.098 1.00 . A A . 3 ASP O 1 1 32 19322 1 1 3 ASP OD1 O -7.250 13.661 1.307 1.00 . A A . 3 ASP OD1 1 1 32 19323 1 1 3 ASP OD2 O -8.519 14.221 3.012 1.00 . A A . 3 ASP OD2 1 1 32 19324 1 1 4 CYS C C -7.505 10.154 -1.031 1.00 . A A . 4 CYS C 1 1 32 19325 1 1 4 CYS CA C -8.896 10.356 -1.624 1.00 . A A . 4 CYS CA 1 1 32 19326 1 1 4 CYS CB C -8.780 10.867 -3.061 1.00 . A A . 4 CYS CB 1 1 32 19327 1 1 4 CYS H H -10.513 10.982 -0.409 1.00 . A A . 4 CYS H 1 1 32 19328 1 1 4 CYS HA H -9.413 9.409 -1.628 1.00 . A A . 4 CYS HA 1 1 32 19329 1 1 4 CYS HB2 H -8.464 11.899 -3.044 1.00 . A A . 4 CYS HB2 1 1 32 19330 1 1 4 CYS HB3 H -8.042 10.279 -3.586 1.00 . A A . 4 CYS HB3 1 1 32 19331 1 1 4 CYS N N -9.675 11.288 -0.817 1.00 . A A . 4 CYS N 1 1 32 19332 1 1 4 CYS O O -6.672 11.060 -1.053 1.00 . A A . 4 CYS O 1 1 32 19333 1 1 4 CYS SG S -10.334 10.782 -4.010 1.00 . A A . 4 CYS SG 1 1 32 19334 1 1 5 THR C C -4.863 8.672 -0.953 1.00 . A A . 5 THR C 1 1 32 19335 1 1 5 THR CA C -5.970 8.637 0.096 1.00 . A A . 5 THR CA 1 1 32 19336 1 1 5 THR CB C -6.021 7.259 0.762 1.00 . A A . 5 THR CB 1 1 32 19337 1 1 5 THR CG2 C -5.402 7.240 2.143 1.00 . A A . 5 THR CG2 1 1 32 19338 1 1 5 THR H H -7.965 8.278 -0.515 1.00 . A A . 5 THR H 1 1 32 19339 1 1 5 THR HA H -5.760 9.382 0.849 1.00 . A A . 5 THR HA 1 1 32 19340 1 1 5 THR HB H -5.481 6.552 0.148 1.00 . A A . 5 THR HB 1 1 32 19341 1 1 5 THR HG1 H -7.880 7.475 1.339 1.00 . A A . 5 THR HG1 1 1 32 19342 1 1 5 THR HG21 H -5.927 7.933 2.782 1.00 . A A . 5 THR HG21 1 1 32 19343 1 1 5 THR HG22 H -5.473 6.244 2.555 1.00 . A A . 5 THR HG22 1 1 32 19344 1 1 5 THR HG23 H -4.363 7.528 2.076 1.00 . A A . 5 THR HG23 1 1 32 19345 1 1 5 THR N N -7.261 8.959 -0.502 1.00 . A A . 5 THR N 1 1 32 19346 1 1 5 THR O O -5.092 8.360 -2.121 1.00 . A A . 5 THR O 1 1 32 19347 1 1 5 THR OG1 O -7.358 6.808 0.886 1.00 . A A . 5 THR OG1 1 1 32 19348 1 1 6 THR C C -1.339 8.334 -0.899 1.00 . A A . 6 THR C 1 1 32 19349 1 1 6 THR CA C -2.521 9.135 -1.436 1.00 . A A . 6 THR CA 1 1 32 19350 1 1 6 THR CB C -2.111 10.593 -1.646 1.00 . A A . 6 THR CB 1 1 32 19351 1 1 6 THR CG2 C -3.230 11.458 -2.184 1.00 . A A . 6 THR CG2 1 1 32 19352 1 1 6 THR H H -3.541 9.295 0.413 1.00 . A A . 6 THR H 1 1 32 19353 1 1 6 THR HA H -2.823 8.715 -2.384 1.00 . A A . 6 THR HA 1 1 32 19354 1 1 6 THR HB H -1.296 10.628 -2.355 1.00 . A A . 6 THR HB 1 1 32 19355 1 1 6 THR HG1 H -2.397 11.203 0.192 1.00 . A A . 6 THR HG1 1 1 32 19356 1 1 6 THR HG21 H -3.732 10.939 -2.987 1.00 . A A . 6 THR HG21 1 1 32 19357 1 1 6 THR HG22 H -3.935 11.667 -1.393 1.00 . A A . 6 THR HG22 1 1 32 19358 1 1 6 THR HG23 H -2.820 12.386 -2.556 1.00 . A A . 6 THR HG23 1 1 32 19359 1 1 6 THR N N -3.662 9.057 -0.529 1.00 . A A . 6 THR N 1 1 32 19360 1 1 6 THR O O -0.936 8.499 0.253 1.00 . A A . 6 THR O 1 1 32 19361 1 1 6 THR OG1 O -1.668 11.169 -0.430 1.00 . A A . 6 THR OG1 1 1 32 19362 1 1 7 GLY C C 0.488 5.398 -2.177 1.00 . A A . 7 GLY C 1 1 32 19363 1 1 7 GLY CA C 0.345 6.654 -1.337 1.00 . A A . 7 GLY CA 1 1 32 19364 1 1 7 GLY H H -1.150 7.381 -2.648 1.00 . A A . 7 GLY H 1 1 32 19365 1 1 7 GLY HA2 H 0.221 6.371 -0.303 1.00 . A A . 7 GLY HA2 1 1 32 19366 1 1 7 GLY HA3 H 1.247 7.241 -1.433 1.00 . A A . 7 GLY HA3 1 1 32 19367 1 1 7 GLY N N -0.787 7.468 -1.742 1.00 . A A . 7 GLY N 1 1 32 19368 1 1 7 GLY O O -0.132 5.282 -3.234 1.00 . A A . 7 GLY O 1 1 32 19369 1 1 8 PRO C C 0.399 2.177 -2.269 1.00 . A A . 8 PRO C 1 1 32 19370 1 1 8 PRO CA C 1.532 3.182 -2.461 1.00 . A A . 8 PRO CA 1 1 32 19371 1 1 8 PRO CB C 2.825 2.653 -1.847 1.00 . A A . 8 PRO CB 1 1 32 19372 1 1 8 PRO CD C 2.099 4.490 -0.484 1.00 . A A . 8 PRO CD 1 1 32 19373 1 1 8 PRO CG C 2.812 3.162 -0.446 1.00 . A A . 8 PRO CG 1 1 32 19374 1 1 8 PRO HA H 1.678 3.360 -3.516 1.00 . A A . 8 PRO HA 1 1 32 19375 1 1 8 PRO HB2 H 2.825 1.573 -1.876 1.00 . A A . 8 PRO HB2 1 1 32 19376 1 1 8 PRO HB3 H 3.672 3.035 -2.397 1.00 . A A . 8 PRO HB3 1 1 32 19377 1 1 8 PRO HD2 H 1.451 4.594 0.374 1.00 . A A . 8 PRO HD2 1 1 32 19378 1 1 8 PRO HD3 H 2.813 5.300 -0.518 1.00 . A A . 8 PRO HD3 1 1 32 19379 1 1 8 PRO HG2 H 2.280 2.471 0.190 1.00 . A A . 8 PRO HG2 1 1 32 19380 1 1 8 PRO HG3 H 3.824 3.292 -0.094 1.00 . A A . 8 PRO HG3 1 1 32 19381 1 1 8 PRO N N 1.311 4.433 -1.732 1.00 . A A . 8 PRO N 1 1 32 19382 1 1 8 PRO O O -0.058 1.554 -3.227 1.00 . A A . 8 PRO O 1 1 32 19383 1 1 9 CYS C C -2.416 1.478 -1.416 1.00 . A A . 9 CYS C 1 1 32 19384 1 1 9 CYS CA C -1.120 1.081 -0.714 1.00 . A A . 9 CYS CA 1 1 32 19385 1 1 9 CYS CB C -1.342 1.009 0.798 1.00 . A A . 9 CYS CB 1 1 32 19386 1 1 9 CYS H H 0.359 2.539 -0.302 1.00 . A A . 9 CYS H 1 1 32 19387 1 1 9 CYS HA H -0.820 0.106 -1.070 1.00 . A A . 9 CYS HA 1 1 32 19388 1 1 9 CYS HB2 H -0.768 1.789 1.275 1.00 . A A . 9 CYS HB2 1 1 32 19389 1 1 9 CYS HB3 H -2.390 1.158 1.011 1.00 . A A . 9 CYS HB3 1 1 32 19390 1 1 9 CYS N N -0.046 2.018 -1.026 1.00 . A A . 9 CYS N 1 1 32 19391 1 1 9 CYS O O -3.207 0.621 -1.810 1.00 . A A . 9 CYS O 1 1 32 19392 1 1 9 CYS SG S -0.845 -0.576 1.547 1.00 . A A . 9 CYS SG 1 1 32 19393 1 1 10 CYS C C -3.515 3.722 -3.657 1.00 . A A . 10 CYS C 1 1 32 19394 1 1 10 CYS CA C -3.826 3.285 -2.231 1.00 . A A . 10 CYS CA 1 1 32 19395 1 1 10 CYS CB C -4.424 4.448 -1.437 1.00 . A A . 10 CYS CB 1 1 32 19396 1 1 10 CYS H H -1.959 3.416 -1.241 1.00 . A A . 10 CYS H 1 1 32 19397 1 1 10 CYS HA H -4.544 2.481 -2.266 1.00 . A A . 10 CYS HA 1 1 32 19398 1 1 10 CYS HB2 H -5.340 4.764 -1.913 1.00 . A A . 10 CYS HB2 1 1 32 19399 1 1 10 CYS HB3 H -4.644 4.112 -0.435 1.00 . A A . 10 CYS HB3 1 1 32 19400 1 1 10 CYS N N -2.626 2.780 -1.572 1.00 . A A . 10 CYS N 1 1 32 19401 1 1 10 CYS O O -2.431 4.234 -3.938 1.00 . A A . 10 CYS O 1 1 32 19402 1 1 10 CYS SG S -3.339 5.906 -1.309 1.00 . A A . 10 CYS SG 1 1 32 19403 1 1 11 ARG C C -4.330 5.397 -6.128 1.00 . A A . 11 ARG C 1 1 32 19404 1 1 11 ARG CA C -4.292 3.881 -5.957 1.00 . A A . 11 ARG CA 1 1 32 19405 1 1 11 ARG CB C -5.369 3.222 -6.823 1.00 . A A . 11 ARG CB 1 1 32 19406 1 1 11 ARG CD C -4.496 2.232 -8.961 1.00 . A A . 11 ARG CD 1 1 32 19407 1 1 11 ARG CG C -4.897 1.957 -7.521 1.00 . A A . 11 ARG CG 1 1 32 19408 1 1 11 ARG CZ C -2.484 2.933 -10.199 1.00 . A A . 11 ARG CZ 1 1 32 19409 1 1 11 ARG H H -5.314 3.098 -4.276 1.00 . A A . 11 ARG H 1 1 32 19410 1 1 11 ARG HA H -3.323 3.523 -6.270 1.00 . A A . 11 ARG HA 1 1 32 19411 1 1 11 ARG HB2 H -6.212 2.969 -6.197 1.00 . A A . 11 ARG HB2 1 1 32 19412 1 1 11 ARG HB3 H -5.690 3.925 -7.577 1.00 . A A . 11 ARG HB3 1 1 32 19413 1 1 11 ARG HD2 H -4.771 1.381 -9.567 1.00 . A A . 11 ARG HD2 1 1 32 19414 1 1 11 ARG HD3 H -5.026 3.106 -9.309 1.00 . A A . 11 ARG HD3 1 1 32 19415 1 1 11 ARG HE H -2.494 2.257 -8.321 1.00 . A A . 11 ARG HE 1 1 32 19416 1 1 11 ARG HG2 H -4.045 1.561 -6.990 1.00 . A A . 11 ARG HG2 1 1 32 19417 1 1 11 ARG HG3 H -5.698 1.232 -7.512 1.00 . A A . 11 ARG HG3 1 1 32 19418 1 1 11 ARG HH11 H -4.208 3.089 -11.245 1.00 . A A . 11 ARG HH11 1 1 32 19419 1 1 11 ARG HH12 H -2.779 3.576 -12.093 1.00 . A A . 11 ARG HH12 1 1 32 19420 1 1 11 ARG HH21 H -0.613 2.897 -9.435 1.00 . A A . 11 ARG HH21 1 1 32 19421 1 1 11 ARG HH22 H -0.738 3.467 -11.066 1.00 . A A . 11 ARG HH22 1 1 32 19422 1 1 11 ARG N N -4.471 3.513 -4.558 1.00 . A A . 11 ARG N 1 1 32 19423 1 1 11 ARG NE N -3.059 2.463 -9.095 1.00 . A A . 11 ARG NE 1 1 32 19424 1 1 11 ARG NH1 N -3.217 3.223 -11.267 1.00 . A A . 11 ARG NH1 1 1 32 19425 1 1 11 ARG NH2 N -1.170 3.114 -10.236 1.00 . A A . 11 ARG NH2 1 1 32 19426 1 1 11 ARG O O -3.289 6.048 -6.203 1.00 . A A . 11 ARG O 1 1 32 19427 1 1 12 GLN C C -6.861 7.918 -5.509 1.00 . A A . 12 GLN C 1 1 32 19428 1 1 12 GLN CA C -5.704 7.390 -6.355 1.00 . A A . 12 GLN CA 1 1 32 19429 1 1 12 GLN CB C -5.948 7.724 -7.825 1.00 . A A . 12 GLN CB 1 1 32 19430 1 1 12 GLN CD C -4.111 9.010 -8.988 1.00 . A A . 12 GLN CD 1 1 32 19431 1 1 12 GLN CG C -5.424 9.091 -8.235 1.00 . A A . 12 GLN CG 1 1 32 19432 1 1 12 GLN H H -6.329 5.381 -6.127 1.00 . A A . 12 GLN H 1 1 32 19433 1 1 12 GLN HA H -4.791 7.869 -6.034 1.00 . A A . 12 GLN HA 1 1 32 19434 1 1 12 GLN HB2 H -5.464 6.978 -8.436 1.00 . A A . 12 GLN HB2 1 1 32 19435 1 1 12 GLN HB3 H -7.011 7.698 -8.013 1.00 . A A . 12 GLN HB3 1 1 32 19436 1 1 12 GLN HE21 H -3.096 9.158 -7.285 1.00 . A A . 12 GLN HE21 1 1 32 19437 1 1 12 GLN HE22 H -2.141 9.017 -8.718 1.00 . A A . 12 GLN HE22 1 1 32 19438 1 1 12 GLN HG2 H -6.157 9.568 -8.869 1.00 . A A . 12 GLN HG2 1 1 32 19439 1 1 12 GLN HG3 H -5.277 9.687 -7.346 1.00 . A A . 12 GLN HG3 1 1 32 19440 1 1 12 GLN N N -5.535 5.952 -6.191 1.00 . A A . 12 GLN N 1 1 32 19441 1 1 12 GLN NE2 N -3.005 9.067 -8.256 1.00 . A A . 12 GLN NE2 1 1 32 19442 1 1 12 GLN O O -7.257 9.076 -5.646 1.00 . A A . 12 GLN O 1 1 32 19443 1 1 12 GLN OE1 O -4.091 8.897 -10.214 1.00 . A A . 12 GLN OE1 1 1 32 19444 1 1 13 CYS C C -8.920 6.372 -2.807 1.00 . A A . 13 CYS C 1 1 32 19445 1 1 13 CYS CA C -8.515 7.477 -3.783 1.00 . A A . 13 CYS CA 1 1 32 19446 1 1 13 CYS CB C -9.720 7.877 -4.636 1.00 . A A . 13 CYS CB 1 1 32 19447 1 1 13 CYS H H -7.051 6.163 -4.567 1.00 . A A . 13 CYS H 1 1 32 19448 1 1 13 CYS HA H -8.194 8.336 -3.214 1.00 . A A . 13 CYS HA 1 1 32 19449 1 1 13 CYS HB2 H -9.379 8.457 -5.479 1.00 . A A . 13 CYS HB2 1 1 32 19450 1 1 13 CYS HB3 H -10.209 6.983 -4.995 1.00 . A A . 13 CYS HB3 1 1 32 19451 1 1 13 CYS N N -7.404 7.072 -4.637 1.00 . A A . 13 CYS N 1 1 32 19452 1 1 13 CYS O O -9.423 6.658 -1.720 1.00 . A A . 13 CYS O 1 1 32 19453 1 1 13 CYS SG S -10.962 8.870 -3.746 1.00 . A A . 13 CYS SG 1 1 32 19454 1 1 14 LYS C C -7.922 3.021 -2.170 1.00 . A A . 14 LYS C 1 1 32 19455 1 1 14 LYS CA C -9.080 3.997 -2.328 1.00 . A A . 14 LYS CA 1 1 32 19456 1 1 14 LYS CB C -10.300 3.268 -2.894 1.00 . A A . 14 LYS CB 1 1 32 19457 1 1 14 LYS CD C -12.522 2.189 -2.433 1.00 . A A . 14 LYS CD 1 1 32 19458 1 1 14 LYS CE C -13.556 1.875 -1.364 1.00 . A A . 14 LYS CE 1 1 32 19459 1 1 14 LYS CG C -11.240 2.735 -1.826 1.00 . A A . 14 LYS CG 1 1 32 19460 1 1 14 LYS H H -8.316 4.929 -4.068 1.00 . A A . 14 LYS H 1 1 32 19461 1 1 14 LYS HA H -9.331 4.397 -1.358 1.00 . A A . 14 LYS HA 1 1 32 19462 1 1 14 LYS HB2 H -10.854 3.952 -3.522 1.00 . A A . 14 LYS HB2 1 1 32 19463 1 1 14 LYS HB3 H -9.962 2.436 -3.494 1.00 . A A . 14 LYS HB3 1 1 32 19464 1 1 14 LYS HD2 H -12.931 2.925 -3.109 1.00 . A A . 14 LYS HD2 1 1 32 19465 1 1 14 LYS HD3 H -12.294 1.285 -2.978 1.00 . A A . 14 LYS HD3 1 1 32 19466 1 1 14 LYS HE2 H -14.157 1.042 -1.696 1.00 . A A . 14 LYS HE2 1 1 32 19467 1 1 14 LYS HE3 H -13.041 1.606 -0.453 1.00 . A A . 14 LYS HE3 1 1 32 19468 1 1 14 LYS HG2 H -10.744 1.942 -1.286 1.00 . A A . 14 LYS HG2 1 1 32 19469 1 1 14 LYS HG3 H -11.487 3.537 -1.145 1.00 . A A . 14 LYS HG3 1 1 32 19470 1 1 14 LYS HZ1 H -14.838 3.402 -1.985 1.00 . A A . 14 LYS HZ1 1 1 32 19471 1 1 14 LYS HZ2 H -15.232 2.750 -0.475 1.00 . A A . 14 LYS HZ2 1 1 32 19472 1 1 14 LYS HZ3 H -13.911 3.796 -0.625 1.00 . A A . 14 LYS HZ3 1 1 32 19473 1 1 14 LYS N N -8.714 5.113 -3.190 1.00 . A A . 14 LYS N 1 1 32 19474 1 1 14 LYS NZ N -14.446 3.037 -1.093 1.00 . A A . 14 LYS NZ 1 1 32 19475 1 1 14 LYS O O -7.160 2.786 -3.107 1.00 . A A . 14 LYS O 1 1 32 19476 1 1 15 LEU C C -6.795 0.328 -1.678 1.00 . A A . 15 LEU C 1 1 32 19477 1 1 15 LEU CA C -6.744 1.489 -0.692 1.00 . A A . 15 LEU CA 1 1 32 19478 1 1 15 LEU CB C -6.874 0.966 0.739 1.00 . A A . 15 LEU CB 1 1 32 19479 1 1 15 LEU CD1 C -8.297 -0.703 1.959 1.00 . A A . 15 LEU CD1 1 1 32 19480 1 1 15 LEU CD2 C -8.924 1.722 1.975 1.00 . A A . 15 LEU CD2 1 1 32 19481 1 1 15 LEU CG C -8.297 0.595 1.164 1.00 . A A . 15 LEU CG 1 1 32 19482 1 1 15 LEU H H -8.445 2.673 -0.273 1.00 . A A . 15 LEU H 1 1 32 19483 1 1 15 LEU HA H -5.797 1.997 -0.798 1.00 . A A . 15 LEU HA 1 1 32 19484 1 1 15 LEU HB2 H -6.249 0.090 0.837 1.00 . A A . 15 LEU HB2 1 1 32 19485 1 1 15 LEU HB3 H -6.507 1.726 1.413 1.00 . A A . 15 LEU HB3 1 1 32 19486 1 1 15 LEU HD11 H -7.293 -0.919 2.293 1.00 . A A . 15 LEU HD11 1 1 32 19487 1 1 15 LEU HD12 H -8.947 -0.603 2.815 1.00 . A A . 15 LEU HD12 1 1 32 19488 1 1 15 LEU HD13 H -8.649 -1.509 1.332 1.00 . A A . 15 LEU HD13 1 1 32 19489 1 1 15 LEU HD21 H -8.146 2.365 2.358 1.00 . A A . 15 LEU HD21 1 1 32 19490 1 1 15 LEU HD22 H -9.585 2.294 1.342 1.00 . A A . 15 LEU HD22 1 1 32 19491 1 1 15 LEU HD23 H -9.485 1.305 2.798 1.00 . A A . 15 LEU HD23 1 1 32 19492 1 1 15 LEU HG H -8.900 0.443 0.281 1.00 . A A . 15 LEU HG 1 1 32 19493 1 1 15 LEU N N -7.802 2.448 -0.977 1.00 . A A . 15 LEU N 1 1 32 19494 1 1 15 LEU O O -7.825 -0.332 -1.819 1.00 . A A . 15 LEU O 1 1 32 19495 1 1 16 LYS C C -5.942 -2.334 -2.682 1.00 . A A . 16 LYS C 1 1 32 19496 1 1 16 LYS CA C -5.609 -0.994 -3.335 1.00 . A A . 16 LYS CA 1 1 32 19497 1 1 16 LYS CB C -4.214 -1.050 -3.960 1.00 . A A . 16 LYS CB 1 1 32 19498 1 1 16 LYS CD C -2.426 0.591 -4.622 1.00 . A A . 16 LYS CD 1 1 32 19499 1 1 16 LYS CE C -1.775 0.948 -5.948 1.00 . A A . 16 LYS CE 1 1 32 19500 1 1 16 LYS CG C -3.876 0.167 -4.806 1.00 . A A . 16 LYS CG 1 1 32 19501 1 1 16 LYS H H -4.895 0.645 -2.208 1.00 . A A . 16 LYS H 1 1 32 19502 1 1 16 LYS HA H -6.335 -0.788 -4.109 1.00 . A A . 16 LYS HA 1 1 32 19503 1 1 16 LYS HB2 H -3.481 -1.128 -3.171 1.00 . A A . 16 LYS HB2 1 1 32 19504 1 1 16 LYS HB3 H -4.147 -1.927 -4.588 1.00 . A A . 16 LYS HB3 1 1 32 19505 1 1 16 LYS HD2 H -2.393 1.453 -3.973 1.00 . A A . 16 LYS HD2 1 1 32 19506 1 1 16 LYS HD3 H -1.878 -0.223 -4.170 1.00 . A A . 16 LYS HD3 1 1 32 19507 1 1 16 LYS HE2 H -2.198 1.875 -6.304 1.00 . A A . 16 LYS HE2 1 1 32 19508 1 1 16 LYS HE3 H -0.714 1.075 -5.791 1.00 . A A . 16 LYS HE3 1 1 32 19509 1 1 16 LYS HG2 H -4.041 -0.072 -5.846 1.00 . A A . 16 LYS HG2 1 1 32 19510 1 1 16 LYS HG3 H -4.520 0.985 -4.516 1.00 . A A . 16 LYS HG3 1 1 32 19511 1 1 16 LYS HZ1 H -2.252 -1.004 -6.521 1.00 . A A . 16 LYS HZ1 1 1 32 19512 1 1 16 LYS HZ2 H -2.753 0.175 -7.625 1.00 . A A . 16 LYS HZ2 1 1 32 19513 1 1 16 LYS HZ3 H -1.119 -0.253 -7.526 1.00 . A A . 16 LYS HZ3 1 1 32 19514 1 1 16 LYS N N -5.683 0.085 -2.361 1.00 . A A . 16 LYS N 1 1 32 19515 1 1 16 LYS NZ N -1.990 -0.107 -6.977 1.00 . A A . 16 LYS NZ 1 1 32 19516 1 1 16 LYS O O -5.807 -2.490 -1.468 1.00 . A A . 16 LYS O 1 1 32 19517 1 1 17 PRO C C -5.580 -5.284 -2.184 1.00 . A A . 17 PRO C 1 1 32 19518 1 1 17 PRO CA C -6.728 -4.652 -2.965 1.00 . A A . 17 PRO CA 1 1 32 19519 1 1 17 PRO CB C -7.033 -5.470 -4.229 1.00 . A A . 17 PRO CB 1 1 32 19520 1 1 17 PRO CD C -6.569 -3.234 -4.933 1.00 . A A . 17 PRO CD 1 1 32 19521 1 1 17 PRO CG C -6.488 -4.669 -5.364 1.00 . A A . 17 PRO CG 1 1 32 19522 1 1 17 PRO HA H -7.606 -4.614 -2.338 1.00 . A A . 17 PRO HA 1 1 32 19523 1 1 17 PRO HB2 H -6.551 -6.434 -4.161 1.00 . A A . 17 PRO HB2 1 1 32 19524 1 1 17 PRO HB3 H -8.101 -5.605 -4.322 1.00 . A A . 17 PRO HB3 1 1 32 19525 1 1 17 PRO HD2 H -5.782 -2.655 -5.392 1.00 . A A . 17 PRO HD2 1 1 32 19526 1 1 17 PRO HD3 H -7.537 -2.819 -5.172 1.00 . A A . 17 PRO HD3 1 1 32 19527 1 1 17 PRO HG2 H -5.461 -4.947 -5.550 1.00 . A A . 17 PRO HG2 1 1 32 19528 1 1 17 PRO HG3 H -7.087 -4.828 -6.248 1.00 . A A . 17 PRO HG3 1 1 32 19529 1 1 17 PRO N N -6.380 -3.324 -3.478 1.00 . A A . 17 PRO N 1 1 32 19530 1 1 17 PRO O O -4.414 -5.145 -2.552 1.00 . A A . 17 PRO O 1 1 32 19531 1 1 18 ALA C C -3.969 -7.487 -1.101 1.00 . A A . 18 ALA C 1 1 32 19532 1 1 18 ALA CA C -4.917 -6.634 -0.263 1.00 . A A . 18 ALA CA 1 1 32 19533 1 1 18 ALA CB C -5.595 -7.485 0.799 1.00 . A A . 18 ALA CB 1 1 32 19534 1 1 18 ALA H H -6.865 -6.054 -0.858 1.00 . A A . 18 ALA H 1 1 32 19535 1 1 18 ALA HA H -4.347 -5.864 0.238 1.00 . A A . 18 ALA HA 1 1 32 19536 1 1 18 ALA HB1 H -6.367 -6.907 1.286 1.00 . A A . 18 ALA HB1 1 1 32 19537 1 1 18 ALA HB2 H -4.864 -7.798 1.530 1.00 . A A . 18 ALA HB2 1 1 32 19538 1 1 18 ALA HB3 H -6.036 -8.356 0.336 1.00 . A A . 18 ALA HB3 1 1 32 19539 1 1 18 ALA N N -5.919 -5.979 -1.100 1.00 . A A . 18 ALA N 1 1 32 19540 1 1 18 ALA O O -4.374 -8.490 -1.688 1.00 . A A . 18 ALA O 1 1 32 19541 1 1 19 GLY C C -0.781 -6.905 -2.695 1.00 . A A . 19 GLY C 1 1 32 19542 1 1 19 GLY CA C -1.719 -7.815 -1.923 1.00 . A A . 19 GLY CA 1 1 32 19543 1 1 19 GLY H H -2.439 -6.271 -0.666 1.00 . A A . 19 GLY H 1 1 32 19544 1 1 19 GLY HA2 H -2.233 -8.460 -2.621 1.00 . A A . 19 GLY HA2 1 1 32 19545 1 1 19 GLY HA3 H -1.136 -8.426 -1.249 1.00 . A A . 19 GLY HA3 1 1 32 19546 1 1 19 GLY N N -2.705 -7.079 -1.153 1.00 . A A . 19 GLY N 1 1 32 19547 1 1 19 GLY O O 0.245 -7.354 -3.207 1.00 . A A . 19 GLY O 1 1 32 19548 1 1 20 THR C C 0.977 -4.372 -2.731 1.00 . A A . 20 THR C 1 1 32 19549 1 1 20 THR CA C -0.311 -4.654 -3.495 1.00 . A A . 20 THR CA 1 1 32 19550 1 1 20 THR CB C -1.088 -3.354 -3.706 1.00 . A A . 20 THR CB 1 1 32 19551 1 1 20 THR CG2 C -0.576 -2.533 -4.869 1.00 . A A . 20 THR CG2 1 1 32 19552 1 1 20 THR H H -1.958 -5.324 -2.352 1.00 . A A . 20 THR H 1 1 32 19553 1 1 20 THR HA H -0.060 -5.075 -4.457 1.00 . A A . 20 THR HA 1 1 32 19554 1 1 20 THR HB H -1.008 -2.750 -2.814 1.00 . A A . 20 THR HB 1 1 32 19555 1 1 20 THR HG1 H -2.962 -3.442 -3.142 1.00 . A A . 20 THR HG1 1 1 32 19556 1 1 20 THR HG21 H 0.350 -2.957 -5.229 1.00 . A A . 20 THR HG21 1 1 32 19557 1 1 20 THR HG22 H -1.307 -2.539 -5.664 1.00 . A A . 20 THR HG22 1 1 32 19558 1 1 20 THR HG23 H -0.405 -1.517 -4.545 1.00 . A A . 20 THR HG23 1 1 32 19559 1 1 20 THR N N -1.131 -5.624 -2.781 1.00 . A A . 20 THR N 1 1 32 19560 1 1 20 THR O O 0.947 -3.871 -1.607 1.00 . A A . 20 THR O 1 1 32 19561 1 1 20 THR OG1 O -2.459 -3.622 -3.940 1.00 . A A . 20 THR OG1 1 1 32 19562 1 1 21 THR C C 3.745 -3.001 -2.656 1.00 . A A . 21 THR C 1 1 32 19563 1 1 21 THR CA C 3.405 -4.485 -2.718 1.00 . A A . 21 THR CA 1 1 32 19564 1 1 21 THR CB C 4.496 -5.244 -3.476 1.00 . A A . 21 THR CB 1 1 32 19565 1 1 21 THR CG2 C 5.164 -6.310 -2.637 1.00 . A A . 21 THR CG2 1 1 32 19566 1 1 21 THR H H 2.068 -5.099 -4.239 1.00 . A A . 21 THR H 1 1 32 19567 1 1 21 THR HA H 3.350 -4.869 -1.710 1.00 . A A . 21 THR HA 1 1 32 19568 1 1 21 THR HB H 5.258 -4.545 -3.790 1.00 . A A . 21 THR HB 1 1 32 19569 1 1 21 THR HG1 H 3.387 -6.591 -4.366 1.00 . A A . 21 THR HG1 1 1 32 19570 1 1 21 THR HG21 H 4.410 -6.952 -2.207 1.00 . A A . 21 THR HG21 1 1 32 19571 1 1 21 THR HG22 H 5.826 -6.895 -3.258 1.00 . A A . 21 THR HG22 1 1 32 19572 1 1 21 THR HG23 H 5.731 -5.841 -1.847 1.00 . A A . 21 THR HG23 1 1 32 19573 1 1 21 THR N N 2.107 -4.700 -3.345 1.00 . A A . 21 THR N 1 1 32 19574 1 1 21 THR O O 3.347 -2.224 -3.523 1.00 . A A . 21 THR O 1 1 32 19575 1 1 21 THR OG1 O 3.967 -5.873 -4.630 1.00 . A A . 21 THR OG1 1 1 32 19576 1 1 22 CYS C C 6.128 -0.903 -2.257 1.00 . A A . 22 CYS C 1 1 32 19577 1 1 22 CYS CA C 4.880 -1.225 -1.441 1.00 . A A . 22 CYS CA 1 1 32 19578 1 1 22 CYS CB C 5.134 -0.933 0.040 1.00 . A A . 22 CYS CB 1 1 32 19579 1 1 22 CYS H H 4.770 -3.283 -0.963 1.00 . A A . 22 CYS H 1 1 32 19580 1 1 22 CYS HA H 4.069 -0.604 -1.787 1.00 . A A . 22 CYS HA 1 1 32 19581 1 1 22 CYS HB2 H 4.668 -1.704 0.636 1.00 . A A . 22 CYS HB2 1 1 32 19582 1 1 22 CYS HB3 H 6.199 -0.938 0.224 1.00 . A A . 22 CYS HB3 1 1 32 19583 1 1 22 CYS N N 4.484 -2.615 -1.621 1.00 . A A . 22 CYS N 1 1 32 19584 1 1 22 CYS O O 6.309 0.225 -2.715 1.00 . A A . 22 CYS O 1 1 32 19585 1 1 22 CYS SG S 4.481 0.671 0.605 1.00 . A A . 22 CYS SG 1 1 32 19586 1 1 23 TRP C C 8.502 -2.951 -4.060 1.00 . A A . 23 TRP C 1 1 32 19587 1 1 23 TRP CA C 8.216 -1.727 -3.199 1.00 . A A . 23 TRP CA 1 1 32 19588 1 1 23 TRP CB C 9.392 -1.465 -2.256 1.00 . A A . 23 TRP CB 1 1 32 19589 1 1 23 TRP CD1 C 10.265 0.398 -3.784 1.00 . A A . 23 TRP CD1 1 1 32 19590 1 1 23 TRP CD2 C 11.848 -0.606 -2.561 1.00 . A A . 23 TRP CD2 1 1 32 19591 1 1 23 TRP CE2 C 12.455 0.390 -3.350 1.00 . A A . 23 TRP CE2 1 1 32 19592 1 1 23 TRP CE3 C 12.650 -1.370 -1.708 1.00 . A A . 23 TRP CE3 1 1 32 19593 1 1 23 TRP CG C 10.447 -0.584 -2.853 1.00 . A A . 23 TRP CG 1 1 32 19594 1 1 23 TRP CH2 C 14.584 -0.123 -2.467 1.00 . A A . 23 TRP CH2 1 1 32 19595 1 1 23 TRP CZ2 C 13.824 0.640 -3.311 1.00 . A A . 23 TRP CZ2 1 1 32 19596 1 1 23 TRP CZ3 C 14.009 -1.121 -1.670 1.00 . A A . 23 TRP CZ3 1 1 32 19597 1 1 23 TRP H H 6.785 -2.780 -2.048 1.00 . A A . 23 TRP H 1 1 32 19598 1 1 23 TRP HA H 8.087 -0.875 -3.843 1.00 . A A . 23 TRP HA 1 1 32 19599 1 1 23 TRP HB2 H 9.026 -0.986 -1.360 1.00 . A A . 23 TRP HB2 1 1 32 19600 1 1 23 TRP HB3 H 9.851 -2.407 -1.994 1.00 . A A . 23 TRP HB3 1 1 32 19601 1 1 23 TRP HD1 H 9.308 0.662 -4.211 1.00 . A A . 23 TRP HD1 1 1 32 19602 1 1 23 TRP HE1 H 11.597 1.719 -4.728 1.00 . A A . 23 TRP HE1 1 1 32 19603 1 1 23 TRP HE3 H 12.224 -2.144 -1.086 1.00 . A A . 23 TRP HE3 1 1 32 19604 1 1 23 TRP HH2 H 15.651 0.036 -2.406 1.00 . A A . 23 TRP HH2 1 1 32 19605 1 1 23 TRP HZ2 H 14.283 1.405 -3.919 1.00 . A A . 23 TRP HZ2 1 1 32 19606 1 1 23 TRP HZ3 H 14.644 -1.702 -1.018 1.00 . A A . 23 TRP HZ3 1 1 32 19607 1 1 23 TRP N N 6.985 -1.903 -2.437 1.00 . A A . 23 TRP N 1 1 32 19608 1 1 23 TRP NE1 N 11.467 0.989 -4.088 1.00 . A A . 23 TRP NE1 1 1 32 19609 1 1 23 TRP O O 8.464 -2.884 -5.288 1.00 . A A . 23 TRP O 1 1 32 19610 1 1 24 ARG C C 10.313 -5.162 -4.989 1.00 . A A . 24 ARG C 1 1 32 19611 1 1 24 ARG CA C 9.083 -5.313 -4.100 1.00 . A A . 24 ARG CA 1 1 32 19612 1 1 24 ARG CB C 7.882 -5.747 -4.941 1.00 . A A . 24 ARG CB 1 1 32 19613 1 1 24 ARG CD C 6.685 -7.630 -6.098 1.00 . A A . 24 ARG CD 1 1 32 19614 1 1 24 ARG CG C 7.750 -7.255 -5.080 1.00 . A A . 24 ARG CG 1 1 32 19615 1 1 24 ARG CZ C 7.877 -9.068 -7.705 1.00 . A A . 24 ARG CZ 1 1 32 19616 1 1 24 ARG H H 8.802 -4.049 -2.425 1.00 . A A . 24 ARG H 1 1 32 19617 1 1 24 ARG HA H 9.282 -6.069 -3.355 1.00 . A A . 24 ARG HA 1 1 32 19618 1 1 24 ARG HB2 H 6.980 -5.370 -4.483 1.00 . A A . 24 ARG HB2 1 1 32 19619 1 1 24 ARG HB3 H 7.977 -5.324 -5.930 1.00 . A A . 24 ARG HB3 1 1 32 19620 1 1 24 ARG HD2 H 5.732 -7.697 -5.594 1.00 . A A . 24 ARG HD2 1 1 32 19621 1 1 24 ARG HD3 H 6.639 -6.859 -6.852 1.00 . A A . 24 ARG HD3 1 1 32 19622 1 1 24 ARG HE H 6.461 -9.691 -6.445 1.00 . A A . 24 ARG HE 1 1 32 19623 1 1 24 ARG HG2 H 8.698 -7.662 -5.400 1.00 . A A . 24 ARG HG2 1 1 32 19624 1 1 24 ARG HG3 H 7.482 -7.673 -4.120 1.00 . A A . 24 ARG HG3 1 1 32 19625 1 1 24 ARG HH11 H 8.443 -7.126 -7.738 1.00 . A A . 24 ARG HH11 1 1 32 19626 1 1 24 ARG HH12 H 9.266 -8.158 -8.859 1.00 . A A . 24 ARG HH12 1 1 32 19627 1 1 24 ARG HH21 H 7.542 -11.050 -7.918 1.00 . A A . 24 ARG HH21 1 1 32 19628 1 1 24 ARG HH22 H 8.755 -10.385 -8.962 1.00 . A A . 24 ARG HH22 1 1 32 19629 1 1 24 ARG N N 8.788 -4.066 -3.403 1.00 . A A . 24 ARG N 1 1 32 19630 1 1 24 ARG NE N 6.971 -8.909 -6.743 1.00 . A A . 24 ARG NE 1 1 32 19631 1 1 24 ARG NH1 N 8.586 -8.032 -8.136 1.00 . A A . 24 ARG NH1 1 1 32 19632 1 1 24 ARG NH2 N 8.074 -10.266 -8.239 1.00 . A A . 24 ARG NH2 1 1 32 19633 1 1 24 ARG O O 10.262 -4.508 -6.031 1.00 . A A . 24 ARG O 1 1 32 19634 1 1 25 THR C C 13.494 -6.965 -5.117 1.00 . A A . 25 THR C 1 1 32 19635 1 1 25 THR CA C 12.662 -5.704 -5.328 1.00 . A A . 25 THR CA 1 1 32 19636 1 1 25 THR CB C 13.468 -4.471 -4.917 1.00 . A A . 25 THR CB 1 1 32 19637 1 1 25 THR CG2 C 12.814 -3.167 -5.318 1.00 . A A . 25 THR CG2 1 1 32 19638 1 1 25 THR H H 11.396 -6.277 -3.731 1.00 . A A . 25 THR H 1 1 32 19639 1 1 25 THR HA H 12.408 -5.626 -6.374 1.00 . A A . 25 THR HA 1 1 32 19640 1 1 25 THR HB H 14.438 -4.514 -5.391 1.00 . A A . 25 THR HB 1 1 32 19641 1 1 25 THR HG1 H 14.600 -4.405 -3.320 1.00 . A A . 25 THR HG1 1 1 32 19642 1 1 25 THR HG21 H 12.426 -3.253 -6.323 1.00 . A A . 25 THR HG21 1 1 32 19643 1 1 25 THR HG22 H 12.005 -2.946 -4.638 1.00 . A A . 25 THR HG22 1 1 32 19644 1 1 25 THR HG23 H 13.543 -2.372 -5.281 1.00 . A A . 25 THR HG23 1 1 32 19645 1 1 25 THR N N 11.418 -5.771 -4.570 1.00 . A A . 25 THR N 1 1 32 19646 1 1 25 THR O O 14.722 -6.906 -5.056 1.00 . A A . 25 THR O 1 1 32 19647 1 1 25 THR OG1 O 13.660 -4.442 -3.514 1.00 . A A . 25 THR OG1 1 1 32 19648 1 1 26 SER C C 13.910 -9.559 -3.346 1.00 . A A . 26 SER C 1 1 32 19649 1 1 26 SER CA C 13.480 -9.392 -4.798 1.00 . A A . 26 SER CA 1 1 32 19650 1 1 26 SER CB C 14.693 -9.533 -5.723 1.00 . A A . 26 SER CB 1 1 32 19651 1 1 26 SER H H 11.838 -8.081 -5.060 1.00 . A A . 26 SER H 1 1 32 19652 1 1 26 SER HA H 12.770 -10.166 -5.034 1.00 . A A . 26 SER HA 1 1 32 19653 1 1 26 SER HB2 H 14.452 -9.127 -6.694 1.00 . A A . 26 SER HB2 1 1 32 19654 1 1 26 SER HB3 H 15.528 -8.991 -5.304 1.00 . A A . 26 SER HB3 1 1 32 19655 1 1 26 SER HG H 14.274 -11.424 -6.019 1.00 . A A . 26 SER HG 1 1 32 19656 1 1 26 SER N N 12.815 -8.105 -5.005 1.00 . A A . 26 SER N 1 1 32 19657 1 1 26 SER O O 13.534 -10.525 -2.682 1.00 . A A . 26 SER O 1 1 32 19658 1 1 26 SER OG O 15.061 -10.893 -5.877 1.00 . A A . 26 SER OG 1 1 32 19659 1 1 27 VAL C C 14.148 -8.082 -0.522 1.00 . A A . 27 VAL C 1 1 32 19660 1 1 27 VAL CA C 15.185 -8.647 -1.487 1.00 . A A . 27 VAL CA 1 1 32 19661 1 1 27 VAL CB C 16.496 -7.855 -1.334 1.00 . A A . 27 VAL CB 1 1 32 19662 1 1 27 VAL CG1 C 17.092 -8.069 0.049 1.00 . A A . 27 VAL CG1 1 1 32 19663 1 1 27 VAL CG2 C 17.488 -8.249 -2.417 1.00 . A A . 27 VAL CG2 1 1 32 19664 1 1 27 VAL H H 14.961 -7.870 -3.442 1.00 . A A . 27 VAL H 1 1 32 19665 1 1 27 VAL HA H 15.379 -9.678 -1.228 1.00 . A A . 27 VAL HA 1 1 32 19666 1 1 27 VAL HB H 16.273 -6.804 -1.445 1.00 . A A . 27 VAL HB 1 1 32 19667 1 1 27 VAL HG11 H 16.307 -8.329 0.743 1.00 . A A . 27 VAL HG11 1 1 32 19668 1 1 27 VAL HG12 H 17.817 -8.869 0.009 1.00 . A A . 27 VAL HG12 1 1 32 19669 1 1 27 VAL HG13 H 17.577 -7.161 0.377 1.00 . A A . 27 VAL HG13 1 1 32 19670 1 1 27 VAL HG21 H 16.991 -8.257 -3.375 1.00 . A A . 27 VAL HG21 1 1 32 19671 1 1 27 VAL HG22 H 18.300 -7.537 -2.439 1.00 . A A . 27 VAL HG22 1 1 32 19672 1 1 27 VAL HG23 H 17.879 -9.234 -2.206 1.00 . A A . 27 VAL HG23 1 1 32 19673 1 1 27 VAL N N 14.699 -8.611 -2.861 1.00 . A A . 27 VAL N 1 1 32 19674 1 1 27 VAL O O 14.070 -8.498 0.634 1.00 . A A . 27 VAL O 1 1 32 19675 1 1 28 SER C C 10.935 -6.750 -0.777 1.00 . A A . 28 SER C 1 1 32 19676 1 1 28 SER CA C 12.320 -6.509 -0.184 1.00 . A A . 28 SER CA 1 1 32 19677 1 1 28 SER CB C 12.578 -5.007 -0.056 1.00 . A A . 28 SER CB 1 1 32 19678 1 1 28 SER H H 13.464 -6.843 -1.934 1.00 . A A . 28 SER H 1 1 32 19679 1 1 28 SER HA H 12.362 -6.957 0.797 1.00 . A A . 28 SER HA 1 1 32 19680 1 1 28 SER HB2 H 11.850 -4.574 0.612 1.00 . A A . 28 SER HB2 1 1 32 19681 1 1 28 SER HB3 H 13.570 -4.847 0.340 1.00 . A A . 28 SER HB3 1 1 32 19682 1 1 28 SER HG H 13.303 -3.906 -1.506 1.00 . A A . 28 SER HG 1 1 32 19683 1 1 28 SER N N 13.353 -7.132 -1.005 1.00 . A A . 28 SER N 1 1 32 19684 1 1 28 SER O O 10.801 -7.058 -1.961 1.00 . A A . 28 SER O 1 1 32 19685 1 1 28 SER OG O 12.481 -4.363 -1.315 1.00 . A A . 28 SER OG 1 1 32 19686 1 1 29 SER C C 7.552 -6.510 0.743 1.00 . A A . 29 SER C 1 1 32 19687 1 1 29 SER CA C 8.533 -6.810 -0.385 1.00 . A A . 29 SER CA 1 1 32 19688 1 1 29 SER CB C 8.339 -8.245 -0.878 1.00 . A A . 29 SER CB 1 1 32 19689 1 1 29 SER H H 10.081 -6.361 0.988 1.00 . A A . 29 SER H 1 1 32 19690 1 1 29 SER HA H 8.344 -6.129 -1.202 1.00 . A A . 29 SER HA 1 1 32 19691 1 1 29 SER HB2 H 7.287 -8.489 -0.863 1.00 . A A . 29 SER HB2 1 1 32 19692 1 1 29 SER HB3 H 8.714 -8.331 -1.887 1.00 . A A . 29 SER HB3 1 1 32 19693 1 1 29 SER HG H 9.313 -9.918 -0.579 1.00 . A A . 29 SER HG 1 1 32 19694 1 1 29 SER N N 9.909 -6.608 0.056 1.00 . A A . 29 SER N 1 1 32 19695 1 1 29 SER O O 7.568 -7.166 1.785 1.00 . A A . 29 SER O 1 1 32 19696 1 1 29 SER OG O 9.031 -9.166 -0.053 1.00 . A A . 29 SER OG 1 1 32 19697 1 1 30 HIS C C 4.304 -5.125 0.933 1.00 . A A . 30 HIS C 1 1 32 19698 1 1 30 HIS CA C 5.709 -5.127 1.528 1.00 . A A . 30 HIS CA 1 1 32 19699 1 1 30 HIS CB C 6.037 -3.743 2.091 1.00 . A A . 30 HIS CB 1 1 32 19700 1 1 30 HIS CD2 C 8.594 -4.060 2.398 1.00 . A A . 30 HIS CD2 1 1 32 19701 1 1 30 HIS CE1 C 8.773 -3.260 4.432 1.00 . A A . 30 HIS CE1 1 1 32 19702 1 1 30 HIS CG C 7.356 -3.682 2.798 1.00 . A A . 30 HIS CG 1 1 32 19703 1 1 30 HIS H H 6.734 -5.028 -0.322 1.00 . A A . 30 HIS H 1 1 32 19704 1 1 30 HIS HA H 5.746 -5.850 2.329 1.00 . A A . 30 HIS HA 1 1 32 19705 1 1 30 HIS HB2 H 6.062 -3.029 1.282 1.00 . A A . 30 HIS HB2 1 1 32 19706 1 1 30 HIS HB3 H 5.269 -3.457 2.795 1.00 . A A . 30 HIS HB3 1 1 32 19707 1 1 30 HIS HD1 H 6.783 -2.832 4.639 1.00 . A A . 30 HIS HD1 1 1 32 19708 1 1 30 HIS HD2 H 8.854 -4.494 1.444 1.00 . A A . 30 HIS HD2 1 1 32 19709 1 1 30 HIS HE1 H 9.184 -2.944 5.380 1.00 . A A . 30 HIS HE1 1 1 32 19710 1 1 30 HIS HE2 H 10.403 -4.035 3.463 1.00 . A A . 30 HIS HE2 1 1 32 19711 1 1 30 HIS N N 6.698 -5.514 0.529 1.00 . A A . 30 HIS N 1 1 32 19712 1 1 30 HIS ND1 N 7.503 -3.186 4.076 1.00 . A A . 30 HIS ND1 1 1 32 19713 1 1 30 HIS NE2 N 9.456 -3.787 3.432 1.00 . A A . 30 HIS NE2 1 1 32 19714 1 1 30 HIS O O 3.847 -4.115 0.398 1.00 . A A . 30 HIS O 1 1 32 19715 1 1 31 TYR C C 1.293 -5.531 1.298 1.00 . A A . 31 TYR C 1 1 32 19716 1 1 31 TYR CA C 2.270 -6.391 0.503 1.00 . A A . 31 TYR CA 1 1 32 19717 1 1 31 TYR CB C 1.824 -7.854 0.538 1.00 . A A . 31 TYR CB 1 1 32 19718 1 1 31 TYR CD1 C 2.732 -8.796 -1.622 1.00 . A A . 31 TYR CD1 1 1 32 19719 1 1 31 TYR CD2 C 3.597 -9.649 0.429 1.00 . A A . 31 TYR CD2 1 1 32 19720 1 1 31 TYR CE1 C 3.563 -9.644 -2.330 1.00 . A A . 31 TYR CE1 1 1 32 19721 1 1 31 TYR CE2 C 4.431 -10.499 -0.271 1.00 . A A . 31 TYR CE2 1 1 32 19722 1 1 31 TYR CG C 2.735 -8.784 -0.233 1.00 . A A . 31 TYR CG 1 1 32 19723 1 1 31 TYR CZ C 4.410 -10.493 -1.650 1.00 . A A . 31 TYR CZ 1 1 32 19724 1 1 31 TYR H H 4.041 -7.033 1.469 1.00 . A A . 31 TYR H 1 1 32 19725 1 1 31 TYR HA H 2.280 -6.051 -0.521 1.00 . A A . 31 TYR HA 1 1 32 19726 1 1 31 TYR HB2 H 1.798 -8.191 1.563 1.00 . A A . 31 TYR HB2 1 1 32 19727 1 1 31 TYR HB3 H 0.834 -7.931 0.113 1.00 . A A . 31 TYR HB3 1 1 32 19728 1 1 31 TYR HD1 H 2.068 -8.129 -2.151 1.00 . A A . 31 TYR HD1 1 1 32 19729 1 1 31 TYR HD2 H 3.611 -9.652 1.509 1.00 . A A . 31 TYR HD2 1 1 32 19730 1 1 31 TYR HE1 H 3.546 -9.638 -3.410 1.00 . A A . 31 TYR HE1 1 1 32 19731 1 1 31 TYR HE2 H 5.094 -11.165 0.261 1.00 . A A . 31 TYR HE2 1 1 32 19732 1 1 31 TYR HH H 4.762 -12.141 -2.576 1.00 . A A . 31 TYR HH 1 1 32 19733 1 1 31 TYR N N 3.624 -6.262 1.031 1.00 . A A . 31 TYR N 1 1 32 19734 1 1 31 TYR O O 1.460 -5.337 2.502 1.00 . A A . 31 TYR O 1 1 32 19735 1 1 31 TYR OH O 5.238 -11.339 -2.351 1.00 . A A . 31 TYR OH 1 1 32 19736 1 1 32 CYS C C -1.787 -5.032 1.950 1.00 . A A . 32 CYS C 1 1 32 19737 1 1 32 CYS CA C -0.729 -4.180 1.260 1.00 . A A . 32 CYS CA 1 1 32 19738 1 1 32 CYS CB C -1.390 -3.257 0.235 1.00 . A A . 32 CYS CB 1 1 32 19739 1 1 32 CYS H H 0.194 -5.208 -0.341 1.00 . A A . 32 CYS H 1 1 32 19740 1 1 32 CYS HA H -0.229 -3.577 2.004 1.00 . A A . 32 CYS HA 1 1 32 19741 1 1 32 CYS HB2 H -0.629 -2.845 -0.410 1.00 . A A . 32 CYS HB2 1 1 32 19742 1 1 32 CYS HB3 H -2.085 -3.831 -0.359 1.00 . A A . 32 CYS HB3 1 1 32 19743 1 1 32 CYS N N 0.274 -5.018 0.617 1.00 . A A . 32 CYS N 1 1 32 19744 1 1 32 CYS O O -2.287 -6.002 1.380 1.00 . A A . 32 CYS O 1 1 32 19745 1 1 32 CYS SG S -2.305 -1.863 0.970 1.00 . A A . 32 CYS SG 1 1 32 19746 1 1 33 THR C C -4.532 -5.147 3.405 1.00 . A A . 33 THR C 1 1 32 19747 1 1 33 THR CA C -3.126 -5.392 3.951 1.00 . A A . 33 THR CA 1 1 32 19748 1 1 33 THR CB C -3.064 -4.977 5.421 1.00 . A A . 33 THR CB 1 1 32 19749 1 1 33 THR CG2 C -3.065 -3.476 5.616 1.00 . A A . 33 THR CG2 1 1 32 19750 1 1 33 THR H H -1.691 -3.880 3.580 1.00 . A A . 33 THR H 1 1 32 19751 1 1 33 THR HA H -2.901 -6.445 3.874 1.00 . A A . 33 THR HA 1 1 32 19752 1 1 33 THR HB H -2.155 -5.367 5.857 1.00 . A A . 33 THR HB 1 1 32 19753 1 1 33 THR HG1 H -4.970 -5.059 5.863 1.00 . A A . 33 THR HG1 1 1 32 19754 1 1 33 THR HG21 H -3.305 -2.993 4.680 1.00 . A A . 33 THR HG21 1 1 32 19755 1 1 33 THR HG22 H -3.802 -3.210 6.359 1.00 . A A . 33 THR HG22 1 1 32 19756 1 1 33 THR HG23 H -2.088 -3.155 5.946 1.00 . A A . 33 THR HG23 1 1 32 19757 1 1 33 THR N N -2.125 -4.663 3.180 1.00 . A A . 33 THR N 1 1 32 19758 1 1 33 THR O O -5.487 -5.806 3.815 1.00 . A A . 33 THR O 1 1 32 19759 1 1 33 THR OG1 O -4.165 -5.505 6.138 1.00 . A A . 33 THR OG1 1 1 32 19760 1 1 34 GLY C C -6.900 -3.277 2.921 1.00 . A A . 34 GLY C 1 1 32 19761 1 1 34 GLY CA C -5.952 -3.889 1.908 1.00 . A A . 34 GLY CA 1 1 32 19762 1 1 34 GLY H H -3.864 -3.697 2.191 1.00 . A A . 34 GLY H 1 1 32 19763 1 1 34 GLY HA2 H -6.389 -4.799 1.526 1.00 . A A . 34 GLY HA2 1 1 32 19764 1 1 34 GLY HA3 H -5.817 -3.195 1.091 1.00 . A A . 34 GLY HA3 1 1 32 19765 1 1 34 GLY N N -4.656 -4.195 2.482 1.00 . A A . 34 GLY N 1 1 32 19766 1 1 34 GLY O O -8.100 -3.550 2.902 1.00 . A A . 34 GLY O 1 1 32 19767 1 1 35 ARG C C -7.120 -0.277 4.685 1.00 . A A . 35 ARG C 1 1 32 19768 1 1 35 ARG CA C -7.164 -1.795 4.836 1.00 . A A . 35 ARG CA 1 1 32 19769 1 1 35 ARG CB C -6.672 -2.194 6.228 1.00 . A A . 35 ARG CB 1 1 32 19770 1 1 35 ARG CD C -7.517 -3.375 8.279 1.00 . A A . 35 ARG CD 1 1 32 19771 1 1 35 ARG CG C -7.336 -3.449 6.771 1.00 . A A . 35 ARG CG 1 1 32 19772 1 1 35 ARG CZ C -9.963 -3.437 8.567 1.00 . A A . 35 ARG CZ 1 1 32 19773 1 1 35 ARG H H -5.396 -2.271 3.772 1.00 . A A . 35 ARG H 1 1 32 19774 1 1 35 ARG HA H -8.183 -2.125 4.717 1.00 . A A . 35 ARG HA 1 1 32 19775 1 1 35 ARG HB2 H -5.606 -2.367 6.185 1.00 . A A . 35 ARG HB2 1 1 32 19776 1 1 35 ARG HB3 H -6.868 -1.383 6.913 1.00 . A A . 35 ARG HB3 1 1 32 19777 1 1 35 ARG HD2 H -6.689 -3.881 8.753 1.00 . A A . 35 ARG HD2 1 1 32 19778 1 1 35 ARG HD3 H -7.521 -2.337 8.578 1.00 . A A . 35 ARG HD3 1 1 32 19779 1 1 35 ARG HE H -8.707 -4.881 9.134 1.00 . A A . 35 ARG HE 1 1 32 19780 1 1 35 ARG HG2 H -8.305 -3.560 6.308 1.00 . A A . 35 ARG HG2 1 1 32 19781 1 1 35 ARG HG3 H -6.720 -4.303 6.533 1.00 . A A . 35 ARG HG3 1 1 32 19782 1 1 35 ARG HH11 H -9.267 -1.758 7.680 1.00 . A A . 35 ARG HH11 1 1 32 19783 1 1 35 ARG HH12 H -10.984 -1.827 7.894 1.00 . A A . 35 ARG HH12 1 1 32 19784 1 1 35 ARG HH21 H -10.965 -4.973 9.416 1.00 . A A . 35 ARG HH21 1 1 32 19785 1 1 35 ARG HH22 H -11.948 -3.652 8.879 1.00 . A A . 35 ARG HH22 1 1 32 19786 1 1 35 ARG N N -6.359 -2.447 3.808 1.00 . A A . 35 ARG N 1 1 32 19787 1 1 35 ARG NE N -8.765 -3.998 8.712 1.00 . A A . 35 ARG NE 1 1 32 19788 1 1 35 ARG NH1 N -10.080 -2.243 8.000 1.00 . A A . 35 ARG NH1 1 1 32 19789 1 1 35 ARG NH2 N -11.048 -4.073 8.988 1.00 . A A . 35 ARG NH2 1 1 32 19790 1 1 35 ARG O O -8.124 0.406 4.891 1.00 . A A . 35 ARG O 1 1 32 19791 1 1 36 SER C C -4.526 1.985 3.334 1.00 . A A . 36 SER C 1 1 32 19792 1 1 36 SER CA C -5.779 1.682 4.149 1.00 . A A . 36 SER CA 1 1 32 19793 1 1 36 SER CB C -5.697 2.378 5.509 1.00 . A A . 36 SER CB 1 1 32 19794 1 1 36 SER H H -5.190 -0.353 4.178 1.00 . A A . 36 SER H 1 1 32 19795 1 1 36 SER HA H -6.639 2.056 3.615 1.00 . A A . 36 SER HA 1 1 32 19796 1 1 36 SER HB2 H -5.437 3.416 5.365 1.00 . A A . 36 SER HB2 1 1 32 19797 1 1 36 SER HB3 H -6.655 2.312 6.003 1.00 . A A . 36 SER HB3 1 1 32 19798 1 1 36 SER HG H -5.012 1.786 7.246 1.00 . A A . 36 SER HG 1 1 32 19799 1 1 36 SER N N -5.953 0.244 4.326 1.00 . A A . 36 SER N 1 1 32 19800 1 1 36 SER O O -3.736 1.089 3.036 1.00 . A A . 36 SER O 1 1 32 19801 1 1 36 SER OG O -4.716 1.773 6.333 1.00 . A A . 36 SER OG 1 1 32 19802 1 1 37 CYS C C -1.922 3.659 3.049 1.00 . A A . 37 CYS C 1 1 32 19803 1 1 37 CYS CA C -3.190 3.673 2.198 1.00 . A A . 37 CYS CA 1 1 32 19804 1 1 37 CYS CB C -3.411 5.071 1.619 1.00 . A A . 37 CYS CB 1 1 32 19805 1 1 37 CYS H H -5.012 3.923 3.245 1.00 . A A . 37 CYS H 1 1 32 19806 1 1 37 CYS HA H -3.069 2.973 1.385 1.00 . A A . 37 CYS HA 1 1 32 19807 1 1 37 CYS HB2 H -4.395 5.121 1.180 1.00 . A A . 37 CYS HB2 1 1 32 19808 1 1 37 CYS HB3 H -3.341 5.797 2.415 1.00 . A A . 37 CYS HB3 1 1 32 19809 1 1 37 CYS N N -4.349 3.253 2.977 1.00 . A A . 37 CYS N 1 1 32 19810 1 1 37 CYS O O -0.811 3.610 2.521 1.00 . A A . 37 CYS O 1 1 32 19811 1 1 37 CYS SG S -2.205 5.538 0.335 1.00 . A A . 37 CYS SG 1 1 32 19812 1 1 38 GLU C C -0.156 2.406 5.141 1.00 . A A . 38 GLU C 1 1 32 19813 1 1 38 GLU CA C -0.958 3.696 5.283 1.00 . A A . 38 GLU CA 1 1 32 19814 1 1 38 GLU CB C -1.440 3.855 6.726 1.00 . A A . 38 GLU CB 1 1 32 19815 1 1 38 GLU CD C -0.379 6.067 7.329 1.00 . A A . 38 GLU CD 1 1 32 19816 1 1 38 GLU CG C -1.673 5.301 7.134 1.00 . A A . 38 GLU CG 1 1 32 19817 1 1 38 GLU H H -3.001 3.743 4.732 1.00 . A A . 38 GLU H 1 1 32 19818 1 1 38 GLU HA H -0.322 4.531 5.030 1.00 . A A . 38 GLU HA 1 1 32 19819 1 1 38 GLU HB2 H -2.368 3.316 6.845 1.00 . A A . 38 GLU HB2 1 1 32 19820 1 1 38 GLU HB3 H -0.700 3.431 7.389 1.00 . A A . 38 GLU HB3 1 1 32 19821 1 1 38 GLU HG2 H -2.249 5.790 6.363 1.00 . A A . 38 GLU HG2 1 1 32 19822 1 1 38 GLU HG3 H -2.226 5.315 8.061 1.00 . A A . 38 GLU HG3 1 1 32 19823 1 1 38 GLU N N -2.093 3.704 4.367 1.00 . A A . 38 GLU N 1 1 32 19824 1 1 38 GLU O O -0.405 1.428 5.847 1.00 . A A . 38 GLU O 1 1 32 19825 1 1 38 GLU OE1 O 0.652 5.646 6.762 1.00 . A A . 38 GLU OE1 1 1 32 19826 1 1 38 GLU OE2 O -0.396 7.087 8.049 1.00 . A A . 38 GLU OE2 1 1 32 19827 1 1 39 CYS C C 2.380 0.831 5.263 1.00 . A A . 39 CYS C 1 1 32 19828 1 1 39 CYS CA C 1.644 1.240 3.988 1.00 . A A . 39 CYS CA 1 1 32 19829 1 1 39 CYS CB C 2.651 1.525 2.871 1.00 . A A . 39 CYS CB 1 1 32 19830 1 1 39 CYS H H 0.955 3.220 3.692 1.00 . A A . 39 CYS H 1 1 32 19831 1 1 39 CYS HA H 1.000 0.430 3.682 1.00 . A A . 39 CYS HA 1 1 32 19832 1 1 39 CYS HB2 H 2.340 2.408 2.334 1.00 . A A . 39 CYS HB2 1 1 32 19833 1 1 39 CYS HB3 H 3.623 1.699 3.308 1.00 . A A . 39 CYS HB3 1 1 32 19834 1 1 39 CYS N N 0.806 2.411 4.224 1.00 . A A . 39 CYS N 1 1 32 19835 1 1 39 CYS O O 2.763 1.680 6.068 1.00 . A A . 39 CYS O 1 1 32 19836 1 1 39 CYS SG S 2.820 0.173 1.661 1.00 . A A . 39 CYS SG 1 1 32 19837 1 1 40 PRO C C 4.642 -0.337 6.858 1.00 . A A . 40 PRO C 1 1 32 19838 1 1 40 PRO CA C 3.284 -0.998 6.649 1.00 . A A . 40 PRO CA 1 1 32 19839 1 1 40 PRO CB C 3.456 -2.488 6.344 1.00 . A A . 40 PRO CB 1 1 32 19840 1 1 40 PRO CD C 2.167 -1.566 4.556 1.00 . A A . 40 PRO CD 1 1 32 19841 1 1 40 PRO CG C 2.367 -2.807 5.380 1.00 . A A . 40 PRO CG 1 1 32 19842 1 1 40 PRO HA H 2.686 -0.878 7.541 1.00 . A A . 40 PRO HA 1 1 32 19843 1 1 40 PRO HB2 H 4.431 -2.658 5.910 1.00 . A A . 40 PRO HB2 1 1 32 19844 1 1 40 PRO HB3 H 3.356 -3.060 7.254 1.00 . A A . 40 PRO HB3 1 1 32 19845 1 1 40 PRO HD2 H 2.789 -1.594 3.674 1.00 . A A . 40 PRO HD2 1 1 32 19846 1 1 40 PRO HD3 H 1.128 -1.457 4.284 1.00 . A A . 40 PRO HD3 1 1 32 19847 1 1 40 PRO HG2 H 2.664 -3.632 4.750 1.00 . A A . 40 PRO HG2 1 1 32 19848 1 1 40 PRO HG3 H 1.461 -3.050 5.916 1.00 . A A . 40 PRO HG3 1 1 32 19849 1 1 40 PRO N N 2.589 -0.483 5.465 1.00 . A A . 40 PRO N 1 1 32 19850 1 1 40 PRO O O 5.182 0.294 5.950 1.00 . A A . 40 PRO O 1 1 32 19851 1 1 41 SER C C 7.544 -0.992 8.546 1.00 . A A . 41 SER C 1 1 32 19852 1 1 41 SER CA C 6.485 0.094 8.389 1.00 . A A . 41 SER CA 1 1 32 19853 1 1 41 SER CB C 6.386 0.917 9.675 1.00 . A A . 41 SER CB 1 1 32 19854 1 1 41 SER H H 4.709 -1.002 8.742 1.00 . A A . 41 SER H 1 1 32 19855 1 1 41 SER HA H 6.771 0.746 7.577 1.00 . A A . 41 SER HA 1 1 32 19856 1 1 41 SER HB2 H 7.379 1.178 10.010 1.00 . A A . 41 SER HB2 1 1 32 19857 1 1 41 SER HB3 H 5.823 1.818 9.482 1.00 . A A . 41 SER HB3 1 1 32 19858 1 1 41 SER HG H 5.072 0.737 11.117 1.00 . A A . 41 SER HG 1 1 32 19859 1 1 41 SER N N 5.188 -0.487 8.060 1.00 . A A . 41 SER N 1 1 32 19860 1 1 41 SER O O 8.722 -0.768 8.267 1.00 . A A . 41 SER O 1 1 32 19861 1 1 41 SER OG O 5.738 0.185 10.701 1.00 . A A . 41 SER OG 1 1 32 19862 1 1 42 TYR C C 8.240 -4.052 7.882 1.00 . A A . 42 TYR C 1 1 32 19863 1 1 42 TYR CA C 8.030 -3.289 9.188 1.00 . A A . 42 TYR CA 1 1 32 19864 1 1 42 TYR CB C 7.492 -4.233 10.264 1.00 . A A . 42 TYR CB 1 1 32 19865 1 1 42 TYR CD1 C 5.701 -5.695 9.247 1.00 . A A . 42 TYR CD1 1 1 32 19866 1 1 42 TYR CD2 C 5.022 -3.920 10.686 1.00 . A A . 42 TYR CD2 1 1 32 19867 1 1 42 TYR CE1 C 4.380 -6.054 9.060 1.00 . A A . 42 TYR CE1 1 1 32 19868 1 1 42 TYR CE2 C 3.698 -4.273 10.504 1.00 . A A . 42 TYR CE2 1 1 32 19869 1 1 42 TYR CG C 6.044 -4.623 10.062 1.00 . A A . 42 TYR CG 1 1 32 19870 1 1 42 TYR CZ C 3.383 -5.341 9.690 1.00 . A A . 42 TYR CZ 1 1 32 19871 1 1 42 TYR H H 6.167 -2.285 9.199 1.00 . A A . 42 TYR H 1 1 32 19872 1 1 42 TYR HA H 8.979 -2.890 9.513 1.00 . A A . 42 TYR HA 1 1 32 19873 1 1 42 TYR HB2 H 8.081 -5.138 10.267 1.00 . A A . 42 TYR HB2 1 1 32 19874 1 1 42 TYR HB3 H 7.575 -3.753 11.228 1.00 . A A . 42 TYR HB3 1 1 32 19875 1 1 42 TYR HD1 H 6.485 -6.251 8.755 1.00 . A A . 42 TYR HD1 1 1 32 19876 1 1 42 TYR HD2 H 5.272 -3.084 11.323 1.00 . A A . 42 TYR HD2 1 1 32 19877 1 1 42 TYR HE1 H 4.133 -6.890 8.422 1.00 . A A . 42 TYR HE1 1 1 32 19878 1 1 42 TYR HE2 H 2.917 -3.714 10.998 1.00 . A A . 42 TYR HE2 1 1 32 19879 1 1 42 TYR HH H 1.671 -5.911 10.354 1.00 . A A . 42 TYR HH 1 1 32 19880 1 1 42 TYR N N 7.118 -2.168 8.994 1.00 . A A . 42 TYR N 1 1 32 19881 1 1 42 TYR O O 7.445 -3.934 6.950 1.00 . A A . 42 TYR O 1 1 32 19882 1 1 42 TYR OH O 2.066 -5.696 9.506 1.00 . A A . 42 TYR OH 1 1 32 19883 1 1 43 PRO C C 8.455 -6.489 6.142 1.00 . A A . 43 PRO C 1 1 32 19884 1 1 43 PRO CA C 9.632 -5.634 6.599 1.00 . A A . 43 PRO CA 1 1 32 19885 1 1 43 PRO CB C 10.795 -6.522 7.046 1.00 . A A . 43 PRO CB 1 1 32 19886 1 1 43 PRO CD C 10.319 -5.047 8.865 1.00 . A A . 43 PRO CD 1 1 32 19887 1 1 43 PRO CG C 11.433 -5.776 8.166 1.00 . A A . 43 PRO CG 1 1 32 19888 1 1 43 PRO HA H 9.951 -5.000 5.785 1.00 . A A . 43 PRO HA 1 1 32 19889 1 1 43 PRO HB2 H 10.416 -7.479 7.373 1.00 . A A . 43 PRO HB2 1 1 32 19890 1 1 43 PRO HB3 H 11.482 -6.662 6.225 1.00 . A A . 43 PRO HB3 1 1 32 19891 1 1 43 PRO HD2 H 9.916 -5.651 9.664 1.00 . A A . 43 PRO HD2 1 1 32 19892 1 1 43 PRO HD3 H 10.669 -4.099 9.245 1.00 . A A . 43 PRO HD3 1 1 32 19893 1 1 43 PRO HG2 H 11.911 -6.469 8.843 1.00 . A A . 43 PRO HG2 1 1 32 19894 1 1 43 PRO HG3 H 12.154 -5.073 7.776 1.00 . A A . 43 PRO HG3 1 1 32 19895 1 1 43 PRO N N 9.320 -4.849 7.799 1.00 . A A . 43 PRO N 1 1 32 19896 1 1 43 PRO O O 7.362 -6.408 6.703 1.00 . A A . 43 PRO O 1 1 32 19897 1 1 44 GLY C C 8.180 -9.382 3.886 1.00 . A A . 44 GLY C 1 1 32 19898 1 1 44 GLY CA C 7.635 -8.166 4.607 1.00 . A A . 44 GLY CA 1 1 32 19899 1 1 44 GLY H H 9.577 -7.329 4.714 1.00 . A A . 44 GLY H 1 1 32 19900 1 1 44 GLY HA2 H 7.025 -7.597 3.921 1.00 . A A . 44 GLY HA2 1 1 32 19901 1 1 44 GLY HA3 H 7.019 -8.496 5.431 1.00 . A A . 44 GLY HA3 1 1 32 19902 1 1 44 GLY N N 8.686 -7.308 5.122 1.00 . A A . 44 GLY N 1 1 32 19903 1 1 44 GLY O O 7.475 -10.412 3.841 1.00 . A A . 44 GLY O 1 1 32 19904 1 1 44 GLY OXT O 9.313 -9.305 3.364 1.00 . A A . 44 GLY OXT 1 1 33 19905 1 1 1 ALA C C -12.322 15.929 0.329 1.00 . A A . 1 ALA C 1 1 33 19906 1 1 1 ALA CA C -12.975 15.621 -1.014 1.00 . A A . 1 ALA CA 1 1 33 19907 1 1 1 ALA CB C -11.962 15.773 -2.139 1.00 . A A . 1 ALA CB 1 1 33 19908 1 1 1 ALA H1 H -14.782 16.414 -0.435 1.00 . A A . 1 ALA H1 1 1 33 19909 1 1 1 ALA H2 H -13.795 17.477 -1.348 1.00 . A A . 1 ALA H2 1 1 33 19910 1 1 1 ALA H3 H -14.610 16.183 -2.127 1.00 . A A . 1 ALA H3 1 1 33 19911 1 1 1 ALA HA H -13.317 14.596 -1.008 1.00 . A A . 1 ALA HA 1 1 33 19912 1 1 1 ALA HB1 H -10.985 15.478 -1.786 1.00 . A A . 1 ALA HB1 1 1 33 19913 1 1 1 ALA HB2 H -11.933 16.804 -2.460 1.00 . A A . 1 ALA HB2 1 1 33 19914 1 1 1 ALA HB3 H -12.250 15.146 -2.970 1.00 . A A . 1 ALA HB3 1 1 33 19915 1 1 1 ALA N N -14.146 16.503 -1.252 1.00 . A A . 1 ALA N 1 1 33 19916 1 1 1 ALA O O -12.022 17.083 0.635 1.00 . A A . 1 ALA O 1 1 33 19917 1 1 2 MET C C -10.034 14.586 2.417 1.00 . A A . 2 MET C 1 1 33 19918 1 1 2 MET CA C -11.487 15.049 2.440 1.00 . A A . 2 MET CA 1 1 33 19919 1 1 2 MET CB C -12.269 14.263 3.494 1.00 . A A . 2 MET CB 1 1 33 19920 1 1 2 MET CE C -14.234 17.202 5.637 1.00 . A A . 2 MET CE 1 1 33 19921 1 1 2 MET CG C -13.423 15.042 4.102 1.00 . A A . 2 MET CG 1 1 33 19922 1 1 2 MET H H -12.366 13.993 0.829 1.00 . A A . 2 MET H 1 1 33 19923 1 1 2 MET HA H -11.514 16.098 2.693 1.00 . A A . 2 MET HA 1 1 33 19924 1 1 2 MET HB2 H -12.667 13.369 3.037 1.00 . A A . 2 MET HB2 1 1 33 19925 1 1 2 MET HB3 H -11.595 13.981 4.289 1.00 . A A . 2 MET HB3 1 1 33 19926 1 1 2 MET HE1 H -15.036 16.918 4.972 1.00 . A A . 2 MET HE1 1 1 33 19927 1 1 2 MET HE2 H -14.611 17.276 6.646 1.00 . A A . 2 MET HE2 1 1 33 19928 1 1 2 MET HE3 H -13.835 18.158 5.331 1.00 . A A . 2 MET HE3 1 1 33 19929 1 1 2 MET HG2 H -13.798 15.737 3.365 1.00 . A A . 2 MET HG2 1 1 33 19930 1 1 2 MET HG3 H -14.206 14.348 4.371 1.00 . A A . 2 MET HG3 1 1 33 19931 1 1 2 MET N N -12.105 14.889 1.128 1.00 . A A . 2 MET N 1 1 33 19932 1 1 2 MET O O -9.186 15.134 3.121 1.00 . A A . 2 MET O 1 1 33 19933 1 1 2 MET SD S -12.939 15.966 5.572 1.00 . A A . 2 MET SD 1 1 33 19934 1 1 3 ASP C C -8.334 11.964 0.406 1.00 . A A . 3 ASP C 1 1 33 19935 1 1 3 ASP CA C -8.403 13.036 1.488 1.00 . A A . 3 ASP CA 1 1 33 19936 1 1 3 ASP CB C -7.948 12.454 2.828 1.00 . A A . 3 ASP CB 1 1 33 19937 1 1 3 ASP CG C -6.472 12.686 3.087 1.00 . A A . 3 ASP CG 1 1 33 19938 1 1 3 ASP H H -10.473 13.177 1.067 1.00 . A A . 3 ASP H 1 1 33 19939 1 1 3 ASP HA H -7.746 13.848 1.217 1.00 . A A . 3 ASP HA 1 1 33 19940 1 1 3 ASP HB2 H -8.511 12.917 3.625 1.00 . A A . 3 ASP HB2 1 1 33 19941 1 1 3 ASP HB3 H -8.133 11.390 2.833 1.00 . A A . 3 ASP HB3 1 1 33 19942 1 1 3 ASP N N -9.754 13.573 1.603 1.00 . A A . 3 ASP N 1 1 33 19943 1 1 3 ASP O O -7.374 11.906 -0.363 1.00 . A A . 3 ASP O 1 1 33 19944 1 1 3 ASP OD1 O -6.018 13.840 2.942 1.00 . A A . 3 ASP OD1 1 1 33 19945 1 1 3 ASP OD2 O -5.771 11.713 3.436 1.00 . A A . 3 ASP OD2 1 1 33 19946 1 1 4 CYS C C -8.330 8.996 -0.403 1.00 . A A . 4 CYS C 1 1 33 19947 1 1 4 CYS CA C -9.423 10.040 -0.635 1.00 . A A . 4 CYS CA 1 1 33 19948 1 1 4 CYS CB C -9.300 10.610 -2.048 1.00 . A A . 4 CYS CB 1 1 33 19949 1 1 4 CYS H H -10.093 11.215 0.995 1.00 . A A . 4 CYS H 1 1 33 19950 1 1 4 CYS HA H -10.385 9.559 -0.537 1.00 . A A . 4 CYS HA 1 1 33 19951 1 1 4 CYS HB2 H -8.775 11.552 -2.003 1.00 . A A . 4 CYS HB2 1 1 33 19952 1 1 4 CYS HB3 H -8.737 9.920 -2.659 1.00 . A A . 4 CYS HB3 1 1 33 19953 1 1 4 CYS N N -9.359 11.116 0.353 1.00 . A A . 4 CYS N 1 1 33 19954 1 1 4 CYS O O -8.127 8.108 -1.231 1.00 . A A . 4 CYS O 1 1 33 19955 1 1 4 CYS SG S -10.898 10.907 -2.872 1.00 . A A . 4 CYS SG 1 1 33 19956 1 1 5 THR C C -5.567 8.039 -0.098 1.00 . A A . 5 THR C 1 1 33 19957 1 1 5 THR CA C -6.563 8.163 1.053 1.00 . A A . 5 THR CA 1 1 33 19958 1 1 5 THR CB C -7.151 6.790 1.385 1.00 . A A . 5 THR CB 1 1 33 19959 1 1 5 THR CG2 C -6.339 6.024 2.408 1.00 . A A . 5 THR CG2 1 1 33 19960 1 1 5 THR H H -7.835 9.827 1.346 1.00 . A A . 5 THR H 1 1 33 19961 1 1 5 THR HA H -6.045 8.542 1.921 1.00 . A A . 5 THR HA 1 1 33 19962 1 1 5 THR HB H -7.189 6.198 0.482 1.00 . A A . 5 THR HB 1 1 33 19963 1 1 5 THR HG1 H -9.001 6.180 1.585 1.00 . A A . 5 THR HG1 1 1 33 19964 1 1 5 THR HG21 H -5.327 6.400 2.419 1.00 . A A . 5 THR HG21 1 1 33 19965 1 1 5 THR HG22 H -6.781 6.149 3.385 1.00 . A A . 5 THR HG22 1 1 33 19966 1 1 5 THR HG23 H -6.330 4.976 2.148 1.00 . A A . 5 THR HG23 1 1 33 19967 1 1 5 THR N N -7.630 9.103 0.723 1.00 . A A . 5 THR N 1 1 33 19968 1 1 5 THR O O -5.525 7.021 -0.789 1.00 . A A . 5 THR O 1 1 33 19969 1 1 5 THR OG1 O -8.468 6.918 1.891 1.00 . A A . 5 THR OG1 1 1 33 19970 1 1 6 THR C C -2.466 8.458 -0.891 1.00 . A A . 6 THR C 1 1 33 19971 1 1 6 THR CA C -3.773 9.087 -1.364 1.00 . A A . 6 THR CA 1 1 33 19972 1 1 6 THR CB C -3.521 10.516 -1.848 1.00 . A A . 6 THR CB 1 1 33 19973 1 1 6 THR CG2 C -4.462 10.948 -2.951 1.00 . A A . 6 THR CG2 1 1 33 19974 1 1 6 THR H H -4.848 9.865 0.286 1.00 . A A . 6 THR H 1 1 33 19975 1 1 6 THR HA H -4.163 8.503 -2.184 1.00 . A A . 6 THR HA 1 1 33 19976 1 1 6 THR HB H -2.511 10.583 -2.228 1.00 . A A . 6 THR HB 1 1 33 19977 1 1 6 THR HG1 H -2.814 11.533 -0.330 1.00 . A A . 6 THR HG1 1 1 33 19978 1 1 6 THR HG21 H -5.139 10.140 -3.184 1.00 . A A . 6 THR HG21 1 1 33 19979 1 1 6 THR HG22 H -5.026 11.809 -2.626 1.00 . A A . 6 THR HG22 1 1 33 19980 1 1 6 THR HG23 H -3.891 11.204 -3.832 1.00 . A A . 6 THR HG23 1 1 33 19981 1 1 6 THR N N -4.767 9.081 -0.297 1.00 . A A . 6 THR N 1 1 33 19982 1 1 6 THR O O -2.130 8.519 0.291 1.00 . A A . 6 THR O 1 1 33 19983 1 1 6 THR OG1 O -3.657 11.438 -0.781 1.00 . A A . 6 THR OG1 1 1 33 19984 1 1 7 GLY C C -0.187 5.992 -2.322 1.00 . A A . 7 GLY C 1 1 33 19985 1 1 7 GLY CA C -0.476 7.219 -1.475 1.00 . A A . 7 GLY CA 1 1 33 19986 1 1 7 GLY H H -2.054 7.833 -2.747 1.00 . A A . 7 GLY H 1 1 33 19987 1 1 7 GLY HA2 H -0.507 6.926 -0.436 1.00 . A A . 7 GLY HA2 1 1 33 19988 1 1 7 GLY HA3 H 0.322 7.934 -1.613 1.00 . A A . 7 GLY HA3 1 1 33 19989 1 1 7 GLY N N -1.735 7.852 -1.821 1.00 . A A . 7 GLY N 1 1 33 19990 1 1 7 GLY O O -0.835 5.775 -3.346 1.00 . A A . 7 GLY O 1 1 33 19991 1 1 8 PRO C C 0.069 2.901 -2.655 1.00 . A A . 8 PRO C 1 1 33 19992 1 1 8 PRO CA C 1.172 3.956 -2.655 1.00 . A A . 8 PRO CA 1 1 33 19993 1 1 8 PRO CB C 2.406 3.434 -1.903 1.00 . A A . 8 PRO CB 1 1 33 19994 1 1 8 PRO CD C 1.623 5.355 -0.719 1.00 . A A . 8 PRO CD 1 1 33 19995 1 1 8 PRO CG C 2.858 4.568 -1.045 1.00 . A A . 8 PRO CG 1 1 33 19996 1 1 8 PRO HA H 1.443 4.186 -3.675 1.00 . A A . 8 PRO HA 1 1 33 19997 1 1 8 PRO HB2 H 2.129 2.577 -1.307 1.00 . A A . 8 PRO HB2 1 1 33 19998 1 1 8 PRO HB3 H 3.168 3.152 -2.614 1.00 . A A . 8 PRO HB3 1 1 33 19999 1 1 8 PRO HD2 H 1.136 4.950 0.157 1.00 . A A . 8 PRO HD2 1 1 33 20000 1 1 8 PRO HD3 H 1.864 6.397 -0.574 1.00 . A A . 8 PRO HD3 1 1 33 20001 1 1 8 PRO HG2 H 3.310 4.188 -0.141 1.00 . A A . 8 PRO HG2 1 1 33 20002 1 1 8 PRO HG3 H 3.561 5.182 -1.588 1.00 . A A . 8 PRO HG3 1 1 33 20003 1 1 8 PRO N N 0.795 5.168 -1.918 1.00 . A A . 8 PRO N 1 1 33 20004 1 1 8 PRO O O -0.418 2.499 -3.712 1.00 . A A . 8 PRO O 1 1 33 20005 1 1 9 CYS C C -2.747 2.055 -1.386 1.00 . A A . 9 CYS C 1 1 33 20006 1 1 9 CYS CA C -1.354 1.432 -1.331 1.00 . A A . 9 CYS CA 1 1 33 20007 1 1 9 CYS CB C -1.178 0.662 -0.020 1.00 . A A . 9 CYS CB 1 1 33 20008 1 1 9 CYS H H 0.113 2.802 -0.659 1.00 . A A . 9 CYS H 1 1 33 20009 1 1 9 CYS HA H -1.250 0.744 -2.156 1.00 . A A . 9 CYS HA 1 1 33 20010 1 1 9 CYS HB2 H -1.160 1.363 0.801 1.00 . A A . 9 CYS HB2 1 1 33 20011 1 1 9 CYS HB3 H -2.013 -0.011 0.108 1.00 . A A . 9 CYS HB3 1 1 33 20012 1 1 9 CYS N N -0.315 2.448 -1.465 1.00 . A A . 9 CYS N 1 1 33 20013 1 1 9 CYS O O -3.551 1.889 -0.469 1.00 . A A . 9 CYS O 1 1 33 20014 1 1 9 CYS SG S 0.350 -0.327 0.063 1.00 . A A . 9 CYS SG 1 1 33 20015 1 1 10 CYS C C -4.862 3.167 -4.053 1.00 . A A . 10 CYS C 1 1 33 20016 1 1 10 CYS CA C -4.324 3.411 -2.647 1.00 . A A . 10 CYS CA 1 1 33 20017 1 1 10 CYS CB C -4.216 4.914 -2.385 1.00 . A A . 10 CYS CB 1 1 33 20018 1 1 10 CYS H H -2.347 2.862 -3.169 1.00 . A A . 10 CYS H 1 1 33 20019 1 1 10 CYS HA H -5.008 2.978 -1.933 1.00 . A A . 10 CYS HA 1 1 33 20020 1 1 10 CYS HB2 H -3.817 5.398 -3.264 1.00 . A A . 10 CYS HB2 1 1 33 20021 1 1 10 CYS HB3 H -5.201 5.307 -2.181 1.00 . A A . 10 CYS HB3 1 1 33 20022 1 1 10 CYS N N -3.027 2.768 -2.471 1.00 . A A . 10 CYS N 1 1 33 20023 1 1 10 CYS O O -4.118 2.787 -4.957 1.00 . A A . 10 CYS O 1 1 33 20024 1 1 10 CYS SG S -3.141 5.352 -0.980 1.00 . A A . 10 CYS SG 1 1 33 20025 1 1 11 ARG C C -7.677 4.384 -5.887 1.00 . A A . 11 ARG C 1 1 33 20026 1 1 11 ARG CA C -6.800 3.190 -5.525 1.00 . A A . 11 ARG CA 1 1 33 20027 1 1 11 ARG CB C -7.638 1.911 -5.514 1.00 . A A . 11 ARG CB 1 1 33 20028 1 1 11 ARG CD C -9.077 0.477 -6.994 1.00 . A A . 11 ARG CD 1 1 33 20029 1 1 11 ARG CG C -7.783 1.267 -6.883 1.00 . A A . 11 ARG CG 1 1 33 20030 1 1 11 ARG CZ C -9.352 0.229 -9.430 1.00 . A A . 11 ARG CZ 1 1 33 20031 1 1 11 ARG H H -6.702 3.689 -3.470 1.00 . A A . 11 ARG H 1 1 33 20032 1 1 11 ARG HA H -6.021 3.093 -6.267 1.00 . A A . 11 ARG HA 1 1 33 20033 1 1 11 ARG HB2 H -7.174 1.196 -4.851 1.00 . A A . 11 ARG HB2 1 1 33 20034 1 1 11 ARG HB3 H -8.626 2.144 -5.144 1.00 . A A . 11 ARG HB3 1 1 33 20035 1 1 11 ARG HD2 H -9.147 -0.195 -6.152 1.00 . A A . 11 ARG HD2 1 1 33 20036 1 1 11 ARG HD3 H -9.907 1.168 -6.972 1.00 . A A . 11 ARG HD3 1 1 33 20037 1 1 11 ARG HE H -9.017 -1.272 -8.158 1.00 . A A . 11 ARG HE 1 1 33 20038 1 1 11 ARG HG2 H -7.779 2.040 -7.637 1.00 . A A . 11 ARG HG2 1 1 33 20039 1 1 11 ARG HG3 H -6.949 0.599 -7.046 1.00 . A A . 11 ARG HG3 1 1 33 20040 1 1 11 ARG HH11 H -9.492 2.133 -8.760 1.00 . A A . 11 ARG HH11 1 1 33 20041 1 1 11 ARG HH12 H -9.681 1.932 -10.470 1.00 . A A . 11 ARG HH12 1 1 33 20042 1 1 11 ARG HH21 H -9.266 -1.538 -10.406 1.00 . A A . 11 ARG HH21 1 1 33 20043 1 1 11 ARG HH22 H -9.554 -0.152 -11.404 1.00 . A A . 11 ARG HH22 1 1 33 20044 1 1 11 ARG N N -6.161 3.387 -4.229 1.00 . A A . 11 ARG N 1 1 33 20045 1 1 11 ARG NE N -9.140 -0.302 -8.228 1.00 . A A . 11 ARG NE 1 1 33 20046 1 1 11 ARG NH1 N -9.522 1.539 -9.564 1.00 . A A . 11 ARG NH1 1 1 33 20047 1 1 11 ARG NH2 N -9.394 -0.551 -10.501 1.00 . A A . 11 ARG NH2 1 1 33 20048 1 1 11 ARG O O -8.900 4.328 -5.766 1.00 . A A . 11 ARG O 1 1 33 20049 1 1 12 GLN C C -8.351 7.375 -5.498 1.00 . A A . 12 GLN C 1 1 33 20050 1 1 12 GLN CA C -7.760 6.677 -6.717 1.00 . A A . 12 GLN CA 1 1 33 20051 1 1 12 GLN CB C -8.870 6.348 -7.719 1.00 . A A . 12 GLN CB 1 1 33 20052 1 1 12 GLN CD C -8.331 7.906 -9.634 1.00 . A A . 12 GLN CD 1 1 33 20053 1 1 12 GLN CG C -9.320 7.544 -8.542 1.00 . A A . 12 GLN CG 1 1 33 20054 1 1 12 GLN H H -6.065 5.446 -6.408 1.00 . A A . 12 GLN H 1 1 33 20055 1 1 12 GLN HA H -7.055 7.342 -7.184 1.00 . A A . 12 GLN HA 1 1 33 20056 1 1 12 GLN HB2 H -8.513 5.586 -8.396 1.00 . A A . 12 GLN HB2 1 1 33 20057 1 1 12 GLN HB3 H -9.724 5.967 -7.180 1.00 . A A . 12 GLN HB3 1 1 33 20058 1 1 12 GLN HE21 H -7.604 9.383 -8.520 1.00 . A A . 12 GLN HE21 1 1 33 20059 1 1 12 GLN HE22 H -6.871 9.182 -10.072 1.00 . A A . 12 GLN HE22 1 1 33 20060 1 1 12 GLN HG2 H -10.270 7.313 -9.000 1.00 . A A . 12 GLN HG2 1 1 33 20061 1 1 12 GLN HG3 H -9.435 8.394 -7.885 1.00 . A A . 12 GLN HG3 1 1 33 20062 1 1 12 GLN N N -7.041 5.465 -6.333 1.00 . A A . 12 GLN N 1 1 33 20063 1 1 12 GLN NE2 N -7.520 8.927 -9.383 1.00 . A A . 12 GLN NE2 1 1 33 20064 1 1 12 GLN O O -7.956 8.489 -5.154 1.00 . A A . 12 GLN O 1 1 33 20065 1 1 12 GLN OE1 O -8.297 7.274 -10.690 1.00 . A A . 12 GLN OE1 1 1 33 20066 1 1 13 CYS C C -10.427 6.160 -2.736 1.00 . A A . 13 CYS C 1 1 33 20067 1 1 13 CYS CA C -9.955 7.268 -3.674 1.00 . A A . 13 CYS CA 1 1 33 20068 1 1 13 CYS CB C -11.142 8.139 -4.088 1.00 . A A . 13 CYS CB 1 1 33 20069 1 1 13 CYS H H -9.571 5.833 -5.180 1.00 . A A . 13 CYS H 1 1 33 20070 1 1 13 CYS HA H -9.235 7.881 -3.153 1.00 . A A . 13 CYS HA 1 1 33 20071 1 1 13 CYS HB2 H -10.822 8.827 -4.857 1.00 . A A . 13 CYS HB2 1 1 33 20072 1 1 13 CYS HB3 H -11.923 7.506 -4.481 1.00 . A A . 13 CYS HB3 1 1 33 20073 1 1 13 CYS N N -9.301 6.713 -4.853 1.00 . A A . 13 CYS N 1 1 33 20074 1 1 13 CYS O O -11.430 6.311 -2.039 1.00 . A A . 13 CYS O 1 1 33 20075 1 1 13 CYS SG S -11.854 9.122 -2.730 1.00 . A A . 13 CYS SG 1 1 33 20076 1 1 14 LYS C C -8.827 3.048 -1.593 1.00 . A A . 14 LYS C 1 1 33 20077 1 1 14 LYS CA C -10.047 3.919 -1.869 1.00 . A A . 14 LYS CA 1 1 33 20078 1 1 14 LYS CB C -11.149 3.081 -2.521 1.00 . A A . 14 LYS CB 1 1 33 20079 1 1 14 LYS CD C -11.137 0.819 -1.426 1.00 . A A . 14 LYS CD 1 1 33 20080 1 1 14 LYS CE C -12.116 -0.333 -1.269 1.00 . A A . 14 LYS CE 1 1 33 20081 1 1 14 LYS CG C -11.860 2.150 -1.551 1.00 . A A . 14 LYS CG 1 1 33 20082 1 1 14 LYS H H -8.909 4.985 -3.301 1.00 . A A . 14 LYS H 1 1 33 20083 1 1 14 LYS HA H -10.413 4.312 -0.933 1.00 . A A . 14 LYS HA 1 1 33 20084 1 1 14 LYS HB2 H -11.883 3.745 -2.953 1.00 . A A . 14 LYS HB2 1 1 33 20085 1 1 14 LYS HB3 H -10.712 2.481 -3.306 1.00 . A A . 14 LYS HB3 1 1 33 20086 1 1 14 LYS HD2 H -10.546 0.656 -2.315 1.00 . A A . 14 LYS HD2 1 1 33 20087 1 1 14 LYS HD3 H -10.491 0.851 -0.562 1.00 . A A . 14 LYS HD3 1 1 33 20088 1 1 14 LYS HE2 H -12.842 -0.284 -2.067 1.00 . A A . 14 LYS HE2 1 1 33 20089 1 1 14 LYS HE3 H -11.572 -1.263 -1.336 1.00 . A A . 14 LYS HE3 1 1 33 20090 1 1 14 LYS HG2 H -11.898 2.620 -0.580 1.00 . A A . 14 LYS HG2 1 1 33 20091 1 1 14 LYS HG3 H -12.864 1.974 -1.908 1.00 . A A . 14 LYS HG3 1 1 33 20092 1 1 14 LYS HZ1 H -12.953 0.706 0.338 1.00 . A A . 14 LYS HZ1 1 1 33 20093 1 1 14 LYS HZ2 H -13.766 -0.727 -0.049 1.00 . A A . 14 LYS HZ2 1 1 33 20094 1 1 14 LYS HZ3 H -12.283 -0.788 0.763 1.00 . A A . 14 LYS HZ3 1 1 33 20095 1 1 14 LYS N N -9.698 5.048 -2.723 1.00 . A A . 14 LYS N 1 1 33 20096 1 1 14 LYS NZ N -12.830 -0.282 0.037 1.00 . A A . 14 LYS NZ 1 1 33 20097 1 1 14 LYS O O -7.953 2.898 -2.446 1.00 . A A . 14 LYS O 1 1 33 20098 1 1 15 LEU C C -7.464 0.487 -1.011 1.00 . A A . 15 LEU C 1 1 33 20099 1 1 15 LEU CA C -7.659 1.617 -0.005 1.00 . A A . 15 LEU CA 1 1 33 20100 1 1 15 LEU CB C -7.898 1.041 1.394 1.00 . A A . 15 LEU CB 1 1 33 20101 1 1 15 LEU CD1 C -7.306 1.414 3.801 1.00 . A A . 15 LEU CD1 1 1 33 20102 1 1 15 LEU CD2 C -5.759 0.120 2.321 1.00 . A A . 15 LEU CD2 1 1 33 20103 1 1 15 LEU CG C -6.759 1.265 2.389 1.00 . A A . 15 LEU CG 1 1 33 20104 1 1 15 LEU H H -9.500 2.632 0.244 1.00 . A A . 15 LEU H 1 1 33 20105 1 1 15 LEU HA H -6.765 2.224 0.014 1.00 . A A . 15 LEU HA 1 1 33 20106 1 1 15 LEU HB2 H -8.794 1.491 1.796 1.00 . A A . 15 LEU HB2 1 1 33 20107 1 1 15 LEU HB3 H -8.060 -0.023 1.302 1.00 . A A . 15 LEU HB3 1 1 33 20108 1 1 15 LEU HD11 H -8.246 1.945 3.768 1.00 . A A . 15 LEU HD11 1 1 33 20109 1 1 15 LEU HD12 H -7.458 0.437 4.233 1.00 . A A . 15 LEU HD12 1 1 33 20110 1 1 15 LEU HD13 H -6.601 1.968 4.403 1.00 . A A . 15 LEU HD13 1 1 33 20111 1 1 15 LEU HD21 H -5.843 -0.375 1.365 1.00 . A A . 15 LEU HD21 1 1 33 20112 1 1 15 LEU HD22 H -4.758 0.509 2.438 1.00 . A A . 15 LEU HD22 1 1 33 20113 1 1 15 LEU HD23 H -5.966 -0.585 3.112 1.00 . A A . 15 LEU HD23 1 1 33 20114 1 1 15 LEU HG H -6.241 2.178 2.134 1.00 . A A . 15 LEU HG 1 1 33 20115 1 1 15 LEU N N -8.773 2.475 -0.394 1.00 . A A . 15 LEU N 1 1 33 20116 1 1 15 LEU O O -8.410 -0.224 -1.351 1.00 . A A . 15 LEU O 1 1 33 20117 1 1 16 LYS C C -6.284 -2.095 -1.913 1.00 . A A . 16 LYS C 1 1 33 20118 1 1 16 LYS CA C -5.917 -0.715 -2.456 1.00 . A A . 16 LYS CA 1 1 33 20119 1 1 16 LYS CB C -4.430 -0.671 -2.818 1.00 . A A . 16 LYS CB 1 1 33 20120 1 1 16 LYS CD C -2.692 0.124 -4.449 1.00 . A A . 16 LYS CD 1 1 33 20121 1 1 16 LYS CE C -2.418 0.561 -5.879 1.00 . A A . 16 LYS CE 1 1 33 20122 1 1 16 LYS CG C -4.163 -0.192 -4.235 1.00 . A A . 16 LYS CG 1 1 33 20123 1 1 16 LYS H H -5.520 0.927 -1.179 1.00 . A A . 16 LYS H 1 1 33 20124 1 1 16 LYS HA H -6.500 -0.524 -3.346 1.00 . A A . 16 LYS HA 1 1 33 20125 1 1 16 LYS HB2 H -3.925 -0.004 -2.135 1.00 . A A . 16 LYS HB2 1 1 33 20126 1 1 16 LYS HB3 H -4.014 -1.663 -2.712 1.00 . A A . 16 LYS HB3 1 1 33 20127 1 1 16 LYS HD2 H -2.404 0.920 -3.779 1.00 . A A . 16 LYS HD2 1 1 33 20128 1 1 16 LYS HD3 H -2.109 -0.759 -4.234 1.00 . A A . 16 LYS HD3 1 1 33 20129 1 1 16 LYS HE2 H -2.283 -0.318 -6.491 1.00 . A A . 16 LYS HE2 1 1 33 20130 1 1 16 LYS HE3 H -3.268 1.123 -6.239 1.00 . A A . 16 LYS HE3 1 1 33 20131 1 1 16 LYS HG2 H -4.459 -0.966 -4.928 1.00 . A A . 16 LYS HG2 1 1 33 20132 1 1 16 LYS HG3 H -4.745 0.699 -4.419 1.00 . A A . 16 LYS HG3 1 1 33 20133 1 1 16 LYS HZ1 H -1.309 2.263 -5.391 1.00 . A A . 16 LYS HZ1 1 1 33 20134 1 1 16 LYS HZ2 H -0.367 0.880 -5.646 1.00 . A A . 16 LYS HZ2 1 1 33 20135 1 1 16 LYS HZ3 H -1.042 1.699 -6.963 1.00 . A A . 16 LYS HZ3 1 1 33 20136 1 1 16 LYS N N -6.233 0.328 -1.486 1.00 . A A . 16 LYS N 1 1 33 20137 1 1 16 LYS NZ N -1.199 1.410 -5.976 1.00 . A A . 16 LYS NZ 1 1 33 20138 1 1 16 LYS O O -6.425 -2.278 -0.704 1.00 . A A . 16 LYS O 1 1 33 20139 1 1 17 PRO C C -5.827 -5.031 -1.385 1.00 . A A . 17 PRO C 1 1 33 20140 1 1 17 PRO CA C -6.796 -4.456 -2.411 1.00 . A A . 17 PRO CA 1 1 33 20141 1 1 17 PRO CB C -6.711 -5.243 -3.723 1.00 . A A . 17 PRO CB 1 1 33 20142 1 1 17 PRO CD C -6.293 -2.954 -4.266 1.00 . A A . 17 PRO CD 1 1 33 20143 1 1 17 PRO CG C -6.899 -4.224 -4.793 1.00 . A A . 17 PRO CG 1 1 33 20144 1 1 17 PRO HA H -7.802 -4.509 -2.021 1.00 . A A . 17 PRO HA 1 1 33 20145 1 1 17 PRO HB2 H -5.745 -5.720 -3.796 1.00 . A A . 17 PRO HB2 1 1 33 20146 1 1 17 PRO HB3 H -7.490 -5.989 -3.748 1.00 . A A . 17 PRO HB3 1 1 33 20147 1 1 17 PRO HD2 H -5.251 -2.889 -4.543 1.00 . A A . 17 PRO HD2 1 1 33 20148 1 1 17 PRO HD3 H -6.837 -2.096 -4.632 1.00 . A A . 17 PRO HD3 1 1 33 20149 1 1 17 PRO HG2 H -6.389 -4.538 -5.692 1.00 . A A . 17 PRO HG2 1 1 33 20150 1 1 17 PRO HG3 H -7.952 -4.085 -4.987 1.00 . A A . 17 PRO HG3 1 1 33 20151 1 1 17 PRO N N -6.444 -3.087 -2.806 1.00 . A A . 17 PRO N 1 1 33 20152 1 1 17 PRO O O -4.634 -4.726 -1.402 1.00 . A A . 17 PRO O 1 1 33 20153 1 1 18 ALA C C -4.582 -7.520 -0.059 1.00 . A A . 18 ALA C 1 1 33 20154 1 1 18 ALA CA C -5.530 -6.487 0.541 1.00 . A A . 18 ALA CA 1 1 33 20155 1 1 18 ALA CB C -6.415 -7.130 1.598 1.00 . A A . 18 ALA CB 1 1 33 20156 1 1 18 ALA H H -7.306 -6.069 -0.533 1.00 . A A . 18 ALA H 1 1 33 20157 1 1 18 ALA HA H -4.947 -5.711 1.017 1.00 . A A . 18 ALA HA 1 1 33 20158 1 1 18 ALA HB1 H -6.580 -6.431 2.404 1.00 . A A . 18 ALA HB1 1 1 33 20159 1 1 18 ALA HB2 H -5.931 -8.016 1.983 1.00 . A A . 18 ALA HB2 1 1 33 20160 1 1 18 ALA HB3 H -7.363 -7.400 1.157 1.00 . A A . 18 ALA HB3 1 1 33 20161 1 1 18 ALA N N -6.348 -5.865 -0.493 1.00 . A A . 18 ALA N 1 1 33 20162 1 1 18 ALA O O -4.994 -8.628 -0.403 1.00 . A A . 18 ALA O 1 1 33 20163 1 1 19 GLY C C -1.670 -7.506 -1.991 1.00 . A A . 19 GLY C 1 1 33 20164 1 1 19 GLY CA C -2.325 -8.056 -0.738 1.00 . A A . 19 GLY CA 1 1 33 20165 1 1 19 GLY H H -3.042 -6.254 0.112 1.00 . A A . 19 GLY H 1 1 33 20166 1 1 19 GLY HA2 H -2.807 -8.992 -0.980 1.00 . A A . 19 GLY HA2 1 1 33 20167 1 1 19 GLY HA3 H -1.561 -8.239 0.003 1.00 . A A . 19 GLY HA3 1 1 33 20168 1 1 19 GLY N N -3.312 -7.150 -0.180 1.00 . A A . 19 GLY N 1 1 33 20169 1 1 19 GLY O O -1.289 -8.264 -2.884 1.00 . A A . 19 GLY O 1 1 33 20170 1 1 20 THR C C 0.538 -5.203 -2.928 1.00 . A A . 20 THR C 1 1 33 20171 1 1 20 THR CA C -0.923 -5.536 -3.210 1.00 . A A . 20 THR CA 1 1 33 20172 1 1 20 THR CB C -1.688 -4.261 -3.571 1.00 . A A . 20 THR CB 1 1 33 20173 1 1 20 THR CG2 C -1.544 -3.868 -5.026 1.00 . A A . 20 THR CG2 1 1 33 20174 1 1 20 THR H H -1.859 -5.634 -1.315 1.00 . A A . 20 THR H 1 1 33 20175 1 1 20 THR HA H -0.970 -6.222 -4.042 1.00 . A A . 20 THR HA 1 1 33 20176 1 1 20 THR HB H -1.313 -3.446 -2.969 1.00 . A A . 20 THR HB 1 1 33 20177 1 1 20 THR HG1 H -3.399 -5.198 -3.748 1.00 . A A . 20 THR HG1 1 1 33 20178 1 1 20 THR HG21 H -1.517 -4.757 -5.638 1.00 . A A . 20 THR HG21 1 1 33 20179 1 1 20 THR HG22 H -2.383 -3.254 -5.317 1.00 . A A . 20 THR HG22 1 1 33 20180 1 1 20 THR HG23 H -0.628 -3.311 -5.159 1.00 . A A . 20 THR HG23 1 1 33 20181 1 1 20 THR N N -1.538 -6.185 -2.058 1.00 . A A . 20 THR N 1 1 33 20182 1 1 20 THR O O 1.012 -5.352 -1.801 1.00 . A A . 20 THR O 1 1 33 20183 1 1 20 THR OG1 O -3.070 -4.413 -3.303 1.00 . A A . 20 THR OG1 1 1 33 20184 1 1 21 THR C C 2.895 -2.946 -4.213 1.00 . A A . 21 THR C 1 1 33 20185 1 1 21 THR CA C 2.657 -4.400 -3.817 1.00 . A A . 21 THR CA 1 1 33 20186 1 1 21 THR CB C 3.525 -5.325 -4.674 1.00 . A A . 21 THR CB 1 1 33 20187 1 1 21 THR CG2 C 4.755 -5.829 -3.949 1.00 . A A . 21 THR CG2 1 1 33 20188 1 1 21 THR H H 0.815 -4.656 -4.831 1.00 . A A . 21 THR H 1 1 33 20189 1 1 21 THR HA H 2.928 -4.526 -2.780 1.00 . A A . 21 THR HA 1 1 33 20190 1 1 21 THR HB H 3.855 -4.786 -5.550 1.00 . A A . 21 THR HB 1 1 33 20191 1 1 21 THR HG1 H 2.302 -6.822 -4.357 1.00 . A A . 21 THR HG1 1 1 33 20192 1 1 21 THR HG21 H 4.482 -6.147 -2.954 1.00 . A A . 21 THR HG21 1 1 33 20193 1 1 21 THR HG22 H 5.176 -6.663 -4.491 1.00 . A A . 21 THR HG22 1 1 33 20194 1 1 21 THR HG23 H 5.485 -5.035 -3.886 1.00 . A A . 21 THR HG23 1 1 33 20195 1 1 21 THR N N 1.248 -4.753 -3.957 1.00 . A A . 21 THR N 1 1 33 20196 1 1 21 THR O O 2.739 -2.576 -5.377 1.00 . A A . 21 THR O 1 1 33 20197 1 1 21 THR OG1 O 2.787 -6.457 -5.101 1.00 . A A . 21 THR OG1 1 1 33 20198 1 1 22 CYS C C 4.994 -0.483 -3.851 1.00 . A A . 22 CYS C 1 1 33 20199 1 1 22 CYS CA C 3.532 -0.713 -3.485 1.00 . A A . 22 CYS CA 1 1 33 20200 1 1 22 CYS CB C 3.164 0.118 -2.255 1.00 . A A . 22 CYS CB 1 1 33 20201 1 1 22 CYS H H 3.380 -2.481 -2.330 1.00 . A A . 22 CYS H 1 1 33 20202 1 1 22 CYS HA H 2.913 -0.404 -4.313 1.00 . A A . 22 CYS HA 1 1 33 20203 1 1 22 CYS HB2 H 3.261 1.166 -2.496 1.00 . A A . 22 CYS HB2 1 1 33 20204 1 1 22 CYS HB3 H 2.139 -0.090 -1.983 1.00 . A A . 22 CYS HB3 1 1 33 20205 1 1 22 CYS N N 3.273 -2.127 -3.237 1.00 . A A . 22 CYS N 1 1 33 20206 1 1 22 CYS O O 5.311 0.386 -4.664 1.00 . A A . 22 CYS O 1 1 33 20207 1 1 22 CYS SG S 4.202 -0.211 -0.795 1.00 . A A . 22 CYS SG 1 1 33 20208 1 1 23 TRP C C 8.071 -2.339 -2.935 1.00 . A A . 23 TRP C 1 1 33 20209 1 1 23 TRP CA C 7.310 -1.148 -3.510 1.00 . A A . 23 TRP CA 1 1 33 20210 1 1 23 TRP CB C 7.853 0.153 -2.916 1.00 . A A . 23 TRP CB 1 1 33 20211 1 1 23 TRP CD1 C 9.846 0.744 -4.415 1.00 . A A . 23 TRP CD1 1 1 33 20212 1 1 23 TRP CD2 C 10.397 0.267 -2.298 1.00 . A A . 23 TRP CD2 1 1 33 20213 1 1 23 TRP CE2 C 11.573 0.572 -3.010 1.00 . A A . 23 TRP CE2 1 1 33 20214 1 1 23 TRP CE3 C 10.496 -0.064 -0.944 1.00 . A A . 23 TRP CE3 1 1 33 20215 1 1 23 TRP CG C 9.303 0.383 -3.215 1.00 . A A . 23 TRP CG 1 1 33 20216 1 1 23 TRP CH2 C 12.898 0.227 -1.086 1.00 . A A . 23 TRP CH2 1 1 33 20217 1 1 23 TRP CZ2 C 12.830 0.555 -2.413 1.00 . A A . 23 TRP CZ2 1 1 33 20218 1 1 23 TRP CZ3 C 11.746 -0.081 -0.352 1.00 . A A . 23 TRP CZ3 1 1 33 20219 1 1 23 TRP H H 5.567 -1.941 -2.609 1.00 . A A . 23 TRP H 1 1 33 20220 1 1 23 TRP HA H 7.450 -1.130 -4.581 1.00 . A A . 23 TRP HA 1 1 33 20221 1 1 23 TRP HB2 H 7.294 0.985 -3.318 1.00 . A A . 23 TRP HB2 1 1 33 20222 1 1 23 TRP HB3 H 7.732 0.129 -1.843 1.00 . A A . 23 TRP HB3 1 1 33 20223 1 1 23 TRP HD1 H 9.274 0.910 -5.316 1.00 . A A . 23 TRP HD1 1 1 33 20224 1 1 23 TRP HE1 H 11.823 1.108 -5.023 1.00 . A A . 23 TRP HE1 1 1 33 20225 1 1 23 TRP HE3 H 9.619 -0.305 -0.361 1.00 . A A . 23 TRP HE3 1 1 33 20226 1 1 23 TRP HH2 H 13.853 0.201 -0.583 1.00 . A A . 23 TRP HH2 1 1 33 20227 1 1 23 TRP HZ2 H 13.729 0.790 -2.964 1.00 . A A . 23 TRP HZ2 1 1 33 20228 1 1 23 TRP HZ3 H 11.842 -0.335 0.693 1.00 . A A . 23 TRP HZ3 1 1 33 20229 1 1 23 TRP N N 5.881 -1.267 -3.247 1.00 . A A . 23 TRP N 1 1 33 20230 1 1 23 TRP NE1 N 11.210 0.859 -4.300 1.00 . A A . 23 TRP NE1 1 1 33 20231 1 1 23 TRP O O 8.416 -2.356 -1.754 1.00 . A A . 23 TRP O 1 1 33 20232 1 1 24 ARG C C 10.511 -4.461 -3.778 1.00 . A A . 24 ARG C 1 1 33 20233 1 1 24 ARG CA C 9.048 -4.528 -3.354 1.00 . A A . 24 ARG CA 1 1 33 20234 1 1 24 ARG CB C 8.391 -5.779 -3.941 1.00 . A A . 24 ARG CB 1 1 33 20235 1 1 24 ARG CD C 7.767 -7.088 -5.993 1.00 . A A . 24 ARG CD 1 1 33 20236 1 1 24 ARG CG C 8.357 -5.792 -5.461 1.00 . A A . 24 ARG CG 1 1 33 20237 1 1 24 ARG CZ C 9.555 -7.988 -7.430 1.00 . A A . 24 ARG CZ 1 1 33 20238 1 1 24 ARG H H 8.027 -3.261 -4.709 1.00 . A A . 24 ARG H 1 1 33 20239 1 1 24 ARG HA H 8.999 -4.579 -2.277 1.00 . A A . 24 ARG HA 1 1 33 20240 1 1 24 ARG HB2 H 8.938 -6.649 -3.607 1.00 . A A . 24 ARG HB2 1 1 33 20241 1 1 24 ARG HB3 H 7.376 -5.843 -3.579 1.00 . A A . 24 ARG HB3 1 1 33 20242 1 1 24 ARG HD2 H 7.963 -7.877 -5.282 1.00 . A A . 24 ARG HD2 1 1 33 20243 1 1 24 ARG HD3 H 6.700 -6.963 -6.107 1.00 . A A . 24 ARG HD3 1 1 33 20244 1 1 24 ARG HE H 7.794 -7.312 -8.083 1.00 . A A . 24 ARG HE 1 1 33 20245 1 1 24 ARG HG2 H 7.753 -4.966 -5.805 1.00 . A A . 24 ARG HG2 1 1 33 20246 1 1 24 ARG HG3 H 9.365 -5.685 -5.835 1.00 . A A . 24 ARG HG3 1 1 33 20247 1 1 24 ARG HH11 H 9.995 -7.973 -5.456 1.00 . A A . 24 ARG HH11 1 1 33 20248 1 1 24 ARG HH12 H 11.236 -8.601 -6.488 1.00 . A A . 24 ARG HH12 1 1 33 20249 1 1 24 ARG HH21 H 9.425 -8.138 -9.442 1.00 . A A . 24 ARG HH21 1 1 33 20250 1 1 24 ARG HH22 H 10.912 -8.695 -8.751 1.00 . A A . 24 ARG HH22 1 1 33 20251 1 1 24 ARG N N 8.328 -3.333 -3.779 1.00 . A A . 24 ARG N 1 1 33 20252 1 1 24 ARG NE N 8.341 -7.462 -7.284 1.00 . A A . 24 ARG NE 1 1 33 20253 1 1 24 ARG NH1 N 10.325 -8.205 -6.371 1.00 . A A . 24 ARG NH1 1 1 33 20254 1 1 24 ARG NH2 N 10.000 -8.299 -8.640 1.00 . A A . 24 ARG NH2 1 1 33 20255 1 1 24 ARG O O 10.857 -3.783 -4.745 1.00 . A A . 24 ARG O 1 1 33 20256 1 1 25 THR C C 13.350 -6.606 -3.249 1.00 . A A . 25 THR C 1 1 33 20257 1 1 25 THR CA C 12.793 -5.190 -3.348 1.00 . A A . 25 THR CA 1 1 33 20258 1 1 25 THR CB C 13.550 -4.264 -2.395 1.00 . A A . 25 THR CB 1 1 33 20259 1 1 25 THR CG2 C 13.663 -2.843 -2.904 1.00 . A A . 25 THR CG2 1 1 33 20260 1 1 25 THR H H 11.030 -5.690 -2.289 1.00 . A A . 25 THR H 1 1 33 20261 1 1 25 THR HA H 12.924 -4.835 -4.360 1.00 . A A . 25 THR HA 1 1 33 20262 1 1 25 THR HB H 14.551 -4.646 -2.257 1.00 . A A . 25 THR HB 1 1 33 20263 1 1 25 THR HG1 H 12.692 -5.109 -0.850 1.00 . A A . 25 THR HG1 1 1 33 20264 1 1 25 THR HG21 H 13.322 -2.800 -3.928 1.00 . A A . 25 THR HG21 1 1 33 20265 1 1 25 THR HG22 H 13.054 -2.193 -2.294 1.00 . A A . 25 THR HG22 1 1 33 20266 1 1 25 THR HG23 H 14.693 -2.523 -2.854 1.00 . A A . 25 THR HG23 1 1 33 20267 1 1 25 THR N N 11.367 -5.169 -3.048 1.00 . A A . 25 THR N 1 1 33 20268 1 1 25 THR O O 12.611 -7.559 -3.000 1.00 . A A . 25 THR O 1 1 33 20269 1 1 25 THR OG1 O 12.914 -4.218 -1.130 1.00 . A A . 25 THR OG1 1 1 33 20270 1 1 26 SER C C 15.590 -8.433 -1.929 1.00 . A A . 26 SER C 1 1 33 20271 1 1 26 SER CA C 15.314 -8.038 -3.376 1.00 . A A . 26 SER CA 1 1 33 20272 1 1 26 SER CB C 16.623 -8.015 -4.168 1.00 . A A . 26 SER CB 1 1 33 20273 1 1 26 SER H H 15.195 -5.941 -3.639 1.00 . A A . 26 SER H 1 1 33 20274 1 1 26 SER HA H 14.651 -8.767 -3.816 1.00 . A A . 26 SER HA 1 1 33 20275 1 1 26 SER HB2 H 17.443 -7.807 -3.498 1.00 . A A . 26 SER HB2 1 1 33 20276 1 1 26 SER HB3 H 16.775 -8.976 -4.637 1.00 . A A . 26 SER HB3 1 1 33 20277 1 1 26 SER HG H 17.355 -7.118 -5.748 1.00 . A A . 26 SER HG 1 1 33 20278 1 1 26 SER N N 14.658 -6.738 -3.444 1.00 . A A . 26 SER N 1 1 33 20279 1 1 26 SER O O 15.556 -9.613 -1.580 1.00 . A A . 26 SER O 1 1 33 20280 1 1 26 SER OG O 16.593 -7.017 -5.174 1.00 . A A . 26 SER OG 1 1 33 20281 1 1 27 VAL C C 14.853 -7.785 1.126 1.00 . A A . 27 VAL C 1 1 33 20282 1 1 27 VAL CA C 16.143 -7.682 0.319 1.00 . A A . 27 VAL CA 1 1 33 20283 1 1 27 VAL CB C 17.022 -6.568 0.918 1.00 . A A . 27 VAL CB 1 1 33 20284 1 1 27 VAL CG1 C 18.441 -6.658 0.377 1.00 . A A . 27 VAL CG1 1 1 33 20285 1 1 27 VAL CG2 C 16.420 -5.201 0.631 1.00 . A A . 27 VAL CG2 1 1 33 20286 1 1 27 VAL H H 15.874 -6.519 -1.428 1.00 . A A . 27 VAL H 1 1 33 20287 1 1 27 VAL HA H 16.680 -8.617 0.395 1.00 . A A . 27 VAL HA 1 1 33 20288 1 1 27 VAL HB H 17.059 -6.704 1.989 1.00 . A A . 27 VAL HB 1 1 33 20289 1 1 27 VAL HG11 H 18.410 -6.868 -0.682 1.00 . A A . 27 VAL HG11 1 1 33 20290 1 1 27 VAL HG12 H 18.949 -5.720 0.544 1.00 . A A . 27 VAL HG12 1 1 33 20291 1 1 27 VAL HG13 H 18.970 -7.450 0.886 1.00 . A A . 27 VAL HG13 1 1 33 20292 1 1 27 VAL HG21 H 15.354 -5.233 0.806 1.00 . A A . 27 VAL HG21 1 1 33 20293 1 1 27 VAL HG22 H 16.869 -4.466 1.282 1.00 . A A . 27 VAL HG22 1 1 33 20294 1 1 27 VAL HG23 H 16.608 -4.934 -0.398 1.00 . A A . 27 VAL HG23 1 1 33 20295 1 1 27 VAL N N 15.862 -7.439 -1.091 1.00 . A A . 27 VAL N 1 1 33 20296 1 1 27 VAL O O 14.782 -8.522 2.110 1.00 . A A . 27 VAL O 1 1 33 20297 1 1 28 SER C C 11.405 -6.857 0.397 1.00 . A A . 28 SER C 1 1 33 20298 1 1 28 SER CA C 12.548 -7.049 1.388 1.00 . A A . 28 SER CA 1 1 33 20299 1 1 28 SER CB C 12.506 -5.951 2.452 1.00 . A A . 28 SER CB 1 1 33 20300 1 1 28 SER H H 13.954 -6.475 -0.087 1.00 . A A . 28 SER H 1 1 33 20301 1 1 28 SER HA H 12.434 -8.009 1.869 1.00 . A A . 28 SER HA 1 1 33 20302 1 1 28 SER HB2 H 13.423 -5.969 3.021 1.00 . A A . 28 SER HB2 1 1 33 20303 1 1 28 SER HB3 H 12.400 -4.990 1.971 1.00 . A A . 28 SER HB3 1 1 33 20304 1 1 28 SER HG H 10.989 -5.298 3.506 1.00 . A A . 28 SER HG 1 1 33 20305 1 1 28 SER N N 13.836 -7.042 0.704 1.00 . A A . 28 SER N 1 1 33 20306 1 1 28 SER O O 11.609 -6.893 -0.817 1.00 . A A . 28 SER O 1 1 33 20307 1 1 28 SER OG O 11.416 -6.141 3.338 1.00 . A A . 28 SER OG 1 1 33 20308 1 1 29 SER C C 7.917 -5.748 0.857 1.00 . A A . 29 SER C 1 1 33 20309 1 1 29 SER CA C 9.025 -6.455 0.083 1.00 . A A . 29 SER CA 1 1 33 20310 1 1 29 SER CB C 8.517 -7.798 -0.444 1.00 . A A . 29 SER CB 1 1 33 20311 1 1 29 SER H H 10.101 -6.636 1.897 1.00 . A A . 29 SER H 1 1 33 20312 1 1 29 SER HA H 9.315 -5.837 -0.753 1.00 . A A . 29 SER HA 1 1 33 20313 1 1 29 SER HB2 H 9.345 -8.486 -0.531 1.00 . A A . 29 SER HB2 1 1 33 20314 1 1 29 SER HB3 H 7.786 -8.199 0.243 1.00 . A A . 29 SER HB3 1 1 33 20315 1 1 29 SER HG H 7.195 -7.016 -1.661 1.00 . A A . 29 SER HG 1 1 33 20316 1 1 29 SER N N 10.201 -6.653 0.922 1.00 . A A . 29 SER N 1 1 33 20317 1 1 29 SER O O 7.527 -6.184 1.940 1.00 . A A . 29 SER O 1 1 33 20318 1 1 29 SER OG O 7.913 -7.651 -1.718 1.00 . A A . 29 SER OG 1 1 33 20319 1 1 30 HIS C C 4.995 -4.221 0.318 1.00 . A A . 30 HIS C 1 1 33 20320 1 1 30 HIS CA C 6.351 -3.886 0.931 1.00 . A A . 30 HIS CA 1 1 33 20321 1 1 30 HIS CB C 6.627 -2.387 0.800 1.00 . A A . 30 HIS CB 1 1 33 20322 1 1 30 HIS CD2 C 8.828 -2.643 2.149 1.00 . A A . 30 HIS CD2 1 1 33 20323 1 1 30 HIS CE1 C 9.279 -0.516 2.432 1.00 . A A . 30 HIS CE1 1 1 33 20324 1 1 30 HIS CG C 7.843 -1.935 1.547 1.00 . A A . 30 HIS CG 1 1 33 20325 1 1 30 HIS H H 7.767 -4.356 -0.571 1.00 . A A . 30 HIS H 1 1 33 20326 1 1 30 HIS HA H 6.334 -4.149 1.978 1.00 . A A . 30 HIS HA 1 1 33 20327 1 1 30 HIS HB2 H 6.769 -2.145 -0.243 1.00 . A A . 30 HIS HB2 1 1 33 20328 1 1 30 HIS HB3 H 5.778 -1.838 1.180 1.00 . A A . 30 HIS HB3 1 1 33 20329 1 1 30 HIS HD1 H 7.631 0.158 1.424 1.00 . A A . 30 HIS HD1 1 1 33 20330 1 1 30 HIS HD2 H 8.907 -3.720 2.194 1.00 . A A . 30 HIS HD2 1 1 33 20331 1 1 30 HIS HE1 H 9.764 0.400 2.733 1.00 . A A . 30 HIS HE1 1 1 33 20332 1 1 30 HIS HE2 H 10.563 -1.959 3.113 1.00 . A A . 30 HIS HE2 1 1 33 20333 1 1 30 HIS N N 7.414 -4.654 0.294 1.00 . A A . 30 HIS N 1 1 33 20334 1 1 30 HIS ND1 N 8.155 -0.606 1.743 1.00 . A A . 30 HIS ND1 1 1 33 20335 1 1 30 HIS NE2 N 9.706 -1.738 2.691 1.00 . A A . 30 HIS NE2 1 1 33 20336 1 1 30 HIS O O 4.657 -3.743 -0.765 1.00 . A A . 30 HIS O 1 1 33 20337 1 1 31 TYR C C 1.805 -4.725 1.317 1.00 . A A . 31 TYR C 1 1 33 20338 1 1 31 TYR CA C 2.904 -5.446 0.542 1.00 . A A . 31 TYR CA 1 1 33 20339 1 1 31 TYR CB C 2.728 -6.959 0.674 1.00 . A A . 31 TYR CB 1 1 33 20340 1 1 31 TYR CD1 C 4.541 -8.254 -0.514 1.00 . A A . 31 TYR CD1 1 1 33 20341 1 1 31 TYR CD2 C 2.457 -7.951 -1.632 1.00 . A A . 31 TYR CD2 1 1 33 20342 1 1 31 TYR CE1 C 5.023 -8.964 -1.597 1.00 . A A . 31 TYR CE1 1 1 33 20343 1 1 31 TYR CE2 C 2.932 -8.661 -2.718 1.00 . A A . 31 TYR CE2 1 1 33 20344 1 1 31 TYR CG C 3.252 -7.736 -0.513 1.00 . A A . 31 TYR CG 1 1 33 20345 1 1 31 TYR CZ C 4.216 -9.165 -2.696 1.00 . A A . 31 TYR CZ 1 1 33 20346 1 1 31 TYR H H 4.548 -5.395 1.874 1.00 . A A . 31 TYR H 1 1 33 20347 1 1 31 TYR HA H 2.831 -5.173 -0.500 1.00 . A A . 31 TYR HA 1 1 33 20348 1 1 31 TYR HB2 H 3.255 -7.301 1.552 1.00 . A A . 31 TYR HB2 1 1 33 20349 1 1 31 TYR HB3 H 1.677 -7.185 0.781 1.00 . A A . 31 TYR HB3 1 1 33 20350 1 1 31 TYR HD1 H 5.171 -8.095 0.348 1.00 . A A . 31 TYR HD1 1 1 33 20351 1 1 31 TYR HD2 H 1.453 -7.555 -1.647 1.00 . A A . 31 TYR HD2 1 1 33 20352 1 1 31 TYR HE1 H 6.029 -9.359 -1.579 1.00 . A A . 31 TYR HE1 1 1 33 20353 1 1 31 TYR HE2 H 2.299 -8.818 -3.579 1.00 . A A . 31 TYR HE2 1 1 33 20354 1 1 31 TYR HH H 5.456 -9.420 -4.142 1.00 . A A . 31 TYR HH 1 1 33 20355 1 1 31 TYR N N 4.223 -5.046 1.018 1.00 . A A . 31 TYR N 1 1 33 20356 1 1 31 TYR O O 1.960 -4.425 2.500 1.00 . A A . 31 TYR O 1 1 33 20357 1 1 31 TYR OH O 4.692 -9.871 -3.776 1.00 . A A . 31 TYR OH 1 1 33 20358 1 1 32 CYS C C -1.376 -4.767 1.922 1.00 . A A . 32 CYS C 1 1 33 20359 1 1 32 CYS CA C -0.432 -3.767 1.265 1.00 . A A . 32 CYS CA 1 1 33 20360 1 1 32 CYS CB C -1.192 -2.936 0.228 1.00 . A A . 32 CYS CB 1 1 33 20361 1 1 32 CYS H H 0.629 -4.717 -0.300 1.00 . A A . 32 CYS H 1 1 33 20362 1 1 32 CYS HA H -0.039 -3.107 2.024 1.00 . A A . 32 CYS HA 1 1 33 20363 1 1 32 CYS HB2 H -1.825 -3.591 -0.352 1.00 . A A . 32 CYS HB2 1 1 33 20364 1 1 32 CYS HB3 H -1.808 -2.212 0.741 1.00 . A A . 32 CYS HB3 1 1 33 20365 1 1 32 CYS N N 0.694 -4.451 0.641 1.00 . A A . 32 CYS N 1 1 33 20366 1 1 32 CYS O O -1.711 -5.796 1.336 1.00 . A A . 32 CYS O 1 1 33 20367 1 1 32 CYS SG S -0.122 -2.030 -0.936 1.00 . A A . 32 CYS SG 1 1 33 20368 1 1 33 THR C C -4.160 -4.898 3.701 1.00 . A A . 33 THR C 1 1 33 20369 1 1 33 THR CA C -2.707 -5.335 3.878 1.00 . A A . 33 THR CA 1 1 33 20370 1 1 33 THR CB C -2.345 -5.343 5.363 1.00 . A A . 33 THR CB 1 1 33 20371 1 1 33 THR CG2 C -2.258 -3.957 5.964 1.00 . A A . 33 THR CG2 1 1 33 20372 1 1 33 THR H H -1.499 -3.626 3.559 1.00 . A A . 33 THR H 1 1 33 20373 1 1 33 THR HA H -2.595 -6.334 3.485 1.00 . A A . 33 THR HA 1 1 33 20374 1 1 33 THR HB H -1.381 -5.817 5.486 1.00 . A A . 33 THR HB 1 1 33 20375 1 1 33 THR HG1 H -4.140 -5.611 6.100 1.00 . A A . 33 THR HG1 1 1 33 20376 1 1 33 THR HG21 H -3.006 -3.321 5.513 1.00 . A A . 33 THR HG21 1 1 33 20377 1 1 33 THR HG22 H -2.430 -4.014 7.029 1.00 . A A . 33 THR HG22 1 1 33 20378 1 1 33 THR HG23 H -1.277 -3.545 5.779 1.00 . A A . 33 THR HG23 1 1 33 20379 1 1 33 THR N N -1.801 -4.460 3.143 1.00 . A A . 33 THR N 1 1 33 20380 1 1 33 THR O O -5.029 -5.275 4.488 1.00 . A A . 33 THR O 1 1 33 20381 1 1 33 THR OG1 O -3.300 -6.076 6.109 1.00 . A A . 33 THR OG1 1 1 33 20382 1 1 34 GLY C C -6.409 -2.990 3.627 1.00 . A A . 34 GLY C 1 1 33 20383 1 1 34 GLY CA C -5.769 -3.632 2.409 1.00 . A A . 34 GLY CA 1 1 33 20384 1 1 34 GLY H H -3.689 -3.834 2.070 1.00 . A A . 34 GLY H 1 1 33 20385 1 1 34 GLY HA2 H -6.377 -4.469 2.097 1.00 . A A . 34 GLY HA2 1 1 33 20386 1 1 34 GLY HA3 H -5.739 -2.907 1.610 1.00 . A A . 34 GLY HA3 1 1 33 20387 1 1 34 GLY N N -4.419 -4.103 2.666 1.00 . A A . 34 GLY N 1 1 33 20388 1 1 34 GLY O O -7.633 -2.955 3.746 1.00 . A A . 34 GLY O 1 1 33 20389 1 1 35 ARG C C -5.675 -0.370 5.787 1.00 . A A . 35 ARG C 1 1 33 20390 1 1 35 ARG CA C -6.072 -1.842 5.748 1.00 . A A . 35 ARG CA 1 1 33 20391 1 1 35 ARG CB C -5.531 -2.561 6.985 1.00 . A A . 35 ARG CB 1 1 33 20392 1 1 35 ARG CD C -7.364 -2.798 8.688 1.00 . A A . 35 ARG CD 1 1 33 20393 1 1 35 ARG CG C -6.107 -2.040 8.291 1.00 . A A . 35 ARG CG 1 1 33 20394 1 1 35 ARG CZ C -8.091 -1.497 10.650 1.00 . A A . 35 ARG CZ 1 1 33 20395 1 1 35 ARG H H -4.612 -2.543 4.383 1.00 . A A . 35 ARG H 1 1 33 20396 1 1 35 ARG HA H -7.148 -1.911 5.744 1.00 . A A . 35 ARG HA 1 1 33 20397 1 1 35 ARG HB2 H -5.766 -3.612 6.907 1.00 . A A . 35 ARG HB2 1 1 33 20398 1 1 35 ARG HB3 H -4.458 -2.442 7.016 1.00 . A A . 35 ARG HB3 1 1 33 20399 1 1 35 ARG HD2 H -7.845 -3.165 7.793 1.00 . A A . 35 ARG HD2 1 1 33 20400 1 1 35 ARG HD3 H -7.083 -3.632 9.313 1.00 . A A . 35 ARG HD3 1 1 33 20401 1 1 35 ARG HE H -9.142 -1.712 8.967 1.00 . A A . 35 ARG HE 1 1 33 20402 1 1 35 ARG HG2 H -5.369 -2.155 9.071 1.00 . A A . 35 ARG HG2 1 1 33 20403 1 1 35 ARG HG3 H -6.350 -0.994 8.175 1.00 . A A . 35 ARG HG3 1 1 33 20404 1 1 35 ARG HH11 H -6.281 -2.377 10.852 1.00 . A A . 35 ARG HH11 1 1 33 20405 1 1 35 ARG HH12 H -6.815 -1.457 12.218 1.00 . A A . 35 ARG HH12 1 1 33 20406 1 1 35 ARG HH21 H -9.846 -0.501 10.763 1.00 . A A . 35 ARG HH21 1 1 33 20407 1 1 35 ARG HH22 H -8.839 -0.392 12.168 1.00 . A A . 35 ARG HH22 1 1 33 20408 1 1 35 ARG N N -5.579 -2.483 4.534 1.00 . A A . 35 ARG N 1 1 33 20409 1 1 35 ARG NE N -8.306 -1.953 9.418 1.00 . A A . 35 ARG NE 1 1 33 20410 1 1 35 ARG NH1 N -6.970 -1.802 11.292 1.00 . A A . 35 ARG NH1 1 1 33 20411 1 1 35 ARG NH2 N -8.999 -0.734 11.242 1.00 . A A . 35 ARG NH2 1 1 33 20412 1 1 35 ARG O O -6.446 0.479 6.235 1.00 . A A . 35 ARG O 1 1 33 20413 1 1 36 SER C C -3.147 1.553 4.038 1.00 . A A . 36 SER C 1 1 33 20414 1 1 36 SER CA C -3.968 1.293 5.296 1.00 . A A . 36 SER CA 1 1 33 20415 1 1 36 SER CB C -3.119 1.565 6.539 1.00 . A A . 36 SER CB 1 1 33 20416 1 1 36 SER H H -3.902 -0.798 4.973 1.00 . A A . 36 SER H 1 1 33 20417 1 1 36 SER HA H -4.819 1.957 5.300 1.00 . A A . 36 SER HA 1 1 33 20418 1 1 36 SER HB2 H -2.416 0.757 6.676 1.00 . A A . 36 SER HB2 1 1 33 20419 1 1 36 SER HB3 H -2.580 2.492 6.408 1.00 . A A . 36 SER HB3 1 1 33 20420 1 1 36 SER HG H -3.477 2.198 8.358 1.00 . A A . 36 SER HG 1 1 33 20421 1 1 36 SER N N -4.469 -0.076 5.316 1.00 . A A . 36 SER N 1 1 33 20422 1 1 36 SER O O -2.545 0.637 3.477 1.00 . A A . 36 SER O 1 1 33 20423 1 1 36 SER OG O -3.928 1.666 7.698 1.00 . A A . 36 SER OG 1 1 33 20424 1 1 37 CYS C C -0.874 3.172 2.676 1.00 . A A . 37 CYS C 1 1 33 20425 1 1 37 CYS CA C -2.377 3.187 2.408 1.00 . A A . 37 CYS CA 1 1 33 20426 1 1 37 CYS CB C -2.809 4.575 1.930 1.00 . A A . 37 CYS CB 1 1 33 20427 1 1 37 CYS H H -3.624 3.494 4.090 1.00 . A A . 37 CYS H 1 1 33 20428 1 1 37 CYS HA H -2.599 2.466 1.635 1.00 . A A . 37 CYS HA 1 1 33 20429 1 1 37 CYS HB2 H -3.208 5.128 2.767 1.00 . A A . 37 CYS HB2 1 1 33 20430 1 1 37 CYS HB3 H -1.949 5.097 1.537 1.00 . A A . 37 CYS HB3 1 1 33 20431 1 1 37 CYS N N -3.126 2.807 3.600 1.00 . A A . 37 CYS N 1 1 33 20432 1 1 37 CYS O O -0.071 3.052 1.751 1.00 . A A . 37 CYS O 1 1 33 20433 1 1 37 CYS SG S -4.083 4.548 0.628 1.00 . A A . 37 CYS SG 1 1 33 20434 1 1 38 GLU C C 1.465 1.872 4.340 1.00 . A A . 38 GLU C 1 1 33 20435 1 1 38 GLU CA C 0.908 3.292 4.330 1.00 . A A . 38 GLU CA 1 1 33 20436 1 1 38 GLU CB C 1.083 3.931 5.709 1.00 . A A . 38 GLU CB 1 1 33 20437 1 1 38 GLU CD C 2.865 4.513 7.402 1.00 . A A . 38 GLU CD 1 1 33 20438 1 1 38 GLU CG C 2.469 4.511 5.938 1.00 . A A . 38 GLU CG 1 1 33 20439 1 1 38 GLU H H -1.184 3.387 4.641 1.00 . A A . 38 GLU H 1 1 33 20440 1 1 38 GLU HA H 1.451 3.874 3.601 1.00 . A A . 38 GLU HA 1 1 33 20441 1 1 38 GLU HB2 H 0.361 4.726 5.818 1.00 . A A . 38 GLU HB2 1 1 33 20442 1 1 38 GLU HB3 H 0.899 3.183 6.466 1.00 . A A . 38 GLU HB3 1 1 33 20443 1 1 38 GLU HG2 H 3.188 3.922 5.388 1.00 . A A . 38 GLU HG2 1 1 33 20444 1 1 38 GLU HG3 H 2.484 5.528 5.575 1.00 . A A . 38 GLU HG3 1 1 33 20445 1 1 38 GLU N N -0.499 3.294 3.946 1.00 . A A . 38 GLU N 1 1 33 20446 1 1 38 GLU O O 1.040 1.034 5.135 1.00 . A A . 38 GLU O 1 1 33 20447 1 1 38 GLU OE1 O 2.660 5.547 8.071 1.00 . A A . 38 GLU OE1 1 1 33 20448 1 1 38 GLU OE2 O 3.379 3.480 7.879 1.00 . A A . 38 GLU OE2 1 1 33 20449 1 1 39 CYS C C 3.742 -0.073 4.662 1.00 . A A . 39 CYS C 1 1 33 20450 1 1 39 CYS CA C 3.033 0.289 3.359 1.00 . A A . 39 CYS CA 1 1 33 20451 1 1 39 CYS CB C 4.025 0.243 2.195 1.00 . A A . 39 CYS CB 1 1 33 20452 1 1 39 CYS H H 2.715 2.318 2.844 1.00 . A A . 39 CYS H 1 1 33 20453 1 1 39 CYS HA H 2.247 -0.430 3.179 1.00 . A A . 39 CYS HA 1 1 33 20454 1 1 39 CYS HB2 H 4.917 0.787 2.470 1.00 . A A . 39 CYS HB2 1 1 33 20455 1 1 39 CYS HB3 H 4.285 -0.786 1.994 1.00 . A A . 39 CYS HB3 1 1 33 20456 1 1 39 CYS N N 2.418 1.609 3.451 1.00 . A A . 39 CYS N 1 1 33 20457 1 1 39 CYS O O 4.170 0.805 5.410 1.00 . A A . 39 CYS O 1 1 33 20458 1 1 39 CYS SG S 3.394 0.966 0.647 1.00 . A A . 39 CYS SG 1 1 33 20459 1 1 40 PRO C C 6.043 -1.610 6.144 1.00 . A A . 40 PRO C 1 1 33 20460 1 1 40 PRO CA C 4.538 -1.855 6.169 1.00 . A A . 40 PRO CA 1 1 33 20461 1 1 40 PRO CB C 4.241 -3.356 6.173 1.00 . A A . 40 PRO CB 1 1 33 20462 1 1 40 PRO CD C 3.395 -2.493 4.111 1.00 . A A . 40 PRO CD 1 1 33 20463 1 1 40 PRO CG C 4.027 -3.703 4.740 1.00 . A A . 40 PRO CG 1 1 33 20464 1 1 40 PRO HA H 4.115 -1.399 7.052 1.00 . A A . 40 PRO HA 1 1 33 20465 1 1 40 PRO HB2 H 5.082 -3.891 6.589 1.00 . A A . 40 PRO HB2 1 1 33 20466 1 1 40 PRO HB3 H 3.356 -3.549 6.761 1.00 . A A . 40 PRO HB3 1 1 33 20467 1 1 40 PRO HD2 H 3.730 -2.380 3.090 1.00 . A A . 40 PRO HD2 1 1 33 20468 1 1 40 PRO HD3 H 2.318 -2.567 4.150 1.00 . A A . 40 PRO HD3 1 1 33 20469 1 1 40 PRO HG2 H 4.975 -3.919 4.270 1.00 . A A . 40 PRO HG2 1 1 33 20470 1 1 40 PRO HG3 H 3.367 -4.554 4.663 1.00 . A A . 40 PRO HG3 1 1 33 20471 1 1 40 PRO N N 3.876 -1.380 4.950 1.00 . A A . 40 PRO N 1 1 33 20472 1 1 40 PRO O O 6.660 -1.583 5.079 1.00 . A A . 40 PRO O 1 1 33 20473 1 1 41 SER C C 8.805 -2.473 7.786 1.00 . A A . 41 SER C 1 1 33 20474 1 1 41 SER CA C 8.061 -1.188 7.437 1.00 . A A . 41 SER CA 1 1 33 20475 1 1 41 SER CB C 8.337 -0.122 8.498 1.00 . A A . 41 SER CB 1 1 33 20476 1 1 41 SER H H 6.083 -1.464 8.137 1.00 . A A . 41 SER H 1 1 33 20477 1 1 41 SER HA H 8.413 -0.831 6.480 1.00 . A A . 41 SER HA 1 1 33 20478 1 1 41 SER HB2 H 9.395 0.093 8.524 1.00 . A A . 41 SER HB2 1 1 33 20479 1 1 41 SER HB3 H 7.793 0.778 8.250 1.00 . A A . 41 SER HB3 1 1 33 20480 1 1 41 SER HG H 6.978 -0.689 9.790 1.00 . A A . 41 SER HG 1 1 33 20481 1 1 41 SER N N 6.628 -1.431 7.323 1.00 . A A . 41 SER N 1 1 33 20482 1 1 41 SER O O 9.790 -2.452 8.524 1.00 . A A . 41 SER O 1 1 33 20483 1 1 41 SER OG O 7.930 -0.562 9.782 1.00 . A A . 41 SER OG 1 1 33 20484 1 1 42 TYR C C 8.591 -5.887 6.406 1.00 . A A . 42 TYR C 1 1 33 20485 1 1 42 TYR CA C 8.947 -4.887 7.504 1.00 . A A . 42 TYR CA 1 1 33 20486 1 1 42 TYR CB C 8.507 -5.428 8.865 1.00 . A A . 42 TYR CB 1 1 33 20487 1 1 42 TYR CD1 C 6.343 -4.186 9.254 1.00 . A A . 42 TYR CD1 1 1 33 20488 1 1 42 TYR CD2 C 6.264 -6.564 9.097 1.00 . A A . 42 TYR CD2 1 1 33 20489 1 1 42 TYR CE1 C 4.975 -4.149 9.447 1.00 . A A . 42 TYR CE1 1 1 33 20490 1 1 42 TYR CE2 C 4.895 -6.535 9.289 1.00 . A A . 42 TYR CE2 1 1 33 20491 1 1 42 TYR CG C 7.010 -5.392 9.076 1.00 . A A . 42 TYR CG 1 1 33 20492 1 1 42 TYR CZ C 4.256 -5.326 9.464 1.00 . A A . 42 TYR CZ 1 1 33 20493 1 1 42 TYR H H 7.540 -3.545 6.669 1.00 . A A . 42 TYR H 1 1 33 20494 1 1 42 TYR HA H 10.018 -4.746 7.512 1.00 . A A . 42 TYR HA 1 1 33 20495 1 1 42 TYR HB2 H 8.829 -6.454 8.959 1.00 . A A . 42 TYR HB2 1 1 33 20496 1 1 42 TYR HB3 H 8.967 -4.838 9.645 1.00 . A A . 42 TYR HB3 1 1 33 20497 1 1 42 TYR HD1 H 6.908 -3.266 9.240 1.00 . A A . 42 TYR HD1 1 1 33 20498 1 1 42 TYR HD2 H 6.767 -7.509 8.961 1.00 . A A . 42 TYR HD2 1 1 33 20499 1 1 42 TYR HE1 H 4.474 -3.202 9.583 1.00 . A A . 42 TYR HE1 1 1 33 20500 1 1 42 TYR HE2 H 4.333 -7.457 9.302 1.00 . A A . 42 TYR HE2 1 1 33 20501 1 1 42 TYR HH H 2.681 -5.678 10.509 1.00 . A A . 42 TYR HH 1 1 33 20502 1 1 42 TYR N N 8.328 -3.592 7.249 1.00 . A A . 42 TYR N 1 1 33 20503 1 1 42 TYR O O 7.559 -5.757 5.748 1.00 . A A . 42 TYR O 1 1 33 20504 1 1 42 TYR OH O 2.894 -5.293 9.655 1.00 . A A . 42 TYR OH 1 1 33 20505 1 1 43 PRO C C 7.834 -8.561 5.286 1.00 . A A . 43 PRO C 1 1 33 20506 1 1 43 PRO CA C 9.216 -7.927 5.170 1.00 . A A . 43 PRO CA 1 1 33 20507 1 1 43 PRO CB C 10.305 -8.964 5.452 1.00 . A A . 43 PRO CB 1 1 33 20508 1 1 43 PRO CD C 10.700 -7.132 6.935 1.00 . A A . 43 PRO CD 1 1 33 20509 1 1 43 PRO CG C 11.388 -8.201 6.132 1.00 . A A . 43 PRO CG 1 1 33 20510 1 1 43 PRO HA H 9.344 -7.527 4.175 1.00 . A A . 43 PRO HA 1 1 33 20511 1 1 43 PRO HB2 H 9.909 -9.742 6.089 1.00 . A A . 43 PRO HB2 1 1 33 20512 1 1 43 PRO HB3 H 10.648 -9.392 4.523 1.00 . A A . 43 PRO HB3 1 1 33 20513 1 1 43 PRO HD2 H 10.498 -7.484 7.936 1.00 . A A . 43 PRO HD2 1 1 33 20514 1 1 43 PRO HD3 H 11.301 -6.235 6.963 1.00 . A A . 43 PRO HD3 1 1 33 20515 1 1 43 PRO HG2 H 11.948 -8.857 6.782 1.00 . A A . 43 PRO HG2 1 1 33 20516 1 1 43 PRO HG3 H 12.041 -7.755 5.396 1.00 . A A . 43 PRO HG3 1 1 33 20517 1 1 43 PRO N N 9.446 -6.903 6.194 1.00 . A A . 43 PRO N 1 1 33 20518 1 1 43 PRO O O 7.169 -8.441 6.315 1.00 . A A . 43 PRO O 1 1 33 20519 1 1 44 GLY C C 6.131 -11.234 4.907 1.00 . A A . 44 GLY C 1 1 33 20520 1 1 44 GLY CA C 6.107 -9.879 4.227 1.00 . A A . 44 GLY CA 1 1 33 20521 1 1 44 GLY H H 7.981 -9.298 3.431 1.00 . A A . 44 GLY H 1 1 33 20522 1 1 44 GLY HA2 H 5.778 -10.007 3.206 1.00 . A A . 44 GLY HA2 1 1 33 20523 1 1 44 GLY HA3 H 5.404 -9.242 4.743 1.00 . A A . 44 GLY HA3 1 1 33 20524 1 1 44 GLY N N 7.407 -9.236 4.224 1.00 . A A . 44 GLY N 1 1 33 20525 1 1 44 GLY O O 5.993 -11.278 6.147 1.00 . A A . 44 GLY O 1 1 33 20526 1 1 44 GLY OXT O 6.287 -12.251 4.199 1.00 . A A . 44 GLY OXT 1 1 34 20527 1 1 1 ALA C C -10.834 13.943 4.022 1.00 . A A . 1 ALA C 1 1 34 20528 1 1 1 ALA CA C -11.655 13.485 5.223 1.00 . A A . 1 ALA CA 1 1 34 20529 1 1 1 ALA CB C -10.756 13.298 6.436 1.00 . A A . 1 ALA CB 1 1 34 20530 1 1 1 ALA H1 H -12.974 12.392 4.084 1.00 . A A . 1 ALA H1 1 1 34 20531 1 1 1 ALA H2 H -11.674 11.486 4.737 1.00 . A A . 1 ALA H2 1 1 34 20532 1 1 1 ALA H3 H -12.963 11.989 5.752 1.00 . A A . 1 ALA H3 1 1 34 20533 1 1 1 ALA HA H -12.382 14.248 5.459 1.00 . A A . 1 ALA HA 1 1 34 20534 1 1 1 ALA HB1 H -10.290 14.239 6.686 1.00 . A A . 1 ALA HB1 1 1 34 20535 1 1 1 ALA HB2 H -9.993 12.568 6.209 1.00 . A A . 1 ALA HB2 1 1 34 20536 1 1 1 ALA HB3 H -11.347 12.955 7.272 1.00 . A A . 1 ALA HB3 1 1 34 20537 1 1 1 ALA N N -12.382 12.225 4.922 1.00 . A A . 1 ALA N 1 1 34 20538 1 1 1 ALA O O -11.153 14.948 3.387 1.00 . A A . 1 ALA O 1 1 34 20539 1 1 2 MET C C -9.531 13.078 1.275 1.00 . A A . 2 MET C 1 1 34 20540 1 1 2 MET CA C -8.909 13.530 2.592 1.00 . A A . 2 MET CA 1 1 34 20541 1 1 2 MET CB C -7.536 12.879 2.771 1.00 . A A . 2 MET CB 1 1 34 20542 1 1 2 MET CE C -5.615 16.259 3.652 1.00 . A A . 2 MET CE 1 1 34 20543 1 1 2 MET CG C -6.600 13.669 3.670 1.00 . A A . 2 MET CG 1 1 34 20544 1 1 2 MET H H -9.573 12.410 4.261 1.00 . A A . 2 MET H 1 1 34 20545 1 1 2 MET HA H -8.788 14.603 2.570 1.00 . A A . 2 MET HA 1 1 34 20546 1 1 2 MET HB2 H -7.669 11.897 3.200 1.00 . A A . 2 MET HB2 1 1 34 20547 1 1 2 MET HB3 H -7.069 12.778 1.802 1.00 . A A . 2 MET HB3 1 1 34 20548 1 1 2 MET HE1 H -6.592 16.317 4.108 1.00 . A A . 2 MET HE1 1 1 34 20549 1 1 2 MET HE2 H -4.857 16.295 4.420 1.00 . A A . 2 MET HE2 1 1 34 20550 1 1 2 MET HE3 H -5.483 17.092 2.977 1.00 . A A . 2 MET HE3 1 1 34 20551 1 1 2 MET HG2 H -7.192 14.290 4.326 1.00 . A A . 2 MET HG2 1 1 34 20552 1 1 2 MET HG3 H -6.020 12.976 4.261 1.00 . A A . 2 MET HG3 1 1 34 20553 1 1 2 MET N N -9.776 13.200 3.717 1.00 . A A . 2 MET N 1 1 34 20554 1 1 2 MET O O -9.915 11.919 1.123 1.00 . A A . 2 MET O 1 1 34 20555 1 1 2 MET SD S -5.471 14.724 2.741 1.00 . A A . 2 MET SD 1 1 34 20556 1 1 3 ASP C C -9.402 12.612 -1.690 1.00 . A A . 3 ASP C 1 1 34 20557 1 1 3 ASP CA C -10.203 13.699 -0.981 1.00 . A A . 3 ASP CA 1 1 34 20558 1 1 3 ASP CB C -10.251 14.960 -1.846 1.00 . A A . 3 ASP CB 1 1 34 20559 1 1 3 ASP CG C -8.878 15.563 -2.066 1.00 . A A . 3 ASP CG 1 1 34 20560 1 1 3 ASP H H -9.304 14.910 0.505 1.00 . A A . 3 ASP H 1 1 34 20561 1 1 3 ASP HA H -11.210 13.343 -0.824 1.00 . A A . 3 ASP HA 1 1 34 20562 1 1 3 ASP HB2 H -10.673 14.713 -2.808 1.00 . A A . 3 ASP HB2 1 1 34 20563 1 1 3 ASP HB3 H -10.875 15.697 -1.362 1.00 . A A . 3 ASP HB3 1 1 34 20564 1 1 3 ASP N N -9.628 14.002 0.324 1.00 . A A . 3 ASP N 1 1 34 20565 1 1 3 ASP O O -8.267 12.839 -2.110 1.00 . A A . 3 ASP O 1 1 34 20566 1 1 3 ASP OD1 O -8.308 15.359 -3.158 1.00 . A A . 3 ASP OD1 1 1 34 20567 1 1 3 ASP OD2 O -8.372 16.239 -1.145 1.00 . A A . 3 ASP OD2 1 1 34 20568 1 1 4 CYS C C -8.063 9.920 -1.745 1.00 . A A . 4 CYS C 1 1 34 20569 1 1 4 CYS CA C -9.343 10.309 -2.478 1.00 . A A . 4 CYS CA 1 1 34 20570 1 1 4 CYS CB C -9.023 10.657 -3.932 1.00 . A A . 4 CYS CB 1 1 34 20571 1 1 4 CYS H H -10.905 11.314 -1.463 1.00 . A A . 4 CYS H 1 1 34 20572 1 1 4 CYS HA H -10.023 9.470 -2.459 1.00 . A A . 4 CYS HA 1 1 34 20573 1 1 4 CYS HB2 H -8.625 11.660 -3.976 1.00 . A A . 4 CYS HB2 1 1 34 20574 1 1 4 CYS HB3 H -8.282 9.965 -4.305 1.00 . A A . 4 CYS HB3 1 1 34 20575 1 1 4 CYS N N -10.000 11.432 -1.819 1.00 . A A . 4 CYS N 1 1 34 20576 1 1 4 CYS O O -7.099 10.684 -1.711 1.00 . A A . 4 CYS O 1 1 34 20577 1 1 4 CYS SG S -10.461 10.584 -5.049 1.00 . A A . 4 CYS SG 1 1 34 20578 1 1 5 THR C C -5.674 8.173 -1.345 1.00 . A A . 5 THR C 1 1 34 20579 1 1 5 THR CA C -6.897 8.233 -0.434 1.00 . A A . 5 THR CA 1 1 34 20580 1 1 5 THR CB C -7.182 6.848 0.149 1.00 . A A . 5 THR CB 1 1 34 20581 1 1 5 THR CG2 C -8.531 6.750 0.827 1.00 . A A . 5 THR CG2 1 1 34 20582 1 1 5 THR H H -8.858 8.160 -1.227 1.00 . A A . 5 THR H 1 1 34 20583 1 1 5 THR HA H -6.696 8.921 0.374 1.00 . A A . 5 THR HA 1 1 34 20584 1 1 5 THR HB H -6.425 6.616 0.884 1.00 . A A . 5 THR HB 1 1 34 20585 1 1 5 THR HG1 H -6.818 5.034 -0.491 1.00 . A A . 5 THR HG1 1 1 34 20586 1 1 5 THR HG21 H -9.064 7.682 0.706 1.00 . A A . 5 THR HG21 1 1 34 20587 1 1 5 THR HG22 H -9.101 5.949 0.380 1.00 . A A . 5 THR HG22 1 1 34 20588 1 1 5 THR HG23 H -8.392 6.550 1.879 1.00 . A A . 5 THR HG23 1 1 34 20589 1 1 5 THR N N -8.060 8.725 -1.163 1.00 . A A . 5 THR N 1 1 34 20590 1 1 5 THR O O -5.627 7.379 -2.283 1.00 . A A . 5 THR O 1 1 34 20591 1 1 5 THR OG1 O -7.137 5.859 -0.864 1.00 . A A . 5 THR OG1 1 1 34 20592 1 1 6 THR C C -2.269 8.593 -1.040 1.00 . A A . 6 THR C 1 1 34 20593 1 1 6 THR CA C -3.467 9.061 -1.858 1.00 . A A . 6 THR CA 1 1 34 20594 1 1 6 THR CB C -3.223 10.478 -2.381 1.00 . A A . 6 THR CB 1 1 34 20595 1 1 6 THR CG2 C -3.810 10.718 -3.755 1.00 . A A . 6 THR CG2 1 1 34 20596 1 1 6 THR H H -4.786 9.630 -0.302 1.00 . A A . 6 THR H 1 1 34 20597 1 1 6 THR HA H -3.596 8.395 -2.699 1.00 . A A . 6 THR HA 1 1 34 20598 1 1 6 THR HB H -2.157 10.650 -2.442 1.00 . A A . 6 THR HB 1 1 34 20599 1 1 6 THR HG1 H -4.736 11.370 -1.515 1.00 . A A . 6 THR HG1 1 1 34 20600 1 1 6 THR HG21 H -4.121 9.777 -4.183 1.00 . A A . 6 THR HG21 1 1 34 20601 1 1 6 THR HG22 H -4.663 11.376 -3.672 1.00 . A A . 6 THR HG22 1 1 34 20602 1 1 6 THR HG23 H -3.065 11.174 -4.390 1.00 . A A . 6 THR HG23 1 1 34 20603 1 1 6 THR N N -4.689 9.019 -1.063 1.00 . A A . 6 THR N 1 1 34 20604 1 1 6 THR O O -2.181 8.857 0.159 1.00 . A A . 6 THR O 1 1 34 20605 1 1 6 THR OG1 O -3.778 11.440 -1.502 1.00 . A A . 6 THR OG1 1 1 34 20606 1 1 7 GLY C C 0.357 6.110 -1.623 1.00 . A A . 7 GLY C 1 1 34 20607 1 1 7 GLY CA C -0.168 7.398 -1.014 1.00 . A A . 7 GLY CA 1 1 34 20608 1 1 7 GLY H H -1.472 7.713 -2.652 1.00 . A A . 7 GLY H 1 1 34 20609 1 1 7 GLY HA2 H -0.414 7.219 0.022 1.00 . A A . 7 GLY HA2 1 1 34 20610 1 1 7 GLY HA3 H 0.606 8.149 -1.065 1.00 . A A . 7 GLY HA3 1 1 34 20611 1 1 7 GLY N N -1.348 7.894 -1.696 1.00 . A A . 7 GLY N 1 1 34 20612 1 1 7 GLY O O 0.094 5.823 -2.791 1.00 . A A . 7 GLY O 1 1 34 20613 1 1 8 PRO C C 0.630 2.934 -1.415 1.00 . A A . 8 PRO C 1 1 34 20614 1 1 8 PRO CA C 1.672 4.046 -1.333 1.00 . A A . 8 PRO CA 1 1 34 20615 1 1 8 PRO CB C 2.729 3.712 -0.282 1.00 . A A . 8 PRO CB 1 1 34 20616 1 1 8 PRO CD C 1.478 5.577 0.555 1.00 . A A . 8 PRO CD 1 1 34 20617 1 1 8 PRO CG C 2.220 4.335 0.972 1.00 . A A . 8 PRO CG 1 1 34 20618 1 1 8 PRO HA H 2.145 4.166 -2.297 1.00 . A A . 8 PRO HA 1 1 34 20619 1 1 8 PRO HB2 H 2.817 2.639 -0.184 1.00 . A A . 8 PRO HB2 1 1 34 20620 1 1 8 PRO HB3 H 3.679 4.133 -0.574 1.00 . A A . 8 PRO HB3 1 1 34 20621 1 1 8 PRO HD2 H 0.596 5.711 1.164 1.00 . A A . 8 PRO HD2 1 1 34 20622 1 1 8 PRO HD3 H 2.121 6.442 0.626 1.00 . A A . 8 PRO HD3 1 1 34 20623 1 1 8 PRO HG2 H 1.553 3.651 1.477 1.00 . A A . 8 PRO HG2 1 1 34 20624 1 1 8 PRO HG3 H 3.049 4.593 1.615 1.00 . A A . 8 PRO HG3 1 1 34 20625 1 1 8 PRO N N 1.110 5.309 -0.850 1.00 . A A . 8 PRO N 1 1 34 20626 1 1 8 PRO O O 0.572 2.196 -2.398 1.00 . A A . 8 PRO O 1 1 34 20627 1 1 9 CYS C C -2.569 2.346 -0.800 1.00 . A A . 9 CYS C 1 1 34 20628 1 1 9 CYS CA C -1.226 1.791 -0.331 1.00 . A A . 9 CYS CA 1 1 34 20629 1 1 9 CYS CB C -1.358 1.229 1.087 1.00 . A A . 9 CYS CB 1 1 34 20630 1 1 9 CYS H H -0.094 3.433 0.382 1.00 . A A . 9 CYS H 1 1 34 20631 1 1 9 CYS HA H -0.929 0.994 -0.996 1.00 . A A . 9 CYS HA 1 1 34 20632 1 1 9 CYS HB2 H -1.098 2.000 1.796 1.00 . A A . 9 CYS HB2 1 1 34 20633 1 1 9 CYS HB3 H -2.381 0.925 1.252 1.00 . A A . 9 CYS HB3 1 1 34 20634 1 1 9 CYS N N -0.190 2.817 -0.374 1.00 . A A . 9 CYS N 1 1 34 20635 1 1 9 CYS O O -3.561 2.301 -0.072 1.00 . A A . 9 CYS O 1 1 34 20636 1 1 9 CYS SG S -0.289 -0.209 1.418 1.00 . A A . 9 CYS SG 1 1 34 20637 1 1 10 CYS C C -3.603 3.815 -4.053 1.00 . A A . 10 CYS C 1 1 34 20638 1 1 10 CYS CA C -3.813 3.427 -2.593 1.00 . A A . 10 CYS CA 1 1 34 20639 1 1 10 CYS CB C -4.283 4.650 -1.795 1.00 . A A . 10 CYS CB 1 1 34 20640 1 1 10 CYS H H -1.770 2.871 -2.555 1.00 . A A . 10 CYS H 1 1 34 20641 1 1 10 CYS HA H -4.577 2.666 -2.546 1.00 . A A . 10 CYS HA 1 1 34 20642 1 1 10 CYS HB2 H -4.712 5.369 -2.476 1.00 . A A . 10 CYS HB2 1 1 34 20643 1 1 10 CYS HB3 H -5.040 4.340 -1.090 1.00 . A A . 10 CYS HB3 1 1 34 20644 1 1 10 CYS N N -2.592 2.866 -2.023 1.00 . A A . 10 CYS N 1 1 34 20645 1 1 10 CYS O O -2.594 4.425 -4.405 1.00 . A A . 10 CYS O 1 1 34 20646 1 1 10 CYS SG S -2.970 5.499 -0.857 1.00 . A A . 10 CYS SG 1 1 34 20647 1 1 11 ARG C C -5.814 4.346 -6.810 1.00 . A A . 11 ARG C 1 1 34 20648 1 1 11 ARG CA C -4.492 3.769 -6.317 1.00 . A A . 11 ARG CA 1 1 34 20649 1 1 11 ARG CB C -4.135 2.514 -7.117 1.00 . A A . 11 ARG CB 1 1 34 20650 1 1 11 ARG CD C -2.400 1.261 -8.435 1.00 . A A . 11 ARG CD 1 1 34 20651 1 1 11 ARG CG C -2.675 2.454 -7.534 1.00 . A A . 11 ARG CG 1 1 34 20652 1 1 11 ARG CZ C -0.229 1.962 -9.366 1.00 . A A . 11 ARG CZ 1 1 34 20653 1 1 11 ARG H H -5.346 2.975 -4.551 1.00 . A A . 11 ARG H 1 1 34 20654 1 1 11 ARG HA H -3.716 4.507 -6.455 1.00 . A A . 11 ARG HA 1 1 34 20655 1 1 11 ARG HB2 H -4.351 1.643 -6.516 1.00 . A A . 11 ARG HB2 1 1 34 20656 1 1 11 ARG HB3 H -4.743 2.483 -8.010 1.00 . A A . 11 ARG HB3 1 1 34 20657 1 1 11 ARG HD2 H -1.952 0.476 -7.845 1.00 . A A . 11 ARG HD2 1 1 34 20658 1 1 11 ARG HD3 H -3.336 0.912 -8.845 1.00 . A A . 11 ARG HD3 1 1 34 20659 1 1 11 ARG HE H -1.858 1.556 -10.444 1.00 . A A . 11 ARG HE 1 1 34 20660 1 1 11 ARG HG2 H -2.425 3.359 -8.067 1.00 . A A . 11 ARG HG2 1 1 34 20661 1 1 11 ARG HG3 H -2.061 2.375 -6.649 1.00 . A A . 11 ARG HG3 1 1 34 20662 1 1 11 ARG HH11 H -0.267 1.814 -7.349 1.00 . A A . 11 ARG HH11 1 1 34 20663 1 1 11 ARG HH12 H 1.248 2.306 -8.029 1.00 . A A . 11 ARG HH12 1 1 34 20664 1 1 11 ARG HH21 H 0.134 2.202 -11.340 1.00 . A A . 11 ARG HH21 1 1 34 20665 1 1 11 ARG HH22 H 1.476 2.527 -10.294 1.00 . A A . 11 ARG HH22 1 1 34 20666 1 1 11 ARG N N -4.566 3.458 -4.895 1.00 . A A . 11 ARG N 1 1 34 20667 1 1 11 ARG NE N -1.499 1.600 -9.534 1.00 . A A . 11 ARG NE 1 1 34 20668 1 1 11 ARG NH1 N 0.293 2.033 -8.148 1.00 . A A . 11 ARG NH1 1 1 34 20669 1 1 11 ARG NH2 N 0.522 2.254 -10.420 1.00 . A A . 11 ARG NH2 1 1 34 20670 1 1 11 ARG O O -6.878 4.032 -6.276 1.00 . A A . 11 ARG O 1 1 34 20671 1 1 12 GLN C C -7.573 6.776 -7.406 1.00 . A A . 12 GLN C 1 1 34 20672 1 1 12 GLN CA C -6.930 5.817 -8.401 1.00 . A A . 12 GLN CA 1 1 34 20673 1 1 12 GLN CB C -7.942 4.750 -8.831 1.00 . A A . 12 GLN CB 1 1 34 20674 1 1 12 GLN CD C -8.960 5.416 -11.045 1.00 . A A . 12 GLN CD 1 1 34 20675 1 1 12 GLN CG C -7.973 4.513 -10.332 1.00 . A A . 12 GLN CG 1 1 34 20676 1 1 12 GLN H H -4.862 5.403 -8.215 1.00 . A A . 12 GLN H 1 1 34 20677 1 1 12 GLN HA H -6.625 6.377 -9.268 1.00 . A A . 12 GLN HA 1 1 34 20678 1 1 12 GLN HB2 H -7.693 3.817 -8.347 1.00 . A A . 12 GLN HB2 1 1 34 20679 1 1 12 GLN HB3 H -8.929 5.056 -8.517 1.00 . A A . 12 GLN HB3 1 1 34 20680 1 1 12 GLN HE21 H -8.593 4.499 -12.770 1.00 . A A . 12 GLN HE21 1 1 34 20681 1 1 12 GLN HE22 H -9.749 5.782 -12.833 1.00 . A A . 12 GLN HE22 1 1 34 20682 1 1 12 GLN HG2 H -6.987 4.696 -10.733 1.00 . A A . 12 GLN HG2 1 1 34 20683 1 1 12 GLN HG3 H -8.250 3.485 -10.516 1.00 . A A . 12 GLN HG3 1 1 34 20684 1 1 12 GLN N N -5.740 5.193 -7.832 1.00 . A A . 12 GLN N 1 1 34 20685 1 1 12 GLN NE2 N -9.116 5.212 -12.347 1.00 . A A . 12 GLN NE2 1 1 34 20686 1 1 12 GLN O O -7.466 7.995 -7.545 1.00 . A A . 12 GLN O 1 1 34 20687 1 1 12 GLN OE1 O -9.576 6.288 -10.431 1.00 . A A . 12 GLN OE1 1 1 34 20688 1 1 13 CYS C C -9.325 6.169 -4.193 1.00 . A A . 13 CYS C 1 1 34 20689 1 1 13 CYS CA C -8.908 7.024 -5.388 1.00 . A A . 13 CYS CA 1 1 34 20690 1 1 13 CYS CB C -10.137 7.717 -5.983 1.00 . A A . 13 CYS CB 1 1 34 20691 1 1 13 CYS H H -8.293 5.243 -6.353 1.00 . A A . 13 CYS H 1 1 34 20692 1 1 13 CYS HA H -8.211 7.776 -5.052 1.00 . A A . 13 CYS HA 1 1 34 20693 1 1 13 CYS HB2 H -10.496 7.138 -6.821 1.00 . A A . 13 CYS HB2 1 1 34 20694 1 1 13 CYS HB3 H -10.911 7.770 -5.232 1.00 . A A . 13 CYS HB3 1 1 34 20695 1 1 13 CYS N N -8.243 6.218 -6.406 1.00 . A A . 13 CYS N 1 1 34 20696 1 1 13 CYS O O -10.318 6.462 -3.527 1.00 . A A . 13 CYS O 1 1 34 20697 1 1 13 CYS SG S -9.823 9.411 -6.577 1.00 . A A . 13 CYS SG 1 1 34 20698 1 1 14 LYS C C -7.664 3.344 -2.473 1.00 . A A . 14 LYS C 1 1 34 20699 1 1 14 LYS CA C -8.863 4.225 -2.806 1.00 . A A . 14 LYS CA 1 1 34 20700 1 1 14 LYS CB C -10.079 3.354 -3.133 1.00 . A A . 14 LYS CB 1 1 34 20701 1 1 14 LYS CD C -12.563 3.638 -3.395 1.00 . A A . 14 LYS CD 1 1 34 20702 1 1 14 LYS CE C -13.857 4.058 -2.716 1.00 . A A . 14 LYS CE 1 1 34 20703 1 1 14 LYS CG C -11.365 3.835 -2.480 1.00 . A A . 14 LYS CG 1 1 34 20704 1 1 14 LYS H H -7.782 4.925 -4.486 1.00 . A A . 14 LYS H 1 1 34 20705 1 1 14 LYS HA H -9.093 4.839 -1.948 1.00 . A A . 14 LYS HA 1 1 34 20706 1 1 14 LYS HB2 H -10.225 3.347 -4.203 1.00 . A A . 14 LYS HB2 1 1 34 20707 1 1 14 LYS HB3 H -9.887 2.345 -2.799 1.00 . A A . 14 LYS HB3 1 1 34 20708 1 1 14 LYS HD2 H -12.425 4.233 -4.285 1.00 . A A . 14 LYS HD2 1 1 34 20709 1 1 14 LYS HD3 H -12.630 2.593 -3.664 1.00 . A A . 14 LYS HD3 1 1 34 20710 1 1 14 LYS HE2 H -14.252 3.214 -2.170 1.00 . A A . 14 LYS HE2 1 1 34 20711 1 1 14 LYS HE3 H -13.642 4.862 -2.028 1.00 . A A . 14 LYS HE3 1 1 34 20712 1 1 14 LYS HG2 H -11.525 3.277 -1.569 1.00 . A A . 14 LYS HG2 1 1 34 20713 1 1 14 LYS HG3 H -11.268 4.885 -2.248 1.00 . A A . 14 LYS HG3 1 1 34 20714 1 1 14 LYS HZ1 H -14.871 3.900 -4.536 1.00 . A A . 14 LYS HZ1 1 1 34 20715 1 1 14 LYS HZ2 H -15.823 4.495 -3.271 1.00 . A A . 14 LYS HZ2 1 1 34 20716 1 1 14 LYS HZ3 H -14.667 5.492 -4.001 1.00 . A A . 14 LYS HZ3 1 1 34 20717 1 1 14 LYS N N -8.563 5.113 -3.923 1.00 . A A . 14 LYS N 1 1 34 20718 1 1 14 LYS NZ N -14.875 4.518 -3.700 1.00 . A A . 14 LYS NZ 1 1 34 20719 1 1 14 LYS O O -6.782 3.139 -3.306 1.00 . A A . 14 LYS O 1 1 34 20720 1 1 15 LEU C C -6.417 0.748 -1.717 1.00 . A A . 15 LEU C 1 1 34 20721 1 1 15 LEU CA C -6.549 1.964 -0.808 1.00 . A A . 15 LEU CA 1 1 34 20722 1 1 15 LEU CB C -6.777 1.516 0.637 1.00 . A A . 15 LEU CB 1 1 34 20723 1 1 15 LEU CD1 C -7.644 -0.833 0.729 1.00 . A A . 15 LEU CD1 1 1 34 20724 1 1 15 LEU CD2 C -8.626 0.920 2.219 1.00 . A A . 15 LEU CD2 1 1 34 20725 1 1 15 LEU CG C -8.009 0.638 0.857 1.00 . A A . 15 LEU CG 1 1 34 20726 1 1 15 LEU H H -8.373 3.024 -0.631 1.00 . A A . 15 LEU H 1 1 34 20727 1 1 15 LEU HA H -5.636 2.535 -0.858 1.00 . A A . 15 LEU HA 1 1 34 20728 1 1 15 LEU HB2 H -5.905 0.966 0.962 1.00 . A A . 15 LEU HB2 1 1 34 20729 1 1 15 LEU HB3 H -6.876 2.397 1.253 1.00 . A A . 15 LEU HB3 1 1 34 20730 1 1 15 LEU HD11 H -6.643 -0.989 1.103 1.00 . A A . 15 LEU HD11 1 1 34 20731 1 1 15 LEU HD12 H -8.340 -1.427 1.302 1.00 . A A . 15 LEU HD12 1 1 34 20732 1 1 15 LEU HD13 H -7.690 -1.126 -0.309 1.00 . A A . 15 LEU HD13 1 1 34 20733 1 1 15 LEU HD21 H -7.876 1.339 2.874 1.00 . A A . 15 LEU HD21 1 1 34 20734 1 1 15 LEU HD22 H -9.439 1.623 2.107 1.00 . A A . 15 LEU HD22 1 1 34 20735 1 1 15 LEU HD23 H -9.001 0.000 2.643 1.00 . A A . 15 LEU HD23 1 1 34 20736 1 1 15 LEU HG H -8.746 0.866 0.101 1.00 . A A . 15 LEU HG 1 1 34 20737 1 1 15 LEU N N -7.640 2.825 -1.250 1.00 . A A . 15 LEU N 1 1 34 20738 1 1 15 LEU O O -7.415 0.152 -2.122 1.00 . A A . 15 LEU O 1 1 34 20739 1 1 16 LYS C C -5.477 -2.039 -2.286 1.00 . A A . 16 LYS C 1 1 34 20740 1 1 16 LYS CA C -4.920 -0.757 -2.901 1.00 . A A . 16 LYS CA 1 1 34 20741 1 1 16 LYS CB C -3.417 -0.904 -3.149 1.00 . A A . 16 LYS CB 1 1 34 20742 1 1 16 LYS CD C -1.859 -1.137 -5.108 1.00 . A A . 16 LYS CD 1 1 34 20743 1 1 16 LYS CE C -0.778 -0.262 -5.720 1.00 . A A . 16 LYS CE 1 1 34 20744 1 1 16 LYS CG C -2.956 -0.302 -4.467 1.00 . A A . 16 LYS CG 1 1 34 20745 1 1 16 LYS H H -4.424 0.902 -1.684 1.00 . A A . 16 LYS H 1 1 34 20746 1 1 16 LYS HA H -5.417 -0.577 -3.844 1.00 . A A . 16 LYS HA 1 1 34 20747 1 1 16 LYS HB2 H -2.883 -0.415 -2.348 1.00 . A A . 16 LYS HB2 1 1 34 20748 1 1 16 LYS HB3 H -3.164 -1.955 -3.150 1.00 . A A . 16 LYS HB3 1 1 34 20749 1 1 16 LYS HD2 H -1.412 -1.768 -4.353 1.00 . A A . 16 LYS HD2 1 1 34 20750 1 1 16 LYS HD3 H -2.293 -1.752 -5.882 1.00 . A A . 16 LYS HD3 1 1 34 20751 1 1 16 LYS HE2 H -1.215 0.686 -5.999 1.00 . A A . 16 LYS HE2 1 1 34 20752 1 1 16 LYS HE3 H -0.004 -0.098 -4.984 1.00 . A A . 16 LYS HE3 1 1 34 20753 1 1 16 LYS HG2 H -3.797 -0.252 -5.142 1.00 . A A . 16 LYS HG2 1 1 34 20754 1 1 16 LYS HG3 H -2.579 0.693 -4.284 1.00 . A A . 16 LYS HG3 1 1 34 20755 1 1 16 LYS HZ1 H -0.920 -1.215 -7.573 1.00 . A A . 16 LYS HZ1 1 1 34 20756 1 1 16 LYS HZ2 H 0.425 -0.199 -7.427 1.00 . A A . 16 LYS HZ2 1 1 34 20757 1 1 16 LYS HZ3 H 0.413 -1.703 -6.653 1.00 . A A . 16 LYS HZ3 1 1 34 20758 1 1 16 LYS N N -5.180 0.387 -2.037 1.00 . A A . 16 LYS N 1 1 34 20759 1 1 16 LYS NZ N -0.173 -0.889 -6.928 1.00 . A A . 16 LYS NZ 1 1 34 20760 1 1 16 LYS O O -5.817 -2.072 -1.103 1.00 . A A . 16 LYS O 1 1 34 20761 1 1 17 PRO C C -5.194 -5.035 -1.553 1.00 . A A . 17 PRO C 1 1 34 20762 1 1 17 PRO CA C -6.096 -4.404 -2.608 1.00 . A A . 17 PRO CA 1 1 34 20763 1 1 17 PRO CB C -6.129 -5.270 -3.871 1.00 . A A . 17 PRO CB 1 1 34 20764 1 1 17 PRO CD C -5.195 -3.166 -4.505 1.00 . A A . 17 PRO CD 1 1 34 20765 1 1 17 PRO CG C -5.148 -4.639 -4.797 1.00 . A A . 17 PRO CG 1 1 34 20766 1 1 17 PRO HA H -7.095 -4.304 -2.210 1.00 . A A . 17 PRO HA 1 1 34 20767 1 1 17 PRO HB2 H -5.844 -6.282 -3.623 1.00 . A A . 17 PRO HB2 1 1 34 20768 1 1 17 PRO HB3 H -7.125 -5.263 -4.289 1.00 . A A . 17 PRO HB3 1 1 34 20769 1 1 17 PRO HD2 H -4.223 -2.719 -4.660 1.00 . A A . 17 PRO HD2 1 1 34 20770 1 1 17 PRO HD3 H -5.938 -2.682 -5.122 1.00 . A A . 17 PRO HD3 1 1 34 20771 1 1 17 PRO HG2 H -4.159 -5.028 -4.605 1.00 . A A . 17 PRO HG2 1 1 34 20772 1 1 17 PRO HG3 H -5.434 -4.827 -5.821 1.00 . A A . 17 PRO HG3 1 1 34 20773 1 1 17 PRO N N -5.578 -3.116 -3.083 1.00 . A A . 17 PRO N 1 1 34 20774 1 1 17 PRO O O -3.969 -4.935 -1.629 1.00 . A A . 17 PRO O 1 1 34 20775 1 1 18 ALA C C -4.063 -7.344 -0.056 1.00 . A A . 18 ALA C 1 1 34 20776 1 1 18 ALA CA C -5.059 -6.333 0.503 1.00 . A A . 18 ALA CA 1 1 34 20777 1 1 18 ALA CB C -6.013 -7.011 1.475 1.00 . A A . 18 ALA CB 1 1 34 20778 1 1 18 ALA H H -6.786 -5.729 -0.563 1.00 . A A . 18 ALA H 1 1 34 20779 1 1 18 ALA HA H -4.518 -5.569 1.041 1.00 . A A . 18 ALA HA 1 1 34 20780 1 1 18 ALA HB1 H -6.295 -6.312 2.249 1.00 . A A . 18 ALA HB1 1 1 34 20781 1 1 18 ALA HB2 H -5.525 -7.865 1.921 1.00 . A A . 18 ALA HB2 1 1 34 20782 1 1 18 ALA HB3 H -6.896 -7.337 0.945 1.00 . A A . 18 ALA HB3 1 1 34 20783 1 1 18 ALA N N -5.807 -5.685 -0.569 1.00 . A A . 18 ALA N 1 1 34 20784 1 1 18 ALA O O -4.219 -7.831 -1.176 1.00 . A A . 18 ALA O 1 1 34 20785 1 1 19 GLY C C -1.287 -8.140 -0.938 1.00 . A A . 19 GLY C 1 1 34 20786 1 1 19 GLY CA C -2.033 -8.606 0.298 1.00 . A A . 19 GLY CA 1 1 34 20787 1 1 19 GLY H H -2.966 -7.236 1.614 1.00 . A A . 19 GLY H 1 1 34 20788 1 1 19 GLY HA2 H -2.514 -9.549 0.080 1.00 . A A . 19 GLY HA2 1 1 34 20789 1 1 19 GLY HA3 H -1.323 -8.753 1.099 1.00 . A A . 19 GLY HA3 1 1 34 20790 1 1 19 GLY N N -3.039 -7.656 0.732 1.00 . A A . 19 GLY N 1 1 34 20791 1 1 19 GLY O O -0.745 -8.953 -1.687 1.00 . A A . 19 GLY O 1 1 34 20792 1 1 20 THR C C 0.556 -5.334 -1.863 1.00 . A A . 20 THR C 1 1 34 20793 1 1 20 THR CA C -0.576 -6.256 -2.306 1.00 . A A . 20 THR CA 1 1 34 20794 1 1 20 THR CB C -1.565 -5.483 -3.181 1.00 . A A . 20 THR CB 1 1 34 20795 1 1 20 THR CG2 C -0.936 -4.906 -4.430 1.00 . A A . 20 THR CG2 1 1 34 20796 1 1 20 THR H H -1.711 -6.231 -0.520 1.00 . A A . 20 THR H 1 1 34 20797 1 1 20 THR HA H -0.158 -7.068 -2.882 1.00 . A A . 20 THR HA 1 1 34 20798 1 1 20 THR HB H -1.972 -4.664 -2.607 1.00 . A A . 20 THR HB 1 1 34 20799 1 1 20 THR HG1 H -2.286 -7.158 -3.896 1.00 . A A . 20 THR HG1 1 1 34 20800 1 1 20 THR HG21 H 0.096 -4.655 -4.231 1.00 . A A . 20 THR HG21 1 1 34 20801 1 1 20 THR HG22 H -0.982 -5.634 -5.226 1.00 . A A . 20 THR HG22 1 1 34 20802 1 1 20 THR HG23 H -1.472 -4.016 -4.725 1.00 . A A . 20 THR HG23 1 1 34 20803 1 1 20 THR N N -1.260 -6.828 -1.153 1.00 . A A . 20 THR N 1 1 34 20804 1 1 20 THR O O 0.341 -4.395 -1.097 1.00 . A A . 20 THR O 1 1 34 20805 1 1 20 THR OG1 O -2.635 -6.319 -3.585 1.00 . A A . 20 THR OG1 1 1 34 20806 1 1 21 THR C C 2.712 -3.341 -2.370 1.00 . A A . 21 THR C 1 1 34 20807 1 1 21 THR CA C 2.929 -4.806 -2.003 1.00 . A A . 21 THR CA 1 1 34 20808 1 1 21 THR CB C 4.173 -5.342 -2.714 1.00 . A A . 21 THR CB 1 1 34 20809 1 1 21 THR CG2 C 3.939 -5.647 -4.178 1.00 . A A . 21 THR CG2 1 1 34 20810 1 1 21 THR H H 1.870 -6.372 -2.955 1.00 . A A . 21 THR H 1 1 34 20811 1 1 21 THR HA H 3.077 -4.879 -0.936 1.00 . A A . 21 THR HA 1 1 34 20812 1 1 21 THR HB H 4.484 -6.257 -2.231 1.00 . A A . 21 THR HB 1 1 34 20813 1 1 21 THR HG1 H 5.333 -4.112 -1.726 1.00 . A A . 21 THR HG1 1 1 34 20814 1 1 21 THR HG21 H 2.900 -5.482 -4.418 1.00 . A A . 21 THR HG21 1 1 34 20815 1 1 21 THR HG22 H 4.556 -4.999 -4.783 1.00 . A A . 21 THR HG22 1 1 34 20816 1 1 21 THR HG23 H 4.196 -6.677 -4.376 1.00 . A A . 21 THR HG23 1 1 34 20817 1 1 21 THR N N 1.762 -5.610 -2.349 1.00 . A A . 21 THR N 1 1 34 20818 1 1 21 THR O O 2.046 -3.030 -3.357 1.00 . A A . 21 THR O 1 1 34 20819 1 1 21 THR OG1 O 5.237 -4.411 -2.633 1.00 . A A . 21 THR OG1 1 1 34 20820 1 1 22 CYS C C 4.455 -0.424 -2.324 1.00 . A A . 22 CYS C 1 1 34 20821 1 1 22 CYS CA C 3.146 -1.013 -1.808 1.00 . A A . 22 CYS CA 1 1 34 20822 1 1 22 CYS CB C 2.722 -0.296 -0.524 1.00 . A A . 22 CYS CB 1 1 34 20823 1 1 22 CYS H H 3.797 -2.754 -0.796 1.00 . A A . 22 CYS H 1 1 34 20824 1 1 22 CYS HA H 2.382 -0.872 -2.557 1.00 . A A . 22 CYS HA 1 1 34 20825 1 1 22 CYS HB2 H 2.538 0.744 -0.746 1.00 . A A . 22 CYS HB2 1 1 34 20826 1 1 22 CYS HB3 H 1.812 -0.746 -0.154 1.00 . A A . 22 CYS HB3 1 1 34 20827 1 1 22 CYS N N 3.278 -2.445 -1.568 1.00 . A A . 22 CYS N 1 1 34 20828 1 1 22 CYS O O 4.457 0.418 -3.222 1.00 . A A . 22 CYS O 1 1 34 20829 1 1 22 CYS SG S 3.960 -0.366 0.812 1.00 . A A . 22 CYS SG 1 1 34 20830 1 1 23 TRP C C 7.524 -1.333 -3.164 1.00 . A A . 23 TRP C 1 1 34 20831 1 1 23 TRP CA C 6.883 -0.390 -2.153 1.00 . A A . 23 TRP CA 1 1 34 20832 1 1 23 TRP CB C 7.790 -0.237 -0.930 1.00 . A A . 23 TRP CB 1 1 34 20833 1 1 23 TRP CD1 C 9.464 1.150 -2.287 1.00 . A A . 23 TRP CD1 1 1 34 20834 1 1 23 TRP CD2 C 10.368 0.048 -0.560 1.00 . A A . 23 TRP CD2 1 1 34 20835 1 1 23 TRP CE2 C 11.386 0.765 -1.218 1.00 . A A . 23 TRP CE2 1 1 34 20836 1 1 23 TRP CE3 C 10.701 -0.721 0.558 1.00 . A A . 23 TRP CE3 1 1 34 20837 1 1 23 TRP CG C 9.146 0.308 -1.260 1.00 . A A . 23 TRP CG 1 1 34 20838 1 1 23 TRP CH2 C 13.009 -0.025 0.305 1.00 . A A . 23 TRP CH2 1 1 34 20839 1 1 23 TRP CZ2 C 12.712 0.736 -0.793 1.00 . A A . 23 TRP CZ2 1 1 34 20840 1 1 23 TRP CZ3 C 12.018 -0.749 0.979 1.00 . A A . 23 TRP CZ3 1 1 34 20841 1 1 23 TRP H H 5.501 -1.544 -1.040 1.00 . A A . 23 TRP H 1 1 34 20842 1 1 23 TRP HA H 6.754 0.574 -2.615 1.00 . A A . 23 TRP HA 1 1 34 20843 1 1 23 TRP HB2 H 7.323 0.435 -0.226 1.00 . A A . 23 TRP HB2 1 1 34 20844 1 1 23 TRP HB3 H 7.922 -1.203 -0.465 1.00 . A A . 23 TRP HB3 1 1 34 20845 1 1 23 TRP HD1 H 8.751 1.532 -3.002 1.00 . A A . 23 TRP HD1 1 1 34 20846 1 1 23 TRP HE1 H 11.278 2.011 -2.903 1.00 . A A . 23 TRP HE1 1 1 34 20847 1 1 23 TRP HE3 H 9.951 -1.286 1.091 1.00 . A A . 23 TRP HE3 1 1 34 20848 1 1 23 TRP HH2 H 14.024 -0.077 0.669 1.00 . A A . 23 TRP HH2 1 1 34 20849 1 1 23 TRP HZ2 H 13.488 1.289 -1.301 1.00 . A A . 23 TRP HZ2 1 1 34 20850 1 1 23 TRP HZ3 H 12.294 -1.338 1.841 1.00 . A A . 23 TRP HZ3 1 1 34 20851 1 1 23 TRP N N 5.567 -0.872 -1.751 1.00 . A A . 23 TRP N 1 1 34 20852 1 1 23 TRP NE1 N 10.809 1.430 -2.268 1.00 . A A . 23 TRP NE1 1 1 34 20853 1 1 23 TRP O O 7.652 -1.005 -4.343 1.00 . A A . 23 TRP O 1 1 34 20854 1 1 24 ARG C C 9.847 -2.968 -4.148 1.00 . A A . 24 ARG C 1 1 34 20855 1 1 24 ARG CA C 8.552 -3.504 -3.548 1.00 . A A . 24 ARG CA 1 1 34 20856 1 1 24 ARG CB C 7.595 -3.925 -4.665 1.00 . A A . 24 ARG CB 1 1 34 20857 1 1 24 ARG CD C 6.724 -5.768 -6.134 1.00 . A A . 24 ARG CD 1 1 34 20858 1 1 24 ARG CG C 7.764 -5.372 -5.099 1.00 . A A . 24 ARG CG 1 1 34 20859 1 1 24 ARG CZ C 6.636 -6.989 -8.273 1.00 . A A . 24 ARG CZ 1 1 34 20860 1 1 24 ARG H H 7.790 -2.704 -1.742 1.00 . A A . 24 ARG H 1 1 34 20861 1 1 24 ARG HA H 8.781 -4.366 -2.939 1.00 . A A . 24 ARG HA 1 1 34 20862 1 1 24 ARG HB2 H 6.579 -3.790 -4.323 1.00 . A A . 24 ARG HB2 1 1 34 20863 1 1 24 ARG HB3 H 7.762 -3.292 -5.524 1.00 . A A . 24 ARG HB3 1 1 34 20864 1 1 24 ARG HD2 H 5.914 -6.280 -5.635 1.00 . A A . 24 ARG HD2 1 1 34 20865 1 1 24 ARG HD3 H 6.346 -4.874 -6.607 1.00 . A A . 24 ARG HD3 1 1 34 20866 1 1 24 ARG HE H 8.180 -7.007 -7.008 1.00 . A A . 24 ARG HE 1 1 34 20867 1 1 24 ARG HG2 H 8.748 -5.497 -5.525 1.00 . A A . 24 ARG HG2 1 1 34 20868 1 1 24 ARG HG3 H 7.660 -6.011 -4.234 1.00 . A A . 24 ARG HG3 1 1 34 20869 1 1 24 ARG HH11 H 4.974 -5.916 -7.851 1.00 . A A . 24 ARG HH11 1 1 34 20870 1 1 24 ARG HH12 H 4.938 -6.782 -9.350 1.00 . A A . 24 ARG HH12 1 1 34 20871 1 1 24 ARG HH21 H 8.134 -8.147 -8.979 1.00 . A A . 24 ARG HH21 1 1 34 20872 1 1 24 ARG HH22 H 6.731 -8.050 -9.990 1.00 . A A . 24 ARG HH22 1 1 34 20873 1 1 24 ARG N N 7.923 -2.506 -2.691 1.00 . A A . 24 ARG N 1 1 34 20874 1 1 24 ARG NE N 7.280 -6.649 -7.159 1.00 . A A . 24 ARG NE 1 1 34 20875 1 1 24 ARG NH1 N 5.416 -6.524 -8.511 1.00 . A A . 24 ARG NH1 1 1 34 20876 1 1 24 ARG NH2 N 7.214 -7.794 -9.153 1.00 . A A . 24 ARG NH2 1 1 34 20877 1 1 24 ARG O O 10.025 -1.758 -4.285 1.00 . A A . 24 ARG O 1 1 34 20878 1 1 25 THR C C 12.616 -4.639 -5.909 1.00 . A A . 25 THR C 1 1 34 20879 1 1 25 THR CA C 12.029 -3.495 -5.089 1.00 . A A . 25 THR CA 1 1 34 20880 1 1 25 THR CB C 13.012 -3.078 -3.992 1.00 . A A . 25 THR CB 1 1 34 20881 1 1 25 THR CG2 C 12.717 -1.711 -3.413 1.00 . A A . 25 THR CG2 1 1 34 20882 1 1 25 THR H H 10.550 -4.827 -4.369 1.00 . A A . 25 THR H 1 1 34 20883 1 1 25 THR HA H 11.857 -2.655 -5.741 1.00 . A A . 25 THR HA 1 1 34 20884 1 1 25 THR HB H 14.009 -3.054 -4.407 1.00 . A A . 25 THR HB 1 1 34 20885 1 1 25 THR HG1 H 12.109 -4.068 -2.564 1.00 . A A . 25 THR HG1 1 1 34 20886 1 1 25 THR HG21 H 12.433 -1.037 -4.208 1.00 . A A . 25 THR HG21 1 1 34 20887 1 1 25 THR HG22 H 11.910 -1.788 -2.700 1.00 . A A . 25 THR HG22 1 1 34 20888 1 1 25 THR HG23 H 13.599 -1.332 -2.919 1.00 . A A . 25 THR HG23 1 1 34 20889 1 1 25 THR N N 10.750 -3.877 -4.503 1.00 . A A . 25 THR N 1 1 34 20890 1 1 25 THR O O 12.541 -4.639 -7.137 1.00 . A A . 25 THR O 1 1 34 20891 1 1 25 THR OG1 O 12.996 -4.009 -2.925 1.00 . A A . 25 THR OG1 1 1 34 20892 1 1 26 SER C C 14.354 -7.750 -4.856 1.00 . A A . 26 SER C 1 1 34 20893 1 1 26 SER CA C 13.801 -6.765 -5.879 1.00 . A A . 26 SER CA 1 1 34 20894 1 1 26 SER CB C 14.916 -6.315 -6.825 1.00 . A A . 26 SER CB 1 1 34 20895 1 1 26 SER H H 13.226 -5.551 -4.243 1.00 . A A . 26 SER H 1 1 34 20896 1 1 26 SER HA H 13.031 -7.255 -6.453 1.00 . A A . 26 SER HA 1 1 34 20897 1 1 26 SER HB2 H 14.758 -5.283 -7.100 1.00 . A A . 26 SER HB2 1 1 34 20898 1 1 26 SER HB3 H 15.869 -6.413 -6.327 1.00 . A A . 26 SER HB3 1 1 34 20899 1 1 26 SER HG H 14.489 -6.630 -8.711 1.00 . A A . 26 SER HG 1 1 34 20900 1 1 26 SER N N 13.200 -5.611 -5.219 1.00 . A A . 26 SER N 1 1 34 20901 1 1 26 SER O O 14.240 -8.965 -5.024 1.00 . A A . 26 SER O 1 1 34 20902 1 1 26 SER OG O 14.934 -7.102 -8.004 1.00 . A A . 26 SER OG 1 1 34 20903 1 1 27 VAL C C 14.635 -8.053 -1.504 1.00 . A A . 27 VAL C 1 1 34 20904 1 1 27 VAL CA C 15.524 -8.050 -2.744 1.00 . A A . 27 VAL CA 1 1 34 20905 1 1 27 VAL CB C 16.936 -7.569 -2.355 1.00 . A A . 27 VAL CB 1 1 34 20906 1 1 27 VAL CG1 C 16.891 -6.148 -1.814 1.00 . A A . 27 VAL CG1 1 1 34 20907 1 1 27 VAL CG2 C 17.564 -8.514 -1.340 1.00 . A A . 27 VAL CG2 1 1 34 20908 1 1 27 VAL H H 15.010 -6.244 -3.721 1.00 . A A . 27 VAL H 1 1 34 20909 1 1 27 VAL HA H 15.601 -9.059 -3.122 1.00 . A A . 27 VAL HA 1 1 34 20910 1 1 27 VAL HB H 17.551 -7.571 -3.243 1.00 . A A . 27 VAL HB 1 1 34 20911 1 1 27 VAL HG11 H 16.171 -6.091 -1.011 1.00 . A A . 27 VAL HG11 1 1 34 20912 1 1 27 VAL HG12 H 17.867 -5.873 -1.443 1.00 . A A . 27 VAL HG12 1 1 34 20913 1 1 27 VAL HG13 H 16.602 -5.471 -2.605 1.00 . A A . 27 VAL HG13 1 1 34 20914 1 1 27 VAL HG21 H 17.099 -9.486 -1.419 1.00 . A A . 27 VAL HG21 1 1 34 20915 1 1 27 VAL HG22 H 18.622 -8.604 -1.538 1.00 . A A . 27 VAL HG22 1 1 34 20916 1 1 27 VAL HG23 H 17.415 -8.124 -0.345 1.00 . A A . 27 VAL HG23 1 1 34 20917 1 1 27 VAL N N 14.952 -7.219 -3.797 1.00 . A A . 27 VAL N 1 1 34 20918 1 1 27 VAL O O 14.563 -9.048 -0.782 1.00 . A A . 27 VAL O 1 1 34 20919 1 1 28 SER C C 11.671 -6.398 -0.544 1.00 . A A . 28 SER C 1 1 34 20920 1 1 28 SER CA C 13.074 -6.809 -0.111 1.00 . A A . 28 SER CA 1 1 34 20921 1 1 28 SER CB C 13.634 -5.786 0.879 1.00 . A A . 28 SER CB 1 1 34 20922 1 1 28 SER H H 14.057 -6.176 -1.876 1.00 . A A . 28 SER H 1 1 34 20923 1 1 28 SER HA H 13.020 -7.772 0.373 1.00 . A A . 28 SER HA 1 1 34 20924 1 1 28 SER HB2 H 13.957 -4.906 0.341 1.00 . A A . 28 SER HB2 1 1 34 20925 1 1 28 SER HB3 H 12.864 -5.513 1.586 1.00 . A A . 28 SER HB3 1 1 34 20926 1 1 28 SER HG H 15.323 -6.774 0.980 1.00 . A A . 28 SER HG 1 1 34 20927 1 1 28 SER N N 13.959 -6.935 -1.263 1.00 . A A . 28 SER N 1 1 34 20928 1 1 28 SER O O 11.441 -5.253 -0.935 1.00 . A A . 28 SER O 1 1 34 20929 1 1 28 SER OG O 14.740 -6.315 1.590 1.00 . A A . 28 SER OG 1 1 34 20930 1 1 29 SER C C 8.485 -6.822 0.370 1.00 . A A . 29 SER C 1 1 34 20931 1 1 29 SER CA C 9.354 -7.075 -0.858 1.00 . A A . 29 SER CA 1 1 34 20932 1 1 29 SER CB C 8.793 -8.250 -1.661 1.00 . A A . 29 SER CB 1 1 34 20933 1 1 29 SER H H 10.980 -8.233 -0.153 1.00 . A A . 29 SER H 1 1 34 20934 1 1 29 SER HA H 9.346 -6.191 -1.478 1.00 . A A . 29 SER HA 1 1 34 20935 1 1 29 SER HB2 H 8.641 -9.093 -1.004 1.00 . A A . 29 SER HB2 1 1 34 20936 1 1 29 SER HB3 H 7.849 -7.963 -2.102 1.00 . A A . 29 SER HB3 1 1 34 20937 1 1 29 SER HG H 9.402 -8.235 -3.523 1.00 . A A . 29 SER HG 1 1 34 20938 1 1 29 SER N N 10.735 -7.339 -0.473 1.00 . A A . 29 SER N 1 1 34 20939 1 1 29 SER O O 8.882 -7.121 1.496 1.00 . A A . 29 SER O 1 1 34 20940 1 1 29 SER OG O 9.683 -8.633 -2.695 1.00 . A A . 29 SER OG 1 1 34 20941 1 1 30 HIS C C 4.964 -6.453 0.891 1.00 . A A . 30 HIS C 1 1 34 20942 1 1 30 HIS CA C 6.372 -5.976 1.232 1.00 . A A . 30 HIS CA 1 1 34 20943 1 1 30 HIS CB C 6.358 -4.475 1.527 1.00 . A A . 30 HIS CB 1 1 34 20944 1 1 30 HIS CD2 C 8.701 -4.000 2.536 1.00 . A A . 30 HIS CD2 1 1 34 20945 1 1 30 HIS CE1 C 8.064 -3.349 4.530 1.00 . A A . 30 HIS CE1 1 1 34 20946 1 1 30 HIS CG C 7.348 -4.062 2.572 1.00 . A A . 30 HIS CG 1 1 34 20947 1 1 30 HIS H H 7.038 -6.054 -0.776 1.00 . A A . 30 HIS H 1 1 34 20948 1 1 30 HIS HA H 6.715 -6.504 2.110 1.00 . A A . 30 HIS HA 1 1 34 20949 1 1 30 HIS HB2 H 6.588 -3.935 0.621 1.00 . A A . 30 HIS HB2 1 1 34 20950 1 1 30 HIS HB3 H 5.374 -4.192 1.870 1.00 . A A . 30 HIS HB3 1 1 34 20951 1 1 30 HIS HD1 H 6.063 -3.583 4.172 1.00 . A A . 30 HIS HD1 1 1 34 20952 1 1 30 HIS HD2 H 9.332 -4.254 1.696 1.00 . A A . 30 HIS HD2 1 1 34 20953 1 1 30 HIS HE1 H 8.083 -2.998 5.552 1.00 . A A . 30 HIS HE1 1 1 34 20954 1 1 30 HIS HE2 H 10.043 -3.329 4.004 1.00 . A A . 30 HIS HE2 1 1 34 20955 1 1 30 HIS N N 7.298 -6.270 0.144 1.00 . A A . 30 HIS N 1 1 34 20956 1 1 30 HIS ND1 N 6.981 -3.648 3.835 1.00 . A A . 30 HIS ND1 1 1 34 20957 1 1 30 HIS NE2 N 9.120 -3.555 3.765 1.00 . A A . 30 HIS NE2 1 1 34 20958 1 1 30 HIS O O 4.740 -7.064 -0.154 1.00 . A A . 30 HIS O 1 1 34 20959 1 1 31 TYR C C 1.678 -5.635 2.313 1.00 . A A . 31 TYR C 1 1 34 20960 1 1 31 TYR CA C 2.630 -6.569 1.572 1.00 . A A . 31 TYR CA 1 1 34 20961 1 1 31 TYR CB C 2.417 -8.009 2.040 1.00 . A A . 31 TYR CB 1 1 34 20962 1 1 31 TYR CD1 C 2.138 -8.863 -0.319 1.00 . A A . 31 TYR CD1 1 1 34 20963 1 1 31 TYR CD2 C 3.393 -10.187 1.216 1.00 . A A . 31 TYR CD2 1 1 34 20964 1 1 31 TYR CE1 C 2.352 -9.803 -1.310 1.00 . A A . 31 TYR CE1 1 1 34 20965 1 1 31 TYR CE2 C 3.612 -11.130 0.230 1.00 . A A . 31 TYR CE2 1 1 34 20966 1 1 31 TYR CG C 2.654 -9.039 0.959 1.00 . A A . 31 TYR CG 1 1 34 20967 1 1 31 TYR CZ C 3.089 -10.934 -1.031 1.00 . A A . 31 TYR CZ 1 1 34 20968 1 1 31 TYR H H 4.257 -5.679 2.594 1.00 . A A . 31 TYR H 1 1 34 20969 1 1 31 TYR HA H 2.423 -6.509 0.514 1.00 . A A . 31 TYR HA 1 1 34 20970 1 1 31 TYR HB2 H 3.096 -8.220 2.853 1.00 . A A . 31 TYR HB2 1 1 34 20971 1 1 31 TYR HB3 H 1.401 -8.120 2.389 1.00 . A A . 31 TYR HB3 1 1 34 20972 1 1 31 TYR HD1 H 1.561 -7.976 -0.535 1.00 . A A . 31 TYR HD1 1 1 34 20973 1 1 31 TYR HD2 H 3.800 -10.339 2.204 1.00 . A A . 31 TYR HD2 1 1 34 20974 1 1 31 TYR HE1 H 1.943 -9.648 -2.298 1.00 . A A . 31 TYR HE1 1 1 34 20975 1 1 31 TYR HE2 H 4.189 -12.016 0.449 1.00 . A A . 31 TYR HE2 1 1 34 20976 1 1 31 TYR HH H 3.081 -12.743 -1.682 1.00 . A A . 31 TYR HH 1 1 34 20977 1 1 31 TYR N N 4.017 -6.169 1.780 1.00 . A A . 31 TYR N 1 1 34 20978 1 1 31 TYR O O 1.803 -5.436 3.521 1.00 . A A . 31 TYR O 1 1 34 20979 1 1 31 TYR OH O 3.305 -11.871 -2.015 1.00 . A A . 31 TYR OH 1 1 34 20980 1 1 32 CYS C C -1.404 -4.922 2.795 1.00 . A A . 32 CYS C 1 1 34 20981 1 1 32 CYS CA C -0.246 -4.152 2.168 1.00 . A A . 32 CYS CA 1 1 34 20982 1 1 32 CYS CB C -0.776 -3.186 1.107 1.00 . A A . 32 CYS CB 1 1 34 20983 1 1 32 CYS H H 0.679 -5.263 0.622 1.00 . A A . 32 CYS H 1 1 34 20984 1 1 32 CYS HA H 0.254 -3.586 2.939 1.00 . A A . 32 CYS HA 1 1 34 20985 1 1 32 CYS HB2 H 0.047 -2.847 0.496 1.00 . A A . 32 CYS HB2 1 1 34 20986 1 1 32 CYS HB3 H -1.490 -3.705 0.483 1.00 . A A . 32 CYS HB3 1 1 34 20987 1 1 32 CYS N N 0.727 -5.065 1.580 1.00 . A A . 32 CYS N 1 1 34 20988 1 1 32 CYS O O -1.708 -6.045 2.391 1.00 . A A . 32 CYS O 1 1 34 20989 1 1 32 CYS SG S -1.602 -1.712 1.789 1.00 . A A . 32 CYS SG 1 1 34 20990 1 1 33 THR C C -4.506 -4.508 3.857 1.00 . A A . 33 THR C 1 1 34 20991 1 1 33 THR CA C -3.173 -4.939 4.468 1.00 . A A . 33 THR CA 1 1 34 20992 1 1 33 THR CB C -3.148 -4.590 5.956 1.00 . A A . 33 THR CB 1 1 34 20993 1 1 33 THR CG2 C -2.957 -3.112 6.222 1.00 . A A . 33 THR CG2 1 1 34 20994 1 1 33 THR H H -1.758 -3.417 4.061 1.00 . A A . 33 THR H 1 1 34 20995 1 1 33 THR HA H -3.070 -6.008 4.358 1.00 . A A . 33 THR HA 1 1 34 20996 1 1 33 THR HB H -2.331 -5.119 6.426 1.00 . A A . 33 THR HB 1 1 34 20997 1 1 33 THR HG1 H -5.072 -4.424 6.287 1.00 . A A . 33 THR HG1 1 1 34 20998 1 1 33 THR HG21 H -3.151 -2.556 5.316 1.00 . A A . 33 THR HG21 1 1 34 20999 1 1 33 THR HG22 H -3.642 -2.794 6.993 1.00 . A A . 33 THR HG22 1 1 34 21000 1 1 33 THR HG23 H -1.942 -2.933 6.545 1.00 . A A . 33 THR HG23 1 1 34 21001 1 1 33 THR N N -2.047 -4.311 3.784 1.00 . A A . 33 THR N 1 1 34 21002 1 1 33 THR O O -5.570 -4.915 4.325 1.00 . A A . 33 THR O 1 1 34 21003 1 1 33 THR OG1 O -4.354 -4.987 6.585 1.00 . A A . 33 THR OG1 1 1 34 21004 1 1 34 GLY C C -6.618 -2.551 3.134 1.00 . A A . 34 GLY C 1 1 34 21005 1 1 34 GLY CA C -5.662 -3.221 2.166 1.00 . A A . 34 GLY CA 1 1 34 21006 1 1 34 GLY H H -3.576 -3.390 2.477 1.00 . A A . 34 GLY H 1 1 34 21007 1 1 34 GLY HA2 H -6.160 -4.065 1.712 1.00 . A A . 34 GLY HA2 1 1 34 21008 1 1 34 GLY HA3 H -5.398 -2.515 1.393 1.00 . A A . 34 GLY HA3 1 1 34 21009 1 1 34 GLY N N -4.448 -3.685 2.812 1.00 . A A . 34 GLY N 1 1 34 21010 1 1 34 GLY O O -7.832 -2.734 3.045 1.00 . A A . 34 GLY O 1 1 34 21011 1 1 35 ARG C C -6.732 0.434 4.922 1.00 . A A . 35 ARG C 1 1 34 21012 1 1 35 ARG CA C -6.882 -1.078 5.055 1.00 . A A . 35 ARG CA 1 1 34 21013 1 1 35 ARG CB C -6.491 -1.518 6.467 1.00 . A A . 35 ARG CB 1 1 34 21014 1 1 35 ARG CD C -7.247 -1.200 8.842 1.00 . A A . 35 ARG CD 1 1 34 21015 1 1 35 ARG CG C -7.664 -1.584 7.431 1.00 . A A . 35 ARG CG 1 1 34 21016 1 1 35 ARG CZ C -7.608 0.701 10.369 1.00 . A A . 35 ARG CZ 1 1 34 21017 1 1 35 ARG H H -5.095 -1.671 4.086 1.00 . A A . 35 ARG H 1 1 34 21018 1 1 35 ARG HA H -7.914 -1.340 4.880 1.00 . A A . 35 ARG HA 1 1 34 21019 1 1 35 ARG HB2 H -6.041 -2.499 6.414 1.00 . A A . 35 ARG HB2 1 1 34 21020 1 1 35 ARG HB3 H -5.767 -0.820 6.862 1.00 . A A . 35 ARG HB3 1 1 34 21021 1 1 35 ARG HD2 H -7.780 -1.824 9.544 1.00 . A A . 35 ARG HD2 1 1 34 21022 1 1 35 ARG HD3 H -6.185 -1.366 8.948 1.00 . A A . 35 ARG HD3 1 1 34 21023 1 1 35 ARG HE H -7.696 0.801 8.378 1.00 . A A . 35 ARG HE 1 1 34 21024 1 1 35 ARG HG2 H -8.432 -0.903 7.096 1.00 . A A . 35 ARG HG2 1 1 34 21025 1 1 35 ARG HG3 H -8.053 -2.592 7.442 1.00 . A A . 35 ARG HG3 1 1 34 21026 1 1 35 ARG HH11 H -7.198 -1.051 11.293 1.00 . A A . 35 ARG HH11 1 1 34 21027 1 1 35 ARG HH12 H -7.455 0.301 12.345 1.00 . A A . 35 ARG HH12 1 1 34 21028 1 1 35 ARG HH21 H -8.034 2.580 9.759 1.00 . A A . 35 ARG HH21 1 1 34 21029 1 1 35 ARG HH22 H -7.930 2.362 11.474 1.00 . A A . 35 ARG HH22 1 1 34 21030 1 1 35 ARG N N -6.070 -1.775 4.064 1.00 . A A . 35 ARG N 1 1 34 21031 1 1 35 ARG NE N -7.541 0.201 9.137 1.00 . A A . 35 ARG NE 1 1 34 21032 1 1 35 ARG NH1 N -7.403 -0.081 11.422 1.00 . A A . 35 ARG NH1 1 1 34 21033 1 1 35 ARG NH2 N -7.879 1.986 10.549 1.00 . A A . 35 ARG NH2 1 1 34 21034 1 1 35 ARG O O -7.694 1.181 5.102 1.00 . A A . 35 ARG O 1 1 34 21035 1 1 36 SER C C -3.955 2.524 3.670 1.00 . A A . 36 SER C 1 1 34 21036 1 1 36 SER CA C -5.244 2.302 4.453 1.00 . A A . 36 SER CA 1 1 34 21037 1 1 36 SER CB C -5.144 2.975 5.823 1.00 . A A . 36 SER CB 1 1 34 21038 1 1 36 SER H H -4.795 0.233 4.480 1.00 . A A . 36 SER H 1 1 34 21039 1 1 36 SER HA H -6.063 2.742 3.905 1.00 . A A . 36 SER HA 1 1 34 21040 1 1 36 SER HB2 H -6.097 2.909 6.325 1.00 . A A . 36 SER HB2 1 1 34 21041 1 1 36 SER HB3 H -4.391 2.474 6.414 1.00 . A A . 36 SER HB3 1 1 34 21042 1 1 36 SER HG H -4.123 4.562 6.350 1.00 . A A . 36 SER HG 1 1 34 21043 1 1 36 SER N N -5.521 0.878 4.609 1.00 . A A . 36 SER N 1 1 34 21044 1 1 36 SER O O -3.236 1.575 3.356 1.00 . A A . 36 SER O 1 1 34 21045 1 1 36 SER OG O -4.789 4.341 5.695 1.00 . A A . 36 SER OG 1 1 34 21046 1 1 37 CYS C C -1.220 3.920 3.467 1.00 . A A . 37 CYS C 1 1 34 21047 1 1 37 CYS CA C -2.465 4.132 2.614 1.00 . A A . 37 CYS CA 1 1 34 21048 1 1 37 CYS CB C -2.532 5.586 2.144 1.00 . A A . 37 CYS CB 1 1 34 21049 1 1 37 CYS H H -4.281 4.495 3.639 1.00 . A A . 37 CYS H 1 1 34 21050 1 1 37 CYS HA H -2.412 3.485 1.751 1.00 . A A . 37 CYS HA 1 1 34 21051 1 1 37 CYS HB2 H -2.708 6.224 2.996 1.00 . A A . 37 CYS HB2 1 1 34 21052 1 1 37 CYS HB3 H -1.588 5.853 1.690 1.00 . A A . 37 CYS HB3 1 1 34 21053 1 1 37 CYS N N -3.669 3.783 3.359 1.00 . A A . 37 CYS N 1 1 34 21054 1 1 37 CYS O O -0.137 3.647 2.949 1.00 . A A . 37 CYS O 1 1 34 21055 1 1 37 CYS SG S -3.845 5.916 0.926 1.00 . A A . 37 CYS SG 1 1 34 21056 1 1 38 GLU C C 0.282 2.451 5.630 1.00 . A A . 38 GLU C 1 1 34 21057 1 1 38 GLU CA C -0.270 3.870 5.708 1.00 . A A . 38 GLU CA 1 1 34 21058 1 1 38 GLU CB C -0.717 4.179 7.138 1.00 . A A . 38 GLU CB 1 1 34 21059 1 1 38 GLU CD C 0.297 4.184 9.451 1.00 . A A . 38 GLU CD 1 1 34 21060 1 1 38 GLU CG C 0.402 4.695 8.027 1.00 . A A . 38 GLU CG 1 1 34 21061 1 1 38 GLU H H -2.269 4.267 5.134 1.00 . A A . 38 GLU H 1 1 34 21062 1 1 38 GLU HA H 0.510 4.563 5.427 1.00 . A A . 38 GLU HA 1 1 34 21063 1 1 38 GLU HB2 H -1.496 4.926 7.105 1.00 . A A . 38 GLU HB2 1 1 34 21064 1 1 38 GLU HB3 H -1.114 3.277 7.581 1.00 . A A . 38 GLU HB3 1 1 34 21065 1 1 38 GLU HG2 H 1.348 4.376 7.616 1.00 . A A . 38 GLU HG2 1 1 34 21066 1 1 38 GLU HG3 H 0.362 5.774 8.044 1.00 . A A . 38 GLU HG3 1 1 34 21067 1 1 38 GLU N N -1.381 4.048 4.780 1.00 . A A . 38 GLU N 1 1 34 21068 1 1 38 GLU O O -0.095 1.584 6.419 1.00 . A A . 38 GLU O 1 1 34 21069 1 1 38 GLU OE1 O 0.603 2.995 9.679 1.00 . A A . 38 GLU OE1 1 1 34 21070 1 1 38 GLU OE2 O -0.091 4.973 10.338 1.00 . A A . 38 GLU OE2 1 1 34 21071 1 1 39 CYS C C 2.598 0.510 5.726 1.00 . A A . 39 CYS C 1 1 34 21072 1 1 39 CYS CA C 1.782 0.905 4.496 1.00 . A A . 39 CYS CA 1 1 34 21073 1 1 39 CYS CB C 2.675 0.899 3.253 1.00 . A A . 39 CYS CB 1 1 34 21074 1 1 39 CYS H H 1.438 2.952 4.078 1.00 . A A . 39 CYS H 1 1 34 21075 1 1 39 CYS HA H 0.984 0.192 4.359 1.00 . A A . 39 CYS HA 1 1 34 21076 1 1 39 CYS HB2 H 2.258 1.567 2.515 1.00 . A A . 39 CYS HB2 1 1 34 21077 1 1 39 CYS HB3 H 3.662 1.244 3.527 1.00 . A A . 39 CYS HB3 1 1 34 21078 1 1 39 CYS N N 1.178 2.220 4.675 1.00 . A A . 39 CYS N 1 1 34 21079 1 1 39 CYS O O 3.373 1.312 6.247 1.00 . A A . 39 CYS O 1 1 34 21080 1 1 39 CYS SG S 2.857 -0.739 2.475 1.00 . A A . 39 CYS SG 1 1 34 21081 1 1 40 PRO C C 4.650 -1.438 7.095 1.00 . A A . 40 PRO C 1 1 34 21082 1 1 40 PRO CA C 3.168 -1.225 7.383 1.00 . A A . 40 PRO CA 1 1 34 21083 1 1 40 PRO CB C 2.487 -2.558 7.696 1.00 . A A . 40 PRO CB 1 1 34 21084 1 1 40 PRO CD C 1.536 -1.764 5.652 1.00 . A A . 40 PRO CD 1 1 34 21085 1 1 40 PRO CG C 1.929 -3.012 6.392 1.00 . A A . 40 PRO CG 1 1 34 21086 1 1 40 PRO HA H 3.059 -0.555 8.223 1.00 . A A . 40 PRO HA 1 1 34 21087 1 1 40 PRO HB2 H 3.217 -3.257 8.080 1.00 . A A . 40 PRO HB2 1 1 34 21088 1 1 40 PRO HB3 H 1.707 -2.405 8.426 1.00 . A A . 40 PRO HB3 1 1 34 21089 1 1 40 PRO HD2 H 1.699 -1.886 4.592 1.00 . A A . 40 PRO HD2 1 1 34 21090 1 1 40 PRO HD3 H 0.503 -1.517 5.850 1.00 . A A . 40 PRO HD3 1 1 34 21091 1 1 40 PRO HG2 H 2.683 -3.554 5.839 1.00 . A A . 40 PRO HG2 1 1 34 21092 1 1 40 PRO HG3 H 1.064 -3.636 6.560 1.00 . A A . 40 PRO HG3 1 1 34 21093 1 1 40 PRO N N 2.438 -0.736 6.209 1.00 . A A . 40 PRO N 1 1 34 21094 1 1 40 PRO O O 5.092 -1.335 5.951 1.00 . A A . 40 PRO O 1 1 34 21095 1 1 41 SER C C 7.203 -3.411 8.327 1.00 . A A . 41 SER C 1 1 34 21096 1 1 41 SER CA C 6.848 -1.964 8.001 1.00 . A A . 41 SER CA 1 1 34 21097 1 1 41 SER CB C 7.628 -1.017 8.916 1.00 . A A . 41 SER CB 1 1 34 21098 1 1 41 SER H H 5.004 -1.804 9.029 1.00 . A A . 41 SER H 1 1 34 21099 1 1 41 SER HA H 7.117 -1.761 6.976 1.00 . A A . 41 SER HA 1 1 34 21100 1 1 41 SER HB2 H 7.464 0.002 8.599 1.00 . A A . 41 SER HB2 1 1 34 21101 1 1 41 SER HB3 H 7.283 -1.138 9.933 1.00 . A A . 41 SER HB3 1 1 34 21102 1 1 41 SER HG H 9.381 -1.256 9.757 1.00 . A A . 41 SER HG 1 1 34 21103 1 1 41 SER N N 5.414 -1.736 8.141 1.00 . A A . 41 SER N 1 1 34 21104 1 1 41 SER O O 8.264 -3.689 8.886 1.00 . A A . 41 SER O 1 1 34 21105 1 1 41 SER OG O 9.017 -1.291 8.869 1.00 . A A . 41 SER OG 1 1 34 21106 1 1 42 TYR C C 6.870 -6.486 6.936 1.00 . A A . 42 TYR C 1 1 34 21107 1 1 42 TYR CA C 6.528 -5.747 8.228 1.00 . A A . 42 TYR CA 1 1 34 21108 1 1 42 TYR CB C 5.287 -6.369 8.871 1.00 . A A . 42 TYR CB 1 1 34 21109 1 1 42 TYR CD1 C 3.661 -5.029 10.262 1.00 . A A . 42 TYR CD1 1 1 34 21110 1 1 42 TYR CD2 C 5.696 -5.738 11.281 1.00 . A A . 42 TYR CD2 1 1 34 21111 1 1 42 TYR CE1 C 3.279 -4.416 11.441 1.00 . A A . 42 TYR CE1 1 1 34 21112 1 1 42 TYR CE2 C 5.322 -5.127 12.463 1.00 . A A . 42 TYR CE2 1 1 34 21113 1 1 42 TYR CG C 4.873 -5.699 10.163 1.00 . A A . 42 TYR CG 1 1 34 21114 1 1 42 TYR CZ C 4.113 -4.468 12.538 1.00 . A A . 42 TYR CZ 1 1 34 21115 1 1 42 TYR H H 5.482 -4.044 7.531 1.00 . A A . 42 TYR H 1 1 34 21116 1 1 42 TYR HA H 7.359 -5.836 8.911 1.00 . A A . 42 TYR HA 1 1 34 21117 1 1 42 TYR HB2 H 4.459 -6.298 8.182 1.00 . A A . 42 TYR HB2 1 1 34 21118 1 1 42 TYR HB3 H 5.484 -7.409 9.084 1.00 . A A . 42 TYR HB3 1 1 34 21119 1 1 42 TYR HD1 H 3.010 -4.990 9.402 1.00 . A A . 42 TYR HD1 1 1 34 21120 1 1 42 TYR HD2 H 6.642 -6.254 11.220 1.00 . A A . 42 TYR HD2 1 1 34 21121 1 1 42 TYR HE1 H 2.332 -3.900 11.499 1.00 . A A . 42 TYR HE1 1 1 34 21122 1 1 42 TYR HE2 H 5.975 -5.168 13.322 1.00 . A A . 42 TYR HE2 1 1 34 21123 1 1 42 TYR HH H 3.099 -4.412 14.171 1.00 . A A . 42 TYR HH 1 1 34 21124 1 1 42 TYR N N 6.309 -4.328 7.974 1.00 . A A . 42 TYR N 1 1 34 21125 1 1 42 TYR O O 5.989 -7.030 6.271 1.00 . A A . 42 TYR O 1 1 34 21126 1 1 42 TYR OH O 3.737 -3.859 13.713 1.00 . A A . 42 TYR OH 1 1 34 21127 1 1 43 PRO C C 8.516 -8.708 5.454 1.00 . A A . 43 PRO C 1 1 34 21128 1 1 43 PRO CA C 8.617 -7.191 5.345 1.00 . A A . 43 PRO CA 1 1 34 21129 1 1 43 PRO CB C 10.080 -6.759 5.224 1.00 . A A . 43 PRO CB 1 1 34 21130 1 1 43 PRO CD C 9.277 -5.890 7.301 1.00 . A A . 43 PRO CD 1 1 34 21131 1 1 43 PRO CG C 10.498 -6.442 6.618 1.00 . A A . 43 PRO CG 1 1 34 21132 1 1 43 PRO HA H 8.066 -6.856 4.478 1.00 . A A . 43 PRO HA 1 1 34 21133 1 1 43 PRO HB2 H 10.663 -7.569 4.810 1.00 . A A . 43 PRO HB2 1 1 34 21134 1 1 43 PRO HB3 H 10.151 -5.892 4.584 1.00 . A A . 43 PRO HB3 1 1 34 21135 1 1 43 PRO HD2 H 9.262 -6.180 8.341 1.00 . A A . 43 PRO HD2 1 1 34 21136 1 1 43 PRO HD3 H 9.246 -4.814 7.207 1.00 . A A . 43 PRO HD3 1 1 34 21137 1 1 43 PRO HG2 H 10.831 -7.341 7.115 1.00 . A A . 43 PRO HG2 1 1 34 21138 1 1 43 PRO HG3 H 11.286 -5.704 6.606 1.00 . A A . 43 PRO HG3 1 1 34 21139 1 1 43 PRO N N 8.161 -6.514 6.564 1.00 . A A . 43 PRO N 1 1 34 21140 1 1 43 PRO O O 9.402 -9.361 6.006 1.00 . A A . 43 PRO O 1 1 34 21141 1 1 44 GLY C C 5.808 -11.080 5.313 1.00 . A A . 44 GLY C 1 1 34 21142 1 1 44 GLY CA C 7.235 -10.701 4.972 1.00 . A A . 44 GLY CA 1 1 34 21143 1 1 44 GLY H H 6.759 -8.693 4.497 1.00 . A A . 44 GLY H 1 1 34 21144 1 1 44 GLY HA2 H 7.895 -11.118 5.718 1.00 . A A . 44 GLY HA2 1 1 34 21145 1 1 44 GLY HA3 H 7.487 -11.120 4.009 1.00 . A A . 44 GLY HA3 1 1 34 21146 1 1 44 GLY N N 7.431 -9.264 4.924 1.00 . A A . 44 GLY N 1 1 34 21147 1 1 44 GLY O O 4.885 -10.609 4.615 1.00 . A A . 44 GLY O 1 1 34 21148 1 1 44 GLY OXT O 5.612 -11.849 6.278 1.00 . A A . 44 GLY OXT 1 1 35 21149 1 1 1 ALA C C -13.709 7.363 4.717 1.00 . A A . 1 ALA C 1 1 35 21150 1 1 1 ALA CA C -12.805 6.525 5.615 1.00 . A A . 1 ALA CA 1 1 35 21151 1 1 1 ALA CB C -11.442 6.339 4.965 1.00 . A A . 1 ALA CB 1 1 35 21152 1 1 1 ALA H1 H -14.389 5.374 6.243 1.00 . A A . 1 ALA H1 1 1 35 21153 1 1 1 ALA H2 H -13.419 4.653 5.026 1.00 . A A . 1 ALA H2 1 1 35 21154 1 1 1 ALA H3 H -12.846 4.743 6.641 1.00 . A A . 1 ALA H3 1 1 35 21155 1 1 1 ALA HA H -12.661 7.048 6.550 1.00 . A A . 1 ALA HA 1 1 35 21156 1 1 1 ALA HB1 H -11.052 5.365 5.219 1.00 . A A . 1 ALA HB1 1 1 35 21157 1 1 1 ALA HB2 H -11.541 6.419 3.893 1.00 . A A . 1 ALA HB2 1 1 35 21158 1 1 1 ALA HB3 H -10.766 7.102 5.322 1.00 . A A . 1 ALA HB3 1 1 35 21159 1 1 1 ALA N N -13.420 5.205 5.908 1.00 . A A . 1 ALA N 1 1 35 21160 1 1 1 ALA O O -14.864 7.010 4.480 1.00 . A A . 1 ALA O 1 1 35 21161 1 1 2 MET C C -13.004 10.296 2.580 1.00 . A A . 2 MET C 1 1 35 21162 1 1 2 MET CA C -13.934 9.363 3.348 1.00 . A A . 2 MET CA 1 1 35 21163 1 1 2 MET CB C -14.935 10.181 4.166 1.00 . A A . 2 MET CB 1 1 35 21164 1 1 2 MET CE C -14.549 13.162 7.014 1.00 . A A . 2 MET CE 1 1 35 21165 1 1 2 MET CG C -14.283 11.086 5.198 1.00 . A A . 2 MET CG 1 1 35 21166 1 1 2 MET H H -12.249 8.702 4.446 1.00 . A A . 2 MET H 1 1 35 21167 1 1 2 MET HA H -14.474 8.751 2.641 1.00 . A A . 2 MET HA 1 1 35 21168 1 1 2 MET HB2 H -15.513 10.797 3.493 1.00 . A A . 2 MET HB2 1 1 35 21169 1 1 2 MET HB3 H -15.600 9.504 4.681 1.00 . A A . 2 MET HB3 1 1 35 21170 1 1 2 MET HE1 H -13.806 12.458 7.359 1.00 . A A . 2 MET HE1 1 1 35 21171 1 1 2 MET HE2 H -14.103 14.142 6.926 1.00 . A A . 2 MET HE2 1 1 35 21172 1 1 2 MET HE3 H -15.365 13.200 7.720 1.00 . A A . 2 MET HE3 1 1 35 21173 1 1 2 MET HG2 H -14.257 10.568 6.145 1.00 . A A . 2 MET HG2 1 1 35 21174 1 1 2 MET HG3 H -13.273 11.302 4.881 1.00 . A A . 2 MET HG3 1 1 35 21175 1 1 2 MET N N -13.175 8.474 4.221 1.00 . A A . 2 MET N 1 1 35 21176 1 1 2 MET O O -13.334 11.457 2.337 1.00 . A A . 2 MET O 1 1 35 21177 1 1 2 MET SD S -15.167 12.642 5.416 1.00 . A A . 2 MET SD 1 1 35 21178 1 1 3 ASP C C -10.165 9.718 0.402 1.00 . A A . 3 ASP C 1 1 35 21179 1 1 3 ASP CA C -10.860 10.569 1.459 1.00 . A A . 3 ASP CA 1 1 35 21180 1 1 3 ASP CB C -9.824 11.163 2.415 1.00 . A A . 3 ASP CB 1 1 35 21181 1 1 3 ASP CG C -10.329 12.411 3.113 1.00 . A A . 3 ASP CG 1 1 35 21182 1 1 3 ASP H H -11.632 8.850 2.423 1.00 . A A . 3 ASP H 1 1 35 21183 1 1 3 ASP HA H -11.386 11.373 0.968 1.00 . A A . 3 ASP HA 1 1 35 21184 1 1 3 ASP HB2 H -9.574 10.430 3.166 1.00 . A A . 3 ASP HB2 1 1 35 21185 1 1 3 ASP HB3 H -8.935 11.419 1.857 1.00 . A A . 3 ASP HB3 1 1 35 21186 1 1 3 ASP N N -11.839 9.781 2.200 1.00 . A A . 3 ASP N 1 1 35 21187 1 1 3 ASP O O -10.047 8.501 0.549 1.00 . A A . 3 ASP O 1 1 35 21188 1 1 3 ASP OD1 O -11.184 13.111 2.531 1.00 . A A . 3 ASP OD1 1 1 35 21189 1 1 3 ASP OD2 O -9.870 12.687 4.241 1.00 . A A . 3 ASP OD2 1 1 35 21190 1 1 4 CYS C C -7.761 8.978 -1.238 1.00 . A A . 4 CYS C 1 1 35 21191 1 1 4 CYS CA C -9.022 9.668 -1.747 1.00 . A A . 4 CYS CA 1 1 35 21192 1 1 4 CYS CB C -8.664 10.647 -2.867 1.00 . A A . 4 CYS CB 1 1 35 21193 1 1 4 CYS H H -9.831 11.336 -0.724 1.00 . A A . 4 CYS H 1 1 35 21194 1 1 4 CYS HA H -9.695 8.920 -2.136 1.00 . A A . 4 CYS HA 1 1 35 21195 1 1 4 CYS HB2 H -8.573 11.640 -2.451 1.00 . A A . 4 CYS HB2 1 1 35 21196 1 1 4 CYS HB3 H -7.719 10.356 -3.301 1.00 . A A . 4 CYS HB3 1 1 35 21197 1 1 4 CYS N N -9.706 10.366 -0.664 1.00 . A A . 4 CYS N 1 1 35 21198 1 1 4 CYS O O -7.383 7.913 -1.726 1.00 . A A . 4 CYS O 1 1 35 21199 1 1 4 CYS SG S -9.892 10.721 -4.210 1.00 . A A . 4 CYS SG 1 1 35 21200 1 1 5 THR C C -4.776 8.990 -0.718 1.00 . A A . 5 THR C 1 1 35 21201 1 1 5 THR CA C -5.891 9.040 0.322 1.00 . A A . 5 THR CA 1 1 35 21202 1 1 5 THR CB C -6.151 7.639 0.878 1.00 . A A . 5 THR CB 1 1 35 21203 1 1 5 THR CG2 C -5.376 7.345 2.144 1.00 . A A . 5 THR CG2 1 1 35 21204 1 1 5 THR H H -7.462 10.441 0.093 1.00 . A A . 5 THR H 1 1 35 21205 1 1 5 THR HA H -5.584 9.687 1.130 1.00 . A A . 5 THR HA 1 1 35 21206 1 1 5 THR HB H -5.860 6.909 0.136 1.00 . A A . 5 THR HB 1 1 35 21207 1 1 5 THR HG1 H -7.694 6.536 1.364 1.00 . A A . 5 THR HG1 1 1 35 21208 1 1 5 THR HG21 H -4.328 7.545 1.980 1.00 . A A . 5 THR HG21 1 1 35 21209 1 1 5 THR HG22 H -5.742 7.973 2.944 1.00 . A A . 5 THR HG22 1 1 35 21210 1 1 5 THR HG23 H -5.507 6.307 2.413 1.00 . A A . 5 THR HG23 1 1 35 21211 1 1 5 THR N N -7.112 9.593 -0.254 1.00 . A A . 5 THR N 1 1 35 21212 1 1 5 THR O O -4.995 8.584 -1.859 1.00 . A A . 5 THR O 1 1 35 21213 1 1 5 THR OG1 O -7.526 7.460 1.163 1.00 . A A . 5 THR OG1 1 1 35 21214 1 1 6 THR C C -1.242 8.693 -0.577 1.00 . A A . 6 THR C 1 1 35 21215 1 1 6 THR CA C -2.430 9.407 -1.213 1.00 . A A . 6 THR CA 1 1 35 21216 1 1 6 THR CB C -2.043 10.841 -1.577 1.00 . A A . 6 THR CB 1 1 35 21217 1 1 6 THR CG2 C -2.765 11.365 -2.799 1.00 . A A . 6 THR CG2 1 1 35 21218 1 1 6 THR H H -3.467 9.717 0.606 1.00 . A A . 6 THR H 1 1 35 21219 1 1 6 THR HA H -2.711 8.881 -2.113 1.00 . A A . 6 THR HA 1 1 35 21220 1 1 6 THR HB H -0.982 10.877 -1.779 1.00 . A A . 6 THR HB 1 1 35 21221 1 1 6 THR HG1 H -1.550 12.269 -0.329 1.00 . A A . 6 THR HG1 1 1 35 21222 1 1 6 THR HG21 H -3.357 10.572 -3.234 1.00 . A A . 6 THR HG21 1 1 35 21223 1 1 6 THR HG22 H -3.412 12.181 -2.513 1.00 . A A . 6 THR HG22 1 1 35 21224 1 1 6 THR HG23 H -2.043 11.713 -3.522 1.00 . A A . 6 THR HG23 1 1 35 21225 1 1 6 THR N N -3.579 9.405 -0.316 1.00 . A A . 6 THR N 1 1 35 21226 1 1 6 THR O O -0.972 8.855 0.613 1.00 . A A . 6 THR O 1 1 35 21227 1 1 6 THR OG1 O -2.321 11.723 -0.503 1.00 . A A . 6 THR OG1 1 1 35 21228 1 1 7 GLY C C 0.953 5.962 -1.721 1.00 . A A . 7 GLY C 1 1 35 21229 1 1 7 GLY CA C 0.615 7.175 -0.874 1.00 . A A . 7 GLY CA 1 1 35 21230 1 1 7 GLY H H -0.798 7.810 -2.318 1.00 . A A . 7 GLY H 1 1 35 21231 1 1 7 GLY HA2 H 0.407 6.849 0.135 1.00 . A A . 7 GLY HA2 1 1 35 21232 1 1 7 GLY HA3 H 1.467 7.838 -0.859 1.00 . A A . 7 GLY HA3 1 1 35 21233 1 1 7 GLY N N -0.536 7.902 -1.378 1.00 . A A . 7 GLY N 1 1 35 21234 1 1 7 GLY O O 0.462 5.830 -2.842 1.00 . A A . 7 GLY O 1 1 35 21235 1 1 8 PRO C C 1.061 2.827 -2.044 1.00 . A A . 8 PRO C 1 1 35 21236 1 1 8 PRO CA C 2.194 3.842 -1.935 1.00 . A A . 8 PRO CA 1 1 35 21237 1 1 8 PRO CB C 3.336 3.278 -1.087 1.00 . A A . 8 PRO CB 1 1 35 21238 1 1 8 PRO CD C 2.430 5.129 0.124 1.00 . A A . 8 PRO CD 1 1 35 21239 1 1 8 PRO CG C 3.065 3.776 0.290 1.00 . A A . 8 PRO CG 1 1 35 21240 1 1 8 PRO HA H 2.559 4.079 -2.924 1.00 . A A . 8 PRO HA 1 1 35 21241 1 1 8 PRO HB2 H 3.319 2.198 -1.129 1.00 . A A . 8 PRO HB2 1 1 35 21242 1 1 8 PRO HB3 H 4.280 3.644 -1.460 1.00 . A A . 8 PRO HB3 1 1 35 21243 1 1 8 PRO HD2 H 1.690 5.296 0.893 1.00 . A A . 8 PRO HD2 1 1 35 21244 1 1 8 PRO HD3 H 3.181 5.904 0.147 1.00 . A A . 8 PRO HD3 1 1 35 21245 1 1 8 PRO HG2 H 2.389 3.104 0.797 1.00 . A A . 8 PRO HG2 1 1 35 21246 1 1 8 PRO HG3 H 3.991 3.862 0.838 1.00 . A A . 8 PRO HG3 1 1 35 21247 1 1 8 PRO N N 1.796 5.051 -1.207 1.00 . A A . 8 PRO N 1 1 35 21248 1 1 8 PRO O O 1.031 2.013 -2.968 1.00 . A A . 8 PRO O 1 1 35 21249 1 1 9 CYS C C -2.240 2.607 -1.701 1.00 . A A . 9 CYS C 1 1 35 21250 1 1 9 CYS CA C -1.002 1.957 -1.089 1.00 . A A . 9 CYS CA 1 1 35 21251 1 1 9 CYS CB C -1.304 1.498 0.339 1.00 . A A . 9 CYS CB 1 1 35 21252 1 1 9 CYS H H 0.208 3.545 -0.384 1.00 . A A . 9 CYS H 1 1 35 21253 1 1 9 CYS HA H -0.732 1.097 -1.683 1.00 . A A . 9 CYS HA 1 1 35 21254 1 1 9 CYS HB2 H -0.976 2.258 1.031 1.00 . A A . 9 CYS HB2 1 1 35 21255 1 1 9 CYS HB3 H -2.369 1.356 0.446 1.00 . A A . 9 CYS HB3 1 1 35 21256 1 1 9 CYS N N 0.131 2.877 -1.096 1.00 . A A . 9 CYS N 1 1 35 21257 1 1 9 CYS O O -3.369 2.280 -1.336 1.00 . A A . 9 CYS O 1 1 35 21258 1 1 9 CYS SG S -0.487 -0.063 0.805 1.00 . A A . 9 CYS SG 1 1 35 21259 1 1 10 CYS C C -3.018 4.059 -4.814 1.00 . A A . 10 CYS C 1 1 35 21260 1 1 10 CYS CA C -3.118 4.220 -3.300 1.00 . A A . 10 CYS CA 1 1 35 21261 1 1 10 CYS CB C -3.112 5.704 -2.931 1.00 . A A . 10 CYS CB 1 1 35 21262 1 1 10 CYS H H -1.098 3.744 -2.884 1.00 . A A . 10 CYS H 1 1 35 21263 1 1 10 CYS HA H -4.044 3.777 -2.963 1.00 . A A . 10 CYS HA 1 1 35 21264 1 1 10 CYS HB2 H -2.106 6.086 -3.023 1.00 . A A . 10 CYS HB2 1 1 35 21265 1 1 10 CYS HB3 H -3.759 6.239 -3.610 1.00 . A A . 10 CYS HB3 1 1 35 21266 1 1 10 CYS N N -2.020 3.527 -2.635 1.00 . A A . 10 CYS N 1 1 35 21267 1 1 10 CYS O O -1.926 4.103 -5.381 1.00 . A A . 10 CYS O 1 1 35 21268 1 1 10 CYS SG S -3.680 6.049 -1.234 1.00 . A A . 10 CYS SG 1 1 35 21269 1 1 11 ARG C C -4.216 5.048 -7.626 1.00 . A A . 11 ARG C 1 1 35 21270 1 1 11 ARG CA C -4.194 3.696 -6.912 1.00 . A A . 11 ARG CA 1 1 35 21271 1 1 11 ARG CB C -5.407 2.854 -7.320 1.00 . A A . 11 ARG CB 1 1 35 21272 1 1 11 ARG CD C -6.288 0.522 -7.003 1.00 . A A . 11 ARG CD 1 1 35 21273 1 1 11 ARG CG C -5.104 1.369 -7.439 1.00 . A A . 11 ARG CG 1 1 35 21274 1 1 11 ARG CZ C -6.462 -1.131 -8.822 1.00 . A A . 11 ARG CZ 1 1 35 21275 1 1 11 ARG H H -5.001 3.839 -4.959 1.00 . A A . 11 ARG H 1 1 35 21276 1 1 11 ARG HA H -3.296 3.173 -7.198 1.00 . A A . 11 ARG HA 1 1 35 21277 1 1 11 ARG HB2 H -6.185 2.983 -6.583 1.00 . A A . 11 ARG HB2 1 1 35 21278 1 1 11 ARG HB3 H -5.768 3.203 -8.277 1.00 . A A . 11 ARG HB3 1 1 35 21279 1 1 11 ARG HD2 H -6.297 0.466 -5.925 1.00 . A A . 11 ARG HD2 1 1 35 21280 1 1 11 ARG HD3 H -7.197 0.995 -7.345 1.00 . A A . 11 ARG HD3 1 1 35 21281 1 1 11 ARG HE H -5.989 -1.557 -6.930 1.00 . A A . 11 ARG HE 1 1 35 21282 1 1 11 ARG HG2 H -4.870 1.140 -8.468 1.00 . A A . 11 ARG HG2 1 1 35 21283 1 1 11 ARG HG3 H -4.254 1.134 -6.815 1.00 . A A . 11 ARG HG3 1 1 35 21284 1 1 11 ARG HH11 H -6.845 0.774 -9.382 1.00 . A A . 11 ARG HH11 1 1 35 21285 1 1 11 ARG HH12 H -6.961 -0.408 -10.642 1.00 . A A . 11 ARG HH12 1 1 35 21286 1 1 11 ARG HH21 H -6.139 -3.112 -8.587 1.00 . A A . 11 ARG HH21 1 1 35 21287 1 1 11 ARG HH22 H -6.560 -2.614 -10.191 1.00 . A A . 11 ARG HH22 1 1 35 21288 1 1 11 ARG N N -4.161 3.868 -5.464 1.00 . A A . 11 ARG N 1 1 35 21289 1 1 11 ARG NE N -6.223 -0.832 -7.547 1.00 . A A . 11 ARG NE 1 1 35 21290 1 1 11 ARG NH1 N -6.782 -0.176 -9.686 1.00 . A A . 11 ARG NH1 1 1 35 21291 1 1 11 ARG NH2 N -6.381 -2.389 -9.234 1.00 . A A . 11 ARG NH2 1 1 35 21292 1 1 11 ARG O O -3.165 5.599 -7.955 1.00 . A A . 11 ARG O 1 1 35 21293 1 1 12 GLN C C -6.262 7.880 -7.650 1.00 . A A . 12 GLN C 1 1 35 21294 1 1 12 GLN CA C -5.556 6.862 -8.542 1.00 . A A . 12 GLN CA 1 1 35 21295 1 1 12 GLN CB C -6.334 6.688 -9.848 1.00 . A A . 12 GLN CB 1 1 35 21296 1 1 12 GLN CD C -7.130 8.968 -10.586 1.00 . A A . 12 GLN CD 1 1 35 21297 1 1 12 GLN CG C -6.148 7.838 -10.824 1.00 . A A . 12 GLN CG 1 1 35 21298 1 1 12 GLN H H -6.216 5.094 -7.584 1.00 . A A . 12 GLN H 1 1 35 21299 1 1 12 GLN HA H -4.567 7.228 -8.771 1.00 . A A . 12 GLN HA 1 1 35 21300 1 1 12 GLN HB2 H -6.006 5.778 -10.330 1.00 . A A . 12 GLN HB2 1 1 35 21301 1 1 12 GLN HB3 H -7.386 6.605 -9.619 1.00 . A A . 12 GLN HB3 1 1 35 21302 1 1 12 GLN HE21 H -5.643 10.184 -10.071 1.00 . A A . 12 GLN HE21 1 1 35 21303 1 1 12 GLN HE22 H -7.226 10.874 -10.026 1.00 . A A . 12 GLN HE22 1 1 35 21304 1 1 12 GLN HG2 H -5.145 8.224 -10.719 1.00 . A A . 12 GLN HG2 1 1 35 21305 1 1 12 GLN HG3 H -6.286 7.466 -11.829 1.00 . A A . 12 GLN HG3 1 1 35 21306 1 1 12 GLN N N -5.412 5.578 -7.866 1.00 . A A . 12 GLN N 1 1 35 21307 1 1 12 GLN NE2 N -6.614 10.125 -10.188 1.00 . A A . 12 GLN NE2 1 1 35 21308 1 1 12 GLN O O -6.131 9.087 -7.850 1.00 . A A . 12 GLN O 1 1 35 21309 1 1 12 GLN OE1 O -8.337 8.804 -10.759 1.00 . A A . 12 GLN OE1 1 1 35 21310 1 1 13 CYS C C -8.528 7.446 -4.730 1.00 . A A . 13 CYS C 1 1 35 21311 1 1 13 CYS CA C -7.738 8.261 -5.750 1.00 . A A . 13 CYS CA 1 1 35 21312 1 1 13 CYS CB C -8.684 9.180 -6.528 1.00 . A A . 13 CYS CB 1 1 35 21313 1 1 13 CYS H H -7.080 6.417 -6.555 1.00 . A A . 13 CYS H 1 1 35 21314 1 1 13 CYS HA H -7.013 8.867 -5.226 1.00 . A A . 13 CYS HA 1 1 35 21315 1 1 13 CYS HB2 H -8.359 9.231 -7.556 1.00 . A A . 13 CYS HB2 1 1 35 21316 1 1 13 CYS HB3 H -9.683 8.769 -6.491 1.00 . A A . 13 CYS HB3 1 1 35 21317 1 1 13 CYS N N -7.012 7.388 -6.667 1.00 . A A . 13 CYS N 1 1 35 21318 1 1 13 CYS O O -9.645 7.810 -4.362 1.00 . A A . 13 CYS O 1 1 35 21319 1 1 13 CYS SG S -8.761 10.884 -5.888 1.00 . A A . 13 CYS SG 1 1 35 21320 1 1 14 LYS C C -7.607 4.477 -2.712 1.00 . A A . 14 LYS C 1 1 35 21321 1 1 14 LYS CA C -8.595 5.480 -3.300 1.00 . A A . 14 LYS CA 1 1 35 21322 1 1 14 LYS CB C -9.768 4.740 -3.945 1.00 . A A . 14 LYS CB 1 1 35 21323 1 1 14 LYS CD C -12.267 4.551 -3.765 1.00 . A A . 14 LYS CD 1 1 35 21324 1 1 14 LYS CE C -12.796 4.170 -5.138 1.00 . A A . 14 LYS CE 1 1 35 21325 1 1 14 LYS CG C -11.082 5.498 -3.868 1.00 . A A . 14 LYS CG 1 1 35 21326 1 1 14 LYS H H -7.050 6.103 -4.606 1.00 . A A . 14 LYS H 1 1 35 21327 1 1 14 LYS HA H -8.970 6.105 -2.504 1.00 . A A . 14 LYS HA 1 1 35 21328 1 1 14 LYS HB2 H -9.539 4.564 -4.986 1.00 . A A . 14 LYS HB2 1 1 35 21329 1 1 14 LYS HB3 H -9.895 3.789 -3.449 1.00 . A A . 14 LYS HB3 1 1 35 21330 1 1 14 LYS HD2 H -11.955 3.655 -3.249 1.00 . A A . 14 LYS HD2 1 1 35 21331 1 1 14 LYS HD3 H -13.054 5.034 -3.206 1.00 . A A . 14 LYS HD3 1 1 35 21332 1 1 14 LYS HE2 H -13.497 3.356 -5.026 1.00 . A A . 14 LYS HE2 1 1 35 21333 1 1 14 LYS HE3 H -13.303 5.024 -5.564 1.00 . A A . 14 LYS HE3 1 1 35 21334 1 1 14 LYS HG2 H -11.068 6.136 -2.997 1.00 . A A . 14 LYS HG2 1 1 35 21335 1 1 14 LYS HG3 H -11.191 6.102 -4.757 1.00 . A A . 14 LYS HG3 1 1 35 21336 1 1 14 LYS HZ1 H -11.088 3.054 -5.583 1.00 . A A . 14 LYS HZ1 1 1 35 21337 1 1 14 LYS HZ2 H -12.105 3.308 -6.911 1.00 . A A . 14 LYS HZ2 1 1 35 21338 1 1 14 LYS HZ3 H -11.133 4.568 -6.337 1.00 . A A . 14 LYS HZ3 1 1 35 21339 1 1 14 LYS N N -7.942 6.343 -4.276 1.00 . A A . 14 LYS N 1 1 35 21340 1 1 14 LYS NZ N -11.704 3.745 -6.056 1.00 . A A . 14 LYS NZ 1 1 35 21341 1 1 14 LYS O O -6.681 4.033 -3.390 1.00 . A A . 14 LYS O 1 1 35 21342 1 1 15 LEU C C -6.919 1.837 -1.503 1.00 . A A . 15 LEU C 1 1 35 21343 1 1 15 LEU CA C -6.943 3.173 -0.768 1.00 . A A . 15 LEU CA 1 1 35 21344 1 1 15 LEU CB C -7.406 2.970 0.677 1.00 . A A . 15 LEU CB 1 1 35 21345 1 1 15 LEU CD1 C -6.824 3.730 2.994 1.00 . A A . 15 LEU CD1 1 1 35 21346 1 1 15 LEU CD2 C -5.745 1.684 2.044 1.00 . A A . 15 LEU CD2 1 1 35 21347 1 1 15 LEU CG C -6.301 3.065 1.731 1.00 . A A . 15 LEU CG 1 1 35 21348 1 1 15 LEU H H -8.570 4.512 -0.961 1.00 . A A . 15 LEU H 1 1 35 21349 1 1 15 LEU HA H -5.944 3.584 -0.761 1.00 . A A . 15 LEU HA 1 1 35 21350 1 1 15 LEU HB2 H -8.154 3.717 0.900 1.00 . A A . 15 LEU HB2 1 1 35 21351 1 1 15 LEU HB3 H -7.863 1.994 0.755 1.00 . A A . 15 LEU HB3 1 1 35 21352 1 1 15 LEU HD11 H -7.203 4.712 2.754 1.00 . A A . 15 LEU HD11 1 1 35 21353 1 1 15 LEU HD12 H -7.618 3.131 3.415 1.00 . A A . 15 LEU HD12 1 1 35 21354 1 1 15 LEU HD13 H -6.022 3.819 3.712 1.00 . A A . 15 LEU HD13 1 1 35 21355 1 1 15 LEU HD21 H -5.887 1.037 1.191 1.00 . A A . 15 LEU HD21 1 1 35 21356 1 1 15 LEU HD22 H -4.690 1.762 2.264 1.00 . A A . 15 LEU HD22 1 1 35 21357 1 1 15 LEU HD23 H -6.262 1.273 2.898 1.00 . A A . 15 LEU HD23 1 1 35 21358 1 1 15 LEU HG H -5.495 3.671 1.344 1.00 . A A . 15 LEU HG 1 1 35 21359 1 1 15 LEU N N -7.813 4.124 -1.448 1.00 . A A . 15 LEU N 1 1 35 21360 1 1 15 LEU O O -7.948 1.176 -1.644 1.00 . A A . 15 LEU O 1 1 35 21361 1 1 16 LYS C C -6.065 -0.990 -1.853 1.00 . A A . 16 LYS C 1 1 35 21362 1 1 16 LYS CA C -5.579 0.188 -2.694 1.00 . A A . 16 LYS CA 1 1 35 21363 1 1 16 LYS CB C -4.115 -0.018 -3.084 1.00 . A A . 16 LYS CB 1 1 35 21364 1 1 16 LYS CD C -2.656 0.145 -5.123 1.00 . A A . 16 LYS CD 1 1 35 21365 1 1 16 LYS CE C -1.366 -0.149 -4.374 1.00 . A A . 16 LYS CE 1 1 35 21366 1 1 16 LYS CG C -3.663 0.861 -4.239 1.00 . A A . 16 LYS CG 1 1 35 21367 1 1 16 LYS H H -4.954 2.016 -1.828 1.00 . A A . 16 LYS H 1 1 35 21368 1 1 16 LYS HA H -6.177 0.245 -3.592 1.00 . A A . 16 LYS HA 1 1 35 21369 1 1 16 LYS HB2 H -3.492 0.200 -2.229 1.00 . A A . 16 LYS HB2 1 1 35 21370 1 1 16 LYS HB3 H -3.972 -1.050 -3.368 1.00 . A A . 16 LYS HB3 1 1 35 21371 1 1 16 LYS HD2 H -3.085 -0.787 -5.460 1.00 . A A . 16 LYS HD2 1 1 35 21372 1 1 16 LYS HD3 H -2.432 0.770 -5.976 1.00 . A A . 16 LYS HD3 1 1 35 21373 1 1 16 LYS HE2 H -1.103 0.715 -3.783 1.00 . A A . 16 LYS HE2 1 1 35 21374 1 1 16 LYS HE3 H -1.529 -0.994 -3.721 1.00 . A A . 16 LYS HE3 1 1 35 21375 1 1 16 LYS HG2 H -4.524 1.127 -4.834 1.00 . A A . 16 LYS HG2 1 1 35 21376 1 1 16 LYS HG3 H -3.208 1.756 -3.840 1.00 . A A . 16 LYS HG3 1 1 35 21377 1 1 16 LYS HZ1 H -0.587 -1.035 -6.098 1.00 . A A . 16 LYS HZ1 1 1 35 21378 1 1 16 LYS HZ2 H 0.168 0.418 -5.673 1.00 . A A . 16 LYS HZ2 1 1 35 21379 1 1 16 LYS HZ3 H 0.497 -0.992 -4.799 1.00 . A A . 16 LYS HZ3 1 1 35 21380 1 1 16 LYS N N -5.738 1.445 -1.971 1.00 . A A . 16 LYS N 1 1 35 21381 1 1 16 LYS NZ N -0.243 -0.461 -5.301 1.00 . A A . 16 LYS NZ 1 1 35 21382 1 1 16 LYS O O -6.090 -0.918 -0.624 1.00 . A A . 16 LYS O 1 1 35 21383 1 1 17 PRO C C -5.843 -4.001 -1.035 1.00 . A A . 17 PRO C 1 1 35 21384 1 1 17 PRO CA C -6.947 -3.293 -1.812 1.00 . A A . 17 PRO CA 1 1 35 21385 1 1 17 PRO CB C -7.456 -4.183 -2.948 1.00 . A A . 17 PRO CB 1 1 35 21386 1 1 17 PRO CD C -6.462 -2.267 -3.972 1.00 . A A . 17 PRO CD 1 1 35 21387 1 1 17 PRO CG C -6.694 -3.742 -4.149 1.00 . A A . 17 PRO CG 1 1 35 21388 1 1 17 PRO HA H -7.761 -3.058 -1.142 1.00 . A A . 17 PRO HA 1 1 35 21389 1 1 17 PRO HB2 H -7.259 -5.219 -2.713 1.00 . A A . 17 PRO HB2 1 1 35 21390 1 1 17 PRO HB3 H -8.518 -4.034 -3.079 1.00 . A A . 17 PRO HB3 1 1 35 21391 1 1 17 PRO HD2 H -5.511 -1.980 -4.395 1.00 . A A . 17 PRO HD2 1 1 35 21392 1 1 17 PRO HD3 H -7.264 -1.702 -4.424 1.00 . A A . 17 PRO HD3 1 1 35 21393 1 1 17 PRO HG2 H -5.751 -4.266 -4.199 1.00 . A A . 17 PRO HG2 1 1 35 21394 1 1 17 PRO HG3 H -7.274 -3.925 -5.041 1.00 . A A . 17 PRO HG3 1 1 35 21395 1 1 17 PRO N N -6.460 -2.096 -2.507 1.00 . A A . 17 PRO N 1 1 35 21396 1 1 17 PRO O O -4.687 -4.021 -1.457 1.00 . A A . 17 PRO O 1 1 35 21397 1 1 18 ALA C C -4.567 -6.413 0.166 1.00 . A A . 18 ALA C 1 1 35 21398 1 1 18 ALA CA C -5.252 -5.293 0.942 1.00 . A A . 18 ALA CA 1 1 35 21399 1 1 18 ALA CB C -5.945 -5.852 2.176 1.00 . A A . 18 ALA CB 1 1 35 21400 1 1 18 ALA H H -7.146 -4.531 0.385 1.00 . A A . 18 ALA H 1 1 35 21401 1 1 18 ALA HA H -4.504 -4.585 1.269 1.00 . A A . 18 ALA HA 1 1 35 21402 1 1 18 ALA HB1 H -6.853 -5.297 2.360 1.00 . A A . 18 ALA HB1 1 1 35 21403 1 1 18 ALA HB2 H -6.185 -6.892 2.014 1.00 . A A . 18 ALA HB2 1 1 35 21404 1 1 18 ALA HB3 H -5.289 -5.762 3.029 1.00 . A A . 18 ALA HB3 1 1 35 21405 1 1 18 ALA N N -6.209 -4.582 0.103 1.00 . A A . 18 ALA N 1 1 35 21406 1 1 18 ALA O O -5.226 -7.300 -0.376 1.00 . A A . 18 ALA O 1 1 35 21407 1 1 19 GLY C C -1.560 -6.788 -1.642 1.00 . A A . 19 GLY C 1 1 35 21408 1 1 19 GLY CA C -2.486 -7.380 -0.598 1.00 . A A . 19 GLY CA 1 1 35 21409 1 1 19 GLY H H -2.767 -5.634 0.566 1.00 . A A . 19 GLY H 1 1 35 21410 1 1 19 GLY HA2 H -3.179 -8.050 -1.086 1.00 . A A . 19 GLY HA2 1 1 35 21411 1 1 19 GLY HA3 H -1.898 -7.942 0.112 1.00 . A A . 19 GLY HA3 1 1 35 21412 1 1 19 GLY N N -3.239 -6.365 0.116 1.00 . A A . 19 GLY N 1 1 35 21413 1 1 19 GLY O O -0.550 -7.394 -2.000 1.00 . A A . 19 GLY O 1 1 35 21414 1 1 20 THR C C 0.252 -4.504 -2.563 1.00 . A A . 20 THR C 1 1 35 21415 1 1 20 THR CA C -1.095 -4.927 -3.140 1.00 . A A . 20 THR CA 1 1 35 21416 1 1 20 THR CB C -1.836 -3.704 -3.684 1.00 . A A . 20 THR CB 1 1 35 21417 1 1 20 THR CG2 C -1.294 -3.215 -5.009 1.00 . A A . 20 THR CG2 1 1 35 21418 1 1 20 THR H H -2.719 -5.168 -1.807 1.00 . A A . 20 THR H 1 1 35 21419 1 1 20 THR HA H -0.924 -5.622 -3.948 1.00 . A A . 20 THR HA 1 1 35 21420 1 1 20 THR HB H -1.748 -2.897 -2.972 1.00 . A A . 20 THR HB 1 1 35 21421 1 1 20 THR HG1 H -3.736 -3.241 -3.572 1.00 . A A . 20 THR HG1 1 1 35 21422 1 1 20 THR HG21 H -1.333 -4.016 -5.732 1.00 . A A . 20 THR HG21 1 1 35 21423 1 1 20 THR HG22 H -1.892 -2.386 -5.359 1.00 . A A . 20 THR HG22 1 1 35 21424 1 1 20 THR HG23 H -0.271 -2.893 -4.883 1.00 . A A . 20 THR HG23 1 1 35 21425 1 1 20 THR N N -1.903 -5.601 -2.132 1.00 . A A . 20 THR N 1 1 35 21426 1 1 20 THR O O 0.313 -3.742 -1.598 1.00 . A A . 20 THR O 1 1 35 21427 1 1 20 THR OG1 O -3.212 -3.991 -3.862 1.00 . A A . 20 THR OG1 1 1 35 21428 1 1 21 THR C C 3.116 -3.317 -3.234 1.00 . A A . 21 THR C 1 1 35 21429 1 1 21 THR CA C 2.675 -4.677 -2.701 1.00 . A A . 21 THR CA 1 1 35 21430 1 1 21 THR CB C 3.666 -5.760 -3.140 1.00 . A A . 21 THR CB 1 1 35 21431 1 1 21 THR CG2 C 4.334 -6.462 -1.978 1.00 . A A . 21 THR CG2 1 1 35 21432 1 1 21 THR H H 1.217 -5.607 -3.923 1.00 . A A . 21 THR H 1 1 35 21433 1 1 21 THR HA H 2.656 -4.637 -1.623 1.00 . A A . 21 THR HA 1 1 35 21434 1 1 21 THR HB H 4.441 -5.305 -3.740 1.00 . A A . 21 THR HB 1 1 35 21435 1 1 21 THR HG1 H 3.109 -6.528 -4.854 1.00 . A A . 21 THR HG1 1 1 35 21436 1 1 21 THR HG21 H 3.683 -6.432 -1.117 1.00 . A A . 21 THR HG21 1 1 35 21437 1 1 21 THR HG22 H 4.533 -7.489 -2.244 1.00 . A A . 21 THR HG22 1 1 35 21438 1 1 21 THR HG23 H 5.264 -5.964 -1.743 1.00 . A A . 21 THR HG23 1 1 35 21439 1 1 21 THR N N 1.329 -5.004 -3.159 1.00 . A A . 21 THR N 1 1 35 21440 1 1 21 THR O O 2.842 -2.971 -4.383 1.00 . A A . 21 THR O 1 1 35 21441 1 1 21 THR OG1 O 3.020 -6.748 -3.924 1.00 . A A . 21 THR OG1 1 1 35 21442 1 1 22 CYS C C 5.780 -1.249 -3.042 1.00 . A A . 22 CYS C 1 1 35 21443 1 1 22 CYS CA C 4.278 -1.229 -2.776 1.00 . A A . 22 CYS CA 1 1 35 21444 1 1 22 CYS CB C 3.956 -0.208 -1.683 1.00 . A A . 22 CYS CB 1 1 35 21445 1 1 22 CYS H H 3.986 -2.882 -1.487 1.00 . A A . 22 CYS H 1 1 35 21446 1 1 22 CYS HA H 3.768 -0.944 -3.684 1.00 . A A . 22 CYS HA 1 1 35 21447 1 1 22 CYS HB2 H 4.410 0.738 -1.940 1.00 . A A . 22 CYS HB2 1 1 35 21448 1 1 22 CYS HB3 H 2.885 -0.083 -1.623 1.00 . A A . 22 CYS HB3 1 1 35 21449 1 1 22 CYS N N 3.799 -2.551 -2.391 1.00 . A A . 22 CYS N 1 1 35 21450 1 1 22 CYS O O 6.258 -0.653 -4.006 1.00 . A A . 22 CYS O 1 1 35 21451 1 1 22 CYS SG S 4.555 -0.677 -0.027 1.00 . A A . 22 CYS SG 1 1 35 21452 1 1 23 TRP C C 8.390 -3.476 -2.604 1.00 . A A . 23 TRP C 1 1 35 21453 1 1 23 TRP CA C 7.968 -2.039 -2.321 1.00 . A A . 23 TRP CA 1 1 35 21454 1 1 23 TRP CB C 8.660 -1.531 -1.056 1.00 . A A . 23 TRP CB 1 1 35 21455 1 1 23 TRP CD1 C 10.576 -0.372 -2.303 1.00 . A A . 23 TRP CD1 1 1 35 21456 1 1 23 TRP CD2 C 11.211 -1.473 -0.459 1.00 . A A . 23 TRP CD2 1 1 35 21457 1 1 23 TRP CE2 C 12.348 -0.886 -1.046 1.00 . A A . 23 TRP CE2 1 1 35 21458 1 1 23 TRP CE3 C 11.367 -2.216 0.714 1.00 . A A . 23 TRP CE3 1 1 35 21459 1 1 23 TRP CG C 10.087 -1.132 -1.279 1.00 . A A . 23 TRP CG 1 1 35 21460 1 1 23 TRP CH2 C 13.744 -1.753 0.650 1.00 . A A . 23 TRP CH2 1 1 35 21461 1 1 23 TRP CZ2 C 13.622 -1.020 -0.499 1.00 . A A . 23 TRP CZ2 1 1 35 21462 1 1 23 TRP CZ3 C 12.631 -2.349 1.256 1.00 . A A . 23 TRP CZ3 1 1 35 21463 1 1 23 TRP H H 6.081 -2.395 -1.430 1.00 . A A . 23 TRP H 1 1 35 21464 1 1 23 TRP HA H 8.262 -1.419 -3.155 1.00 . A A . 23 TRP HA 1 1 35 21465 1 1 23 TRP HB2 H 8.128 -0.669 -0.683 1.00 . A A . 23 TRP HB2 1 1 35 21466 1 1 23 TRP HB3 H 8.644 -2.309 -0.307 1.00 . A A . 23 TRP HB3 1 1 35 21467 1 1 23 TRP HD1 H 9.970 0.041 -3.096 1.00 . A A . 23 TRP HD1 1 1 35 21468 1 1 23 TRP HE1 H 12.513 0.284 -2.780 1.00 . A A . 23 TRP HE1 1 1 35 21469 1 1 23 TRP HE3 H 10.520 -2.683 1.196 1.00 . A A . 23 TRP HE3 1 1 35 21470 1 1 23 TRP HH2 H 14.714 -1.884 1.108 1.00 . A A . 23 TRP HH2 1 1 35 21471 1 1 23 TRP HZ2 H 14.490 -0.567 -0.954 1.00 . A A . 23 TRP HZ2 1 1 35 21472 1 1 23 TRP HZ3 H 12.770 -2.920 2.162 1.00 . A A . 23 TRP HZ3 1 1 35 21473 1 1 23 TRP N N 6.519 -1.940 -2.180 1.00 . A A . 23 TRP N 1 1 35 21474 1 1 23 TRP NE1 N 11.935 -0.220 -2.170 1.00 . A A . 23 TRP NE1 1 1 35 21475 1 1 23 TRP O O 7.790 -4.422 -2.094 1.00 . A A . 23 TRP O 1 1 35 21476 1 1 24 ARG C C 11.178 -4.849 -4.643 1.00 . A A . 24 ARG C 1 1 35 21477 1 1 24 ARG CA C 9.932 -4.956 -3.771 1.00 . A A . 24 ARG CA 1 1 35 21478 1 1 24 ARG CB C 8.852 -5.759 -4.499 1.00 . A A . 24 ARG CB 1 1 35 21479 1 1 24 ARG CD C 7.910 -8.074 -4.781 1.00 . A A . 24 ARG CD 1 1 35 21480 1 1 24 ARG CG C 9.172 -7.241 -4.616 1.00 . A A . 24 ARG CG 1 1 35 21481 1 1 24 ARG CZ C 7.377 -7.965 -7.185 1.00 . A A . 24 ARG CZ 1 1 35 21482 1 1 24 ARG H H 9.865 -2.840 -3.795 1.00 . A A . 24 ARG H 1 1 35 21483 1 1 24 ARG HA H 10.190 -5.465 -2.855 1.00 . A A . 24 ARG HA 1 1 35 21484 1 1 24 ARG HB2 H 7.920 -5.655 -3.965 1.00 . A A . 24 ARG HB2 1 1 35 21485 1 1 24 ARG HB3 H 8.733 -5.359 -5.495 1.00 . A A . 24 ARG HB3 1 1 35 21486 1 1 24 ARG HD2 H 7.928 -8.877 -4.059 1.00 . A A . 24 ARG HD2 1 1 35 21487 1 1 24 ARG HD3 H 7.051 -7.446 -4.596 1.00 . A A . 24 ARG HD3 1 1 35 21488 1 1 24 ARG HE H 8.058 -9.583 -6.236 1.00 . A A . 24 ARG HE 1 1 35 21489 1 1 24 ARG HG2 H 9.807 -7.395 -5.476 1.00 . A A . 24 ARG HG2 1 1 35 21490 1 1 24 ARG HG3 H 9.689 -7.559 -3.723 1.00 . A A . 24 ARG HG3 1 1 35 21491 1 1 24 ARG HH11 H 7.069 -6.237 -6.180 1.00 . A A . 24 ARG HH11 1 1 35 21492 1 1 24 ARG HH12 H 6.703 -6.187 -7.871 1.00 . A A . 24 ARG HH12 1 1 35 21493 1 1 24 ARG HH21 H 7.577 -9.519 -8.461 1.00 . A A . 24 ARG HH21 1 1 35 21494 1 1 24 ARG HH22 H 6.990 -8.050 -9.166 1.00 . A A . 24 ARG HH22 1 1 35 21495 1 1 24 ARG N N 9.428 -3.633 -3.420 1.00 . A A . 24 ARG N 1 1 35 21496 1 1 24 ARG NE N 7.801 -8.644 -6.121 1.00 . A A . 24 ARG NE 1 1 35 21497 1 1 24 ARG NH1 N 7.020 -6.692 -7.069 1.00 . A A . 24 ARG NH1 1 1 35 21498 1 1 24 ARG NH2 N 7.309 -8.560 -8.367 1.00 . A A . 24 ARG NH2 1 1 35 21499 1 1 24 ARG O O 11.085 -4.769 -5.868 1.00 . A A . 24 ARG O 1 1 35 21500 1 1 25 THR C C 14.027 -6.112 -5.273 1.00 . A A . 25 THR C 1 1 35 21501 1 1 25 THR CA C 13.609 -4.752 -4.723 1.00 . A A . 25 THR CA 1 1 35 21502 1 1 25 THR CB C 14.701 -4.202 -3.804 1.00 . A A . 25 THR CB 1 1 35 21503 1 1 25 THR CG2 C 14.856 -4.990 -2.521 1.00 . A A . 25 THR CG2 1 1 35 21504 1 1 25 THR H H 12.353 -4.916 -3.027 1.00 . A A . 25 THR H 1 1 35 21505 1 1 25 THR HA H 13.469 -4.072 -5.549 1.00 . A A . 25 THR HA 1 1 35 21506 1 1 25 THR HB H 14.454 -3.184 -3.539 1.00 . A A . 25 THR HB 1 1 35 21507 1 1 25 THR HG1 H 16.605 -3.757 -3.911 1.00 . A A . 25 THR HG1 1 1 35 21508 1 1 25 THR HG21 H 14.932 -6.042 -2.752 1.00 . A A . 25 THR HG21 1 1 35 21509 1 1 25 THR HG22 H 15.750 -4.669 -2.008 1.00 . A A . 25 THR HG22 1 1 35 21510 1 1 25 THR HG23 H 13.997 -4.821 -1.889 1.00 . A A . 25 THR HG23 1 1 35 21511 1 1 25 THR N N 12.344 -4.849 -4.005 1.00 . A A . 25 THR N 1 1 35 21512 1 1 25 THR O O 14.583 -6.207 -6.367 1.00 . A A . 25 THR O 1 1 35 21513 1 1 25 THR OG1 O 15.955 -4.200 -4.462 1.00 . A A . 25 THR OG1 1 1 35 21514 1 1 26 SER C C 13.651 -9.532 -3.868 1.00 . A A . 26 SER C 1 1 35 21515 1 1 26 SER CA C 14.103 -8.518 -4.913 1.00 . A A . 26 SER CA 1 1 35 21516 1 1 26 SER CB C 15.612 -8.638 -5.136 1.00 . A A . 26 SER CB 1 1 35 21517 1 1 26 SER H H 13.312 -7.020 -3.644 1.00 . A A . 26 SER H 1 1 35 21518 1 1 26 SER HA H 13.594 -8.725 -5.840 1.00 . A A . 26 SER HA 1 1 35 21519 1 1 26 SER HB2 H 15.890 -8.072 -6.013 1.00 . A A . 26 SER HB2 1 1 35 21520 1 1 26 SER HB3 H 16.134 -8.247 -4.275 1.00 . A A . 26 SER HB3 1 1 35 21521 1 1 26 SER HG H 16.860 -10.135 -4.938 1.00 . A A . 26 SER HG 1 1 35 21522 1 1 26 SER N N 13.757 -7.161 -4.505 1.00 . A A . 26 SER N 1 1 35 21523 1 1 26 SER O O 13.169 -10.614 -4.204 1.00 . A A . 26 SER O 1 1 35 21524 1 1 26 SER OG O 15.994 -9.989 -5.327 1.00 . A A . 26 SER OG 1 1 35 21525 1 1 27 VAL C C 12.330 -9.413 -0.649 1.00 . A A . 27 VAL C 1 1 35 21526 1 1 27 VAL CA C 13.423 -10.051 -1.501 1.00 . A A . 27 VAL CA 1 1 35 21527 1 1 27 VAL CB C 14.628 -10.398 -0.605 1.00 . A A . 27 VAL CB 1 1 35 21528 1 1 27 VAL CG1 C 15.207 -9.141 0.029 1.00 . A A . 27 VAL CG1 1 1 35 21529 1 1 27 VAL CG2 C 14.230 -11.407 0.462 1.00 . A A . 27 VAL CG2 1 1 35 21530 1 1 27 VAL H H 14.204 -8.300 -2.398 1.00 . A A . 27 VAL H 1 1 35 21531 1 1 27 VAL HA H 13.042 -10.967 -1.926 1.00 . A A . 27 VAL HA 1 1 35 21532 1 1 27 VAL HB H 15.393 -10.844 -1.224 1.00 . A A . 27 VAL HB 1 1 35 21533 1 1 27 VAL HG11 H 15.406 -8.410 -0.740 1.00 . A A . 27 VAL HG11 1 1 35 21534 1 1 27 VAL HG12 H 14.499 -8.736 0.736 1.00 . A A . 27 VAL HG12 1 1 35 21535 1 1 27 VAL HG13 H 16.127 -9.386 0.539 1.00 . A A . 27 VAL HG13 1 1 35 21536 1 1 27 VAL HG21 H 13.369 -11.966 0.126 1.00 . A A . 27 VAL HG21 1 1 35 21537 1 1 27 VAL HG22 H 15.052 -12.086 0.640 1.00 . A A . 27 VAL HG22 1 1 35 21538 1 1 27 VAL HG23 H 13.988 -10.888 1.377 1.00 . A A . 27 VAL HG23 1 1 35 21539 1 1 27 VAL N N 13.813 -9.174 -2.599 1.00 . A A . 27 VAL N 1 1 35 21540 1 1 27 VAL O O 11.422 -10.095 -0.173 1.00 . A A . 27 VAL O 1 1 35 21541 1 1 28 SER C C 10.057 -7.465 -0.290 1.00 . A A . 28 SER C 1 1 35 21542 1 1 28 SER CA C 11.445 -7.371 0.334 1.00 . A A . 28 SER CA 1 1 35 21543 1 1 28 SER CB C 11.859 -5.904 0.467 1.00 . A A . 28 SER CB 1 1 35 21544 1 1 28 SER H H 13.171 -7.615 -0.866 1.00 . A A . 28 SER H 1 1 35 21545 1 1 28 SER HA H 11.416 -7.817 1.317 1.00 . A A . 28 SER HA 1 1 35 21546 1 1 28 SER HB2 H 12.407 -5.605 -0.414 1.00 . A A . 28 SER HB2 1 1 35 21547 1 1 28 SER HB3 H 10.975 -5.291 0.567 1.00 . A A . 28 SER HB3 1 1 35 21548 1 1 28 SER HG H 12.311 -6.178 2.354 1.00 . A A . 28 SER HG 1 1 35 21549 1 1 28 SER N N 12.425 -8.102 -0.461 1.00 . A A . 28 SER N 1 1 35 21550 1 1 28 SER O O 9.921 -7.685 -1.494 1.00 . A A . 28 SER O 1 1 35 21551 1 1 28 SER OG O 12.682 -5.707 1.604 1.00 . A A . 28 SER OG 1 1 35 21552 1 1 29 SER C C 6.688 -6.835 1.123 1.00 . A A . 29 SER C 1 1 35 21553 1 1 29 SER CA C 7.651 -7.362 0.064 1.00 . A A . 29 SER CA 1 1 35 21554 1 1 29 SER CB C 7.284 -8.801 -0.304 1.00 . A A . 29 SER CB 1 1 35 21555 1 1 29 SER H H 9.202 -7.124 1.484 1.00 . A A . 29 SER H 1 1 35 21556 1 1 29 SER HA H 7.572 -6.743 -0.817 1.00 . A A . 29 SER HA 1 1 35 21557 1 1 29 SER HB2 H 6.212 -8.922 -0.252 1.00 . A A . 29 SER HB2 1 1 35 21558 1 1 29 SER HB3 H 7.621 -9.010 -1.309 1.00 . A A . 29 SER HB3 1 1 35 21559 1 1 29 SER HG H 7.651 -9.506 1.486 1.00 . A A . 29 SER HG 1 1 35 21560 1 1 29 SER N N 9.029 -7.296 0.535 1.00 . A A . 29 SER N 1 1 35 21561 1 1 29 SER O O 6.494 -7.459 2.166 1.00 . A A . 29 SER O 1 1 35 21562 1 1 29 SER OG O 7.890 -9.725 0.583 1.00 . A A . 29 SER OG 1 1 35 21563 1 1 30 HIS C C 3.771 -4.915 1.134 1.00 . A A . 30 HIS C 1 1 35 21564 1 1 30 HIS CA C 5.145 -5.069 1.777 1.00 . A A . 30 HIS CA 1 1 35 21565 1 1 30 HIS CB C 5.662 -3.704 2.235 1.00 . A A . 30 HIS CB 1 1 35 21566 1 1 30 HIS CD2 C 8.250 -3.802 2.088 1.00 . A A . 30 HIS CD2 1 1 35 21567 1 1 30 HIS CE1 C 8.695 -3.749 4.234 1.00 . A A . 30 HIS CE1 1 1 35 21568 1 1 30 HIS CG C 7.069 -3.738 2.747 1.00 . A A . 30 HIS CG 1 1 35 21569 1 1 30 HIS H H 6.284 -5.231 0.000 1.00 . A A . 30 HIS H 1 1 35 21570 1 1 30 HIS HA H 5.057 -5.718 2.636 1.00 . A A . 30 HIS HA 1 1 35 21571 1 1 30 HIS HB2 H 5.628 -3.016 1.404 1.00 . A A . 30 HIS HB2 1 1 35 21572 1 1 30 HIS HB3 H 5.028 -3.335 3.028 1.00 . A A . 30 HIS HB3 1 1 35 21573 1 1 30 HIS HD1 H 6.739 -3.660 4.827 1.00 . A A . 30 HIS HD1 1 1 35 21574 1 1 30 HIS HD2 H 8.385 -3.841 1.016 1.00 . A A . 30 HIS HD2 1 1 35 21575 1 1 30 HIS HE1 H 9.228 -3.739 5.173 1.00 . A A . 30 HIS HE1 1 1 35 21576 1 1 30 HIS HE2 H 10.206 -3.763 2.851 1.00 . A A . 30 HIS HE2 1 1 35 21577 1 1 30 HIS N N 6.088 -5.681 0.848 1.00 . A A . 30 HIS N 1 1 35 21578 1 1 30 HIS ND1 N 7.383 -3.707 4.090 1.00 . A A . 30 HIS ND1 1 1 35 21579 1 1 30 HIS NE2 N 9.244 -3.808 3.035 1.00 . A A . 30 HIS NE2 1 1 35 21580 1 1 30 HIS O O 3.512 -3.944 0.422 1.00 . A A . 30 HIS O 1 1 35 21581 1 1 31 TYR C C 0.685 -4.809 1.547 1.00 . A A . 31 TYR C 1 1 35 21582 1 1 31 TYR CA C 1.543 -5.851 0.836 1.00 . A A . 31 TYR CA 1 1 35 21583 1 1 31 TYR CB C 0.893 -7.230 0.953 1.00 . A A . 31 TYR CB 1 1 35 21584 1 1 31 TYR CD1 C 2.126 -9.432 1.019 1.00 . A A . 31 TYR CD1 1 1 35 21585 1 1 31 TYR CD2 C 1.998 -8.276 -1.062 1.00 . A A . 31 TYR CD2 1 1 35 21586 1 1 31 TYR CE1 C 2.853 -10.442 0.417 1.00 . A A . 31 TYR CE1 1 1 35 21587 1 1 31 TYR CE2 C 2.724 -9.282 -1.671 1.00 . A A . 31 TYR CE2 1 1 35 21588 1 1 31 TYR CG C 1.687 -8.333 0.291 1.00 . A A . 31 TYR CG 1 1 35 21589 1 1 31 TYR CZ C 3.149 -10.363 -0.927 1.00 . A A . 31 TYR CZ 1 1 35 21590 1 1 31 TYR H H 3.157 -6.627 1.964 1.00 . A A . 31 TYR H 1 1 35 21591 1 1 31 TYR HA H 1.619 -5.586 -0.208 1.00 . A A . 31 TYR HA 1 1 35 21592 1 1 31 TYR HB2 H 0.784 -7.482 1.997 1.00 . A A . 31 TYR HB2 1 1 35 21593 1 1 31 TYR HB3 H -0.083 -7.200 0.491 1.00 . A A . 31 TYR HB3 1 1 35 21594 1 1 31 TYR HD1 H 1.892 -9.492 2.071 1.00 . A A . 31 TYR HD1 1 1 35 21595 1 1 31 TYR HD2 H 1.665 -7.428 -1.641 1.00 . A A . 31 TYR HD2 1 1 35 21596 1 1 31 TYR HE1 H 3.185 -11.289 1.000 1.00 . A A . 31 TYR HE1 1 1 35 21597 1 1 31 TYR HE2 H 2.955 -9.219 -2.724 1.00 . A A . 31 TYR HE2 1 1 35 21598 1 1 31 TYR HH H 4.756 -11.050 -1.727 1.00 . A A . 31 TYR HH 1 1 35 21599 1 1 31 TYR N N 2.892 -5.879 1.390 1.00 . A A . 31 TYR N 1 1 35 21600 1 1 31 TYR O O 0.938 -4.465 2.701 1.00 . A A . 31 TYR O 1 1 35 21601 1 1 31 TYR OH O 3.871 -11.366 -1.530 1.00 . A A . 31 TYR OH 1 1 35 21602 1 1 32 CYS C C -2.176 -3.940 2.426 1.00 . A A . 32 CYS C 1 1 35 21603 1 1 32 CYS CA C -1.226 -3.309 1.414 1.00 . A A . 32 CYS CA 1 1 35 21604 1 1 32 CYS CB C -2.027 -2.627 0.303 1.00 . A A . 32 CYS CB 1 1 35 21605 1 1 32 CYS H H -0.482 -4.625 -0.067 1.00 . A A . 32 CYS H 1 1 35 21606 1 1 32 CYS HA H -0.622 -2.569 1.917 1.00 . A A . 32 CYS HA 1 1 35 21607 1 1 32 CYS HB2 H -2.359 -3.374 -0.402 1.00 . A A . 32 CYS HB2 1 1 35 21608 1 1 32 CYS HB3 H -2.888 -2.141 0.737 1.00 . A A . 32 CYS HB3 1 1 35 21609 1 1 32 CYS N N -0.330 -4.311 0.849 1.00 . A A . 32 CYS N 1 1 35 21610 1 1 32 CYS O O -2.574 -5.096 2.282 1.00 . A A . 32 CYS O 1 1 35 21611 1 1 32 CYS SG S -1.089 -1.370 -0.625 1.00 . A A . 32 CYS SG 1 1 35 21612 1 1 33 THR C C -4.893 -3.302 4.163 1.00 . A A . 33 THR C 1 1 35 21613 1 1 33 THR CA C -3.442 -3.658 4.484 1.00 . A A . 33 THR CA 1 1 35 21614 1 1 33 THR CB C -3.051 -3.075 5.843 1.00 . A A . 33 THR CB 1 1 35 21615 1 1 33 THR CG2 C -1.783 -3.676 6.408 1.00 . A A . 33 THR CG2 1 1 35 21616 1 1 33 THR H H -2.187 -2.260 3.509 1.00 . A A . 33 THR H 1 1 35 21617 1 1 33 THR HA H -3.350 -4.733 4.526 1.00 . A A . 33 THR HA 1 1 35 21618 1 1 33 THR HB H -3.849 -3.264 6.547 1.00 . A A . 33 THR HB 1 1 35 21619 1 1 33 THR HG1 H -3.567 -1.287 5.232 1.00 . A A . 33 THR HG1 1 1 35 21620 1 1 33 THR HG21 H -1.463 -4.495 5.781 1.00 . A A . 33 THR HG21 1 1 35 21621 1 1 33 THR HG22 H -1.010 -2.923 6.438 1.00 . A A . 33 THR HG22 1 1 35 21622 1 1 33 THR HG23 H -1.971 -4.040 7.408 1.00 . A A . 33 THR HG23 1 1 35 21623 1 1 33 THR N N -2.537 -3.173 3.449 1.00 . A A . 33 THR N 1 1 35 21624 1 1 33 THR O O -5.788 -3.522 4.979 1.00 . A A . 33 THR O 1 1 35 21625 1 1 33 THR OG1 O -2.859 -1.674 5.752 1.00 . A A . 33 THR OG1 1 1 35 21626 1 1 34 GLY C C -7.170 -1.515 3.599 1.00 . A A . 34 GLY C 1 1 35 21627 1 1 34 GLY CA C -6.469 -2.382 2.570 1.00 . A A . 34 GLY CA 1 1 35 21628 1 1 34 GLY H H -4.374 -2.602 2.357 1.00 . A A . 34 GLY H 1 1 35 21629 1 1 34 GLY HA2 H -7.048 -3.281 2.420 1.00 . A A . 34 GLY HA2 1 1 35 21630 1 1 34 GLY HA3 H -6.417 -1.841 1.637 1.00 . A A . 34 GLY HA3 1 1 35 21631 1 1 34 GLY N N -5.123 -2.754 2.971 1.00 . A A . 34 GLY N 1 1 35 21632 1 1 34 GLY O O -8.397 -1.527 3.697 1.00 . A A . 34 GLY O 1 1 35 21633 1 1 35 ARG C C -6.261 1.474 5.390 1.00 . A A . 35 ARG C 1 1 35 21634 1 1 35 ARG CA C -6.949 0.114 5.394 1.00 . A A . 35 ARG CA 1 1 35 21635 1 1 35 ARG CB C -6.817 -0.533 6.774 1.00 . A A . 35 ARG CB 1 1 35 21636 1 1 35 ARG CD C -5.373 -1.783 8.407 1.00 . A A . 35 ARG CD 1 1 35 21637 1 1 35 ARG CG C -5.432 -1.090 7.055 1.00 . A A . 35 ARG CG 1 1 35 21638 1 1 35 ARG CZ C -6.381 -3.733 9.528 1.00 . A A . 35 ARG CZ 1 1 35 21639 1 1 35 ARG H H -5.420 -0.794 4.244 1.00 . A A . 35 ARG H 1 1 35 21640 1 1 35 ARG HA H -7.994 0.256 5.173 1.00 . A A . 35 ARG HA 1 1 35 21641 1 1 35 ARG HB2 H -7.045 0.205 7.529 1.00 . A A . 35 ARG HB2 1 1 35 21642 1 1 35 ARG HB3 H -7.529 -1.343 6.849 1.00 . A A . 35 ARG HB3 1 1 35 21643 1 1 35 ARG HD2 H -4.347 -2.043 8.620 1.00 . A A . 35 ARG HD2 1 1 35 21644 1 1 35 ARG HD3 H -5.735 -1.101 9.162 1.00 . A A . 35 ARG HD3 1 1 35 21645 1 1 35 ARG HE H -6.607 -3.280 7.597 1.00 . A A . 35 ARG HE 1 1 35 21646 1 1 35 ARG HG2 H -5.178 -1.804 6.286 1.00 . A A . 35 ARG HG2 1 1 35 21647 1 1 35 ARG HG3 H -4.719 -0.278 7.045 1.00 . A A . 35 ARG HG3 1 1 35 21648 1 1 35 ARG HH11 H -5.257 -2.560 10.734 1.00 . A A . 35 ARG HH11 1 1 35 21649 1 1 35 ARG HH12 H -5.977 -3.938 11.498 1.00 . A A . 35 ARG HH12 1 1 35 21650 1 1 35 ARG HH21 H -7.554 -5.092 8.600 1.00 . A A . 35 ARG HH21 1 1 35 21651 1 1 35 ARG HH22 H -7.280 -5.376 10.287 1.00 . A A . 35 ARG HH22 1 1 35 21652 1 1 35 ARG N N -6.391 -0.761 4.368 1.00 . A A . 35 ARG N 1 1 35 21653 1 1 35 ARG NE N -6.185 -2.997 8.436 1.00 . A A . 35 ARG NE 1 1 35 21654 1 1 35 ARG NH1 N -5.826 -3.381 10.681 1.00 . A A . 35 ARG NH1 1 1 35 21655 1 1 35 ARG NH2 N -7.133 -4.823 9.467 1.00 . A A . 35 ARG NH2 1 1 35 21656 1 1 35 ARG O O -6.916 2.514 5.454 1.00 . A A . 35 ARG O 1 1 35 21657 1 1 36 SER C C -3.270 2.760 4.063 1.00 . A A . 36 SER C 1 1 35 21658 1 1 36 SER CA C -4.154 2.688 5.304 1.00 . A A . 36 SER CA 1 1 35 21659 1 1 36 SER CB C -3.292 2.780 6.564 1.00 . A A . 36 SER CB 1 1 35 21660 1 1 36 SER H H -4.474 0.596 5.268 1.00 . A A . 36 SER H 1 1 35 21661 1 1 36 SER HA H -4.843 3.519 5.289 1.00 . A A . 36 SER HA 1 1 35 21662 1 1 36 SER HB2 H -3.057 1.785 6.911 1.00 . A A . 36 SER HB2 1 1 35 21663 1 1 36 SER HB3 H -2.377 3.306 6.334 1.00 . A A . 36 SER HB3 1 1 35 21664 1 1 36 SER HG H -3.770 4.412 7.538 1.00 . A A . 36 SER HG 1 1 35 21665 1 1 36 SER N N -4.936 1.457 5.315 1.00 . A A . 36 SER N 1 1 35 21666 1 1 36 SER O O -2.697 1.757 3.637 1.00 . A A . 36 SER O 1 1 35 21667 1 1 36 SER OG O -3.970 3.475 7.597 1.00 . A A . 36 SER OG 1 1 35 21668 1 1 37 CYS C C -0.859 4.193 2.643 1.00 . A A . 37 CYS C 1 1 35 21669 1 1 37 CYS CA C -2.346 4.157 2.296 1.00 . A A . 37 CYS CA 1 1 35 21670 1 1 37 CYS CB C -2.748 5.454 1.592 1.00 . A A . 37 CYS CB 1 1 35 21671 1 1 37 CYS H H -3.642 4.716 3.874 1.00 . A A . 37 CYS H 1 1 35 21672 1 1 37 CYS HA H -2.527 3.327 1.629 1.00 . A A . 37 CYS HA 1 1 35 21673 1 1 37 CYS HB2 H -3.824 5.492 1.509 1.00 . A A . 37 CYS HB2 1 1 35 21674 1 1 37 CYS HB3 H -2.407 6.294 2.178 1.00 . A A . 37 CYS HB3 1 1 35 21675 1 1 37 CYS N N -3.163 3.954 3.488 1.00 . A A . 37 CYS N 1 1 35 21676 1 1 37 CYS O O -0.006 4.112 1.759 1.00 . A A . 37 CYS O 1 1 35 21677 1 1 37 CYS SG S -2.059 5.631 -0.086 1.00 . A A . 37 CYS SG 1 1 35 21678 1 1 38 GLU C C 1.400 2.953 4.541 1.00 . A A . 38 GLU C 1 1 35 21679 1 1 38 GLU CA C 0.835 4.361 4.384 1.00 . A A . 38 GLU CA 1 1 35 21680 1 1 38 GLU CB C 0.936 5.115 5.711 1.00 . A A . 38 GLU CB 1 1 35 21681 1 1 38 GLU CD C 0.556 7.309 6.904 1.00 . A A . 38 GLU CD 1 1 35 21682 1 1 38 GLU CG C 0.767 6.619 5.570 1.00 . A A . 38 GLU CG 1 1 35 21683 1 1 38 GLU H H -1.270 4.377 4.594 1.00 . A A . 38 GLU H 1 1 35 21684 1 1 38 GLU HA H 1.410 4.886 3.636 1.00 . A A . 38 GLU HA 1 1 35 21685 1 1 38 GLU HB2 H 0.171 4.749 6.379 1.00 . A A . 38 GLU HB2 1 1 35 21686 1 1 38 GLU HB3 H 1.905 4.923 6.147 1.00 . A A . 38 GLU HB3 1 1 35 21687 1 1 38 GLU HG2 H 1.653 7.027 5.108 1.00 . A A . 38 GLU HG2 1 1 35 21688 1 1 38 GLU HG3 H -0.089 6.814 4.941 1.00 . A A . 38 GLU HG3 1 1 35 21689 1 1 38 GLU N N -0.551 4.316 3.932 1.00 . A A . 38 GLU N 1 1 35 21690 1 1 38 GLU O O 1.113 2.264 5.519 1.00 . A A . 38 GLU O 1 1 35 21691 1 1 38 GLU OE1 O -0.316 8.200 6.980 1.00 . A A . 38 GLU OE1 1 1 35 21692 1 1 38 GLU OE2 O 1.263 6.958 7.872 1.00 . A A . 38 GLU OE2 1 1 35 21693 1 1 39 CYS C C 3.657 1.020 4.859 1.00 . A A . 39 CYS C 1 1 35 21694 1 1 39 CYS CA C 2.810 1.205 3.601 1.00 . A A . 39 CYS CA 1 1 35 21695 1 1 39 CYS CB C 3.669 0.985 2.353 1.00 . A A . 39 CYS CB 1 1 35 21696 1 1 39 CYS H H 2.396 3.127 2.815 1.00 . A A . 39 CYS H 1 1 35 21697 1 1 39 CYS HA H 2.012 0.478 3.609 1.00 . A A . 39 CYS HA 1 1 35 21698 1 1 39 CYS HB2 H 3.763 1.919 1.820 1.00 . A A . 39 CYS HB2 1 1 35 21699 1 1 39 CYS HB3 H 4.651 0.647 2.652 1.00 . A A . 39 CYS HB3 1 1 35 21700 1 1 39 CYS N N 2.205 2.531 3.570 1.00 . A A . 39 CYS N 1 1 35 21701 1 1 39 CYS O O 4.238 1.976 5.372 1.00 . A A . 39 CYS O 1 1 35 21702 1 1 39 CYS SG S 2.990 -0.246 1.192 1.00 . A A . 39 CYS SG 1 1 35 21703 1 1 40 PRO C C 6.020 -0.437 6.332 1.00 . A A . 40 PRO C 1 1 35 21704 1 1 40 PRO CA C 4.517 -0.525 6.578 1.00 . A A . 40 PRO CA 1 1 35 21705 1 1 40 PRO CB C 4.112 -1.963 6.908 1.00 . A A . 40 PRO CB 1 1 35 21706 1 1 40 PRO CD C 3.075 -1.418 4.825 1.00 . A A . 40 PRO CD 1 1 35 21707 1 1 40 PRO CG C 3.692 -2.546 5.604 1.00 . A A . 40 PRO CG 1 1 35 21708 1 1 40 PRO HA H 4.250 0.126 7.398 1.00 . A A . 40 PRO HA 1 1 35 21709 1 1 40 PRO HB2 H 4.958 -2.491 7.325 1.00 . A A . 40 PRO HB2 1 1 35 21710 1 1 40 PRO HB3 H 3.299 -1.957 7.618 1.00 . A A . 40 PRO HB3 1 1 35 21711 1 1 40 PRO HD2 H 3.287 -1.527 3.771 1.00 . A A . 40 PRO HD2 1 1 35 21712 1 1 40 PRO HD3 H 2.009 -1.381 4.994 1.00 . A A . 40 PRO HD3 1 1 35 21713 1 1 40 PRO HG2 H 4.554 -2.936 5.082 1.00 . A A . 40 PRO HG2 1 1 35 21714 1 1 40 PRO HG3 H 2.966 -3.329 5.769 1.00 . A A . 40 PRO HG3 1 1 35 21715 1 1 40 PRO N N 3.737 -0.219 5.374 1.00 . A A . 40 PRO N 1 1 35 21716 1 1 40 PRO O O 6.462 -0.184 5.211 1.00 . A A . 40 PRO O 1 1 35 21717 1 1 41 SER C C 8.855 -1.995 7.324 1.00 . A A . 41 SER C 1 1 35 21718 1 1 41 SER CA C 8.253 -0.594 7.285 1.00 . A A . 41 SER CA 1 1 35 21719 1 1 41 SER CB C 8.833 0.254 8.419 1.00 . A A . 41 SER CB 1 1 35 21720 1 1 41 SER H H 6.388 -0.846 8.254 1.00 . A A . 41 SER H 1 1 35 21721 1 1 41 SER HA H 8.503 -0.134 6.341 1.00 . A A . 41 SER HA 1 1 35 21722 1 1 41 SER HB2 H 8.501 1.276 8.307 1.00 . A A . 41 SER HB2 1 1 35 21723 1 1 41 SER HB3 H 8.491 -0.134 9.367 1.00 . A A . 41 SER HB3 1 1 35 21724 1 1 41 SER HG H 10.583 1.123 8.278 1.00 . A A . 41 SER HG 1 1 35 21725 1 1 41 SER N N 6.800 -0.648 7.387 1.00 . A A . 41 SER N 1 1 35 21726 1 1 41 SER O O 9.896 -2.251 6.719 1.00 . A A . 41 SER O 1 1 35 21727 1 1 41 SER OG O 10.250 0.232 8.401 1.00 . A A . 41 SER OG 1 1 35 21728 1 1 42 TYR C C 8.182 -5.116 6.979 1.00 . A A . 42 TYR C 1 1 35 21729 1 1 42 TYR CA C 8.663 -4.273 8.158 1.00 . A A . 42 TYR CA 1 1 35 21730 1 1 42 TYR CB C 8.178 -4.890 9.472 1.00 . A A . 42 TYR CB 1 1 35 21731 1 1 42 TYR CD1 C 6.221 -3.646 10.471 1.00 . A A . 42 TYR CD1 1 1 35 21732 1 1 42 TYR CD2 C 5.773 -5.607 9.191 1.00 . A A . 42 TYR CD2 1 1 35 21733 1 1 42 TYR CE1 C 4.868 -3.479 10.697 1.00 . A A . 42 TYR CE1 1 1 35 21734 1 1 42 TYR CE2 C 4.419 -5.447 9.412 1.00 . A A . 42 TYR CE2 1 1 35 21735 1 1 42 TYR CG C 6.696 -4.711 9.716 1.00 . A A . 42 TYR CG 1 1 35 21736 1 1 42 TYR CZ C 3.971 -4.382 10.165 1.00 . A A . 42 TYR CZ 1 1 35 21737 1 1 42 TYR H H 7.370 -2.633 8.501 1.00 . A A . 42 TYR H 1 1 35 21738 1 1 42 TYR HA H 9.742 -4.256 8.156 1.00 . A A . 42 TYR HA 1 1 35 21739 1 1 42 TYR HB2 H 8.386 -5.949 9.462 1.00 . A A . 42 TYR HB2 1 1 35 21740 1 1 42 TYR HB3 H 8.708 -4.431 10.294 1.00 . A A . 42 TYR HB3 1 1 35 21741 1 1 42 TYR HD1 H 6.926 -2.941 10.886 1.00 . A A . 42 TYR HD1 1 1 35 21742 1 1 42 TYR HD2 H 6.127 -6.440 8.602 1.00 . A A . 42 TYR HD2 1 1 35 21743 1 1 42 TYR HE1 H 4.518 -2.645 11.286 1.00 . A A . 42 TYR HE1 1 1 35 21744 1 1 42 TYR HE2 H 3.717 -6.154 8.995 1.00 . A A . 42 TYR HE2 1 1 35 21745 1 1 42 TYR HH H 2.153 -4.261 9.551 1.00 . A A . 42 TYR HH 1 1 35 21746 1 1 42 TYR N N 8.193 -2.898 8.041 1.00 . A A . 42 TYR N 1 1 35 21747 1 1 42 TYR O O 7.120 -4.857 6.413 1.00 . A A . 42 TYR O 1 1 35 21748 1 1 42 TYR OH O 2.623 -4.219 10.387 1.00 . A A . 42 TYR OH 1 1 35 21749 1 1 43 PRO C C 7.205 -7.594 5.607 1.00 . A A . 43 PRO C 1 1 35 21750 1 1 43 PRO CA C 8.612 -7.022 5.474 1.00 . A A . 43 PRO CA 1 1 35 21751 1 1 43 PRO CB C 9.653 -8.139 5.561 1.00 . A A . 43 PRO CB 1 1 35 21752 1 1 43 PRO CD C 10.246 -6.518 7.213 1.00 . A A . 43 PRO CD 1 1 35 21753 1 1 43 PRO CG C 10.819 -7.518 6.248 1.00 . A A . 43 PRO CG 1 1 35 21754 1 1 43 PRO HA H 8.704 -6.513 4.526 1.00 . A A . 43 PRO HA 1 1 35 21755 1 1 43 PRO HB2 H 9.252 -8.965 6.130 1.00 . A A . 43 PRO HB2 1 1 35 21756 1 1 43 PRO HB3 H 9.913 -8.472 4.567 1.00 . A A . 43 PRO HB3 1 1 35 21757 1 1 43 PRO HD2 H 10.087 -6.974 8.179 1.00 . A A . 43 PRO HD2 1 1 35 21758 1 1 43 PRO HD3 H 10.898 -5.661 7.301 1.00 . A A . 43 PRO HD3 1 1 35 21759 1 1 43 PRO HG2 H 11.379 -8.274 6.779 1.00 . A A . 43 PRO HG2 1 1 35 21760 1 1 43 PRO HG3 H 11.450 -7.022 5.525 1.00 . A A . 43 PRO HG3 1 1 35 21761 1 1 43 PRO N N 8.963 -6.140 6.592 1.00 . A A . 43 PRO N 1 1 35 21762 1 1 43 PRO O O 6.481 -7.277 6.551 1.00 . A A . 43 PRO O 1 1 35 21763 1 1 44 GLY C C 5.448 -10.355 3.929 1.00 . A A . 44 GLY C 1 1 35 21764 1 1 44 GLY CA C 5.503 -9.041 4.683 1.00 . A A . 44 GLY CA 1 1 35 21765 1 1 44 GLY H H 7.441 -8.653 3.925 1.00 . A A . 44 GLY H 1 1 35 21766 1 1 44 GLY HA2 H 4.796 -8.355 4.240 1.00 . A A . 44 GLY HA2 1 1 35 21767 1 1 44 GLY HA3 H 5.222 -9.216 5.711 1.00 . A A . 44 GLY HA3 1 1 35 21768 1 1 44 GLY N N 6.822 -8.438 4.654 1.00 . A A . 44 GLY N 1 1 35 21769 1 1 44 GLY O O 4.333 -10.884 3.739 1.00 . A A . 44 GLY O 1 1 35 21770 1 1 44 GLY OXT O 6.520 -10.854 3.528 1.00 . A A . 44 GLY OXT 1 1 36 21771 1 1 1 ALA C C -13.318 15.569 -1.653 1.00 . A A . 1 ALA C 1 1 36 21772 1 1 1 ALA CA C -14.667 15.005 -2.083 1.00 . A A . 1 ALA CA 1 1 36 21773 1 1 1 ALA CB C -14.504 14.133 -3.319 1.00 . A A . 1 ALA CB 1 1 36 21774 1 1 1 ALA H1 H -15.157 16.825 -2.907 1.00 . A A . 1 ALA H1 1 1 36 21775 1 1 1 ALA H2 H -16.439 15.688 -2.874 1.00 . A A . 1 ALA H2 1 1 36 21776 1 1 1 ALA H3 H -15.952 16.472 -1.427 1.00 . A A . 1 ALA H3 1 1 36 21777 1 1 1 ALA HA H -15.056 14.387 -1.286 1.00 . A A . 1 ALA HA 1 1 36 21778 1 1 1 ALA HB1 H -15.395 13.539 -3.460 1.00 . A A . 1 ALA HB1 1 1 36 21779 1 1 1 ALA HB2 H -14.349 14.761 -4.184 1.00 . A A . 1 ALA HB2 1 1 36 21780 1 1 1 ALA HB3 H -13.654 13.481 -3.189 1.00 . A A . 1 ALA HB3 1 1 36 21781 1 1 1 ALA N N -15.641 16.096 -2.347 1.00 . A A . 1 ALA N 1 1 36 21782 1 1 1 ALA O O -12.509 15.975 -2.487 1.00 . A A . 1 ALA O 1 1 36 21783 1 1 2 MET C C -10.875 14.967 0.539 1.00 . A A . 2 MET C 1 1 36 21784 1 1 2 MET CA C -11.828 16.107 0.196 1.00 . A A . 2 MET CA 1 1 36 21785 1 1 2 MET CB C -12.097 16.954 1.441 1.00 . A A . 2 MET CB 1 1 36 21786 1 1 2 MET CE C -11.959 20.759 1.193 1.00 . A A . 2 MET CE 1 1 36 21787 1 1 2 MET CG C -11.153 18.137 1.587 1.00 . A A . 2 MET CG 1 1 36 21788 1 1 2 MET H H -13.765 15.255 0.271 1.00 . A A . 2 MET H 1 1 36 21789 1 1 2 MET HA H -11.371 16.728 -0.559 1.00 . A A . 2 MET HA 1 1 36 21790 1 1 2 MET HB2 H -13.107 17.332 1.395 1.00 . A A . 2 MET HB2 1 1 36 21791 1 1 2 MET HB3 H -11.995 16.330 2.316 1.00 . A A . 2 MET HB3 1 1 36 21792 1 1 2 MET HE1 H -12.171 20.459 2.209 1.00 . A A . 2 MET HE1 1 1 36 21793 1 1 2 MET HE2 H -11.210 21.537 1.197 1.00 . A A . 2 MET HE2 1 1 36 21794 1 1 2 MET HE3 H -12.862 21.130 0.732 1.00 . A A . 2 MET HE3 1 1 36 21795 1 1 2 MET HG2 H -11.346 18.620 2.533 1.00 . A A . 2 MET HG2 1 1 36 21796 1 1 2 MET HG3 H -10.136 17.773 1.571 1.00 . A A . 2 MET HG3 1 1 36 21797 1 1 2 MET N N -13.081 15.592 -0.345 1.00 . A A . 2 MET N 1 1 36 21798 1 1 2 MET O O -11.305 13.863 0.872 1.00 . A A . 2 MET O 1 1 36 21799 1 1 2 MET SD S -11.352 19.351 0.268 1.00 . A A . 2 MET SD 1 1 36 21800 1 1 3 ASP C C -8.688 13.040 -0.179 1.00 . A A . 3 ASP C 1 1 36 21801 1 1 3 ASP CA C -8.562 14.239 0.755 1.00 . A A . 3 ASP CA 1 1 36 21802 1 1 3 ASP CB C -8.683 13.782 2.210 1.00 . A A . 3 ASP CB 1 1 36 21803 1 1 3 ASP CG C -8.781 14.946 3.176 1.00 . A A . 3 ASP CG 1 1 36 21804 1 1 3 ASP H H -9.296 16.141 0.183 1.00 . A A . 3 ASP H 1 1 36 21805 1 1 3 ASP HA H -7.594 14.694 0.610 1.00 . A A . 3 ASP HA 1 1 36 21806 1 1 3 ASP HB2 H -9.569 13.174 2.318 1.00 . A A . 3 ASP HB2 1 1 36 21807 1 1 3 ASP HB3 H -7.815 13.194 2.470 1.00 . A A . 3 ASP HB3 1 1 36 21808 1 1 3 ASP N N -9.577 15.242 0.454 1.00 . A A . 3 ASP N 1 1 36 21809 1 1 3 ASP O O -9.747 12.799 -0.757 1.00 . A A . 3 ASP O 1 1 36 21810 1 1 3 ASP OD1 O -9.885 15.183 3.711 1.00 . A A . 3 ASP OD1 1 1 36 21811 1 1 3 ASP OD2 O -7.754 15.621 3.399 1.00 . A A . 3 ASP OD2 1 1 36 21812 1 1 4 CYS C C -6.471 10.158 -0.785 1.00 . A A . 4 CYS C 1 1 36 21813 1 1 4 CYS CA C -7.587 11.117 -1.187 1.00 . A A . 4 CYS CA 1 1 36 21814 1 1 4 CYS CB C -7.418 11.537 -2.649 1.00 . A A . 4 CYS CB 1 1 36 21815 1 1 4 CYS H H -6.784 12.535 0.165 1.00 . A A . 4 CYS H 1 1 36 21816 1 1 4 CYS HA H -8.535 10.614 -1.074 1.00 . A A . 4 CYS HA 1 1 36 21817 1 1 4 CYS HB2 H -7.260 12.604 -2.694 1.00 . A A . 4 CYS HB2 1 1 36 21818 1 1 4 CYS HB3 H -6.556 11.034 -3.065 1.00 . A A . 4 CYS HB3 1 1 36 21819 1 1 4 CYS N N -7.599 12.292 -0.322 1.00 . A A . 4 CYS N 1 1 36 21820 1 1 4 CYS O O -5.301 10.537 -0.735 1.00 . A A . 4 CYS O 1 1 36 21821 1 1 4 CYS SG S -8.850 11.146 -3.706 1.00 . A A . 4 CYS SG 1 1 36 21822 1 1 5 THR C C -4.842 7.677 -1.214 1.00 . A A . 5 THR C 1 1 36 21823 1 1 5 THR CA C -5.870 7.898 -0.110 1.00 . A A . 5 THR CA 1 1 36 21824 1 1 5 THR CB C -6.581 6.582 0.216 1.00 . A A . 5 THR CB 1 1 36 21825 1 1 5 THR CG2 C -6.746 6.345 1.702 1.00 . A A . 5 THR CG2 1 1 36 21826 1 1 5 THR H H -7.788 8.671 -0.564 1.00 . A A . 5 THR H 1 1 36 21827 1 1 5 THR HA H -5.361 8.251 0.775 1.00 . A A . 5 THR HA 1 1 36 21828 1 1 5 THR HB H -6.004 5.762 -0.187 1.00 . A A . 5 THR HB 1 1 36 21829 1 1 5 THR HG1 H -8.258 5.680 -0.241 1.00 . A A . 5 THR HG1 1 1 36 21830 1 1 5 THR HG21 H -6.325 7.176 2.248 1.00 . A A . 5 THR HG21 1 1 36 21831 1 1 5 THR HG22 H -7.796 6.254 1.937 1.00 . A A . 5 THR HG22 1 1 36 21832 1 1 5 THR HG23 H -6.235 5.435 1.980 1.00 . A A . 5 THR HG23 1 1 36 21833 1 1 5 THR N N -6.841 8.913 -0.504 1.00 . A A . 5 THR N 1 1 36 21834 1 1 5 THR O O -5.148 7.093 -2.254 1.00 . A A . 5 THR O 1 1 36 21835 1 1 5 THR OG1 O -7.870 6.549 -0.369 1.00 . A A . 5 THR OG1 1 1 36 21836 1 1 6 THR C C -1.391 7.198 -1.379 1.00 . A A . 6 THR C 1 1 36 21837 1 1 6 THR CA C -2.548 8.005 -1.959 1.00 . A A . 6 THR CA 1 1 36 21838 1 1 6 THR CB C -2.051 9.379 -2.410 1.00 . A A . 6 THR CB 1 1 36 21839 1 1 6 THR CG2 C -1.673 9.428 -3.875 1.00 . A A . 6 THR CG2 1 1 36 21840 1 1 6 THR H H -3.438 8.607 -0.136 1.00 . A A . 6 THR H 1 1 36 21841 1 1 6 THR HA H -2.945 7.478 -2.813 1.00 . A A . 6 THR HA 1 1 36 21842 1 1 6 THR HB H -1.175 9.641 -1.834 1.00 . A A . 6 THR HB 1 1 36 21843 1 1 6 THR HG1 H -2.650 11.115 -1.729 1.00 . A A . 6 THR HG1 1 1 36 21844 1 1 6 THR HG21 H -2.431 8.925 -4.459 1.00 . A A . 6 THR HG21 1 1 36 21845 1 1 6 THR HG22 H -1.597 10.457 -4.193 1.00 . A A . 6 THR HG22 1 1 36 21846 1 1 6 THR HG23 H -0.723 8.936 -4.018 1.00 . A A . 6 THR HG23 1 1 36 21847 1 1 6 THR N N -3.621 8.150 -0.983 1.00 . A A . 6 THR N 1 1 36 21848 1 1 6 THR O O -1.373 6.885 -0.189 1.00 . A A . 6 THR O 1 1 36 21849 1 1 6 THR OG1 O -3.041 10.368 -2.189 1.00 . A A . 6 THR OG1 1 1 36 21850 1 1 7 GLY C C 0.807 4.737 -2.454 1.00 . A A . 7 GLY C 1 1 36 21851 1 1 7 GLY CA C 0.723 6.096 -1.784 1.00 . A A . 7 GLY CA 1 1 36 21852 1 1 7 GLY H H -0.493 7.141 -3.167 1.00 . A A . 7 GLY H 1 1 36 21853 1 1 7 GLY HA2 H 0.656 5.954 -0.716 1.00 . A A . 7 GLY HA2 1 1 36 21854 1 1 7 GLY HA3 H 1.622 6.651 -2.008 1.00 . A A . 7 GLY HA3 1 1 36 21855 1 1 7 GLY N N -0.425 6.864 -2.230 1.00 . A A . 7 GLY N 1 1 36 21856 1 1 7 GLY O O -0.163 4.281 -3.060 1.00 . A A . 7 GLY O 1 1 36 21857 1 1 8 PRO C C 1.075 1.746 -2.557 1.00 . A A . 8 PRO C 1 1 36 21858 1 1 8 PRO CA C 2.157 2.739 -2.970 1.00 . A A . 8 PRO CA 1 1 36 21859 1 1 8 PRO CB C 3.521 2.295 -2.435 1.00 . A A . 8 PRO CB 1 1 36 21860 1 1 8 PRO CD C 3.172 4.528 -1.658 1.00 . A A . 8 PRO CD 1 1 36 21861 1 1 8 PRO CG C 4.232 3.561 -2.107 1.00 . A A . 8 PRO CG 1 1 36 21862 1 1 8 PRO HA H 2.193 2.802 -4.047 1.00 . A A . 8 PRO HA 1 1 36 21863 1 1 8 PRO HB2 H 3.383 1.679 -1.558 1.00 . A A . 8 PRO HB2 1 1 36 21864 1 1 8 PRO HB3 H 4.044 1.735 -3.196 1.00 . A A . 8 PRO HB3 1 1 36 21865 1 1 8 PRO HD2 H 3.041 4.473 -0.587 1.00 . A A . 8 PRO HD2 1 1 36 21866 1 1 8 PRO HD3 H 3.427 5.533 -1.958 1.00 . A A . 8 PRO HD3 1 1 36 21867 1 1 8 PRO HG2 H 4.943 3.388 -1.312 1.00 . A A . 8 PRO HG2 1 1 36 21868 1 1 8 PRO HG3 H 4.735 3.938 -2.985 1.00 . A A . 8 PRO HG3 1 1 36 21869 1 1 8 PRO N N 1.964 4.060 -2.362 1.00 . A A . 8 PRO N 1 1 36 21870 1 1 8 PRO O O 0.790 0.790 -3.277 1.00 . A A . 8 PRO O 1 1 36 21871 1 1 9 CYS C C -1.940 1.773 -0.974 1.00 . A A . 9 CYS C 1 1 36 21872 1 1 9 CYS CA C -0.572 1.102 -0.885 1.00 . A A . 9 CYS CA 1 1 36 21873 1 1 9 CYS CB C -0.279 0.713 0.565 1.00 . A A . 9 CYS CB 1 1 36 21874 1 1 9 CYS H H 0.749 2.756 -0.862 1.00 . A A . 9 CYS H 1 1 36 21875 1 1 9 CYS HA H -0.582 0.210 -1.492 1.00 . A A . 9 CYS HA 1 1 36 21876 1 1 9 CYS HB2 H 0.767 0.462 0.658 1.00 . A A . 9 CYS HB2 1 1 36 21877 1 1 9 CYS HB3 H -0.501 1.553 1.206 1.00 . A A . 9 CYS HB3 1 1 36 21878 1 1 9 CYS N N 0.477 1.979 -1.393 1.00 . A A . 9 CYS N 1 1 36 21879 1 1 9 CYS O O -2.850 1.449 -0.210 1.00 . A A . 9 CYS O 1 1 36 21880 1 1 9 CYS SG S -1.245 -0.710 1.163 1.00 . A A . 9 CYS SG 1 1 36 21881 1 1 10 CYS C C -3.428 4.026 -3.488 1.00 . A A . 10 CYS C 1 1 36 21882 1 1 10 CYS CA C -3.340 3.419 -2.091 1.00 . A A . 10 CYS CA 1 1 36 21883 1 1 10 CYS CB C -3.486 4.516 -1.036 1.00 . A A . 10 CYS CB 1 1 36 21884 1 1 10 CYS H H -1.321 2.923 -2.489 1.00 . A A . 10 CYS H 1 1 36 21885 1 1 10 CYS HA H -4.143 2.707 -1.970 1.00 . A A . 10 CYS HA 1 1 36 21886 1 1 10 CYS HB2 H -2.513 4.938 -0.830 1.00 . A A . 10 CYS HB2 1 1 36 21887 1 1 10 CYS HB3 H -4.133 5.290 -1.420 1.00 . A A . 10 CYS HB3 1 1 36 21888 1 1 10 CYS N N -2.080 2.707 -1.909 1.00 . A A . 10 CYS N 1 1 36 21889 1 1 10 CYS O O -2.728 4.988 -3.803 1.00 . A A . 10 CYS O 1 1 36 21890 1 1 10 CYS SG S -4.185 3.941 0.545 1.00 . A A . 10 CYS SG 1 1 36 21891 1 1 11 ARG C C -5.945 4.279 -5.941 1.00 . A A . 11 ARG C 1 1 36 21892 1 1 11 ARG CA C -4.480 3.944 -5.682 1.00 . A A . 11 ARG CA 1 1 36 21893 1 1 11 ARG CB C -3.998 2.898 -6.689 1.00 . A A . 11 ARG CB 1 1 36 21894 1 1 11 ARG CD C -2.338 3.880 -8.298 1.00 . A A . 11 ARG CD 1 1 36 21895 1 1 11 ARG CG C -2.528 3.034 -7.050 1.00 . A A . 11 ARG CG 1 1 36 21896 1 1 11 ARG CZ C -0.605 5.306 -9.318 1.00 . A A . 11 ARG CZ 1 1 36 21897 1 1 11 ARG H H -4.826 2.695 -4.008 1.00 . A A . 11 ARG H 1 1 36 21898 1 1 11 ARG HA H -3.891 4.841 -5.798 1.00 . A A . 11 ARG HA 1 1 36 21899 1 1 11 ARG HB2 H -4.155 1.914 -6.271 1.00 . A A . 11 ARG HB2 1 1 36 21900 1 1 11 ARG HB3 H -4.580 2.992 -7.594 1.00 . A A . 11 ARG HB3 1 1 36 21901 1 1 11 ARG HD2 H -2.400 3.239 -9.165 1.00 . A A . 11 ARG HD2 1 1 36 21902 1 1 11 ARG HD3 H -3.124 4.619 -8.340 1.00 . A A . 11 ARG HD3 1 1 36 21903 1 1 11 ARG HE H -0.475 4.459 -7.515 1.00 . A A . 11 ARG HE 1 1 36 21904 1 1 11 ARG HG2 H -2.007 3.500 -6.228 1.00 . A A . 11 ARG HG2 1 1 36 21905 1 1 11 ARG HG3 H -2.119 2.050 -7.227 1.00 . A A . 11 ARG HG3 1 1 36 21906 1 1 11 ARG HH11 H -2.246 5.029 -10.468 1.00 . A A . 11 ARG HH11 1 1 36 21907 1 1 11 ARG HH12 H -1.014 6.028 -11.162 1.00 . A A . 11 ARG HH12 1 1 36 21908 1 1 11 ARG HH21 H 1.147 5.773 -8.426 1.00 . A A . 11 ARG HH21 1 1 36 21909 1 1 11 ARG HH22 H 0.913 6.450 -10.003 1.00 . A A . 11 ARG HH22 1 1 36 21910 1 1 11 ARG N N -4.296 3.458 -4.319 1.00 . A A . 11 ARG N 1 1 36 21911 1 1 11 ARG NE N -1.045 4.562 -8.306 1.00 . A A . 11 ARG NE 1 1 36 21912 1 1 11 ARG NH1 N -1.350 5.467 -10.405 1.00 . A A . 11 ARG NH1 1 1 36 21913 1 1 11 ARG NH2 N 0.582 5.891 -9.243 1.00 . A A . 11 ARG NH2 1 1 36 21914 1 1 11 ARG O O -6.843 3.608 -5.433 1.00 . A A . 11 ARG O 1 1 36 21915 1 1 12 GLN C C -8.286 6.221 -5.807 1.00 . A A . 12 GLN C 1 1 36 21916 1 1 12 GLN CA C -7.540 5.750 -7.054 1.00 . A A . 12 GLN CA 1 1 36 21917 1 1 12 GLN CB C -8.308 4.603 -7.707 1.00 . A A . 12 GLN CB 1 1 36 21918 1 1 12 GLN CD C -9.378 5.563 -9.784 1.00 . A A . 12 GLN CD 1 1 36 21919 1 1 12 GLN CG C -8.303 4.651 -9.226 1.00 . A A . 12 GLN CG 1 1 36 21920 1 1 12 GLN H H -5.423 5.821 -7.104 1.00 . A A . 12 GLN H 1 1 36 21921 1 1 12 GLN HA H -7.474 6.570 -7.753 1.00 . A A . 12 GLN HA 1 1 36 21922 1 1 12 GLN HB2 H -7.865 3.671 -7.395 1.00 . A A . 12 GLN HB2 1 1 36 21923 1 1 12 GLN HB3 H -9.333 4.636 -7.369 1.00 . A A . 12 GLN HB3 1 1 36 21924 1 1 12 GLN HE21 H -9.131 4.785 -11.597 1.00 . A A . 12 GLN HE21 1 1 36 21925 1 1 12 GLN HE22 H -10.330 6.022 -11.468 1.00 . A A . 12 GLN HE22 1 1 36 21926 1 1 12 GLN HG2 H -7.341 5.010 -9.559 1.00 . A A . 12 GLN HG2 1 1 36 21927 1 1 12 GLN HG3 H -8.465 3.653 -9.605 1.00 . A A . 12 GLN HG3 1 1 36 21928 1 1 12 GLN N N -6.180 5.324 -6.731 1.00 . A A . 12 GLN N 1 1 36 21929 1 1 12 GLN NE2 N -9.639 5.445 -11.081 1.00 . A A . 12 GLN NE2 1 1 36 21930 1 1 12 GLN O O -9.508 6.359 -5.820 1.00 . A A . 12 GLN O 1 1 36 21931 1 1 12 GLN OE1 O -9.968 6.363 -9.058 1.00 . A A . 12 GLN OE1 1 1 36 21932 1 1 13 CYS C C -8.896 5.787 -2.794 1.00 . A A . 13 CYS C 1 1 36 21933 1 1 13 CYS CA C -8.123 6.914 -3.472 1.00 . A A . 13 CYS CA 1 1 36 21934 1 1 13 CYS CB C -9.042 8.119 -3.698 1.00 . A A . 13 CYS CB 1 1 36 21935 1 1 13 CYS H H -6.576 6.328 -4.789 1.00 . A A . 13 CYS H 1 1 36 21936 1 1 13 CYS HA H -7.311 7.212 -2.825 1.00 . A A . 13 CYS HA 1 1 36 21937 1 1 13 CYS HB2 H -9.931 7.794 -4.216 1.00 . A A . 13 CYS HB2 1 1 36 21938 1 1 13 CYS HB3 H -9.321 8.533 -2.740 1.00 . A A . 13 CYS HB3 1 1 36 21939 1 1 13 CYS N N -7.541 6.462 -4.734 1.00 . A A . 13 CYS N 1 1 36 21940 1 1 13 CYS O O -10.032 5.973 -2.358 1.00 . A A . 13 CYS O 1 1 36 21941 1 1 13 CYS SG S -8.288 9.457 -4.680 1.00 . A A . 13 CYS SG 1 1 36 21942 1 1 14 LYS C C -7.836 2.485 -1.579 1.00 . A A . 14 LYS C 1 1 36 21943 1 1 14 LYS CA C -8.894 3.461 -2.080 1.00 . A A . 14 LYS CA 1 1 36 21944 1 1 14 LYS CB C -9.827 2.759 -3.068 1.00 . A A . 14 LYS CB 1 1 36 21945 1 1 14 LYS CD C -12.198 2.381 -3.811 1.00 . A A . 14 LYS CD 1 1 36 21946 1 1 14 LYS CE C -13.449 3.125 -4.251 1.00 . A A . 14 LYS CE 1 1 36 21947 1 1 14 LYS CG C -11.251 3.289 -3.042 1.00 . A A . 14 LYS CG 1 1 36 21948 1 1 14 LYS H H -7.363 4.531 -3.071 1.00 . A A . 14 LYS H 1 1 36 21949 1 1 14 LYS HA H -9.473 3.811 -1.238 1.00 . A A . 14 LYS HA 1 1 36 21950 1 1 14 LYS HB2 H -9.437 2.886 -4.067 1.00 . A A . 14 LYS HB2 1 1 36 21951 1 1 14 LYS HB3 H -9.854 1.705 -2.834 1.00 . A A . 14 LYS HB3 1 1 36 21952 1 1 14 LYS HD2 H -11.689 2.005 -4.686 1.00 . A A . 14 LYS HD2 1 1 36 21953 1 1 14 LYS HD3 H -12.484 1.556 -3.176 1.00 . A A . 14 LYS HD3 1 1 36 21954 1 1 14 LYS HE2 H -14.190 3.050 -3.469 1.00 . A A . 14 LYS HE2 1 1 36 21955 1 1 14 LYS HE3 H -13.197 4.163 -4.410 1.00 . A A . 14 LYS HE3 1 1 36 21956 1 1 14 LYS HG2 H -11.583 3.352 -2.017 1.00 . A A . 14 LYS HG2 1 1 36 21957 1 1 14 LYS HG3 H -11.267 4.272 -3.489 1.00 . A A . 14 LYS HG3 1 1 36 21958 1 1 14 LYS HZ1 H -13.874 1.534 -5.537 1.00 . A A . 14 LYS HZ1 1 1 36 21959 1 1 14 LYS HZ2 H -15.034 2.765 -5.563 1.00 . A A . 14 LYS HZ2 1 1 36 21960 1 1 14 LYS HZ3 H -13.545 2.991 -6.333 1.00 . A A . 14 LYS HZ3 1 1 36 21961 1 1 14 LYS N N -8.270 4.618 -2.707 1.00 . A A . 14 LYS N 1 1 36 21962 1 1 14 LYS NZ N -14.015 2.565 -5.509 1.00 . A A . 14 LYS NZ 1 1 36 21963 1 1 14 LYS O O -6.972 2.049 -2.340 1.00 . A A . 14 LYS O 1 1 36 21964 1 1 15 LEU C C -6.770 -0.019 -0.561 1.00 . A A . 15 LEU C 1 1 36 21965 1 1 15 LEU CA C -6.953 1.221 0.309 1.00 . A A . 15 LEU CA 1 1 36 21966 1 1 15 LEU CB C -7.420 0.814 1.708 1.00 . A A . 15 LEU CB 1 1 36 21967 1 1 15 LEU CD1 C -5.392 1.497 3.011 1.00 . A A . 15 LEU CD1 1 1 36 21968 1 1 15 LEU CD2 C -7.221 3.150 2.591 1.00 . A A . 15 LEU CD2 1 1 36 21969 1 1 15 LEU CG C -6.891 1.687 2.846 1.00 . A A . 15 LEU CG 1 1 36 21970 1 1 15 LEU H H -8.619 2.528 0.261 1.00 . A A . 15 LEU H 1 1 36 21971 1 1 15 LEU HA H -6.005 1.731 0.391 1.00 . A A . 15 LEU HA 1 1 36 21972 1 1 15 LEU HB2 H -8.500 0.847 1.728 1.00 . A A . 15 LEU HB2 1 1 36 21973 1 1 15 LEU HB3 H -7.105 -0.203 1.889 1.00 . A A . 15 LEU HB3 1 1 36 21974 1 1 15 LEU HD11 H -4.915 1.543 2.043 1.00 . A A . 15 LEU HD11 1 1 36 21975 1 1 15 LEU HD12 H -4.998 2.279 3.643 1.00 . A A . 15 LEU HD12 1 1 36 21976 1 1 15 LEU HD13 H -5.198 0.536 3.463 1.00 . A A . 15 LEU HD13 1 1 36 21977 1 1 15 LEU HD21 H -6.819 3.448 1.634 1.00 . A A . 15 LEU HD21 1 1 36 21978 1 1 15 LEU HD22 H -8.293 3.283 2.588 1.00 . A A . 15 LEU HD22 1 1 36 21979 1 1 15 LEU HD23 H -6.785 3.759 3.370 1.00 . A A . 15 LEU HD23 1 1 36 21980 1 1 15 LEU HG H -7.368 1.392 3.770 1.00 . A A . 15 LEU HG 1 1 36 21981 1 1 15 LEU N N -7.908 2.146 -0.295 1.00 . A A . 15 LEU N 1 1 36 21982 1 1 15 LEU O O -7.730 -0.730 -0.854 1.00 . A A . 15 LEU O 1 1 36 21983 1 1 16 LYS C C -5.824 -2.701 -1.238 1.00 . A A . 16 LYS C 1 1 36 21984 1 1 16 LYS CA C -5.223 -1.420 -1.817 1.00 . A A . 16 LYS CA 1 1 36 21985 1 1 16 LYS CB C -3.708 -1.575 -1.971 1.00 . A A . 16 LYS CB 1 1 36 21986 1 1 16 LYS CD C -1.965 -1.123 -3.726 1.00 . A A . 16 LYS CD 1 1 36 21987 1 1 16 LYS CE C -2.219 0.275 -4.267 1.00 . A A . 16 LYS CE 1 1 36 21988 1 1 16 LYS CG C -3.267 -1.839 -3.402 1.00 . A A . 16 LYS CG 1 1 36 21989 1 1 16 LYS H H -4.807 0.338 -0.711 1.00 . A A . 16 LYS H 1 1 36 21990 1 1 16 LYS HA H -5.657 -1.240 -2.789 1.00 . A A . 16 LYS HA 1 1 36 21991 1 1 16 LYS HB2 H -3.228 -0.670 -1.630 1.00 . A A . 16 LYS HB2 1 1 36 21992 1 1 16 LYS HB3 H -3.377 -2.401 -1.358 1.00 . A A . 16 LYS HB3 1 1 36 21993 1 1 16 LYS HD2 H -1.374 -1.047 -2.826 1.00 . A A . 16 LYS HD2 1 1 36 21994 1 1 16 LYS HD3 H -1.426 -1.694 -4.467 1.00 . A A . 16 LYS HD3 1 1 36 21995 1 1 16 LYS HE2 H -3.106 0.253 -4.883 1.00 . A A . 16 LYS HE2 1 1 36 21996 1 1 16 LYS HE3 H -2.375 0.946 -3.436 1.00 . A A . 16 LYS HE3 1 1 36 21997 1 1 16 LYS HG2 H -3.123 -2.901 -3.535 1.00 . A A . 16 LYS HG2 1 1 36 21998 1 1 16 LYS HG3 H -4.036 -1.491 -4.075 1.00 . A A . 16 LYS HG3 1 1 36 21999 1 1 16 LYS HZ1 H -0.185 0.362 -4.734 1.00 . A A . 16 LYS HZ1 1 1 36 22000 1 1 16 LYS HZ2 H -1.203 0.499 -6.079 1.00 . A A . 16 LYS HZ2 1 1 36 22001 1 1 16 LYS HZ3 H -1.016 1.807 -5.022 1.00 . A A . 16 LYS HZ3 1 1 36 22002 1 1 16 LYS N N -5.531 -0.269 -0.975 1.00 . A A . 16 LYS N 1 1 36 22003 1 1 16 LYS NZ N -1.076 0.770 -5.083 1.00 . A A . 16 LYS NZ 1 1 36 22004 1 1 16 LYS O O -6.002 -2.819 -0.026 1.00 . A A . 16 LYS O 1 1 36 22005 1 1 17 PRO C C -5.905 -5.631 -0.583 1.00 . A A . 17 PRO C 1 1 36 22006 1 1 17 PRO CA C -6.731 -4.952 -1.670 1.00 . A A . 17 PRO CA 1 1 36 22007 1 1 17 PRO CB C -6.730 -5.798 -2.945 1.00 . A A . 17 PRO CB 1 1 36 22008 1 1 17 PRO CD C -5.968 -3.618 -3.565 1.00 . A A . 17 PRO CD 1 1 36 22009 1 1 17 PRO CG C -6.740 -4.810 -4.059 1.00 . A A . 17 PRO CG 1 1 36 22010 1 1 17 PRO HA H -7.745 -4.823 -1.321 1.00 . A A . 17 PRO HA 1 1 36 22011 1 1 17 PRO HB2 H -5.843 -6.414 -2.970 1.00 . A A . 17 PRO HB2 1 1 36 22012 1 1 17 PRO HB3 H -7.610 -6.423 -2.966 1.00 . A A . 17 PRO HB3 1 1 36 22013 1 1 17 PRO HD2 H -4.925 -3.708 -3.830 1.00 . A A . 17 PRO HD2 1 1 36 22014 1 1 17 PRO HD3 H -6.384 -2.706 -3.966 1.00 . A A . 17 PRO HD3 1 1 36 22015 1 1 17 PRO HG2 H -6.259 -5.233 -4.929 1.00 . A A . 17 PRO HG2 1 1 36 22016 1 1 17 PRO HG3 H -7.756 -4.528 -4.291 1.00 . A A . 17 PRO HG3 1 1 36 22017 1 1 17 PRO N N -6.146 -3.678 -2.102 1.00 . A A . 17 PRO N 1 1 36 22018 1 1 17 PRO O O -4.753 -6.002 -0.806 1.00 . A A . 17 PRO O 1 1 36 22019 1 1 18 ALA C C -5.349 -7.835 1.339 1.00 . A A . 18 ALA C 1 1 36 22020 1 1 18 ALA CA C -5.823 -6.434 1.713 1.00 . A A . 18 ALA CA 1 1 36 22021 1 1 18 ALA CB C -6.742 -6.492 2.924 1.00 . A A . 18 ALA CB 1 1 36 22022 1 1 18 ALA H H -7.424 -5.481 0.708 1.00 . A A . 18 ALA H 1 1 36 22023 1 1 18 ALA HA H -4.964 -5.831 1.971 1.00 . A A . 18 ALA HA 1 1 36 22024 1 1 18 ALA HB1 H -6.594 -5.610 3.530 1.00 . A A . 18 ALA HB1 1 1 36 22025 1 1 18 ALA HB2 H -7.770 -6.534 2.594 1.00 . A A . 18 ALA HB2 1 1 36 22026 1 1 18 ALA HB3 H -6.515 -7.372 3.507 1.00 . A A . 18 ALA HB3 1 1 36 22027 1 1 18 ALA N N -6.503 -5.795 0.593 1.00 . A A . 18 ALA N 1 1 36 22028 1 1 18 ALA O O -6.158 -8.726 1.080 1.00 . A A . 18 ALA O 1 1 36 22029 1 1 19 GLY C C -2.592 -9.264 -0.269 1.00 . A A . 19 GLY C 1 1 36 22030 1 1 19 GLY CA C -3.475 -9.315 0.966 1.00 . A A . 19 GLY CA 1 1 36 22031 1 1 19 GLY H H -3.438 -7.274 1.527 1.00 . A A . 19 GLY H 1 1 36 22032 1 1 19 GLY HA2 H -4.284 -10.008 0.786 1.00 . A A . 19 GLY HA2 1 1 36 22033 1 1 19 GLY HA3 H -2.887 -9.674 1.798 1.00 . A A . 19 GLY HA3 1 1 36 22034 1 1 19 GLY N N -4.034 -8.021 1.311 1.00 . A A . 19 GLY N 1 1 36 22035 1 1 19 GLY O O -2.272 -10.300 -0.851 1.00 . A A . 19 GLY O 1 1 36 22036 1 1 20 THR C C 0.024 -7.344 -1.425 1.00 . A A . 20 THR C 1 1 36 22037 1 1 20 THR CA C -1.340 -7.884 -1.837 1.00 . A A . 20 THR CA 1 1 36 22038 1 1 20 THR CB C -2.004 -6.936 -2.841 1.00 . A A . 20 THR CB 1 1 36 22039 1 1 20 THR CG2 C -2.072 -5.500 -2.364 1.00 . A A . 20 THR CG2 1 1 36 22040 1 1 20 THR H H -2.476 -7.268 -0.163 1.00 . A A . 20 THR H 1 1 36 22041 1 1 20 THR HA H -1.205 -8.849 -2.301 1.00 . A A . 20 THR HA 1 1 36 22042 1 1 20 THR HB H -3.016 -7.272 -3.015 1.00 . A A . 20 THR HB 1 1 36 22043 1 1 20 THR HG1 H -0.592 -6.319 -4.058 1.00 . A A . 20 THR HG1 1 1 36 22044 1 1 20 THR HG21 H -1.079 -5.157 -2.113 1.00 . A A . 20 THR HG21 1 1 36 22045 1 1 20 THR HG22 H -2.480 -4.879 -3.148 1.00 . A A . 20 THR HG22 1 1 36 22046 1 1 20 THR HG23 H -2.705 -5.440 -1.491 1.00 . A A . 20 THR HG23 1 1 36 22047 1 1 20 THR N N -2.193 -8.059 -0.668 1.00 . A A . 20 THR N 1 1 36 22048 1 1 20 THR O O 0.242 -7.017 -0.262 1.00 . A A . 20 THR O 1 1 36 22049 1 1 20 THR OG1 O -1.315 -6.951 -4.081 1.00 . A A . 20 THR OG1 1 1 36 22050 1 1 21 THR C C 2.264 -5.238 -1.927 1.00 . A A . 21 THR C 1 1 36 22051 1 1 21 THR CA C 2.280 -6.754 -2.108 1.00 . A A . 21 THR CA 1 1 36 22052 1 1 21 THR CB C 3.233 -7.137 -3.242 1.00 . A A . 21 THR CB 1 1 36 22053 1 1 21 THR CG2 C 2.912 -6.448 -4.550 1.00 . A A . 21 THR CG2 1 1 36 22054 1 1 21 THR H H 0.707 -7.537 -3.292 1.00 . A A . 21 THR H 1 1 36 22055 1 1 21 THR HA H 2.623 -7.210 -1.191 1.00 . A A . 21 THR HA 1 1 36 22056 1 1 21 THR HB H 3.170 -8.203 -3.406 1.00 . A A . 21 THR HB 1 1 36 22057 1 1 21 THR HG1 H 4.684 -5.864 -2.907 1.00 . A A . 21 THR HG1 1 1 36 22058 1 1 21 THR HG21 H 2.068 -5.789 -4.411 1.00 . A A . 21 THR HG21 1 1 36 22059 1 1 21 THR HG22 H 3.768 -5.874 -4.873 1.00 . A A . 21 THR HG22 1 1 36 22060 1 1 21 THR HG23 H 2.672 -7.188 -5.298 1.00 . A A . 21 THR HG23 1 1 36 22061 1 1 21 THR N N 0.938 -7.257 -2.382 1.00 . A A . 21 THR N 1 1 36 22062 1 1 21 THR O O 1.294 -4.571 -2.288 1.00 . A A . 21 THR O 1 1 36 22063 1 1 21 THR OG1 O 4.571 -6.817 -2.903 1.00 . A A . 21 THR OG1 1 1 36 22064 1 1 22 CYS C C 4.638 -2.679 -1.899 1.00 . A A . 22 CYS C 1 1 36 22065 1 1 22 CYS CA C 3.450 -3.263 -1.140 1.00 . A A . 22 CYS CA 1 1 36 22066 1 1 22 CYS CB C 3.589 -2.971 0.356 1.00 . A A . 22 CYS CB 1 1 36 22067 1 1 22 CYS H H 4.084 -5.283 -1.101 1.00 . A A . 22 CYS H 1 1 36 22068 1 1 22 CYS HA H 2.544 -2.802 -1.504 1.00 . A A . 22 CYS HA 1 1 36 22069 1 1 22 CYS HB2 H 3.433 -3.886 0.909 1.00 . A A . 22 CYS HB2 1 1 36 22070 1 1 22 CYS HB3 H 4.586 -2.604 0.554 1.00 . A A . 22 CYS HB3 1 1 36 22071 1 1 22 CYS N N 3.343 -4.700 -1.367 1.00 . A A . 22 CYS N 1 1 36 22072 1 1 22 CYS O O 5.739 -2.569 -1.360 1.00 . A A . 22 CYS O 1 1 36 22073 1 1 22 CYS SG S 2.407 -1.737 0.988 1.00 . A A . 22 CYS SG 1 1 36 22074 1 1 23 TRP C C 6.630 -2.695 -4.128 1.00 . A A . 23 TRP C 1 1 36 22075 1 1 23 TRP CA C 5.457 -1.730 -3.987 1.00 . A A . 23 TRP CA 1 1 36 22076 1 1 23 TRP CB C 5.940 -0.406 -3.393 1.00 . A A . 23 TRP CB 1 1 36 22077 1 1 23 TRP CD1 C 6.000 0.740 -5.684 1.00 . A A . 23 TRP CD1 1 1 36 22078 1 1 23 TRP CD2 C 7.590 1.432 -4.268 1.00 . A A . 23 TRP CD2 1 1 36 22079 1 1 23 TRP CE2 C 7.733 2.133 -5.480 1.00 . A A . 23 TRP CE2 1 1 36 22080 1 1 23 TRP CE3 C 8.481 1.701 -3.225 1.00 . A A . 23 TRP CE3 1 1 36 22081 1 1 23 TRP CG C 6.476 0.545 -4.419 1.00 . A A . 23 TRP CG 1 1 36 22082 1 1 23 TRP CH2 C 9.587 3.329 -4.639 1.00 . A A . 23 TRP CH2 1 1 36 22083 1 1 23 TRP CZ2 C 8.730 3.086 -5.677 1.00 . A A . 23 TRP CZ2 1 1 36 22084 1 1 23 TRP CZ3 C 9.470 2.647 -3.422 1.00 . A A . 23 TRP CZ3 1 1 36 22085 1 1 23 TRP H H 3.507 -2.416 -3.528 1.00 . A A . 23 TRP H 1 1 36 22086 1 1 23 TRP HA H 5.040 -1.544 -4.965 1.00 . A A . 23 TRP HA 1 1 36 22087 1 1 23 TRP HB2 H 5.117 0.077 -2.889 1.00 . A A . 23 TRP HB2 1 1 36 22088 1 1 23 TRP HB3 H 6.726 -0.605 -2.679 1.00 . A A . 23 TRP HB3 1 1 36 22089 1 1 23 TRP HD1 H 5.156 0.213 -6.104 1.00 . A A . 23 TRP HD1 1 1 36 22090 1 1 23 TRP HE1 H 6.606 2.007 -7.245 1.00 . A A . 23 TRP HE1 1 1 36 22091 1 1 23 TRP HE3 H 8.407 1.185 -2.279 1.00 . A A . 23 TRP HE3 1 1 36 22092 1 1 23 TRP HH2 H 10.376 4.059 -4.749 1.00 . A A . 23 TRP HH2 1 1 36 22093 1 1 23 TRP HZ2 H 8.833 3.621 -6.609 1.00 . A A . 23 TRP HZ2 1 1 36 22094 1 1 23 TRP HZ3 H 10.168 2.868 -2.627 1.00 . A A . 23 TRP HZ3 1 1 36 22095 1 1 23 TRP N N 4.406 -2.304 -3.154 1.00 . A A . 23 TRP N 1 1 36 22096 1 1 23 TRP NE1 N 6.750 1.693 -6.328 1.00 . A A . 23 TRP NE1 1 1 36 22097 1 1 23 TRP O O 6.663 -3.746 -3.487 1.00 . A A . 23 TRP O 1 1 36 22098 1 1 24 ARG C C 9.899 -2.350 -5.814 1.00 . A A . 24 ARG C 1 1 36 22099 1 1 24 ARG CA C 8.766 -3.164 -5.197 1.00 . A A . 24 ARG CA 1 1 36 22100 1 1 24 ARG CB C 8.414 -4.344 -6.107 1.00 . A A . 24 ARG CB 1 1 36 22101 1 1 24 ARG CD C 9.338 -6.571 -5.397 1.00 . A A . 24 ARG CD 1 1 36 22102 1 1 24 ARG CG C 8.142 -5.635 -5.351 1.00 . A A . 24 ARG CG 1 1 36 22103 1 1 24 ARG CZ C 8.470 -8.656 -6.384 1.00 . A A . 24 ARG CZ 1 1 36 22104 1 1 24 ARG H H 7.507 -1.482 -5.453 1.00 . A A . 24 ARG H 1 1 36 22105 1 1 24 ARG HA H 9.092 -3.544 -4.240 1.00 . A A . 24 ARG HA 1 1 36 22106 1 1 24 ARG HB2 H 7.531 -4.093 -6.676 1.00 . A A . 24 ARG HB2 1 1 36 22107 1 1 24 ARG HB3 H 9.234 -4.517 -6.789 1.00 . A A . 24 ARG HB3 1 1 36 22108 1 1 24 ARG HD2 H 10.231 -5.986 -5.558 1.00 . A A . 24 ARG HD2 1 1 36 22109 1 1 24 ARG HD3 H 9.412 -7.086 -4.450 1.00 . A A . 24 ARG HD3 1 1 36 22110 1 1 24 ARG HE H 9.725 -7.397 -7.290 1.00 . A A . 24 ARG HE 1 1 36 22111 1 1 24 ARG HG2 H 7.923 -5.398 -4.321 1.00 . A A . 24 ARG HG2 1 1 36 22112 1 1 24 ARG HG3 H 7.291 -6.129 -5.797 1.00 . A A . 24 ARG HG3 1 1 36 22113 1 1 24 ARG HH11 H 7.805 -8.275 -4.511 1.00 . A A . 24 ARG HH11 1 1 36 22114 1 1 24 ARG HH12 H 7.210 -9.734 -5.228 1.00 . A A . 24 ARG HH12 1 1 36 22115 1 1 24 ARG HH21 H 8.942 -9.316 -8.234 1.00 . A A . 24 ARG HH21 1 1 36 22116 1 1 24 ARG HH22 H 7.855 -10.326 -7.341 1.00 . A A . 24 ARG HH22 1 1 36 22117 1 1 24 ARG N N 7.591 -2.331 -4.971 1.00 . A A . 24 ARG N 1 1 36 22118 1 1 24 ARG NE N 9.220 -7.559 -6.467 1.00 . A A . 24 ARG NE 1 1 36 22119 1 1 24 ARG NH1 N 7.771 -8.909 -5.284 1.00 . A A . 24 ARG NH1 1 1 36 22120 1 1 24 ARG NH2 N 8.418 -9.502 -7.403 1.00 . A A . 24 ARG NH2 1 1 36 22121 1 1 24 ARG O O 9.823 -1.940 -6.972 1.00 . A A . 24 ARG O 1 1 36 22122 1 1 25 THR C C 13.382 -2.171 -5.389 1.00 . A A . 25 THR C 1 1 36 22123 1 1 25 THR CA C 12.099 -1.353 -5.502 1.00 . A A . 25 THR CA 1 1 36 22124 1 1 25 THR CB C 12.235 -0.056 -4.703 1.00 . A A . 25 THR CB 1 1 36 22125 1 1 25 THR CG2 C 11.484 1.106 -5.316 1.00 . A A . 25 THR CG2 1 1 36 22126 1 1 25 THR H H 10.952 -2.471 -4.118 1.00 . A A . 25 THR H 1 1 36 22127 1 1 25 THR HA H 11.933 -1.109 -6.541 1.00 . A A . 25 THR HA 1 1 36 22128 1 1 25 THR HB H 13.280 0.215 -4.652 1.00 . A A . 25 THR HB 1 1 36 22129 1 1 25 THR HG1 H 12.097 -1.050 -3.021 1.00 . A A . 25 THR HG1 1 1 36 22130 1 1 25 THR HG21 H 11.634 1.107 -6.385 1.00 . A A . 25 THR HG21 1 1 36 22131 1 1 25 THR HG22 H 10.431 1.008 -5.100 1.00 . A A . 25 THR HG22 1 1 36 22132 1 1 25 THR HG23 H 11.853 2.032 -4.900 1.00 . A A . 25 THR HG23 1 1 36 22133 1 1 25 THR N N 10.949 -2.119 -5.032 1.00 . A A . 25 THR N 1 1 36 22134 1 1 25 THR O O 14.466 -1.620 -5.196 1.00 . A A . 25 THR O 1 1 36 22135 1 1 25 THR OG1 O 11.755 -0.229 -3.381 1.00 . A A . 25 THR OG1 1 1 36 22136 1 1 26 SER C C 15.129 -4.216 -4.090 1.00 . A A . 26 SER C 1 1 36 22137 1 1 26 SER CA C 14.400 -4.383 -5.421 1.00 . A A . 26 SER CA 1 1 36 22138 1 1 26 SER CB C 15.365 -4.122 -6.579 1.00 . A A . 26 SER CB 1 1 36 22139 1 1 26 SER H H 12.361 -3.868 -5.663 1.00 . A A . 26 SER H 1 1 36 22140 1 1 26 SER HA H 14.035 -5.397 -5.492 1.00 . A A . 26 SER HA 1 1 36 22141 1 1 26 SER HB2 H 16.089 -3.378 -6.280 1.00 . A A . 26 SER HB2 1 1 36 22142 1 1 26 SER HB3 H 15.876 -5.039 -6.833 1.00 . A A . 26 SER HB3 1 1 36 22143 1 1 26 SER HG H 14.346 -4.399 -8.228 1.00 . A A . 26 SER HG 1 1 36 22144 1 1 26 SER N N 13.251 -3.488 -5.510 1.00 . A A . 26 SER N 1 1 36 22145 1 1 26 SER O O 16.307 -4.550 -3.972 1.00 . A A . 26 SER O 1 1 36 22146 1 1 26 SER OG O 14.674 -3.652 -7.723 1.00 . A A . 26 SER OG 1 1 36 22147 1 1 27 VAL C C 13.972 -2.933 -0.792 1.00 . A A . 27 VAL C 1 1 36 22148 1 1 27 VAL CA C 15.005 -3.491 -1.769 1.00 . A A . 27 VAL CA 1 1 36 22149 1 1 27 VAL CB C 16.215 -2.535 -1.835 1.00 . A A . 27 VAL CB 1 1 36 22150 1 1 27 VAL CG1 C 15.783 -1.148 -2.287 1.00 . A A . 27 VAL CG1 1 1 36 22151 1 1 27 VAL CG2 C 16.921 -2.471 -0.489 1.00 . A A . 27 VAL CG2 1 1 36 22152 1 1 27 VAL H H 13.486 -3.452 -3.241 1.00 . A A . 27 VAL H 1 1 36 22153 1 1 27 VAL HA H 15.349 -4.448 -1.404 1.00 . A A . 27 VAL HA 1 1 36 22154 1 1 27 VAL HB H 16.912 -2.923 -2.563 1.00 . A A . 27 VAL HB 1 1 36 22155 1 1 27 VAL HG11 H 14.957 -1.235 -2.977 1.00 . A A . 27 VAL HG11 1 1 36 22156 1 1 27 VAL HG12 H 15.476 -0.569 -1.428 1.00 . A A . 27 VAL HG12 1 1 36 22157 1 1 27 VAL HG13 H 16.610 -0.655 -2.776 1.00 . A A . 27 VAL HG13 1 1 36 22158 1 1 27 VAL HG21 H 16.704 -3.367 0.075 1.00 . A A . 27 VAL HG21 1 1 36 22159 1 1 27 VAL HG22 H 17.987 -2.393 -0.644 1.00 . A A . 27 VAL HG22 1 1 36 22160 1 1 27 VAL HG23 H 16.573 -1.608 0.060 1.00 . A A . 27 VAL HG23 1 1 36 22161 1 1 27 VAL N N 14.421 -3.698 -3.089 1.00 . A A . 27 VAL N 1 1 36 22162 1 1 27 VAL O O 14.292 -2.106 0.063 1.00 . A A . 27 VAL O 1 1 36 22163 1 1 28 SER C C 10.321 -3.561 -0.479 1.00 . A A . 28 SER C 1 1 36 22164 1 1 28 SER CA C 11.649 -2.940 -0.056 1.00 . A A . 28 SER CA 1 1 36 22165 1 1 28 SER CB C 11.542 -1.413 -0.083 1.00 . A A . 28 SER CB 1 1 36 22166 1 1 28 SER H H 12.538 -4.049 -1.625 1.00 . A A . 28 SER H 1 1 36 22167 1 1 28 SER HA H 11.877 -3.259 0.950 1.00 . A A . 28 SER HA 1 1 36 22168 1 1 28 SER HB2 H 11.903 -1.045 -1.031 1.00 . A A . 28 SER HB2 1 1 36 22169 1 1 28 SER HB3 H 10.509 -1.124 0.046 1.00 . A A . 28 SER HB3 1 1 36 22170 1 1 28 SER HG H 12.010 -1.162 1.803 1.00 . A A . 28 SER HG 1 1 36 22171 1 1 28 SER N N 12.731 -3.391 -0.926 1.00 . A A . 28 SER N 1 1 36 22172 1 1 28 SER O O 9.455 -2.884 -1.034 1.00 . A A . 28 SER O 1 1 36 22173 1 1 28 SER OG O 12.312 -0.830 0.954 1.00 . A A . 28 SER OG 1 1 36 22174 1 1 29 SER C C 8.109 -5.868 0.673 1.00 . A A . 29 SER C 1 1 36 22175 1 1 29 SER CA C 8.944 -5.565 -0.567 1.00 . A A . 29 SER CA 1 1 36 22176 1 1 29 SER CB C 9.279 -6.865 -1.300 1.00 . A A . 29 SER CB 1 1 36 22177 1 1 29 SER H H 10.892 -5.341 0.231 1.00 . A A . 29 SER H 1 1 36 22178 1 1 29 SER HA H 8.370 -4.930 -1.225 1.00 . A A . 29 SER HA 1 1 36 22179 1 1 29 SER HB2 H 8.417 -7.190 -1.865 1.00 . A A . 29 SER HB2 1 1 36 22180 1 1 29 SER HB3 H 10.106 -6.694 -1.972 1.00 . A A . 29 SER HB3 1 1 36 22181 1 1 29 SER HG H 10.144 -8.563 -0.844 1.00 . A A . 29 SER HG 1 1 36 22182 1 1 29 SER N N 10.166 -4.854 -0.212 1.00 . A A . 29 SER N 1 1 36 22183 1 1 29 SER O O 8.602 -6.449 1.640 1.00 . A A . 29 SER O 1 1 36 22184 1 1 29 SER OG O 9.636 -7.888 -0.387 1.00 . A A . 29 SER OG 1 1 36 22185 1 1 30 HIS C C 4.558 -6.128 1.249 1.00 . A A . 30 HIS C 1 1 36 22186 1 1 30 HIS CA C 5.934 -5.699 1.754 1.00 . A A . 30 HIS CA 1 1 36 22187 1 1 30 HIS CB C 5.814 -4.434 2.608 1.00 . A A . 30 HIS CB 1 1 36 22188 1 1 30 HIS CD2 C 7.803 -2.807 2.254 1.00 . A A . 30 HIS CD2 1 1 36 22189 1 1 30 HIS CE1 C 9.009 -3.392 3.989 1.00 . A A . 30 HIS CE1 1 1 36 22190 1 1 30 HIS CG C 7.130 -3.786 2.905 1.00 . A A . 30 HIS CG 1 1 36 22191 1 1 30 HIS H H 6.508 -5.013 -0.164 1.00 . A A . 30 HIS H 1 1 36 22192 1 1 30 HIS HA H 6.346 -6.494 2.358 1.00 . A A . 30 HIS HA 1 1 36 22193 1 1 30 HIS HB2 H 5.200 -3.714 2.090 1.00 . A A . 30 HIS HB2 1 1 36 22194 1 1 30 HIS HB3 H 5.347 -4.687 3.549 1.00 . A A . 30 HIS HB3 1 1 36 22195 1 1 30 HIS HD1 H 7.697 -4.815 4.655 1.00 . A A . 30 HIS HD1 1 1 36 22196 1 1 30 HIS HD2 H 7.484 -2.298 1.355 1.00 . A A . 30 HIS HD2 1 1 36 22197 1 1 30 HIS HE1 H 9.804 -3.444 4.718 1.00 . A A . 30 HIS HE1 1 1 36 22198 1 1 30 HIS HE2 H 9.613 -1.869 2.761 1.00 . A A . 30 HIS HE2 1 1 36 22199 1 1 30 HIS N N 6.842 -5.470 0.636 1.00 . A A . 30 HIS N 1 1 36 22200 1 1 30 HIS ND1 N 7.913 -4.131 3.987 1.00 . A A . 30 HIS ND1 1 1 36 22201 1 1 30 HIS NE2 N 8.967 -2.582 2.948 1.00 . A A . 30 HIS NE2 1 1 36 22202 1 1 30 HIS O O 4.414 -6.540 0.098 1.00 . A A . 30 HIS O 1 1 36 22203 1 1 31 TYR C C 1.176 -5.399 2.246 1.00 . A A . 31 TYR C 1 1 36 22204 1 1 31 TYR CA C 2.194 -6.415 1.738 1.00 . A A . 31 TYR CA 1 1 36 22205 1 1 31 TYR CB C 1.864 -7.803 2.290 1.00 . A A . 31 TYR CB 1 1 36 22206 1 1 31 TYR CD1 C 1.894 -9.500 0.421 1.00 . A A . 31 TYR CD1 1 1 36 22207 1 1 31 TYR CD2 C 3.758 -9.427 1.906 1.00 . A A . 31 TYR CD2 1 1 36 22208 1 1 31 TYR CE1 C 2.489 -10.532 -0.281 1.00 . A A . 31 TYR CE1 1 1 36 22209 1 1 31 TYR CE2 C 4.359 -10.458 1.208 1.00 . A A . 31 TYR CE2 1 1 36 22210 1 1 31 TYR CG C 2.518 -8.931 1.525 1.00 . A A . 31 TYR CG 1 1 36 22211 1 1 31 TYR CZ C 3.721 -11.007 0.116 1.00 . A A . 31 TYR CZ 1 1 36 22212 1 1 31 TYR H H 3.723 -5.699 3.016 1.00 . A A . 31 TYR H 1 1 36 22213 1 1 31 TYR HA H 2.146 -6.447 0.661 1.00 . A A . 31 TYR HA 1 1 36 22214 1 1 31 TYR HB2 H 2.196 -7.863 3.316 1.00 . A A . 31 TYR HB2 1 1 36 22215 1 1 31 TYR HB3 H 0.795 -7.952 2.254 1.00 . A A . 31 TYR HB3 1 1 36 22216 1 1 31 TYR HD1 H 0.930 -9.126 0.112 1.00 . A A . 31 TYR HD1 1 1 36 22217 1 1 31 TYR HD2 H 4.256 -8.996 2.762 1.00 . A A . 31 TYR HD2 1 1 36 22218 1 1 31 TYR HE1 H 1.988 -10.961 -1.136 1.00 . A A . 31 TYR HE1 1 1 36 22219 1 1 31 TYR HE2 H 5.324 -10.830 1.520 1.00 . A A . 31 TYR HE2 1 1 36 22220 1 1 31 TYR HH H 3.924 -12.869 -0.316 1.00 . A A . 31 TYR HH 1 1 36 22221 1 1 31 TYR N N 3.551 -6.032 2.111 1.00 . A A . 31 TYR N 1 1 36 22222 1 1 31 TYR O O 1.341 -4.823 3.321 1.00 . A A . 31 TYR O 1 1 36 22223 1 1 31 TYR OH O 4.316 -12.033 -0.580 1.00 . A A . 31 TYR OH 1 1 36 22224 1 1 32 CYS C C -1.981 -4.920 2.699 1.00 . A A . 32 CYS C 1 1 36 22225 1 1 32 CYS CA C -0.927 -4.244 1.832 1.00 . A A . 32 CYS CA 1 1 36 22226 1 1 32 CYS CB C -1.582 -3.665 0.578 1.00 . A A . 32 CYS CB 1 1 36 22227 1 1 32 CYS H H 0.043 -5.676 0.620 1.00 . A A . 32 CYS H 1 1 36 22228 1 1 32 CYS HA H -0.472 -3.444 2.394 1.00 . A A . 32 CYS HA 1 1 36 22229 1 1 32 CYS HB2 H -1.601 -4.422 -0.190 1.00 . A A . 32 CYS HB2 1 1 36 22230 1 1 32 CYS HB3 H -2.595 -3.373 0.813 1.00 . A A . 32 CYS HB3 1 1 36 22231 1 1 32 CYS N N 0.120 -5.186 1.465 1.00 . A A . 32 CYS N 1 1 36 22232 1 1 32 CYS O O -2.548 -5.944 2.319 1.00 . A A . 32 CYS O 1 1 36 22233 1 1 32 CYS SG S -0.728 -2.208 -0.105 1.00 . A A . 32 CYS SG 1 1 36 22234 1 1 33 THR C C -4.615 -4.274 4.515 1.00 . A A . 33 THR C 1 1 36 22235 1 1 33 THR CA C -3.239 -4.881 4.778 1.00 . A A . 33 THR CA 1 1 36 22236 1 1 33 THR CB C -2.823 -4.622 6.227 1.00 . A A . 33 THR CB 1 1 36 22237 1 1 33 THR CG2 C -1.369 -4.943 6.497 1.00 . A A . 33 THR CG2 1 1 36 22238 1 1 33 THR H H -1.764 -3.519 4.108 1.00 . A A . 33 THR H 1 1 36 22239 1 1 33 THR HA H -3.292 -5.947 4.614 1.00 . A A . 33 THR HA 1 1 36 22240 1 1 33 THR HB H -3.424 -5.239 6.879 1.00 . A A . 33 THR HB 1 1 36 22241 1 1 33 THR HG1 H -2.649 -2.698 5.905 1.00 . A A . 33 THR HG1 1 1 36 22242 1 1 33 THR HG21 H -1.022 -5.671 5.779 1.00 . A A . 33 THR HG21 1 1 36 22243 1 1 33 THR HG22 H -0.780 -4.042 6.409 1.00 . A A . 33 THR HG22 1 1 36 22244 1 1 33 THR HG23 H -1.268 -5.344 7.494 1.00 . A A . 33 THR HG23 1 1 36 22245 1 1 33 THR N N -2.245 -4.336 3.862 1.00 . A A . 33 THR N 1 1 36 22246 1 1 33 THR O O -5.523 -4.396 5.337 1.00 . A A . 33 THR O 1 1 36 22247 1 1 33 THR OG1 O -3.036 -3.266 6.575 1.00 . A A . 33 THR OG1 1 1 36 22248 1 1 34 GLY C C -6.631 -2.196 4.153 1.00 . A A . 34 GLY C 1 1 36 22249 1 1 34 GLY CA C -6.035 -3.004 3.014 1.00 . A A . 34 GLY CA 1 1 36 22250 1 1 34 GLY H H -4.007 -3.554 2.743 1.00 . A A . 34 GLY H 1 1 36 22251 1 1 34 GLY HA2 H -6.733 -3.780 2.735 1.00 . A A . 34 GLY HA2 1 1 36 22252 1 1 34 GLY HA3 H -5.884 -2.351 2.167 1.00 . A A . 34 GLY HA3 1 1 36 22253 1 1 34 GLY N N -4.765 -3.619 3.363 1.00 . A A . 34 GLY N 1 1 36 22254 1 1 34 GLY O O -7.830 -2.282 4.421 1.00 . A A . 34 GLY O 1 1 36 22255 1 1 35 ARG C C -5.600 0.787 5.914 1.00 . A A . 35 ARG C 1 1 36 22256 1 1 35 ARG CA C -6.250 -0.592 5.942 1.00 . A A . 35 ARG CA 1 1 36 22257 1 1 35 ARG CB C -5.943 -1.286 7.270 1.00 . A A . 35 ARG CB 1 1 36 22258 1 1 35 ARG CD C -8.126 -2.090 8.218 1.00 . A A . 35 ARG CD 1 1 36 22259 1 1 35 ARG CG C -7.008 -1.066 8.332 1.00 . A A . 35 ARG CG 1 1 36 22260 1 1 35 ARG CZ C -9.560 -1.485 10.130 1.00 . A A . 35 ARG CZ 1 1 36 22261 1 1 35 ARG H H -4.849 -1.387 4.567 1.00 . A A . 35 ARG H 1 1 36 22262 1 1 35 ARG HA H -7.316 -0.472 5.849 1.00 . A A . 35 ARG HA 1 1 36 22263 1 1 35 ARG HB2 H -5.852 -2.348 7.096 1.00 . A A . 35 ARG HB2 1 1 36 22264 1 1 35 ARG HB3 H -5.004 -0.911 7.651 1.00 . A A . 35 ARG HB3 1 1 36 22265 1 1 35 ARG HD2 H -8.300 -2.300 7.174 1.00 . A A . 35 ARG HD2 1 1 36 22266 1 1 35 ARG HD3 H -7.820 -2.995 8.721 1.00 . A A . 35 ARG HD3 1 1 36 22267 1 1 35 ARG HE H -10.102 -1.371 8.212 1.00 . A A . 35 ARG HE 1 1 36 22268 1 1 35 ARG HG2 H -6.554 -1.151 9.307 1.00 . A A . 35 ARG HG2 1 1 36 22269 1 1 35 ARG HG3 H -7.424 -0.077 8.211 1.00 . A A . 35 ARG HG3 1 1 36 22270 1 1 35 ARG HH11 H -7.713 -2.135 10.639 1.00 . A A . 35 ARG HH11 1 1 36 22271 1 1 35 ARG HH12 H -8.740 -1.704 11.965 1.00 . A A . 35 ARG HH12 1 1 36 22272 1 1 35 ARG HH21 H -11.454 -0.803 9.955 1.00 . A A . 35 ARG HH21 1 1 36 22273 1 1 35 ARG HH22 H -10.864 -0.948 11.577 1.00 . A A . 35 ARG HH22 1 1 36 22274 1 1 35 ARG N N -5.794 -1.412 4.825 1.00 . A A . 35 ARG N 1 1 36 22275 1 1 35 ARG NE N -9.370 -1.611 8.818 1.00 . A A . 35 ARG NE 1 1 36 22276 1 1 35 ARG NH1 N -8.591 -1.801 10.981 1.00 . A A . 35 ARG NH1 1 1 36 22277 1 1 35 ARG NH2 N -10.721 -1.042 10.592 1.00 . A A . 35 ARG NH2 1 1 36 22278 1 1 35 ARG O O -6.272 1.805 6.081 1.00 . A A . 35 ARG O 1 1 36 22279 1 1 36 SER C C -2.637 2.119 4.436 1.00 . A A . 36 SER C 1 1 36 22280 1 1 36 SER CA C -3.547 2.066 5.660 1.00 . A A . 36 SER CA 1 1 36 22281 1 1 36 SER CB C -2.717 2.237 6.933 1.00 . A A . 36 SER CB 1 1 36 22282 1 1 36 SER H H -3.812 -0.034 5.582 1.00 . A A . 36 SER H 1 1 36 22283 1 1 36 SER HA H -4.262 2.872 5.597 1.00 . A A . 36 SER HA 1 1 36 22284 1 1 36 SER HB2 H -2.337 1.275 7.245 1.00 . A A . 36 SER HB2 1 1 36 22285 1 1 36 SER HB3 H -1.890 2.903 6.734 1.00 . A A . 36 SER HB3 1 1 36 22286 1 1 36 SER HG H -3.881 3.614 7.698 1.00 . A A . 36 SER HG 1 1 36 22287 1 1 36 SER N N -4.290 0.811 5.706 1.00 . A A . 36 SER N 1 1 36 22288 1 1 36 SER O O -2.135 1.093 3.977 1.00 . A A . 36 SER O 1 1 36 22289 1 1 36 SER OG O -3.499 2.780 7.983 1.00 . A A . 36 SER OG 1 1 36 22290 1 1 37 CYS C C -0.104 3.335 3.103 1.00 . A A . 37 CYS C 1 1 36 22291 1 1 37 CYS CA C -1.577 3.516 2.746 1.00 . A A . 37 CYS CA 1 1 36 22292 1 1 37 CYS CB C -1.801 4.908 2.151 1.00 . A A . 37 CYS CB 1 1 36 22293 1 1 37 CYS H H -2.855 4.104 4.327 1.00 . A A . 37 CYS H 1 1 36 22294 1 1 37 CYS HA H -1.851 2.774 2.012 1.00 . A A . 37 CYS HA 1 1 36 22295 1 1 37 CYS HB2 H -1.385 5.648 2.818 1.00 . A A . 37 CYS HB2 1 1 36 22296 1 1 37 CYS HB3 H -1.300 4.968 1.197 1.00 . A A . 37 CYS HB3 1 1 36 22297 1 1 37 CYS N N -2.428 3.324 3.915 1.00 . A A . 37 CYS N 1 1 36 22298 1 1 37 CYS O O 0.729 3.085 2.231 1.00 . A A . 37 CYS O 1 1 36 22299 1 1 37 CYS SG S -3.554 5.328 1.885 1.00 . A A . 37 CYS SG 1 1 36 22300 1 1 38 GLU C C 1.979 1.841 4.928 1.00 . A A . 38 GLU C 1 1 36 22301 1 1 38 GLU CA C 1.589 3.313 4.852 1.00 . A A . 38 GLU CA 1 1 36 22302 1 1 38 GLU CB C 1.761 3.970 6.223 1.00 . A A . 38 GLU CB 1 1 36 22303 1 1 38 GLU CD C 2.782 6.228 5.734 1.00 . A A . 38 GLU CD 1 1 36 22304 1 1 38 GLU CG C 1.553 5.476 6.206 1.00 . A A . 38 GLU CG 1 1 36 22305 1 1 38 GLU H H -0.490 3.665 5.038 1.00 . A A . 38 GLU H 1 1 36 22306 1 1 38 GLU HA H 2.234 3.808 4.142 1.00 . A A . 38 GLU HA 1 1 36 22307 1 1 38 GLU HB2 H 1.047 3.538 6.908 1.00 . A A . 38 GLU HB2 1 1 36 22308 1 1 38 GLU HB3 H 2.759 3.770 6.582 1.00 . A A . 38 GLU HB3 1 1 36 22309 1 1 38 GLU HG2 H 0.733 5.706 5.543 1.00 . A A . 38 GLU HG2 1 1 36 22310 1 1 38 GLU HG3 H 1.310 5.804 7.206 1.00 . A A . 38 GLU HG3 1 1 36 22311 1 1 38 GLU N N 0.214 3.464 4.387 1.00 . A A . 38 GLU N 1 1 36 22312 1 1 38 GLU O O 1.518 1.111 5.806 1.00 . A A . 38 GLU O 1 1 36 22313 1 1 38 GLU OE1 O 3.283 5.916 4.633 1.00 . A A . 38 GLU OE1 1 1 36 22314 1 1 38 GLU OE2 O 3.243 7.130 6.465 1.00 . A A . 38 GLU OE2 1 1 36 22315 1 1 39 CYS C C 3.947 -0.370 5.286 1.00 . A A . 39 CYS C 1 1 36 22316 1 1 39 CYS CA C 3.285 0.023 3.965 1.00 . A A . 39 CYS CA 1 1 36 22317 1 1 39 CYS CB C 4.268 -0.181 2.811 1.00 . A A . 39 CYS CB 1 1 36 22318 1 1 39 CYS H H 3.164 2.040 3.330 1.00 . A A . 39 CYS H 1 1 36 22319 1 1 39 CYS HA H 2.421 -0.603 3.804 1.00 . A A . 39 CYS HA 1 1 36 22320 1 1 39 CYS HB2 H 5.048 0.563 2.877 1.00 . A A . 39 CYS HB2 1 1 36 22321 1 1 39 CYS HB3 H 4.707 -1.164 2.892 1.00 . A A . 39 CYS HB3 1 1 36 22322 1 1 39 CYS N N 2.831 1.410 4.003 1.00 . A A . 39 CYS N 1 1 36 22323 1 1 39 CYS O O 5.043 0.095 5.599 1.00 . A A . 39 CYS O 1 1 36 22324 1 1 39 CYS SG S 3.515 -0.044 1.157 1.00 . A A . 39 CYS SG 1 1 36 22325 1 1 40 PRO C C 5.252 -2.226 7.245 1.00 . A A . 40 PRO C 1 1 36 22326 1 1 40 PRO CA C 3.833 -1.683 7.371 1.00 . A A . 40 PRO CA 1 1 36 22327 1 1 40 PRO CB C 2.871 -2.794 7.796 1.00 . A A . 40 PRO CB 1 1 36 22328 1 1 40 PRO CD C 1.979 -1.844 5.793 1.00 . A A . 40 PRO CD 1 1 36 22329 1 1 40 PRO CG C 1.592 -2.475 7.102 1.00 . A A . 40 PRO CG 1 1 36 22330 1 1 40 PRO HA H 3.816 -0.889 8.103 1.00 . A A . 40 PRO HA 1 1 36 22331 1 1 40 PRO HB2 H 3.262 -3.752 7.484 1.00 . A A . 40 PRO HB2 1 1 36 22332 1 1 40 PRO HB3 H 2.751 -2.780 8.869 1.00 . A A . 40 PRO HB3 1 1 36 22333 1 1 40 PRO HD2 H 2.064 -2.596 5.023 1.00 . A A . 40 PRO HD2 1 1 36 22334 1 1 40 PRO HD3 H 1.260 -1.091 5.510 1.00 . A A . 40 PRO HD3 1 1 36 22335 1 1 40 PRO HG2 H 1.031 -3.382 6.930 1.00 . A A . 40 PRO HG2 1 1 36 22336 1 1 40 PRO HG3 H 1.015 -1.782 7.696 1.00 . A A . 40 PRO HG3 1 1 36 22337 1 1 40 PRO N N 3.292 -1.236 6.082 1.00 . A A . 40 PRO N 1 1 36 22338 1 1 40 PRO O O 5.803 -2.303 6.147 1.00 . A A . 40 PRO O 1 1 36 22339 1 1 41 SER C C 7.175 -4.663 8.464 1.00 . A A . 41 SER C 1 1 36 22340 1 1 41 SER CA C 7.194 -3.139 8.394 1.00 . A A . 41 SER CA 1 1 36 22341 1 1 41 SER CB C 7.975 -2.572 9.581 1.00 . A A . 41 SER CB 1 1 36 22342 1 1 41 SER H H 5.347 -2.517 9.221 1.00 . A A . 41 SER H 1 1 36 22343 1 1 41 SER HA H 7.680 -2.839 7.478 1.00 . A A . 41 SER HA 1 1 36 22344 1 1 41 SER HB2 H 7.537 -1.632 9.881 1.00 . A A . 41 SER HB2 1 1 36 22345 1 1 41 SER HB3 H 7.930 -3.269 10.405 1.00 . A A . 41 SER HB3 1 1 36 22346 1 1 41 SER HG H 9.403 -1.572 8.688 1.00 . A A . 41 SER HG 1 1 36 22347 1 1 41 SER N N 5.838 -2.603 8.377 1.00 . A A . 41 SER N 1 1 36 22348 1 1 41 SER O O 8.071 -5.279 9.041 1.00 . A A . 41 SER O 1 1 36 22349 1 1 41 SER OG O 9.333 -2.354 9.241 1.00 . A A . 41 SER OG 1 1 36 22350 1 1 42 TYR C C 6.285 -7.285 6.478 1.00 . A A . 42 TYR C 1 1 36 22351 1 1 42 TYR CA C 6.012 -6.717 7.868 1.00 . A A . 42 TYR CA 1 1 36 22352 1 1 42 TYR CB C 4.611 -7.120 8.331 1.00 . A A . 42 TYR CB 1 1 36 22353 1 1 42 TYR CD1 C 3.432 -6.746 10.532 1.00 . A A . 42 TYR CD1 1 1 36 22354 1 1 42 TYR CD2 C 5.447 -8.020 10.537 1.00 . A A . 42 TYR CD2 1 1 36 22355 1 1 42 TYR CE1 C 3.323 -6.906 11.900 1.00 . A A . 42 TYR CE1 1 1 36 22356 1 1 42 TYR CE2 C 5.344 -8.185 11.905 1.00 . A A . 42 TYR CE2 1 1 36 22357 1 1 42 TYR CG C 4.495 -7.299 9.828 1.00 . A A . 42 TYR CG 1 1 36 22358 1 1 42 TYR CZ C 4.280 -7.627 12.582 1.00 . A A . 42 TYR CZ 1 1 36 22359 1 1 42 TYR H H 5.465 -4.720 7.429 1.00 . A A . 42 TYR H 1 1 36 22360 1 1 42 TYR HA H 6.739 -7.120 8.558 1.00 . A A . 42 TYR HA 1 1 36 22361 1 1 42 TYR HB2 H 3.908 -6.358 8.033 1.00 . A A . 42 TYR HB2 1 1 36 22362 1 1 42 TYR HB3 H 4.341 -8.055 7.862 1.00 . A A . 42 TYR HB3 1 1 36 22363 1 1 42 TYR HD1 H 2.683 -6.182 9.995 1.00 . A A . 42 TYR HD1 1 1 36 22364 1 1 42 TYR HD2 H 6.280 -8.456 10.004 1.00 . A A . 42 TYR HD2 1 1 36 22365 1 1 42 TYR HE1 H 2.489 -6.469 12.430 1.00 . A A . 42 TYR HE1 1 1 36 22366 1 1 42 TYR HE2 H 6.095 -8.750 12.438 1.00 . A A . 42 TYR HE2 1 1 36 22367 1 1 42 TYR HH H 4.437 -8.681 14.182 1.00 . A A . 42 TYR HH 1 1 36 22368 1 1 42 TYR N N 6.148 -5.265 7.873 1.00 . A A . 42 TYR N 1 1 36 22369 1 1 42 TYR O O 5.357 -7.590 5.730 1.00 . A A . 42 TYR O 1 1 36 22370 1 1 42 TYR OH O 4.174 -7.789 13.944 1.00 . A A . 42 TYR OH 1 1 36 22371 1 1 43 PRO C C 7.649 -9.456 4.669 1.00 . A A . 43 PRO C 1 1 36 22372 1 1 43 PRO CA C 7.962 -7.969 4.804 1.00 . A A . 43 PRO CA 1 1 36 22373 1 1 43 PRO CB C 9.473 -7.735 4.761 1.00 . A A . 43 PRO CB 1 1 36 22374 1 1 43 PRO CD C 8.740 -7.095 6.945 1.00 . A A . 43 PRO CD 1 1 36 22375 1 1 43 PRO CG C 9.892 -7.700 6.190 1.00 . A A . 43 PRO CG 1 1 36 22376 1 1 43 PRO HA H 7.487 -7.429 3.998 1.00 . A A . 43 PRO HA 1 1 36 22377 1 1 43 PRO HB2 H 9.951 -8.544 4.228 1.00 . A A . 43 PRO HB2 1 1 36 22378 1 1 43 PRO HB3 H 9.681 -6.798 4.267 1.00 . A A . 43 PRO HB3 1 1 36 22379 1 1 43 PRO HD2 H 8.657 -7.539 7.926 1.00 . A A . 43 PRO HD2 1 1 36 22380 1 1 43 PRO HD3 H 8.860 -6.025 7.022 1.00 . A A . 43 PRO HD3 1 1 36 22381 1 1 43 PRO HG2 H 10.084 -8.704 6.541 1.00 . A A . 43 PRO HG2 1 1 36 22382 1 1 43 PRO HG3 H 10.774 -7.088 6.300 1.00 . A A . 43 PRO HG3 1 1 36 22383 1 1 43 PRO N N 7.570 -7.435 6.112 1.00 . A A . 43 PRO N 1 1 36 22384 1 1 43 PRO O O 7.221 -10.100 5.627 1.00 . A A . 43 PRO O 1 1 36 22385 1 1 44 GLY C C 8.827 -12.267 3.456 1.00 . A A . 44 GLY C 1 1 36 22386 1 1 44 GLY CA C 7.602 -11.401 3.236 1.00 . A A . 44 GLY CA 1 1 36 22387 1 1 44 GLY H H 8.207 -9.432 2.748 1.00 . A A . 44 GLY H 1 1 36 22388 1 1 44 GLY HA2 H 7.264 -11.526 2.218 1.00 . A A . 44 GLY HA2 1 1 36 22389 1 1 44 GLY HA3 H 6.819 -11.728 3.906 1.00 . A A . 44 GLY HA3 1 1 36 22390 1 1 44 GLY N N 7.866 -9.995 3.474 1.00 . A A . 44 GLY N 1 1 36 22391 1 1 44 GLY O O 8.666 -13.420 3.906 1.00 . A A . 44 GLY O 1 1 36 22392 1 1 44 GLY OXT O 9.947 -11.791 3.176 1.00 . A A . 44 GLY OXT 1 1 37 22393 1 1 1 ALA C C -14.209 11.543 5.967 1.00 . A A . 1 ALA C 1 1 37 22394 1 1 1 ALA CA C -14.736 12.419 7.098 1.00 . A A . 1 ALA CA 1 1 37 22395 1 1 1 ALA CB C -13.884 13.671 7.236 1.00 . A A . 1 ALA CB 1 1 37 22396 1 1 1 ALA H1 H -13.849 11.189 8.488 1.00 . A A . 1 ALA H1 1 1 37 22397 1 1 1 ALA H2 H -14.912 12.360 9.147 1.00 . A A . 1 ALA H2 1 1 37 22398 1 1 1 ALA H3 H -15.546 10.988 8.334 1.00 . A A . 1 ALA H3 1 1 37 22399 1 1 1 ALA HA H -15.744 12.724 6.861 1.00 . A A . 1 ALA HA 1 1 37 22400 1 1 1 ALA HB1 H -13.086 13.489 7.941 1.00 . A A . 1 ALA HB1 1 1 37 22401 1 1 1 ALA HB2 H -13.463 13.928 6.275 1.00 . A A . 1 ALA HB2 1 1 37 22402 1 1 1 ALA HB3 H -14.497 14.487 7.589 1.00 . A A . 1 ALA HB3 1 1 37 22403 1 1 1 ALA N N -14.763 11.672 8.383 1.00 . A A . 1 ALA N 1 1 37 22404 1 1 1 ALA O O -13.658 10.468 6.205 1.00 . A A . 1 ALA O 1 1 37 22405 1 1 2 MET C C -12.620 11.853 3.027 1.00 . A A . 2 MET C 1 1 37 22406 1 1 2 MET CA C -13.922 11.269 3.565 1.00 . A A . 2 MET CA 1 1 37 22407 1 1 2 MET CB C -14.993 11.286 2.473 1.00 . A A . 2 MET CB 1 1 37 22408 1 1 2 MET CE C -16.697 15.070 2.507 1.00 . A A . 2 MET CE 1 1 37 22409 1 1 2 MET CG C -15.375 12.685 2.017 1.00 . A A . 2 MET CG 1 1 37 22410 1 1 2 MET H H -14.827 12.873 4.609 1.00 . A A . 2 MET H 1 1 37 22411 1 1 2 MET HA H -13.747 10.247 3.869 1.00 . A A . 2 MET HA 1 1 37 22412 1 1 2 MET HB2 H -14.626 10.740 1.616 1.00 . A A . 2 MET HB2 1 1 37 22413 1 1 2 MET HB3 H -15.881 10.798 2.846 1.00 . A A . 2 MET HB3 1 1 37 22414 1 1 2 MET HE1 H -16.027 15.214 1.672 1.00 . A A . 2 MET HE1 1 1 37 22415 1 1 2 MET HE2 H -17.673 15.458 2.256 1.00 . A A . 2 MET HE2 1 1 37 22416 1 1 2 MET HE3 H -16.313 15.593 3.371 1.00 . A A . 2 MET HE3 1 1 37 22417 1 1 2 MET HG2 H -14.544 13.349 2.204 1.00 . A A . 2 MET HG2 1 1 37 22418 1 1 2 MET HG3 H -15.582 12.660 0.958 1.00 . A A . 2 MET HG3 1 1 37 22419 1 1 2 MET N N -14.381 12.010 4.735 1.00 . A A . 2 MET N 1 1 37 22420 1 1 2 MET O O -12.448 13.071 2.980 1.00 . A A . 2 MET O 1 1 37 22421 1 1 2 MET SD S -16.826 13.323 2.876 1.00 . A A . 2 MET SD 1 1 37 22422 1 1 3 ASP C C -9.895 10.403 1.065 1.00 . A A . 3 ASP C 1 1 37 22423 1 1 3 ASP CA C -10.420 11.405 2.088 1.00 . A A . 3 ASP CA 1 1 37 22424 1 1 3 ASP CB C -9.405 11.575 3.220 1.00 . A A . 3 ASP CB 1 1 37 22425 1 1 3 ASP CG C -8.266 12.502 2.840 1.00 . A A . 3 ASP CG 1 1 37 22426 1 1 3 ASP H H -11.903 10.018 2.686 1.00 . A A . 3 ASP H 1 1 37 22427 1 1 3 ASP HA H -10.565 12.357 1.600 1.00 . A A . 3 ASP HA 1 1 37 22428 1 1 3 ASP HB2 H -9.904 11.985 4.085 1.00 . A A . 3 ASP HB2 1 1 37 22429 1 1 3 ASP HB3 H -8.991 10.610 3.472 1.00 . A A . 3 ASP HB3 1 1 37 22430 1 1 3 ASP N N -11.707 10.976 2.623 1.00 . A A . 3 ASP N 1 1 37 22431 1 1 3 ASP O O -10.415 9.294 0.944 1.00 . A A . 3 ASP O 1 1 37 22432 1 1 3 ASP OD1 O -8.488 13.403 2.005 1.00 . A A . 3 ASP OD1 1 1 37 22433 1 1 3 ASP OD2 O -7.153 12.326 3.379 1.00 . A A . 3 ASP OD2 1 1 37 22434 1 1 4 CYS C C -7.130 9.110 -0.094 1.00 . A A . 4 CYS C 1 1 37 22435 1 1 4 CYS CA C -8.266 9.939 -0.683 1.00 . A A . 4 CYS CA 1 1 37 22436 1 1 4 CYS CB C -7.746 10.775 -1.854 1.00 . A A . 4 CYS CB 1 1 37 22437 1 1 4 CYS H H -8.491 11.698 0.473 1.00 . A A . 4 CYS H 1 1 37 22438 1 1 4 CYS HA H -9.034 9.271 -1.043 1.00 . A A . 4 CYS HA 1 1 37 22439 1 1 4 CYS HB2 H -7.291 11.676 -1.470 1.00 . A A . 4 CYS HB2 1 1 37 22440 1 1 4 CYS HB3 H -7.003 10.204 -2.392 1.00 . A A . 4 CYS HB3 1 1 37 22441 1 1 4 CYS N N -8.862 10.802 0.330 1.00 . A A . 4 CYS N 1 1 37 22442 1 1 4 CYS O O -6.874 7.989 -0.533 1.00 . A A . 4 CYS O 1 1 37 22443 1 1 4 CYS SG S -9.033 11.270 -3.045 1.00 . A A . 4 CYS SG 1 1 37 22444 1 1 5 THR C C -4.231 8.680 0.544 1.00 . A A . 5 THR C 1 1 37 22445 1 1 5 THR CA C -5.339 8.979 1.549 1.00 . A A . 5 THR CA 1 1 37 22446 1 1 5 THR CB C -5.826 7.682 2.198 1.00 . A A . 5 THR CB 1 1 37 22447 1 1 5 THR CG2 C -5.109 7.353 3.490 1.00 . A A . 5 THR CG2 1 1 37 22448 1 1 5 THR H H -6.699 10.566 1.209 1.00 . A A . 5 THR H 1 1 37 22449 1 1 5 THR HA H -4.947 9.630 2.316 1.00 . A A . 5 THR HA 1 1 37 22450 1 1 5 THR HB H -5.663 6.864 1.511 1.00 . A A . 5 THR HB 1 1 37 22451 1 1 5 THR HG1 H -7.654 6.984 2.117 1.00 . A A . 5 THR HG1 1 1 37 22452 1 1 5 THR HG21 H -4.051 7.255 3.299 1.00 . A A . 5 THR HG21 1 1 37 22453 1 1 5 THR HG22 H -5.274 8.146 4.205 1.00 . A A . 5 THR HG22 1 1 37 22454 1 1 5 THR HG23 H -5.492 6.425 3.888 1.00 . A A . 5 THR HG23 1 1 37 22455 1 1 5 THR N N -6.450 9.669 0.903 1.00 . A A . 5 THR N 1 1 37 22456 1 1 5 THR O O -3.921 7.521 0.270 1.00 . A A . 5 THR O 1 1 37 22457 1 1 5 THR OG1 O -7.212 7.753 2.483 1.00 . A A . 5 THR OG1 1 1 37 22458 1 1 6 THR C C -1.436 8.725 -0.437 1.00 . A A . 6 THR C 1 1 37 22459 1 1 6 THR CA C -2.566 9.593 -0.983 1.00 . A A . 6 THR CA 1 1 37 22460 1 1 6 THR CB C -2.023 10.967 -1.379 1.00 . A A . 6 THR CB 1 1 37 22461 1 1 6 THR CG2 C -2.726 11.564 -2.580 1.00 . A A . 6 THR CG2 1 1 37 22462 1 1 6 THR H H -3.932 10.635 0.255 1.00 . A A . 6 THR H 1 1 37 22463 1 1 6 THR HA H -2.979 9.115 -1.858 1.00 . A A . 6 THR HA 1 1 37 22464 1 1 6 THR HB H -0.975 10.872 -1.622 1.00 . A A . 6 THR HB 1 1 37 22465 1 1 6 THR HG1 H -1.281 12.200 -0.051 1.00 . A A . 6 THR HG1 1 1 37 22466 1 1 6 THR HG21 H -3.357 10.815 -3.036 1.00 . A A . 6 THR HG21 1 1 37 22467 1 1 6 THR HG22 H -3.331 12.401 -2.264 1.00 . A A . 6 THR HG22 1 1 37 22468 1 1 6 THR HG23 H -1.991 11.900 -3.296 1.00 . A A . 6 THR HG23 1 1 37 22469 1 1 6 THR N N -3.639 9.736 -0.004 1.00 . A A . 6 THR N 1 1 37 22470 1 1 6 THR O O -1.101 8.794 0.746 1.00 . A A . 6 THR O 1 1 37 22471 1 1 6 THR OG1 O -2.150 11.885 -0.307 1.00 . A A . 6 THR OG1 1 1 37 22472 1 1 7 GLY C C 0.511 5.944 -1.913 1.00 . A A . 7 GLY C 1 1 37 22473 1 1 7 GLY CA C 0.233 7.038 -0.899 1.00 . A A . 7 GLY CA 1 1 37 22474 1 1 7 GLY H H -1.163 7.898 -2.238 1.00 . A A . 7 GLY H 1 1 37 22475 1 1 7 GLY HA2 H -0.022 6.582 0.045 1.00 . A A . 7 GLY HA2 1 1 37 22476 1 1 7 GLY HA3 H 1.127 7.631 -0.771 1.00 . A A . 7 GLY HA3 1 1 37 22477 1 1 7 GLY N N -0.852 7.909 -1.309 1.00 . A A . 7 GLY N 1 1 37 22478 1 1 7 GLY O O -0.176 5.849 -2.930 1.00 . A A . 7 GLY O 1 1 37 22479 1 1 8 PRO C C 0.813 2.908 -2.608 1.00 . A A . 8 PRO C 1 1 37 22480 1 1 8 PRO CA C 1.877 4.000 -2.572 1.00 . A A . 8 PRO CA 1 1 37 22481 1 1 8 PRO CB C 3.182 3.456 -1.985 1.00 . A A . 8 PRO CB 1 1 37 22482 1 1 8 PRO CD C 2.393 5.131 -0.474 1.00 . A A . 8 PRO CD 1 1 37 22483 1 1 8 PRO CG C 3.130 3.822 -0.542 1.00 . A A . 8 PRO CG 1 1 37 22484 1 1 8 PRO HA H 2.053 4.361 -3.575 1.00 . A A . 8 PRO HA 1 1 37 22485 1 1 8 PRO HB2 H 3.222 2.385 -2.120 1.00 . A A . 8 PRO HB2 1 1 37 22486 1 1 8 PRO HB3 H 4.023 3.919 -2.478 1.00 . A A . 8 PRO HB3 1 1 37 22487 1 1 8 PRO HD2 H 1.808 5.188 0.433 1.00 . A A . 8 PRO HD2 1 1 37 22488 1 1 8 PRO HD3 H 3.086 5.957 -0.530 1.00 . A A . 8 PRO HD3 1 1 37 22489 1 1 8 PRO HG2 H 2.597 3.063 0.011 1.00 . A A . 8 PRO HG2 1 1 37 22490 1 1 8 PRO HG3 H 4.132 3.935 -0.155 1.00 . A A . 8 PRO HG3 1 1 37 22491 1 1 8 PRO N N 1.521 5.093 -1.662 1.00 . A A . 8 PRO N 1 1 37 22492 1 1 8 PRO O O 0.655 2.214 -3.613 1.00 . A A . 8 PRO O 1 1 37 22493 1 1 9 CYS C C -2.338 2.379 -1.622 1.00 . A A . 9 CYS C 1 1 37 22494 1 1 9 CYS CA C -0.963 1.753 -1.410 1.00 . A A . 9 CYS CA 1 1 37 22495 1 1 9 CYS CB C -0.909 1.060 -0.047 1.00 . A A . 9 CYS CB 1 1 37 22496 1 1 9 CYS H H 0.260 3.344 -0.737 1.00 . A A . 9 CYS H 1 1 37 22497 1 1 9 CYS HA H -0.791 1.020 -2.184 1.00 . A A . 9 CYS HA 1 1 37 22498 1 1 9 CYS HB2 H 0.098 0.715 0.133 1.00 . A A . 9 CYS HB2 1 1 37 22499 1 1 9 CYS HB3 H -1.183 1.770 0.720 1.00 . A A . 9 CYS HB3 1 1 37 22500 1 1 9 CYS N N 0.086 2.761 -1.505 1.00 . A A . 9 CYS N 1 1 37 22501 1 1 9 CYS O O -3.302 2.033 -0.939 1.00 . A A . 9 CYS O 1 1 37 22502 1 1 9 CYS SG S -2.020 -0.376 0.103 1.00 . A A . 9 CYS SG 1 1 37 22503 1 1 10 CYS C C -3.804 4.255 -4.368 1.00 . A A . 10 CYS C 1 1 37 22504 1 1 10 CYS CA C -3.678 3.980 -2.873 1.00 . A A . 10 CYS CA 1 1 37 22505 1 1 10 CYS CB C -3.771 5.292 -2.092 1.00 . A A . 10 CYS CB 1 1 37 22506 1 1 10 CYS H H -1.618 3.538 -3.083 1.00 . A A . 10 CYS H 1 1 37 22507 1 1 10 CYS HA H -4.485 3.331 -2.568 1.00 . A A . 10 CYS HA 1 1 37 22508 1 1 10 CYS HB2 H -3.044 5.279 -1.295 1.00 . A A . 10 CYS HB2 1 1 37 22509 1 1 10 CYS HB3 H -3.553 6.114 -2.757 1.00 . A A . 10 CYS HB3 1 1 37 22510 1 1 10 CYS N N -2.421 3.304 -2.572 1.00 . A A . 10 CYS N 1 1 37 22511 1 1 10 CYS O O -3.058 5.059 -4.926 1.00 . A A . 10 CYS O 1 1 37 22512 1 1 10 CYS SG S -5.404 5.603 -1.344 1.00 . A A . 10 CYS SG 1 1 37 22513 1 1 11 ARG C C -5.519 5.161 -6.731 1.00 . A A . 11 ARG C 1 1 37 22514 1 1 11 ARG CA C -4.980 3.764 -6.439 1.00 . A A . 11 ARG CA 1 1 37 22515 1 1 11 ARG CB C -5.956 2.707 -6.960 1.00 . A A . 11 ARG CB 1 1 37 22516 1 1 11 ARG CD C -6.221 3.271 -9.394 1.00 . A A . 11 ARG CD 1 1 37 22517 1 1 11 ARG CG C -5.674 2.271 -8.389 1.00 . A A . 11 ARG CG 1 1 37 22518 1 1 11 ARG CZ C -5.120 2.456 -11.442 1.00 . A A . 11 ARG CZ 1 1 37 22519 1 1 11 ARG H H -5.321 2.961 -4.511 1.00 . A A . 11 ARG H 1 1 37 22520 1 1 11 ARG HA H -4.031 3.645 -6.941 1.00 . A A . 11 ARG HA 1 1 37 22521 1 1 11 ARG HB2 H -5.899 1.837 -6.323 1.00 . A A . 11 ARG HB2 1 1 37 22522 1 1 11 ARG HB3 H -6.958 3.107 -6.919 1.00 . A A . 11 ARG HB3 1 1 37 22523 1 1 11 ARG HD2 H -7.189 2.932 -9.731 1.00 . A A . 11 ARG HD2 1 1 37 22524 1 1 11 ARG HD3 H -6.326 4.230 -8.908 1.00 . A A . 11 ARG HD3 1 1 37 22525 1 1 11 ARG HE H -4.895 4.283 -10.672 1.00 . A A . 11 ARG HE 1 1 37 22526 1 1 11 ARG HG2 H -4.607 2.186 -8.525 1.00 . A A . 11 ARG HG2 1 1 37 22527 1 1 11 ARG HG3 H -6.139 1.311 -8.560 1.00 . A A . 11 ARG HG3 1 1 37 22528 1 1 11 ARG HH11 H -6.323 1.102 -10.541 1.00 . A A . 11 ARG HH11 1 1 37 22529 1 1 11 ARG HH12 H -5.536 0.553 -11.983 1.00 . A A . 11 ARG HH12 1 1 37 22530 1 1 11 ARG HH21 H -3.860 3.564 -12.569 1.00 . A A . 11 ARG HH21 1 1 37 22531 1 1 11 ARG HH22 H -4.138 1.950 -13.135 1.00 . A A . 11 ARG HH22 1 1 37 22532 1 1 11 ARG N N -4.756 3.587 -5.010 1.00 . A A . 11 ARG N 1 1 37 22533 1 1 11 ARG NE N -5.343 3.420 -10.552 1.00 . A A . 11 ARG NE 1 1 37 22534 1 1 11 ARG NH1 N -5.708 1.273 -11.311 1.00 . A A . 11 ARG NH1 1 1 37 22535 1 1 11 ARG NH2 N -4.306 2.674 -12.466 1.00 . A A . 11 ARG NH2 1 1 37 22536 1 1 11 ARG O O -6.710 5.336 -6.990 1.00 . A A . 11 ARG O 1 1 37 22537 1 1 12 GLN C C -5.867 8.089 -5.803 1.00 . A A . 12 GLN C 1 1 37 22538 1 1 12 GLN CA C -5.017 7.539 -6.941 1.00 . A A . 12 GLN CA 1 1 37 22539 1 1 12 GLN CB C -5.780 7.650 -8.264 1.00 . A A . 12 GLN CB 1 1 37 22540 1 1 12 GLN CD C -6.376 9.105 -10.242 1.00 . A A . 12 GLN CD 1 1 37 22541 1 1 12 GLN CG C -5.468 8.919 -9.042 1.00 . A A . 12 GLN CG 1 1 37 22542 1 1 12 GLN H H -3.700 5.949 -6.471 1.00 . A A . 12 GLN H 1 1 37 22543 1 1 12 GLN HA H -4.115 8.122 -7.009 1.00 . A A . 12 GLN HA 1 1 37 22544 1 1 12 GLN HB2 H -5.529 6.803 -8.884 1.00 . A A . 12 GLN HB2 1 1 37 22545 1 1 12 GLN HB3 H -6.840 7.632 -8.058 1.00 . A A . 12 GLN HB3 1 1 37 22546 1 1 12 GLN HE21 H -5.158 10.493 -10.979 1.00 . A A . 12 GLN HE21 1 1 37 22547 1 1 12 GLN HE22 H -6.561 10.147 -11.925 1.00 . A A . 12 GLN HE22 1 1 37 22548 1 1 12 GLN HG2 H -5.588 9.767 -8.385 1.00 . A A . 12 GLN HG2 1 1 37 22549 1 1 12 GLN HG3 H -4.446 8.872 -9.386 1.00 . A A . 12 GLN HG3 1 1 37 22550 1 1 12 GLN N N -4.634 6.153 -6.685 1.00 . A A . 12 GLN N 1 1 37 22551 1 1 12 GLN NE2 N -5.993 10.006 -11.139 1.00 . A A . 12 GLN NE2 1 1 37 22552 1 1 12 GLN O O -5.458 9.008 -5.094 1.00 . A A . 12 GLN O 1 1 37 22553 1 1 12 GLN OE1 O -7.410 8.447 -10.361 1.00 . A A . 12 GLN OE1 1 1 37 22554 1 1 13 CYS C C -8.796 6.768 -4.075 1.00 . A A . 13 CYS C 1 1 37 22555 1 1 13 CYS CA C -7.968 7.944 -4.585 1.00 . A A . 13 CYS CA 1 1 37 22556 1 1 13 CYS CB C -8.894 9.046 -5.103 1.00 . A A . 13 CYS CB 1 1 37 22557 1 1 13 CYS H H -7.315 6.792 -6.235 1.00 . A A . 13 CYS H 1 1 37 22558 1 1 13 CYS HA H -7.379 8.335 -3.769 1.00 . A A . 13 CYS HA 1 1 37 22559 1 1 13 CYS HB2 H -9.042 8.912 -6.164 1.00 . A A . 13 CYS HB2 1 1 37 22560 1 1 13 CYS HB3 H -9.847 8.972 -4.600 1.00 . A A . 13 CYS HB3 1 1 37 22561 1 1 13 CYS N N -7.052 7.518 -5.636 1.00 . A A . 13 CYS N 1 1 37 22562 1 1 13 CYS O O -9.927 6.944 -3.620 1.00 . A A . 13 CYS O 1 1 37 22563 1 1 13 CYS SG S -8.259 10.735 -4.843 1.00 . A A . 13 CYS SG 1 1 37 22564 1 1 14 LYS C C -7.944 3.410 -3.019 1.00 . A A . 14 LYS C 1 1 37 22565 1 1 14 LYS CA C -8.916 4.366 -3.701 1.00 . A A . 14 LYS CA 1 1 37 22566 1 1 14 LYS CB C -9.596 3.667 -4.879 1.00 . A A . 14 LYS CB 1 1 37 22567 1 1 14 LYS CD C -11.798 3.255 -6.017 1.00 . A A . 14 LYS CD 1 1 37 22568 1 1 14 LYS CE C -11.185 2.969 -7.378 1.00 . A A . 14 LYS CE 1 1 37 22569 1 1 14 LYS CG C -10.959 4.244 -5.225 1.00 . A A . 14 LYS CG 1 1 37 22570 1 1 14 LYS H H -7.324 5.490 -4.526 1.00 . A A . 14 LYS H 1 1 37 22571 1 1 14 LYS HA H -9.669 4.665 -2.987 1.00 . A A . 14 LYS HA 1 1 37 22572 1 1 14 LYS HB2 H -8.961 3.752 -5.748 1.00 . A A . 14 LYS HB2 1 1 37 22573 1 1 14 LYS HB3 H -9.722 2.622 -4.638 1.00 . A A . 14 LYS HB3 1 1 37 22574 1 1 14 LYS HD2 H -11.866 2.330 -5.463 1.00 . A A . 14 LYS HD2 1 1 37 22575 1 1 14 LYS HD3 H -12.787 3.667 -6.157 1.00 . A A . 14 LYS HD3 1 1 37 22576 1 1 14 LYS HE2 H -11.978 2.875 -8.104 1.00 . A A . 14 LYS HE2 1 1 37 22577 1 1 14 LYS HE3 H -10.544 3.795 -7.651 1.00 . A A . 14 LYS HE3 1 1 37 22578 1 1 14 LYS HG2 H -11.478 4.489 -4.310 1.00 . A A . 14 LYS HG2 1 1 37 22579 1 1 14 LYS HG3 H -10.821 5.139 -5.814 1.00 . A A . 14 LYS HG3 1 1 37 22580 1 1 14 LYS HZ1 H -9.966 1.560 -6.434 1.00 . A A . 14 LYS HZ1 1 1 37 22581 1 1 14 LYS HZ2 H -10.987 0.903 -7.612 1.00 . A A . 14 LYS HZ2 1 1 37 22582 1 1 14 LYS HZ3 H -9.616 1.778 -8.074 1.00 . A A . 14 LYS HZ3 1 1 37 22583 1 1 14 LYS N N -8.228 5.569 -4.154 1.00 . A A . 14 LYS N 1 1 37 22584 1 1 14 LYS NZ N -10.382 1.715 -7.374 1.00 . A A . 14 LYS NZ 1 1 37 22585 1 1 14 LYS O O -6.787 3.292 -3.423 1.00 . A A . 14 LYS O 1 1 37 22586 1 1 15 LEU C C -7.086 0.674 -2.159 1.00 . A A . 15 LEU C 1 1 37 22587 1 1 15 LEU CA C -7.593 1.782 -1.244 1.00 . A A . 15 LEU CA 1 1 37 22588 1 1 15 LEU CB C -8.383 1.179 -0.082 1.00 . A A . 15 LEU CB 1 1 37 22589 1 1 15 LEU CD1 C -6.560 -0.373 0.661 1.00 . A A . 15 LEU CD1 1 1 37 22590 1 1 15 LEU CD2 C -6.794 1.879 1.723 1.00 . A A . 15 LEU CD2 1 1 37 22591 1 1 15 LEU CG C -7.537 0.707 1.101 1.00 . A A . 15 LEU CG 1 1 37 22592 1 1 15 LEU H H -9.352 2.866 -1.707 1.00 . A A . 15 LEU H 1 1 37 22593 1 1 15 LEU HA H -6.746 2.321 -0.850 1.00 . A A . 15 LEU HA 1 1 37 22594 1 1 15 LEU HB2 H -9.080 1.924 0.275 1.00 . A A . 15 LEU HB2 1 1 37 22595 1 1 15 LEU HB3 H -8.943 0.335 -0.454 1.00 . A A . 15 LEU HB3 1 1 37 22596 1 1 15 LEU HD11 H -7.076 -1.095 0.045 1.00 . A A . 15 LEU HD11 1 1 37 22597 1 1 15 LEU HD12 H -5.758 0.077 0.094 1.00 . A A . 15 LEU HD12 1 1 37 22598 1 1 15 LEU HD13 H -6.153 -0.866 1.531 1.00 . A A . 15 LEU HD13 1 1 37 22599 1 1 15 LEU HD21 H -7.313 2.798 1.492 1.00 . A A . 15 LEU HD21 1 1 37 22600 1 1 15 LEU HD22 H -6.749 1.750 2.794 1.00 . A A . 15 LEU HD22 1 1 37 22601 1 1 15 LEU HD23 H -5.791 1.922 1.324 1.00 . A A . 15 LEU HD23 1 1 37 22602 1 1 15 LEU HG H -8.186 0.283 1.853 1.00 . A A . 15 LEU HG 1 1 37 22603 1 1 15 LEU N N -8.421 2.729 -1.982 1.00 . A A . 15 LEU N 1 1 37 22604 1 1 15 LEU O O -7.865 -0.135 -2.663 1.00 . A A . 15 LEU O 1 1 37 22605 1 1 16 LYS C C -5.481 -1.774 -2.715 1.00 . A A . 16 LYS C 1 1 37 22606 1 1 16 LYS CA C -5.161 -0.368 -3.223 1.00 . A A . 16 LYS CA 1 1 37 22607 1 1 16 LYS CB C -3.645 -0.165 -3.277 1.00 . A A . 16 LYS CB 1 1 37 22608 1 1 16 LYS CD C -2.505 -0.554 -5.485 1.00 . A A . 16 LYS CD 1 1 37 22609 1 1 16 LYS CE C -3.654 -0.534 -6.481 1.00 . A A . 16 LYS CE 1 1 37 22610 1 1 16 LYS CG C -2.926 -1.172 -4.161 1.00 . A A . 16 LYS CG 1 1 37 22611 1 1 16 LYS H H -5.204 1.314 -1.939 1.00 . A A . 16 LYS H 1 1 37 22612 1 1 16 LYS HA H -5.567 -0.250 -4.216 1.00 . A A . 16 LYS HA 1 1 37 22613 1 1 16 LYS HB2 H -3.440 0.826 -3.656 1.00 . A A . 16 LYS HB2 1 1 37 22614 1 1 16 LYS HB3 H -3.247 -0.248 -2.277 1.00 . A A . 16 LYS HB3 1 1 37 22615 1 1 16 LYS HD2 H -2.176 0.459 -5.310 1.00 . A A . 16 LYS HD2 1 1 37 22616 1 1 16 LYS HD3 H -1.692 -1.133 -5.898 1.00 . A A . 16 LYS HD3 1 1 37 22617 1 1 16 LYS HE2 H -4.583 -0.453 -5.937 1.00 . A A . 16 LYS HE2 1 1 37 22618 1 1 16 LYS HE3 H -3.539 0.326 -7.125 1.00 . A A . 16 LYS HE3 1 1 37 22619 1 1 16 LYS HG2 H -2.046 -1.525 -3.645 1.00 . A A . 16 LYS HG2 1 1 37 22620 1 1 16 LYS HG3 H -3.589 -2.003 -4.356 1.00 . A A . 16 LYS HG3 1 1 37 22621 1 1 16 LYS HZ1 H -3.511 -2.603 -6.725 1.00 . A A . 16 LYS HZ1 1 1 37 22622 1 1 16 LYS HZ2 H -4.617 -1.864 -7.772 1.00 . A A . 16 LYS HZ2 1 1 37 22623 1 1 16 LYS HZ3 H -2.956 -1.717 -8.054 1.00 . A A . 16 LYS HZ3 1 1 37 22624 1 1 16 LYS N N -5.774 0.642 -2.369 1.00 . A A . 16 LYS N 1 1 37 22625 1 1 16 LYS NZ N -3.687 -1.765 -7.316 1.00 . A A . 16 LYS NZ 1 1 37 22626 1 1 16 LYS O O -5.354 -2.053 -1.523 1.00 . A A . 16 LYS O 1 1 37 22627 1 1 17 PRO C C -5.141 -4.726 -2.417 1.00 . A A . 17 PRO C 1 1 37 22628 1 1 17 PRO CA C -6.240 -4.061 -3.239 1.00 . A A . 17 PRO CA 1 1 37 22629 1 1 17 PRO CB C -6.399 -4.766 -4.587 1.00 . A A . 17 PRO CB 1 1 37 22630 1 1 17 PRO CD C -6.086 -2.443 -5.058 1.00 . A A . 17 PRO CD 1 1 37 22631 1 1 17 PRO CG C -6.790 -3.685 -5.534 1.00 . A A . 17 PRO CG 1 1 37 22632 1 1 17 PRO HA H -7.171 -4.106 -2.694 1.00 . A A . 17 PRO HA 1 1 37 22633 1 1 17 PRO HB2 H -5.461 -5.221 -4.871 1.00 . A A . 17 PRO HB2 1 1 37 22634 1 1 17 PRO HB3 H -7.166 -5.522 -4.514 1.00 . A A . 17 PRO HB3 1 1 37 22635 1 1 17 PRO HD2 H -5.133 -2.337 -5.555 1.00 . A A . 17 PRO HD2 1 1 37 22636 1 1 17 PRO HD3 H -6.701 -1.572 -5.228 1.00 . A A . 17 PRO HD3 1 1 37 22637 1 1 17 PRO HG2 H -6.469 -3.938 -6.533 1.00 . A A . 17 PRO HG2 1 1 37 22638 1 1 17 PRO HG3 H -7.860 -3.542 -5.506 1.00 . A A . 17 PRO HG3 1 1 37 22639 1 1 17 PRO N N -5.903 -2.684 -3.613 1.00 . A A . 17 PRO N 1 1 37 22640 1 1 17 PRO O O -3.953 -4.547 -2.689 1.00 . A A . 17 PRO O 1 1 37 22641 1 1 18 ALA C C -3.678 -7.097 -1.359 1.00 . A A . 18 ALA C 1 1 37 22642 1 1 18 ALA CA C -4.595 -6.187 -0.547 1.00 . A A . 18 ALA CA 1 1 37 22643 1 1 18 ALA CB C -5.334 -6.991 0.513 1.00 . A A . 18 ALA CB 1 1 37 22644 1 1 18 ALA H H -6.505 -5.598 -1.243 1.00 . A A . 18 ALA H 1 1 37 22645 1 1 18 ALA HA H -3.994 -5.442 -0.045 1.00 . A A . 18 ALA HA 1 1 37 22646 1 1 18 ALA HB1 H -6.106 -6.379 0.955 1.00 . A A . 18 ALA HB1 1 1 37 22647 1 1 18 ALA HB2 H -4.639 -7.303 1.278 1.00 . A A . 18 ALA HB2 1 1 37 22648 1 1 18 ALA HB3 H -5.782 -7.861 0.057 1.00 . A A . 18 ALA HB3 1 1 37 22649 1 1 18 ALA N N -5.545 -5.494 -1.409 1.00 . A A . 18 ALA N 1 1 37 22650 1 1 18 ALA O O -4.081 -7.640 -2.387 1.00 . A A . 18 ALA O 1 1 37 22651 1 1 19 GLY C C -0.587 -7.308 -2.514 1.00 . A A . 19 GLY C 1 1 37 22652 1 1 19 GLY CA C -1.492 -8.099 -1.590 1.00 . A A . 19 GLY CA 1 1 37 22653 1 1 19 GLY H H -2.179 -6.797 -0.068 1.00 . A A . 19 GLY H 1 1 37 22654 1 1 19 GLY HA2 H -2.034 -8.829 -2.173 1.00 . A A . 19 GLY HA2 1 1 37 22655 1 1 19 GLY HA3 H -0.883 -8.614 -0.862 1.00 . A A . 19 GLY HA3 1 1 37 22656 1 1 19 GLY N N -2.445 -7.256 -0.892 1.00 . A A . 19 GLY N 1 1 37 22657 1 1 19 GLY O O 0.526 -7.736 -2.820 1.00 . A A . 19 GLY O 1 1 37 22658 1 1 20 THR C C 0.909 -4.696 -3.129 1.00 . A A . 20 THR C 1 1 37 22659 1 1 20 THR CA C -0.290 -5.297 -3.855 1.00 . A A . 20 THR CA 1 1 37 22660 1 1 20 THR CB C -1.172 -4.181 -4.418 1.00 . A A . 20 THR CB 1 1 37 22661 1 1 20 THR CG2 C -0.449 -3.283 -5.398 1.00 . A A . 20 THR CG2 1 1 37 22662 1 1 20 THR H H -1.958 -5.861 -2.681 1.00 . A A . 20 THR H 1 1 37 22663 1 1 20 THR HA H 0.066 -5.909 -4.670 1.00 . A A . 20 THR HA 1 1 37 22664 1 1 20 THR HB H -1.521 -3.566 -3.601 1.00 . A A . 20 THR HB 1 1 37 22665 1 1 20 THR HG1 H -3.102 -4.342 -4.711 1.00 . A A . 20 THR HG1 1 1 37 22666 1 1 20 THR HG21 H 0.411 -3.802 -5.795 1.00 . A A . 20 THR HG21 1 1 37 22667 1 1 20 THR HG22 H -1.116 -3.022 -6.206 1.00 . A A . 20 THR HG22 1 1 37 22668 1 1 20 THR HG23 H -0.126 -2.385 -4.893 1.00 . A A . 20 THR HG23 1 1 37 22669 1 1 20 THR N N -1.064 -6.150 -2.960 1.00 . A A . 20 THR N 1 1 37 22670 1 1 20 THR O O 0.756 -3.831 -2.267 1.00 . A A . 20 THR O 1 1 37 22671 1 1 20 THR OG1 O -2.301 -4.721 -5.081 1.00 . A A . 20 THR OG1 1 1 37 22672 1 1 21 THR C C 3.715 -3.308 -3.433 1.00 . A A . 21 THR C 1 1 37 22673 1 1 21 THR CA C 3.328 -4.671 -2.865 1.00 . A A . 21 THR CA 1 1 37 22674 1 1 21 THR CB C 4.470 -5.670 -3.075 1.00 . A A . 21 THR CB 1 1 37 22675 1 1 21 THR CG2 C 5.129 -6.102 -1.783 1.00 . A A . 21 THR CG2 1 1 37 22676 1 1 21 THR H H 2.160 -5.853 -4.177 1.00 . A A . 21 THR H 1 1 37 22677 1 1 21 THR HA H 3.144 -4.566 -1.807 1.00 . A A . 21 THR HA 1 1 37 22678 1 1 21 THR HB H 5.228 -5.213 -3.695 1.00 . A A . 21 THR HB 1 1 37 22679 1 1 21 THR HG1 H 3.943 -6.673 -4.673 1.00 . A A . 21 THR HG1 1 1 37 22680 1 1 21 THR HG21 H 4.370 -6.386 -1.069 1.00 . A A . 21 THR HG21 1 1 37 22681 1 1 21 THR HG22 H 5.778 -6.944 -1.973 1.00 . A A . 21 THR HG22 1 1 37 22682 1 1 21 THR HG23 H 5.710 -5.284 -1.384 1.00 . A A . 21 THR HG23 1 1 37 22683 1 1 21 THR N N 2.102 -5.162 -3.484 1.00 . A A . 21 THR N 1 1 37 22684 1 1 21 THR O O 3.699 -3.103 -4.646 1.00 . A A . 21 THR O 1 1 37 22685 1 1 21 THR OG1 O 4.005 -6.838 -3.729 1.00 . A A . 21 THR OG1 1 1 37 22686 1 1 22 CYS C C 5.899 -1.014 -3.437 1.00 . A A . 22 CYS C 1 1 37 22687 1 1 22 CYS CA C 4.451 -1.038 -2.957 1.00 . A A . 22 CYS CA 1 1 37 22688 1 1 22 CYS CB C 4.268 -0.054 -1.800 1.00 . A A . 22 CYS CB 1 1 37 22689 1 1 22 CYS H H 4.053 -2.605 -1.592 1.00 . A A . 22 CYS H 1 1 37 22690 1 1 22 CYS HA H 3.809 -0.742 -3.774 1.00 . A A . 22 CYS HA 1 1 37 22691 1 1 22 CYS HB2 H 4.581 0.928 -2.120 1.00 . A A . 22 CYS HB2 1 1 37 22692 1 1 22 CYS HB3 H 3.224 -0.023 -1.526 1.00 . A A . 22 CYS HB3 1 1 37 22693 1 1 22 CYS N N 4.061 -2.381 -2.546 1.00 . A A . 22 CYS N 1 1 37 22694 1 1 22 CYS O O 6.225 -0.359 -4.426 1.00 . A A . 22 CYS O 1 1 37 22695 1 1 22 CYS SG S 5.222 -0.478 -0.306 1.00 . A A . 22 CYS SG 1 1 37 22696 1 1 23 TRP C C 8.446 -2.941 -4.049 1.00 . A A . 23 TRP C 1 1 37 22697 1 1 23 TRP CA C 8.176 -1.795 -3.082 1.00 . A A . 23 TRP CA 1 1 37 22698 1 1 23 TRP CB C 9.032 -1.958 -1.824 1.00 . A A . 23 TRP CB 1 1 37 22699 1 1 23 TRP CD1 C 10.414 0.124 -2.390 1.00 . A A . 23 TRP CD1 1 1 37 22700 1 1 23 TRP CD2 C 11.541 -1.450 -1.265 1.00 . A A . 23 TRP CD2 1 1 37 22701 1 1 23 TRP CE2 C 12.407 -0.368 -1.512 1.00 . A A . 23 TRP CE2 1 1 37 22702 1 1 23 TRP CE3 C 12.031 -2.559 -0.569 1.00 . A A . 23 TRP CE3 1 1 37 22703 1 1 23 TRP CG C 10.271 -1.115 -1.834 1.00 . A A . 23 TRP CG 1 1 37 22704 1 1 23 TRP CH2 C 14.186 -1.463 -0.408 1.00 . A A . 23 TRP CH2 1 1 37 22705 1 1 23 TRP CZ2 C 13.734 -0.364 -1.087 1.00 . A A . 23 TRP CZ2 1 1 37 22706 1 1 23 TRP CZ3 C 13.347 -2.554 -0.148 1.00 . A A . 23 TRP CZ3 1 1 37 22707 1 1 23 TRP H H 6.443 -2.234 -1.949 1.00 . A A . 23 TRP H 1 1 37 22708 1 1 23 TRP HA H 8.437 -0.868 -3.564 1.00 . A A . 23 TRP HA 1 1 37 22709 1 1 23 TRP HB2 H 8.447 -1.679 -0.960 1.00 . A A . 23 TRP HB2 1 1 37 22710 1 1 23 TRP HB3 H 9.332 -2.992 -1.731 1.00 . A A . 23 TRP HB3 1 1 37 22711 1 1 23 TRP HD1 H 9.626 0.656 -2.902 1.00 . A A . 23 TRP HD1 1 1 37 22712 1 1 23 TRP HE1 H 12.045 1.443 -2.506 1.00 . A A . 23 TRP HE1 1 1 37 22713 1 1 23 TRP HE3 H 11.399 -3.410 -0.359 1.00 . A A . 23 TRP HE3 1 1 37 22714 1 1 23 TRP HH2 H 15.208 -1.502 -0.062 1.00 . A A . 23 TRP HH2 1 1 37 22715 1 1 23 TRP HZ2 H 14.393 0.469 -1.279 1.00 . A A . 23 TRP HZ2 1 1 37 22716 1 1 23 TRP HZ3 H 13.743 -3.403 0.390 1.00 . A A . 23 TRP HZ3 1 1 37 22717 1 1 23 TRP N N 6.763 -1.733 -2.728 1.00 . A A . 23 TRP N 1 1 37 22718 1 1 23 TRP NE1 N 11.696 0.580 -2.200 1.00 . A A . 23 TRP NE1 1 1 37 22719 1 1 23 TRP O O 8.751 -2.722 -5.221 1.00 . A A . 23 TRP O 1 1 37 22720 1 1 24 ARG C C 9.981 -5.365 -4.914 1.00 . A A . 24 ARG C 1 1 37 22721 1 1 24 ARG CA C 8.560 -5.351 -4.360 1.00 . A A . 24 ARG CA 1 1 37 22722 1 1 24 ARG CB C 7.551 -5.411 -5.508 1.00 . A A . 24 ARG CB 1 1 37 22723 1 1 24 ARG CD C 8.181 -7.427 -6.869 1.00 . A A . 24 ARG CD 1 1 37 22724 1 1 24 ARG CG C 7.168 -6.827 -5.908 1.00 . A A . 24 ARG CG 1 1 37 22725 1 1 24 ARG CZ C 9.352 -9.574 -7.175 1.00 . A A . 24 ARG CZ 1 1 37 22726 1 1 24 ARG H H 8.085 -4.266 -2.605 1.00 . A A . 24 ARG H 1 1 37 22727 1 1 24 ARG HA H 8.424 -6.216 -3.728 1.00 . A A . 24 ARG HA 1 1 37 22728 1 1 24 ARG HB2 H 6.654 -4.888 -5.212 1.00 . A A . 24 ARG HB2 1 1 37 22729 1 1 24 ARG HB3 H 7.976 -4.919 -6.371 1.00 . A A . 24 ARG HB3 1 1 37 22730 1 1 24 ARG HD2 H 7.839 -7.263 -7.880 1.00 . A A . 24 ARG HD2 1 1 37 22731 1 1 24 ARG HD3 H 9.130 -6.934 -6.726 1.00 . A A . 24 ARG HD3 1 1 37 22732 1 1 24 ARG HE H 7.693 -9.320 -6.095 1.00 . A A . 24 ARG HE 1 1 37 22733 1 1 24 ARG HG2 H 7.121 -7.440 -5.021 1.00 . A A . 24 ARG HG2 1 1 37 22734 1 1 24 ARG HG3 H 6.199 -6.806 -6.385 1.00 . A A . 24 ARG HG3 1 1 37 22735 1 1 24 ARG HH11 H 10.210 -8.008 -8.126 1.00 . A A . 24 ARG HH11 1 1 37 22736 1 1 24 ARG HH12 H 11.014 -9.528 -8.325 1.00 . A A . 24 ARG HH12 1 1 37 22737 1 1 24 ARG HH21 H 8.750 -11.320 -6.355 1.00 . A A . 24 ARG HH21 1 1 37 22738 1 1 24 ARG HH22 H 10.186 -11.409 -7.320 1.00 . A A . 24 ARG HH22 1 1 37 22739 1 1 24 ARG N N 8.331 -4.162 -3.546 1.00 . A A . 24 ARG N 1 1 37 22740 1 1 24 ARG NE N 8.354 -8.862 -6.655 1.00 . A A . 24 ARG NE 1 1 37 22741 1 1 24 ARG NH1 N 10.267 -8.988 -7.938 1.00 . A A . 24 ARG NH1 1 1 37 22742 1 1 24 ARG NH2 N 9.436 -10.874 -6.930 1.00 . A A . 24 ARG NH2 1 1 37 22743 1 1 24 ARG O O 10.211 -5.005 -6.069 1.00 . A A . 24 ARG O 1 1 37 22744 1 1 25 THR C C 12.762 -7.286 -4.738 1.00 . A A . 25 THR C 1 1 37 22745 1 1 25 THR CA C 12.329 -5.845 -4.491 1.00 . A A . 25 THR CA 1 1 37 22746 1 1 25 THR CB C 13.221 -5.205 -3.426 1.00 . A A . 25 THR CB 1 1 37 22747 1 1 25 THR CG2 C 13.325 -3.701 -3.558 1.00 . A A . 25 THR CG2 1 1 37 22748 1 1 25 THR H H 10.685 -6.058 -3.176 1.00 . A A . 25 THR H 1 1 37 22749 1 1 25 THR HA H 12.430 -5.292 -5.410 1.00 . A A . 25 THR HA 1 1 37 22750 1 1 25 THR HB H 14.218 -5.614 -3.512 1.00 . A A . 25 THR HB 1 1 37 22751 1 1 25 THR HG1 H 13.307 -5.081 -1.473 1.00 . A A . 25 THR HG1 1 1 37 22752 1 1 25 THR HG21 H 13.525 -3.442 -4.587 1.00 . A A . 25 THR HG21 1 1 37 22753 1 1 25 THR HG22 H 12.396 -3.247 -3.247 1.00 . A A . 25 THR HG22 1 1 37 22754 1 1 25 THR HG23 H 14.129 -3.339 -2.934 1.00 . A A . 25 THR HG23 1 1 37 22755 1 1 25 THR N N 10.931 -5.784 -4.084 1.00 . A A . 25 THR N 1 1 37 22756 1 1 25 THR O O 12.859 -7.730 -5.882 1.00 . A A . 25 THR O 1 1 37 22757 1 1 25 THR OG1 O 12.734 -5.489 -2.127 1.00 . A A . 25 THR OG1 1 1 37 22758 1 1 26 SER C C 13.611 -10.015 -2.362 1.00 . A A . 26 SER C 1 1 37 22759 1 1 26 SER CA C 13.442 -9.403 -3.749 1.00 . A A . 26 SER CA 1 1 37 22760 1 1 26 SER CB C 14.754 -9.510 -4.529 1.00 . A A . 26 SER CB 1 1 37 22761 1 1 26 SER H H 12.923 -7.597 -2.774 1.00 . A A . 26 SER H 1 1 37 22762 1 1 26 SER HA H 12.675 -9.947 -4.276 1.00 . A A . 26 SER HA 1 1 37 22763 1 1 26 SER HB2 H 15.236 -10.447 -4.292 1.00 . A A . 26 SER HB2 1 1 37 22764 1 1 26 SER HB3 H 14.544 -9.472 -5.588 1.00 . A A . 26 SER HB3 1 1 37 22765 1 1 26 SER HG H 15.577 -7.766 -4.871 1.00 . A A . 26 SER HG 1 1 37 22766 1 1 26 SER N N 13.020 -8.010 -3.656 1.00 . A A . 26 SER N 1 1 37 22767 1 1 26 SER O O 13.256 -11.171 -2.135 1.00 . A A . 26 SER O 1 1 37 22768 1 1 26 SER OG O 15.632 -8.449 -4.198 1.00 . A A . 26 SER OG 1 1 37 22769 1 1 27 VAL C C 13.159 -9.394 0.804 1.00 . A A . 27 VAL C 1 1 37 22770 1 1 27 VAL CA C 14.371 -9.690 -0.074 1.00 . A A . 27 VAL CA 1 1 37 22771 1 1 27 VAL CB C 15.621 -9.035 0.548 1.00 . A A . 27 VAL CB 1 1 37 22772 1 1 27 VAL CG1 C 15.458 -7.524 0.616 1.00 . A A . 27 VAL CG1 1 1 37 22773 1 1 27 VAL CG2 C 15.899 -9.613 1.928 1.00 . A A . 27 VAL CG2 1 1 37 22774 1 1 27 VAL H H 14.415 -8.318 -1.684 1.00 . A A . 27 VAL H 1 1 37 22775 1 1 27 VAL HA H 14.528 -10.759 -0.105 1.00 . A A . 27 VAL HA 1 1 37 22776 1 1 27 VAL HB H 16.468 -9.253 -0.086 1.00 . A A . 27 VAL HB 1 1 37 22777 1 1 27 VAL HG11 H 14.572 -7.283 1.186 1.00 . A A . 27 VAL HG11 1 1 37 22778 1 1 27 VAL HG12 H 16.323 -7.090 1.095 1.00 . A A . 27 VAL HG12 1 1 37 22779 1 1 27 VAL HG13 H 15.362 -7.127 -0.383 1.00 . A A . 27 VAL HG13 1 1 37 22780 1 1 27 VAL HG21 H 15.419 -10.576 2.018 1.00 . A A . 27 VAL HG21 1 1 37 22781 1 1 27 VAL HG22 H 16.964 -9.727 2.062 1.00 . A A . 27 VAL HG22 1 1 37 22782 1 1 27 VAL HG23 H 15.510 -8.945 2.682 1.00 . A A . 27 VAL HG23 1 1 37 22783 1 1 27 VAL N N 14.154 -9.229 -1.440 1.00 . A A . 27 VAL N 1 1 37 22784 1 1 27 VAL O O 12.866 -10.132 1.745 1.00 . A A . 27 VAL O 1 1 37 22785 1 1 28 SER C C 10.058 -7.802 0.341 1.00 . A A . 28 SER C 1 1 37 22786 1 1 28 SER CA C 11.277 -7.915 1.250 1.00 . A A . 28 SER CA 1 1 37 22787 1 1 28 SER CB C 11.524 -6.583 1.960 1.00 . A A . 28 SER CB 1 1 37 22788 1 1 28 SER H H 12.741 -7.761 -0.271 1.00 . A A . 28 SER H 1 1 37 22789 1 1 28 SER HA H 11.090 -8.678 1.991 1.00 . A A . 28 SER HA 1 1 37 22790 1 1 28 SER HB2 H 10.827 -6.479 2.779 1.00 . A A . 28 SER HB2 1 1 37 22791 1 1 28 SER HB3 H 12.534 -6.563 2.343 1.00 . A A . 28 SER HB3 1 1 37 22792 1 1 28 SER HG H 11.781 -5.686 0.238 1.00 . A A . 28 SER HG 1 1 37 22793 1 1 28 SER N N 12.458 -8.309 0.490 1.00 . A A . 28 SER N 1 1 37 22794 1 1 28 SER O O 10.168 -7.921 -0.879 1.00 . A A . 28 SER O 1 1 37 22795 1 1 28 SER OG O 11.349 -5.492 1.073 1.00 . A A . 28 SER OG 1 1 37 22796 1 1 29 SER C C 6.569 -6.788 1.035 1.00 . A A . 29 SER C 1 1 37 22797 1 1 29 SER CA C 7.655 -7.443 0.189 1.00 . A A . 29 SER CA 1 1 37 22798 1 1 29 SER CB C 7.183 -8.815 -0.295 1.00 . A A . 29 SER CB 1 1 37 22799 1 1 29 SER H H 8.872 -7.487 1.920 1.00 . A A . 29 SER H 1 1 37 22800 1 1 29 SER HA H 7.853 -6.817 -0.669 1.00 . A A . 29 SER HA 1 1 37 22801 1 1 29 SER HB2 H 6.659 -9.316 0.506 1.00 . A A . 29 SER HB2 1 1 37 22802 1 1 29 SER HB3 H 6.518 -8.688 -1.136 1.00 . A A . 29 SER HB3 1 1 37 22803 1 1 29 SER HG H 8.676 -10.027 0.077 1.00 . A A . 29 SER HG 1 1 37 22804 1 1 29 SER N N 8.896 -7.572 0.944 1.00 . A A . 29 SER N 1 1 37 22805 1 1 29 SER O O 5.905 -7.450 1.833 1.00 . A A . 29 SER O 1 1 37 22806 1 1 29 SER OG O 8.278 -9.620 -0.696 1.00 . A A . 29 SER OG 1 1 37 22807 1 1 30 HIS C C 4.036 -4.787 0.896 1.00 . A A . 30 HIS C 1 1 37 22808 1 1 30 HIS CA C 5.386 -4.737 1.603 1.00 . A A . 30 HIS CA 1 1 37 22809 1 1 30 HIS CB C 5.828 -3.284 1.784 1.00 . A A . 30 HIS CB 1 1 37 22810 1 1 30 HIS CD2 C 8.383 -3.580 2.118 1.00 . A A . 30 HIS CD2 1 1 37 22811 1 1 30 HIS CE1 C 8.582 -2.518 4.026 1.00 . A A . 30 HIS CE1 1 1 37 22812 1 1 30 HIS CG C 7.151 -3.142 2.470 1.00 . A A . 30 HIS CG 1 1 37 22813 1 1 30 HIS H H 6.952 -5.010 0.205 1.00 . A A . 30 HIS H 1 1 37 22814 1 1 30 HIS HA H 5.287 -5.198 2.575 1.00 . A A . 30 HIS HA 1 1 37 22815 1 1 30 HIS HB2 H 5.905 -2.815 0.814 1.00 . A A . 30 HIS HB2 1 1 37 22816 1 1 30 HIS HB3 H 5.089 -2.761 2.373 1.00 . A A . 30 HIS HB3 1 1 37 22817 1 1 30 HIS HD1 H 6.597 -2.048 4.184 1.00 . A A . 30 HIS HD1 1 1 37 22818 1 1 30 HIS HD2 H 8.634 -4.141 1.229 1.00 . A A . 30 HIS HD2 1 1 37 22819 1 1 30 HIS HE1 H 9.001 -2.083 4.921 1.00 . A A . 30 HIS HE1 1 1 37 22820 1 1 30 HIS HE2 H 10.199 -3.430 3.161 1.00 . A A . 30 HIS HE2 1 1 37 22821 1 1 30 HIS N N 6.393 -5.483 0.856 1.00 . A A . 30 HIS N 1 1 37 22822 1 1 30 HIS ND1 N 7.310 -2.481 3.670 1.00 . A A . 30 HIS ND1 1 1 37 22823 1 1 30 HIS NE2 N 9.253 -3.180 3.102 1.00 . A A . 30 HIS NE2 1 1 37 22824 1 1 30 HIS O O 3.621 -3.820 0.257 1.00 . A A . 30 HIS O 1 1 37 22825 1 1 31 TYR C C 1.008 -5.187 1.028 1.00 . A A . 31 TYR C 1 1 37 22826 1 1 31 TYR CA C 2.049 -6.099 0.386 1.00 . A A . 31 TYR CA 1 1 37 22827 1 1 31 TYR CB C 1.602 -7.558 0.495 1.00 . A A . 31 TYR CB 1 1 37 22828 1 1 31 TYR CD1 C 3.033 -8.496 -1.361 1.00 . A A . 31 TYR CD1 1 1 37 22829 1 1 31 TYR CD2 C 3.161 -9.523 0.786 1.00 . A A . 31 TYR CD2 1 1 37 22830 1 1 31 TYR CE1 C 3.961 -9.396 -1.851 1.00 . A A . 31 TYR CE1 1 1 37 22831 1 1 31 TYR CE2 C 4.089 -10.426 0.304 1.00 . A A . 31 TYR CE2 1 1 37 22832 1 1 31 TYR CG C 2.618 -8.544 -0.037 1.00 . A A . 31 TYR CG 1 1 37 22833 1 1 31 TYR CZ C 4.486 -10.358 -1.015 1.00 . A A . 31 TYR CZ 1 1 37 22834 1 1 31 TYR H H 3.736 -6.658 1.536 1.00 . A A . 31 TYR H 1 1 37 22835 1 1 31 TYR HA H 2.145 -5.838 -0.657 1.00 . A A . 31 TYR HA 1 1 37 22836 1 1 31 TYR HB2 H 1.422 -7.796 1.533 1.00 . A A . 31 TYR HB2 1 1 37 22837 1 1 31 TYR HB3 H 0.687 -7.689 -0.064 1.00 . A A . 31 TYR HB3 1 1 37 22838 1 1 31 TYR HD1 H 2.621 -7.741 -2.014 1.00 . A A . 31 TYR HD1 1 1 37 22839 1 1 31 TYR HD2 H 2.847 -9.574 1.819 1.00 . A A . 31 TYR HD2 1 1 37 22840 1 1 31 TYR HE1 H 4.272 -9.342 -2.884 1.00 . A A . 31 TYR HE1 1 1 37 22841 1 1 31 TYR HE2 H 4.499 -11.180 0.960 1.00 . A A . 31 TYR HE2 1 1 37 22842 1 1 31 TYR HH H 4.954 -12.004 -1.891 1.00 . A A . 31 TYR HH 1 1 37 22843 1 1 31 TYR N N 3.354 -5.922 1.014 1.00 . A A . 31 TYR N 1 1 37 22844 1 1 31 TYR O O 1.149 -4.785 2.183 1.00 . A A . 31 TYR O 1 1 37 22845 1 1 31 TYR OH O 5.410 -11.256 -1.498 1.00 . A A . 31 TYR OH 1 1 37 22846 1 1 32 CYS C C -2.073 -4.789 1.639 1.00 . A A . 32 CYS C 1 1 37 22847 1 1 32 CYS CA C -1.101 -4.003 0.767 1.00 . A A . 32 CYS CA 1 1 37 22848 1 1 32 CYS CB C -1.851 -3.362 -0.401 1.00 . A A . 32 CYS CB 1 1 37 22849 1 1 32 CYS H H -0.094 -5.217 -0.640 1.00 . A A . 32 CYS H 1 1 37 22850 1 1 32 CYS HA H -0.647 -3.225 1.363 1.00 . A A . 32 CYS HA 1 1 37 22851 1 1 32 CYS HB2 H -1.875 -4.056 -1.228 1.00 . A A . 32 CYS HB2 1 1 37 22852 1 1 32 CYS HB3 H -2.863 -3.142 -0.093 1.00 . A A . 32 CYS HB3 1 1 37 22853 1 1 32 CYS N N -0.036 -4.866 0.272 1.00 . A A . 32 CYS N 1 1 37 22854 1 1 32 CYS O O -2.347 -5.961 1.380 1.00 . A A . 32 CYS O 1 1 37 22855 1 1 32 CYS SG S -1.105 -1.812 -1.003 1.00 . A A . 32 CYS SG 1 1 37 22856 1 1 33 THR C C -4.977 -4.453 3.200 1.00 . A A . 33 THR C 1 1 37 22857 1 1 33 THR CA C -3.534 -4.778 3.583 1.00 . A A . 33 THR CA 1 1 37 22858 1 1 33 THR CB C -3.265 -4.335 5.022 1.00 . A A . 33 THR CB 1 1 37 22859 1 1 33 THR CG2 C -1.794 -4.319 5.378 1.00 . A A . 33 THR CG2 1 1 37 22860 1 1 33 THR H H -2.335 -3.205 2.829 1.00 . A A . 33 THR H 1 1 37 22861 1 1 33 THR HA H -3.388 -5.845 3.513 1.00 . A A . 33 THR HA 1 1 37 22862 1 1 33 THR HB H -3.761 -5.018 5.697 1.00 . A A . 33 THR HB 1 1 37 22863 1 1 33 THR HG1 H -4.059 -2.956 6.165 1.00 . A A . 33 THR HG1 1 1 37 22864 1 1 33 THR HG21 H -1.216 -4.665 4.533 1.00 . A A . 33 THR HG21 1 1 37 22865 1 1 33 THR HG22 H -1.495 -3.313 5.630 1.00 . A A . 33 THR HG22 1 1 37 22866 1 1 33 THR HG23 H -1.621 -4.969 6.223 1.00 . A A . 33 THR HG23 1 1 37 22867 1 1 33 THR N N -2.591 -4.137 2.674 1.00 . A A . 33 THR N 1 1 37 22868 1 1 33 THR O O -5.905 -4.732 3.959 1.00 . A A . 33 THR O 1 1 37 22869 1 1 33 THR OG1 O -3.776 -3.034 5.250 1.00 . A A . 33 THR OG1 1 1 37 22870 1 1 34 GLY C C -7.313 -2.794 2.621 1.00 . A A . 34 GLY C 1 1 37 22871 1 1 34 GLY CA C -6.497 -3.515 1.563 1.00 . A A . 34 GLY CA 1 1 37 22872 1 1 34 GLY H H -4.387 -3.665 1.453 1.00 . A A . 34 GLY H 1 1 37 22873 1 1 34 GLY HA2 H -7.015 -4.420 1.280 1.00 . A A . 34 GLY HA2 1 1 37 22874 1 1 34 GLY HA3 H -6.413 -2.877 0.695 1.00 . A A . 34 GLY HA3 1 1 37 22875 1 1 34 GLY N N -5.162 -3.863 2.020 1.00 . A A . 34 GLY N 1 1 37 22876 1 1 34 GLY O O -8.541 -2.871 2.626 1.00 . A A . 34 GLY O 1 1 37 22877 1 1 35 ARG C C -6.818 0.086 4.643 1.00 . A A . 35 ARG C 1 1 37 22878 1 1 35 ARG CA C -7.299 -1.359 4.588 1.00 . A A . 35 ARG CA 1 1 37 22879 1 1 35 ARG CB C -7.056 -2.042 5.935 1.00 . A A . 35 ARG CB 1 1 37 22880 1 1 35 ARG CD C -6.973 -4.351 6.923 1.00 . A A . 35 ARG CD 1 1 37 22881 1 1 35 ARG CG C -7.776 -3.372 6.082 1.00 . A A . 35 ARG CG 1 1 37 22882 1 1 35 ARG CZ C -8.702 -5.506 8.244 1.00 . A A . 35 ARG CZ 1 1 37 22883 1 1 35 ARG H H -5.650 -2.071 3.465 1.00 . A A . 35 ARG H 1 1 37 22884 1 1 35 ARG HA H -8.355 -1.364 4.378 1.00 . A A . 35 ARG HA 1 1 37 22885 1 1 35 ARG HB2 H -5.997 -2.215 6.052 1.00 . A A . 35 ARG HB2 1 1 37 22886 1 1 35 ARG HB3 H -7.393 -1.385 6.724 1.00 . A A . 35 ARG HB3 1 1 37 22887 1 1 35 ARG HD2 H -6.116 -4.676 6.352 1.00 . A A . 35 ARG HD2 1 1 37 22888 1 1 35 ARG HD3 H -6.638 -3.846 7.817 1.00 . A A . 35 ARG HD3 1 1 37 22889 1 1 35 ARG HE H -7.578 -6.361 6.834 1.00 . A A . 35 ARG HE 1 1 37 22890 1 1 35 ARG HG2 H -8.731 -3.203 6.558 1.00 . A A . 35 ARG HG2 1 1 37 22891 1 1 35 ARG HG3 H -7.931 -3.796 5.101 1.00 . A A . 35 ARG HG3 1 1 37 22892 1 1 35 ARG HH11 H -8.475 -3.547 8.692 1.00 . A A . 35 ARG HH11 1 1 37 22893 1 1 35 ARG HH12 H -9.685 -4.382 9.607 1.00 . A A . 35 ARG HH12 1 1 37 22894 1 1 35 ARG HH21 H -9.169 -7.461 8.036 1.00 . A A . 35 ARG HH21 1 1 37 22895 1 1 35 ARG HH22 H -10.079 -6.604 9.235 1.00 . A A . 35 ARG HH22 1 1 37 22896 1 1 35 ARG N N -6.628 -2.094 3.520 1.00 . A A . 35 ARG N 1 1 37 22897 1 1 35 ARG NE N -7.760 -5.521 7.304 1.00 . A A . 35 ARG NE 1 1 37 22898 1 1 35 ARG NH1 N -8.976 -4.386 8.901 1.00 . A A . 35 ARG NH1 1 1 37 22899 1 1 35 ARG NH2 N -9.372 -6.615 8.529 1.00 . A A . 35 ARG NH2 1 1 37 22900 1 1 35 ARG O O -7.617 1.014 4.763 1.00 . A A . 35 ARG O 1 1 37 22901 1 1 36 SER C C -4.231 1.928 3.268 1.00 . A A . 36 SER C 1 1 37 22902 1 1 36 SER CA C -4.912 1.599 4.593 1.00 . A A . 36 SER CA 1 1 37 22903 1 1 36 SER CB C -3.902 1.696 5.737 1.00 . A A . 36 SER CB 1 1 37 22904 1 1 36 SER H H -4.925 -0.514 4.460 1.00 . A A . 36 SER H 1 1 37 22905 1 1 36 SER HA H -5.706 2.311 4.763 1.00 . A A . 36 SER HA 1 1 37 22906 1 1 36 SER HB2 H -3.245 0.840 5.709 1.00 . A A . 36 SER HB2 1 1 37 22907 1 1 36 SER HB3 H -3.321 2.600 5.625 1.00 . A A . 36 SER HB3 1 1 37 22908 1 1 36 SER HG H -4.518 2.616 7.354 1.00 . A A . 36 SER HG 1 1 37 22909 1 1 36 SER N N -5.507 0.267 4.554 1.00 . A A . 36 SER N 1 1 37 22910 1 1 36 SER O O -4.004 1.045 2.441 1.00 . A A . 36 SER O 1 1 37 22911 1 1 36 SER OG O -4.556 1.727 6.994 1.00 . A A . 36 SER OG 1 1 37 22912 1 1 37 CYS C C -1.796 4.025 2.116 1.00 . A A . 37 CYS C 1 1 37 22913 1 1 37 CYS CA C -3.250 3.644 1.850 1.00 . A A . 37 CYS CA 1 1 37 22914 1 1 37 CYS CB C -4.002 4.831 1.245 1.00 . A A . 37 CYS CB 1 1 37 22915 1 1 37 CYS H H -4.112 3.860 3.771 1.00 . A A . 37 CYS H 1 1 37 22916 1 1 37 CYS HA H -3.271 2.823 1.150 1.00 . A A . 37 CYS HA 1 1 37 22917 1 1 37 CYS HB2 H -4.342 5.476 2.041 1.00 . A A . 37 CYS HB2 1 1 37 22918 1 1 37 CYS HB3 H -3.333 5.383 0.603 1.00 . A A . 37 CYS HB3 1 1 37 22919 1 1 37 CYS N N -3.907 3.202 3.075 1.00 . A A . 37 CYS N 1 1 37 22920 1 1 37 CYS O O -1.188 4.768 1.345 1.00 . A A . 37 CYS O 1 1 37 22921 1 1 37 CYS SG S -5.458 4.356 0.257 1.00 . A A . 37 CYS SG 1 1 37 22922 1 1 38 GLU C C 0.908 2.496 3.818 1.00 . A A . 38 GLU C 1 1 37 22923 1 1 38 GLU CA C 0.139 3.791 3.575 1.00 . A A . 38 GLU CA 1 1 37 22924 1 1 38 GLU CB C 0.190 4.671 4.826 1.00 . A A . 38 GLU CB 1 1 37 22925 1 1 38 GLU CD C -0.647 6.773 5.949 1.00 . A A . 38 GLU CD 1 1 37 22926 1 1 38 GLU CG C -0.466 6.029 4.640 1.00 . A A . 38 GLU CG 1 1 37 22927 1 1 38 GLU H H -1.778 2.922 3.784 1.00 . A A . 38 GLU H 1 1 37 22928 1 1 38 GLU HA H 0.599 4.320 2.754 1.00 . A A . 38 GLU HA 1 1 37 22929 1 1 38 GLU HB2 H -0.314 4.159 5.633 1.00 . A A . 38 GLU HB2 1 1 37 22930 1 1 38 GLU HB3 H 1.223 4.828 5.100 1.00 . A A . 38 GLU HB3 1 1 37 22931 1 1 38 GLU HG2 H 0.151 6.627 3.987 1.00 . A A . 38 GLU HG2 1 1 37 22932 1 1 38 GLU HG3 H -1.436 5.887 4.187 1.00 . A A . 38 GLU HG3 1 1 37 22933 1 1 38 GLU N N -1.244 3.509 3.210 1.00 . A A . 38 GLU N 1 1 37 22934 1 1 38 GLU O O 0.660 1.789 4.796 1.00 . A A . 38 GLU O 1 1 37 22935 1 1 38 GLU OE1 O 0.253 6.684 6.811 1.00 . A A . 38 GLU OE1 1 1 37 22936 1 1 38 GLU OE2 O -1.687 7.444 6.112 1.00 . A A . 38 GLU OE2 1 1 37 22937 1 1 39 CYS C C 3.359 0.918 4.386 1.00 . A A . 39 CYS C 1 1 37 22938 1 1 39 CYS CA C 2.643 0.976 3.037 1.00 . A A . 39 CYS CA 1 1 37 22939 1 1 39 CYS CB C 3.665 0.907 1.900 1.00 . A A . 39 CYS CB 1 1 37 22940 1 1 39 CYS H H 1.990 2.790 2.163 1.00 . A A . 39 CYS H 1 1 37 22941 1 1 39 CYS HA H 1.976 0.130 2.961 1.00 . A A . 39 CYS HA 1 1 37 22942 1 1 39 CYS HB2 H 3.385 1.612 1.132 1.00 . A A . 39 CYS HB2 1 1 37 22943 1 1 39 CYS HB3 H 4.640 1.169 2.284 1.00 . A A . 39 CYS HB3 1 1 37 22944 1 1 39 CYS N N 1.840 2.188 2.922 1.00 . A A . 39 CYS N 1 1 37 22945 1 1 39 CYS O O 3.766 1.948 4.926 1.00 . A A . 39 CYS O 1 1 37 22946 1 1 39 CYS SG S 3.799 -0.735 1.119 1.00 . A A . 39 CYS SG 1 1 37 22947 1 1 40 PRO C C 5.571 0.180 6.278 1.00 . A A . 40 PRO C 1 1 37 22948 1 1 40 PRO CA C 4.194 -0.475 6.242 1.00 . A A . 40 PRO CA 1 1 37 22949 1 1 40 PRO CB C 4.322 -1.995 6.367 1.00 . A A . 40 PRO CB 1 1 37 22950 1 1 40 PRO CD C 3.069 -1.572 4.377 1.00 . A A . 40 PRO CD 1 1 37 22951 1 1 40 PRO CG C 3.226 -2.539 5.517 1.00 . A A . 40 PRO CG 1 1 37 22952 1 1 40 PRO HA H 3.595 -0.093 7.056 1.00 . A A . 40 PRO HA 1 1 37 22953 1 1 40 PRO HB2 H 5.292 -2.307 6.010 1.00 . A A . 40 PRO HB2 1 1 37 22954 1 1 40 PRO HB3 H 4.200 -2.286 7.400 1.00 . A A . 40 PRO HB3 1 1 37 22955 1 1 40 PRO HD2 H 3.693 -1.865 3.545 1.00 . A A . 40 PRO HD2 1 1 37 22956 1 1 40 PRO HD3 H 2.035 -1.513 4.072 1.00 . A A . 40 PRO HD3 1 1 37 22957 1 1 40 PRO HG2 H 3.500 -3.516 5.146 1.00 . A A . 40 PRO HG2 1 1 37 22958 1 1 40 PRO HG3 H 2.312 -2.596 6.088 1.00 . A A . 40 PRO HG3 1 1 37 22959 1 1 40 PRO N N 3.523 -0.291 4.951 1.00 . A A . 40 PRO N 1 1 37 22960 1 1 40 PRO O O 6.049 0.698 5.268 1.00 . A A . 40 PRO O 1 1 37 22961 1 1 41 SER C C 8.594 -0.339 7.734 1.00 . A A . 41 SER C 1 1 37 22962 1 1 41 SER CA C 7.526 0.743 7.613 1.00 . A A . 41 SER CA 1 1 37 22963 1 1 41 SER CB C 7.553 1.644 8.849 1.00 . A A . 41 SER CB 1 1 37 22964 1 1 41 SER H H 5.770 -0.275 8.214 1.00 . A A . 41 SER H 1 1 37 22965 1 1 41 SER HA H 7.735 1.341 6.738 1.00 . A A . 41 SER HA 1 1 37 22966 1 1 41 SER HB2 H 8.522 2.115 8.927 1.00 . A A . 41 SER HB2 1 1 37 22967 1 1 41 SER HB3 H 6.790 2.403 8.756 1.00 . A A . 41 SER HB3 1 1 37 22968 1 1 41 SER HG H 6.982 1.482 10.716 1.00 . A A . 41 SER HG 1 1 37 22969 1 1 41 SER N N 6.203 0.153 7.446 1.00 . A A . 41 SER N 1 1 37 22970 1 1 41 SER O O 9.736 -0.148 7.319 1.00 . A A . 41 SER O 1 1 37 22971 1 1 41 SER OG O 7.313 0.898 10.030 1.00 . A A . 41 SER OG 1 1 37 22972 1 1 42 TYR C C 8.944 -3.638 7.389 1.00 . A A . 42 TYR C 1 1 37 22973 1 1 42 TYR CA C 9.138 -2.590 8.483 1.00 . A A . 42 TYR CA 1 1 37 22974 1 1 42 TYR CB C 8.942 -3.230 9.859 1.00 . A A . 42 TYR CB 1 1 37 22975 1 1 42 TYR CD1 C 6.742 -4.406 9.468 1.00 . A A . 42 TYR CD1 1 1 37 22976 1 1 42 TYR CD2 C 6.878 -2.840 11.260 1.00 . A A . 42 TYR CD2 1 1 37 22977 1 1 42 TYR CE1 C 5.418 -4.653 9.779 1.00 . A A . 42 TYR CE1 1 1 37 22978 1 1 42 TYR CE2 C 5.555 -3.081 11.577 1.00 . A A . 42 TYR CE2 1 1 37 22979 1 1 42 TYR CG C 7.493 -3.497 10.202 1.00 . A A . 42 TYR CG 1 1 37 22980 1 1 42 TYR CZ C 4.829 -3.988 10.834 1.00 . A A . 42 TYR CZ 1 1 37 22981 1 1 42 TYR H H 7.288 -1.569 8.618 1.00 . A A . 42 TYR H 1 1 37 22982 1 1 42 TYR HA H 10.142 -2.200 8.418 1.00 . A A . 42 TYR HA 1 1 37 22983 1 1 42 TYR HB2 H 9.468 -4.173 9.888 1.00 . A A . 42 TYR HB2 1 1 37 22984 1 1 42 TYR HB3 H 9.347 -2.574 10.615 1.00 . A A . 42 TYR HB3 1 1 37 22985 1 1 42 TYR HD1 H 7.206 -4.926 8.643 1.00 . A A . 42 TYR HD1 1 1 37 22986 1 1 42 TYR HD2 H 7.448 -2.130 11.840 1.00 . A A . 42 TYR HD2 1 1 37 22987 1 1 42 TYR HE1 H 4.850 -5.364 9.197 1.00 . A A . 42 TYR HE1 1 1 37 22988 1 1 42 TYR HE2 H 5.094 -2.560 12.404 1.00 . A A . 42 TYR HE2 1 1 37 22989 1 1 42 TYR HH H 3.449 -5.034 11.668 1.00 . A A . 42 TYR HH 1 1 37 22990 1 1 42 TYR N N 8.213 -1.477 8.307 1.00 . A A . 42 TYR N 1 1 37 22991 1 1 42 TYR O O 7.873 -3.730 6.790 1.00 . A A . 42 TYR O 1 1 37 22992 1 1 42 TYR OH O 3.512 -4.231 11.146 1.00 . A A . 42 TYR OH 1 1 37 22993 1 1 43 PRO C C 9.009 -6.643 6.489 1.00 . A A . 43 PRO C 1 1 37 22994 1 1 43 PRO CA C 9.922 -5.489 6.088 1.00 . A A . 43 PRO CA 1 1 37 22995 1 1 43 PRO CB C 11.371 -5.967 5.979 1.00 . A A . 43 PRO CB 1 1 37 22996 1 1 43 PRO CD C 11.297 -4.403 7.784 1.00 . A A . 43 PRO CD 1 1 37 22997 1 1 43 PRO CG C 11.972 -5.658 7.306 1.00 . A A . 43 PRO CG 1 1 37 22998 1 1 43 PRO HA H 9.598 -5.090 5.137 1.00 . A A . 43 PRO HA 1 1 37 22999 1 1 43 PRO HB2 H 11.389 -7.028 5.773 1.00 . A A . 43 PRO HB2 1 1 37 23000 1 1 43 PRO HB3 H 11.871 -5.433 5.185 1.00 . A A . 43 PRO HB3 1 1 37 23001 1 1 43 PRO HD2 H 11.184 -4.421 8.858 1.00 . A A . 43 PRO HD2 1 1 37 23002 1 1 43 PRO HD3 H 11.858 -3.532 7.477 1.00 . A A . 43 PRO HD3 1 1 37 23003 1 1 43 PRO HG2 H 11.784 -6.471 7.992 1.00 . A A . 43 PRO HG2 1 1 37 23004 1 1 43 PRO HG3 H 13.034 -5.495 7.199 1.00 . A A . 43 PRO HG3 1 1 37 23005 1 1 43 PRO N N 9.983 -4.445 7.115 1.00 . A A . 43 PRO N 1 1 37 23006 1 1 43 PRO O O 9.068 -7.131 7.617 1.00 . A A . 43 PRO O 1 1 37 23007 1 1 44 GLY C C 7.973 -9.445 6.214 1.00 . A A . 44 GLY C 1 1 37 23008 1 1 44 GLY CA C 7.251 -8.167 5.834 1.00 . A A . 44 GLY CA 1 1 37 23009 1 1 44 GLY H H 8.161 -6.646 4.676 1.00 . A A . 44 GLY H 1 1 37 23010 1 1 44 GLY HA2 H 6.653 -8.353 4.954 1.00 . A A . 44 GLY HA2 1 1 37 23011 1 1 44 GLY HA3 H 6.598 -7.880 6.646 1.00 . A A . 44 GLY HA3 1 1 37 23012 1 1 44 GLY N N 8.164 -7.074 5.558 1.00 . A A . 44 GLY N 1 1 37 23013 1 1 44 GLY O O 8.665 -10.016 5.346 1.00 . A A . 44 GLY O 1 1 37 23014 1 1 44 GLY OXT O 7.846 -9.874 7.380 1.00 . A A . 44 GLY OXT 1 1 38 23015 1 1 1 ALA C C -14.567 10.765 4.077 1.00 . A A . 1 ALA C 1 1 38 23016 1 1 1 ALA CA C -14.168 10.304 5.475 1.00 . A A . 1 ALA CA 1 1 38 23017 1 1 1 ALA CB C -14.353 8.800 5.607 1.00 . A A . 1 ALA CB 1 1 38 23018 1 1 1 ALA H1 H -15.953 11.015 6.210 1.00 . A A . 1 ALA H1 1 1 38 23019 1 1 1 ALA H2 H -14.840 10.497 7.410 1.00 . A A . 1 ALA H2 1 1 38 23020 1 1 1 ALA H3 H -14.587 11.981 6.591 1.00 . A A . 1 ALA H3 1 1 38 23021 1 1 1 ALA HA H -13.123 10.528 5.631 1.00 . A A . 1 ALA HA 1 1 38 23022 1 1 1 ALA HB1 H -14.148 8.327 4.658 1.00 . A A . 1 ALA HB1 1 1 38 23023 1 1 1 ALA HB2 H -13.673 8.418 6.354 1.00 . A A . 1 ALA HB2 1 1 38 23024 1 1 1 ALA HB3 H -15.369 8.587 5.903 1.00 . A A . 1 ALA HB3 1 1 38 23025 1 1 1 ALA N N -14.958 11.013 6.515 1.00 . A A . 1 ALA N 1 1 38 23026 1 1 1 ALA O O -15.556 10.294 3.516 1.00 . A A . 1 ALA O 1 1 38 23027 1 1 2 MET C C -12.791 12.768 1.551 1.00 . A A . 2 MET C 1 1 38 23028 1 1 2 MET CA C -14.061 12.212 2.187 1.00 . A A . 2 MET CA 1 1 38 23029 1 1 2 MET CB C -15.132 13.303 2.253 1.00 . A A . 2 MET CB 1 1 38 23030 1 1 2 MET CE C -16.787 15.780 4.721 1.00 . A A . 2 MET CE 1 1 38 23031 1 1 2 MET CG C -14.869 14.349 3.323 1.00 . A A . 2 MET CG 1 1 38 23032 1 1 2 MET H H -13.015 12.024 4.017 1.00 . A A . 2 MET H 1 1 38 23033 1 1 2 MET HA H -14.427 11.398 1.579 1.00 . A A . 2 MET HA 1 1 38 23034 1 1 2 MET HB2 H -15.181 13.802 1.297 1.00 . A A . 2 MET HB2 1 1 38 23035 1 1 2 MET HB3 H -16.087 12.842 2.458 1.00 . A A . 2 MET HB3 1 1 38 23036 1 1 2 MET HE1 H -16.815 14.770 5.104 1.00 . A A . 2 MET HE1 1 1 38 23037 1 1 2 MET HE2 H -16.270 16.416 5.424 1.00 . A A . 2 MET HE2 1 1 38 23038 1 1 2 MET HE3 H -17.796 16.140 4.584 1.00 . A A . 2 MET HE3 1 1 38 23039 1 1 2 MET HG2 H -15.046 13.906 4.292 1.00 . A A . 2 MET HG2 1 1 38 23040 1 1 2 MET HG3 H -13.837 14.662 3.255 1.00 . A A . 2 MET HG3 1 1 38 23041 1 1 2 MET N N -13.790 11.688 3.520 1.00 . A A . 2 MET N 1 1 38 23042 1 1 2 MET O O -12.831 13.765 0.830 1.00 . A A . 2 MET O 1 1 38 23043 1 1 2 MET SD S -15.926 15.800 3.151 1.00 . A A . 2 MET SD 1 1 38 23044 1 1 3 ASP C C -9.655 11.381 0.619 1.00 . A A . 3 ASP C 1 1 38 23045 1 1 3 ASP CA C -10.382 12.547 1.280 1.00 . A A . 3 ASP CA 1 1 38 23046 1 1 3 ASP CB C -9.511 13.147 2.384 1.00 . A A . 3 ASP CB 1 1 38 23047 1 1 3 ASP CG C -9.854 14.596 2.668 1.00 . A A . 3 ASP CG 1 1 38 23048 1 1 3 ASP H H -11.698 11.330 2.407 1.00 . A A . 3 ASP H 1 1 38 23049 1 1 3 ASP HA H -10.576 13.304 0.535 1.00 . A A . 3 ASP HA 1 1 38 23050 1 1 3 ASP HB2 H -9.649 12.580 3.292 1.00 . A A . 3 ASP HB2 1 1 38 23051 1 1 3 ASP HB3 H -8.474 13.093 2.085 1.00 . A A . 3 ASP HB3 1 1 38 23052 1 1 3 ASP N N -11.665 12.118 1.825 1.00 . A A . 3 ASP N 1 1 38 23053 1 1 3 ASP O O -10.089 10.233 0.709 1.00 . A A . 3 ASP O 1 1 38 23054 1 1 3 ASP OD1 O -10.224 14.904 3.821 1.00 . A A . 3 ASP OD1 1 1 38 23055 1 1 3 ASP OD2 O -9.751 15.424 1.738 1.00 . A A . 3 ASP OD2 1 1 38 23056 1 1 4 CYS C C -6.468 10.372 0.040 1.00 . A A . 4 CYS C 1 1 38 23057 1 1 4 CYS CA C -7.756 10.661 -0.723 1.00 . A A . 4 CYS CA 1 1 38 23058 1 1 4 CYS CB C -7.425 11.101 -2.150 1.00 . A A . 4 CYS CB 1 1 38 23059 1 1 4 CYS H H -8.248 12.617 -0.083 1.00 . A A . 4 CYS H 1 1 38 23060 1 1 4 CYS HA H -8.347 9.758 -0.762 1.00 . A A . 4 CYS HA 1 1 38 23061 1 1 4 CYS HB2 H -6.846 12.011 -2.113 1.00 . A A . 4 CYS HB2 1 1 38 23062 1 1 4 CYS HB3 H -6.841 10.329 -2.629 1.00 . A A . 4 CYS HB3 1 1 38 23063 1 1 4 CYS N N -8.544 11.684 -0.046 1.00 . A A . 4 CYS N 1 1 38 23064 1 1 4 CYS O O -5.549 11.191 0.060 1.00 . A A . 4 CYS O 1 1 38 23065 1 1 4 CYS SG S -8.888 11.417 -3.189 1.00 . A A . 4 CYS SG 1 1 38 23066 1 1 5 THR C C -4.062 8.492 0.488 1.00 . A A . 5 THR C 1 1 38 23067 1 1 5 THR CA C -5.226 8.802 1.424 1.00 . A A . 5 THR CA 1 1 38 23068 1 1 5 THR CB C -5.543 7.582 2.293 1.00 . A A . 5 THR CB 1 1 38 23069 1 1 5 THR CG2 C -6.151 7.943 3.631 1.00 . A A . 5 THR CG2 1 1 38 23070 1 1 5 THR H H -7.168 8.588 0.608 1.00 . A A . 5 THR H 1 1 38 23071 1 1 5 THR HA H -4.949 9.625 2.064 1.00 . A A . 5 THR HA 1 1 38 23072 1 1 5 THR HB H -4.627 7.041 2.481 1.00 . A A . 5 THR HB 1 1 38 23073 1 1 5 THR HG1 H -6.197 6.634 0.708 1.00 . A A . 5 THR HG1 1 1 38 23074 1 1 5 THR HG21 H -6.296 9.012 3.684 1.00 . A A . 5 THR HG21 1 1 38 23075 1 1 5 THR HG22 H -7.103 7.445 3.740 1.00 . A A . 5 THR HG22 1 1 38 23076 1 1 5 THR HG23 H -5.487 7.630 4.424 1.00 . A A . 5 THR HG23 1 1 38 23077 1 1 5 THR N N -6.405 9.200 0.664 1.00 . A A . 5 THR N 1 1 38 23078 1 1 5 THR O O -3.614 7.350 0.391 1.00 . A A . 5 THR O 1 1 38 23079 1 1 5 THR OG1 O -6.446 6.714 1.631 1.00 . A A . 5 THR OG1 1 1 38 23080 1 1 6 THR C C -1.313 8.594 -0.509 1.00 . A A . 6 THR C 1 1 38 23081 1 1 6 THR CA C -2.469 9.365 -1.141 1.00 . A A . 6 THR CA 1 1 38 23082 1 1 6 THR CB C -1.982 10.734 -1.618 1.00 . A A . 6 THR CB 1 1 38 23083 1 1 6 THR CG2 C -2.689 11.218 -2.866 1.00 . A A . 6 THR CG2 1 1 38 23084 1 1 6 THR H H -3.980 10.406 -0.086 1.00 . A A . 6 THR H 1 1 38 23085 1 1 6 THR HA H -2.832 8.808 -1.992 1.00 . A A . 6 THR HA 1 1 38 23086 1 1 6 THR HB H -0.926 10.673 -1.838 1.00 . A A . 6 THR HB 1 1 38 23087 1 1 6 THR HG1 H -1.748 11.422 0.201 1.00 . A A . 6 THR HG1 1 1 38 23088 1 1 6 THR HG21 H -3.381 10.461 -3.204 1.00 . A A . 6 THR HG21 1 1 38 23089 1 1 6 THR HG22 H -3.229 12.126 -2.645 1.00 . A A . 6 THR HG22 1 1 38 23090 1 1 6 THR HG23 H -1.960 11.411 -3.639 1.00 . A A . 6 THR HG23 1 1 38 23091 1 1 6 THR N N -3.578 9.520 -0.205 1.00 . A A . 6 THR N 1 1 38 23092 1 1 6 THR O O -0.911 8.870 0.621 1.00 . A A . 6 THR O 1 1 38 23093 1 1 6 THR OG1 O -2.172 11.712 -0.610 1.00 . A A . 6 THR OG1 1 1 38 23094 1 1 7 GLY C C 0.678 5.687 -1.689 1.00 . A A . 7 GLY C 1 1 38 23095 1 1 7 GLY CA C 0.320 6.826 -0.752 1.00 . A A . 7 GLY CA 1 1 38 23096 1 1 7 GLY H H -1.147 7.451 -2.143 1.00 . A A . 7 GLY H 1 1 38 23097 1 1 7 GLY HA2 H 0.048 6.415 0.209 1.00 . A A . 7 GLY HA2 1 1 38 23098 1 1 7 GLY HA3 H 1.184 7.462 -0.628 1.00 . A A . 7 GLY HA3 1 1 38 23099 1 1 7 GLY N N -0.784 7.625 -1.250 1.00 . A A . 7 GLY N 1 1 38 23100 1 1 7 GLY O O 0.182 5.629 -2.814 1.00 . A A . 7 GLY O 1 1 38 23101 1 1 8 PRO C C 0.815 2.641 -2.329 1.00 . A A . 8 PRO C 1 1 38 23102 1 1 8 PRO CA C 1.959 3.616 -2.071 1.00 . A A . 8 PRO CA 1 1 38 23103 1 1 8 PRO CB C 3.052 2.948 -1.232 1.00 . A A . 8 PRO CB 1 1 38 23104 1 1 8 PRO CD C 2.185 4.747 0.077 1.00 . A A . 8 PRO CD 1 1 38 23105 1 1 8 PRO CG C 2.762 3.363 0.169 1.00 . A A . 8 PRO CG 1 1 38 23106 1 1 8 PRO HA H 2.373 3.938 -3.015 1.00 . A A . 8 PRO HA 1 1 38 23107 1 1 8 PRO HB2 H 2.992 1.876 -1.347 1.00 . A A . 8 PRO HB2 1 1 38 23108 1 1 8 PRO HB3 H 4.021 3.297 -1.554 1.00 . A A . 8 PRO HB3 1 1 38 23109 1 1 8 PRO HD2 H 1.457 4.906 0.859 1.00 . A A . 8 PRO HD2 1 1 38 23110 1 1 8 PRO HD3 H 2.968 5.488 0.132 1.00 . A A . 8 PRO HD3 1 1 38 23111 1 1 8 PRO HG2 H 2.047 2.687 0.612 1.00 . A A . 8 PRO HG2 1 1 38 23112 1 1 8 PRO HG3 H 3.676 3.376 0.745 1.00 . A A . 8 PRO HG3 1 1 38 23113 1 1 8 PRO N N 1.544 4.758 -1.250 1.00 . A A . 8 PRO N 1 1 38 23114 1 1 8 PRO O O 0.639 2.156 -3.447 1.00 . A A . 8 PRO O 1 1 38 23115 1 1 9 CYS C C -2.378 2.198 -1.704 1.00 . A A . 9 CYS C 1 1 38 23116 1 1 9 CYS CA C -1.089 1.439 -1.401 1.00 . A A . 9 CYS CA 1 1 38 23117 1 1 9 CYS CB C -1.246 0.632 -0.111 1.00 . A A . 9 CYS CB 1 1 38 23118 1 1 9 CYS H H 0.230 2.775 -0.421 1.00 . A A . 9 CYS H 1 1 38 23119 1 1 9 CYS HA H -0.883 0.762 -2.216 1.00 . A A . 9 CYS HA 1 1 38 23120 1 1 9 CYS HB2 H -0.304 0.160 0.127 1.00 . A A . 9 CYS HB2 1 1 38 23121 1 1 9 CYS HB3 H -1.519 1.300 0.693 1.00 . A A . 9 CYS HB3 1 1 38 23122 1 1 9 CYS N N 0.039 2.357 -1.287 1.00 . A A . 9 CYS N 1 1 38 23123 1 1 9 CYS O O -3.407 1.979 -1.064 1.00 . A A . 9 CYS O 1 1 38 23124 1 1 9 CYS SG S -2.511 -0.677 -0.201 1.00 . A A . 9 CYS SG 1 1 38 23125 1 1 10 CYS C C -3.477 4.127 -4.584 1.00 . A A . 10 CYS C 1 1 38 23126 1 1 10 CYS CA C -3.471 3.886 -3.077 1.00 . A A . 10 CYS CA 1 1 38 23127 1 1 10 CYS CB C -3.467 5.224 -2.334 1.00 . A A . 10 CYS CB 1 1 38 23128 1 1 10 CYS H H -1.464 3.221 -3.158 1.00 . A A . 10 CYS H 1 1 38 23129 1 1 10 CYS HA H -4.361 3.335 -2.807 1.00 . A A . 10 CYS HA 1 1 38 23130 1 1 10 CYS HB2 H -2.676 5.216 -1.601 1.00 . A A . 10 CYS HB2 1 1 38 23131 1 1 10 CYS HB3 H -3.286 6.021 -3.041 1.00 . A A . 10 CYS HB3 1 1 38 23132 1 1 10 CYS N N -2.313 3.091 -2.686 1.00 . A A . 10 CYS N 1 1 38 23133 1 1 10 CYS O O -2.567 4.755 -5.124 1.00 . A A . 10 CYS O 1 1 38 23134 1 1 10 CYS SG S -5.023 5.600 -1.463 1.00 . A A . 10 CYS SG 1 1 38 23135 1 1 11 ARG C C -4.785 5.261 -7.071 1.00 . A A . 11 ARG C 1 1 38 23136 1 1 11 ARG CA C -4.622 3.788 -6.703 1.00 . A A . 11 ARG CA 1 1 38 23137 1 1 11 ARG CB C -5.797 2.967 -7.241 1.00 . A A . 11 ARG CB 1 1 38 23138 1 1 11 ARG CD C -4.424 1.577 -8.821 1.00 . A A . 11 ARG CD 1 1 38 23139 1 1 11 ARG CG C -5.412 1.559 -7.666 1.00 . A A . 11 ARG CG 1 1 38 23140 1 1 11 ARG CZ C -3.306 -0.075 -10.268 1.00 . A A . 11 ARG CZ 1 1 38 23141 1 1 11 ARG H H -5.202 3.131 -4.775 1.00 . A A . 11 ARG H 1 1 38 23142 1 1 11 ARG HA H -3.710 3.424 -7.147 1.00 . A A . 11 ARG HA 1 1 38 23143 1 1 11 ARG HB2 H -6.552 2.893 -6.472 1.00 . A A . 11 ARG HB2 1 1 38 23144 1 1 11 ARG HB3 H -6.215 3.476 -8.097 1.00 . A A . 11 ARG HB3 1 1 38 23145 1 1 11 ARG HD2 H -4.757 2.298 -9.552 1.00 . A A . 11 ARG HD2 1 1 38 23146 1 1 11 ARG HD3 H -3.454 1.869 -8.444 1.00 . A A . 11 ARG HD3 1 1 38 23147 1 1 11 ARG HE H -5.015 -0.386 -9.285 1.00 . A A . 11 ARG HE 1 1 38 23148 1 1 11 ARG HG2 H -4.960 1.051 -6.827 1.00 . A A . 11 ARG HG2 1 1 38 23149 1 1 11 ARG HG3 H -6.302 1.030 -7.973 1.00 . A A . 11 ARG HG3 1 1 38 23150 1 1 11 ARG HH11 H -2.347 1.700 -10.127 1.00 . A A . 11 ARG HH11 1 1 38 23151 1 1 11 ARG HH12 H -1.582 0.521 -11.139 1.00 . A A . 11 ARG HH12 1 1 38 23152 1 1 11 ARG HH21 H -4.010 -1.938 -10.615 1.00 . A A . 11 ARG HH21 1 1 38 23153 1 1 11 ARG HH22 H -2.526 -1.544 -11.416 1.00 . A A . 11 ARG HH22 1 1 38 23154 1 1 11 ARG N N -4.506 3.624 -5.259 1.00 . A A . 11 ARG N 1 1 38 23155 1 1 11 ARG NE N -4.308 0.269 -9.463 1.00 . A A . 11 ARG NE 1 1 38 23156 1 1 11 ARG NH1 N -2.332 0.786 -10.533 1.00 . A A . 11 ARG NH1 1 1 38 23157 1 1 11 ARG NH2 N -3.278 -1.285 -10.811 1.00 . A A . 11 ARG NH2 1 1 38 23158 1 1 11 ARG O O -3.803 5.956 -7.330 1.00 . A A . 11 ARG O 1 1 38 23159 1 1 12 GLN C C -6.915 7.855 -6.223 1.00 . A A . 12 GLN C 1 1 38 23160 1 1 12 GLN CA C -6.310 7.126 -7.419 1.00 . A A . 12 GLN CA 1 1 38 23161 1 1 12 GLN CB C -7.262 7.205 -8.614 1.00 . A A . 12 GLN CB 1 1 38 23162 1 1 12 GLN CD C -8.119 9.523 -9.136 1.00 . A A . 12 GLN CD 1 1 38 23163 1 1 12 GLN CG C -7.084 8.461 -9.451 1.00 . A A . 12 GLN CG 1 1 38 23164 1 1 12 GLN H H -6.771 5.136 -6.870 1.00 . A A . 12 GLN H 1 1 38 23165 1 1 12 GLN HA H -5.376 7.602 -7.681 1.00 . A A . 12 GLN HA 1 1 38 23166 1 1 12 GLN HB2 H -7.095 6.348 -9.249 1.00 . A A . 12 GLN HB2 1 1 38 23167 1 1 12 GLN HB3 H -8.279 7.181 -8.251 1.00 . A A . 12 GLN HB3 1 1 38 23168 1 1 12 GLN HE21 H -6.831 10.459 -7.944 1.00 . A A . 12 GLN HE21 1 1 38 23169 1 1 12 GLN HE22 H -8.392 11.187 -8.081 1.00 . A A . 12 GLN HE22 1 1 38 23170 1 1 12 GLN HG2 H -6.102 8.869 -9.261 1.00 . A A . 12 GLN HG2 1 1 38 23171 1 1 12 GLN HG3 H -7.166 8.197 -10.495 1.00 . A A . 12 GLN HG3 1 1 38 23172 1 1 12 GLN N N -6.027 5.735 -7.088 1.00 . A A . 12 GLN N 1 1 38 23173 1 1 12 GLN NE2 N -7.743 10.487 -8.303 1.00 . A A . 12 GLN NE2 1 1 38 23174 1 1 12 GLN O O -6.793 9.073 -6.100 1.00 . A A . 12 GLN O 1 1 38 23175 1 1 12 GLN OE1 O -9.243 9.479 -9.635 1.00 . A A . 12 GLN OE1 1 1 38 23176 1 1 13 CYS C C -8.859 6.574 -3.319 1.00 . A A . 13 CYS C 1 1 38 23177 1 1 13 CYS CA C -8.191 7.665 -4.153 1.00 . A A . 13 CYS CA 1 1 38 23178 1 1 13 CYS CB C -9.225 8.724 -4.547 1.00 . A A . 13 CYS CB 1 1 38 23179 1 1 13 CYS H H -7.623 6.132 -5.496 1.00 . A A . 13 CYS H 1 1 38 23180 1 1 13 CYS HA H -7.418 8.131 -3.561 1.00 . A A . 13 CYS HA 1 1 38 23181 1 1 13 CYS HB2 H -8.767 9.432 -5.220 1.00 . A A . 13 CYS HB2 1 1 38 23182 1 1 13 CYS HB3 H -10.050 8.240 -5.049 1.00 . A A . 13 CYS HB3 1 1 38 23183 1 1 13 CYS N N -7.565 7.097 -5.342 1.00 . A A . 13 CYS N 1 1 38 23184 1 1 13 CYS O O -9.919 6.791 -2.732 1.00 . A A . 13 CYS O 1 1 38 23185 1 1 13 CYS SG S -9.905 9.662 -3.140 1.00 . A A . 13 CYS SG 1 1 38 23186 1 1 14 LYS C C -7.680 3.292 -2.143 1.00 . A A . 14 LYS C 1 1 38 23187 1 1 14 LYS CA C -8.778 4.283 -2.510 1.00 . A A . 14 LYS CA 1 1 38 23188 1 1 14 LYS CB C -9.873 3.575 -3.311 1.00 . A A . 14 LYS CB 1 1 38 23189 1 1 14 LYS CD C -11.635 1.806 -3.031 1.00 . A A . 14 LYS CD 1 1 38 23190 1 1 14 LYS CE C -13.147 1.796 -2.878 1.00 . A A . 14 LYS CE 1 1 38 23191 1 1 14 LYS CG C -11.025 3.074 -2.456 1.00 . A A . 14 LYS CG 1 1 38 23192 1 1 14 LYS H H -7.395 5.282 -3.761 1.00 . A A . 14 LYS H 1 1 38 23193 1 1 14 LYS HA H -9.208 4.678 -1.602 1.00 . A A . 14 LYS HA 1 1 38 23194 1 1 14 LYS HB2 H -10.270 4.264 -4.043 1.00 . A A . 14 LYS HB2 1 1 38 23195 1 1 14 LYS HB3 H -9.439 2.730 -3.824 1.00 . A A . 14 LYS HB3 1 1 38 23196 1 1 14 LYS HD2 H -11.389 1.743 -4.081 1.00 . A A . 14 LYS HD2 1 1 38 23197 1 1 14 LYS HD3 H -11.223 0.952 -2.512 1.00 . A A . 14 LYS HD3 1 1 38 23198 1 1 14 LYS HE2 H -13.475 0.777 -2.738 1.00 . A A . 14 LYS HE2 1 1 38 23199 1 1 14 LYS HE3 H -13.412 2.382 -2.010 1.00 . A A . 14 LYS HE3 1 1 38 23200 1 1 14 LYS HG2 H -10.659 2.866 -1.462 1.00 . A A . 14 LYS HG2 1 1 38 23201 1 1 14 LYS HG3 H -11.786 3.839 -2.409 1.00 . A A . 14 LYS HG3 1 1 38 23202 1 1 14 LYS HZ1 H -13.218 2.278 -4.910 1.00 . A A . 14 LYS HZ1 1 1 38 23203 1 1 14 LYS HZ2 H -14.718 1.853 -4.254 1.00 . A A . 14 LYS HZ2 1 1 38 23204 1 1 14 LYS HZ3 H -14.046 3.369 -3.918 1.00 . A A . 14 LYS HZ3 1 1 38 23205 1 1 14 LYS N N -8.236 5.400 -3.272 1.00 . A A . 14 LYS N 1 1 38 23206 1 1 14 LYS NZ N -13.830 2.363 -4.074 1.00 . A A . 14 LYS NZ 1 1 38 23207 1 1 14 LYS O O -6.603 3.293 -2.740 1.00 . A A . 14 LYS O 1 1 38 23208 1 1 15 LEU C C -6.824 0.359 -1.764 1.00 . A A . 15 LEU C 1 1 38 23209 1 1 15 LEU CA C -6.999 1.447 -0.713 1.00 . A A . 15 LEU CA 1 1 38 23210 1 1 15 LEU CB C -7.451 0.825 0.609 1.00 . A A . 15 LEU CB 1 1 38 23211 1 1 15 LEU CD1 C -8.864 1.148 2.653 1.00 . A A . 15 LEU CD1 1 1 38 23212 1 1 15 LEU CD2 C -6.728 2.421 2.398 1.00 . A A . 15 LEU CD2 1 1 38 23213 1 1 15 LEU CG C -7.920 1.822 1.670 1.00 . A A . 15 LEU CG 1 1 38 23214 1 1 15 LEU H H -8.838 2.493 -0.725 1.00 . A A . 15 LEU H 1 1 38 23215 1 1 15 LEU HA H -6.052 1.942 -0.563 1.00 . A A . 15 LEU HA 1 1 38 23216 1 1 15 LEU HB2 H -8.263 0.142 0.402 1.00 . A A . 15 LEU HB2 1 1 38 23217 1 1 15 LEU HB3 H -6.626 0.262 1.018 1.00 . A A . 15 LEU HB3 1 1 38 23218 1 1 15 LEU HD11 H -8.662 0.087 2.677 1.00 . A A . 15 LEU HD11 1 1 38 23219 1 1 15 LEU HD12 H -8.716 1.565 3.638 1.00 . A A . 15 LEU HD12 1 1 38 23220 1 1 15 LEU HD13 H -9.886 1.312 2.342 1.00 . A A . 15 LEU HD13 1 1 38 23221 1 1 15 LEU HD21 H -5.855 2.368 1.764 1.00 . A A . 15 LEU HD21 1 1 38 23222 1 1 15 LEU HD22 H -6.935 3.453 2.640 1.00 . A A . 15 LEU HD22 1 1 38 23223 1 1 15 LEU HD23 H -6.547 1.867 3.307 1.00 . A A . 15 LEU HD23 1 1 38 23224 1 1 15 LEU HG H -8.458 2.625 1.188 1.00 . A A . 15 LEU HG 1 1 38 23225 1 1 15 LEU N N -7.962 2.446 -1.159 1.00 . A A . 15 LEU N 1 1 38 23226 1 1 15 LEU O O -7.776 -0.342 -2.110 1.00 . A A . 15 LEU O 1 1 38 23227 1 1 16 LYS C C -5.744 -2.172 -2.809 1.00 . A A . 16 LYS C 1 1 38 23228 1 1 16 LYS CA C -5.307 -0.786 -3.281 1.00 . A A . 16 LYS CA 1 1 38 23229 1 1 16 LYS CB C -3.811 -0.791 -3.606 1.00 . A A . 16 LYS CB 1 1 38 23230 1 1 16 LYS CD C -1.984 0.464 -4.789 1.00 . A A . 16 LYS CD 1 1 38 23231 1 1 16 LYS CE C -1.546 1.049 -6.122 1.00 . A A . 16 LYS CE 1 1 38 23232 1 1 16 LYS CG C -3.449 0.057 -4.814 1.00 . A A . 16 LYS CG 1 1 38 23233 1 1 16 LYS H H -4.885 0.807 -1.954 1.00 . A A . 16 LYS H 1 1 38 23234 1 1 16 LYS HA H -5.859 -0.530 -4.173 1.00 . A A . 16 LYS HA 1 1 38 23235 1 1 16 LYS HB2 H -3.269 -0.413 -2.752 1.00 . A A . 16 LYS HB2 1 1 38 23236 1 1 16 LYS HB3 H -3.499 -1.807 -3.799 1.00 . A A . 16 LYS HB3 1 1 38 23237 1 1 16 LYS HD2 H -1.840 1.206 -4.018 1.00 . A A . 16 LYS HD2 1 1 38 23238 1 1 16 LYS HD3 H -1.382 -0.406 -4.572 1.00 . A A . 16 LYS HD3 1 1 38 23239 1 1 16 LYS HE2 H -2.316 1.717 -6.478 1.00 . A A . 16 LYS HE2 1 1 38 23240 1 1 16 LYS HE3 H -0.630 1.601 -5.975 1.00 . A A . 16 LYS HE3 1 1 38 23241 1 1 16 LYS HG2 H -3.638 -0.513 -5.711 1.00 . A A . 16 LYS HG2 1 1 38 23242 1 1 16 LYS HG3 H -4.061 0.947 -4.814 1.00 . A A . 16 LYS HG3 1 1 38 23243 1 1 16 LYS HZ1 H -2.026 -0.763 -7.046 1.00 . A A . 16 LYS HZ1 1 1 38 23244 1 1 16 LYS HZ2 H -1.385 0.395 -8.100 1.00 . A A . 16 LYS HZ2 1 1 38 23245 1 1 16 LYS HZ3 H -0.369 -0.424 -7.022 1.00 . A A . 16 LYS HZ3 1 1 38 23246 1 1 16 LYS N N -5.603 0.220 -2.269 1.00 . A A . 16 LYS N 1 1 38 23247 1 1 16 LYS NZ N -1.315 -0.010 -7.144 1.00 . A A . 16 LYS NZ 1 1 38 23248 1 1 16 LYS O O -6.019 -2.374 -1.626 1.00 . A A . 16 LYS O 1 1 38 23249 1 1 17 PRO C C -5.462 -5.076 -2.199 1.00 . A A . 17 PRO C 1 1 38 23250 1 1 17 PRO CA C -6.225 -4.517 -3.396 1.00 . A A . 17 PRO CA 1 1 38 23251 1 1 17 PRO CB C -5.884 -5.304 -4.662 1.00 . A A . 17 PRO CB 1 1 38 23252 1 1 17 PRO CD C -5.507 -2.996 -5.164 1.00 . A A . 17 PRO CD 1 1 38 23253 1 1 17 PRO CG C -5.958 -4.302 -5.761 1.00 . A A . 17 PRO CG 1 1 38 23254 1 1 17 PRO HA H -7.286 -4.577 -3.206 1.00 . A A . 17 PRO HA 1 1 38 23255 1 1 17 PRO HB2 H -4.892 -5.723 -4.574 1.00 . A A . 17 PRO HB2 1 1 38 23256 1 1 17 PRO HB3 H -6.605 -6.096 -4.802 1.00 . A A . 17 PRO HB3 1 1 38 23257 1 1 17 PRO HD2 H -4.447 -2.858 -5.317 1.00 . A A . 17 PRO HD2 1 1 38 23258 1 1 17 PRO HD3 H -6.062 -2.174 -5.592 1.00 . A A . 17 PRO HD3 1 1 38 23259 1 1 17 PRO HG2 H -5.301 -4.592 -6.568 1.00 . A A . 17 PRO HG2 1 1 38 23260 1 1 17 PRO HG3 H -6.975 -4.220 -6.116 1.00 . A A . 17 PRO HG3 1 1 38 23261 1 1 17 PRO N N -5.816 -3.149 -3.730 1.00 . A A . 17 PRO N 1 1 38 23262 1 1 17 PRO O O -4.232 -5.125 -2.202 1.00 . A A . 17 PRO O 1 1 38 23263 1 1 18 ALA C C -4.565 -7.127 -0.315 1.00 . A A . 18 ALA C 1 1 38 23264 1 1 18 ALA CA C -5.596 -6.057 0.031 1.00 . A A . 18 ALA CA 1 1 38 23265 1 1 18 ALA CB C -6.670 -6.633 0.941 1.00 . A A . 18 ALA CB 1 1 38 23266 1 1 18 ALA H H -7.178 -5.434 -1.233 1.00 . A A . 18 ALA H 1 1 38 23267 1 1 18 ALA HA H -5.103 -5.253 0.560 1.00 . A A . 18 ALA HA 1 1 38 23268 1 1 18 ALA HB1 H -7.571 -6.043 0.853 1.00 . A A . 18 ALA HB1 1 1 38 23269 1 1 18 ALA HB2 H -6.878 -7.652 0.652 1.00 . A A . 18 ALA HB2 1 1 38 23270 1 1 18 ALA HB3 H -6.325 -6.612 1.964 1.00 . A A . 18 ALA HB3 1 1 38 23271 1 1 18 ALA N N -6.201 -5.499 -1.175 1.00 . A A . 18 ALA N 1 1 38 23272 1 1 18 ALA O O -4.915 -8.222 -0.756 1.00 . A A . 18 ALA O 1 1 38 23273 1 1 19 GLY C C -1.397 -7.297 -1.609 1.00 . A A . 19 GLY C 1 1 38 23274 1 1 19 GLY CA C -2.229 -7.737 -0.421 1.00 . A A . 19 GLY CA 1 1 38 23275 1 1 19 GLY H H -3.074 -5.910 0.231 1.00 . A A . 19 GLY H 1 1 38 23276 1 1 19 GLY HA2 H -2.663 -8.702 -0.636 1.00 . A A . 19 GLY HA2 1 1 38 23277 1 1 19 GLY HA3 H -1.586 -7.827 0.442 1.00 . A A . 19 GLY HA3 1 1 38 23278 1 1 19 GLY N N -3.293 -6.799 -0.119 1.00 . A A . 19 GLY N 1 1 38 23279 1 1 19 GLY O O -0.804 -8.123 -2.302 1.00 . A A . 19 GLY O 1 1 38 23280 1 1 20 THR C C 0.686 -4.773 -2.461 1.00 . A A . 20 THR C 1 1 38 23281 1 1 20 THR CA C -0.595 -5.434 -2.957 1.00 . A A . 20 THR CA 1 1 38 23282 1 1 20 THR CB C -1.443 -4.420 -3.726 1.00 . A A . 20 THR CB 1 1 38 23283 1 1 20 THR CG2 C -0.729 -3.822 -4.919 1.00 . A A . 20 THR CG2 1 1 38 23284 1 1 20 THR H H -1.851 -5.381 -1.257 1.00 . A A . 20 THR H 1 1 38 23285 1 1 20 THR HA H -0.334 -6.247 -3.619 1.00 . A A . 20 THR HA 1 1 38 23286 1 1 20 THR HB H -1.709 -3.611 -3.060 1.00 . A A . 20 THR HB 1 1 38 23287 1 1 20 THR HG1 H -3.125 -5.387 -3.456 1.00 . A A . 20 THR HG1 1 1 38 23288 1 1 20 THR HG21 H 0.334 -3.804 -4.730 1.00 . A A . 20 THR HG21 1 1 38 23289 1 1 20 THR HG22 H -0.929 -4.420 -5.795 1.00 . A A . 20 THR HG22 1 1 38 23290 1 1 20 THR HG23 H -1.083 -2.814 -5.082 1.00 . A A . 20 THR HG23 1 1 38 23291 1 1 20 THR N N -1.356 -5.989 -1.845 1.00 . A A . 20 THR N 1 1 38 23292 1 1 20 THR O O 0.643 -3.777 -1.739 1.00 . A A . 20 THR O 1 1 38 23293 1 1 20 THR OG1 O -2.637 -5.019 -4.197 1.00 . A A . 20 THR OG1 1 1 38 23294 1 1 21 THR C C 3.282 -3.355 -2.910 1.00 . A A . 21 THR C 1 1 38 23295 1 1 21 THR CA C 3.120 -4.800 -2.450 1.00 . A A . 21 THR CA 1 1 38 23296 1 1 21 THR CB C 4.248 -5.660 -3.021 1.00 . A A . 21 THR CB 1 1 38 23297 1 1 21 THR CG2 C 4.052 -6.008 -4.481 1.00 . A A . 21 THR CG2 1 1 38 23298 1 1 21 THR H H 1.793 -6.126 -3.429 1.00 . A A . 21 THR H 1 1 38 23299 1 1 21 THR HA H 3.169 -4.829 -1.372 1.00 . A A . 21 THR HA 1 1 38 23300 1 1 21 THR HB H 4.297 -6.584 -2.465 1.00 . A A . 21 THR HB 1 1 38 23301 1 1 21 THR HG1 H 5.527 -4.257 -3.508 1.00 . A A . 21 THR HG1 1 1 38 23302 1 1 21 THR HG21 H 3.737 -5.128 -5.022 1.00 . A A . 21 THR HG21 1 1 38 23303 1 1 21 THR HG22 H 4.982 -6.371 -4.892 1.00 . A A . 21 THR HG22 1 1 38 23304 1 1 21 THR HG23 H 3.296 -6.774 -4.569 1.00 . A A . 21 THR HG23 1 1 38 23305 1 1 21 THR N N 1.825 -5.334 -2.854 1.00 . A A . 21 THR N 1 1 38 23306 1 1 21 THR O O 2.596 -2.904 -3.827 1.00 . A A . 21 THR O 1 1 38 23307 1 1 21 THR OG1 O 5.495 -4.999 -2.899 1.00 . A A . 21 THR OG1 1 1 38 23308 1 1 22 CYS C C 5.900 -1.039 -3.036 1.00 . A A . 22 CYS C 1 1 38 23309 1 1 22 CYS CA C 4.449 -1.239 -2.609 1.00 . A A . 22 CYS CA 1 1 38 23310 1 1 22 CYS CB C 4.126 -0.334 -1.419 1.00 . A A . 22 CYS CB 1 1 38 23311 1 1 22 CYS H H 4.711 -3.050 -1.545 1.00 . A A . 22 CYS H 1 1 38 23312 1 1 22 CYS HA H 3.804 -0.977 -3.435 1.00 . A A . 22 CYS HA 1 1 38 23313 1 1 22 CYS HB2 H 4.546 0.645 -1.597 1.00 . A A . 22 CYS HB2 1 1 38 23314 1 1 22 CYS HB3 H 3.053 -0.248 -1.323 1.00 . A A . 22 CYS HB3 1 1 38 23315 1 1 22 CYS N N 4.195 -2.634 -2.267 1.00 . A A . 22 CYS N 1 1 38 23316 1 1 22 CYS O O 6.181 -0.328 -4.001 1.00 . A A . 22 CYS O 1 1 38 23317 1 1 22 CYS SG S 4.779 -0.935 0.172 1.00 . A A . 22 CYS SG 1 1 38 23318 1 1 23 TRP C C 8.888 -2.941 -2.682 1.00 . A A . 23 TRP C 1 1 38 23319 1 1 23 TRP CA C 8.239 -1.562 -2.614 1.00 . A A . 23 TRP CA 1 1 38 23320 1 1 23 TRP CB C 8.943 -0.706 -1.560 1.00 . A A . 23 TRP CB 1 1 38 23321 1 1 23 TRP CD1 C 10.092 0.970 -3.121 1.00 . A A . 23 TRP CD1 1 1 38 23322 1 1 23 TRP CD2 C 11.468 -0.011 -1.652 1.00 . A A . 23 TRP CD2 1 1 38 23323 1 1 23 TRP CE2 C 12.218 0.879 -2.443 1.00 . A A . 23 TRP CE2 1 1 38 23324 1 1 23 TRP CE3 C 12.122 -0.742 -0.656 1.00 . A A . 23 TRP CE3 1 1 38 23325 1 1 23 TRP CG C 10.110 0.062 -2.101 1.00 . A A . 23 TRP CG 1 1 38 23326 1 1 23 TRP CH2 C 14.202 0.329 -1.287 1.00 . A A . 23 TRP CH2 1 1 38 23327 1 1 23 TRP CZ2 C 13.588 1.057 -2.269 1.00 . A A . 23 TRP CZ2 1 1 38 23328 1 1 23 TRP CZ3 C 13.483 -0.565 -0.485 1.00 . A A . 23 TRP CZ3 1 1 38 23329 1 1 23 TRP H H 6.531 -2.223 -1.554 1.00 . A A . 23 TRP H 1 1 38 23330 1 1 23 TRP HA H 8.337 -1.084 -3.577 1.00 . A A . 23 TRP HA 1 1 38 23331 1 1 23 TRP HB2 H 8.238 0.002 -1.152 1.00 . A A . 23 TRP HB2 1 1 38 23332 1 1 23 TRP HB3 H 9.302 -1.347 -0.768 1.00 . A A . 23 TRP HB3 1 1 38 23333 1 1 23 TRP HD1 H 9.206 1.247 -3.672 1.00 . A A . 23 TRP HD1 1 1 38 23334 1 1 23 TRP HE1 H 11.600 2.131 -4.009 1.00 . A A . 23 TRP HE1 1 1 38 23335 1 1 23 TRP HE3 H 11.584 -1.436 -0.027 1.00 . A A . 23 TRP HE3 1 1 38 23336 1 1 23 TRP HH2 H 15.264 0.435 -1.119 1.00 . A A . 23 TRP HH2 1 1 38 23337 1 1 23 TRP HZ2 H 14.157 1.743 -2.880 1.00 . A A . 23 TRP HZ2 1 1 38 23338 1 1 23 TRP HZ3 H 14.005 -1.121 0.279 1.00 . A A . 23 TRP HZ3 1 1 38 23339 1 1 23 TRP N N 6.817 -1.671 -2.311 1.00 . A A . 23 TRP N 1 1 38 23340 1 1 23 TRP NE1 N 11.356 1.466 -3.332 1.00 . A A . 23 TRP NE1 1 1 38 23341 1 1 23 TRP O O 9.274 -3.507 -1.660 1.00 . A A . 23 TRP O 1 1 38 23342 1 1 24 ARG C C 10.716 -4.723 -5.139 1.00 . A A . 24 ARG C 1 1 38 23343 1 1 24 ARG CA C 9.606 -4.788 -4.095 1.00 . A A . 24 ARG CA 1 1 38 23344 1 1 24 ARG CB C 8.542 -5.799 -4.528 1.00 . A A . 24 ARG CB 1 1 38 23345 1 1 24 ARG CD C 7.988 -8.249 -4.585 1.00 . A A . 24 ARG CD 1 1 38 23346 1 1 24 ARG CG C 9.084 -7.206 -4.724 1.00 . A A . 24 ARG CG 1 1 38 23347 1 1 24 ARG CZ C 6.628 -9.686 -6.054 1.00 . A A . 24 ARG CZ 1 1 38 23348 1 1 24 ARG H H 8.677 -2.975 -4.670 1.00 . A A . 24 ARG H 1 1 38 23349 1 1 24 ARG HA H 10.031 -5.107 -3.155 1.00 . A A . 24 ARG HA 1 1 38 23350 1 1 24 ARG HB2 H 7.770 -5.836 -3.775 1.00 . A A . 24 ARG HB2 1 1 38 23351 1 1 24 ARG HB3 H 8.108 -5.471 -5.461 1.00 . A A . 24 ARG HB3 1 1 38 23352 1 1 24 ARG HD2 H 8.397 -9.120 -4.094 1.00 . A A . 24 ARG HD2 1 1 38 23353 1 1 24 ARG HD3 H 7.192 -7.838 -3.982 1.00 . A A . 24 ARG HD3 1 1 38 23354 1 1 24 ARG HE H 7.699 -8.116 -6.662 1.00 . A A . 24 ARG HE 1 1 38 23355 1 1 24 ARG HG2 H 9.515 -7.281 -5.712 1.00 . A A . 24 ARG HG2 1 1 38 23356 1 1 24 ARG HG3 H 9.845 -7.395 -3.982 1.00 . A A . 24 ARG HG3 1 1 38 23357 1 1 24 ARG HH11 H 6.595 -10.214 -4.102 1.00 . A A . 24 ARG HH11 1 1 38 23358 1 1 24 ARG HH12 H 5.647 -11.209 -5.156 1.00 . A A . 24 ARG HH12 1 1 38 23359 1 1 24 ARG HH21 H 6.452 -9.422 -8.050 1.00 . A A . 24 ARG HH21 1 1 38 23360 1 1 24 ARG HH22 H 5.566 -10.759 -7.398 1.00 . A A . 24 ARG HH22 1 1 38 23361 1 1 24 ARG N N 9.004 -3.476 -3.894 1.00 . A A . 24 ARG N 1 1 38 23362 1 1 24 ARG NE N 7.443 -8.648 -5.881 1.00 . A A . 24 ARG NE 1 1 38 23363 1 1 24 ARG NH1 N 6.260 -10.431 -5.019 1.00 . A A . 24 ARG NH1 1 1 38 23364 1 1 24 ARG NH2 N 6.178 -9.980 -7.267 1.00 . A A . 24 ARG NH2 1 1 38 23365 1 1 24 ARG O O 10.459 -4.492 -6.320 1.00 . A A . 24 ARG O 1 1 38 23366 1 1 25 THR C C 13.613 -6.301 -5.875 1.00 . A A . 25 THR C 1 1 38 23367 1 1 25 THR CA C 13.102 -4.893 -5.590 1.00 . A A . 25 THR CA 1 1 38 23368 1 1 25 THR CB C 14.221 -4.044 -4.984 1.00 . A A . 25 THR CB 1 1 38 23369 1 1 25 THR CG2 C 14.135 -2.581 -5.361 1.00 . A A . 25 THR CG2 1 1 38 23370 1 1 25 THR H H 12.094 -5.107 -3.742 1.00 . A A . 25 THR H 1 1 38 23371 1 1 25 THR HA H 12.785 -4.443 -6.519 1.00 . A A . 25 THR HA 1 1 38 23372 1 1 25 THR HB H 15.173 -4.420 -5.332 1.00 . A A . 25 THR HB 1 1 38 23373 1 1 25 THR HG1 H 13.417 -3.686 -3.235 1.00 . A A . 25 THR HG1 1 1 38 23374 1 1 25 THR HG21 H 13.097 -2.293 -5.448 1.00 . A A . 25 THR HG21 1 1 38 23375 1 1 25 THR HG22 H 14.612 -1.984 -4.598 1.00 . A A . 25 THR HG22 1 1 38 23376 1 1 25 THR HG23 H 14.633 -2.423 -6.306 1.00 . A A . 25 THR HG23 1 1 38 23377 1 1 25 THR N N 11.952 -4.928 -4.695 1.00 . A A . 25 THR N 1 1 38 23378 1 1 25 THR O O 14.127 -6.578 -6.959 1.00 . A A . 25 THR O 1 1 38 23379 1 1 25 THR OG1 O 14.202 -4.125 -3.570 1.00 . A A . 25 THR OG1 1 1 38 23380 1 1 26 SER C C 13.552 -9.390 -3.811 1.00 . A A . 26 SER C 1 1 38 23381 1 1 26 SER CA C 13.916 -8.567 -5.041 1.00 . A A . 26 SER CA 1 1 38 23382 1 1 26 SER CB C 15.428 -8.614 -5.274 1.00 . A A . 26 SER CB 1 1 38 23383 1 1 26 SER H H 13.052 -6.906 -4.054 1.00 . A A . 26 SER H 1 1 38 23384 1 1 26 SER HA H 13.417 -8.988 -5.898 1.00 . A A . 26 SER HA 1 1 38 23385 1 1 26 SER HB2 H 15.888 -7.751 -4.815 1.00 . A A . 26 SER HB2 1 1 38 23386 1 1 26 SER HB3 H 15.831 -9.514 -4.833 1.00 . A A . 26 SER HB3 1 1 38 23387 1 1 26 SER HG H 16.436 -7.980 -6.830 1.00 . A A . 26 SER HG 1 1 38 23388 1 1 26 SER N N 13.469 -7.187 -4.895 1.00 . A A . 26 SER N 1 1 38 23389 1 1 26 SER O O 12.588 -10.156 -3.826 1.00 . A A . 26 SER O 1 1 38 23390 1 1 26 SER OG O 15.731 -8.609 -6.659 1.00 . A A . 26 SER OG 1 1 38 23391 1 1 27 VAL C C 13.021 -9.265 -0.665 1.00 . A A . 27 VAL C 1 1 38 23392 1 1 27 VAL CA C 14.093 -9.952 -1.506 1.00 . A A . 27 VAL CA 1 1 38 23393 1 1 27 VAL CB C 15.386 -10.080 -0.676 1.00 . A A . 27 VAL CB 1 1 38 23394 1 1 27 VAL CG1 C 15.913 -8.708 -0.287 1.00 . A A . 27 VAL CG1 1 1 38 23395 1 1 27 VAL CG2 C 15.148 -10.939 0.558 1.00 . A A . 27 VAL CG2 1 1 38 23396 1 1 27 VAL H H 15.081 -8.601 -2.802 1.00 . A A . 27 VAL H 1 1 38 23397 1 1 27 VAL HA H 13.753 -10.946 -1.761 1.00 . A A . 27 VAL HA 1 1 38 23398 1 1 27 VAL HB H 16.133 -10.567 -1.287 1.00 . A A . 27 VAL HB 1 1 38 23399 1 1 27 VAL HG11 H 15.505 -7.963 -0.953 1.00 . A A . 27 VAL HG11 1 1 38 23400 1 1 27 VAL HG12 H 15.619 -8.483 0.728 1.00 . A A . 27 VAL HG12 1 1 38 23401 1 1 27 VAL HG13 H 16.991 -8.703 -0.358 1.00 . A A . 27 VAL HG13 1 1 38 23402 1 1 27 VAL HG21 H 14.338 -11.627 0.367 1.00 . A A . 27 VAL HG21 1 1 38 23403 1 1 27 VAL HG22 H 16.045 -11.494 0.788 1.00 . A A . 27 VAL HG22 1 1 38 23404 1 1 27 VAL HG23 H 14.892 -10.305 1.394 1.00 . A A . 27 VAL HG23 1 1 38 23405 1 1 27 VAL N N 14.329 -9.226 -2.748 1.00 . A A . 27 VAL N 1 1 38 23406 1 1 27 VAL O O 12.265 -9.921 0.051 1.00 . A A . 27 VAL O 1 1 38 23407 1 1 28 SER C C 10.594 -7.307 -0.611 1.00 . A A . 28 SER C 1 1 38 23408 1 1 28 SER CA C 11.985 -7.164 -0.003 1.00 . A A . 28 SER CA 1 1 38 23409 1 1 28 SER CB C 12.391 -5.690 0.032 1.00 . A A . 28 SER CB 1 1 38 23410 1 1 28 SER H H 13.594 -7.474 -1.343 1.00 . A A . 28 SER H 1 1 38 23411 1 1 28 SER HA H 11.965 -7.547 1.006 1.00 . A A . 28 SER HA 1 1 38 23412 1 1 28 SER HB2 H 12.419 -5.302 -0.976 1.00 . A A . 28 SER HB2 1 1 38 23413 1 1 28 SER HB3 H 11.668 -5.134 0.611 1.00 . A A . 28 SER HB3 1 1 38 23414 1 1 28 SER HG H 13.721 -6.043 1.426 1.00 . A A . 28 SER HG 1 1 38 23415 1 1 28 SER N N 12.964 -7.940 -0.756 1.00 . A A . 28 SER N 1 1 38 23416 1 1 28 SER O O 10.449 -7.488 -1.820 1.00 . A A . 28 SER O 1 1 38 23417 1 1 28 SER OG O 13.670 -5.526 0.619 1.00 . A A . 28 SER OG 1 1 38 23418 1 1 29 SER C C 7.224 -6.825 0.841 1.00 . A A . 29 SER C 1 1 38 23419 1 1 29 SER CA C 8.192 -7.344 -0.218 1.00 . A A . 29 SER CA 1 1 38 23420 1 1 29 SER CB C 7.868 -8.801 -0.553 1.00 . A A . 29 SER CB 1 1 38 23421 1 1 29 SER H H 9.752 -7.079 1.188 1.00 . A A . 29 SER H 1 1 38 23422 1 1 29 SER HA H 8.084 -6.746 -1.111 1.00 . A A . 29 SER HA 1 1 38 23423 1 1 29 SER HB2 H 8.598 -9.178 -1.253 1.00 . A A . 29 SER HB2 1 1 38 23424 1 1 29 SER HB3 H 7.897 -9.390 0.352 1.00 . A A . 29 SER HB3 1 1 38 23425 1 1 29 SER HG H 5.950 -8.406 -0.617 1.00 . A A . 29 SER HG 1 1 38 23426 1 1 29 SER N N 9.573 -7.224 0.236 1.00 . A A . 29 SER N 1 1 38 23427 1 1 29 SER O O 6.848 -7.551 1.761 1.00 . A A . 29 SER O 1 1 38 23428 1 1 29 SER OG O 6.579 -8.917 -1.131 1.00 . A A . 29 SER OG 1 1 38 23429 1 1 30 HIS C C 4.463 -5.052 1.148 1.00 . A A . 30 HIS C 1 1 38 23430 1 1 30 HIS CA C 5.900 -4.949 1.648 1.00 . A A . 30 HIS CA 1 1 38 23431 1 1 30 HIS CB C 6.271 -3.483 1.874 1.00 . A A . 30 HIS CB 1 1 38 23432 1 1 30 HIS CD2 C 8.772 -3.921 2.403 1.00 . A A . 30 HIS CD2 1 1 38 23433 1 1 30 HIS CE1 C 9.026 -2.441 4.000 1.00 . A A . 30 HIS CE1 1 1 38 23434 1 1 30 HIS CG C 7.582 -3.297 2.572 1.00 . A A . 30 HIS CG 1 1 38 23435 1 1 30 HIS H H 7.159 -5.037 -0.051 1.00 . A A . 30 HIS H 1 1 38 23436 1 1 30 HIS HA H 5.981 -5.480 2.585 1.00 . A A . 30 HIS HA 1 1 38 23437 1 1 30 HIS HB2 H 6.330 -2.983 0.919 1.00 . A A . 30 HIS HB2 1 1 38 23438 1 1 30 HIS HB3 H 5.505 -3.013 2.473 1.00 . A A . 30 HIS HB3 1 1 38 23439 1 1 30 HIS HD1 H 7.096 -1.766 3.935 1.00 . A A . 30 HIS HD1 1 1 38 23440 1 1 30 HIS HD2 H 8.989 -4.706 1.692 1.00 . A A . 30 HIS HD2 1 1 38 23441 1 1 30 HIS HE1 H 9.463 -1.838 4.782 1.00 . A A . 30 HIS HE1 1 1 38 23442 1 1 30 HIS HE2 H 10.565 -3.684 3.470 1.00 . A A . 30 HIS HE2 1 1 38 23443 1 1 30 HIS N N 6.825 -5.565 0.704 1.00 . A A . 30 HIS N 1 1 38 23444 1 1 30 HIS ND1 N 7.775 -2.376 3.580 1.00 . A A . 30 HIS ND1 1 1 38 23445 1 1 30 HIS NE2 N 9.652 -3.371 3.302 1.00 . A A . 30 HIS NE2 1 1 38 23446 1 1 30 HIS O O 3.912 -4.091 0.610 1.00 . A A . 30 HIS O 1 1 38 23447 1 1 31 TYR C C 1.513 -5.595 1.692 1.00 . A A . 31 TYR C 1 1 38 23448 1 1 31 TYR CA C 2.489 -6.454 0.895 1.00 . A A . 31 TYR CA 1 1 38 23449 1 1 31 TYR CB C 2.126 -7.931 1.047 1.00 . A A . 31 TYR CB 1 1 38 23450 1 1 31 TYR CD1 C 3.502 -9.785 0.026 1.00 . A A . 31 TYR CD1 1 1 38 23451 1 1 31 TYR CD2 C 2.007 -8.582 -1.389 1.00 . A A . 31 TYR CD2 1 1 38 23452 1 1 31 TYR CE1 C 3.895 -10.565 -1.045 1.00 . A A . 31 TYR CE1 1 1 38 23453 1 1 31 TYR CE2 C 2.394 -9.358 -2.465 1.00 . A A . 31 TYR CE2 1 1 38 23454 1 1 31 TYR CG C 2.553 -8.782 -0.127 1.00 . A A . 31 TYR CG 1 1 38 23455 1 1 31 TYR CZ C 3.338 -10.347 -2.288 1.00 . A A . 31 TYR CZ 1 1 38 23456 1 1 31 TYR H H 4.354 -6.951 1.762 1.00 . A A . 31 TYR H 1 1 38 23457 1 1 31 TYR HA H 2.420 -6.181 -0.148 1.00 . A A . 31 TYR HA 1 1 38 23458 1 1 31 TYR HB2 H 2.605 -8.323 1.931 1.00 . A A . 31 TYR HB2 1 1 38 23459 1 1 31 TYR HB3 H 1.055 -8.023 1.152 1.00 . A A . 31 TYR HB3 1 1 38 23460 1 1 31 TYR HD1 H 3.935 -9.953 1.000 1.00 . A A . 31 TYR HD1 1 1 38 23461 1 1 31 TYR HD2 H 1.268 -7.805 -1.524 1.00 . A A . 31 TYR HD2 1 1 38 23462 1 1 31 TYR HE1 H 4.634 -11.340 -0.906 1.00 . A A . 31 TYR HE1 1 1 38 23463 1 1 31 TYR HE2 H 1.958 -9.187 -3.438 1.00 . A A . 31 TYR HE2 1 1 38 23464 1 1 31 TYR HH H 4.673 -11.280 -3.311 1.00 . A A . 31 TYR HH 1 1 38 23465 1 1 31 TYR N N 3.862 -6.223 1.328 1.00 . A A . 31 TYR N 1 1 38 23466 1 1 31 TYR O O 1.644 -5.455 2.908 1.00 . A A . 31 TYR O 1 1 38 23467 1 1 31 TYR OH O 3.727 -11.122 -3.357 1.00 . A A . 31 TYR OH 1 1 38 23468 1 1 32 CYS C C -1.541 -5.029 2.315 1.00 . A A . 32 CYS C 1 1 38 23469 1 1 32 CYS CA C -0.466 -4.180 1.646 1.00 . A A . 32 CYS CA 1 1 38 23470 1 1 32 CYS CB C -1.105 -3.236 0.627 1.00 . A A . 32 CYS CB 1 1 38 23471 1 1 32 CYS H H 0.479 -5.172 0.033 1.00 . A A . 32 CYS H 1 1 38 23472 1 1 32 CYS HA H 0.035 -3.594 2.402 1.00 . A A . 32 CYS HA 1 1 38 23473 1 1 32 CYS HB2 H -0.329 -2.790 0.023 1.00 . A A . 32 CYS HB2 1 1 38 23474 1 1 32 CYS HB3 H -1.769 -3.802 -0.011 1.00 . A A . 32 CYS HB3 1 1 38 23475 1 1 32 CYS N N 0.533 -5.023 1.000 1.00 . A A . 32 CYS N 1 1 38 23476 1 1 32 CYS O O -1.729 -6.196 1.969 1.00 . A A . 32 CYS O 1 1 38 23477 1 1 32 CYS SG S -2.072 -1.882 1.372 1.00 . A A . 32 CYS SG 1 1 38 23478 1 1 33 THR C C -4.682 -4.648 3.569 1.00 . A A . 33 THR C 1 1 38 23479 1 1 33 THR CA C -3.300 -5.142 3.993 1.00 . A A . 33 THR CA 1 1 38 23480 1 1 33 THR CB C -3.124 -4.956 5.500 1.00 . A A . 33 THR CB 1 1 38 23481 1 1 33 THR CG2 C -3.076 -3.503 5.918 1.00 . A A . 33 THR CG2 1 1 38 23482 1 1 33 THR H H -2.047 -3.506 3.506 1.00 . A A . 33 THR H 1 1 38 23483 1 1 33 THR HA H -3.218 -6.192 3.758 1.00 . A A . 33 THR HA 1 1 38 23484 1 1 33 THR HB H -2.196 -5.419 5.804 1.00 . A A . 33 THR HB 1 1 38 23485 1 1 33 THR HG1 H -5.000 -5.095 6.046 1.00 . A A . 33 THR HG1 1 1 38 23486 1 1 33 THR HG21 H -3.617 -2.904 5.200 1.00 . A A . 33 THR HG21 1 1 38 23487 1 1 33 THR HG22 H -3.529 -3.393 6.892 1.00 . A A . 33 THR HG22 1 1 38 23488 1 1 33 THR HG23 H -2.048 -3.174 5.959 1.00 . A A . 33 THR HG23 1 1 38 23489 1 1 33 THR N N -2.243 -4.438 3.275 1.00 . A A . 33 THR N 1 1 38 23490 1 1 33 THR O O -5.679 -4.923 4.238 1.00 . A A . 33 THR O 1 1 38 23491 1 1 33 THR OG1 O -4.184 -5.573 6.209 1.00 . A A . 33 THR OG1 1 1 38 23492 1 1 34 GLY C C -6.776 -2.638 3.032 1.00 . A A . 34 GLY C 1 1 38 23493 1 1 34 GLY CA C -6.007 -3.404 1.971 1.00 . A A . 34 GLY CA 1 1 38 23494 1 1 34 GLY H H -3.915 -3.730 1.961 1.00 . A A . 34 GLY H 1 1 38 23495 1 1 34 GLY HA2 H -6.612 -4.231 1.632 1.00 . A A . 34 GLY HA2 1 1 38 23496 1 1 34 GLY HA3 H -5.818 -2.745 1.136 1.00 . A A . 34 GLY HA3 1 1 38 23497 1 1 34 GLY N N -4.739 -3.919 2.457 1.00 . A A . 34 GLY N 1 1 38 23498 1 1 34 GLY O O -8.000 -2.528 2.962 1.00 . A A . 34 GLY O 1 1 38 23499 1 1 35 ARG C C -6.250 0.113 5.054 1.00 . A A . 35 ARG C 1 1 38 23500 1 1 35 ARG CA C -6.682 -1.349 5.097 1.00 . A A . 35 ARG CA 1 1 38 23501 1 1 35 ARG CB C -6.323 -1.960 6.452 1.00 . A A . 35 ARG CB 1 1 38 23502 1 1 35 ARG CD C -6.449 -4.008 7.903 1.00 . A A . 35 ARG CD 1 1 38 23503 1 1 35 ARG CG C -7.101 -3.225 6.775 1.00 . A A . 35 ARG CG 1 1 38 23504 1 1 35 ARG CZ C -8.024 -3.816 9.789 1.00 . A A . 35 ARG CZ 1 1 38 23505 1 1 35 ARG H H -5.085 -2.228 4.020 1.00 . A A . 35 ARG H 1 1 38 23506 1 1 35 ARG HA H -7.751 -1.399 4.961 1.00 . A A . 35 ARG HA 1 1 38 23507 1 1 35 ARG HB2 H -5.270 -2.200 6.459 1.00 . A A . 35 ARG HB2 1 1 38 23508 1 1 35 ARG HB3 H -6.522 -1.233 7.226 1.00 . A A . 35 ARG HB3 1 1 38 23509 1 1 35 ARG HD2 H -6.731 -5.046 7.813 1.00 . A A . 35 ARG HD2 1 1 38 23510 1 1 35 ARG HD3 H -5.377 -3.917 7.814 1.00 . A A . 35 ARG HD3 1 1 38 23511 1 1 35 ARG HE H -6.234 -2.937 9.699 1.00 . A A . 35 ARG HE 1 1 38 23512 1 1 35 ARG HG2 H -8.103 -2.954 7.071 1.00 . A A . 35 ARG HG2 1 1 38 23513 1 1 35 ARG HG3 H -7.140 -3.847 5.892 1.00 . A A . 35 ARG HG3 1 1 38 23514 1 1 35 ARG HH11 H -8.681 -4.970 8.263 1.00 . A A . 35 ARG HH11 1 1 38 23515 1 1 35 ARG HH12 H -9.769 -4.819 9.601 1.00 . A A . 35 ARG HH12 1 1 38 23516 1 1 35 ARG HH21 H -7.665 -2.738 11.460 1.00 . A A . 35 ARG HH21 1 1 38 23517 1 1 35 ARG HH22 H -9.193 -3.552 11.416 1.00 . A A . 35 ARG HH22 1 1 38 23518 1 1 35 ARG N N -6.058 -2.107 4.018 1.00 . A A . 35 ARG N 1 1 38 23519 1 1 35 ARG NE N -6.859 -3.518 9.217 1.00 . A A . 35 ARG NE 1 1 38 23520 1 1 35 ARG NH1 N -8.896 -4.599 9.166 1.00 . A A . 35 ARG NH1 1 1 38 23521 1 1 35 ARG NH2 N -8.318 -3.328 10.987 1.00 . A A . 35 ARG NH2 1 1 38 23522 1 1 35 ARG O O -7.045 1.015 5.319 1.00 . A A . 35 ARG O 1 1 38 23523 1 1 36 SER C C -3.724 1.900 3.308 1.00 . A A . 36 SER C 1 1 38 23524 1 1 36 SER CA C -4.442 1.688 4.636 1.00 . A A . 36 SER CA 1 1 38 23525 1 1 36 SER CB C -3.479 1.944 5.797 1.00 . A A . 36 SER CB 1 1 38 23526 1 1 36 SER H H -4.404 -0.424 4.517 1.00 . A A . 36 SER H 1 1 38 23527 1 1 36 SER HA H -5.266 2.383 4.703 1.00 . A A . 36 SER HA 1 1 38 23528 1 1 36 SER HB2 H -2.664 1.238 5.748 1.00 . A A . 36 SER HB2 1 1 38 23529 1 1 36 SER HB3 H -3.089 2.949 5.723 1.00 . A A . 36 SER HB3 1 1 38 23530 1 1 36 SER HG H -3.730 2.385 7.689 1.00 . A A . 36 SER HG 1 1 38 23531 1 1 36 SER N N -4.986 0.338 4.718 1.00 . A A . 36 SER N 1 1 38 23532 1 1 36 SER O O -3.345 0.939 2.637 1.00 . A A . 36 SER O 1 1 38 23533 1 1 36 SER OG O -4.134 1.799 7.045 1.00 . A A . 36 SER OG 1 1 38 23534 1 1 37 CYS C C -1.375 3.763 1.919 1.00 . A A . 37 CYS C 1 1 38 23535 1 1 37 CYS CA C -2.859 3.488 1.683 1.00 . A A . 37 CYS CA 1 1 38 23536 1 1 37 CYS CB C -3.519 4.699 1.023 1.00 . A A . 37 CYS CB 1 1 38 23537 1 1 37 CYS H H -3.856 3.887 3.507 1.00 . A A . 37 CYS H 1 1 38 23538 1 1 37 CYS HA H -2.953 2.637 1.025 1.00 . A A . 37 CYS HA 1 1 38 23539 1 1 37 CYS HB2 H -3.780 5.417 1.786 1.00 . A A . 37 CYS HB2 1 1 38 23540 1 1 37 CYS HB3 H -2.821 5.150 0.335 1.00 . A A . 37 CYS HB3 1 1 38 23541 1 1 37 CYS N N -3.536 3.161 2.932 1.00 . A A . 37 CYS N 1 1 38 23542 1 1 37 CYS O O -0.678 4.256 1.032 1.00 . A A . 37 CYS O 1 1 38 23543 1 1 37 CYS SG S -5.037 4.300 0.097 1.00 . A A . 37 CYS SG 1 1 38 23544 1 1 38 GLU C C 1.102 2.375 4.066 1.00 . A A . 38 GLU C 1 1 38 23545 1 1 38 GLU CA C 0.504 3.643 3.466 1.00 . A A . 38 GLU CA 1 1 38 23546 1 1 38 GLU CB C 0.640 4.803 4.453 1.00 . A A . 38 GLU CB 1 1 38 23547 1 1 38 GLU CD C -1.374 6.276 4.058 1.00 . A A . 38 GLU CD 1 1 38 23548 1 1 38 GLU CG C 0.128 6.127 3.910 1.00 . A A . 38 GLU CG 1 1 38 23549 1 1 38 GLU H H -1.499 3.043 3.782 1.00 . A A . 38 GLU H 1 1 38 23550 1 1 38 GLU HA H 1.039 3.886 2.560 1.00 . A A . 38 GLU HA 1 1 38 23551 1 1 38 GLU HB2 H 0.084 4.566 5.348 1.00 . A A . 38 GLU HB2 1 1 38 23552 1 1 38 GLU HB3 H 1.683 4.923 4.708 1.00 . A A . 38 GLU HB3 1 1 38 23553 1 1 38 GLU HG2 H 0.608 6.932 4.446 1.00 . A A . 38 GLU HG2 1 1 38 23554 1 1 38 GLU HG3 H 0.380 6.194 2.862 1.00 . A A . 38 GLU HG3 1 1 38 23555 1 1 38 GLU N N -0.896 3.436 3.117 1.00 . A A . 38 GLU N 1 1 38 23556 1 1 38 GLU O O 0.697 1.935 5.143 1.00 . A A . 38 GLU O 1 1 38 23557 1 1 38 GLU OE1 O -2.026 6.707 3.084 1.00 . A A . 38 GLU OE1 1 1 38 23558 1 1 38 GLU OE2 O -1.897 5.961 5.147 1.00 . A A . 38 GLU OE2 1 1 38 23559 1 1 39 CYS C C 3.326 0.762 5.213 1.00 . A A . 39 CYS C 1 1 38 23560 1 1 39 CYS CA C 2.716 0.567 3.824 1.00 . A A . 39 CYS CA 1 1 38 23561 1 1 39 CYS CB C 3.803 0.140 2.836 1.00 . A A . 39 CYS CB 1 1 38 23562 1 1 39 CYS H H 2.343 2.184 2.510 1.00 . A A . 39 CYS H 1 1 38 23563 1 1 39 CYS HA H 1.966 -0.207 3.875 1.00 . A A . 39 CYS HA 1 1 38 23564 1 1 39 CYS HB2 H 4.287 1.020 2.442 1.00 . A A . 39 CYS HB2 1 1 38 23565 1 1 39 CYS HB3 H 4.533 -0.465 3.354 1.00 . A A . 39 CYS HB3 1 1 38 23566 1 1 39 CYS N N 2.065 1.788 3.362 1.00 . A A . 39 CYS N 1 1 38 23567 1 1 39 CYS O O 3.951 1.787 5.484 1.00 . A A . 39 CYS O 1 1 38 23568 1 1 39 CYS SG S 3.183 -0.828 1.422 1.00 . A A . 39 CYS SG 1 1 38 23569 1 1 40 PRO C C 5.194 0.125 7.488 1.00 . A A . 40 PRO C 1 1 38 23570 1 1 40 PRO CA C 3.694 -0.146 7.476 1.00 . A A . 40 PRO CA 1 1 38 23571 1 1 40 PRO CB C 3.399 -1.530 8.060 1.00 . A A . 40 PRO CB 1 1 38 23572 1 1 40 PRO CD C 2.423 -1.483 5.881 1.00 . A A . 40 PRO CD 1 1 38 23573 1 1 40 PRO CG C 2.251 -2.044 7.264 1.00 . A A . 40 PRO CG 1 1 38 23574 1 1 40 PRO HA H 3.189 0.609 8.060 1.00 . A A . 40 PRO HA 1 1 38 23575 1 1 40 PRO HB2 H 4.269 -2.162 7.953 1.00 . A A . 40 PRO HB2 1 1 38 23576 1 1 40 PRO HB3 H 3.143 -1.436 9.105 1.00 . A A . 40 PRO HB3 1 1 38 23577 1 1 40 PRO HD2 H 3.004 -2.157 5.269 1.00 . A A . 40 PRO HD2 1 1 38 23578 1 1 40 PRO HD3 H 1.462 -1.292 5.429 1.00 . A A . 40 PRO HD3 1 1 38 23579 1 1 40 PRO HG2 H 2.277 -3.124 7.236 1.00 . A A . 40 PRO HG2 1 1 38 23580 1 1 40 PRO HG3 H 1.322 -1.701 7.694 1.00 . A A . 40 PRO HG3 1 1 38 23581 1 1 40 PRO N N 3.154 -0.223 6.114 1.00 . A A . 40 PRO N 1 1 38 23582 1 1 40 PRO O O 5.827 0.216 6.436 1.00 . A A . 40 PRO O 1 1 38 23583 1 1 41 SER C C 7.999 -0.745 8.547 1.00 . A A . 41 SER C 1 1 38 23584 1 1 41 SER CA C 7.185 0.512 8.833 1.00 . A A . 41 SER CA 1 1 38 23585 1 1 41 SER CB C 7.487 1.020 10.245 1.00 . A A . 41 SER CB 1 1 38 23586 1 1 41 SER H H 5.200 0.169 9.486 1.00 . A A . 41 SER H 1 1 38 23587 1 1 41 SER HA H 7.459 1.275 8.120 1.00 . A A . 41 SER HA 1 1 38 23588 1 1 41 SER HB2 H 7.193 0.271 10.965 1.00 . A A . 41 SER HB2 1 1 38 23589 1 1 41 SER HB3 H 8.546 1.211 10.337 1.00 . A A . 41 SER HB3 1 1 38 23590 1 1 41 SER HG H 7.175 2.941 10.026 1.00 . A A . 41 SER HG 1 1 38 23591 1 1 41 SER N N 5.758 0.253 8.684 1.00 . A A . 41 SER N 1 1 38 23592 1 1 41 SER O O 9.131 -0.669 8.070 1.00 . A A . 41 SER O 1 1 38 23593 1 1 41 SER OG O 6.781 2.217 10.519 1.00 . A A . 41 SER OG 1 1 38 23594 1 1 42 TYR C C 7.663 -3.787 7.282 1.00 . A A . 42 TYR C 1 1 38 23595 1 1 42 TYR CA C 8.087 -3.177 8.617 1.00 . A A . 42 TYR CA 1 1 38 23596 1 1 42 TYR CB C 7.777 -4.149 9.756 1.00 . A A . 42 TYR CB 1 1 38 23597 1 1 42 TYR CD1 C 5.447 -5.049 9.382 1.00 . A A . 42 TYR CD1 1 1 38 23598 1 1 42 TYR CD2 C 5.779 -3.483 11.149 1.00 . A A . 42 TYR CD2 1 1 38 23599 1 1 42 TYR CE1 C 4.103 -5.124 9.695 1.00 . A A . 42 TYR CE1 1 1 38 23600 1 1 42 TYR CE2 C 4.436 -3.553 11.469 1.00 . A A . 42 TYR CE2 1 1 38 23601 1 1 42 TYR CG C 6.307 -4.229 10.103 1.00 . A A . 42 TYR CG 1 1 38 23602 1 1 42 TYR CZ C 3.603 -4.374 10.739 1.00 . A A . 42 TYR CZ 1 1 38 23603 1 1 42 TYR H H 6.511 -1.899 9.221 1.00 . A A . 42 TYR H 1 1 38 23604 1 1 42 TYR HA H 9.150 -2.992 8.593 1.00 . A A . 42 TYR HA 1 1 38 23605 1 1 42 TYR HB2 H 8.104 -5.139 9.475 1.00 . A A . 42 TYR HB2 1 1 38 23606 1 1 42 TYR HB3 H 8.311 -3.837 10.642 1.00 . A A . 42 TYR HB3 1 1 38 23607 1 1 42 TYR HD1 H 5.842 -5.635 8.566 1.00 . A A . 42 TYR HD1 1 1 38 23608 1 1 42 TYR HD2 H 6.434 -2.840 11.718 1.00 . A A . 42 TYR HD2 1 1 38 23609 1 1 42 TYR HE1 H 3.451 -5.767 9.124 1.00 . A A . 42 TYR HE1 1 1 38 23610 1 1 42 TYR HE2 H 4.045 -2.966 12.286 1.00 . A A . 42 TYR HE2 1 1 38 23611 1 1 42 TYR HH H 1.965 -5.354 10.970 1.00 . A A . 42 TYR HH 1 1 38 23612 1 1 42 TYR N N 7.415 -1.903 8.842 1.00 . A A . 42 TYR N 1 1 38 23613 1 1 42 TYR O O 6.593 -3.475 6.760 1.00 . A A . 42 TYR O 1 1 38 23614 1 1 42 TYR OH O 2.265 -4.446 11.054 1.00 . A A . 42 TYR OH 1 1 38 23615 1 1 43 PRO C C 7.079 -6.343 5.548 1.00 . A A . 43 PRO C 1 1 38 23616 1 1 43 PRO CA C 8.209 -5.324 5.433 1.00 . A A . 43 PRO CA 1 1 38 23617 1 1 43 PRO CB C 9.524 -6.022 5.082 1.00 . A A . 43 PRO CB 1 1 38 23618 1 1 43 PRO CD C 9.799 -5.099 7.269 1.00 . A A . 43 PRO CD 1 1 38 23619 1 1 43 PRO CG C 10.190 -6.257 6.393 1.00 . A A . 43 PRO CG 1 1 38 23620 1 1 43 PRO HA H 7.965 -4.603 4.667 1.00 . A A . 43 PRO HA 1 1 38 23621 1 1 43 PRO HB2 H 9.316 -6.951 4.571 1.00 . A A . 43 PRO HB2 1 1 38 23622 1 1 43 PRO HB3 H 10.118 -5.381 4.448 1.00 . A A . 43 PRO HB3 1 1 38 23623 1 1 43 PRO HD2 H 9.690 -5.421 8.294 1.00 . A A . 43 PRO HD2 1 1 38 23624 1 1 43 PRO HD3 H 10.529 -4.307 7.197 1.00 . A A . 43 PRO HD3 1 1 38 23625 1 1 43 PRO HG2 H 9.841 -7.186 6.821 1.00 . A A . 43 PRO HG2 1 1 38 23626 1 1 43 PRO HG3 H 11.261 -6.282 6.262 1.00 . A A . 43 PRO HG3 1 1 38 23627 1 1 43 PRO N N 8.502 -4.670 6.712 1.00 . A A . 43 PRO N 1 1 38 23628 1 1 43 PRO O O 6.523 -6.549 6.627 1.00 . A A . 43 PRO O 1 1 38 23629 1 1 44 GLY C C 4.353 -7.391 4.867 1.00 . A A . 44 GLY C 1 1 38 23630 1 1 44 GLY CA C 5.684 -7.966 4.425 1.00 . A A . 44 GLY CA 1 1 38 23631 1 1 44 GLY H H 7.224 -6.772 3.598 1.00 . A A . 44 GLY H 1 1 38 23632 1 1 44 GLY HA2 H 5.955 -8.771 5.093 1.00 . A A . 44 GLY HA2 1 1 38 23633 1 1 44 GLY HA3 H 5.579 -8.362 3.426 1.00 . A A . 44 GLY HA3 1 1 38 23634 1 1 44 GLY N N 6.746 -6.977 4.429 1.00 . A A . 44 GLY N 1 1 38 23635 1 1 44 GLY O O 4.336 -6.240 5.353 1.00 . A A . 44 GLY O 1 1 38 23636 1 1 44 GLY OXT O 3.327 -8.090 4.725 1.00 . A A . 44 GLY OXT 1 1 39 23637 1 1 1 ALA C C -15.806 11.786 1.138 1.00 . A A . 1 ALA C 1 1 39 23638 1 1 1 ALA CA C -16.943 12.720 1.536 1.00 . A A . 1 ALA CA 1 1 39 23639 1 1 1 ALA CB C -17.160 13.774 0.462 1.00 . A A . 1 ALA CB 1 1 39 23640 1 1 1 ALA H1 H -15.667 13.652 2.853 1.00 . A A . 1 ALA H1 1 1 39 23641 1 1 1 ALA H2 H -17.292 14.194 2.927 1.00 . A A . 1 ALA H2 1 1 39 23642 1 1 1 ALA H3 H -16.866 12.670 3.591 1.00 . A A . 1 ALA H3 1 1 39 23643 1 1 1 ALA HA H -17.852 12.143 1.628 1.00 . A A . 1 ALA HA 1 1 39 23644 1 1 1 ALA HB1 H -18.131 14.229 0.594 1.00 . A A . 1 ALA HB1 1 1 39 23645 1 1 1 ALA HB2 H -16.394 14.532 0.541 1.00 . A A . 1 ALA HB2 1 1 39 23646 1 1 1 ALA HB3 H -17.110 13.311 -0.513 1.00 . A A . 1 ALA HB3 1 1 39 23647 1 1 1 ALA N N -16.667 13.367 2.845 1.00 . A A . 1 ALA N 1 1 39 23648 1 1 1 ALA O O -15.482 11.655 -0.043 1.00 . A A . 1 ALA O 1 1 39 23649 1 1 2 MET C C -12.928 10.933 1.222 1.00 . A A . 2 MET C 1 1 39 23650 1 1 2 MET CA C -14.101 10.216 1.882 1.00 . A A . 2 MET CA 1 1 39 23651 1 1 2 MET CB C -14.567 9.057 0.998 1.00 . A A . 2 MET CB 1 1 39 23652 1 1 2 MET CE C -14.992 6.804 3.118 1.00 . A A . 2 MET CE 1 1 39 23653 1 1 2 MET CG C -13.603 7.882 0.977 1.00 . A A . 2 MET CG 1 1 39 23654 1 1 2 MET H H -15.507 11.284 3.050 1.00 . A A . 2 MET H 1 1 39 23655 1 1 2 MET HA H -13.778 9.823 2.834 1.00 . A A . 2 MET HA 1 1 39 23656 1 1 2 MET HB2 H -15.522 8.705 1.361 1.00 . A A . 2 MET HB2 1 1 39 23657 1 1 2 MET HB3 H -14.686 9.416 -0.013 1.00 . A A . 2 MET HB3 1 1 39 23658 1 1 2 MET HE1 H -15.658 6.932 2.278 1.00 . A A . 2 MET HE1 1 1 39 23659 1 1 2 MET HE2 H -15.039 5.781 3.463 1.00 . A A . 2 MET HE2 1 1 39 23660 1 1 2 MET HE3 H -15.290 7.467 3.917 1.00 . A A . 2 MET HE3 1 1 39 23661 1 1 2 MET HG2 H -14.011 7.110 0.342 1.00 . A A . 2 MET HG2 1 1 39 23662 1 1 2 MET HG3 H -12.659 8.217 0.572 1.00 . A A . 2 MET HG3 1 1 39 23663 1 1 2 MET N N -15.203 11.138 2.129 1.00 . A A . 2 MET N 1 1 39 23664 1 1 2 MET O O -13.011 11.346 0.065 1.00 . A A . 2 MET O 1 1 39 23665 1 1 2 MET SD S -13.317 7.189 2.616 1.00 . A A . 2 MET SD 1 1 39 23666 1 1 3 ASP C C -9.700 10.746 0.797 1.00 . A A . 3 ASP C 1 1 39 23667 1 1 3 ASP CA C -10.646 11.747 1.453 1.00 . A A . 3 ASP CA 1 1 39 23668 1 1 3 ASP CB C -9.924 12.485 2.582 1.00 . A A . 3 ASP CB 1 1 39 23669 1 1 3 ASP CG C -10.398 13.917 2.733 1.00 . A A . 3 ASP CG 1 1 39 23670 1 1 3 ASP H H -11.831 10.729 2.881 1.00 . A A . 3 ASP H 1 1 39 23671 1 1 3 ASP HA H -10.963 12.465 0.711 1.00 . A A . 3 ASP HA 1 1 39 23672 1 1 3 ASP HB2 H -10.100 11.967 3.513 1.00 . A A . 3 ASP HB2 1 1 39 23673 1 1 3 ASP HB3 H -8.864 12.496 2.375 1.00 . A A . 3 ASP HB3 1 1 39 23674 1 1 3 ASP N N -11.837 11.079 1.966 1.00 . A A . 3 ASP N 1 1 39 23675 1 1 3 ASP O O -9.886 9.535 0.912 1.00 . A A . 3 ASP O 1 1 39 23676 1 1 3 ASP OD1 O -9.662 14.834 2.312 1.00 . A A . 3 ASP OD1 1 1 39 23677 1 1 3 ASP OD2 O -11.507 14.122 3.271 1.00 . A A . 3 ASP OD2 1 1 39 23678 1 1 4 CYS C C -6.388 10.394 0.193 1.00 . A A . 4 CYS C 1 1 39 23679 1 1 4 CYS CA C -7.711 10.413 -0.564 1.00 . A A . 4 CYS CA 1 1 39 23680 1 1 4 CYS CB C -7.480 10.900 -1.995 1.00 . A A . 4 CYS CB 1 1 39 23681 1 1 4 CYS H H -8.591 12.235 0.055 1.00 . A A . 4 CYS H 1 1 39 23682 1 1 4 CYS HA H -8.108 9.409 -0.596 1.00 . A A . 4 CYS HA 1 1 39 23683 1 1 4 CYS HB2 H -7.011 11.872 -1.965 1.00 . A A . 4 CYS HB2 1 1 39 23684 1 1 4 CYS HB3 H -6.825 10.205 -2.501 1.00 . A A . 4 CYS HB3 1 1 39 23685 1 1 4 CYS N N -8.686 11.261 0.110 1.00 . A A . 4 CYS N 1 1 39 23686 1 1 4 CYS O O -5.644 11.375 0.187 1.00 . A A . 4 CYS O 1 1 39 23687 1 1 4 CYS SG S -9.001 11.051 -2.986 1.00 . A A . 4 CYS SG 1 1 39 23688 1 1 5 THR C C -3.705 8.757 0.665 1.00 . A A . 5 THR C 1 1 39 23689 1 1 5 THR CA C -4.859 9.123 1.594 1.00 . A A . 5 THR CA 1 1 39 23690 1 1 5 THR CB C -5.021 8.058 2.681 1.00 . A A . 5 THR CB 1 1 39 23691 1 1 5 THR CG2 C -5.615 6.764 2.169 1.00 . A A . 5 THR CG2 1 1 39 23692 1 1 5 THR H H -6.727 8.522 0.800 1.00 . A A . 5 THR H 1 1 39 23693 1 1 5 THR HA H -4.641 10.071 2.061 1.00 . A A . 5 THR HA 1 1 39 23694 1 1 5 THR HB H -5.676 8.441 3.449 1.00 . A A . 5 THR HB 1 1 39 23695 1 1 5 THR HG1 H -3.209 7.314 2.632 1.00 . A A . 5 THR HG1 1 1 39 23696 1 1 5 THR HG21 H -5.740 6.824 1.098 1.00 . A A . 5 THR HG21 1 1 39 23697 1 1 5 THR HG22 H -4.954 5.944 2.409 1.00 . A A . 5 THR HG22 1 1 39 23698 1 1 5 THR HG23 H -6.576 6.600 2.635 1.00 . A A . 5 THR HG23 1 1 39 23699 1 1 5 THR N N -6.097 9.270 0.838 1.00 . A A . 5 THR N 1 1 39 23700 1 1 5 THR O O -3.225 7.625 0.669 1.00 . A A . 5 THR O 1 1 39 23701 1 1 5 THR OG1 O -3.771 7.752 3.275 1.00 . A A . 5 THR OG1 1 1 39 23702 1 1 6 THR C C -1.006 8.784 -0.431 1.00 . A A . 6 THR C 1 1 39 23703 1 1 6 THR CA C -2.177 9.515 -1.083 1.00 . A A . 6 THR CA 1 1 39 23704 1 1 6 THR CB C -1.704 10.853 -1.652 1.00 . A A . 6 THR CB 1 1 39 23705 1 1 6 THR CG2 C -2.427 11.253 -2.919 1.00 . A A . 6 THR CG2 1 1 39 23706 1 1 6 THR H H -3.699 10.607 -0.095 1.00 . A A . 6 THR H 1 1 39 23707 1 1 6 THR HA H -2.556 8.908 -1.892 1.00 . A A . 6 THR HA 1 1 39 23708 1 1 6 THR HB H -0.650 10.783 -1.880 1.00 . A A . 6 THR HB 1 1 39 23709 1 1 6 THR HG1 H -1.120 12.471 -0.715 1.00 . A A . 6 THR HG1 1 1 39 23710 1 1 6 THR HG21 H -3.095 10.459 -3.219 1.00 . A A . 6 THR HG21 1 1 39 23711 1 1 6 THR HG22 H -2.996 12.154 -2.740 1.00 . A A . 6 THR HG22 1 1 39 23712 1 1 6 THR HG23 H -1.707 11.433 -3.704 1.00 . A A . 6 THR HG23 1 1 39 23713 1 1 6 THR N N -3.270 9.726 -0.137 1.00 . A A . 6 THR N 1 1 39 23714 1 1 6 THR O O -0.507 9.196 0.616 1.00 . A A . 6 THR O 1 1 39 23715 1 1 6 THR OG1 O -1.886 11.892 -0.706 1.00 . A A . 6 THR OG1 1 1 39 23716 1 1 7 GLY C C 0.991 5.843 -1.501 1.00 . A A . 7 GLY C 1 1 39 23717 1 1 7 GLY CA C 0.532 6.920 -0.535 1.00 . A A . 7 GLY CA 1 1 39 23718 1 1 7 GLY H H -1.014 7.418 -1.892 1.00 . A A . 7 GLY H 1 1 39 23719 1 1 7 GLY HA2 H 0.224 6.452 0.388 1.00 . A A . 7 GLY HA2 1 1 39 23720 1 1 7 GLY HA3 H 1.359 7.584 -0.333 1.00 . A A . 7 GLY HA3 1 1 39 23721 1 1 7 GLY N N -0.575 7.696 -1.061 1.00 . A A . 7 GLY N 1 1 39 23722 1 1 7 GLY O O 0.606 5.853 -2.671 1.00 . A A . 7 GLY O 1 1 39 23723 1 1 8 PRO C C 1.253 2.758 -2.179 1.00 . A A . 8 PRO C 1 1 39 23724 1 1 8 PRO CA C 2.322 3.806 -1.886 1.00 . A A . 8 PRO CA 1 1 39 23725 1 1 8 PRO CB C 3.448 3.203 -1.047 1.00 . A A . 8 PRO CB 1 1 39 23726 1 1 8 PRO CD C 2.330 4.798 0.342 1.00 . A A . 8 PRO CD 1 1 39 23727 1 1 8 PRO CG C 3.052 3.477 0.362 1.00 . A A . 8 PRO CG 1 1 39 23728 1 1 8 PRO HA H 2.722 4.181 -2.816 1.00 . A A . 8 PRO HA 1 1 39 23729 1 1 8 PRO HB2 H 3.518 2.142 -1.240 1.00 . A A . 8 PRO HB2 1 1 39 23730 1 1 8 PRO HB3 H 4.383 3.683 -1.294 1.00 . A A . 8 PRO HB3 1 1 39 23731 1 1 8 PRO HD2 H 1.518 4.795 1.054 1.00 . A A . 8 PRO HD2 1 1 39 23732 1 1 8 PRO HD3 H 3.015 5.606 0.554 1.00 . A A . 8 PRO HD3 1 1 39 23733 1 1 8 PRO HG2 H 2.396 2.697 0.716 1.00 . A A . 8 PRO HG2 1 1 39 23734 1 1 8 PRO HG3 H 3.932 3.541 0.985 1.00 . A A . 8 PRO HG3 1 1 39 23735 1 1 8 PRO N N 1.819 4.891 -1.040 1.00 . A A . 8 PRO N 1 1 39 23736 1 1 8 PRO O O 1.284 2.100 -3.219 1.00 . A A . 8 PRO O 1 1 39 23737 1 1 9 CYS C C -2.074 2.339 -1.804 1.00 . A A . 9 CYS C 1 1 39 23738 1 1 9 CYS CA C -0.773 1.642 -1.417 1.00 . A A . 9 CYS CA 1 1 39 23739 1 1 9 CYS CB C -0.967 0.844 -0.124 1.00 . A A . 9 CYS CB 1 1 39 23740 1 1 9 CYS H H 0.336 3.164 -0.448 1.00 . A A . 9 CYS H 1 1 39 23741 1 1 9 CYS HA H -0.493 0.963 -2.209 1.00 . A A . 9 CYS HA 1 1 39 23742 1 1 9 CYS HB2 H -0.320 1.247 0.639 1.00 . A A . 9 CYS HB2 1 1 39 23743 1 1 9 CYS HB3 H -1.994 0.935 0.198 1.00 . A A . 9 CYS HB3 1 1 39 23744 1 1 9 CYS N N 0.308 2.609 -1.256 1.00 . A A . 9 CYS N 1 1 39 23745 1 1 9 CYS O O -3.163 1.878 -1.463 1.00 . A A . 9 CYS O 1 1 39 23746 1 1 9 CYS SG S -0.591 -0.931 -0.285 1.00 . A A . 9 CYS SG 1 1 39 23747 1 1 10 CYS C C -3.162 4.298 -4.479 1.00 . A A . 10 CYS C 1 1 39 23748 1 1 10 CYS CA C -3.113 4.217 -2.956 1.00 . A A . 10 CYS CA 1 1 39 23749 1 1 10 CYS CB C -3.074 5.624 -2.356 1.00 . A A . 10 CYS CB 1 1 39 23750 1 1 10 CYS H H -1.054 3.768 -2.760 1.00 . A A . 10 CYS H 1 1 39 23751 1 1 10 CYS HA H -3.999 3.708 -2.604 1.00 . A A . 10 CYS HA 1 1 39 23752 1 1 10 CYS HB2 H -2.224 5.701 -1.694 1.00 . A A . 10 CYS HB2 1 1 39 23753 1 1 10 CYS HB3 H -2.968 6.346 -3.153 1.00 . A A . 10 CYS HB3 1 1 39 23754 1 1 10 CYS N N -1.950 3.452 -2.519 1.00 . A A . 10 CYS N 1 1 39 23755 1 1 10 CYS O O -2.325 4.951 -5.102 1.00 . A A . 10 CYS O 1 1 39 23756 1 1 10 CYS SG S -4.559 6.068 -1.399 1.00 . A A . 10 CYS SG 1 1 39 23757 1 1 11 ARG C C -4.475 5.047 -7.059 1.00 . A A . 11 ARG C 1 1 39 23758 1 1 11 ARG CA C -4.295 3.626 -6.525 1.00 . A A . 11 ARG CA 1 1 39 23759 1 1 11 ARG CB C -5.479 2.745 -6.936 1.00 . A A . 11 ARG CB 1 1 39 23760 1 1 11 ARG CD C -4.949 1.161 -8.814 1.00 . A A . 11 ARG CD 1 1 39 23761 1 1 11 ARG CG C -5.081 1.326 -7.308 1.00 . A A . 11 ARG CG 1 1 39 23762 1 1 11 ARG CZ C -6.243 0.134 -10.642 1.00 . A A . 11 ARG CZ 1 1 39 23763 1 1 11 ARG H H -4.781 3.124 -4.526 1.00 . A A . 11 ARG H 1 1 39 23764 1 1 11 ARG HA H -3.392 3.214 -6.946 1.00 . A A . 11 ARG HA 1 1 39 23765 1 1 11 ARG HB2 H -6.178 2.696 -6.114 1.00 . A A . 11 ARG HB2 1 1 39 23766 1 1 11 ARG HB3 H -5.969 3.194 -7.788 1.00 . A A . 11 ARG HB3 1 1 39 23767 1 1 11 ARG HD2 H -4.717 2.121 -9.249 1.00 . A A . 11 ARG HD2 1 1 39 23768 1 1 11 ARG HD3 H -4.145 0.470 -9.018 1.00 . A A . 11 ARG HD3 1 1 39 23769 1 1 11 ARG HE H -6.998 0.697 -8.883 1.00 . A A . 11 ARG HE 1 1 39 23770 1 1 11 ARG HG2 H -4.132 1.097 -6.847 1.00 . A A . 11 ARG HG2 1 1 39 23771 1 1 11 ARG HG3 H -5.835 0.644 -6.944 1.00 . A A . 11 ARG HG3 1 1 39 23772 1 1 11 ARG HH11 H -4.277 0.386 -11.045 1.00 . A A . 11 ARG HH11 1 1 39 23773 1 1 11 ARG HH12 H -5.208 -0.334 -12.315 1.00 . A A . 11 ARG HH12 1 1 39 23774 1 1 11 ARG HH21 H -8.225 -0.250 -10.551 1.00 . A A . 11 ARG HH21 1 1 39 23775 1 1 11 ARG HH22 H -7.450 -0.695 -12.035 1.00 . A A . 11 ARG HH22 1 1 39 23776 1 1 11 ARG N N -4.145 3.629 -5.074 1.00 . A A . 11 ARG N 1 1 39 23777 1 1 11 ARG NE N -6.178 0.652 -9.418 1.00 . A A . 11 ARG NE 1 1 39 23778 1 1 11 ARG NH1 N -5.153 0.056 -11.396 1.00 . A A . 11 ARG NH1 1 1 39 23779 1 1 11 ARG NH2 N -7.401 -0.307 -11.115 1.00 . A A . 11 ARG NH2 1 1 39 23780 1 1 11 ARG O O -3.504 5.706 -7.429 1.00 . A A . 11 ARG O 1 1 39 23781 1 1 12 GLN C C -6.666 7.707 -6.498 1.00 . A A . 12 GLN C 1 1 39 23782 1 1 12 GLN CA C -6.016 6.857 -7.586 1.00 . A A . 12 GLN CA 1 1 39 23783 1 1 12 GLN CB C -6.934 6.785 -8.808 1.00 . A A . 12 GLN CB 1 1 39 23784 1 1 12 GLN CD C -7.679 9.005 -9.754 1.00 . A A . 12 GLN CD 1 1 39 23785 1 1 12 GLN CG C -6.670 7.876 -9.832 1.00 . A A . 12 GLN CG 1 1 39 23786 1 1 12 GLN H H -6.455 4.946 -6.790 1.00 . A A . 12 GLN H 1 1 39 23787 1 1 12 GLN HA H -5.083 7.317 -7.876 1.00 . A A . 12 GLN HA 1 1 39 23788 1 1 12 GLN HB2 H -6.798 5.828 -9.290 1.00 . A A . 12 GLN HB2 1 1 39 23789 1 1 12 GLN HB3 H -7.959 6.869 -8.479 1.00 . A A . 12 GLN HB3 1 1 39 23790 1 1 12 GLN HE21 H -7.932 8.948 -11.725 1.00 . A A . 12 GLN HE21 1 1 39 23791 1 1 12 GLN HE22 H -8.870 10.129 -10.881 1.00 . A A . 12 GLN HE22 1 1 39 23792 1 1 12 GLN HG2 H -5.685 8.283 -9.660 1.00 . A A . 12 GLN HG2 1 1 39 23793 1 1 12 GLN HG3 H -6.713 7.442 -10.820 1.00 . A A . 12 GLN HG3 1 1 39 23794 1 1 12 GLN N N -5.719 5.515 -7.097 1.00 . A A . 12 GLN N 1 1 39 23795 1 1 12 GLN NE2 N -8.215 9.401 -10.903 1.00 . A A . 12 GLN NE2 1 1 39 23796 1 1 12 GLN O O -6.619 8.936 -6.548 1.00 . A A . 12 GLN O 1 1 39 23797 1 1 12 GLN OE1 O -7.975 9.515 -8.673 1.00 . A A . 12 GLN OE1 1 1 39 23798 1 1 13 CYS C C -8.628 6.755 -3.481 1.00 . A A . 13 CYS C 1 1 39 23799 1 1 13 CYS CA C -7.935 7.745 -4.416 1.00 . A A . 13 CYS CA 1 1 39 23800 1 1 13 CYS CB C -8.954 8.751 -4.963 1.00 . A A . 13 CYS CB 1 1 39 23801 1 1 13 CYS H H -7.279 6.069 -5.528 1.00 . A A . 13 CYS H 1 1 39 23802 1 1 13 CYS HA H -7.179 8.278 -3.860 1.00 . A A . 13 CYS HA 1 1 39 23803 1 1 13 CYS HB2 H -9.138 8.535 -6.005 1.00 . A A . 13 CYS HB2 1 1 39 23804 1 1 13 CYS HB3 H -9.879 8.655 -4.413 1.00 . A A . 13 CYS HB3 1 1 39 23805 1 1 13 CYS N N -7.274 7.047 -5.514 1.00 . A A . 13 CYS N 1 1 39 23806 1 1 13 CYS O O -9.703 7.037 -2.952 1.00 . A A . 13 CYS O 1 1 39 23807 1 1 13 CYS SG S -8.420 10.489 -4.848 1.00 . A A . 13 CYS SG 1 1 39 23808 1 1 14 LYS C C -7.542 3.502 -2.079 1.00 . A A . 14 LYS C 1 1 39 23809 1 1 14 LYS CA C -8.575 4.573 -2.411 1.00 . A A . 14 LYS CA 1 1 39 23810 1 1 14 LYS CB C -9.797 3.932 -3.071 1.00 . A A . 14 LYS CB 1 1 39 23811 1 1 14 LYS CD C -12.265 3.685 -2.670 1.00 . A A . 14 LYS CD 1 1 39 23812 1 1 14 LYS CE C -13.542 4.391 -2.245 1.00 . A A . 14 LYS CE 1 1 39 23813 1 1 14 LYS CG C -11.099 4.655 -2.772 1.00 . A A . 14 LYS CG 1 1 39 23814 1 1 14 LYS H H -7.153 5.423 -3.728 1.00 . A A . 14 LYS H 1 1 39 23815 1 1 14 LYS HA H -8.884 5.053 -1.494 1.00 . A A . 14 LYS HA 1 1 39 23816 1 1 14 LYS HB2 H -9.651 3.924 -4.141 1.00 . A A . 14 LYS HB2 1 1 39 23817 1 1 14 LYS HB3 H -9.887 2.914 -2.722 1.00 . A A . 14 LYS HB3 1 1 39 23818 1 1 14 LYS HD2 H -12.423 3.224 -3.633 1.00 . A A . 14 LYS HD2 1 1 39 23819 1 1 14 LYS HD3 H -12.024 2.925 -1.940 1.00 . A A . 14 LYS HD3 1 1 39 23820 1 1 14 LYS HE2 H -13.718 5.221 -2.913 1.00 . A A . 14 LYS HE2 1 1 39 23821 1 1 14 LYS HE3 H -14.364 3.693 -2.315 1.00 . A A . 14 LYS HE3 1 1 39 23822 1 1 14 LYS HG2 H -11.000 5.183 -1.836 1.00 . A A . 14 LYS HG2 1 1 39 23823 1 1 14 LYS HG3 H -11.298 5.360 -3.566 1.00 . A A . 14 LYS HG3 1 1 39 23824 1 1 14 LYS HZ1 H -13.225 4.126 -0.198 1.00 . A A . 14 LYS HZ1 1 1 39 23825 1 1 14 LYS HZ2 H -12.718 5.631 -0.781 1.00 . A A . 14 LYS HZ2 1 1 39 23826 1 1 14 LYS HZ3 H -14.366 5.319 -0.565 1.00 . A A . 14 LYS HZ3 1 1 39 23827 1 1 14 LYS N N -8.008 5.595 -3.281 1.00 . A A . 14 LYS N 1 1 39 23828 1 1 14 LYS NZ N -13.457 4.902 -0.850 1.00 . A A . 14 LYS NZ 1 1 39 23829 1 1 14 LYS O O -6.636 3.230 -2.868 1.00 . A A . 14 LYS O 1 1 39 23830 1 1 15 LEU C C -6.717 0.708 -1.468 1.00 . A A . 15 LEU C 1 1 39 23831 1 1 15 LEU CA C -6.773 1.851 -0.460 1.00 . A A . 15 LEU CA 1 1 39 23832 1 1 15 LEU CB C -7.208 1.321 0.911 1.00 . A A . 15 LEU CB 1 1 39 23833 1 1 15 LEU CD1 C -5.100 0.309 1.824 1.00 . A A . 15 LEU CD1 1 1 39 23834 1 1 15 LEU CD2 C -7.324 -0.636 2.475 1.00 . A A . 15 LEU CD2 1 1 39 23835 1 1 15 LEU CG C -6.522 0.029 1.365 1.00 . A A . 15 LEU CG 1 1 39 23836 1 1 15 LEU H H -8.430 3.158 -0.324 1.00 . A A . 15 LEU H 1 1 39 23837 1 1 15 LEU HA H -5.790 2.285 -0.373 1.00 . A A . 15 LEU HA 1 1 39 23838 1 1 15 LEU HB2 H -7.008 2.087 1.647 1.00 . A A . 15 LEU HB2 1 1 39 23839 1 1 15 LEU HB3 H -8.273 1.145 0.882 1.00 . A A . 15 LEU HB3 1 1 39 23840 1 1 15 LEU HD11 H -4.785 1.274 1.455 1.00 . A A . 15 LEU HD11 1 1 39 23841 1 1 15 LEU HD12 H -5.063 0.308 2.903 1.00 . A A . 15 LEU HD12 1 1 39 23842 1 1 15 LEU HD13 H -4.440 -0.455 1.440 1.00 . A A . 15 LEU HD13 1 1 39 23843 1 1 15 LEU HD21 H -8.335 -0.257 2.465 1.00 . A A . 15 LEU HD21 1 1 39 23844 1 1 15 LEU HD22 H -7.338 -1.704 2.318 1.00 . A A . 15 LEU HD22 1 1 39 23845 1 1 15 LEU HD23 H -6.867 -0.418 3.428 1.00 . A A . 15 LEU HD23 1 1 39 23846 1 1 15 LEU HG H -6.473 -0.658 0.532 1.00 . A A . 15 LEU HG 1 1 39 23847 1 1 15 LEU N N -7.687 2.896 -0.906 1.00 . A A . 15 LEU N 1 1 39 23848 1 1 15 LEU O O -7.739 0.108 -1.800 1.00 . A A . 15 LEU O 1 1 39 23849 1 1 16 LYS C C -5.728 -2.009 -2.283 1.00 . A A . 16 LYS C 1 1 39 23850 1 1 16 LYS CA C -5.326 -0.673 -2.903 1.00 . A A . 16 LYS CA 1 1 39 23851 1 1 16 LYS CB C -3.869 -0.727 -3.366 1.00 . A A . 16 LYS CB 1 1 39 23852 1 1 16 LYS CD C -2.141 -0.002 -5.040 1.00 . A A . 16 LYS CD 1 1 39 23853 1 1 16 LYS CE C -1.634 1.333 -5.561 1.00 . A A . 16 LYS CE 1 1 39 23854 1 1 16 LYS CG C -3.601 0.080 -4.626 1.00 . A A . 16 LYS CG 1 1 39 23855 1 1 16 LYS H H -4.735 0.915 -1.636 1.00 . A A . 16 LYS H 1 1 39 23856 1 1 16 LYS HA H -5.961 -0.476 -3.754 1.00 . A A . 16 LYS HA 1 1 39 23857 1 1 16 LYS HB2 H -3.238 -0.345 -2.578 1.00 . A A . 16 LYS HB2 1 1 39 23858 1 1 16 LYS HB3 H -3.603 -1.756 -3.561 1.00 . A A . 16 LYS HB3 1 1 39 23859 1 1 16 LYS HD2 H -1.549 -0.290 -4.184 1.00 . A A . 16 LYS HD2 1 1 39 23860 1 1 16 LYS HD3 H -2.039 -0.745 -5.818 1.00 . A A . 16 LYS HD3 1 1 39 23861 1 1 16 LYS HE2 H -2.273 1.655 -6.370 1.00 . A A . 16 LYS HE2 1 1 39 23862 1 1 16 LYS HE3 H -1.674 2.057 -4.761 1.00 . A A . 16 LYS HE3 1 1 39 23863 1 1 16 LYS HG2 H -4.214 -0.305 -5.426 1.00 . A A . 16 LYS HG2 1 1 39 23864 1 1 16 LYS HG3 H -3.856 1.114 -4.440 1.00 . A A . 16 LYS HG3 1 1 39 23865 1 1 16 LYS HZ1 H -0.057 0.293 -6.454 1.00 . A A . 16 LYS HZ1 1 1 39 23866 1 1 16 LYS HZ2 H -0.070 1.949 -6.802 1.00 . A A . 16 LYS HZ2 1 1 39 23867 1 1 16 LYS HZ3 H 0.435 1.408 -5.282 1.00 . A A . 16 LYS HZ3 1 1 39 23868 1 1 16 LYS N N -5.514 0.406 -1.944 1.00 . A A . 16 LYS N 1 1 39 23869 1 1 16 LYS NZ N -0.233 1.239 -6.060 1.00 . A A . 16 LYS NZ 1 1 39 23870 1 1 16 LYS O O -5.824 -2.129 -1.061 1.00 . A A . 16 LYS O 1 1 39 23871 1 1 17 PRO C C -5.403 -4.899 -1.573 1.00 . A A . 17 PRO C 1 1 39 23872 1 1 17 PRO CA C -6.363 -4.362 -2.630 1.00 . A A . 17 PRO CA 1 1 39 23873 1 1 17 PRO CB C -6.315 -5.232 -3.888 1.00 . A A . 17 PRO CB 1 1 39 23874 1 1 17 PRO CD C -5.880 -2.985 -4.585 1.00 . A A . 17 PRO CD 1 1 39 23875 1 1 17 PRO CG C -6.510 -4.280 -5.017 1.00 . A A . 17 PRO CG 1 1 39 23876 1 1 17 PRO HA H -7.367 -4.355 -2.231 1.00 . A A . 17 PRO HA 1 1 39 23877 1 1 17 PRO HB2 H -5.358 -5.728 -3.949 1.00 . A A . 17 PRO HB2 1 1 39 23878 1 1 17 PRO HB3 H -7.106 -5.966 -3.851 1.00 . A A . 17 PRO HB3 1 1 39 23879 1 1 17 PRO HD2 H -4.850 -2.939 -4.907 1.00 . A A . 17 PRO HD2 1 1 39 23880 1 1 17 PRO HD3 H -6.437 -2.146 -4.976 1.00 . A A . 17 PRO HD3 1 1 39 23881 1 1 17 PRO HG2 H -6.019 -4.657 -5.903 1.00 . A A . 17 PRO HG2 1 1 39 23882 1 1 17 PRO HG3 H -7.564 -4.141 -5.202 1.00 . A A . 17 PRO HG3 1 1 39 23883 1 1 17 PRO N N -5.970 -3.035 -3.114 1.00 . A A . 17 PRO N 1 1 39 23884 1 1 17 PRO O O -4.191 -4.938 -1.784 1.00 . A A . 17 PRO O 1 1 39 23885 1 1 18 ALA C C -4.193 -6.935 0.153 1.00 . A A . 18 ALA C 1 1 39 23886 1 1 18 ALA CA C -5.145 -5.854 0.657 1.00 . A A . 18 ALA CA 1 1 39 23887 1 1 18 ALA CB C -6.045 -6.413 1.749 1.00 . A A . 18 ALA CB 1 1 39 23888 1 1 18 ALA H H -6.925 -5.260 -0.326 1.00 . A A . 18 ALA H 1 1 39 23889 1 1 18 ALA HA H -4.566 -5.042 1.080 1.00 . A A . 18 ALA HA 1 1 39 23890 1 1 18 ALA HB1 H -6.899 -5.765 1.878 1.00 . A A . 18 ALA HB1 1 1 39 23891 1 1 18 ALA HB2 H -6.381 -7.400 1.468 1.00 . A A . 18 ALA HB2 1 1 39 23892 1 1 18 ALA HB3 H -5.493 -6.470 2.675 1.00 . A A . 18 ALA HB3 1 1 39 23893 1 1 18 ALA N N -5.952 -5.315 -0.434 1.00 . A A . 18 ALA N 1 1 39 23894 1 1 18 ALA O O -4.523 -7.687 -0.763 1.00 . A A . 18 ALA O 1 1 39 23895 1 1 19 GLY C C -1.388 -7.665 -0.987 1.00 . A A . 19 GLY C 1 1 39 23896 1 1 19 GLY CA C -2.032 -7.995 0.347 1.00 . A A . 19 GLY CA 1 1 39 23897 1 1 19 GLY H H -2.799 -6.378 1.477 1.00 . A A . 19 GLY H 1 1 39 23898 1 1 19 GLY HA2 H -2.520 -8.956 0.270 1.00 . A A . 19 GLY HA2 1 1 39 23899 1 1 19 GLY HA3 H -1.261 -8.055 1.101 1.00 . A A . 19 GLY HA3 1 1 39 23900 1 1 19 GLY N N -3.010 -7.005 0.754 1.00 . A A . 19 GLY N 1 1 39 23901 1 1 19 GLY O O -0.742 -8.516 -1.599 1.00 . A A . 19 GLY O 1 1 39 23902 1 1 20 THR C C 0.273 -5.167 -2.478 1.00 . A A . 20 THR C 1 1 39 23903 1 1 20 THR CA C -0.993 -5.987 -2.708 1.00 . A A . 20 THR CA 1 1 39 23904 1 1 20 THR CB C -2.016 -5.165 -3.494 1.00 . A A . 20 THR CB 1 1 39 23905 1 1 20 THR CG2 C -1.475 -4.613 -4.796 1.00 . A A . 20 THR CG2 1 1 39 23906 1 1 20 THR H H -2.088 -5.792 -0.909 1.00 . A A . 20 THR H 1 1 39 23907 1 1 20 THR HA H -0.737 -6.868 -3.278 1.00 . A A . 20 THR HA 1 1 39 23908 1 1 20 THR HB H -2.334 -4.330 -2.887 1.00 . A A . 20 THR HB 1 1 39 23909 1 1 20 THR HG1 H -3.630 -6.156 -2.995 1.00 . A A . 20 THR HG1 1 1 39 23910 1 1 20 THR HG21 H -0.406 -4.766 -4.835 1.00 . A A . 20 THR HG21 1 1 39 23911 1 1 20 THR HG22 H -1.942 -5.124 -5.625 1.00 . A A . 20 THR HG22 1 1 39 23912 1 1 20 THR HG23 H -1.691 -3.557 -4.856 1.00 . A A . 20 THR HG23 1 1 39 23913 1 1 20 THR N N -1.563 -6.426 -1.440 1.00 . A A . 20 THR N 1 1 39 23914 1 1 20 THR O O 0.215 -4.041 -1.984 1.00 . A A . 20 THR O 1 1 39 23915 1 1 20 THR OG1 O -3.155 -5.949 -3.803 1.00 . A A . 20 THR OG1 1 1 39 23916 1 1 21 THR C C 2.673 -3.672 -3.296 1.00 . A A . 21 THR C 1 1 39 23917 1 1 21 THR CA C 2.699 -5.067 -2.678 1.00 . A A . 21 THR CA 1 1 39 23918 1 1 21 THR CB C 3.811 -5.898 -3.318 1.00 . A A . 21 THR CB 1 1 39 23919 1 1 21 THR CG2 C 3.438 -6.443 -4.679 1.00 . A A . 21 THR CG2 1 1 39 23920 1 1 21 THR H H 1.394 -6.639 -3.230 1.00 . A A . 21 THR H 1 1 39 23921 1 1 21 THR HA H 2.895 -4.975 -1.620 1.00 . A A . 21 THR HA 1 1 39 23922 1 1 21 THR HB H 4.032 -6.738 -2.676 1.00 . A A . 21 THR HB 1 1 39 23923 1 1 21 THR HG1 H 4.864 -4.477 -4.161 1.00 . A A . 21 THR HG1 1 1 39 23924 1 1 21 THR HG21 H 2.407 -6.200 -4.892 1.00 . A A . 21 THR HG21 1 1 39 23925 1 1 21 THR HG22 H 4.075 -6.002 -5.431 1.00 . A A . 21 THR HG22 1 1 39 23926 1 1 21 THR HG23 H 3.563 -7.515 -4.684 1.00 . A A . 21 THR HG23 1 1 39 23927 1 1 21 THR N N 1.414 -5.740 -2.841 1.00 . A A . 21 THR N 1 1 39 23928 1 1 21 THR O O 2.237 -3.495 -4.434 1.00 . A A . 21 THR O 1 1 39 23929 1 1 21 THR OG1 O 4.992 -5.130 -3.469 1.00 . A A . 21 THR OG1 1 1 39 23930 1 1 22 CYS C C 4.571 -0.925 -3.485 1.00 . A A . 22 CYS C 1 1 39 23931 1 1 22 CYS CA C 3.172 -1.307 -3.013 1.00 . A A . 22 CYS CA 1 1 39 23932 1 1 22 CYS CB C 2.716 -0.354 -1.906 1.00 . A A . 22 CYS CB 1 1 39 23933 1 1 22 CYS H H 3.475 -2.890 -1.641 1.00 . A A . 22 CYS H 1 1 39 23934 1 1 22 CYS HA H 2.490 -1.228 -3.846 1.00 . A A . 22 CYS HA 1 1 39 23935 1 1 22 CYS HB2 H 2.727 0.657 -2.285 1.00 . A A . 22 CYS HB2 1 1 39 23936 1 1 22 CYS HB3 H 1.709 -0.612 -1.613 1.00 . A A . 22 CYS HB3 1 1 39 23937 1 1 22 CYS N N 3.141 -2.685 -2.539 1.00 . A A . 22 CYS N 1 1 39 23938 1 1 22 CYS O O 4.730 -0.106 -4.391 1.00 . A A . 22 CYS O 1 1 39 23939 1 1 22 CYS SG S 3.757 -0.396 -0.411 1.00 . A A . 22 CYS SG 1 1 39 23940 1 1 23 TRP C C 7.476 -2.254 -4.250 1.00 . A A . 23 TRP C 1 1 39 23941 1 1 23 TRP CA C 6.970 -1.248 -3.225 1.00 . A A . 23 TRP CA 1 1 39 23942 1 1 23 TRP CB C 7.857 -1.280 -1.979 1.00 . A A . 23 TRP CB 1 1 39 23943 1 1 23 TRP CD1 C 9.375 0.539 -2.955 1.00 . A A . 23 TRP CD1 1 1 39 23944 1 1 23 TRP CD2 C 10.395 -0.831 -1.507 1.00 . A A . 23 TRP CD2 1 1 39 23945 1 1 23 TRP CE2 C 11.332 0.114 -1.966 1.00 . A A . 23 TRP CE2 1 1 39 23946 1 1 23 TRP CE3 C 10.810 -1.797 -0.586 1.00 . A A . 23 TRP CE3 1 1 39 23947 1 1 23 TRP CG C 9.150 -0.542 -2.152 1.00 . A A . 23 TRP CG 1 1 39 23948 1 1 23 TRP CH2 C 13.034 -0.836 -0.633 1.00 . A A . 23 TRP CH2 1 1 39 23949 1 1 23 TRP CZ2 C 12.656 0.121 -1.535 1.00 . A A . 23 TRP CZ2 1 1 39 23950 1 1 23 TRP CZ3 C 12.124 -1.790 -0.159 1.00 . A A . 23 TRP CZ3 1 1 39 23951 1 1 23 TRP H H 5.394 -2.169 -2.153 1.00 . A A . 23 TRP H 1 1 39 23952 1 1 23 TRP HA H 7.009 -0.264 -3.659 1.00 . A A . 23 TRP HA 1 1 39 23953 1 1 23 TRP HB2 H 7.325 -0.830 -1.155 1.00 . A A . 23 TRP HB2 1 1 39 23954 1 1 23 TRP HB3 H 8.088 -2.306 -1.736 1.00 . A A . 23 TRP HB3 1 1 39 23955 1 1 23 TRP HD1 H 8.624 1.001 -3.578 1.00 . A A . 23 TRP HD1 1 1 39 23956 1 1 23 TRP HE1 H 11.091 1.693 -3.327 1.00 . A A . 23 TRP HE1 1 1 39 23957 1 1 23 TRP HE3 H 10.123 -2.541 -0.209 1.00 . A A . 23 TRP HE3 1 1 39 23958 1 1 23 TRP HH2 H 14.051 -0.869 -0.272 1.00 . A A . 23 TRP HH2 1 1 39 23959 1 1 23 TRP HZ2 H 13.370 0.850 -1.890 1.00 . A A . 23 TRP HZ2 1 1 39 23960 1 1 23 TRP HZ3 H 12.462 -2.529 0.552 1.00 . A A . 23 TRP HZ3 1 1 39 23961 1 1 23 TRP N N 5.584 -1.524 -2.867 1.00 . A A . 23 TRP N 1 1 39 23962 1 1 23 TRP NE1 N 10.685 0.940 -2.849 1.00 . A A . 23 TRP NE1 1 1 39 23963 1 1 23 TRP O O 7.843 -1.891 -5.367 1.00 . A A . 23 TRP O 1 1 39 23964 1 1 24 ARG C C 9.418 -4.402 -5.107 1.00 . A A . 24 ARG C 1 1 39 23965 1 1 24 ARG CA C 7.951 -4.592 -4.736 1.00 . A A . 24 ARG CA 1 1 39 23966 1 1 24 ARG CB C 7.095 -4.644 -6.003 1.00 . A A . 24 ARG CB 1 1 39 23967 1 1 24 ARG CD C 6.436 -5.946 -8.049 1.00 . A A . 24 ARG CD 1 1 39 23968 1 1 24 ARG CG C 7.089 -6.006 -6.677 1.00 . A A . 24 ARG CG 1 1 39 23969 1 1 24 ARG CZ C 4.320 -7.156 -7.689 1.00 . A A . 24 ARG CZ 1 1 39 23970 1 1 24 ARG H H 7.185 -3.740 -2.955 1.00 . A A . 24 ARG H 1 1 39 23971 1 1 24 ARG HA H 7.845 -5.525 -4.203 1.00 . A A . 24 ARG HA 1 1 39 23972 1 1 24 ARG HB2 H 6.078 -4.388 -5.748 1.00 . A A . 24 ARG HB2 1 1 39 23973 1 1 24 ARG HB3 H 7.473 -3.919 -6.709 1.00 . A A . 24 ARG HB3 1 1 39 23974 1 1 24 ARG HD2 H 6.704 -5.013 -8.520 1.00 . A A . 24 ARG HD2 1 1 39 23975 1 1 24 ARG HD3 H 6.804 -6.769 -8.644 1.00 . A A . 24 ARG HD3 1 1 39 23976 1 1 24 ARG HE H 4.468 -5.214 -8.126 1.00 . A A . 24 ARG HE 1 1 39 23977 1 1 24 ARG HG2 H 8.107 -6.347 -6.789 1.00 . A A . 24 ARG HG2 1 1 39 23978 1 1 24 ARG HG3 H 6.541 -6.701 -6.057 1.00 . A A . 24 ARG HG3 1 1 39 23979 1 1 24 ARG HH11 H 5.979 -8.298 -7.507 1.00 . A A . 24 ARG HH11 1 1 39 23980 1 1 24 ARG HH12 H 4.478 -9.125 -7.259 1.00 . A A . 24 ARG HH12 1 1 39 23981 1 1 24 ARG HH21 H 2.492 -6.300 -7.800 1.00 . A A . 24 ARG HH21 1 1 39 23982 1 1 24 ARG HH22 H 2.498 -7.991 -7.425 1.00 . A A . 24 ARG HH22 1 1 39 23983 1 1 24 ARG N N 7.492 -3.521 -3.858 1.00 . A A . 24 ARG N 1 1 39 23984 1 1 24 ARG NE N 4.980 -6.034 -7.966 1.00 . A A . 24 ARG NE 1 1 39 23985 1 1 24 ARG NH1 N 4.980 -8.286 -7.467 1.00 . A A . 24 ARG NH1 1 1 39 23986 1 1 24 ARG NH2 N 2.995 -7.148 -7.633 1.00 . A A . 24 ARG NH2 1 1 39 23987 1 1 24 ARG O O 9.793 -3.393 -5.704 1.00 . A A . 24 ARG O 1 1 39 23988 1 1 25 THR C C 12.339 -6.663 -4.752 1.00 . A A . 25 THR C 1 1 39 23989 1 1 25 THR CA C 11.670 -5.324 -5.044 1.00 . A A . 25 THR CA 1 1 39 23990 1 1 25 THR CB C 12.338 -4.218 -4.225 1.00 . A A . 25 THR CB 1 1 39 23991 1 1 25 THR CG2 C 12.381 -2.886 -4.942 1.00 . A A . 25 THR CG2 1 1 39 23992 1 1 25 THR H H 9.884 -6.160 -4.276 1.00 . A A . 25 THR H 1 1 39 23993 1 1 25 THR HA H 11.783 -5.100 -6.094 1.00 . A A . 25 THR HA 1 1 39 23994 1 1 25 THR HB H 13.356 -4.509 -4.008 1.00 . A A . 25 THR HB 1 1 39 23995 1 1 25 THR HG1 H 10.795 -3.642 -3.165 1.00 . A A . 25 THR HG1 1 1 39 23996 1 1 25 THR HG21 H 12.341 -3.049 -6.009 1.00 . A A . 25 THR HG21 1 1 39 23997 1 1 25 THR HG22 H 11.536 -2.286 -4.638 1.00 . A A . 25 THR HG22 1 1 39 23998 1 1 25 THR HG23 H 13.296 -2.371 -4.691 1.00 . A A . 25 THR HG23 1 1 39 23999 1 1 25 THR N N 10.243 -5.381 -4.749 1.00 . A A . 25 THR N 1 1 39 24000 1 1 25 THR O O 11.692 -7.604 -4.292 1.00 . A A . 25 THR O 1 1 39 24001 1 1 25 THR OG1 O 11.660 -4.023 -2.997 1.00 . A A . 25 THR OG1 1 1 39 24002 1 1 26 SER C C 15.149 -7.895 -3.462 1.00 . A A . 26 SER C 1 1 39 24003 1 1 26 SER CA C 14.394 -7.966 -4.785 1.00 . A A . 26 SER CA 1 1 39 24004 1 1 26 SER CB C 15.375 -8.213 -5.933 1.00 . A A . 26 SER CB 1 1 39 24005 1 1 26 SER H H 14.099 -5.958 -5.385 1.00 . A A . 26 SER H 1 1 39 24006 1 1 26 SER HA H 13.692 -8.786 -4.742 1.00 . A A . 26 SER HA 1 1 39 24007 1 1 26 SER HB2 H 14.922 -7.908 -6.864 1.00 . A A . 26 SER HB2 1 1 39 24008 1 1 26 SER HB3 H 16.274 -7.637 -5.765 1.00 . A A . 26 SER HB3 1 1 39 24009 1 1 26 SER HG H 16.012 -9.898 -5.163 1.00 . A A . 26 SER HG 1 1 39 24010 1 1 26 SER N N 13.638 -6.742 -5.020 1.00 . A A . 26 SER N 1 1 39 24011 1 1 26 SER O O 16.216 -8.491 -3.311 1.00 . A A . 26 SER O 1 1 39 24012 1 1 26 SER OG O 15.722 -9.584 -6.023 1.00 . A A . 26 SER OG 1 1 39 24013 1 1 27 VAL C C 14.369 -7.675 -0.108 1.00 . A A . 27 VAL C 1 1 39 24014 1 1 27 VAL CA C 15.210 -7.011 -1.195 1.00 . A A . 27 VAL CA 1 1 39 24015 1 1 27 VAL CB C 15.417 -5.525 -0.839 1.00 . A A . 27 VAL CB 1 1 39 24016 1 1 27 VAL CG1 C 14.084 -4.796 -0.775 1.00 . A A . 27 VAL CG1 1 1 39 24017 1 1 27 VAL CG2 C 16.172 -5.388 0.476 1.00 . A A . 27 VAL CG2 1 1 39 24018 1 1 27 VAL H H 13.739 -6.709 -2.685 1.00 . A A . 27 VAL H 1 1 39 24019 1 1 27 VAL HA H 16.178 -7.489 -1.228 1.00 . A A . 27 VAL HA 1 1 39 24020 1 1 27 VAL HB H 16.012 -5.070 -1.618 1.00 . A A . 27 VAL HB 1 1 39 24021 1 1 27 VAL HG11 H 13.417 -5.323 -0.108 1.00 . A A . 27 VAL HG11 1 1 39 24022 1 1 27 VAL HG12 H 14.239 -3.792 -0.409 1.00 . A A . 27 VAL HG12 1 1 39 24023 1 1 27 VAL HG13 H 13.648 -4.756 -1.762 1.00 . A A . 27 VAL HG13 1 1 39 24024 1 1 27 VAL HG21 H 16.767 -6.274 0.643 1.00 . A A . 27 VAL HG21 1 1 39 24025 1 1 27 VAL HG22 H 16.819 -4.524 0.431 1.00 . A A . 27 VAL HG22 1 1 39 24026 1 1 27 VAL HG23 H 15.467 -5.270 1.285 1.00 . A A . 27 VAL HG23 1 1 39 24027 1 1 27 VAL N N 14.589 -7.161 -2.505 1.00 . A A . 27 VAL N 1 1 39 24028 1 1 27 VAL O O 14.902 -8.196 0.871 1.00 . A A . 27 VAL O 1 1 39 24029 1 1 28 SER C C 10.691 -8.120 0.216 1.00 . A A . 28 SER C 1 1 39 24030 1 1 28 SER CA C 12.138 -8.251 0.679 1.00 . A A . 28 SER CA 1 1 39 24031 1 1 28 SER CB C 12.307 -7.595 2.050 1.00 . A A . 28 SER CB 1 1 39 24032 1 1 28 SER H H 12.687 -7.221 -1.088 1.00 . A A . 28 SER H 1 1 39 24033 1 1 28 SER HA H 12.383 -9.299 0.758 1.00 . A A . 28 SER HA 1 1 39 24034 1 1 28 SER HB2 H 13.250 -7.901 2.480 1.00 . A A . 28 SER HB2 1 1 39 24035 1 1 28 SER HB3 H 12.296 -6.521 1.937 1.00 . A A . 28 SER HB3 1 1 39 24036 1 1 28 SER HG H 11.057 -7.242 3.517 1.00 . A A . 28 SER HG 1 1 39 24037 1 1 28 SER N N 13.052 -7.651 -0.287 1.00 . A A . 28 SER N 1 1 39 24038 1 1 28 SER O O 9.885 -9.031 0.400 1.00 . A A . 28 SER O 1 1 39 24039 1 1 28 SER OG O 11.262 -7.973 2.930 1.00 . A A . 28 SER OG 1 1 39 24040 1 1 29 SER C C 8.017 -6.710 0.273 1.00 . A A . 29 SER C 1 1 39 24041 1 1 29 SER CA C 9.021 -6.723 -0.876 1.00 . A A . 29 SER CA 1 1 39 24042 1 1 29 SER CB C 8.620 -7.777 -1.912 1.00 . A A . 29 SER CB 1 1 39 24043 1 1 29 SER H H 11.059 -6.292 -0.500 1.00 . A A . 29 SER H 1 1 39 24044 1 1 29 SER HA H 9.020 -5.752 -1.347 1.00 . A A . 29 SER HA 1 1 39 24045 1 1 29 SER HB2 H 7.879 -7.361 -2.577 1.00 . A A . 29 SER HB2 1 1 39 24046 1 1 29 SER HB3 H 9.491 -8.067 -2.481 1.00 . A A . 29 SER HB3 1 1 39 24047 1 1 29 SER HG H 8.724 -9.638 -1.308 1.00 . A A . 29 SER HG 1 1 39 24048 1 1 29 SER N N 10.370 -6.979 -0.385 1.00 . A A . 29 SER N 1 1 39 24049 1 1 29 SER O O 8.166 -7.445 1.249 1.00 . A A . 29 SER O 1 1 39 24050 1 1 29 SER OG O 8.077 -8.929 -1.289 1.00 . A A . 29 SER OG 1 1 39 24051 1 1 30 HIS C C 4.592 -6.105 0.612 1.00 . A A . 30 HIS C 1 1 39 24052 1 1 30 HIS CA C 5.966 -5.759 1.178 1.00 . A A . 30 HIS CA 1 1 39 24053 1 1 30 HIS CB C 5.950 -4.345 1.762 1.00 . A A . 30 HIS CB 1 1 39 24054 1 1 30 HIS CD2 C 8.495 -3.889 1.539 1.00 . A A . 30 HIS CD2 1 1 39 24055 1 1 30 HIS CE1 C 8.816 -2.916 3.478 1.00 . A A . 30 HIS CE1 1 1 39 24056 1 1 30 HIS CG C 7.302 -3.854 2.179 1.00 . A A . 30 HIS CG 1 1 39 24057 1 1 30 HIS H H 6.931 -5.309 -0.652 1.00 . A A . 30 HIS H 1 1 39 24058 1 1 30 HIS HA H 6.205 -6.461 1.963 1.00 . A A . 30 HIS HA 1 1 39 24059 1 1 30 HIS HB2 H 5.564 -3.661 1.021 1.00 . A A . 30 HIS HB2 1 1 39 24060 1 1 30 HIS HB3 H 5.307 -4.329 2.630 1.00 . A A . 30 HIS HB3 1 1 39 24061 1 1 30 HIS HD1 H 6.867 -3.064 4.084 1.00 . A A . 30 HIS HD1 1 1 39 24062 1 1 30 HIS HD2 H 8.685 -4.302 0.559 1.00 . A A . 30 HIS HD2 1 1 39 24063 1 1 30 HIS HE1 H 9.288 -2.424 4.315 1.00 . A A . 30 HIS HE1 1 1 39 24064 1 1 30 HIS HE2 H 10.350 -3.105 2.134 1.00 . A A . 30 HIS HE2 1 1 39 24065 1 1 30 HIS N N 6.995 -5.869 0.150 1.00 . A A . 30 HIS N 1 1 39 24066 1 1 30 HIS ND1 N 7.538 -3.239 3.391 1.00 . A A . 30 HIS ND1 1 1 39 24067 1 1 30 HIS NE2 N 9.418 -3.300 2.368 1.00 . A A . 30 HIS NE2 1 1 39 24068 1 1 30 HIS O O 4.480 -6.608 -0.506 1.00 . A A . 30 HIS O 1 1 39 24069 1 1 31 TYR C C 1.210 -5.117 1.589 1.00 . A A . 31 TYR C 1 1 39 24070 1 1 31 TYR CA C 2.183 -6.111 0.967 1.00 . A A . 31 TYR CA 1 1 39 24071 1 1 31 TYR CB C 1.791 -7.538 1.355 1.00 . A A . 31 TYR CB 1 1 39 24072 1 1 31 TYR CD1 C 1.919 -8.500 -0.975 1.00 . A A . 31 TYR CD1 1 1 39 24073 1 1 31 TYR CD2 C 3.042 -9.655 0.782 1.00 . A A . 31 TYR CD2 1 1 39 24074 1 1 31 TYR CE1 C 2.346 -9.453 -1.880 1.00 . A A . 31 TYR CE1 1 1 39 24075 1 1 31 TYR CE2 C 3.473 -10.612 -0.116 1.00 . A A . 31 TYR CE2 1 1 39 24076 1 1 31 TYR CG C 2.259 -8.584 0.369 1.00 . A A . 31 TYR CG 1 1 39 24077 1 1 31 TYR CZ C 3.122 -10.507 -1.446 1.00 . A A . 31 TYR CZ 1 1 39 24078 1 1 31 TYR H H 3.705 -5.430 2.271 1.00 . A A . 31 TYR H 1 1 39 24079 1 1 31 TYR HA H 2.142 -6.015 -0.107 1.00 . A A . 31 TYR HA 1 1 39 24080 1 1 31 TYR HB2 H 2.220 -7.773 2.317 1.00 . A A . 31 TYR HB2 1 1 39 24081 1 1 31 TYR HB3 H 0.714 -7.602 1.421 1.00 . A A . 31 TYR HB3 1 1 39 24082 1 1 31 TYR HD1 H 1.311 -7.673 -1.311 1.00 . A A . 31 TYR HD1 1 1 39 24083 1 1 31 TYR HD2 H 3.315 -9.734 1.824 1.00 . A A . 31 TYR HD2 1 1 39 24084 1 1 31 TYR HE1 H 2.071 -9.370 -2.921 1.00 . A A . 31 TYR HE1 1 1 39 24085 1 1 31 TYR HE2 H 4.081 -11.437 0.224 1.00 . A A . 31 TYR HE2 1 1 39 24086 1 1 31 TYR HH H 4.221 -11.081 -2.915 1.00 . A A . 31 TYR HH 1 1 39 24087 1 1 31 TYR N N 3.551 -5.831 1.390 1.00 . A A . 31 TYR N 1 1 39 24088 1 1 31 TYR O O 1.426 -4.638 2.703 1.00 . A A . 31 TYR O 1 1 39 24089 1 1 31 TYR OH O 3.549 -11.458 -2.343 1.00 . A A . 31 TYR OH 1 1 39 24090 1 1 32 CYS C C -1.530 -4.404 2.617 1.00 . A A . 32 CYS C 1 1 39 24091 1 1 32 CYS CA C -0.862 -3.870 1.358 1.00 . A A . 32 CYS CA 1 1 39 24092 1 1 32 CYS CB C -1.916 -3.598 0.282 1.00 . A A . 32 CYS CB 1 1 39 24093 1 1 32 CYS H H 0.015 -5.219 -0.013 1.00 . A A . 32 CYS H 1 1 39 24094 1 1 32 CYS HA H -0.358 -2.946 1.597 1.00 . A A . 32 CYS HA 1 1 39 24095 1 1 32 CYS HB2 H -1.541 -3.935 -0.672 1.00 . A A . 32 CYS HB2 1 1 39 24096 1 1 32 CYS HB3 H -2.816 -4.145 0.522 1.00 . A A . 32 CYS HB3 1 1 39 24097 1 1 32 CYS N N 0.137 -4.808 0.867 1.00 . A A . 32 CYS N 1 1 39 24098 1 1 32 CYS O O -1.949 -5.560 2.670 1.00 . A A . 32 CYS O 1 1 39 24099 1 1 32 CYS SG S -2.362 -1.840 0.109 1.00 . A A . 32 CYS SG 1 1 39 24100 1 1 33 THR C C -3.773 -3.974 4.766 1.00 . A A . 33 THR C 1 1 39 24101 1 1 33 THR CA C -2.251 -3.928 4.891 1.00 . A A . 33 THR CA 1 1 39 24102 1 1 33 THR CB C -1.857 -2.935 5.981 1.00 . A A . 33 THR CB 1 1 39 24103 1 1 33 THR CG2 C -2.319 -1.525 5.686 1.00 . A A . 33 THR CG2 1 1 39 24104 1 1 33 THR H H -1.278 -2.643 3.522 1.00 . A A . 33 THR H 1 1 39 24105 1 1 33 THR HA H -1.891 -4.909 5.161 1.00 . A A . 33 THR HA 1 1 39 24106 1 1 33 THR HB H -0.781 -2.919 6.071 1.00 . A A . 33 THR HB 1 1 39 24107 1 1 33 THR HG1 H -3.363 -3.322 7.173 1.00 . A A . 33 THR HG1 1 1 39 24108 1 1 33 THR HG21 H -2.844 -1.511 4.741 1.00 . A A . 33 THR HG21 1 1 39 24109 1 1 33 THR HG22 H -2.981 -1.191 6.471 1.00 . A A . 33 THR HG22 1 1 39 24110 1 1 33 THR HG23 H -1.463 -0.869 5.633 1.00 . A A . 33 THR HG23 1 1 39 24111 1 1 33 THR N N -1.629 -3.551 3.628 1.00 . A A . 33 THR N 1 1 39 24112 1 1 33 THR O O -4.469 -4.329 5.717 1.00 . A A . 33 THR O 1 1 39 24113 1 1 33 THR OG1 O -2.404 -3.316 7.231 1.00 . A A . 33 THR OG1 1 1 39 24114 1 1 34 GLY C C -6.465 -2.766 4.403 1.00 . A A . 34 GLY C 1 1 39 24115 1 1 34 GLY CA C -5.724 -3.615 3.384 1.00 . A A . 34 GLY CA 1 1 39 24116 1 1 34 GLY H H -3.690 -3.332 2.865 1.00 . A A . 34 GLY H 1 1 39 24117 1 1 34 GLY HA2 H -6.082 -4.631 3.453 1.00 . A A . 34 GLY HA2 1 1 39 24118 1 1 34 GLY HA3 H -5.935 -3.236 2.395 1.00 . A A . 34 GLY HA3 1 1 39 24119 1 1 34 GLY N N -4.288 -3.609 3.593 1.00 . A A . 34 GLY N 1 1 39 24120 1 1 34 GLY O O -7.646 -2.993 4.667 1.00 . A A . 34 GLY O 1 1 39 24121 1 1 35 ARG C C -6.185 0.559 5.592 1.00 . A A . 35 ARG C 1 1 39 24122 1 1 35 ARG CA C -6.371 -0.906 5.973 1.00 . A A . 35 ARG CA 1 1 39 24123 1 1 35 ARG CB C -5.761 -1.168 7.351 1.00 . A A . 35 ARG CB 1 1 39 24124 1 1 35 ARG CD C -6.627 0.563 8.954 1.00 . A A . 35 ARG CD 1 1 39 24125 1 1 35 ARG CG C -6.713 -0.886 8.502 1.00 . A A . 35 ARG CG 1 1 39 24126 1 1 35 ARG CZ C -5.604 1.811 10.816 1.00 . A A . 35 ARG CZ 1 1 39 24127 1 1 35 ARG H H -4.832 -1.656 4.727 1.00 . A A . 35 ARG H 1 1 39 24128 1 1 35 ARG HA H -7.426 -1.122 6.011 1.00 . A A . 35 ARG HA 1 1 39 24129 1 1 35 ARG HB2 H -5.458 -2.203 7.408 1.00 . A A . 35 ARG HB2 1 1 39 24130 1 1 35 ARG HB3 H -4.889 -0.540 7.471 1.00 . A A . 35 ARG HB3 1 1 39 24131 1 1 35 ARG HD2 H -6.352 1.175 8.107 1.00 . A A . 35 ARG HD2 1 1 39 24132 1 1 35 ARG HD3 H -7.596 0.871 9.319 1.00 . A A . 35 ARG HD3 1 1 39 24133 1 1 35 ARG HE H -4.967 0.046 10.135 1.00 . A A . 35 ARG HE 1 1 39 24134 1 1 35 ARG HG2 H -7.722 -1.093 8.180 1.00 . A A . 35 ARG HG2 1 1 39 24135 1 1 35 ARG HG3 H -6.458 -1.528 9.333 1.00 . A A . 35 ARG HG3 1 1 39 24136 1 1 35 ARG HH11 H -7.203 2.721 9.976 1.00 . A A . 35 ARG HH11 1 1 39 24137 1 1 35 ARG HH12 H -6.465 3.578 11.287 1.00 . A A . 35 ARG HH12 1 1 39 24138 1 1 35 ARG HH21 H -3.996 1.171 11.860 1.00 . A A . 35 ARG HH21 1 1 39 24139 1 1 35 ARG HH22 H -4.644 2.699 12.357 1.00 . A A . 35 ARG HH22 1 1 39 24140 1 1 35 ARG N N -5.770 -1.788 4.978 1.00 . A A . 35 ARG N 1 1 39 24141 1 1 35 ARG NE N -5.639 0.749 10.014 1.00 . A A . 35 ARG NE 1 1 39 24142 1 1 35 ARG NH1 N -6.497 2.783 10.682 1.00 . A A . 35 ARG NH1 1 1 39 24143 1 1 35 ARG NH2 N -4.672 1.901 11.755 1.00 . A A . 35 ARG NH2 1 1 39 24144 1 1 35 ARG O O -7.115 1.360 5.689 1.00 . A A . 35 ARG O 1 1 39 24145 1 1 36 SER C C -3.688 2.278 3.587 1.00 . A A . 36 SER C 1 1 39 24146 1 1 36 SER CA C -4.665 2.267 4.758 1.00 . A A . 36 SER CA 1 1 39 24147 1 1 36 SER CB C -4.076 3.043 5.937 1.00 . A A . 36 SER CB 1 1 39 24148 1 1 36 SER H H -4.283 0.213 5.103 1.00 . A A . 36 SER H 1 1 39 24149 1 1 36 SER HA H -5.585 2.741 4.449 1.00 . A A . 36 SER HA 1 1 39 24150 1 1 36 SER HB2 H -4.155 4.102 5.744 1.00 . A A . 36 SER HB2 1 1 39 24151 1 1 36 SER HB3 H -4.623 2.799 6.836 1.00 . A A . 36 SER HB3 1 1 39 24152 1 1 36 SER HG H -2.631 2.086 6.852 1.00 . A A . 36 SER HG 1 1 39 24153 1 1 36 SER N N -4.979 0.899 5.158 1.00 . A A . 36 SER N 1 1 39 24154 1 1 36 SER O O -3.014 1.284 3.319 1.00 . A A . 36 SER O 1 1 39 24155 1 1 36 SER OG O -2.710 2.716 6.132 1.00 . A A . 36 SER OG 1 1 39 24156 1 1 37 CYS C C -1.263 3.631 2.205 1.00 . A A . 37 CYS C 1 1 39 24157 1 1 37 CYS CA C -2.718 3.544 1.749 1.00 . A A . 37 CYS CA 1 1 39 24158 1 1 37 CYS CB C -3.086 4.781 0.928 1.00 . A A . 37 CYS CB 1 1 39 24159 1 1 37 CYS H H -4.176 4.171 3.152 1.00 . A A . 37 CYS H 1 1 39 24160 1 1 37 CYS HA H -2.835 2.666 1.132 1.00 . A A . 37 CYS HA 1 1 39 24161 1 1 37 CYS HB2 H -3.166 5.630 1.589 1.00 . A A . 37 CYS HB2 1 1 39 24162 1 1 37 CYS HB3 H -2.309 4.967 0.202 1.00 . A A . 37 CYS HB3 1 1 39 24163 1 1 37 CYS N N -3.615 3.409 2.891 1.00 . A A . 37 CYS N 1 1 39 24164 1 1 37 CYS O O -0.346 3.330 1.441 1.00 . A A . 37 CYS O 1 1 39 24165 1 1 37 CYS SG S -4.664 4.628 0.029 1.00 . A A . 37 CYS SG 1 1 39 24166 1 1 38 GLU C C 0.867 2.787 4.315 1.00 . A A . 38 GLU C 1 1 39 24167 1 1 38 GLU CA C 0.285 4.163 4.006 1.00 . A A . 38 GLU CA 1 1 39 24168 1 1 38 GLU CB C 0.264 5.018 5.274 1.00 . A A . 38 GLU CB 1 1 39 24169 1 1 38 GLU CD C 1.187 7.319 4.794 1.00 . A A . 38 GLU CD 1 1 39 24170 1 1 38 GLU CG C -0.056 6.481 5.016 1.00 . A A . 38 GLU CG 1 1 39 24171 1 1 38 GLU H H -1.828 4.267 4.016 1.00 . A A . 38 GLU H 1 1 39 24172 1 1 38 GLU HA H 0.906 4.646 3.266 1.00 . A A . 38 GLU HA 1 1 39 24173 1 1 38 GLU HB2 H -0.481 4.622 5.948 1.00 . A A . 38 GLU HB2 1 1 39 24174 1 1 38 GLU HB3 H 1.233 4.962 5.748 1.00 . A A . 38 GLU HB3 1 1 39 24175 1 1 38 GLU HG2 H -0.679 6.550 4.137 1.00 . A A . 38 GLU HG2 1 1 39 24176 1 1 38 GLU HG3 H -0.591 6.875 5.868 1.00 . A A . 38 GLU HG3 1 1 39 24177 1 1 38 GLU N N -1.058 4.042 3.453 1.00 . A A . 38 GLU N 1 1 39 24178 1 1 38 GLU O O 0.562 2.190 5.347 1.00 . A A . 38 GLU O 1 1 39 24179 1 1 38 GLU OE1 O 2.150 6.805 4.186 1.00 . A A . 38 GLU OE1 1 1 39 24180 1 1 38 GLU OE2 O 1.199 8.491 5.228 1.00 . A A . 38 GLU OE2 1 1 39 24181 1 1 39 CYS C C 3.144 0.931 4.875 1.00 . A A . 39 CYS C 1 1 39 24182 1 1 39 CYS CA C 2.328 0.981 3.585 1.00 . A A . 39 CYS CA 1 1 39 24183 1 1 39 CYS CB C 3.223 0.656 2.386 1.00 . A A . 39 CYS CB 1 1 39 24184 1 1 39 CYS H H 1.907 2.811 2.608 1.00 . A A . 39 CYS H 1 1 39 24185 1 1 39 CYS HA H 1.539 0.245 3.643 1.00 . A A . 39 CYS HA 1 1 39 24186 1 1 39 CYS HB2 H 3.533 1.578 1.918 1.00 . A A . 39 CYS HB2 1 1 39 24187 1 1 39 CYS HB3 H 4.096 0.122 2.732 1.00 . A A . 39 CYS HB3 1 1 39 24188 1 1 39 CYS N N 1.705 2.288 3.411 1.00 . A A . 39 CYS N 1 1 39 24189 1 1 39 CYS O O 3.759 1.922 5.269 1.00 . A A . 39 CYS O 1 1 39 24190 1 1 39 CYS SG S 2.415 -0.368 1.113 1.00 . A A . 39 CYS SG 1 1 39 24191 1 1 40 PRO C C 5.411 -0.491 6.574 1.00 . A A . 40 PRO C 1 1 39 24192 1 1 40 PRO CA C 3.906 -0.403 6.804 1.00 . A A . 40 PRO CA 1 1 39 24193 1 1 40 PRO CB C 3.371 -1.726 7.351 1.00 . A A . 40 PRO CB 1 1 39 24194 1 1 40 PRO CD C 2.455 -1.464 5.156 1.00 . A A . 40 PRO CD 1 1 39 24195 1 1 40 PRO CG C 2.948 -2.488 6.144 1.00 . A A . 40 PRO CG 1 1 39 24196 1 1 40 PRO HA H 3.696 0.392 7.504 1.00 . A A . 40 PRO HA 1 1 39 24197 1 1 40 PRO HB2 H 4.154 -2.239 7.890 1.00 . A A . 40 PRO HB2 1 1 39 24198 1 1 40 PRO HB3 H 2.536 -1.536 8.009 1.00 . A A . 40 PRO HB3 1 1 39 24199 1 1 40 PRO HD2 H 2.721 -1.753 4.150 1.00 . A A . 40 PRO HD2 1 1 39 24200 1 1 40 PRO HD3 H 1.386 -1.341 5.243 1.00 . A A . 40 PRO HD3 1 1 39 24201 1 1 40 PRO HG2 H 3.791 -3.026 5.736 1.00 . A A . 40 PRO HG2 1 1 39 24202 1 1 40 PRO HG3 H 2.153 -3.172 6.401 1.00 . A A . 40 PRO HG3 1 1 39 24203 1 1 40 PRO N N 3.161 -0.230 5.554 1.00 . A A . 40 PRO N 1 1 39 24204 1 1 40 PRO O O 5.879 -0.460 5.436 1.00 . A A . 40 PRO O 1 1 39 24205 1 1 41 SER C C 8.089 -2.114 7.894 1.00 . A A . 41 SER C 1 1 39 24206 1 1 41 SER CA C 7.617 -0.697 7.581 1.00 . A A . 41 SER CA 1 1 39 24207 1 1 41 SER CB C 8.269 0.295 8.547 1.00 . A A . 41 SER CB 1 1 39 24208 1 1 41 SER H H 5.733 -0.623 8.543 1.00 . A A . 41 SER H 1 1 39 24209 1 1 41 SER HA H 7.909 -0.448 6.572 1.00 . A A . 41 SER HA 1 1 39 24210 1 1 41 SER HB2 H 9.341 0.259 8.427 1.00 . A A . 41 SER HB2 1 1 39 24211 1 1 41 SER HB3 H 7.915 1.292 8.328 1.00 . A A . 41 SER HB3 1 1 39 24212 1 1 41 SER HG H 8.273 -0.898 10.101 1.00 . A A . 41 SER HG 1 1 39 24213 1 1 41 SER N N 6.164 -0.603 7.663 1.00 . A A . 41 SER N 1 1 39 24214 1 1 41 SER O O 9.179 -2.311 8.431 1.00 . A A . 41 SER O 1 1 39 24215 1 1 41 SER OG O 7.950 -0.018 9.892 1.00 . A A . 41 SER OG 1 1 39 24216 1 1 42 TYR C C 7.982 -5.197 6.502 1.00 . A A . 42 TYR C 1 1 39 24217 1 1 42 TYR CA C 7.593 -4.495 7.800 1.00 . A A . 42 TYR CA 1 1 39 24218 1 1 42 TYR CB C 6.410 -5.217 8.449 1.00 . A A . 42 TYR CB 1 1 39 24219 1 1 42 TYR CD1 C 6.493 -4.006 10.663 1.00 . A A . 42 TYR CD1 1 1 39 24220 1 1 42 TYR CD2 C 4.405 -4.117 9.519 1.00 . A A . 42 TYR CD2 1 1 39 24221 1 1 42 TYR CE1 C 5.900 -3.289 11.684 1.00 . A A . 42 TYR CE1 1 1 39 24222 1 1 42 TYR CE2 C 3.805 -3.400 10.536 1.00 . A A . 42 TYR CE2 1 1 39 24223 1 1 42 TYR CG C 5.757 -4.432 9.564 1.00 . A A . 42 TYR CG 1 1 39 24224 1 1 42 TYR CZ C 4.556 -2.988 11.616 1.00 . A A . 42 TYR CZ 1 1 39 24225 1 1 42 TYR H H 6.405 -2.876 7.131 1.00 . A A . 42 TYR H 1 1 39 24226 1 1 42 TYR HA H 8.434 -4.522 8.477 1.00 . A A . 42 TYR HA 1 1 39 24227 1 1 42 TYR HB2 H 5.659 -5.410 7.697 1.00 . A A . 42 TYR HB2 1 1 39 24228 1 1 42 TYR HB3 H 6.752 -6.156 8.858 1.00 . A A . 42 TYR HB3 1 1 39 24229 1 1 42 TYR HD1 H 7.546 -4.243 10.713 1.00 . A A . 42 TYR HD1 1 1 39 24230 1 1 42 TYR HD2 H 3.819 -4.441 8.672 1.00 . A A . 42 TYR HD2 1 1 39 24231 1 1 42 TYR HE1 H 6.490 -2.967 12.530 1.00 . A A . 42 TYR HE1 1 1 39 24232 1 1 42 TYR HE2 H 2.752 -3.165 10.482 1.00 . A A . 42 TYR HE2 1 1 39 24233 1 1 42 TYR HH H 4.496 -1.503 12.835 1.00 . A A . 42 TYR HH 1 1 39 24234 1 1 42 TYR N N 7.260 -3.096 7.556 1.00 . A A . 42 TYR N 1 1 39 24235 1 1 42 TYR O O 7.497 -4.846 5.427 1.00 . A A . 42 TYR O 1 1 39 24236 1 1 42 TYR OH O 3.962 -2.274 12.631 1.00 . A A . 42 TYR OH 1 1 39 24237 1 1 43 PRO C C 8.223 -7.841 4.829 1.00 . A A . 43 PRO C 1 1 39 24238 1 1 43 PRO CA C 9.321 -6.957 5.410 1.00 . A A . 43 PRO CA 1 1 39 24239 1 1 43 PRO CB C 10.466 -7.814 5.955 1.00 . A A . 43 PRO CB 1 1 39 24240 1 1 43 PRO CD C 9.497 -6.689 7.829 1.00 . A A . 43 PRO CD 1 1 39 24241 1 1 43 PRO CG C 10.166 -7.968 7.406 1.00 . A A . 43 PRO CG 1 1 39 24242 1 1 43 PRO HA H 9.696 -6.298 4.641 1.00 . A A . 43 PRO HA 1 1 39 24243 1 1 43 PRO HB2 H 10.476 -8.768 5.450 1.00 . A A . 43 PRO HB2 1 1 39 24244 1 1 43 PRO HB3 H 11.406 -7.307 5.799 1.00 . A A . 43 PRO HB3 1 1 39 24245 1 1 43 PRO HD2 H 8.752 -6.885 8.586 1.00 . A A . 43 PRO HD2 1 1 39 24246 1 1 43 PRO HD3 H 10.229 -5.982 8.191 1.00 . A A . 43 PRO HD3 1 1 39 24247 1 1 43 PRO HG2 H 9.501 -8.806 7.557 1.00 . A A . 43 PRO HG2 1 1 39 24248 1 1 43 PRO HG3 H 11.083 -8.111 7.958 1.00 . A A . 43 PRO HG3 1 1 39 24249 1 1 43 PRO N N 8.869 -6.205 6.585 1.00 . A A . 43 PRO N 1 1 39 24250 1 1 43 PRO O O 8.226 -8.149 3.638 1.00 . A A . 43 PRO O 1 1 39 24251 1 1 44 GLY C C 6.356 -10.531 5.670 1.00 . A A . 44 GLY C 1 1 39 24252 1 1 44 GLY CA C 6.193 -9.089 5.230 1.00 . A A . 44 GLY CA 1 1 39 24253 1 1 44 GLY H H 7.333 -7.967 6.617 1.00 . A A . 44 GLY H 1 1 39 24254 1 1 44 GLY HA2 H 6.147 -9.057 4.152 1.00 . A A . 44 GLY HA2 1 1 39 24255 1 1 44 GLY HA3 H 5.267 -8.705 5.632 1.00 . A A . 44 GLY HA3 1 1 39 24256 1 1 44 GLY N N 7.284 -8.245 5.679 1.00 . A A . 44 GLY N 1 1 39 24257 1 1 44 GLY O O 7.007 -10.764 6.711 1.00 . A A . 44 GLY O 1 1 39 24258 1 1 44 GLY OXT O 5.833 -11.427 4.975 1.00 . A A . 44 GLY OXT 1 1 40 24259 1 1 1 ALA C C -14.474 7.134 2.173 1.00 . A A . 1 ALA C 1 1 40 24260 1 1 1 ALA CA C -14.597 5.622 2.021 1.00 . A A . 1 ALA CA 1 1 40 24261 1 1 1 ALA CB C -13.598 5.113 0.993 1.00 . A A . 1 ALA CB 1 1 40 24262 1 1 1 ALA H1 H -16.629 5.625 2.342 1.00 . A A . 1 ALA H1 1 1 40 24263 1 1 1 ALA H2 H -16.165 5.638 0.689 1.00 . A A . 1 ALA H2 1 1 40 24264 1 1 1 ALA H3 H -16.024 4.197 1.612 1.00 . A A . 1 ALA H3 1 1 40 24265 1 1 1 ALA HA H -14.369 5.156 2.968 1.00 . A A . 1 ALA HA 1 1 40 24266 1 1 1 ALA HB1 H -13.599 4.033 0.993 1.00 . A A . 1 ALA HB1 1 1 40 24267 1 1 1 ALA HB2 H -13.875 5.472 0.013 1.00 . A A . 1 ALA HB2 1 1 40 24268 1 1 1 ALA HB3 H -12.610 5.472 1.242 1.00 . A A . 1 ALA HB3 1 1 40 24269 1 1 1 ALA N N -15.978 5.236 1.631 1.00 . A A . 1 ALA N 1 1 40 24270 1 1 1 ALA O O -15.346 7.885 1.737 1.00 . A A . 1 ALA O 1 1 40 24271 1 1 2 MET C C -11.654 9.306 3.004 1.00 . A A . 2 MET C 1 1 40 24272 1 1 2 MET CA C -13.148 8.997 3.006 1.00 . A A . 2 MET CA 1 1 40 24273 1 1 2 MET CB C -13.773 9.450 4.327 1.00 . A A . 2 MET CB 1 1 40 24274 1 1 2 MET CE C -14.909 11.997 2.373 1.00 . A A . 2 MET CE 1 1 40 24275 1 1 2 MET CG C -15.210 9.925 4.188 1.00 . A A . 2 MET CG 1 1 40 24276 1 1 2 MET H H -12.725 6.926 3.121 1.00 . A A . 2 MET H 1 1 40 24277 1 1 2 MET HA H -13.615 9.534 2.194 1.00 . A A . 2 MET HA 1 1 40 24278 1 1 2 MET HB2 H -13.754 8.624 5.022 1.00 . A A . 2 MET HB2 1 1 40 24279 1 1 2 MET HB3 H -13.185 10.262 4.730 1.00 . A A . 2 MET HB3 1 1 40 24280 1 1 2 MET HE1 H -14.968 11.064 1.832 1.00 . A A . 2 MET HE1 1 1 40 24281 1 1 2 MET HE2 H -15.595 12.709 1.939 1.00 . A A . 2 MET HE2 1 1 40 24282 1 1 2 MET HE3 H -13.903 12.385 2.313 1.00 . A A . 2 MET HE3 1 1 40 24283 1 1 2 MET HG2 H -15.631 9.498 3.291 1.00 . A A . 2 MET HG2 1 1 40 24284 1 1 2 MET HG3 H -15.771 9.584 5.046 1.00 . A A . 2 MET HG3 1 1 40 24285 1 1 2 MET N N -13.385 7.574 2.796 1.00 . A A . 2 MET N 1 1 40 24286 1 1 2 MET O O -10.854 8.555 3.564 1.00 . A A . 2 MET O 1 1 40 24287 1 1 2 MET SD S -15.341 11.721 4.089 1.00 . A A . 2 MET SD 1 1 40 24288 1 1 3 ASP C C -9.050 9.770 1.579 1.00 . A A . 3 ASP C 1 1 40 24289 1 1 3 ASP CA C -9.887 10.823 2.298 1.00 . A A . 3 ASP CA 1 1 40 24290 1 1 3 ASP CB C -9.329 11.065 3.701 1.00 . A A . 3 ASP CB 1 1 40 24291 1 1 3 ASP CG C -9.497 12.502 4.152 1.00 . A A . 3 ASP CG 1 1 40 24292 1 1 3 ASP H H -11.969 10.972 1.946 1.00 . A A . 3 ASP H 1 1 40 24293 1 1 3 ASP HA H -9.841 11.746 1.738 1.00 . A A . 3 ASP HA 1 1 40 24294 1 1 3 ASP HB2 H -9.844 10.425 4.402 1.00 . A A . 3 ASP HB2 1 1 40 24295 1 1 3 ASP HB3 H -8.275 10.825 3.709 1.00 . A A . 3 ASP HB3 1 1 40 24296 1 1 3 ASP N N -11.285 10.415 2.372 1.00 . A A . 3 ASP N 1 1 40 24297 1 1 3 ASP O O -9.420 8.598 1.527 1.00 . A A . 3 ASP O 1 1 40 24298 1 1 3 ASP OD1 O -8.514 13.087 4.652 1.00 . A A . 3 ASP OD1 1 1 40 24299 1 1 3 ASP OD2 O -10.613 13.044 4.004 1.00 . A A . 3 ASP OD2 1 1 40 24300 1 1 4 CYS C C -5.606 9.837 0.271 1.00 . A A . 4 CYS C 1 1 40 24301 1 1 4 CYS CA C -7.029 9.291 0.310 1.00 . A A . 4 CYS CA 1 1 40 24302 1 1 4 CYS CB C -7.533 9.054 -1.114 1.00 . A A . 4 CYS CB 1 1 40 24303 1 1 4 CYS H H -7.678 11.144 1.101 1.00 . A A . 4 CYS H 1 1 40 24304 1 1 4 CYS HA H -7.023 8.348 0.835 1.00 . A A . 4 CYS HA 1 1 40 24305 1 1 4 CYS HB2 H -6.709 8.713 -1.722 1.00 . A A . 4 CYS HB2 1 1 40 24306 1 1 4 CYS HB3 H -8.296 8.290 -1.093 1.00 . A A . 4 CYS HB3 1 1 40 24307 1 1 4 CYS N N -7.919 10.197 1.026 1.00 . A A . 4 CYS N 1 1 40 24308 1 1 4 CYS O O -5.317 10.796 -0.446 1.00 . A A . 4 CYS O 1 1 40 24309 1 1 4 CYS SG S -8.243 10.525 -1.925 1.00 . A A . 4 CYS SG 1 1 40 24310 1 1 5 THR C C -2.600 9.265 -0.193 1.00 . A A . 5 THR C 1 1 40 24311 1 1 5 THR CA C -3.325 9.638 1.096 1.00 . A A . 5 THR CA 1 1 40 24312 1 1 5 THR CB C -2.622 8.998 2.294 1.00 . A A . 5 THR CB 1 1 40 24313 1 1 5 THR CG2 C -1.541 9.874 2.891 1.00 . A A . 5 THR CG2 1 1 40 24314 1 1 5 THR H H -5.011 8.458 1.590 1.00 . A A . 5 THR H 1 1 40 24315 1 1 5 THR HA H -3.306 10.711 1.209 1.00 . A A . 5 THR HA 1 1 40 24316 1 1 5 THR HB H -2.161 8.074 1.977 1.00 . A A . 5 THR HB 1 1 40 24317 1 1 5 THR HG1 H -3.890 7.812 3.200 1.00 . A A . 5 THR HG1 1 1 40 24318 1 1 5 THR HG21 H -1.336 10.698 2.224 1.00 . A A . 5 THR HG21 1 1 40 24319 1 1 5 THR HG22 H -1.874 10.257 3.844 1.00 . A A . 5 THR HG22 1 1 40 24320 1 1 5 THR HG23 H -0.642 9.291 3.031 1.00 . A A . 5 THR HG23 1 1 40 24321 1 1 5 THR N N -4.720 9.217 1.043 1.00 . A A . 5 THR N 1 1 40 24322 1 1 5 THR O O -2.128 8.139 -0.349 1.00 . A A . 5 THR O 1 1 40 24323 1 1 5 THR OG1 O -3.551 8.702 3.321 1.00 . A A . 5 THR OG1 1 1 40 24324 1 1 6 THR C C -0.468 9.378 -2.202 1.00 . A A . 6 THR C 1 1 40 24325 1 1 6 THR CA C -1.852 9.991 -2.398 1.00 . A A . 6 THR CA 1 1 40 24326 1 1 6 THR CB C -1.734 11.304 -3.175 1.00 . A A . 6 THR CB 1 1 40 24327 1 1 6 THR CG2 C -1.949 11.139 -4.664 1.00 . A A . 6 THR CG2 1 1 40 24328 1 1 6 THR H H -2.914 11.095 -0.936 1.00 . A A . 6 THR H 1 1 40 24329 1 1 6 THR HA H -2.458 9.302 -2.967 1.00 . A A . 6 THR HA 1 1 40 24330 1 1 6 THR HB H -0.745 11.711 -3.027 1.00 . A A . 6 THR HB 1 1 40 24331 1 1 6 THR HG1 H -2.239 12.891 -2.145 1.00 . A A . 6 THR HG1 1 1 40 24332 1 1 6 THR HG21 H -2.867 10.597 -4.838 1.00 . A A . 6 THR HG21 1 1 40 24333 1 1 6 THR HG22 H -2.012 12.111 -5.129 1.00 . A A . 6 THR HG22 1 1 40 24334 1 1 6 THR HG23 H -1.121 10.590 -5.088 1.00 . A A . 6 THR HG23 1 1 40 24335 1 1 6 THR N N -2.517 10.218 -1.118 1.00 . A A . 6 THR N 1 1 40 24336 1 1 6 THR O O 0.475 10.061 -1.803 1.00 . A A . 6 THR O 1 1 40 24337 1 1 6 THR OG1 O -2.679 12.250 -2.708 1.00 . A A . 6 THR OG1 1 1 40 24338 1 1 7 GLY C C 1.050 6.216 -3.277 1.00 . A A . 7 GLY C 1 1 40 24339 1 1 7 GLY CA C 0.914 7.398 -2.334 1.00 . A A . 7 GLY CA 1 1 40 24340 1 1 7 GLY H H -1.142 7.591 -2.799 1.00 . A A . 7 GLY H 1 1 40 24341 1 1 7 GLY HA2 H 1.002 7.046 -1.317 1.00 . A A . 7 GLY HA2 1 1 40 24342 1 1 7 GLY HA3 H 1.714 8.096 -2.533 1.00 . A A . 7 GLY HA3 1 1 40 24343 1 1 7 GLY N N -0.356 8.084 -2.485 1.00 . A A . 7 GLY N 1 1 40 24344 1 1 7 GLY O O 0.445 6.203 -4.349 1.00 . A A . 7 GLY O 1 1 40 24345 1 1 8 PRO C C 0.830 3.091 -3.743 1.00 . A A . 8 PRO C 1 1 40 24346 1 1 8 PRO CA C 2.049 4.009 -3.733 1.00 . A A . 8 PRO CA 1 1 40 24347 1 1 8 PRO CB C 3.235 3.314 -3.065 1.00 . A A . 8 PRO CB 1 1 40 24348 1 1 8 PRO CD C 2.606 5.131 -1.640 1.00 . A A . 8 PRO CD 1 1 40 24349 1 1 8 PRO CG C 3.159 3.731 -1.637 1.00 . A A . 8 PRO CG 1 1 40 24350 1 1 8 PRO HA H 2.307 4.275 -4.747 1.00 . A A . 8 PRO HA 1 1 40 24351 1 1 8 PRO HB2 H 3.136 2.244 -3.171 1.00 . A A . 8 PRO HB2 1 1 40 24352 1 1 8 PRO HB3 H 4.155 3.645 -3.523 1.00 . A A . 8 PRO HB3 1 1 40 24353 1 1 8 PRO HD2 H 1.957 5.281 -0.790 1.00 . A A . 8 PRO HD2 1 1 40 24354 1 1 8 PRO HD3 H 3.409 5.853 -1.636 1.00 . A A . 8 PRO HD3 1 1 40 24355 1 1 8 PRO HG2 H 2.500 3.069 -1.096 1.00 . A A . 8 PRO HG2 1 1 40 24356 1 1 8 PRO HG3 H 4.146 3.719 -1.198 1.00 . A A . 8 PRO HG3 1 1 40 24357 1 1 8 PRO N N 1.844 5.199 -2.902 1.00 . A A . 8 PRO N 1 1 40 24358 1 1 8 PRO O O 0.492 2.505 -4.771 1.00 . A A . 8 PRO O 1 1 40 24359 1 1 9 CYS C C -2.263 2.870 -2.898 1.00 . A A . 9 CYS C 1 1 40 24360 1 1 9 CYS CA C -1.004 2.123 -2.469 1.00 . A A . 9 CYS CA 1 1 40 24361 1 1 9 CYS CB C -1.156 1.632 -1.029 1.00 . A A . 9 CYS CB 1 1 40 24362 1 1 9 CYS H H 0.495 3.464 -1.808 1.00 . A A . 9 CYS H 1 1 40 24363 1 1 9 CYS HA H -0.868 1.270 -3.117 1.00 . A A . 9 CYS HA 1 1 40 24364 1 1 9 CYS HB2 H -0.193 1.667 -0.541 1.00 . A A . 9 CYS HB2 1 1 40 24365 1 1 9 CYS HB3 H -1.842 2.282 -0.506 1.00 . A A . 9 CYS HB3 1 1 40 24366 1 1 9 CYS N N 0.176 2.971 -2.593 1.00 . A A . 9 CYS N 1 1 40 24367 1 1 9 CYS O O -3.227 2.264 -3.368 1.00 . A A . 9 CYS O 1 1 40 24368 1 1 9 CYS SG S -1.788 -0.070 -0.887 1.00 . A A . 9 CYS SG 1 1 40 24369 1 1 10 CYS C C -3.132 5.735 -4.425 1.00 . A A . 10 CYS C 1 1 40 24370 1 1 10 CYS CA C -3.390 5.017 -3.106 1.00 . A A . 10 CYS CA 1 1 40 24371 1 1 10 CYS CB C -3.687 6.038 -2.006 1.00 . A A . 10 CYS CB 1 1 40 24372 1 1 10 CYS H H -1.453 4.616 -2.354 1.00 . A A . 10 CYS H 1 1 40 24373 1 1 10 CYS HA H -4.246 4.369 -3.224 1.00 . A A . 10 CYS HA 1 1 40 24374 1 1 10 CYS HB2 H -2.755 6.403 -1.603 1.00 . A A . 10 CYS HB2 1 1 40 24375 1 1 10 CYS HB3 H -4.238 6.864 -2.432 1.00 . A A . 10 CYS HB3 1 1 40 24376 1 1 10 CYS N N -2.249 4.189 -2.734 1.00 . A A . 10 CYS N 1 1 40 24377 1 1 10 CYS O O -2.022 6.201 -4.683 1.00 . A A . 10 CYS O 1 1 40 24378 1 1 10 CYS SG S -4.666 5.373 -0.621 1.00 . A A . 10 CYS SG 1 1 40 24379 1 1 11 ARG C C -5.375 7.082 -6.993 1.00 . A A . 11 ARG C 1 1 40 24380 1 1 11 ARG CA C -4.043 6.482 -6.554 1.00 . A A . 11 ARG CA 1 1 40 24381 1 1 11 ARG CB C -3.544 5.494 -7.610 1.00 . A A . 11 ARG CB 1 1 40 24382 1 1 11 ARG CD C -3.273 5.296 -10.100 1.00 . A A . 11 ARG CD 1 1 40 24383 1 1 11 ARG CG C -3.031 6.162 -8.875 1.00 . A A . 11 ARG CG 1 1 40 24384 1 1 11 ARG CZ C -0.999 4.803 -10.912 1.00 . A A . 11 ARG CZ 1 1 40 24385 1 1 11 ARG H H -5.024 5.428 -4.997 1.00 . A A . 11 ARG H 1 1 40 24386 1 1 11 ARG HA H -3.321 7.279 -6.452 1.00 . A A . 11 ARG HA 1 1 40 24387 1 1 11 ARG HB2 H -2.742 4.908 -7.187 1.00 . A A . 11 ARG HB2 1 1 40 24388 1 1 11 ARG HB3 H -4.356 4.835 -7.881 1.00 . A A . 11 ARG HB3 1 1 40 24389 1 1 11 ARG HD2 H -3.369 4.268 -9.785 1.00 . A A . 11 ARG HD2 1 1 40 24390 1 1 11 ARG HD3 H -4.191 5.613 -10.574 1.00 . A A . 11 ARG HD3 1 1 40 24391 1 1 11 ARG HE H -2.337 5.933 -11.871 1.00 . A A . 11 ARG HE 1 1 40 24392 1 1 11 ARG HG2 H -3.543 7.104 -9.006 1.00 . A A . 11 ARG HG2 1 1 40 24393 1 1 11 ARG HG3 H -1.970 6.338 -8.772 1.00 . A A . 11 ARG HG3 1 1 40 24394 1 1 11 ARG HH11 H -1.456 3.957 -9.132 1.00 . A A . 11 ARG HH11 1 1 40 24395 1 1 11 ARG HH12 H 0.137 3.625 -9.725 1.00 . A A . 11 ARG HH12 1 1 40 24396 1 1 11 ARG HH21 H -0.242 5.498 -12.652 1.00 . A A . 11 ARG HH21 1 1 40 24397 1 1 11 ARG HH22 H 0.827 4.501 -11.723 1.00 . A A . 11 ARG HH22 1 1 40 24398 1 1 11 ARG N N -4.163 5.820 -5.259 1.00 . A A . 11 ARG N 1 1 40 24399 1 1 11 ARG NE N -2.181 5.396 -11.066 1.00 . A A . 11 ARG NE 1 1 40 24400 1 1 11 ARG NH1 N -0.753 4.068 -9.835 1.00 . A A . 11 ARG NH1 1 1 40 24401 1 1 11 ARG NH2 N -0.062 4.946 -11.838 1.00 . A A . 11 ARG NH2 1 1 40 24402 1 1 11 ARG O O -5.465 8.275 -7.283 1.00 . A A . 11 ARG O 1 1 40 24403 1 1 12 GLN C C -8.559 7.156 -6.245 1.00 . A A . 12 GLN C 1 1 40 24404 1 1 12 GLN CA C -7.737 6.690 -7.445 1.00 . A A . 12 GLN CA 1 1 40 24405 1 1 12 GLN CB C -8.470 5.557 -8.155 1.00 . A A . 12 GLN CB 1 1 40 24406 1 1 12 GLN CD C -9.211 4.928 -10.487 1.00 . A A . 12 GLN CD 1 1 40 24407 1 1 12 GLN CG C -8.061 5.381 -9.608 1.00 . A A . 12 GLN CG 1 1 40 24408 1 1 12 GLN H H -6.271 5.306 -6.797 1.00 . A A . 12 GLN H 1 1 40 24409 1 1 12 GLN HA H -7.618 7.516 -8.130 1.00 . A A . 12 GLN HA 1 1 40 24410 1 1 12 GLN HB2 H -8.268 4.635 -7.631 1.00 . A A . 12 GLN HB2 1 1 40 24411 1 1 12 GLN HB3 H -9.531 5.755 -8.122 1.00 . A A . 12 GLN HB3 1 1 40 24412 1 1 12 GLN HE21 H -9.932 6.781 -10.540 1.00 . A A . 12 GLN HE21 1 1 40 24413 1 1 12 GLN HE22 H -10.833 5.599 -11.421 1.00 . A A . 12 GLN HE22 1 1 40 24414 1 1 12 GLN HG2 H -7.692 6.324 -9.982 1.00 . A A . 12 GLN HG2 1 1 40 24415 1 1 12 GLN HG3 H -7.275 4.642 -9.660 1.00 . A A . 12 GLN HG3 1 1 40 24416 1 1 12 GLN N N -6.407 6.246 -7.039 1.00 . A A . 12 GLN N 1 1 40 24417 1 1 12 GLN NE2 N -10.079 5.864 -10.853 1.00 . A A . 12 GLN NE2 1 1 40 24418 1 1 12 GLN O O -9.773 7.333 -6.346 1.00 . A A . 12 GLN O 1 1 40 24419 1 1 12 GLN OE1 O -9.317 3.752 -10.833 1.00 . A A . 12 GLN OE1 1 1 40 24420 1 1 13 CYS C C -9.253 6.609 -3.205 1.00 . A A . 13 CYS C 1 1 40 24421 1 1 13 CYS CA C -8.548 7.778 -3.882 1.00 . A A . 13 CYS CA 1 1 40 24422 1 1 13 CYS CB C -9.543 8.911 -4.154 1.00 . A A . 13 CYS CB 1 1 40 24423 1 1 13 CYS H H -6.929 7.176 -5.093 1.00 . A A . 13 CYS H 1 1 40 24424 1 1 13 CYS HA H -7.780 8.142 -3.222 1.00 . A A . 13 CYS HA 1 1 40 24425 1 1 13 CYS HB2 H -9.107 9.602 -4.861 1.00 . A A . 13 CYS HB2 1 1 40 24426 1 1 13 CYS HB3 H -10.445 8.494 -4.577 1.00 . A A . 13 CYS HB3 1 1 40 24427 1 1 13 CYS N N -7.891 7.343 -5.110 1.00 . A A . 13 CYS N 1 1 40 24428 1 1 13 CYS O O -10.263 6.786 -2.525 1.00 . A A . 13 CYS O 1 1 40 24429 1 1 13 CYS SG S -10.013 9.862 -2.670 1.00 . A A . 13 CYS SG 1 1 40 24430 1 1 14 LYS C C -8.143 3.239 -2.442 1.00 . A A . 14 LYS C 1 1 40 24431 1 1 14 LYS CA C -9.260 4.208 -2.801 1.00 . A A . 14 LYS CA 1 1 40 24432 1 1 14 LYS CB C -10.243 3.543 -3.767 1.00 . A A . 14 LYS CB 1 1 40 24433 1 1 14 LYS CD C -12.417 4.327 -2.781 1.00 . A A . 14 LYS CD 1 1 40 24434 1 1 14 LYS CE C -13.698 5.108 -3.025 1.00 . A A . 14 LYS CE 1 1 40 24435 1 1 14 LYS CG C -11.509 4.351 -4.000 1.00 . A A . 14 LYS CG 1 1 40 24436 1 1 14 LYS H H -7.893 5.341 -3.942 1.00 . A A . 14 LYS H 1 1 40 24437 1 1 14 LYS HA H -9.784 4.490 -1.900 1.00 . A A . 14 LYS HA 1 1 40 24438 1 1 14 LYS HB2 H -9.753 3.400 -4.719 1.00 . A A . 14 LYS HB2 1 1 40 24439 1 1 14 LYS HB3 H -10.525 2.579 -3.369 1.00 . A A . 14 LYS HB3 1 1 40 24440 1 1 14 LYS HD2 H -12.671 3.302 -2.553 1.00 . A A . 14 LYS HD2 1 1 40 24441 1 1 14 LYS HD3 H -11.892 4.764 -1.944 1.00 . A A . 14 LYS HD3 1 1 40 24442 1 1 14 LYS HE2 H -13.523 6.146 -2.781 1.00 . A A . 14 LYS HE2 1 1 40 24443 1 1 14 LYS HE3 H -13.962 5.024 -4.069 1.00 . A A . 14 LYS HE3 1 1 40 24444 1 1 14 LYS HG2 H -11.237 5.374 -4.213 1.00 . A A . 14 LYS HG2 1 1 40 24445 1 1 14 LYS HG3 H -12.041 3.934 -4.842 1.00 . A A . 14 LYS HG3 1 1 40 24446 1 1 14 LYS HZ1 H -14.459 4.124 -1.347 1.00 . A A . 14 LYS HZ1 1 1 40 24447 1 1 14 LYS HZ2 H -15.436 5.388 -1.901 1.00 . A A . 14 LYS HZ2 1 1 40 24448 1 1 14 LYS HZ3 H -15.393 3.922 -2.743 1.00 . A A . 14 LYS HZ3 1 1 40 24449 1 1 14 LYS N N -8.703 5.414 -3.393 1.00 . A A . 14 LYS N 1 1 40 24450 1 1 14 LYS NZ N -14.825 4.600 -2.196 1.00 . A A . 14 LYS NZ 1 1 40 24451 1 1 14 LYS O O -7.545 2.616 -3.320 1.00 . A A . 14 LYS O 1 1 40 24452 1 1 15 LEU C C -6.793 0.916 -1.420 1.00 . A A . 15 LEU C 1 1 40 24453 1 1 15 LEU CA C -6.798 2.241 -0.662 1.00 . A A . 15 LEU CA 1 1 40 24454 1 1 15 LEU CB C -6.970 1.982 0.837 1.00 . A A . 15 LEU CB 1 1 40 24455 1 1 15 LEU CD1 C -4.650 1.040 1.004 1.00 . A A . 15 LEU CD1 1 1 40 24456 1 1 15 LEU CD2 C -5.111 3.371 1.792 1.00 . A A . 15 LEU CD2 1 1 40 24457 1 1 15 LEU CG C -5.672 1.963 1.649 1.00 . A A . 15 LEU CG 1 1 40 24458 1 1 15 LEU H H -8.364 3.658 -0.499 1.00 . A A . 15 LEU H 1 1 40 24459 1 1 15 LEU HA H -5.853 2.738 -0.827 1.00 . A A . 15 LEU HA 1 1 40 24460 1 1 15 LEU HB2 H -7.611 2.752 1.241 1.00 . A A . 15 LEU HB2 1 1 40 24461 1 1 15 LEU HB3 H -7.460 1.028 0.963 1.00 . A A . 15 LEU HB3 1 1 40 24462 1 1 15 LEU HD11 H -5.148 0.161 0.622 1.00 . A A . 15 LEU HD11 1 1 40 24463 1 1 15 LEU HD12 H -4.160 1.557 0.192 1.00 . A A . 15 LEU HD12 1 1 40 24464 1 1 15 LEU HD13 H -3.915 0.746 1.739 1.00 . A A . 15 LEU HD13 1 1 40 24465 1 1 15 LEU HD21 H -5.831 4.086 1.420 1.00 . A A . 15 LEU HD21 1 1 40 24466 1 1 15 LEU HD22 H -4.909 3.574 2.833 1.00 . A A . 15 LEU HD22 1 1 40 24467 1 1 15 LEU HD23 H -4.196 3.454 1.225 1.00 . A A . 15 LEU HD23 1 1 40 24468 1 1 15 LEU HG H -5.883 1.585 2.639 1.00 . A A . 15 LEU HG 1 1 40 24469 1 1 15 LEU N N -7.856 3.126 -1.147 1.00 . A A . 15 LEU N 1 1 40 24470 1 1 15 LEU O O -7.731 0.126 -1.317 1.00 . A A . 15 LEU O 1 1 40 24471 1 1 16 LYS C C -5.941 -1.771 -2.133 1.00 . A A . 16 LYS C 1 1 40 24472 1 1 16 LYS CA C -5.601 -0.538 -2.972 1.00 . A A . 16 LYS CA 1 1 40 24473 1 1 16 LYS CB C -4.182 -0.660 -3.531 1.00 . A A . 16 LYS CB 1 1 40 24474 1 1 16 LYS CD C -2.619 -0.285 -5.463 1.00 . A A . 16 LYS CD 1 1 40 24475 1 1 16 LYS CE C -2.310 0.815 -6.466 1.00 . A A . 16 LYS CE 1 1 40 24476 1 1 16 LYS CG C -4.057 -0.208 -4.977 1.00 . A A . 16 LYS CG 1 1 40 24477 1 1 16 LYS H H -5.019 1.358 -2.232 1.00 . A A . 16 LYS H 1 1 40 24478 1 1 16 LYS HA H -6.297 -0.474 -3.796 1.00 . A A . 16 LYS HA 1 1 40 24479 1 1 16 LYS HB2 H -3.518 -0.057 -2.930 1.00 . A A . 16 LYS HB2 1 1 40 24480 1 1 16 LYS HB3 H -3.870 -1.692 -3.472 1.00 . A A . 16 LYS HB3 1 1 40 24481 1 1 16 LYS HD2 H -1.957 -0.181 -4.616 1.00 . A A . 16 LYS HD2 1 1 40 24482 1 1 16 LYS HD3 H -2.459 -1.244 -5.932 1.00 . A A . 16 LYS HD3 1 1 40 24483 1 1 16 LYS HE2 H -3.228 1.105 -6.956 1.00 . A A . 16 LYS HE2 1 1 40 24484 1 1 16 LYS HE3 H -1.901 1.663 -5.937 1.00 . A A . 16 LYS HE3 1 1 40 24485 1 1 16 LYS HG2 H -4.670 -0.844 -5.598 1.00 . A A . 16 LYS HG2 1 1 40 24486 1 1 16 LYS HG3 H -4.400 0.814 -5.055 1.00 . A A . 16 LYS HG3 1 1 40 24487 1 1 16 LYS HZ1 H -1.690 -0.475 -7.988 1.00 . A A . 16 LYS HZ1 1 1 40 24488 1 1 16 LYS HZ2 H -1.179 1.123 -8.195 1.00 . A A . 16 LYS HZ2 1 1 40 24489 1 1 16 LYS HZ3 H -0.423 0.134 -7.049 1.00 . A A . 16 LYS HZ3 1 1 40 24490 1 1 16 LYS N N -5.731 0.686 -2.188 1.00 . A A . 16 LYS N 1 1 40 24491 1 1 16 LYS NZ N -1.332 0.368 -7.496 1.00 . A A . 16 LYS NZ 1 1 40 24492 1 1 16 LYS O O -5.994 -1.699 -0.905 1.00 . A A . 16 LYS O 1 1 40 24493 1 1 17 PRO C C -5.411 -4.624 -1.148 1.00 . A A . 17 PRO C 1 1 40 24494 1 1 17 PRO CA C -6.514 -4.170 -2.096 1.00 . A A . 17 PRO CA 1 1 40 24495 1 1 17 PRO CB C -6.692 -5.184 -3.233 1.00 . A A . 17 PRO CB 1 1 40 24496 1 1 17 PRO CD C -6.135 -3.094 -4.248 1.00 . A A . 17 PRO CD 1 1 40 24497 1 1 17 PRO CG C -5.999 -4.581 -4.407 1.00 . A A . 17 PRO CG 1 1 40 24498 1 1 17 PRO HA H -7.439 -4.078 -1.545 1.00 . A A . 17 PRO HA 1 1 40 24499 1 1 17 PRO HB2 H -6.242 -6.125 -2.951 1.00 . A A . 17 PRO HB2 1 1 40 24500 1 1 17 PRO HB3 H -7.744 -5.327 -3.428 1.00 . A A . 17 PRO HB3 1 1 40 24501 1 1 17 PRO HD2 H -5.281 -2.588 -4.674 1.00 . A A . 17 PRO HD2 1 1 40 24502 1 1 17 PRO HD3 H -7.050 -2.747 -4.704 1.00 . A A . 17 PRO HD3 1 1 40 24503 1 1 17 PRO HG2 H -4.957 -4.864 -4.405 1.00 . A A . 17 PRO HG2 1 1 40 24504 1 1 17 PRO HG3 H -6.475 -4.905 -5.321 1.00 . A A . 17 PRO HG3 1 1 40 24505 1 1 17 PRO N N -6.177 -2.920 -2.787 1.00 . A A . 17 PRO N 1 1 40 24506 1 1 17 PRO O O -4.227 -4.404 -1.403 1.00 . A A . 17 PRO O 1 1 40 24507 1 1 18 ALA C C -3.887 -6.750 0.311 1.00 . A A . 18 ALA C 1 1 40 24508 1 1 18 ALA CA C -4.857 -5.754 0.936 1.00 . A A . 18 ALA CA 1 1 40 24509 1 1 18 ALA CB C -5.592 -6.392 2.105 1.00 . A A . 18 ALA CB 1 1 40 24510 1 1 18 ALA H H -6.768 -5.408 0.093 1.00 . A A . 18 ALA H 1 1 40 24511 1 1 18 ALA HA H -4.298 -4.908 1.311 1.00 . A A . 18 ALA HA 1 1 40 24512 1 1 18 ALA HB1 H -6.206 -5.649 2.593 1.00 . A A . 18 ALA HB1 1 1 40 24513 1 1 18 ALA HB2 H -4.875 -6.786 2.809 1.00 . A A . 18 ALA HB2 1 1 40 24514 1 1 18 ALA HB3 H -6.218 -7.194 1.742 1.00 . A A . 18 ALA HB3 1 1 40 24515 1 1 18 ALA N N -5.809 -5.262 -0.053 1.00 . A A . 18 ALA N 1 1 40 24516 1 1 18 ALA O O -4.095 -7.212 -0.811 1.00 . A A . 18 ALA O 1 1 40 24517 1 1 19 GLY C C -1.198 -7.548 -0.754 1.00 . A A . 19 GLY C 1 1 40 24518 1 1 19 GLY CA C -1.841 -8.014 0.539 1.00 . A A . 19 GLY CA 1 1 40 24519 1 1 19 GLY H H -2.712 -6.675 1.929 1.00 . A A . 19 GLY H 1 1 40 24520 1 1 19 GLY HA2 H -2.322 -8.966 0.366 1.00 . A A . 19 GLY HA2 1 1 40 24521 1 1 19 GLY HA3 H -1.071 -8.144 1.285 1.00 . A A . 19 GLY HA3 1 1 40 24522 1 1 19 GLY N N -2.827 -7.076 1.042 1.00 . A A . 19 GLY N 1 1 40 24523 1 1 19 GLY O O -0.620 -8.348 -1.490 1.00 . A A . 19 GLY O 1 1 40 24524 1 1 20 THR C C 0.583 -4.950 -1.927 1.00 . A A . 20 THR C 1 1 40 24525 1 1 20 THR CA C -0.717 -5.682 -2.243 1.00 . A A . 20 THR CA 1 1 40 24526 1 1 20 THR CB C -1.711 -4.726 -2.906 1.00 . A A . 20 THR CB 1 1 40 24527 1 1 20 THR CG2 C -1.174 -4.075 -4.163 1.00 . A A . 20 THR CG2 1 1 40 24528 1 1 20 THR H H -1.767 -5.662 -0.407 1.00 . A A . 20 THR H 1 1 40 24529 1 1 20 THR HA H -0.504 -6.494 -2.922 1.00 . A A . 20 THR HA 1 1 40 24530 1 1 20 THR HB H -1.960 -3.940 -2.207 1.00 . A A . 20 THR HB 1 1 40 24531 1 1 20 THR HG1 H -3.659 -4.931 -2.897 1.00 . A A . 20 THR HG1 1 1 40 24532 1 1 20 THR HG21 H -0.201 -3.653 -3.962 1.00 . A A . 20 THR HG21 1 1 40 24533 1 1 20 THR HG22 H -1.091 -4.816 -4.944 1.00 . A A . 20 THR HG22 1 1 40 24534 1 1 20 THR HG23 H -1.849 -3.293 -4.479 1.00 . A A . 20 THR HG23 1 1 40 24535 1 1 20 THR N N -1.296 -6.251 -1.031 1.00 . A A . 20 THR N 1 1 40 24536 1 1 20 THR O O 0.569 -3.839 -1.398 1.00 . A A . 20 THR O 1 1 40 24537 1 1 20 THR OG1 O -2.904 -5.406 -3.252 1.00 . A A . 20 THR OG1 1 1 40 24538 1 1 21 THR C C 3.151 -3.643 -2.703 1.00 . A A . 21 THR C 1 1 40 24539 1 1 21 THR CA C 3.016 -4.993 -2.004 1.00 . A A . 21 THR CA 1 1 40 24540 1 1 21 THR CB C 4.125 -5.939 -2.473 1.00 . A A . 21 THR CB 1 1 40 24541 1 1 21 THR CG2 C 5.231 -6.113 -1.456 1.00 . A A . 21 THR CG2 1 1 40 24542 1 1 21 THR H H 1.652 -6.467 -2.673 1.00 . A A . 21 THR H 1 1 40 24543 1 1 21 THR HA H 3.112 -4.843 -0.939 1.00 . A A . 21 THR HA 1 1 40 24544 1 1 21 THR HB H 4.566 -5.542 -3.377 1.00 . A A . 21 THR HB 1 1 40 24545 1 1 21 THR HG1 H 3.326 -7.258 -3.681 1.00 . A A . 21 THR HG1 1 1 40 24546 1 1 21 THR HG21 H 4.804 -6.170 -0.466 1.00 . A A . 21 THR HG21 1 1 40 24547 1 1 21 THR HG22 H 5.774 -7.022 -1.666 1.00 . A A . 21 THR HG22 1 1 40 24548 1 1 21 THR HG23 H 5.905 -5.271 -1.509 1.00 . A A . 21 THR HG23 1 1 40 24549 1 1 21 THR N N 1.706 -5.582 -2.254 1.00 . A A . 21 THR N 1 1 40 24550 1 1 21 THR O O 2.638 -3.449 -3.805 1.00 . A A . 21 THR O 1 1 40 24551 1 1 21 THR OG1 O 3.602 -7.224 -2.762 1.00 . A A . 21 THR OG1 1 1 40 24552 1 1 22 CYS C C 5.239 -1.365 -3.561 1.00 . A A . 22 CYS C 1 1 40 24553 1 1 22 CYS CA C 4.047 -1.381 -2.610 1.00 . A A . 22 CYS CA 1 1 40 24554 1 1 22 CYS CB C 4.261 -0.365 -1.487 1.00 . A A . 22 CYS CB 1 1 40 24555 1 1 22 CYS H H 4.228 -2.929 -1.177 1.00 . A A . 22 CYS H 1 1 40 24556 1 1 22 CYS HA H 3.157 -1.114 -3.161 1.00 . A A . 22 CYS HA 1 1 40 24557 1 1 22 CYS HB2 H 4.912 -0.795 -0.741 1.00 . A A . 22 CYS HB2 1 1 40 24558 1 1 22 CYS HB3 H 4.727 0.519 -1.897 1.00 . A A . 22 CYS HB3 1 1 40 24559 1 1 22 CYS N N 3.844 -2.714 -2.053 1.00 . A A . 22 CYS N 1 1 40 24560 1 1 22 CYS O O 5.102 -1.027 -4.737 1.00 . A A . 22 CYS O 1 1 40 24561 1 1 22 CYS SG S 2.728 0.153 -0.650 1.00 . A A . 22 CYS SG 1 1 40 24562 1 1 23 TRP C C 7.843 -3.137 -4.459 1.00 . A A . 23 TRP C 1 1 40 24563 1 1 23 TRP CA C 7.623 -1.756 -3.849 1.00 . A A . 23 TRP CA 1 1 40 24564 1 1 23 TRP CB C 8.832 -1.356 -2.996 1.00 . A A . 23 TRP CB 1 1 40 24565 1 1 23 TRP CD1 C 8.845 0.980 -4.048 1.00 . A A . 23 TRP CD1 1 1 40 24566 1 1 23 TRP CD2 C 10.836 0.307 -3.276 1.00 . A A . 23 TRP CD2 1 1 40 24567 1 1 23 TRP CE2 C 10.980 1.596 -3.825 1.00 . A A . 23 TRP CE2 1 1 40 24568 1 1 23 TRP CE3 C 11.959 -0.320 -2.728 1.00 . A A . 23 TRP CE3 1 1 40 24569 1 1 23 TRP CG C 9.463 -0.068 -3.429 1.00 . A A . 23 TRP CG 1 1 40 24570 1 1 23 TRP CH2 C 13.281 1.629 -3.297 1.00 . A A . 23 TRP CH2 1 1 40 24571 1 1 23 TRP CZ2 C 12.200 2.267 -3.840 1.00 . A A . 23 TRP CZ2 1 1 40 24572 1 1 23 TRP CZ3 C 13.169 0.347 -2.745 1.00 . A A . 23 TRP CZ3 1 1 40 24573 1 1 23 TRP H H 6.453 -1.988 -2.100 1.00 . A A . 23 TRP H 1 1 40 24574 1 1 23 TRP HA H 7.507 -1.042 -4.646 1.00 . A A . 23 TRP HA 1 1 40 24575 1 1 23 TRP HB2 H 8.517 -1.244 -1.970 1.00 . A A . 23 TRP HB2 1 1 40 24576 1 1 23 TRP HB3 H 9.581 -2.132 -3.056 1.00 . A A . 23 TRP HB3 1 1 40 24577 1 1 23 TRP HD1 H 7.796 1.002 -4.305 1.00 . A A . 23 TRP HD1 1 1 40 24578 1 1 23 TRP HE1 H 9.549 2.841 -4.723 1.00 . A A . 23 TRP HE1 1 1 40 24579 1 1 23 TRP HE3 H 11.892 -1.308 -2.298 1.00 . A A . 23 TRP HE3 1 1 40 24580 1 1 23 TRP HH2 H 14.247 2.113 -3.289 1.00 . A A . 23 TRP HH2 1 1 40 24581 1 1 23 TRP HZ2 H 12.303 3.256 -4.262 1.00 . A A . 23 TRP HZ2 1 1 40 24582 1 1 23 TRP HZ3 H 14.047 -0.122 -2.326 1.00 . A A . 23 TRP HZ3 1 1 40 24583 1 1 23 TRP N N 6.407 -1.730 -3.045 1.00 . A A . 23 TRP N 1 1 40 24584 1 1 23 TRP NE1 N 9.750 1.985 -4.289 1.00 . A A . 23 TRP NE1 1 1 40 24585 1 1 23 TRP O O 7.556 -3.361 -5.635 1.00 . A A . 23 TRP O 1 1 40 24586 1 1 24 ARG C C 9.586 -5.423 -5.282 1.00 . A A . 24 ARG C 1 1 40 24587 1 1 24 ARG CA C 8.613 -5.419 -4.107 1.00 . A A . 24 ARG CA 1 1 40 24588 1 1 24 ARG CB C 7.305 -6.102 -4.511 1.00 . A A . 24 ARG CB 1 1 40 24589 1 1 24 ARG CD C 8.426 -8.322 -4.875 1.00 . A A . 24 ARG CD 1 1 40 24590 1 1 24 ARG CG C 7.276 -7.590 -4.202 1.00 . A A . 24 ARG CG 1 1 40 24591 1 1 24 ARG CZ C 7.347 -9.872 -6.458 1.00 . A A . 24 ARG CZ 1 1 40 24592 1 1 24 ARG H H 8.560 -3.816 -2.725 1.00 . A A . 24 ARG H 1 1 40 24593 1 1 24 ARG HA H 9.056 -5.965 -3.287 1.00 . A A . 24 ARG HA 1 1 40 24594 1 1 24 ARG HB2 H 6.489 -5.631 -3.984 1.00 . A A . 24 ARG HB2 1 1 40 24595 1 1 24 ARG HB3 H 7.159 -5.974 -5.573 1.00 . A A . 24 ARG HB3 1 1 40 24596 1 1 24 ARG HD2 H 8.759 -7.740 -5.721 1.00 . A A . 24 ARG HD2 1 1 40 24597 1 1 24 ARG HD3 H 9.235 -8.423 -4.167 1.00 . A A . 24 ARG HD3 1 1 40 24598 1 1 24 ARG HE H 8.293 -10.418 -4.788 1.00 . A A . 24 ARG HE 1 1 40 24599 1 1 24 ARG HG2 H 7.351 -7.728 -3.134 1.00 . A A . 24 ARG HG2 1 1 40 24600 1 1 24 ARG HG3 H 6.342 -8.003 -4.555 1.00 . A A . 24 ARG HG3 1 1 40 24601 1 1 24 ARG HH11 H 7.211 -7.920 -6.973 1.00 . A A . 24 ARG HH11 1 1 40 24602 1 1 24 ARG HH12 H 6.461 -9.031 -8.069 1.00 . A A . 24 ARG HH12 1 1 40 24603 1 1 24 ARG HH21 H 7.307 -11.880 -6.229 1.00 . A A . 24 ARG HH21 1 1 40 24604 1 1 24 ARG HH22 H 6.515 -11.279 -7.647 1.00 . A A . 24 ARG HH22 1 1 40 24605 1 1 24 ARG N N 8.353 -4.058 -3.651 1.00 . A A . 24 ARG N 1 1 40 24606 1 1 24 ARG NE N 8.033 -9.650 -5.339 1.00 . A A . 24 ARG NE 1 1 40 24607 1 1 24 ARG NH1 N 6.976 -8.858 -7.230 1.00 . A A . 24 ARG NH1 1 1 40 24608 1 1 24 ARG NH2 N 7.031 -11.112 -6.807 1.00 . A A . 24 ARG NH2 1 1 40 24609 1 1 24 ARG O O 9.175 -5.469 -6.441 1.00 . A A . 24 ARG O 1 1 40 24610 1 1 25 THR C C 12.763 -6.633 -5.926 1.00 . A A . 25 THR C 1 1 40 24611 1 1 25 THR CA C 11.910 -5.372 -6.006 1.00 . A A . 25 THR CA 1 1 40 24612 1 1 25 THR CB C 12.796 -4.133 -5.868 1.00 . A A . 25 THR CB 1 1 40 24613 1 1 25 THR CG2 C 12.011 -2.841 -5.791 1.00 . A A . 25 THR CG2 1 1 40 24614 1 1 25 THR H H 11.145 -5.338 -4.032 1.00 . A A . 25 THR H 1 1 40 24615 1 1 25 THR HA H 11.418 -5.346 -6.965 1.00 . A A . 25 THR HA 1 1 40 24616 1 1 25 THR HB H 13.449 -4.073 -6.726 1.00 . A A . 25 THR HB 1 1 40 24617 1 1 25 THR HG1 H 13.044 -4.416 -3.945 1.00 . A A . 25 THR HG1 1 1 40 24618 1 1 25 THR HG21 H 11.376 -2.754 -6.660 1.00 . A A . 25 THR HG21 1 1 40 24619 1 1 25 THR HG22 H 11.403 -2.842 -4.899 1.00 . A A . 25 THR HG22 1 1 40 24620 1 1 25 THR HG23 H 12.695 -2.006 -5.760 1.00 . A A . 25 THR HG23 1 1 40 24621 1 1 25 THR N N 10.879 -5.374 -4.974 1.00 . A A . 25 THR N 1 1 40 24622 1 1 25 THR O O 13.117 -7.222 -6.947 1.00 . A A . 25 THR O 1 1 40 24623 1 1 25 THR OG1 O 13.599 -4.218 -4.703 1.00 . A A . 25 THR OG1 1 1 40 24624 1 1 26 SER C C 14.118 -8.479 -2.998 1.00 . A A . 26 SER C 1 1 40 24625 1 1 26 SER CA C 13.900 -8.234 -4.486 1.00 . A A . 26 SER CA 1 1 40 24626 1 1 26 SER CB C 15.249 -8.097 -5.195 1.00 . A A . 26 SER CB 1 1 40 24627 1 1 26 SER H H 12.774 -6.528 -3.933 1.00 . A A . 26 SER H 1 1 40 24628 1 1 26 SER HA H 13.369 -9.075 -4.902 1.00 . A A . 26 SER HA 1 1 40 24629 1 1 26 SER HB2 H 15.156 -7.397 -6.011 1.00 . A A . 26 SER HB2 1 1 40 24630 1 1 26 SER HB3 H 15.987 -7.736 -4.493 1.00 . A A . 26 SER HB3 1 1 40 24631 1 1 26 SER HG H 16.602 -9.487 -5.473 1.00 . A A . 26 SER HG 1 1 40 24632 1 1 26 SER N N 13.088 -7.041 -4.705 1.00 . A A . 26 SER N 1 1 40 24633 1 1 26 SER O O 14.103 -9.620 -2.537 1.00 . A A . 26 SER O 1 1 40 24634 1 1 26 SER OG O 15.683 -9.343 -5.711 1.00 . A A . 26 SER OG 1 1 40 24635 1 1 27 VAL C C 13.372 -6.901 -0.037 1.00 . A A . 27 VAL C 1 1 40 24636 1 1 27 VAL CA C 14.543 -7.494 -0.813 1.00 . A A . 27 VAL CA 1 1 40 24637 1 1 27 VAL CB C 15.837 -6.772 -0.395 1.00 . A A . 27 VAL CB 1 1 40 24638 1 1 27 VAL CG1 C 16.179 -7.084 1.054 1.00 . A A . 27 VAL CG1 1 1 40 24639 1 1 27 VAL CG2 C 16.985 -7.155 -1.316 1.00 . A A . 27 VAL CG2 1 1 40 24640 1 1 27 VAL H H 14.321 -6.518 -2.679 1.00 . A A . 27 VAL H 1 1 40 24641 1 1 27 VAL HA H 14.639 -8.539 -0.558 1.00 . A A . 27 VAL HA 1 1 40 24642 1 1 27 VAL HB H 15.675 -5.707 -0.481 1.00 . A A . 27 VAL HB 1 1 40 24643 1 1 27 VAL HG11 H 16.067 -8.144 1.230 1.00 . A A . 27 VAL HG11 1 1 40 24644 1 1 27 VAL HG12 H 17.199 -6.792 1.254 1.00 . A A . 27 VAL HG12 1 1 40 24645 1 1 27 VAL HG13 H 15.514 -6.539 1.707 1.00 . A A . 27 VAL HG13 1 1 40 24646 1 1 27 VAL HG21 H 16.959 -8.219 -1.501 1.00 . A A . 27 VAL HG21 1 1 40 24647 1 1 27 VAL HG22 H 16.889 -6.624 -2.251 1.00 . A A . 27 VAL HG22 1 1 40 24648 1 1 27 VAL HG23 H 17.924 -6.895 -0.849 1.00 . A A . 27 VAL HG23 1 1 40 24649 1 1 27 VAL N N 14.321 -7.399 -2.251 1.00 . A A . 27 VAL N 1 1 40 24650 1 1 27 VAL O O 13.021 -7.381 1.040 1.00 . A A . 27 VAL O 1 1 40 24651 1 1 28 SER C C 10.332 -5.901 -0.300 1.00 . A A . 28 SER C 1 1 40 24652 1 1 28 SER CA C 11.639 -5.195 0.045 1.00 . A A . 28 SER CA 1 1 40 24653 1 1 28 SER CB C 11.571 -3.727 -0.384 1.00 . A A . 28 SER CB 1 1 40 24654 1 1 28 SER H H 13.098 -5.519 -1.454 1.00 . A A . 28 SER H 1 1 40 24655 1 1 28 SER HA H 11.788 -5.241 1.114 1.00 . A A . 28 SER HA 1 1 40 24656 1 1 28 SER HB2 H 12.106 -3.601 -1.313 1.00 . A A . 28 SER HB2 1 1 40 24657 1 1 28 SER HB3 H 10.538 -3.442 -0.521 1.00 . A A . 28 SER HB3 1 1 40 24658 1 1 28 SER HG H 11.595 -2.866 1.376 1.00 . A A . 28 SER HG 1 1 40 24659 1 1 28 SER N N 12.771 -5.855 -0.593 1.00 . A A . 28 SER N 1 1 40 24660 1 1 28 SER O O 10.174 -6.433 -1.399 1.00 . A A . 28 SER O 1 1 40 24661 1 1 28 SER OG O 12.152 -2.882 0.594 1.00 . A A . 28 SER OG 1 1 40 24662 1 1 29 SER C C 7.105 -6.104 1.504 1.00 . A A . 29 SER C 1 1 40 24663 1 1 29 SER CA C 8.105 -6.544 0.440 1.00 . A A . 29 SER CA 1 1 40 24664 1 1 29 SER CB C 8.257 -8.066 0.465 1.00 . A A . 29 SER CB 1 1 40 24665 1 1 29 SER H H 9.583 -5.463 1.501 1.00 . A A . 29 SER H 1 1 40 24666 1 1 29 SER HA H 7.736 -6.244 -0.529 1.00 . A A . 29 SER HA 1 1 40 24667 1 1 29 SER HB2 H 9.140 -8.347 -0.090 1.00 . A A . 29 SER HB2 1 1 40 24668 1 1 29 SER HB3 H 8.354 -8.400 1.488 1.00 . A A . 29 SER HB3 1 1 40 24669 1 1 29 SER HG H 6.379 -8.623 0.472 1.00 . A A . 29 SER HG 1 1 40 24670 1 1 29 SER N N 9.398 -5.903 0.645 1.00 . A A . 29 SER N 1 1 40 24671 1 1 29 SER O O 6.835 -6.834 2.458 1.00 . A A . 29 SER O 1 1 40 24672 1 1 29 SER OG O 7.132 -8.702 -0.117 1.00 . A A . 29 SER OG 1 1 40 24673 1 1 30 HIS C C 4.169 -4.482 1.728 1.00 . A A . 30 HIS C 1 1 40 24674 1 1 30 HIS CA C 5.586 -4.367 2.280 1.00 . A A . 30 HIS CA 1 1 40 24675 1 1 30 HIS CB C 5.906 -2.905 2.595 1.00 . A A . 30 HIS CB 1 1 40 24676 1 1 30 HIS CD2 C 8.487 -3.118 2.748 1.00 . A A . 30 HIS CD2 1 1 40 24677 1 1 30 HIS CE1 C 8.792 -1.990 4.604 1.00 . A A . 30 HIS CE1 1 1 40 24678 1 1 30 HIS CG C 7.271 -2.703 3.177 1.00 . A A . 30 HIS CG 1 1 40 24679 1 1 30 HIS H H 6.812 -4.369 0.554 1.00 . A A . 30 HIS H 1 1 40 24680 1 1 30 HIS HA H 5.654 -4.945 3.189 1.00 . A A . 30 HIS HA 1 1 40 24681 1 1 30 HIS HB2 H 5.845 -2.326 1.686 1.00 . A A . 30 HIS HB2 1 1 40 24682 1 1 30 HIS HB3 H 5.183 -2.530 3.304 1.00 . A A . 30 HIS HB3 1 1 40 24683 1 1 30 HIS HD1 H 6.810 -1.571 4.894 1.00 . A A . 30 HIS HD1 1 1 40 24684 1 1 30 HIS HD2 H 8.690 -3.699 1.860 1.00 . A A . 30 HIS HD2 1 1 40 24685 1 1 30 HIS HE1 H 9.261 -1.515 5.452 1.00 . A A . 30 HIS HE1 1 1 40 24686 1 1 30 HIS HE2 H 10.387 -2.736 3.558 1.00 . A A . 30 HIS HE2 1 1 40 24687 1 1 30 HIS N N 6.557 -4.905 1.334 1.00 . A A . 30 HIS N 1 1 40 24688 1 1 30 HIS ND1 N 7.497 -2.000 4.342 1.00 . A A . 30 HIS ND1 1 1 40 24689 1 1 30 HIS NE2 N 9.414 -2.662 3.653 1.00 . A A . 30 HIS NE2 1 1 40 24690 1 1 30 HIS O O 3.758 -3.693 0.877 1.00 . A A . 30 HIS O 1 1 40 24691 1 1 31 TYR C C 1.113 -4.658 2.394 1.00 . A A . 31 TYR C 1 1 40 24692 1 1 31 TYR CA C 2.055 -5.686 1.775 1.00 . A A . 31 TYR CA 1 1 40 24693 1 1 31 TYR CB C 1.597 -7.099 2.140 1.00 . A A . 31 TYR CB 1 1 40 24694 1 1 31 TYR CD1 C 2.974 -9.207 1.947 1.00 . A A . 31 TYR CD1 1 1 40 24695 1 1 31 TYR CD2 C 2.196 -8.182 -0.060 1.00 . A A . 31 TYR CD2 1 1 40 24696 1 1 31 TYR CE1 C 3.589 -10.199 1.208 1.00 . A A . 31 TYR CE1 1 1 40 24697 1 1 31 TYR CE2 C 2.809 -9.171 -0.807 1.00 . A A . 31 TYR CE2 1 1 40 24698 1 1 31 TYR CG C 2.268 -8.183 1.327 1.00 . A A . 31 TYR CG 1 1 40 24699 1 1 31 TYR CZ C 3.503 -10.176 -0.168 1.00 . A A . 31 TYR CZ 1 1 40 24700 1 1 31 TYR H H 3.810 -6.064 2.896 1.00 . A A . 31 TYR H 1 1 40 24701 1 1 31 TYR HA H 2.032 -5.576 0.701 1.00 . A A . 31 TYR HA 1 1 40 24702 1 1 31 TYR HB2 H 1.815 -7.283 3.182 1.00 . A A . 31 TYR HB2 1 1 40 24703 1 1 31 TYR HB3 H 0.531 -7.176 1.982 1.00 . A A . 31 TYR HB3 1 1 40 24704 1 1 31 TYR HD1 H 3.039 -9.221 3.025 1.00 . A A . 31 TYR HD1 1 1 40 24705 1 1 31 TYR HD2 H 1.652 -7.393 -0.557 1.00 . A A . 31 TYR HD2 1 1 40 24706 1 1 31 TYR HE1 H 4.133 -10.986 1.708 1.00 . A A . 31 TYR HE1 1 1 40 24707 1 1 31 TYR HE2 H 2.741 -9.153 -1.884 1.00 . A A . 31 TYR HE2 1 1 40 24708 1 1 31 TYR HH H 3.466 -11.586 -1.475 1.00 . A A . 31 TYR HH 1 1 40 24709 1 1 31 TYR N N 3.426 -5.468 2.219 1.00 . A A . 31 TYR N 1 1 40 24710 1 1 31 TYR O O 1.284 -4.260 3.546 1.00 . A A . 31 TYR O 1 1 40 24711 1 1 31 TYR OH O 4.114 -11.163 -0.908 1.00 . A A . 31 TYR OH 1 1 40 24712 1 1 32 CYS C C -1.959 -3.923 2.893 1.00 . A A . 32 CYS C 1 1 40 24713 1 1 32 CYS CA C -0.849 -3.250 2.093 1.00 . A A . 32 CYS CA 1 1 40 24714 1 1 32 CYS CB C -1.448 -2.487 0.911 1.00 . A A . 32 CYS CB 1 1 40 24715 1 1 32 CYS H H 0.035 -4.586 0.712 1.00 . A A . 32 CYS H 1 1 40 24716 1 1 32 CYS HA H -0.330 -2.554 2.735 1.00 . A A . 32 CYS HA 1 1 40 24717 1 1 32 CYS HB2 H -1.372 -3.096 0.023 1.00 . A A . 32 CYS HB2 1 1 40 24718 1 1 32 CYS HB3 H -2.490 -2.284 1.113 1.00 . A A . 32 CYS HB3 1 1 40 24719 1 1 32 CYS N N 0.119 -4.232 1.621 1.00 . A A . 32 CYS N 1 1 40 24720 1 1 32 CYS O O -2.359 -5.048 2.594 1.00 . A A . 32 CYS O 1 1 40 24721 1 1 32 CYS SG S -0.631 -0.897 0.561 1.00 . A A . 32 CYS SG 1 1 40 24722 1 1 33 THR C C -4.862 -3.116 4.397 1.00 . A A . 33 THR C 1 1 40 24723 1 1 33 THR CA C -3.522 -3.755 4.750 1.00 . A A . 33 THR CA 1 1 40 24724 1 1 33 THR CB C -3.203 -3.515 6.227 1.00 . A A . 33 THR CB 1 1 40 24725 1 1 33 THR CG2 C -1.761 -3.805 6.584 1.00 . A A . 33 THR CG2 1 1 40 24726 1 1 33 THR H H -2.096 -2.333 4.096 1.00 . A A . 33 THR H 1 1 40 24727 1 1 33 THR HA H -3.586 -4.818 4.573 1.00 . A A . 33 THR HA 1 1 40 24728 1 1 33 THR HB H -3.829 -4.158 6.829 1.00 . A A . 33 THR HB 1 1 40 24729 1 1 33 THR HG1 H -2.957 -1.582 6.029 1.00 . A A . 33 THR HG1 1 1 40 24730 1 1 33 THR HG21 H -1.285 -4.321 5.763 1.00 . A A . 33 THR HG21 1 1 40 24731 1 1 33 THR HG22 H -1.244 -2.877 6.775 1.00 . A A . 33 THR HG22 1 1 40 24732 1 1 33 THR HG23 H -1.727 -4.425 7.467 1.00 . A A . 33 THR HG23 1 1 40 24733 1 1 33 THR N N -2.455 -3.226 3.909 1.00 . A A . 33 THR N 1 1 40 24734 1 1 33 THR O O -5.782 -3.092 5.214 1.00 . A A . 33 THR O 1 1 40 24735 1 1 33 THR OG1 O -3.472 -2.171 6.585 1.00 . A A . 33 THR OG1 1 1 40 24736 1 1 34 GLY C C -6.688 -0.906 3.708 1.00 . A A . 34 GLY C 1 1 40 24737 1 1 34 GLY CA C -6.198 -1.965 2.738 1.00 . A A . 34 GLY CA 1 1 40 24738 1 1 34 GLY H H -4.200 -2.646 2.565 1.00 . A A . 34 GLY H 1 1 40 24739 1 1 34 GLY HA2 H -6.961 -2.723 2.636 1.00 . A A . 34 GLY HA2 1 1 40 24740 1 1 34 GLY HA3 H -6.031 -1.506 1.775 1.00 . A A . 34 GLY HA3 1 1 40 24741 1 1 34 GLY N N -4.966 -2.598 3.175 1.00 . A A . 34 GLY N 1 1 40 24742 1 1 34 GLY O O -7.886 -0.636 3.789 1.00 . A A . 34 GLY O 1 1 40 24743 1 1 35 ARG C C -5.412 2.045 5.077 1.00 . A A . 35 ARG C 1 1 40 24744 1 1 35 ARG CA C -6.102 0.729 5.415 1.00 . A A . 35 ARG CA 1 1 40 24745 1 1 35 ARG CB C -5.714 0.283 6.826 1.00 . A A . 35 ARG CB 1 1 40 24746 1 1 35 ARG CD C -7.939 0.150 7.984 1.00 . A A . 35 ARG CD 1 1 40 24747 1 1 35 ARG CG C -6.737 -0.631 7.478 1.00 . A A . 35 ARG CG 1 1 40 24748 1 1 35 ARG CZ C -10.103 0.927 7.098 1.00 . A A . 35 ARG CZ 1 1 40 24749 1 1 35 ARG H H -4.820 -0.564 4.336 1.00 . A A . 35 ARG H 1 1 40 24750 1 1 35 ARG HA H -7.168 0.878 5.376 1.00 . A A . 35 ARG HA 1 1 40 24751 1 1 35 ARG HB2 H -4.772 -0.242 6.778 1.00 . A A . 35 ARG HB2 1 1 40 24752 1 1 35 ARG HB3 H -5.596 1.159 7.448 1.00 . A A . 35 ARG HB3 1 1 40 24753 1 1 35 ARG HD2 H -8.259 -0.275 8.924 1.00 . A A . 35 ARG HD2 1 1 40 24754 1 1 35 ARG HD3 H -7.646 1.178 8.136 1.00 . A A . 35 ARG HD3 1 1 40 24755 1 1 35 ARG HE H -9.022 -0.564 6.331 1.00 . A A . 35 ARG HE 1 1 40 24756 1 1 35 ARG HG2 H -7.072 -1.357 6.753 1.00 . A A . 35 ARG HG2 1 1 40 24757 1 1 35 ARG HG3 H -6.273 -1.139 8.311 1.00 . A A . 35 ARG HG3 1 1 40 24758 1 1 35 ARG HH11 H -9.454 1.936 8.727 1.00 . A A . 35 ARG HH11 1 1 40 24759 1 1 35 ARG HH12 H -10.973 2.463 8.084 1.00 . A A . 35 ARG HH12 1 1 40 24760 1 1 35 ARG HH21 H -11.020 0.128 5.484 1.00 . A A . 35 ARG HH21 1 1 40 24761 1 1 35 ARG HH22 H -11.862 1.437 6.244 1.00 . A A . 35 ARG HH22 1 1 40 24762 1 1 35 ARG N N -5.759 -0.305 4.445 1.00 . A A . 35 ARG N 1 1 40 24763 1 1 35 ARG NE N -9.055 0.109 7.042 1.00 . A A . 35 ARG NE 1 1 40 24764 1 1 35 ARG NH1 N -10.183 1.851 8.048 1.00 . A A . 35 ARG NH1 1 1 40 24765 1 1 35 ARG NH2 N -11.075 0.822 6.202 1.00 . A A . 35 ARG NH2 1 1 40 24766 1 1 35 ARG O O -6.057 3.012 4.672 1.00 . A A . 35 ARG O 1 1 40 24767 1 1 36 SER C C -2.594 3.136 3.627 1.00 . A A . 36 SER C 1 1 40 24768 1 1 36 SER CA C -3.311 3.264 4.967 1.00 . A A . 36 SER CA 1 1 40 24769 1 1 36 SER CB C -2.292 3.504 6.082 1.00 . A A . 36 SER CB 1 1 40 24770 1 1 36 SER H H -3.647 1.266 5.576 1.00 . A A . 36 SER H 1 1 40 24771 1 1 36 SER HA H -3.987 4.105 4.922 1.00 . A A . 36 SER HA 1 1 40 24772 1 1 36 SER HB2 H -2.752 3.299 7.037 1.00 . A A . 36 SER HB2 1 1 40 24773 1 1 36 SER HB3 H -1.446 2.846 5.942 1.00 . A A . 36 SER HB3 1 1 40 24774 1 1 36 SER HG H -1.644 5.114 5.174 1.00 . A A . 36 SER HG 1 1 40 24775 1 1 36 SER N N -4.098 2.070 5.250 1.00 . A A . 36 SER N 1 1 40 24776 1 1 36 SER O O -2.190 2.043 3.230 1.00 . A A . 36 SER O 1 1 40 24777 1 1 36 SER OG O -1.833 4.845 6.076 1.00 . A A . 36 SER OG 1 1 40 24778 1 1 37 CYS C C -0.263 4.077 1.800 1.00 . A A . 37 CYS C 1 1 40 24779 1 1 37 CYS CA C -1.769 4.270 1.639 1.00 . A A . 37 CYS CA 1 1 40 24780 1 1 37 CYS CB C -2.048 5.583 0.904 1.00 . A A . 37 CYS CB 1 1 40 24781 1 1 37 CYS H H -2.780 5.101 3.303 1.00 . A A . 37 CYS H 1 1 40 24782 1 1 37 CYS HA H -2.164 3.452 1.057 1.00 . A A . 37 CYS HA 1 1 40 24783 1 1 37 CYS HB2 H -1.417 6.357 1.314 1.00 . A A . 37 CYS HB2 1 1 40 24784 1 1 37 CYS HB3 H -1.817 5.455 -0.143 1.00 . A A . 37 CYS HB3 1 1 40 24785 1 1 37 CYS N N -2.439 4.260 2.934 1.00 . A A . 37 CYS N 1 1 40 24786 1 1 37 CYS O O 0.433 3.732 0.844 1.00 . A A . 37 CYS O 1 1 40 24787 1 1 37 CYS SG S -3.775 6.156 1.026 1.00 . A A . 37 CYS SG 1 1 40 24788 1 1 38 GLU C C 1.971 2.746 3.796 1.00 . A A . 38 GLU C 1 1 40 24789 1 1 38 GLU CA C 1.660 4.151 3.292 1.00 . A A . 38 GLU CA 1 1 40 24790 1 1 38 GLU CB C 2.110 5.187 4.323 1.00 . A A . 38 GLU CB 1 1 40 24791 1 1 38 GLU CD C 2.947 7.139 2.956 1.00 . A A . 38 GLU CD 1 1 40 24792 1 1 38 GLU CG C 1.869 6.623 3.889 1.00 . A A . 38 GLU CG 1 1 40 24793 1 1 38 GLU H H -0.366 4.575 3.736 1.00 . A A . 38 GLU H 1 1 40 24794 1 1 38 GLU HA H 2.197 4.317 2.370 1.00 . A A . 38 GLU HA 1 1 40 24795 1 1 38 GLU HB2 H 1.574 5.017 5.245 1.00 . A A . 38 GLU HB2 1 1 40 24796 1 1 38 GLU HB3 H 3.168 5.061 4.505 1.00 . A A . 38 GLU HB3 1 1 40 24797 1 1 38 GLU HG2 H 0.918 6.677 3.380 1.00 . A A . 38 GLU HG2 1 1 40 24798 1 1 38 GLU HG3 H 1.842 7.252 4.767 1.00 . A A . 38 GLU HG3 1 1 40 24799 1 1 38 GLU N N 0.237 4.301 3.012 1.00 . A A . 38 GLU N 1 1 40 24800 1 1 38 GLU O O 1.576 2.370 4.900 1.00 . A A . 38 GLU O 1 1 40 24801 1 1 38 GLU OE1 O 3.605 6.309 2.293 1.00 . A A . 38 GLU OE1 1 1 40 24802 1 1 38 GLU OE2 O 3.133 8.372 2.887 1.00 . A A . 38 GLU OE2 1 1 40 24803 1 1 39 CYS C C 3.922 0.596 4.596 1.00 . A A . 39 CYS C 1 1 40 24804 1 1 39 CYS CA C 3.046 0.609 3.343 1.00 . A A . 39 CYS CA 1 1 40 24805 1 1 39 CYS CB C 3.784 -0.066 2.186 1.00 . A A . 39 CYS CB 1 1 40 24806 1 1 39 CYS H H 2.967 2.330 2.113 1.00 . A A . 39 CYS H 1 1 40 24807 1 1 39 CYS HA H 2.136 0.066 3.544 1.00 . A A . 39 CYS HA 1 1 40 24808 1 1 39 CYS HB2 H 4.308 0.685 1.615 1.00 . A A . 39 CYS HB2 1 1 40 24809 1 1 39 CYS HB3 H 4.498 -0.770 2.587 1.00 . A A . 39 CYS HB3 1 1 40 24810 1 1 39 CYS N N 2.681 1.974 2.980 1.00 . A A . 39 CYS N 1 1 40 24811 1 1 39 CYS O O 5.076 1.023 4.557 1.00 . A A . 39 CYS O 1 1 40 24812 1 1 39 CYS SG S 2.695 -0.972 1.039 1.00 . A A . 39 CYS SG 1 1 40 24813 1 1 40 PRO C C 5.273 -0.972 6.938 1.00 . A A . 40 PRO C 1 1 40 24814 1 1 40 PRO CA C 4.136 0.042 6.990 1.00 . A A . 40 PRO CA 1 1 40 24815 1 1 40 PRO CB C 3.082 -0.387 8.013 1.00 . A A . 40 PRO CB 1 1 40 24816 1 1 40 PRO CD C 2.019 -0.428 5.874 1.00 . A A . 40 PRO CD 1 1 40 24817 1 1 40 PRO CG C 2.050 -1.106 7.215 1.00 . A A . 40 PRO CG 1 1 40 24818 1 1 40 PRO HA H 4.532 1.010 7.261 1.00 . A A . 40 PRO HA 1 1 40 24819 1 1 40 PRO HB2 H 3.535 -1.035 8.750 1.00 . A A . 40 PRO HB2 1 1 40 24820 1 1 40 PRO HB3 H 2.669 0.485 8.497 1.00 . A A . 40 PRO HB3 1 1 40 24821 1 1 40 PRO HD2 H 1.799 -1.144 5.095 1.00 . A A . 40 PRO HD2 1 1 40 24822 1 1 40 PRO HD3 H 1.293 0.371 5.871 1.00 . A A . 40 PRO HD3 1 1 40 24823 1 1 40 PRO HG2 H 2.328 -2.144 7.105 1.00 . A A . 40 PRO HG2 1 1 40 24824 1 1 40 PRO HG3 H 1.088 -1.023 7.699 1.00 . A A . 40 PRO HG3 1 1 40 24825 1 1 40 PRO N N 3.388 0.104 5.730 1.00 . A A . 40 PRO N 1 1 40 24826 1 1 40 PRO O O 5.450 -1.672 5.940 1.00 . A A . 40 PRO O 1 1 40 24827 1 1 41 SER C C 6.697 -3.354 8.562 1.00 . A A . 41 SER C 1 1 40 24828 1 1 41 SER CA C 7.163 -1.977 8.097 1.00 . A A . 41 SER CA 1 1 40 24829 1 1 41 SER CB C 8.234 -1.437 9.047 1.00 . A A . 41 SER CB 1 1 40 24830 1 1 41 SER H H 5.851 -0.464 8.783 1.00 . A A . 41 SER H 1 1 40 24831 1 1 41 SER HA H 7.586 -2.069 7.108 1.00 . A A . 41 SER HA 1 1 40 24832 1 1 41 SER HB2 H 8.002 -1.740 10.058 1.00 . A A . 41 SER HB2 1 1 40 24833 1 1 41 SER HB3 H 9.197 -1.836 8.765 1.00 . A A . 41 SER HB3 1 1 40 24834 1 1 41 SER HG H 7.634 0.347 9.590 1.00 . A A . 41 SER HG 1 1 40 24835 1 1 41 SER N N 6.042 -1.048 8.019 1.00 . A A . 41 SER N 1 1 40 24836 1 1 41 SER O O 7.179 -3.880 9.566 1.00 . A A . 41 SER O 1 1 40 24837 1 1 41 SER OG O 8.294 -0.022 8.998 1.00 . A A . 41 SER OG 1 1 40 24838 1 1 42 TYR C C 5.544 -6.262 7.063 1.00 . A A . 42 TYR C 1 1 40 24839 1 1 42 TYR CA C 5.222 -5.249 8.160 1.00 . A A . 42 TYR CA 1 1 40 24840 1 1 42 TYR CB C 3.709 -5.172 8.371 1.00 . A A . 42 TYR CB 1 1 40 24841 1 1 42 TYR CD1 C 3.025 -5.994 10.658 1.00 . A A . 42 TYR CD1 1 1 40 24842 1 1 42 TYR CD2 C 3.216 -3.642 10.318 1.00 . A A . 42 TYR CD2 1 1 40 24843 1 1 42 TYR CE1 C 2.659 -5.779 11.973 1.00 . A A . 42 TYR CE1 1 1 40 24844 1 1 42 TYR CE2 C 2.851 -3.419 11.632 1.00 . A A . 42 TYR CE2 1 1 40 24845 1 1 42 TYR CG C 3.309 -4.932 9.809 1.00 . A A . 42 TYR CG 1 1 40 24846 1 1 42 TYR CZ C 2.574 -4.490 12.455 1.00 . A A . 42 TYR CZ 1 1 40 24847 1 1 42 TYR H H 5.409 -3.465 7.036 1.00 . A A . 42 TYR H 1 1 40 24848 1 1 42 TYR HA H 5.689 -5.572 9.079 1.00 . A A . 42 TYR HA 1 1 40 24849 1 1 42 TYR HB2 H 3.311 -4.363 7.777 1.00 . A A . 42 TYR HB2 1 1 40 24850 1 1 42 TYR HB3 H 3.260 -6.101 8.051 1.00 . A A . 42 TYR HB3 1 1 40 24851 1 1 42 TYR HD1 H 3.093 -7.003 10.277 1.00 . A A . 42 TYR HD1 1 1 40 24852 1 1 42 TYR HD2 H 3.433 -2.806 9.671 1.00 . A A . 42 TYR HD2 1 1 40 24853 1 1 42 TYR HE1 H 2.442 -6.618 12.617 1.00 . A A . 42 TYR HE1 1 1 40 24854 1 1 42 TYR HE2 H 2.784 -2.409 12.009 1.00 . A A . 42 TYR HE2 1 1 40 24855 1 1 42 TYR HH H 1.270 -4.436 13.867 1.00 . A A . 42 TYR HH 1 1 40 24856 1 1 42 TYR N N 5.755 -3.933 7.825 1.00 . A A . 42 TYR N 1 1 40 24857 1 1 42 TYR O O 4.707 -6.551 6.208 1.00 . A A . 42 TYR O 1 1 40 24858 1 1 42 TYR OH O 2.210 -4.272 13.764 1.00 . A A . 42 TYR OH 1 1 40 24859 1 1 43 PRO C C 6.217 -8.962 5.948 1.00 . A A . 43 PRO C 1 1 40 24860 1 1 43 PRO CA C 7.198 -7.802 6.077 1.00 . A A . 43 PRO CA 1 1 40 24861 1 1 43 PRO CB C 8.542 -8.296 6.618 1.00 . A A . 43 PRO CB 1 1 40 24862 1 1 43 PRO CD C 7.828 -6.529 8.060 1.00 . A A . 43 PRO CD 1 1 40 24863 1 1 43 PRO CG C 9.046 -7.176 7.461 1.00 . A A . 43 PRO CG 1 1 40 24864 1 1 43 PRO HA H 7.343 -7.346 5.108 1.00 . A A . 43 PRO HA 1 1 40 24865 1 1 43 PRO HB2 H 8.390 -9.193 7.201 1.00 . A A . 43 PRO HB2 1 1 40 24866 1 1 43 PRO HB3 H 9.211 -8.502 5.796 1.00 . A A . 43 PRO HB3 1 1 40 24867 1 1 43 PRO HD2 H 7.596 -6.973 9.016 1.00 . A A . 43 PRO HD2 1 1 40 24868 1 1 43 PRO HD3 H 7.978 -5.464 8.163 1.00 . A A . 43 PRO HD3 1 1 40 24869 1 1 43 PRO HG2 H 9.687 -7.562 8.239 1.00 . A A . 43 PRO HG2 1 1 40 24870 1 1 43 PRO HG3 H 9.583 -6.468 6.848 1.00 . A A . 43 PRO HG3 1 1 40 24871 1 1 43 PRO N N 6.769 -6.817 7.075 1.00 . A A . 43 PRO N 1 1 40 24872 1 1 43 PRO O O 5.445 -9.240 6.866 1.00 . A A . 43 PRO O 1 1 40 24873 1 1 44 GLY C C 5.881 -11.706 3.512 1.00 . A A . 44 GLY C 1 1 40 24874 1 1 44 GLY CA C 5.362 -10.759 4.576 1.00 . A A . 44 GLY CA 1 1 40 24875 1 1 44 GLY H H 6.890 -9.370 4.108 1.00 . A A . 44 GLY H 1 1 40 24876 1 1 44 GLY HA2 H 4.398 -10.382 4.267 1.00 . A A . 44 GLY HA2 1 1 40 24877 1 1 44 GLY HA3 H 5.244 -11.304 5.501 1.00 . A A . 44 GLY HA3 1 1 40 24878 1 1 44 GLY N N 6.253 -9.637 4.804 1.00 . A A . 44 GLY N 1 1 40 24879 1 1 44 GLY O O 6.869 -11.353 2.834 1.00 . A A . 44 GLY O 1 1 40 24880 1 1 44 GLY OXT O 5.301 -12.801 3.358 1.00 . A A . 44 GLY OXT 1 1 41 24881 1 1 1 ALA C C -12.540 14.881 1.263 1.00 . A A . 1 ALA C 1 1 41 24882 1 1 1 ALA CA C -12.808 16.381 1.298 1.00 . A A . 1 ALA CA 1 1 41 24883 1 1 1 ALA CB C -12.159 17.005 2.524 1.00 . A A . 1 ALA CB 1 1 41 24884 1 1 1 ALA H1 H -14.691 16.113 0.516 1.00 . A A . 1 ALA H1 1 1 41 24885 1 1 1 ALA H2 H -14.651 16.373 2.212 1.00 . A A . 1 ALA H2 1 1 41 24886 1 1 1 ALA H3 H -14.392 17.683 1.134 1.00 . A A . 1 ALA H3 1 1 41 24887 1 1 1 ALA HA H -12.369 16.834 0.420 1.00 . A A . 1 ALA HA 1 1 41 24888 1 1 1 ALA HB1 H -12.468 18.036 2.610 1.00 . A A . 1 ALA HB1 1 1 41 24889 1 1 1 ALA HB2 H -12.463 16.463 3.407 1.00 . A A . 1 ALA HB2 1 1 41 24890 1 1 1 ALA HB3 H -11.084 16.958 2.425 1.00 . A A . 1 ALA HB3 1 1 41 24891 1 1 1 ALA N N -14.267 16.663 1.289 1.00 . A A . 1 ALA N 1 1 41 24892 1 1 1 ALA O O -11.762 14.398 0.441 1.00 . A A . 1 ALA O 1 1 41 24893 1 1 2 MET C C -11.568 12.336 2.521 1.00 . A A . 2 MET C 1 1 41 24894 1 1 2 MET CA C -13.021 12.701 2.234 1.00 . A A . 2 MET CA 1 1 41 24895 1 1 2 MET CB C -13.476 12.048 0.927 1.00 . A A . 2 MET CB 1 1 41 24896 1 1 2 MET CE C -17.437 12.032 -0.258 1.00 . A A . 2 MET CE 1 1 41 24897 1 1 2 MET CG C -14.950 11.679 0.912 1.00 . A A . 2 MET CG 1 1 41 24898 1 1 2 MET H H -13.796 14.591 2.791 1.00 . A A . 2 MET H 1 1 41 24899 1 1 2 MET HA H -13.638 12.336 3.042 1.00 . A A . 2 MET HA 1 1 41 24900 1 1 2 MET HB2 H -13.289 12.732 0.113 1.00 . A A . 2 MET HB2 1 1 41 24901 1 1 2 MET HB3 H -12.900 11.148 0.769 1.00 . A A . 2 MET HB3 1 1 41 24902 1 1 2 MET HE1 H -17.552 12.746 0.545 1.00 . A A . 2 MET HE1 1 1 41 24903 1 1 2 MET HE2 H -18.010 12.358 -1.114 1.00 . A A . 2 MET HE2 1 1 41 24904 1 1 2 MET HE3 H -17.792 11.065 0.066 1.00 . A A . 2 MET HE3 1 1 41 24905 1 1 2 MET HG2 H -15.050 10.642 1.194 1.00 . A A . 2 MET HG2 1 1 41 24906 1 1 2 MET HG3 H -15.469 12.297 1.630 1.00 . A A . 2 MET HG3 1 1 41 24907 1 1 2 MET N N -13.189 14.148 2.162 1.00 . A A . 2 MET N 1 1 41 24908 1 1 2 MET O O -10.724 13.211 2.714 1.00 . A A . 2 MET O 1 1 41 24909 1 1 2 MET SD S -15.708 11.913 -0.707 1.00 . A A . 2 MET SD 1 1 41 24910 1 1 3 ASP C C -9.434 9.682 1.663 1.00 . A A . 3 ASP C 1 1 41 24911 1 1 3 ASP CA C -9.933 10.556 2.810 1.00 . A A . 3 ASP CA 1 1 41 24912 1 1 3 ASP CB C -9.896 9.768 4.120 1.00 . A A . 3 ASP CB 1 1 41 24913 1 1 3 ASP CG C -11.006 8.738 4.207 1.00 . A A . 3 ASP CG 1 1 41 24914 1 1 3 ASP H H -12.000 10.388 2.385 1.00 . A A . 3 ASP H 1 1 41 24915 1 1 3 ASP HA H -9.286 11.416 2.899 1.00 . A A . 3 ASP HA 1 1 41 24916 1 1 3 ASP HB2 H -8.949 9.255 4.198 1.00 . A A . 3 ASP HB2 1 1 41 24917 1 1 3 ASP HB3 H -10.000 10.453 4.948 1.00 . A A . 3 ASP HB3 1 1 41 24918 1 1 3 ASP N N -11.284 11.038 2.547 1.00 . A A . 3 ASP N 1 1 41 24919 1 1 3 ASP O O -9.977 8.607 1.408 1.00 . A A . 3 ASP O 1 1 41 24920 1 1 3 ASP OD1 O -10.886 7.680 3.554 1.00 . A A . 3 ASP OD1 1 1 41 24921 1 1 3 ASP OD2 O -11.994 8.990 4.928 1.00 . A A . 3 ASP OD2 1 1 41 24922 1 1 4 CYS C C -6.464 8.834 0.222 1.00 . A A . 4 CYS C 1 1 41 24923 1 1 4 CYS CA C -7.826 9.413 -0.145 1.00 . A A . 4 CYS CA 1 1 41 24924 1 1 4 CYS CB C -7.694 10.322 -1.368 1.00 . A A . 4 CYS CB 1 1 41 24925 1 1 4 CYS H H -8.010 11.015 1.227 1.00 . A A . 4 CYS H 1 1 41 24926 1 1 4 CYS HA H -8.497 8.601 -0.382 1.00 . A A . 4 CYS HA 1 1 41 24927 1 1 4 CYS HB2 H -7.205 11.239 -1.075 1.00 . A A . 4 CYS HB2 1 1 41 24928 1 1 4 CYS HB3 H -7.093 9.822 -2.114 1.00 . A A . 4 CYS HB3 1 1 41 24929 1 1 4 CYS N N -8.399 10.152 0.975 1.00 . A A . 4 CYS N 1 1 41 24930 1 1 4 CYS O O -6.058 7.799 -0.307 1.00 . A A . 4 CYS O 1 1 41 24931 1 1 4 CYS SG S -9.283 10.765 -2.140 1.00 . A A . 4 CYS SG 1 1 41 24932 1 1 5 THR C C -3.577 8.616 0.401 1.00 . A A . 5 THR C 1 1 41 24933 1 1 5 THR CA C -4.439 9.073 1.577 1.00 . A A . 5 THR CA 1 1 41 24934 1 1 5 THR CB C -4.565 7.945 2.606 1.00 . A A . 5 THR CB 1 1 41 24935 1 1 5 THR CG2 C -5.443 6.801 2.146 1.00 . A A . 5 THR CG2 1 1 41 24936 1 1 5 THR H H -6.143 10.329 1.512 1.00 . A A . 5 THR H 1 1 41 24937 1 1 5 THR HA H -3.957 9.918 2.047 1.00 . A A . 5 THR HA 1 1 41 24938 1 1 5 THR HB H -4.994 8.347 3.512 1.00 . A A . 5 THR HB 1 1 41 24939 1 1 5 THR HG1 H -2.768 8.071 3.375 1.00 . A A . 5 THR HG1 1 1 41 24940 1 1 5 THR HG21 H -5.096 6.442 1.189 1.00 . A A . 5 THR HG21 1 1 41 24941 1 1 5 THR HG22 H -5.398 6.000 2.869 1.00 . A A . 5 THR HG22 1 1 41 24942 1 1 5 THR HG23 H -6.463 7.145 2.053 1.00 . A A . 5 THR HG23 1 1 41 24943 1 1 5 THR N N -5.762 9.511 1.131 1.00 . A A . 5 THR N 1 1 41 24944 1 1 5 THR O O -3.346 7.422 0.213 1.00 . A A . 5 THR O 1 1 41 24945 1 1 5 THR OG1 O -3.292 7.408 2.918 1.00 . A A . 5 THR OG1 1 1 41 24946 1 1 6 THR C C -1.013 8.518 -1.129 1.00 . A A . 6 THR C 1 1 41 24947 1 1 6 THR CA C -2.270 9.276 -1.545 1.00 . A A . 6 THR CA 1 1 41 24948 1 1 6 THR CB C -1.885 10.565 -2.271 1.00 . A A . 6 THR CB 1 1 41 24949 1 1 6 THR CG2 C -3.067 11.274 -2.898 1.00 . A A . 6 THR CG2 1 1 41 24950 1 1 6 THR H H -3.324 10.511 -0.186 1.00 . A A . 6 THR H 1 1 41 24951 1 1 6 THR HA H -2.845 8.654 -2.214 1.00 . A A . 6 THR HA 1 1 41 24952 1 1 6 THR HB H -1.186 10.327 -3.060 1.00 . A A . 6 THR HB 1 1 41 24953 1 1 6 THR HG1 H -1.905 11.798 -0.750 1.00 . A A . 6 THR HG1 1 1 41 24954 1 1 6 THR HG21 H -3.757 10.543 -3.293 1.00 . A A . 6 THR HG21 1 1 41 24955 1 1 6 THR HG22 H -3.565 11.873 -2.151 1.00 . A A . 6 THR HG22 1 1 41 24956 1 1 6 THR HG23 H -2.721 11.911 -3.699 1.00 . A A . 6 THR HG23 1 1 41 24957 1 1 6 THR N N -3.105 9.577 -0.387 1.00 . A A . 6 THR N 1 1 41 24958 1 1 6 THR O O -0.298 8.933 -0.217 1.00 . A A . 6 THR O 1 1 41 24959 1 1 6 THR OG1 O -1.260 11.475 -1.383 1.00 . A A . 6 THR OG1 1 1 41 24960 1 1 7 GLY C C 0.487 5.330 -2.312 1.00 . A A . 7 GLY C 1 1 41 24961 1 1 7 GLY CA C 0.421 6.606 -1.493 1.00 . A A . 7 GLY CA 1 1 41 24962 1 1 7 GLY H H -1.355 7.123 -2.522 1.00 . A A . 7 GLY H 1 1 41 24963 1 1 7 GLY HA2 H 0.398 6.347 -0.445 1.00 . A A . 7 GLY HA2 1 1 41 24964 1 1 7 GLY HA3 H 1.306 7.193 -1.688 1.00 . A A . 7 GLY HA3 1 1 41 24965 1 1 7 GLY N N -0.749 7.405 -1.805 1.00 . A A . 7 GLY N 1 1 41 24966 1 1 7 GLY O O -0.415 5.051 -3.101 1.00 . A A . 7 GLY O 1 1 41 24967 1 1 8 PRO C C 0.890 2.137 -2.300 1.00 . A A . 8 PRO C 1 1 41 24968 1 1 8 PRO CA C 1.722 3.276 -2.884 1.00 . A A . 8 PRO CA 1 1 41 24969 1 1 8 PRO CB C 3.212 2.986 -2.724 1.00 . A A . 8 PRO CB 1 1 41 24970 1 1 8 PRO CD C 2.681 4.785 -1.228 1.00 . A A . 8 PRO CD 1 1 41 24971 1 1 8 PRO CG C 3.568 3.579 -1.404 1.00 . A A . 8 PRO CG 1 1 41 24972 1 1 8 PRO HA H 1.484 3.396 -3.930 1.00 . A A . 8 PRO HA 1 1 41 24973 1 1 8 PRO HB2 H 3.379 1.919 -2.738 1.00 . A A . 8 PRO HB2 1 1 41 24974 1 1 8 PRO HB3 H 3.762 3.454 -3.527 1.00 . A A . 8 PRO HB3 1 1 41 24975 1 1 8 PRO HD2 H 2.336 4.852 -0.206 1.00 . A A . 8 PRO HD2 1 1 41 24976 1 1 8 PRO HD3 H 3.208 5.684 -1.509 1.00 . A A . 8 PRO HD3 1 1 41 24977 1 1 8 PRO HG2 H 3.383 2.861 -0.619 1.00 . A A . 8 PRO HG2 1 1 41 24978 1 1 8 PRO HG3 H 4.606 3.876 -1.403 1.00 . A A . 8 PRO HG3 1 1 41 24979 1 1 8 PRO N N 1.553 4.529 -2.146 1.00 . A A . 8 PRO N 1 1 41 24980 1 1 8 PRO O O 1.420 1.079 -1.961 1.00 . A A . 8 PRO O 1 1 41 24981 1 1 9 CYS C C -2.773 1.797 -1.753 1.00 . A A . 9 CYS C 1 1 41 24982 1 1 9 CYS CA C -1.318 1.347 -1.645 1.00 . A A . 9 CYS CA 1 1 41 24983 1 1 9 CYS CB C -0.966 1.049 -0.185 1.00 . A A . 9 CYS CB 1 1 41 24984 1 1 9 CYS H H -0.783 3.220 -2.474 1.00 . A A . 9 CYS H 1 1 41 24985 1 1 9 CYS HA H -1.190 0.446 -2.227 1.00 . A A . 9 CYS HA 1 1 41 24986 1 1 9 CYS HB2 H -0.379 1.865 0.209 1.00 . A A . 9 CYS HB2 1 1 41 24987 1 1 9 CYS HB3 H -1.877 0.958 0.388 1.00 . A A . 9 CYS HB3 1 1 41 24988 1 1 9 CYS N N -0.416 2.358 -2.187 1.00 . A A . 9 CYS N 1 1 41 24989 1 1 9 CYS O O -3.592 1.503 -0.882 1.00 . A A . 9 CYS O 1 1 41 24990 1 1 9 CYS SG S -0.009 -0.484 0.051 1.00 . A A . 9 CYS SG 1 1 41 24991 1 1 10 CYS C C -4.590 3.591 -4.448 1.00 . A A . 10 CYS C 1 1 41 24992 1 1 10 CYS CA C -4.447 2.995 -3.052 1.00 . A A . 10 CYS CA 1 1 41 24993 1 1 10 CYS CB C -4.818 4.039 -1.996 1.00 . A A . 10 CYS CB 1 1 41 24994 1 1 10 CYS H H -2.396 2.709 -3.492 1.00 . A A . 10 CYS H 1 1 41 24995 1 1 10 CYS HA H -5.118 2.153 -2.963 1.00 . A A . 10 CYS HA 1 1 41 24996 1 1 10 CYS HB2 H -5.814 4.404 -2.197 1.00 . A A . 10 CYS HB2 1 1 41 24997 1 1 10 CYS HB3 H -4.800 3.575 -1.021 1.00 . A A . 10 CYS HB3 1 1 41 24998 1 1 10 CYS N N -3.090 2.509 -2.830 1.00 . A A . 10 CYS N 1 1 41 24999 1 1 10 CYS O O -4.010 4.634 -4.751 1.00 . A A . 10 CYS O 1 1 41 25000 1 1 10 CYS SG S -3.702 5.478 -1.947 1.00 . A A . 10 CYS SG 1 1 41 25001 1 1 11 ARG C C -6.204 4.778 -6.672 1.00 . A A . 11 ARG C 1 1 41 25002 1 1 11 ARG CA C -5.585 3.383 -6.660 1.00 . A A . 11 ARG CA 1 1 41 25003 1 1 11 ARG CB C -6.489 2.403 -7.412 1.00 . A A . 11 ARG CB 1 1 41 25004 1 1 11 ARG CD C -6.119 3.392 -9.693 1.00 . A A . 11 ARG CD 1 1 41 25005 1 1 11 ARG CG C -6.041 2.136 -8.840 1.00 . A A . 11 ARG CG 1 1 41 25006 1 1 11 ARG CZ C -5.467 4.059 -11.973 1.00 . A A . 11 ARG CZ 1 1 41 25007 1 1 11 ARG H H -5.800 2.096 -4.994 1.00 . A A . 11 ARG H 1 1 41 25008 1 1 11 ARG HA H -4.626 3.424 -7.154 1.00 . A A . 11 ARG HA 1 1 41 25009 1 1 11 ARG HB2 H -6.502 1.464 -6.880 1.00 . A A . 11 ARG HB2 1 1 41 25010 1 1 11 ARG HB3 H -7.491 2.805 -7.441 1.00 . A A . 11 ARG HB3 1 1 41 25011 1 1 11 ARG HD2 H -7.149 3.557 -9.973 1.00 . A A . 11 ARG HD2 1 1 41 25012 1 1 11 ARG HD3 H -5.766 4.230 -9.110 1.00 . A A . 11 ARG HD3 1 1 41 25013 1 1 11 ARG HE H -4.613 2.593 -10.922 1.00 . A A . 11 ARG HE 1 1 41 25014 1 1 11 ARG HG2 H -5.020 1.785 -8.827 1.00 . A A . 11 ARG HG2 1 1 41 25015 1 1 11 ARG HG3 H -6.679 1.378 -9.271 1.00 . A A . 11 ARG HG3 1 1 41 25016 1 1 11 ARG HH11 H -6.991 5.134 -11.190 1.00 . A A . 11 ARG HH11 1 1 41 25017 1 1 11 ARG HH12 H -6.512 5.583 -12.793 1.00 . A A . 11 ARG HH12 1 1 41 25018 1 1 11 ARG HH21 H -3.982 3.183 -13.029 1.00 . A A . 11 ARG HH21 1 1 41 25019 1 1 11 ARG HH22 H -4.805 4.475 -13.837 1.00 . A A . 11 ARG HH22 1 1 41 25020 1 1 11 ARG N N -5.365 2.922 -5.295 1.00 . A A . 11 ARG N 1 1 41 25021 1 1 11 ARG NE N -5.310 3.282 -10.904 1.00 . A A . 11 ARG NE 1 1 41 25022 1 1 11 ARG NH1 N -6.400 5.002 -11.986 1.00 . A A . 11 ARG NH1 1 1 41 25023 1 1 11 ARG NH2 N -4.687 3.892 -13.033 1.00 . A A . 11 ARG NH2 1 1 41 25024 1 1 11 ARG O O -7.426 4.925 -6.685 1.00 . A A . 11 ARG O 1 1 41 25025 1 1 12 GLN C C -6.480 7.551 -5.364 1.00 . A A . 12 GLN C 1 1 41 25026 1 1 12 GLN CA C -5.807 7.185 -6.681 1.00 . A A . 12 GLN CA 1 1 41 25027 1 1 12 GLN CB C -6.772 7.423 -7.846 1.00 . A A . 12 GLN CB 1 1 41 25028 1 1 12 GLN CD C -6.537 7.839 -10.326 1.00 . A A . 12 GLN CD 1 1 41 25029 1 1 12 GLN CG C -6.263 6.891 -9.176 1.00 . A A . 12 GLN CG 1 1 41 25030 1 1 12 GLN H H -4.388 5.614 -6.660 1.00 . A A . 12 GLN H 1 1 41 25031 1 1 12 GLN HA H -4.943 7.813 -6.811 1.00 . A A . 12 GLN HA 1 1 41 25032 1 1 12 GLN HB2 H -7.712 6.939 -7.625 1.00 . A A . 12 GLN HB2 1 1 41 25033 1 1 12 GLN HB3 H -6.940 8.485 -7.948 1.00 . A A . 12 GLN HB3 1 1 41 25034 1 1 12 GLN HE21 H -8.120 6.765 -10.867 1.00 . A A . 12 GLN HE21 1 1 41 25035 1 1 12 GLN HE22 H -7.789 8.154 -11.839 1.00 . A A . 12 GLN HE22 1 1 41 25036 1 1 12 GLN HG2 H -5.197 6.737 -9.103 1.00 . A A . 12 GLN HG2 1 1 41 25037 1 1 12 GLN HG3 H -6.749 5.948 -9.381 1.00 . A A . 12 GLN HG3 1 1 41 25038 1 1 12 GLN N N -5.350 5.798 -6.670 1.00 . A A . 12 GLN N 1 1 41 25039 1 1 12 GLN NE2 N -7.588 7.558 -11.088 1.00 . A A . 12 GLN NE2 1 1 41 25040 1 1 12 GLN O O -5.963 8.359 -4.593 1.00 . A A . 12 GLN O 1 1 41 25041 1 1 12 GLN OE1 O -5.814 8.814 -10.529 1.00 . A A . 12 GLN OE1 1 1 41 25042 1 1 13 CYS C C -9.218 5.996 -3.493 1.00 . A A . 13 CYS C 1 1 41 25043 1 1 13 CYS CA C -8.386 7.212 -3.892 1.00 . A A . 13 CYS CA 1 1 41 25044 1 1 13 CYS CB C -9.293 8.430 -4.078 1.00 . A A . 13 CYS CB 1 1 41 25045 1 1 13 CYS H H -7.992 6.319 -5.771 1.00 . A A . 13 CYS H 1 1 41 25046 1 1 13 CYS HA H -7.675 7.420 -3.106 1.00 . A A . 13 CYS HA 1 1 41 25047 1 1 13 CYS HB2 H -8.701 9.259 -4.435 1.00 . A A . 13 CYS HB2 1 1 41 25048 1 1 13 CYS HB3 H -10.052 8.196 -4.809 1.00 . A A . 13 CYS HB3 1 1 41 25049 1 1 13 CYS N N -7.635 6.951 -5.115 1.00 . A A . 13 CYS N 1 1 41 25050 1 1 13 CYS O O -10.392 6.123 -3.143 1.00 . A A . 13 CYS O 1 1 41 25051 1 1 13 CYS SG S -10.136 8.970 -2.555 1.00 . A A . 13 CYS SG 1 1 41 25052 1 1 14 LYS C C -8.320 2.590 -2.561 1.00 . A A . 14 LYS C 1 1 41 25053 1 1 14 LYS CA C -9.290 3.585 -3.186 1.00 . A A . 14 LYS CA 1 1 41 25054 1 1 14 LYS CB C -9.951 2.966 -4.419 1.00 . A A . 14 LYS CB 1 1 41 25055 1 1 14 LYS CD C -12.228 2.809 -5.471 1.00 . A A . 14 LYS CD 1 1 41 25056 1 1 14 LYS CE C -13.320 2.537 -4.449 1.00 . A A . 14 LYS CE 1 1 41 25057 1 1 14 LYS CG C -11.163 3.739 -4.913 1.00 . A A . 14 LYS CG 1 1 41 25058 1 1 14 LYS H H -7.667 4.778 -3.830 1.00 . A A . 14 LYS H 1 1 41 25059 1 1 14 LYS HA H -10.054 3.828 -2.463 1.00 . A A . 14 LYS HA 1 1 41 25060 1 1 14 LYS HB2 H -9.227 2.925 -5.219 1.00 . A A . 14 LYS HB2 1 1 41 25061 1 1 14 LYS HB3 H -10.266 1.961 -4.179 1.00 . A A . 14 LYS HB3 1 1 41 25062 1 1 14 LYS HD2 H -12.671 3.267 -6.343 1.00 . A A . 14 LYS HD2 1 1 41 25063 1 1 14 LYS HD3 H -11.765 1.873 -5.749 1.00 . A A . 14 LYS HD3 1 1 41 25064 1 1 14 LYS HE2 H -13.824 3.465 -4.224 1.00 . A A . 14 LYS HE2 1 1 41 25065 1 1 14 LYS HE3 H -14.026 1.838 -4.874 1.00 . A A . 14 LYS HE3 1 1 41 25066 1 1 14 LYS HG2 H -11.582 4.297 -4.089 1.00 . A A . 14 LYS HG2 1 1 41 25067 1 1 14 LYS HG3 H -10.850 4.422 -5.690 1.00 . A A . 14 LYS HG3 1 1 41 25068 1 1 14 LYS HZ1 H -11.942 2.511 -2.880 1.00 . A A . 14 LYS HZ1 1 1 41 25069 1 1 14 LYS HZ2 H -13.492 1.997 -2.439 1.00 . A A . 14 LYS HZ2 1 1 41 25070 1 1 14 LYS HZ3 H -12.486 0.976 -3.339 1.00 . A A . 14 LYS HZ3 1 1 41 25071 1 1 14 LYS N N -8.604 4.819 -3.545 1.00 . A A . 14 LYS N 1 1 41 25072 1 1 14 LYS NZ N -12.772 1.965 -3.188 1.00 . A A . 14 LYS NZ 1 1 41 25073 1 1 14 LYS O O -7.347 2.177 -3.193 1.00 . A A . 14 LYS O 1 1 41 25074 1 1 15 LEU C C -7.446 0.035 -1.468 1.00 . A A . 15 LEU C 1 1 41 25075 1 1 15 LEU CA C -7.738 1.258 -0.605 1.00 . A A . 15 LEU CA 1 1 41 25076 1 1 15 LEU CB C -8.402 0.825 0.703 1.00 . A A . 15 LEU CB 1 1 41 25077 1 1 15 LEU CD1 C -9.021 1.317 3.081 1.00 . A A . 15 LEU CD1 1 1 41 25078 1 1 15 LEU CD2 C -6.983 2.365 2.080 1.00 . A A . 15 LEU CD2 1 1 41 25079 1 1 15 LEU CG C -8.400 1.878 1.812 1.00 . A A . 15 LEU CG 1 1 41 25080 1 1 15 LEU H H -9.379 2.571 -0.865 1.00 . A A . 15 LEU H 1 1 41 25081 1 1 15 LEU HA H -6.806 1.755 -0.378 1.00 . A A . 15 LEU HA 1 1 41 25082 1 1 15 LEU HB2 H -9.427 0.558 0.490 1.00 . A A . 15 LEU HB2 1 1 41 25083 1 1 15 LEU HB3 H -7.889 -0.051 1.070 1.00 . A A . 15 LEU HB3 1 1 41 25084 1 1 15 LEU HD11 H -8.586 0.353 3.299 1.00 . A A . 15 LEU HD11 1 1 41 25085 1 1 15 LEU HD12 H -8.832 1.991 3.903 1.00 . A A . 15 LEU HD12 1 1 41 25086 1 1 15 LEU HD13 H -10.087 1.208 2.942 1.00 . A A . 15 LEU HD13 1 1 41 25087 1 1 15 LEU HD21 H -6.336 1.516 2.245 1.00 . A A . 15 LEU HD21 1 1 41 25088 1 1 15 LEU HD22 H -6.629 2.927 1.229 1.00 . A A . 15 LEU HD22 1 1 41 25089 1 1 15 LEU HD23 H -6.979 2.996 2.956 1.00 . A A . 15 LEU HD23 1 1 41 25090 1 1 15 LEU HG H -8.992 2.725 1.497 1.00 . A A . 15 LEU HG 1 1 41 25091 1 1 15 LEU N N -8.589 2.207 -1.316 1.00 . A A . 15 LEU N 1 1 41 25092 1 1 15 LEU O O -8.323 -0.796 -1.700 1.00 . A A . 15 LEU O 1 1 41 25093 1 1 16 LYS C C -6.190 -2.521 -2.141 1.00 . A A . 16 LYS C 1 1 41 25094 1 1 16 LYS CA C -5.801 -1.189 -2.783 1.00 . A A . 16 LYS CA 1 1 41 25095 1 1 16 LYS CB C -4.290 -1.147 -3.028 1.00 . A A . 16 LYS CB 1 1 41 25096 1 1 16 LYS CD C -2.579 -0.491 -4.750 1.00 . A A . 16 LYS CD 1 1 41 25097 1 1 16 LYS CE C -2.776 0.900 -5.330 1.00 . A A . 16 LYS CE 1 1 41 25098 1 1 16 LYS CG C -3.910 -1.184 -4.500 1.00 . A A . 16 LYS CG 1 1 41 25099 1 1 16 LYS H H -5.552 0.628 -1.724 1.00 . A A . 16 LYS H 1 1 41 25100 1 1 16 LYS HA H -6.313 -1.093 -3.729 1.00 . A A . 16 LYS HA 1 1 41 25101 1 1 16 LYS HB2 H -3.893 -0.239 -2.600 1.00 . A A . 16 LYS HB2 1 1 41 25102 1 1 16 LYS HB3 H -3.832 -1.994 -2.539 1.00 . A A . 16 LYS HB3 1 1 41 25103 1 1 16 LYS HD2 H -2.046 -0.407 -3.815 1.00 . A A . 16 LYS HD2 1 1 41 25104 1 1 16 LYS HD3 H -2.002 -1.083 -5.445 1.00 . A A . 16 LYS HD3 1 1 41 25105 1 1 16 LYS HE2 H -3.692 1.315 -4.936 1.00 . A A . 16 LYS HE2 1 1 41 25106 1 1 16 LYS HE3 H -1.943 1.521 -5.034 1.00 . A A . 16 LYS HE3 1 1 41 25107 1 1 16 LYS HG2 H -3.832 -2.213 -4.815 1.00 . A A . 16 LYS HG2 1 1 41 25108 1 1 16 LYS HG3 H -4.679 -0.687 -5.072 1.00 . A A . 16 LYS HG3 1 1 41 25109 1 1 16 LYS HZ1 H -2.230 0.139 -7.197 1.00 . A A . 16 LYS HZ1 1 1 41 25110 1 1 16 LYS HZ2 H -3.833 0.674 -7.118 1.00 . A A . 16 LYS HZ2 1 1 41 25111 1 1 16 LYS HZ3 H -2.568 1.796 -7.206 1.00 . A A . 16 LYS HZ3 1 1 41 25112 1 1 16 LYS N N -6.207 -0.067 -1.942 1.00 . A A . 16 LYS N 1 1 41 25113 1 1 16 LYS NZ N -2.858 0.876 -6.817 1.00 . A A . 16 LYS NZ 1 1 41 25114 1 1 16 LYS O O -6.208 -2.646 -0.917 1.00 . A A . 16 LYS O 1 1 41 25115 1 1 17 PRO C C -5.882 -5.427 -1.478 1.00 . A A . 17 PRO C 1 1 41 25116 1 1 17 PRO CA C -6.896 -4.861 -2.467 1.00 . A A . 17 PRO CA 1 1 41 25117 1 1 17 PRO CB C -6.954 -5.730 -3.734 1.00 . A A . 17 PRO CB 1 1 41 25118 1 1 17 PRO CD C -6.513 -3.484 -4.428 1.00 . A A . 17 PRO CD 1 1 41 25119 1 1 17 PRO CG C -6.305 -4.920 -4.808 1.00 . A A . 17 PRO CG 1 1 41 25120 1 1 17 PRO HA H -7.870 -4.835 -2.001 1.00 . A A . 17 PRO HA 1 1 41 25121 1 1 17 PRO HB2 H -6.421 -6.653 -3.562 1.00 . A A . 17 PRO HB2 1 1 41 25122 1 1 17 PRO HB3 H -7.984 -5.946 -3.975 1.00 . A A . 17 PRO HB3 1 1 41 25123 1 1 17 PRO HD2 H -5.703 -2.872 -4.798 1.00 . A A . 17 PRO HD2 1 1 41 25124 1 1 17 PRO HD3 H -7.462 -3.126 -4.799 1.00 . A A . 17 PRO HD3 1 1 41 25125 1 1 17 PRO HG2 H -5.250 -5.147 -4.851 1.00 . A A . 17 PRO HG2 1 1 41 25126 1 1 17 PRO HG3 H -6.773 -5.128 -5.758 1.00 . A A . 17 PRO HG3 1 1 41 25127 1 1 17 PRO N N -6.508 -3.537 -2.961 1.00 . A A . 17 PRO N 1 1 41 25128 1 1 17 PRO O O -4.685 -5.479 -1.762 1.00 . A A . 17 PRO O 1 1 41 25129 1 1 18 ALA C C -4.629 -7.526 0.162 1.00 . A A . 18 ALA C 1 1 41 25130 1 1 18 ALA CA C -5.509 -6.412 0.720 1.00 . A A . 18 ALA CA 1 1 41 25131 1 1 18 ALA CB C -6.347 -6.930 1.879 1.00 . A A . 18 ALA CB 1 1 41 25132 1 1 18 ALA H H -7.333 -5.780 -0.148 1.00 . A A . 18 ALA H 1 1 41 25133 1 1 18 ALA HA H -4.875 -5.620 1.093 1.00 . A A . 18 ALA HA 1 1 41 25134 1 1 18 ALA HB1 H -6.786 -6.097 2.407 1.00 . A A . 18 ALA HB1 1 1 41 25135 1 1 18 ALA HB2 H -5.720 -7.494 2.553 1.00 . A A . 18 ALA HB2 1 1 41 25136 1 1 18 ALA HB3 H -7.131 -7.568 1.498 1.00 . A A . 18 ALA HB3 1 1 41 25137 1 1 18 ALA N N -6.370 -5.849 -0.315 1.00 . A A . 18 ALA N 1 1 41 25138 1 1 18 ALA O O -5.127 -8.557 -0.291 1.00 . A A . 18 ALA O 1 1 41 25139 1 1 19 GLY C C -1.660 -7.833 -1.554 1.00 . A A . 19 GLY C 1 1 41 25140 1 1 19 GLY CA C -2.387 -8.302 -0.309 1.00 . A A . 19 GLY CA 1 1 41 25141 1 1 19 GLY H H -2.980 -6.469 0.569 1.00 . A A . 19 GLY H 1 1 41 25142 1 1 19 GLY HA2 H -2.932 -9.205 -0.542 1.00 . A A . 19 GLY HA2 1 1 41 25143 1 1 19 GLY HA3 H -1.660 -8.521 0.459 1.00 . A A . 19 GLY HA3 1 1 41 25144 1 1 19 GLY N N -3.318 -7.310 0.197 1.00 . A A . 19 GLY N 1 1 41 25145 1 1 19 GLY O O -1.189 -8.647 -2.349 1.00 . A A . 19 GLY O 1 1 41 25146 1 1 20 THR C C 0.404 -5.253 -2.468 1.00 . A A . 20 THR C 1 1 41 25147 1 1 20 THR CA C -0.892 -5.942 -2.882 1.00 . A A . 20 THR CA 1 1 41 25148 1 1 20 THR CB C -1.810 -4.945 -3.591 1.00 . A A . 20 THR CB 1 1 41 25149 1 1 20 THR CG2 C -1.194 -4.344 -4.835 1.00 . A A . 20 THR CG2 1 1 41 25150 1 1 20 THR H H -1.962 -5.919 -1.057 1.00 . A A . 20 THR H 1 1 41 25151 1 1 20 THR HA H -0.656 -6.747 -3.563 1.00 . A A . 20 THR HA 1 1 41 25152 1 1 20 THR HB H -2.038 -4.137 -2.911 1.00 . A A . 20 THR HB 1 1 41 25153 1 1 20 THR HG1 H -2.857 -6.204 -4.665 1.00 . A A . 20 THR HG1 1 1 41 25154 1 1 20 THR HG21 H -0.171 -4.064 -4.632 1.00 . A A . 20 THR HG21 1 1 41 25155 1 1 20 THR HG22 H -1.218 -5.069 -5.635 1.00 . A A . 20 THR HG22 1 1 41 25156 1 1 20 THR HG23 H -1.755 -3.468 -5.127 1.00 . A A . 20 THR HG23 1 1 41 25157 1 1 20 THR N N -1.567 -6.518 -1.725 1.00 . A A . 20 THR N 1 1 41 25158 1 1 20 THR O O 0.399 -4.354 -1.627 1.00 . A A . 20 THR O 1 1 41 25159 1 1 20 THR OG1 O -3.026 -5.565 -3.969 1.00 . A A . 20 THR OG1 1 1 41 25160 1 1 21 THR C C 2.838 -3.610 -3.062 1.00 . A A . 21 THR C 1 1 41 25161 1 1 21 THR CA C 2.817 -5.104 -2.754 1.00 . A A . 21 THR CA 1 1 41 25162 1 1 21 THR CB C 3.917 -5.818 -3.545 1.00 . A A . 21 THR CB 1 1 41 25163 1 1 21 THR CG2 C 4.827 -6.659 -2.676 1.00 . A A . 21 THR CG2 1 1 41 25164 1 1 21 THR H H 1.453 -6.401 -3.724 1.00 . A A . 21 THR H 1 1 41 25165 1 1 21 THR HA H 2.998 -5.243 -1.699 1.00 . A A . 21 THR HA 1 1 41 25166 1 1 21 THR HB H 4.528 -5.079 -4.043 1.00 . A A . 21 THR HB 1 1 41 25167 1 1 21 THR HG1 H 3.301 -6.198 -5.365 1.00 . A A . 21 THR HG1 1 1 41 25168 1 1 21 THR HG21 H 4.239 -7.390 -2.142 1.00 . A A . 21 THR HG21 1 1 41 25169 1 1 21 THR HG22 H 5.552 -7.164 -3.297 1.00 . A A . 21 THR HG22 1 1 41 25170 1 1 21 THR HG23 H 5.339 -6.023 -1.970 1.00 . A A . 21 THR HG23 1 1 41 25171 1 1 21 THR N N 1.513 -5.680 -3.062 1.00 . A A . 21 THR N 1 1 41 25172 1 1 21 THR O O 2.077 -3.128 -3.901 1.00 . A A . 21 THR O 1 1 41 25173 1 1 21 THR OG1 O 3.358 -6.669 -4.531 1.00 . A A . 21 THR OG1 1 1 41 25174 1 1 22 CYS C C 5.261 -1.064 -2.964 1.00 . A A . 22 CYS C 1 1 41 25175 1 1 22 CYS CA C 3.835 -1.442 -2.577 1.00 . A A . 22 CYS CA 1 1 41 25176 1 1 22 CYS CB C 3.422 -0.694 -1.308 1.00 . A A . 22 CYS CB 1 1 41 25177 1 1 22 CYS H H 4.293 -3.324 -1.721 1.00 . A A . 22 CYS H 1 1 41 25178 1 1 22 CYS HA H 3.171 -1.163 -3.380 1.00 . A A . 22 CYS HA 1 1 41 25179 1 1 22 CYS HB2 H 3.623 0.359 -1.439 1.00 . A A . 22 CYS HB2 1 1 41 25180 1 1 22 CYS HB3 H 2.364 -0.836 -1.143 1.00 . A A . 22 CYS HB3 1 1 41 25181 1 1 22 CYS N N 3.714 -2.882 -2.377 1.00 . A A . 22 CYS N 1 1 41 25182 1 1 22 CYS O O 5.475 -0.248 -3.860 1.00 . A A . 22 CYS O 1 1 41 25183 1 1 22 CYS SG S 4.296 -1.239 0.195 1.00 . A A . 22 CYS SG 1 1 41 25184 1 1 23 TRP C C 8.427 -2.684 -2.704 1.00 . A A . 23 TRP C 1 1 41 25185 1 1 23 TRP CA C 7.638 -1.388 -2.555 1.00 . A A . 23 TRP CA 1 1 41 25186 1 1 23 TRP CB C 8.240 -0.536 -1.436 1.00 . A A . 23 TRP CB 1 1 41 25187 1 1 23 TRP CD1 C 10.159 0.426 -2.834 1.00 . A A . 23 TRP CD1 1 1 41 25188 1 1 23 TRP CD2 C 10.765 -0.260 -0.791 1.00 . A A . 23 TRP CD2 1 1 41 25189 1 1 23 TRP CE2 C 11.902 0.243 -1.451 1.00 . A A . 23 TRP CE2 1 1 41 25190 1 1 23 TRP CE3 C 10.902 -0.749 0.512 1.00 . A A . 23 TRP CE3 1 1 41 25191 1 1 23 TRP CG C 9.660 -0.133 -1.693 1.00 . A A . 23 TRP CG 1 1 41 25192 1 1 23 TRP CH2 C 13.264 -0.214 0.424 1.00 . A A . 23 TRP CH2 1 1 41 25193 1 1 23 TRP CZ2 C 13.159 0.270 -0.852 1.00 . A A . 23 TRP CZ2 1 1 41 25194 1 1 23 TRP CZ3 C 12.151 -0.721 1.105 1.00 . A A . 23 TRP CZ3 1 1 41 25195 1 1 23 TRP H H 5.999 -2.304 -1.579 1.00 . A A . 23 TRP H 1 1 41 25196 1 1 23 TRP HA H 7.695 -0.838 -3.483 1.00 . A A . 23 TRP HA 1 1 41 25197 1 1 23 TRP HB2 H 7.654 0.364 -1.322 1.00 . A A . 23 TRP HB2 1 1 41 25198 1 1 23 TRP HB3 H 8.213 -1.097 -0.513 1.00 . A A . 23 TRP HB3 1 1 41 25199 1 1 23 TRP HD1 H 9.569 0.649 -3.711 1.00 . A A . 23 TRP HD1 1 1 41 25200 1 1 23 TRP HE1 H 12.090 1.050 -3.378 1.00 . A A . 23 TRP HE1 1 1 41 25201 1 1 23 TRP HE3 H 10.055 -1.143 1.053 1.00 . A A . 23 TRP HE3 1 1 41 25202 1 1 23 TRP HH2 H 14.221 -0.213 0.926 1.00 . A A . 23 TRP HH2 1 1 41 25203 1 1 23 TRP HZ2 H 14.028 0.658 -1.363 1.00 . A A . 23 TRP HZ2 1 1 41 25204 1 1 23 TRP HZ3 H 12.276 -1.095 2.110 1.00 . A A . 23 TRP HZ3 1 1 41 25205 1 1 23 TRP N N 6.233 -1.662 -2.282 1.00 . A A . 23 TRP N 1 1 41 25206 1 1 23 TRP NE1 N 11.507 0.655 -2.696 1.00 . A A . 23 TRP NE1 1 1 41 25207 1 1 23 TRP O O 8.280 -3.608 -1.903 1.00 . A A . 23 TRP O 1 1 41 25208 1 1 24 ARG C C 11.032 -3.696 -5.154 1.00 . A A . 24 ARG C 1 1 41 25209 1 1 24 ARG CA C 10.078 -3.931 -3.987 1.00 . A A . 24 ARG CA 1 1 41 25210 1 1 24 ARG CB C 9.183 -5.136 -4.279 1.00 . A A . 24 ARG CB 1 1 41 25211 1 1 24 ARG CD C 7.046 -5.764 -5.442 1.00 . A A . 24 ARG CD 1 1 41 25212 1 1 24 ARG CG C 8.346 -4.982 -5.538 1.00 . A A . 24 ARG CG 1 1 41 25213 1 1 24 ARG CZ C 7.644 -7.948 -6.415 1.00 . A A . 24 ARG CZ 1 1 41 25214 1 1 24 ARG H H 9.339 -1.978 -4.337 1.00 . A A . 24 ARG H 1 1 41 25215 1 1 24 ARG HA H 10.658 -4.131 -3.098 1.00 . A A . 24 ARG HA 1 1 41 25216 1 1 24 ARG HB2 H 9.805 -6.013 -4.391 1.00 . A A . 24 ARG HB2 1 1 41 25217 1 1 24 ARG HB3 H 8.515 -5.284 -3.444 1.00 . A A . 24 ARG HB3 1 1 41 25218 1 1 24 ARG HD2 H 6.517 -5.452 -4.554 1.00 . A A . 24 ARG HD2 1 1 41 25219 1 1 24 ARG HD3 H 6.446 -5.547 -6.313 1.00 . A A . 24 ARG HD3 1 1 41 25220 1 1 24 ARG HE H 7.157 -7.642 -4.504 1.00 . A A . 24 ARG HE 1 1 41 25221 1 1 24 ARG HG2 H 8.115 -3.936 -5.679 1.00 . A A . 24 ARG HG2 1 1 41 25222 1 1 24 ARG HG3 H 8.913 -5.344 -6.383 1.00 . A A . 24 ARG HG3 1 1 41 25223 1 1 24 ARG HH11 H 7.677 -6.409 -7.727 1.00 . A A . 24 ARG HH11 1 1 41 25224 1 1 24 ARG HH12 H 8.093 -7.955 -8.387 1.00 . A A . 24 ARG HH12 1 1 41 25225 1 1 24 ARG HH21 H 7.704 -9.676 -5.370 1.00 . A A . 24 ARG HH21 1 1 41 25226 1 1 24 ARG HH22 H 8.108 -9.810 -7.049 1.00 . A A . 24 ARG HH22 1 1 41 25227 1 1 24 ARG N N 9.265 -2.747 -3.733 1.00 . A A . 24 ARG N 1 1 41 25228 1 1 24 ARG NE N 7.279 -7.205 -5.373 1.00 . A A . 24 ARG NE 1 1 41 25229 1 1 24 ARG NH1 N 7.819 -7.391 -7.607 1.00 . A A . 24 ARG NH1 1 1 41 25230 1 1 24 ARG NH2 N 7.834 -9.252 -6.266 1.00 . A A . 24 ARG NH2 1 1 41 25231 1 1 24 ARG O O 10.602 -3.473 -6.285 1.00 . A A . 24 ARG O 1 1 41 25232 1 1 25 THR C C 14.018 -4.860 -6.268 1.00 . A A . 25 THR C 1 1 41 25233 1 1 25 THR CA C 13.345 -3.543 -5.897 1.00 . A A . 25 THR CA 1 1 41 25234 1 1 25 THR CB C 14.393 -2.540 -5.412 1.00 . A A . 25 THR CB 1 1 41 25235 1 1 25 THR CG2 C 14.930 -2.855 -4.033 1.00 . A A . 25 THR CG2 1 1 41 25236 1 1 25 THR H H 12.611 -3.931 -3.950 1.00 . A A . 25 THR H 1 1 41 25237 1 1 25 THR HA H 12.855 -3.143 -6.772 1.00 . A A . 25 THR HA 1 1 41 25238 1 1 25 THR HB H 13.946 -1.557 -5.376 1.00 . A A . 25 THR HB 1 1 41 25239 1 1 25 THR HG1 H 15.179 -2.319 -7.192 1.00 . A A . 25 THR HG1 1 1 41 25240 1 1 25 THR HG21 H 15.029 -3.925 -3.921 1.00 . A A . 25 THR HG21 1 1 41 25241 1 1 25 THR HG22 H 15.897 -2.390 -3.908 1.00 . A A . 25 THR HG22 1 1 41 25242 1 1 25 THR HG23 H 14.249 -2.477 -3.286 1.00 . A A . 25 THR HG23 1 1 41 25243 1 1 25 THR N N 12.330 -3.749 -4.870 1.00 . A A . 25 THR N 1 1 41 25244 1 1 25 THR O O 14.409 -5.066 -7.417 1.00 . A A . 25 THR O 1 1 41 25245 1 1 25 THR OG1 O 15.494 -2.495 -6.303 1.00 . A A . 25 THR OG1 1 1 41 25246 1 1 26 SER C C 14.748 -7.890 -4.243 1.00 . A A . 26 SER C 1 1 41 25247 1 1 26 SER CA C 14.775 -7.047 -5.513 1.00 . A A . 26 SER CA 1 1 41 25248 1 1 26 SER CB C 16.218 -6.867 -5.989 1.00 . A A . 26 SER CB 1 1 41 25249 1 1 26 SER H H 13.817 -5.526 -4.394 1.00 . A A . 26 SER H 1 1 41 25250 1 1 26 SER HA H 14.214 -7.556 -6.279 1.00 . A A . 26 SER HA 1 1 41 25251 1 1 26 SER HB2 H 16.806 -7.718 -5.679 1.00 . A A . 26 SER HB2 1 1 41 25252 1 1 26 SER HB3 H 16.233 -6.793 -7.066 1.00 . A A . 26 SER HB3 1 1 41 25253 1 1 26 SER HG H 17.749 -5.735 -5.526 1.00 . A A . 26 SER HG 1 1 41 25254 1 1 26 SER N N 14.150 -5.748 -5.289 1.00 . A A . 26 SER N 1 1 41 25255 1 1 26 SER O O 14.524 -9.100 -4.293 1.00 . A A . 26 SER O 1 1 41 25256 1 1 26 SER OG O 16.793 -5.693 -5.443 1.00 . A A . 26 SER OG 1 1 41 25257 1 1 27 VAL C C 13.779 -7.523 -0.978 1.00 . A A . 27 VAL C 1 1 41 25258 1 1 27 VAL CA C 14.982 -7.931 -1.822 1.00 . A A . 27 VAL CA 1 1 41 25259 1 1 27 VAL CB C 16.271 -7.640 -1.031 1.00 . A A . 27 VAL CB 1 1 41 25260 1 1 27 VAL CG1 C 16.348 -8.517 0.209 1.00 . A A . 27 VAL CG1 1 1 41 25261 1 1 27 VAL CG2 C 17.495 -7.842 -1.912 1.00 . A A . 27 VAL CG2 1 1 41 25262 1 1 27 VAL H H 15.151 -6.280 -3.134 1.00 . A A . 27 VAL H 1 1 41 25263 1 1 27 VAL HA H 14.933 -8.994 -2.012 1.00 . A A . 27 VAL HA 1 1 41 25264 1 1 27 VAL HB H 16.249 -6.608 -0.714 1.00 . A A . 27 VAL HB 1 1 41 25265 1 1 27 VAL HG11 H 15.363 -8.616 0.641 1.00 . A A . 27 VAL HG11 1 1 41 25266 1 1 27 VAL HG12 H 16.722 -9.492 -0.062 1.00 . A A . 27 VAL HG12 1 1 41 25267 1 1 27 VAL HG13 H 17.012 -8.063 0.930 1.00 . A A . 27 VAL HG13 1 1 41 25268 1 1 27 VAL HG21 H 17.380 -7.273 -2.823 1.00 . A A . 27 VAL HG21 1 1 41 25269 1 1 27 VAL HG22 H 18.376 -7.506 -1.386 1.00 . A A . 27 VAL HG22 1 1 41 25270 1 1 27 VAL HG23 H 17.596 -8.890 -2.153 1.00 . A A . 27 VAL HG23 1 1 41 25271 1 1 27 VAL N N 14.979 -7.243 -3.107 1.00 . A A . 27 VAL N 1 1 41 25272 1 1 27 VAL O O 13.262 -8.317 -0.191 1.00 . A A . 27 VAL O 1 1 41 25273 1 1 28 SER C C 10.890 -6.345 -0.938 1.00 . A A . 28 SER C 1 1 41 25274 1 1 28 SER CA C 12.196 -5.768 -0.400 1.00 . A A . 28 SER CA 1 1 41 25275 1 1 28 SER CB C 12.158 -4.240 -0.471 1.00 . A A . 28 SER CB 1 1 41 25276 1 1 28 SER H H 13.792 -5.696 -1.788 1.00 . A A . 28 SER H 1 1 41 25277 1 1 28 SER HA H 12.311 -6.069 0.630 1.00 . A A . 28 SER HA 1 1 41 25278 1 1 28 SER HB2 H 13.167 -3.856 -0.453 1.00 . A A . 28 SER HB2 1 1 41 25279 1 1 28 SER HB3 H 11.674 -3.936 -1.387 1.00 . A A . 28 SER HB3 1 1 41 25280 1 1 28 SER HG H 10.553 -4.051 0.636 1.00 . A A . 28 SER HG 1 1 41 25281 1 1 28 SER N N 13.338 -6.281 -1.147 1.00 . A A . 28 SER N 1 1 41 25282 1 1 28 SER O O 10.776 -6.645 -2.127 1.00 . A A . 28 SER O 1 1 41 25283 1 1 28 SER OG O 11.445 -3.696 0.626 1.00 . A A . 28 SER OG 1 1 41 25284 1 1 29 SER C C 7.622 -6.961 0.717 1.00 . A A . 29 SER C 1 1 41 25285 1 1 29 SER CA C 8.611 -7.039 -0.442 1.00 . A A . 29 SER CA 1 1 41 25286 1 1 29 SER CB C 8.757 -8.489 -0.906 1.00 . A A . 29 SER CB 1 1 41 25287 1 1 29 SER H H 10.060 -6.240 0.878 1.00 . A A . 29 SER H 1 1 41 25288 1 1 29 SER HA H 8.234 -6.444 -1.261 1.00 . A A . 29 SER HA 1 1 41 25289 1 1 29 SER HB2 H 9.417 -8.526 -1.760 1.00 . A A . 29 SER HB2 1 1 41 25290 1 1 29 SER HB3 H 9.173 -9.081 -0.104 1.00 . A A . 29 SER HB3 1 1 41 25291 1 1 29 SER HG H 7.612 -9.961 -1.505 1.00 . A A . 29 SER HG 1 1 41 25292 1 1 29 SER N N 9.909 -6.498 -0.056 1.00 . A A . 29 SER N 1 1 41 25293 1 1 29 SER O O 7.682 -7.761 1.651 1.00 . A A . 29 SER O 1 1 41 25294 1 1 29 SER OG O 7.503 -9.036 -1.275 1.00 . A A . 29 SER OG 1 1 41 25295 1 1 30 HIS C C 4.317 -5.687 1.094 1.00 . A A . 30 HIS C 1 1 41 25296 1 1 30 HIS CA C 5.713 -5.811 1.695 1.00 . A A . 30 HIS CA 1 1 41 25297 1 1 30 HIS CB C 6.034 -4.569 2.528 1.00 . A A . 30 HIS CB 1 1 41 25298 1 1 30 HIS CD2 C 8.609 -4.544 2.209 1.00 . A A . 30 HIS CD2 1 1 41 25299 1 1 30 HIS CE1 C 9.188 -4.263 4.305 1.00 . A A . 30 HIS CE1 1 1 41 25300 1 1 30 HIS CG C 7.471 -4.480 2.941 1.00 . A A . 30 HIS CG 1 1 41 25301 1 1 30 HIS H H 6.718 -5.387 -0.119 1.00 . A A . 30 HIS H 1 1 41 25302 1 1 30 HIS HA H 5.740 -6.680 2.335 1.00 . A A . 30 HIS HA 1 1 41 25303 1 1 30 HIS HB2 H 5.800 -3.687 1.952 1.00 . A A . 30 HIS HB2 1 1 41 25304 1 1 30 HIS HB3 H 5.430 -4.579 3.423 1.00 . A A . 30 HIS HB3 1 1 41 25305 1 1 30 HIS HD1 H 7.272 -4.222 5.023 1.00 . A A . 30 HIS HD1 1 1 41 25306 1 1 30 HIS HD2 H 8.676 -4.678 1.138 1.00 . A A . 30 HIS HD2 1 1 41 25307 1 1 30 HIS HE1 H 9.779 -4.135 5.199 1.00 . A A . 30 HIS HE1 1 1 41 25308 1 1 30 HIS HE2 H 10.604 -4.326 2.826 1.00 . A A . 30 HIS HE2 1 1 41 25309 1 1 30 HIS N N 6.714 -5.993 0.650 1.00 . A A . 30 HIS N 1 1 41 25310 1 1 30 HIS ND1 N 7.869 -4.304 4.249 1.00 . A A . 30 HIS ND1 1 1 41 25311 1 1 30 HIS NE2 N 9.661 -4.406 3.081 1.00 . A A . 30 HIS NE2 1 1 41 25312 1 1 30 HIS O O 4.074 -4.842 0.232 1.00 . A A . 30 HIS O 1 1 41 25313 1 1 31 TYR C C 1.129 -5.704 1.986 1.00 . A A . 31 TYR C 1 1 41 25314 1 1 31 TYR CA C 2.029 -6.518 1.062 1.00 . A A . 31 TYR CA 1 1 41 25315 1 1 31 TYR CB C 1.494 -7.945 0.938 1.00 . A A . 31 TYR CB 1 1 41 25316 1 1 31 TYR CD1 C 3.209 -9.685 0.301 1.00 . A A . 31 TYR CD1 1 1 41 25317 1 1 31 TYR CD2 C 1.940 -8.665 -1.441 1.00 . A A . 31 TYR CD2 1 1 41 25318 1 1 31 TYR CE1 C 3.883 -10.450 -0.632 1.00 . A A . 31 TYR CE1 1 1 41 25319 1 1 31 TYR CE2 C 2.609 -9.427 -2.380 1.00 . A A . 31 TYR CE2 1 1 41 25320 1 1 31 TYR CG C 2.228 -8.781 -0.086 1.00 . A A . 31 TYR CG 1 1 41 25321 1 1 31 TYR CZ C 3.579 -10.318 -1.970 1.00 . A A . 31 TYR CZ 1 1 41 25322 1 1 31 TYR H H 3.656 -7.184 2.242 1.00 . A A . 31 TYR H 1 1 41 25323 1 1 31 TYR HA H 2.033 -6.058 0.086 1.00 . A A . 31 TYR HA 1 1 41 25324 1 1 31 TYR HB2 H 1.582 -8.440 1.893 1.00 . A A . 31 TYR HB2 1 1 41 25325 1 1 31 TYR HB3 H 0.452 -7.908 0.652 1.00 . A A . 31 TYR HB3 1 1 41 25326 1 1 31 TYR HD1 H 3.444 -9.787 1.350 1.00 . A A . 31 TYR HD1 1 1 41 25327 1 1 31 TYR HD2 H 1.181 -7.966 -1.758 1.00 . A A . 31 TYR HD2 1 1 41 25328 1 1 31 TYR HE1 H 4.642 -11.148 -0.311 1.00 . A A . 31 TYR HE1 1 1 41 25329 1 1 31 TYR HE2 H 2.371 -9.323 -3.428 1.00 . A A . 31 TYR HE2 1 1 41 25330 1 1 31 TYR HH H 3.612 -11.511 -3.478 1.00 . A A . 31 TYR HH 1 1 41 25331 1 1 31 TYR N N 3.402 -6.534 1.554 1.00 . A A . 31 TYR N 1 1 41 25332 1 1 31 TYR O O 1.222 -5.809 3.209 1.00 . A A . 31 TYR O 1 1 41 25333 1 1 31 TYR OH O 4.247 -11.078 -2.902 1.00 . A A . 31 TYR OH 1 1 41 25334 1 1 32 CYS C C -1.769 -4.901 2.781 1.00 . A A . 32 CYS C 1 1 41 25335 1 1 32 CYS CA C -0.656 -4.059 2.164 1.00 . A A . 32 CYS CA 1 1 41 25336 1 1 32 CYS CB C -1.254 -2.966 1.274 1.00 . A A . 32 CYS CB 1 1 41 25337 1 1 32 CYS H H 0.235 -4.852 0.414 1.00 . A A . 32 CYS H 1 1 41 25338 1 1 32 CYS HA H -0.091 -3.595 2.958 1.00 . A A . 32 CYS HA 1 1 41 25339 1 1 32 CYS HB2 H -0.927 -3.121 0.257 1.00 . A A . 32 CYS HB2 1 1 41 25340 1 1 32 CYS HB3 H -2.332 -3.027 1.313 1.00 . A A . 32 CYS HB3 1 1 41 25341 1 1 32 CYS N N 0.260 -4.892 1.393 1.00 . A A . 32 CYS N 1 1 41 25342 1 1 32 CYS O O -1.897 -6.089 2.487 1.00 . A A . 32 CYS O 1 1 41 25343 1 1 32 CYS SG S -0.776 -1.274 1.756 1.00 . A A . 32 CYS SG 1 1 41 25344 1 1 33 THR C C -5.024 -4.436 3.822 1.00 . A A . 33 THR C 1 1 41 25345 1 1 33 THR CA C -3.673 -4.968 4.297 1.00 . A A . 33 THR CA 1 1 41 25346 1 1 33 THR CB C -3.557 -4.817 5.815 1.00 . A A . 33 THR CB 1 1 41 25347 1 1 33 THR CG2 C -3.317 -3.389 6.257 1.00 . A A . 33 THR CG2 1 1 41 25348 1 1 33 THR H H -2.417 -3.328 3.832 1.00 . A A . 33 THR H 1 1 41 25349 1 1 33 THR HA H -3.604 -6.016 4.044 1.00 . A A . 33 THR HA 1 1 41 25350 1 1 33 THR HB H -2.727 -5.414 6.163 1.00 . A A . 33 THR HB 1 1 41 25351 1 1 33 THR HG1 H -5.456 -4.670 6.271 1.00 . A A . 33 THR HG1 1 1 41 25352 1 1 33 THR HG21 H -4.014 -2.735 5.755 1.00 . A A . 33 THR HG21 1 1 41 25353 1 1 33 THR HG22 H -3.459 -3.314 7.325 1.00 . A A . 33 THR HG22 1 1 41 25354 1 1 33 THR HG23 H -2.307 -3.099 6.006 1.00 . A A . 33 THR HG23 1 1 41 25355 1 1 33 THR N N -2.571 -4.276 3.638 1.00 . A A . 33 THR N 1 1 41 25356 1 1 33 THR O O -6.051 -4.670 4.459 1.00 . A A . 33 THR O 1 1 41 25357 1 1 33 THR OG1 O -4.734 -5.274 6.458 1.00 . A A . 33 THR OG1 1 1 41 25358 1 1 34 GLY C C -7.017 -2.343 3.180 1.00 . A A . 34 GLY C 1 1 41 25359 1 1 34 GLY CA C -6.254 -3.171 2.164 1.00 . A A . 34 GLY CA 1 1 41 25360 1 1 34 GLY H H -4.175 -3.565 2.230 1.00 . A A . 34 GLY H 1 1 41 25361 1 1 34 GLY HA2 H -6.883 -3.985 1.835 1.00 . A A . 34 GLY HA2 1 1 41 25362 1 1 34 GLY HA3 H -6.017 -2.548 1.314 1.00 . A A . 34 GLY HA3 1 1 41 25363 1 1 34 GLY N N -5.020 -3.720 2.699 1.00 . A A . 34 GLY N 1 1 41 25364 1 1 34 GLY O O -8.234 -2.187 3.075 1.00 . A A . 34 GLY O 1 1 41 25365 1 1 35 ARG C C -6.493 0.465 5.078 1.00 . A A . 35 ARG C 1 1 41 25366 1 1 35 ARG CA C -6.922 -0.993 5.204 1.00 . A A . 35 ARG CA 1 1 41 25367 1 1 35 ARG CB C -6.554 -1.527 6.590 1.00 . A A . 35 ARG CB 1 1 41 25368 1 1 35 ARG CD C -8.742 -2.617 7.187 1.00 . A A . 35 ARG CD 1 1 41 25369 1 1 35 ARG CG C -7.255 -2.828 6.948 1.00 . A A . 35 ARG CG 1 1 41 25370 1 1 35 ARG CZ C -9.078 -0.834 8.861 1.00 . A A . 35 ARG CZ 1 1 41 25371 1 1 35 ARG H H -5.336 -1.969 4.197 1.00 . A A . 35 ARG H 1 1 41 25372 1 1 35 ARG HA H -7.992 -1.053 5.078 1.00 . A A . 35 ARG HA 1 1 41 25373 1 1 35 ARG HB2 H -5.488 -1.696 6.626 1.00 . A A . 35 ARG HB2 1 1 41 25374 1 1 35 ARG HB3 H -6.816 -0.786 7.330 1.00 . A A . 35 ARG HB3 1 1 41 25375 1 1 35 ARG HD2 H -9.113 -1.902 6.469 1.00 . A A . 35 ARG HD2 1 1 41 25376 1 1 35 ARG HD3 H -9.251 -3.560 7.049 1.00 . A A . 35 ARG HD3 1 1 41 25377 1 1 35 ARG HE H -9.167 -2.791 9.237 1.00 . A A . 35 ARG HE 1 1 41 25378 1 1 35 ARG HG2 H -7.128 -3.529 6.137 1.00 . A A . 35 ARG HG2 1 1 41 25379 1 1 35 ARG HG3 H -6.808 -3.230 7.846 1.00 . A A . 35 ARG HG3 1 1 41 25380 1 1 35 ARG HH11 H -8.677 -0.153 6.998 1.00 . A A . 35 ARG HH11 1 1 41 25381 1 1 35 ARG HH12 H -8.926 1.070 8.197 1.00 . A A . 35 ARG HH12 1 1 41 25382 1 1 35 ARG HH21 H -9.491 -1.180 10.809 1.00 . A A . 35 ARG HH21 1 1 41 25383 1 1 35 ARG HH22 H -9.385 0.489 10.358 1.00 . A A . 35 ARG HH22 1 1 41 25384 1 1 35 ARG N N -6.302 -1.810 4.166 1.00 . A A . 35 ARG N 1 1 41 25385 1 1 35 ARG NE N -9.017 -2.124 8.535 1.00 . A A . 35 ARG NE 1 1 41 25386 1 1 35 ARG NH1 N -8.877 0.104 7.943 1.00 . A A . 35 ARG NH1 1 1 41 25387 1 1 35 ARG NH2 N -9.340 -0.479 10.112 1.00 . A A . 35 ARG NH2 1 1 41 25388 1 1 35 ARG O O -7.261 1.377 5.383 1.00 . A A . 35 ARG O 1 1 41 25389 1 1 36 SER C C -3.830 2.104 3.230 1.00 . A A . 36 SER C 1 1 41 25390 1 1 36 SER CA C -4.728 2.023 4.460 1.00 . A A . 36 SER CA 1 1 41 25391 1 1 36 SER CB C -3.945 2.443 5.705 1.00 . A A . 36 SER CB 1 1 41 25392 1 1 36 SER H H -4.696 -0.092 4.401 1.00 . A A . 36 SER H 1 1 41 25393 1 1 36 SER HA H -5.561 2.696 4.326 1.00 . A A . 36 SER HA 1 1 41 25394 1 1 36 SER HB2 H -3.437 1.582 6.115 1.00 . A A . 36 SER HB2 1 1 41 25395 1 1 36 SER HB3 H -3.217 3.194 5.434 1.00 . A A . 36 SER HB3 1 1 41 25396 1 1 36 SER HG H -4.889 3.926 6.569 1.00 . A A . 36 SER HG 1 1 41 25397 1 1 36 SER N N -5.261 0.676 4.627 1.00 . A A . 36 SER N 1 1 41 25398 1 1 36 SER O O -3.530 1.089 2.600 1.00 . A A . 36 SER O 1 1 41 25399 1 1 36 SER OG O -4.807 2.978 6.694 1.00 . A A . 36 SER OG 1 1 41 25400 1 1 37 CYS C C -1.092 3.763 2.172 1.00 . A A . 37 CYS C 1 1 41 25401 1 1 37 CYS CA C -2.537 3.528 1.740 1.00 . A A . 37 CYS CA 1 1 41 25402 1 1 37 CYS CB C -3.033 4.717 0.914 1.00 . A A . 37 CYS CB 1 1 41 25403 1 1 37 CYS H H -3.674 4.085 3.436 1.00 . A A . 37 CYS H 1 1 41 25404 1 1 37 CYS HA H -2.577 2.639 1.130 1.00 . A A . 37 CYS HA 1 1 41 25405 1 1 37 CYS HB2 H -4.091 4.604 0.733 1.00 . A A . 37 CYS HB2 1 1 41 25406 1 1 37 CYS HB3 H -2.863 5.627 1.470 1.00 . A A . 37 CYS HB3 1 1 41 25407 1 1 37 CYS N N -3.403 3.316 2.894 1.00 . A A . 37 CYS N 1 1 41 25408 1 1 37 CYS O O -0.276 4.260 1.396 1.00 . A A . 37 CYS O 1 1 41 25409 1 1 37 CYS SG S -2.210 4.891 -0.702 1.00 . A A . 37 CYS SG 1 1 41 25410 1 1 38 GLU C C 1.134 2.245 4.433 1.00 . A A . 38 GLU C 1 1 41 25411 1 1 38 GLU CA C 0.569 3.574 3.944 1.00 . A A . 38 GLU CA 1 1 41 25412 1 1 38 GLU CB C 0.564 4.591 5.086 1.00 . A A . 38 GLU CB 1 1 41 25413 1 1 38 GLU CD C 1.913 6.475 6.092 1.00 . A A . 38 GLU CD 1 1 41 25414 1 1 38 GLU CG C 1.949 5.102 5.452 1.00 . A A . 38 GLU CG 1 1 41 25415 1 1 38 GLU H H -1.470 3.011 3.988 1.00 . A A . 38 GLU H 1 1 41 25416 1 1 38 GLU HA H 1.194 3.946 3.145 1.00 . A A . 38 GLU HA 1 1 41 25417 1 1 38 GLU HB2 H -0.043 5.437 4.798 1.00 . A A . 38 GLU HB2 1 1 41 25418 1 1 38 GLU HB3 H 0.131 4.130 5.962 1.00 . A A . 38 GLU HB3 1 1 41 25419 1 1 38 GLU HG2 H 2.402 4.410 6.146 1.00 . A A . 38 GLU HG2 1 1 41 25420 1 1 38 GLU HG3 H 2.547 5.154 4.554 1.00 . A A . 38 GLU HG3 1 1 41 25421 1 1 38 GLU N N -0.779 3.402 3.414 1.00 . A A . 38 GLU N 1 1 41 25422 1 1 38 GLU O O 0.758 1.753 5.497 1.00 . A A . 38 GLU O 1 1 41 25423 1 1 38 GLU OE1 O 1.060 6.696 6.978 1.00 . A A . 38 GLU OE1 1 1 41 25424 1 1 38 GLU OE2 O 2.738 7.331 5.709 1.00 . A A . 38 GLU OE2 1 1 41 25425 1 1 39 CYS C C 3.390 0.495 5.337 1.00 . A A . 39 CYS C 1 1 41 25426 1 1 39 CYS CA C 2.655 0.394 4.002 1.00 . A A . 39 CYS CA 1 1 41 25427 1 1 39 CYS CB C 3.625 -0.048 2.904 1.00 . A A . 39 CYS CB 1 1 41 25428 1 1 39 CYS H H 2.297 2.108 2.812 1.00 . A A . 39 CYS H 1 1 41 25429 1 1 39 CYS HA H 1.869 -0.341 4.092 1.00 . A A . 39 CYS HA 1 1 41 25430 1 1 39 CYS HB2 H 4.008 0.826 2.399 1.00 . A A . 39 CYS HB2 1 1 41 25431 1 1 39 CYS HB3 H 4.447 -0.585 3.356 1.00 . A A . 39 CYS HB3 1 1 41 25432 1 1 39 CYS N N 2.038 1.667 3.649 1.00 . A A . 39 CYS N 1 1 41 25433 1 1 39 CYS O O 3.916 1.551 5.686 1.00 . A A . 39 CYS O 1 1 41 25434 1 1 39 CYS SG S 2.879 -1.133 1.645 1.00 . A A . 39 CYS SG 1 1 41 25435 1 1 40 PRO C C 5.628 -0.588 7.272 1.00 . A A . 40 PRO C 1 1 41 25436 1 1 40 PRO CA C 4.110 -0.639 7.405 1.00 . A A . 40 PRO CA 1 1 41 25437 1 1 40 PRO CB C 3.670 -1.977 8.001 1.00 . A A . 40 PRO CB 1 1 41 25438 1 1 40 PRO CD C 2.833 -1.912 5.762 1.00 . A A . 40 PRO CD 1 1 41 25439 1 1 40 PRO CG C 3.371 -2.835 6.821 1.00 . A A . 40 PRO CG 1 1 41 25440 1 1 40 PRO HA H 3.778 0.169 8.041 1.00 . A A . 40 PRO HA 1 1 41 25441 1 1 40 PRO HB2 H 4.471 -2.389 8.598 1.00 . A A . 40 PRO HB2 1 1 41 25442 1 1 40 PRO HB3 H 2.794 -1.831 8.614 1.00 . A A . 40 PRO HB3 1 1 41 25443 1 1 40 PRO HD2 H 3.150 -2.238 4.782 1.00 . A A . 40 PRO HD2 1 1 41 25444 1 1 40 PRO HD3 H 1.756 -1.864 5.815 1.00 . A A . 40 PRO HD3 1 1 41 25445 1 1 40 PRO HG2 H 4.276 -3.314 6.477 1.00 . A A . 40 PRO HG2 1 1 41 25446 1 1 40 PRO HG3 H 2.630 -3.575 7.084 1.00 . A A . 40 PRO HG3 1 1 41 25447 1 1 40 PRO N N 3.435 -0.609 6.103 1.00 . A A . 40 PRO N 1 1 41 25448 1 1 40 PRO O O 6.164 -0.573 6.163 1.00 . A A . 40 PRO O 1 1 41 25449 1 1 41 SER C C 8.364 -1.916 8.472 1.00 . A A . 41 SER C 1 1 41 25450 1 1 41 SER CA C 7.773 -0.511 8.419 1.00 . A A . 41 SER CA 1 1 41 25451 1 1 41 SER CB C 8.268 0.308 9.612 1.00 . A A . 41 SER CB 1 1 41 25452 1 1 41 SER H H 5.831 -0.574 9.260 1.00 . A A . 41 SER H 1 1 41 25453 1 1 41 SER HA H 8.095 -0.032 7.507 1.00 . A A . 41 SER HA 1 1 41 25454 1 1 41 SER HB2 H 7.796 -0.053 10.514 1.00 . A A . 41 SER HB2 1 1 41 25455 1 1 41 SER HB3 H 9.339 0.203 9.699 1.00 . A A . 41 SER HB3 1 1 41 25456 1 1 41 SER HG H 7.629 2.034 10.285 1.00 . A A . 41 SER HG 1 1 41 25457 1 1 41 SER N N 6.316 -0.560 8.408 1.00 . A A . 41 SER N 1 1 41 25458 1 1 41 SER O O 9.444 -2.166 7.936 1.00 . A A . 41 SER O 1 1 41 25459 1 1 41 SER OG O 7.955 1.681 9.454 1.00 . A A . 41 SER OG 1 1 41 25460 1 1 42 TYR C C 7.829 -4.990 7.962 1.00 . A A . 42 TYR C 1 1 41 25461 1 1 42 TYR CA C 8.105 -4.209 9.245 1.00 . A A . 42 TYR CA 1 1 41 25462 1 1 42 TYR CB C 7.416 -4.891 10.429 1.00 . A A . 42 TYR CB 1 1 41 25463 1 1 42 TYR CD1 C 5.296 -3.729 11.158 1.00 . A A . 42 TYR CD1 1 1 41 25464 1 1 42 TYR CD2 C 5.107 -5.599 9.691 1.00 . A A . 42 TYR CD2 1 1 41 25465 1 1 42 TYR CE1 C 3.922 -3.585 11.158 1.00 . A A . 42 TYR CE1 1 1 41 25466 1 1 42 TYR CE2 C 3.732 -5.461 9.686 1.00 . A A . 42 TYR CE2 1 1 41 25467 1 1 42 TYR CG C 5.912 -4.737 10.426 1.00 . A A . 42 TYR CG 1 1 41 25468 1 1 42 TYR CZ C 3.145 -4.453 10.421 1.00 . A A . 42 TYR CZ 1 1 41 25469 1 1 42 TYR H H 6.798 -2.568 9.529 1.00 . A A . 42 TYR H 1 1 41 25470 1 1 42 TYR HA H 9.170 -4.193 9.421 1.00 . A A . 42 TYR HA 1 1 41 25471 1 1 42 TYR HB2 H 7.640 -5.947 10.407 1.00 . A A . 42 TYR HB2 1 1 41 25472 1 1 42 TYR HB3 H 7.792 -4.467 11.348 1.00 . A A . 42 TYR HB3 1 1 41 25473 1 1 42 TYR HD1 H 5.908 -3.050 11.734 1.00 . A A . 42 TYR HD1 1 1 41 25474 1 1 42 TYR HD2 H 5.570 -6.388 9.117 1.00 . A A . 42 TYR HD2 1 1 41 25475 1 1 42 TYR HE1 H 3.462 -2.795 11.733 1.00 . A A . 42 TYR HE1 1 1 41 25476 1 1 42 TYR HE2 H 3.124 -6.141 9.109 1.00 . A A . 42 TYR HE2 1 1 41 25477 1 1 42 TYR HH H 1.499 -3.890 9.602 1.00 . A A . 42 TYR HH 1 1 41 25478 1 1 42 TYR N N 7.650 -2.829 9.122 1.00 . A A . 42 TYR N 1 1 41 25479 1 1 42 TYR O O 6.919 -4.653 7.205 1.00 . A A . 42 TYR O 1 1 41 25480 1 1 42 TYR OH O 1.776 -4.312 10.418 1.00 . A A . 42 TYR OH 1 1 41 25481 1 1 43 PRO C C 7.020 -7.372 6.332 1.00 . A A . 43 PRO C 1 1 41 25482 1 1 43 PRO CA C 8.453 -6.878 6.503 1.00 . A A . 43 PRO CA 1 1 41 25483 1 1 43 PRO CB C 9.398 -8.055 6.753 1.00 . A A . 43 PRO CB 1 1 41 25484 1 1 43 PRO CD C 9.725 -6.518 8.553 1.00 . A A . 43 PRO CD 1 1 41 25485 1 1 43 PRO CG C 10.431 -7.521 7.684 1.00 . A A . 43 PRO CG 1 1 41 25486 1 1 43 PRO HA H 8.758 -6.349 5.612 1.00 . A A . 43 PRO HA 1 1 41 25487 1 1 43 PRO HB2 H 8.849 -8.873 7.197 1.00 . A A . 43 PRO HB2 1 1 41 25488 1 1 43 PRO HB3 H 9.836 -8.373 5.819 1.00 . A A . 43 PRO HB3 1 1 41 25489 1 1 43 PRO HD2 H 9.350 -6.993 9.448 1.00 . A A . 43 PRO HD2 1 1 41 25490 1 1 43 PRO HD3 H 10.388 -5.704 8.806 1.00 . A A . 43 PRO HD3 1 1 41 25491 1 1 43 PRO HG2 H 10.832 -8.323 8.285 1.00 . A A . 43 PRO HG2 1 1 41 25492 1 1 43 PRO HG3 H 11.218 -7.042 7.122 1.00 . A A . 43 PRO HG3 1 1 41 25493 1 1 43 PRO N N 8.616 -6.048 7.702 1.00 . A A . 43 PRO N 1 1 41 25494 1 1 43 PRO O O 6.280 -7.508 7.306 1.00 . A A . 43 PRO O 1 1 41 25495 1 1 44 GLY C C 5.167 -9.616 4.966 1.00 . A A . 44 GLY C 1 1 41 25496 1 1 44 GLY CA C 5.293 -8.113 4.812 1.00 . A A . 44 GLY CA 1 1 41 25497 1 1 44 GLY H H 7.269 -7.510 4.351 1.00 . A A . 44 GLY H 1 1 41 25498 1 1 44 GLY HA2 H 5.028 -7.843 3.801 1.00 . A A . 44 GLY HA2 1 1 41 25499 1 1 44 GLY HA3 H 4.606 -7.634 5.494 1.00 . A A . 44 GLY HA3 1 1 41 25500 1 1 44 GLY N N 6.636 -7.638 5.088 1.00 . A A . 44 GLY N 1 1 41 25501 1 1 44 GLY O O 6.188 -10.318 4.801 1.00 . A A . 44 GLY O 1 1 41 25502 1 1 44 GLY OXT O 4.048 -10.092 5.252 1.00 . A A . 44 GLY OXT 1 1 42 25503 1 1 1 ALA C C -12.001 7.236 5.340 1.00 . A A . 1 ALA C 1 1 42 25504 1 1 1 ALA CA C -12.111 5.814 5.879 1.00 . A A . 1 ALA CA 1 1 42 25505 1 1 1 ALA CB C -11.860 5.798 7.379 1.00 . A A . 1 ALA CB 1 1 42 25506 1 1 1 ALA H1 H -10.257 5.413 5.084 1.00 . A A . 1 ALA H1 1 1 42 25507 1 1 1 ALA H2 H -11.045 4.058 5.778 1.00 . A A . 1 ALA H2 1 1 42 25508 1 1 1 ALA H3 H -11.566 4.668 4.261 1.00 . A A . 1 ALA H3 1 1 42 25509 1 1 1 ALA HA H -13.114 5.451 5.704 1.00 . A A . 1 ALA HA 1 1 42 25510 1 1 1 ALA HB1 H -10.996 6.406 7.606 1.00 . A A . 1 ALA HB1 1 1 42 25511 1 1 1 ALA HB2 H -12.723 6.195 7.893 1.00 . A A . 1 ALA HB2 1 1 42 25512 1 1 1 ALA HB3 H -11.682 4.784 7.704 1.00 . A A . 1 ALA HB3 1 1 42 25513 1 1 1 ALA N N -11.159 4.906 5.188 1.00 . A A . 1 ALA N 1 1 42 25514 1 1 1 ALA O O -11.284 8.068 5.896 1.00 . A A . 1 ALA O 1 1 42 25515 1 1 2 MET C C -11.291 9.203 3.188 1.00 . A A . 2 MET C 1 1 42 25516 1 1 2 MET CA C -12.699 8.830 3.638 1.00 . A A . 2 MET CA 1 1 42 25517 1 1 2 MET CB C -13.228 9.879 4.619 1.00 . A A . 2 MET CB 1 1 42 25518 1 1 2 MET CE C -15.163 9.747 7.442 1.00 . A A . 2 MET CE 1 1 42 25519 1 1 2 MET CG C -14.745 9.918 4.708 1.00 . A A . 2 MET CG 1 1 42 25520 1 1 2 MET H H -13.269 6.803 3.855 1.00 . A A . 2 MET H 1 1 42 25521 1 1 2 MET HA H -13.345 8.802 2.773 1.00 . A A . 2 MET HA 1 1 42 25522 1 1 2 MET HB2 H -12.837 9.665 5.602 1.00 . A A . 2 MET HB2 1 1 42 25523 1 1 2 MET HB3 H -12.882 10.853 4.307 1.00 . A A . 2 MET HB3 1 1 42 25524 1 1 2 MET HE1 H -14.923 8.771 7.047 1.00 . A A . 2 MET HE1 1 1 42 25525 1 1 2 MET HE2 H -14.373 10.073 8.102 1.00 . A A . 2 MET HE2 1 1 42 25526 1 1 2 MET HE3 H -16.092 9.694 7.991 1.00 . A A . 2 MET HE3 1 1 42 25527 1 1 2 MET HG2 H -15.135 10.336 3.792 1.00 . A A . 2 MET HG2 1 1 42 25528 1 1 2 MET HG3 H -15.111 8.909 4.826 1.00 . A A . 2 MET HG3 1 1 42 25529 1 1 2 MET N N -12.717 7.508 4.253 1.00 . A A . 2 MET N 1 1 42 25530 1 1 2 MET O O -10.348 8.431 3.363 1.00 . A A . 2 MET O 1 1 42 25531 1 1 2 MET SD S -15.334 10.912 6.092 1.00 . A A . 2 MET SD 1 1 42 25532 1 1 3 ASP C C -9.296 9.932 1.068 1.00 . A A . 3 ASP C 1 1 42 25533 1 1 3 ASP CA C -9.861 10.866 2.133 1.00 . A A . 3 ASP CA 1 1 42 25534 1 1 3 ASP CB C -8.877 10.982 3.299 1.00 . A A . 3 ASP CB 1 1 42 25535 1 1 3 ASP CG C -8.959 12.327 3.994 1.00 . A A . 3 ASP CG 1 1 42 25536 1 1 3 ASP H H -11.944 10.962 2.497 1.00 . A A . 3 ASP H 1 1 42 25537 1 1 3 ASP HA H -10.006 11.843 1.698 1.00 . A A . 3 ASP HA 1 1 42 25538 1 1 3 ASP HB2 H -9.094 10.211 4.023 1.00 . A A . 3 ASP HB2 1 1 42 25539 1 1 3 ASP HB3 H -7.871 10.849 2.928 1.00 . A A . 3 ASP HB3 1 1 42 25540 1 1 3 ASP N N -11.155 10.391 2.608 1.00 . A A . 3 ASP N 1 1 42 25541 1 1 3 ASP O O -9.698 8.773 0.967 1.00 . A A . 3 ASP O 1 1 42 25542 1 1 3 ASP OD1 O -7.942 12.758 4.575 1.00 . A A . 3 ASP OD1 1 1 42 25543 1 1 3 ASP OD2 O -10.041 12.950 3.955 1.00 . A A . 3 ASP OD2 1 1 42 25544 1 1 4 CYS C C -6.360 9.166 -0.361 1.00 . A A . 4 CYS C 1 1 42 25545 1 1 4 CYS CA C -7.741 9.657 -0.785 1.00 . A A . 4 CYS CA 1 1 42 25546 1 1 4 CYS CB C -7.628 10.485 -2.066 1.00 . A A . 4 CYS CB 1 1 42 25547 1 1 4 CYS H H -8.082 11.376 0.403 1.00 . A A . 4 CYS H 1 1 42 25548 1 1 4 CYS HA H -8.372 8.802 -0.974 1.00 . A A . 4 CYS HA 1 1 42 25549 1 1 4 CYS HB2 H -7.361 11.499 -1.809 1.00 . A A . 4 CYS HB2 1 1 42 25550 1 1 4 CYS HB3 H -6.855 10.062 -2.691 1.00 . A A . 4 CYS HB3 1 1 42 25551 1 1 4 CYS N N -8.361 10.445 0.274 1.00 . A A . 4 CYS N 1 1 42 25552 1 1 4 CYS O O -5.910 8.106 -0.795 1.00 . A A . 4 CYS O 1 1 42 25553 1 1 4 CYS SG S -9.162 10.549 -3.048 1.00 . A A . 4 CYS SG 1 1 42 25554 1 1 5 THR C C -3.469 9.080 -0.150 1.00 . A A . 5 THR C 1 1 42 25555 1 1 5 THR CA C -4.358 9.603 0.977 1.00 . A A . 5 THR CA 1 1 42 25556 1 1 5 THR CB C -4.449 8.565 2.100 1.00 . A A . 5 THR CB 1 1 42 25557 1 1 5 THR CG2 C -5.265 7.345 1.731 1.00 . A A . 5 THR CG2 1 1 42 25558 1 1 5 THR H H -6.109 10.781 0.792 1.00 . A A . 5 THR H 1 1 42 25559 1 1 5 THR HA H -3.913 10.504 1.374 1.00 . A A . 5 THR HA 1 1 42 25560 1 1 5 THR HB H -4.913 9.024 2.962 1.00 . A A . 5 THR HB 1 1 42 25561 1 1 5 THR HG1 H -3.201 7.713 3.344 1.00 . A A . 5 THR HG1 1 1 42 25562 1 1 5 THR HG21 H -4.890 6.926 0.809 1.00 . A A . 5 THR HG21 1 1 42 25563 1 1 5 THR HG22 H -5.189 6.610 2.518 1.00 . A A . 5 THR HG22 1 1 42 25564 1 1 5 THR HG23 H -6.299 7.629 1.602 1.00 . A A . 5 THR HG23 1 1 42 25565 1 1 5 THR N N -5.693 9.948 0.487 1.00 . A A . 5 THR N 1 1 42 25566 1 1 5 THR O O -3.150 7.893 -0.204 1.00 . A A . 5 THR O 1 1 42 25567 1 1 5 THR OG1 O -3.159 8.120 2.476 1.00 . A A . 5 THR OG1 1 1 42 25568 1 1 6 THR C C -0.961 8.895 -1.704 1.00 . A A . 6 THR C 1 1 42 25569 1 1 6 THR CA C -2.224 9.610 -2.177 1.00 . A A . 6 THR CA 1 1 42 25570 1 1 6 THR CB C -1.846 10.853 -2.983 1.00 . A A . 6 THR CB 1 1 42 25571 1 1 6 THR CG2 C -3.030 11.511 -3.659 1.00 . A A . 6 THR CG2 1 1 42 25572 1 1 6 THR H H -3.362 10.909 -0.952 1.00 . A A . 6 THR H 1 1 42 25573 1 1 6 THR HA H -2.786 8.939 -2.810 1.00 . A A . 6 THR HA 1 1 42 25574 1 1 6 THR HB H -1.141 10.571 -3.752 1.00 . A A . 6 THR HB 1 1 42 25575 1 1 6 THR HG1 H -1.872 12.149 -1.515 1.00 . A A . 6 THR HG1 1 1 42 25576 1 1 6 THR HG21 H -3.732 10.753 -3.972 1.00 . A A . 6 THR HG21 1 1 42 25577 1 1 6 THR HG22 H -3.512 12.184 -2.965 1.00 . A A . 6 THR HG22 1 1 42 25578 1 1 6 THR HG23 H -2.690 12.066 -4.521 1.00 . A A . 6 THR HG23 1 1 42 25579 1 1 6 THR N N -3.074 9.977 -1.049 1.00 . A A . 6 THR N 1 1 42 25580 1 1 6 THR O O -0.107 9.491 -1.048 1.00 . A A . 6 THR O 1 1 42 25581 1 1 6 THR OG1 O -1.233 11.822 -2.152 1.00 . A A . 6 THR OG1 1 1 42 25582 1 1 7 GLY C C 0.470 5.573 -2.465 1.00 . A A . 7 GLY C 1 1 42 25583 1 1 7 GLY CA C 0.307 6.838 -1.643 1.00 . A A . 7 GLY CA 1 1 42 25584 1 1 7 GLY H H -1.565 7.192 -2.565 1.00 . A A . 7 GLY H 1 1 42 25585 1 1 7 GLY HA2 H 0.206 6.568 -0.602 1.00 . A A . 7 GLY HA2 1 1 42 25586 1 1 7 GLY HA3 H 1.192 7.447 -1.761 1.00 . A A . 7 GLY HA3 1 1 42 25587 1 1 7 GLY N N -0.852 7.614 -2.041 1.00 . A A . 7 GLY N 1 1 42 25588 1 1 7 GLY O O -0.400 5.238 -3.269 1.00 . A A . 7 GLY O 1 1 42 25589 1 1 8 PRO C C 0.715 2.589 -2.887 1.00 . A A . 8 PRO C 1 1 42 25590 1 1 8 PRO CA C 1.847 3.603 -3.023 1.00 . A A . 8 PRO CA 1 1 42 25591 1 1 8 PRO CB C 3.126 3.064 -2.376 1.00 . A A . 8 PRO CB 1 1 42 25592 1 1 8 PRO CD C 2.673 5.170 -1.346 1.00 . A A . 8 PRO CD 1 1 42 25593 1 1 8 PRO CG C 3.786 4.258 -1.780 1.00 . A A . 8 PRO CG 1 1 42 25594 1 1 8 PRO HA H 2.027 3.800 -4.070 1.00 . A A . 8 PRO HA 1 1 42 25595 1 1 8 PRO HB2 H 2.870 2.335 -1.620 1.00 . A A . 8 PRO HB2 1 1 42 25596 1 1 8 PRO HB3 H 3.748 2.605 -3.130 1.00 . A A . 8 PRO HB3 1 1 42 25597 1 1 8 PRO HD2 H 2.384 4.954 -0.327 1.00 . A A . 8 PRO HD2 1 1 42 25598 1 1 8 PRO HD3 H 2.970 6.203 -1.445 1.00 . A A . 8 PRO HD3 1 1 42 25599 1 1 8 PRO HG2 H 4.383 3.963 -0.930 1.00 . A A . 8 PRO HG2 1 1 42 25600 1 1 8 PRO HG3 H 4.402 4.746 -2.521 1.00 . A A . 8 PRO HG3 1 1 42 25601 1 1 8 PRO N N 1.584 4.843 -2.283 1.00 . A A . 8 PRO N 1 1 42 25602 1 1 8 PRO O O 0.567 1.697 -3.721 1.00 . A A . 8 PRO O 1 1 42 25603 1 1 9 CYS C C -2.505 2.395 -2.125 1.00 . A A . 9 CYS C 1 1 42 25604 1 1 9 CYS CA C -1.196 1.819 -1.589 1.00 . A A . 9 CYS CA 1 1 42 25605 1 1 9 CYS CB C -1.326 1.527 -0.092 1.00 . A A . 9 CYS CB 1 1 42 25606 1 1 9 CYS H H 0.087 3.457 -1.196 1.00 . A A . 9 CYS H 1 1 42 25607 1 1 9 CYS HA H -0.986 0.896 -2.108 1.00 . A A . 9 CYS HA 1 1 42 25608 1 1 9 CYS HB2 H -0.708 2.222 0.457 1.00 . A A . 9 CYS HB2 1 1 42 25609 1 1 9 CYS HB3 H -2.356 1.657 0.206 1.00 . A A . 9 CYS HB3 1 1 42 25610 1 1 9 CYS N N -0.080 2.728 -1.830 1.00 . A A . 9 CYS N 1 1 42 25611 1 1 9 CYS O O -3.586 2.041 -1.655 1.00 . A A . 9 CYS O 1 1 42 25612 1 1 9 CYS SG S -0.819 -0.157 0.383 1.00 . A A . 9 CYS SG 1 1 42 25613 1 1 10 CYS C C -3.450 3.964 -5.224 1.00 . A A . 10 CYS C 1 1 42 25614 1 1 10 CYS CA C -3.580 3.902 -3.705 1.00 . A A . 10 CYS CA 1 1 42 25615 1 1 10 CYS CB C -3.784 5.309 -3.139 1.00 . A A . 10 CYS CB 1 1 42 25616 1 1 10 CYS H H -1.514 3.527 -3.444 1.00 . A A . 10 CYS H 1 1 42 25617 1 1 10 CYS HA H -4.437 3.295 -3.454 1.00 . A A . 10 CYS HA 1 1 42 25618 1 1 10 CYS HB2 H -2.915 5.909 -3.365 1.00 . A A . 10 CYS HB2 1 1 42 25619 1 1 10 CYS HB3 H -4.653 5.753 -3.604 1.00 . A A . 10 CYS HB3 1 1 42 25620 1 1 10 CYS N N -2.402 3.283 -3.109 1.00 . A A . 10 CYS N 1 1 42 25621 1 1 10 CYS O O -2.352 4.136 -5.755 1.00 . A A . 10 CYS O 1 1 42 25622 1 1 10 CYS SG S -4.034 5.353 -1.335 1.00 . A A . 10 CYS SG 1 1 42 25623 1 1 11 ARG C C -4.611 5.298 -7.886 1.00 . A A . 11 ARG C 1 1 42 25624 1 1 11 ARG CA C -4.580 3.859 -7.375 1.00 . A A . 11 ARG CA 1 1 42 25625 1 1 11 ARG CB C -5.775 3.073 -7.923 1.00 . A A . 11 ARG CB 1 1 42 25626 1 1 11 ARG CD C -6.353 0.968 -9.167 1.00 . A A . 11 ARG CD 1 1 42 25627 1 1 11 ARG CG C -5.512 1.583 -8.060 1.00 . A A . 11 ARG CG 1 1 42 25628 1 1 11 ARG CZ C -7.822 -0.993 -9.434 1.00 . A A . 11 ARG CZ 1 1 42 25629 1 1 11 ARG H H -5.419 3.686 -5.439 1.00 . A A . 11 ARG H 1 1 42 25630 1 1 11 ARG HA H -3.671 3.393 -7.718 1.00 . A A . 11 ARG HA 1 1 42 25631 1 1 11 ARG HB2 H -6.616 3.209 -7.259 1.00 . A A . 11 ARG HB2 1 1 42 25632 1 1 11 ARG HB3 H -6.031 3.463 -8.898 1.00 . A A . 11 ARG HB3 1 1 42 25633 1 1 11 ARG HD2 H -7.212 1.599 -9.341 1.00 . A A . 11 ARG HD2 1 1 42 25634 1 1 11 ARG HD3 H -5.758 0.914 -10.066 1.00 . A A . 11 ARG HD3 1 1 42 25635 1 1 11 ARG HE H -6.350 -0.841 -8.096 1.00 . A A . 11 ARG HE 1 1 42 25636 1 1 11 ARG HG2 H -4.468 1.431 -8.289 1.00 . A A . 11 ARG HG2 1 1 42 25637 1 1 11 ARG HG3 H -5.751 1.098 -7.125 1.00 . A A . 11 ARG HG3 1 1 42 25638 1 1 11 ARG HH11 H -8.213 0.528 -10.710 1.00 . A A . 11 ARG HH11 1 1 42 25639 1 1 11 ARG HH12 H -9.232 -0.862 -10.878 1.00 . A A . 11 ARG HH12 1 1 42 25640 1 1 11 ARG HH21 H -7.688 -2.670 -8.315 1.00 . A A . 11 ARG HH21 1 1 42 25641 1 1 11 ARG HH22 H -8.935 -2.678 -9.518 1.00 . A A . 11 ARG HH22 1 1 42 25642 1 1 11 ARG N N -4.574 3.821 -5.918 1.00 . A A . 11 ARG N 1 1 42 25643 1 1 11 ARG NE N -6.815 -0.375 -8.822 1.00 . A A . 11 ARG NE 1 1 42 25644 1 1 11 ARG NH1 N -8.476 -0.393 -10.422 1.00 . A A . 11 ARG NH1 1 1 42 25645 1 1 11 ARG NH2 N -8.178 -2.214 -9.058 1.00 . A A . 11 ARG NH2 1 1 42 25646 1 1 11 ARG O O -3.567 5.882 -8.179 1.00 . A A . 11 ARG O 1 1 42 25647 1 1 12 GLN C C -6.507 8.137 -7.364 1.00 . A A . 12 GLN C 1 1 42 25648 1 1 12 GLN CA C -5.965 7.234 -8.468 1.00 . A A . 12 GLN CA 1 1 42 25649 1 1 12 GLN CB C -6.900 7.271 -9.678 1.00 . A A . 12 GLN CB 1 1 42 25650 1 1 12 GLN CD C -6.658 6.960 -12.173 1.00 . A A . 12 GLN CD 1 1 42 25651 1 1 12 GLN CG C -6.478 6.339 -10.802 1.00 . A A . 12 GLN CG 1 1 42 25652 1 1 12 GLN H H -6.605 5.351 -7.744 1.00 . A A . 12 GLN H 1 1 42 25653 1 1 12 GLN HA H -4.992 7.595 -8.766 1.00 . A A . 12 GLN HA 1 1 42 25654 1 1 12 GLN HB2 H -7.893 6.990 -9.359 1.00 . A A . 12 GLN HB2 1 1 42 25655 1 1 12 GLN HB3 H -6.928 8.278 -10.066 1.00 . A A . 12 GLN HB3 1 1 42 25656 1 1 12 GLN HE21 H -4.705 6.827 -12.517 1.00 . A A . 12 GLN HE21 1 1 42 25657 1 1 12 GLN HE22 H -5.646 7.516 -13.791 1.00 . A A . 12 GLN HE22 1 1 42 25658 1 1 12 GLN HG2 H -5.436 6.088 -10.672 1.00 . A A . 12 GLN HG2 1 1 42 25659 1 1 12 GLN HG3 H -7.074 5.439 -10.749 1.00 . A A . 12 GLN HG3 1 1 42 25660 1 1 12 GLN N N -5.808 5.865 -7.992 1.00 . A A . 12 GLN N 1 1 42 25661 1 1 12 GLN NE2 N -5.559 7.117 -12.901 1.00 . A A . 12 GLN NE2 1 1 42 25662 1 1 12 GLN O O -6.289 9.349 -7.379 1.00 . A A . 12 GLN O 1 1 42 25663 1 1 12 GLN OE1 O -7.773 7.295 -12.574 1.00 . A A . 12 GLN OE1 1 1 42 25664 1 1 13 CYS C C -8.590 7.382 -4.374 1.00 . A A . 13 CYS C 1 1 42 25665 1 1 13 CYS CA C -7.790 8.295 -5.298 1.00 . A A . 13 CYS CA 1 1 42 25666 1 1 13 CYS CB C -8.689 9.419 -5.824 1.00 . A A . 13 CYS CB 1 1 42 25667 1 1 13 CYS H H -7.356 6.572 -6.451 1.00 . A A . 13 CYS H 1 1 42 25668 1 1 13 CYS HA H -6.976 8.731 -4.738 1.00 . A A . 13 CYS HA 1 1 42 25669 1 1 13 CYS HB2 H -8.448 9.608 -6.859 1.00 . A A . 13 CYS HB2 1 1 42 25670 1 1 13 CYS HB3 H -9.721 9.108 -5.751 1.00 . A A . 13 CYS HB3 1 1 42 25671 1 1 13 CYS N N -7.216 7.541 -6.409 1.00 . A A . 13 CYS N 1 1 42 25672 1 1 13 CYS O O -9.643 7.768 -3.865 1.00 . A A . 13 CYS O 1 1 42 25673 1 1 13 CYS SG S -8.518 10.992 -4.921 1.00 . A A . 13 CYS SG 1 1 42 25674 1 1 14 LYS C C -7.775 4.172 -2.766 1.00 . A A . 14 LYS C 1 1 42 25675 1 1 14 LYS CA C -8.759 5.208 -3.296 1.00 . A A . 14 LYS CA 1 1 42 25676 1 1 14 LYS CB C -9.890 4.513 -4.055 1.00 . A A . 14 LYS CB 1 1 42 25677 1 1 14 LYS CD C -12.391 4.416 -4.282 1.00 . A A . 14 LYS CD 1 1 42 25678 1 1 14 LYS CE C -12.998 4.016 -2.947 1.00 . A A . 14 LYS CE 1 1 42 25679 1 1 14 LYS CG C -11.180 5.316 -4.096 1.00 . A A . 14 LYS CG 1 1 42 25680 1 1 14 LYS H H -7.244 5.918 -4.591 1.00 . A A . 14 LYS H 1 1 42 25681 1 1 14 LYS HA H -9.178 5.749 -2.460 1.00 . A A . 14 LYS HA 1 1 42 25682 1 1 14 LYS HB2 H -9.570 4.335 -5.071 1.00 . A A . 14 LYS HB2 1 1 42 25683 1 1 14 LYS HB3 H -10.097 3.565 -3.581 1.00 . A A . 14 LYS HB3 1 1 42 25684 1 1 14 LYS HD2 H -13.135 4.944 -4.860 1.00 . A A . 14 LYS HD2 1 1 42 25685 1 1 14 LYS HD3 H -12.087 3.525 -4.811 1.00 . A A . 14 LYS HD3 1 1 42 25686 1 1 14 LYS HE2 H -12.566 3.076 -2.637 1.00 . A A . 14 LYS HE2 1 1 42 25687 1 1 14 LYS HE3 H -12.763 4.777 -2.217 1.00 . A A . 14 LYS HE3 1 1 42 25688 1 1 14 LYS HG2 H -11.285 5.857 -3.167 1.00 . A A . 14 LYS HG2 1 1 42 25689 1 1 14 LYS HG3 H -11.132 6.015 -4.918 1.00 . A A . 14 LYS HG3 1 1 42 25690 1 1 14 LYS HZ1 H -14.736 3.374 -3.910 1.00 . A A . 14 LYS HZ1 1 1 42 25691 1 1 14 LYS HZ2 H -14.826 3.314 -2.222 1.00 . A A . 14 LYS HZ2 1 1 42 25692 1 1 14 LYS HZ3 H -14.932 4.801 -3.023 1.00 . A A . 14 LYS HZ3 1 1 42 25693 1 1 14 LYS N N -8.087 6.171 -4.159 1.00 . A A . 14 LYS N 1 1 42 25694 1 1 14 LYS NZ N -14.477 3.866 -3.031 1.00 . A A . 14 LYS NZ 1 1 42 25695 1 1 14 LYS O O -6.862 3.748 -3.476 1.00 . A A . 14 LYS O 1 1 42 25696 1 1 15 LEU C C -7.095 1.477 -1.683 1.00 . A A . 15 LEU C 1 1 42 25697 1 1 15 LEU CA C -7.094 2.779 -0.890 1.00 . A A . 15 LEU CA 1 1 42 25698 1 1 15 LEU CB C -7.538 2.514 0.550 1.00 . A A . 15 LEU CB 1 1 42 25699 1 1 15 LEU CD1 C -5.782 0.779 0.985 1.00 . A A . 15 LEU CD1 1 1 42 25700 1 1 15 LEU CD2 C -5.383 3.157 1.659 1.00 . A A . 15 LEU CD2 1 1 42 25701 1 1 15 LEU CG C -6.425 2.059 1.496 1.00 . A A . 15 LEU CG 1 1 42 25702 1 1 15 LEU H H -8.711 4.141 -1.000 1.00 . A A . 15 LEU H 1 1 42 25703 1 1 15 LEU HA H -6.092 3.180 -0.881 1.00 . A A . 15 LEU HA 1 1 42 25704 1 1 15 LEU HB2 H -7.970 3.422 0.944 1.00 . A A . 15 LEU HB2 1 1 42 25705 1 1 15 LEU HB3 H -8.301 1.750 0.534 1.00 . A A . 15 LEU HB3 1 1 42 25706 1 1 15 LEU HD11 H -6.545 0.034 0.819 1.00 . A A . 15 LEU HD11 1 1 42 25707 1 1 15 LEU HD12 H -5.267 0.981 0.057 1.00 . A A . 15 LEU HD12 1 1 42 25708 1 1 15 LEU HD13 H -5.076 0.415 1.716 1.00 . A A . 15 LEU HD13 1 1 42 25709 1 1 15 LEU HD21 H -5.518 3.901 0.888 1.00 . A A . 15 LEU HD21 1 1 42 25710 1 1 15 LEU HD22 H -5.498 3.620 2.628 1.00 . A A . 15 LEU HD22 1 1 42 25711 1 1 15 LEU HD23 H -4.394 2.731 1.580 1.00 . A A . 15 LEU HD23 1 1 42 25712 1 1 15 LEU HG H -6.851 1.853 2.467 1.00 . A A . 15 LEU HG 1 1 42 25713 1 1 15 LEU N N -7.966 3.767 -1.515 1.00 . A A . 15 LEU N 1 1 42 25714 1 1 15 LEU O O -8.119 0.801 -1.785 1.00 . A A . 15 LEU O 1 1 42 25715 1 1 16 LYS C C -6.241 -1.312 -2.221 1.00 . A A . 16 LYS C 1 1 42 25716 1 1 16 LYS CA C -5.808 -0.091 -3.030 1.00 . A A . 16 LYS CA 1 1 42 25717 1 1 16 LYS CB C -4.362 -0.264 -3.501 1.00 . A A . 16 LYS CB 1 1 42 25718 1 1 16 LYS CD C -2.843 -0.075 -5.493 1.00 . A A . 16 LYS CD 1 1 42 25719 1 1 16 LYS CE C -2.181 0.947 -6.403 1.00 . A A . 16 LYS CE 1 1 42 25720 1 1 16 LYS CG C -4.035 0.520 -4.761 1.00 . A A . 16 LYS CG 1 1 42 25721 1 1 16 LYS H H -5.160 1.711 -2.128 1.00 . A A . 16 LYS H 1 1 42 25722 1 1 16 LYS HA H -6.449 0.001 -3.894 1.00 . A A . 16 LYS HA 1 1 42 25723 1 1 16 LYS HB2 H -3.698 0.065 -2.715 1.00 . A A . 16 LYS HB2 1 1 42 25724 1 1 16 LYS HB3 H -4.183 -1.311 -3.697 1.00 . A A . 16 LYS HB3 1 1 42 25725 1 1 16 LYS HD2 H -2.121 -0.417 -4.767 1.00 . A A . 16 LYS HD2 1 1 42 25726 1 1 16 LYS HD3 H -3.180 -0.910 -6.090 1.00 . A A . 16 LYS HD3 1 1 42 25727 1 1 16 LYS HE2 H -2.760 1.031 -7.311 1.00 . A A . 16 LYS HE2 1 1 42 25728 1 1 16 LYS HE3 H -2.165 1.902 -5.898 1.00 . A A . 16 LYS HE3 1 1 42 25729 1 1 16 LYS HG2 H -4.893 0.503 -5.417 1.00 . A A . 16 LYS HG2 1 1 42 25730 1 1 16 LYS HG3 H -3.807 1.540 -4.490 1.00 . A A . 16 LYS HG3 1 1 42 25731 1 1 16 LYS HZ1 H -0.770 -0.406 -7.138 1.00 . A A . 16 LYS HZ1 1 1 42 25732 1 1 16 LYS HZ2 H -0.402 1.212 -7.464 1.00 . A A . 16 LYS HZ2 1 1 42 25733 1 1 16 LYS HZ3 H -0.184 0.592 -5.905 1.00 . A A . 16 LYS HZ3 1 1 42 25734 1 1 16 LYS N N -5.941 1.131 -2.244 1.00 . A A . 16 LYS N 1 1 42 25735 1 1 16 LYS NZ N -0.787 0.559 -6.752 1.00 . A A . 16 LYS NZ 1 1 42 25736 1 1 16 LYS O O -6.284 -1.268 -0.991 1.00 . A A . 16 LYS O 1 1 42 25737 1 1 17 PRO C C -5.871 -4.320 -1.460 1.00 . A A . 17 PRO C 1 1 42 25738 1 1 17 PRO CA C -7.000 -3.658 -2.241 1.00 . A A . 17 PRO CA 1 1 42 25739 1 1 17 PRO CB C -7.443 -4.551 -3.402 1.00 . A A . 17 PRO CB 1 1 42 25740 1 1 17 PRO CD C -6.545 -2.560 -4.372 1.00 . A A . 17 PRO CD 1 1 42 25741 1 1 17 PRO CG C -6.691 -4.042 -4.582 1.00 . A A . 17 PRO CG 1 1 42 25742 1 1 17 PRO HA H -7.836 -3.481 -1.580 1.00 . A A . 17 PRO HA 1 1 42 25743 1 1 17 PRO HB2 H -7.191 -5.579 -3.186 1.00 . A A . 17 PRO HB2 1 1 42 25744 1 1 17 PRO HB3 H -8.509 -4.459 -3.545 1.00 . A A . 17 PRO HB3 1 1 42 25745 1 1 17 PRO HD2 H -5.606 -2.212 -4.777 1.00 . A A . 17 PRO HD2 1 1 42 25746 1 1 17 PRO HD3 H -7.372 -2.032 -4.822 1.00 . A A . 17 PRO HD3 1 1 42 25747 1 1 17 PRO HG2 H -5.719 -4.511 -4.629 1.00 . A A . 17 PRO HG2 1 1 42 25748 1 1 17 PRO HG3 H -7.248 -4.238 -5.486 1.00 . A A . 17 PRO HG3 1 1 42 25749 1 1 17 PRO N N -6.569 -2.422 -2.904 1.00 . A A . 17 PRO N 1 1 42 25750 1 1 17 PRO O O -4.708 -4.263 -1.860 1.00 . A A . 17 PRO O 1 1 42 25751 1 1 18 ALA C C -4.452 -6.659 -0.302 1.00 . A A . 18 ALA C 1 1 42 25752 1 1 18 ALA CA C -5.242 -5.627 0.497 1.00 . A A . 18 ALA CA 1 1 42 25753 1 1 18 ALA CB C -5.929 -6.288 1.682 1.00 . A A . 18 ALA CB 1 1 42 25754 1 1 18 ALA H H -7.167 -4.960 -0.080 1.00 . A A . 18 ALA H 1 1 42 25755 1 1 18 ALA HA H -4.559 -4.881 0.878 1.00 . A A . 18 ALA HA 1 1 42 25756 1 1 18 ALA HB1 H -5.967 -5.595 2.509 1.00 . A A . 18 ALA HB1 1 1 42 25757 1 1 18 ALA HB2 H -6.934 -6.571 1.403 1.00 . A A . 18 ALA HB2 1 1 42 25758 1 1 18 ALA HB3 H -5.376 -7.168 1.974 1.00 . A A . 18 ALA HB3 1 1 42 25759 1 1 18 ALA N N -6.223 -4.950 -0.344 1.00 . A A . 18 ALA N 1 1 42 25760 1 1 18 ALA O O -4.981 -7.283 -1.222 1.00 . A A . 18 ALA O 1 1 42 25761 1 1 19 GLY C C -1.471 -7.134 -1.698 1.00 . A A . 19 GLY C 1 1 42 25762 1 1 19 GLY CA C -2.343 -7.787 -0.642 1.00 . A A . 19 GLY CA 1 1 42 25763 1 1 19 GLY H H -2.815 -6.305 0.794 1.00 . A A . 19 GLY H 1 1 42 25764 1 1 19 GLY HA2 H -2.973 -8.525 -1.117 1.00 . A A . 19 GLY HA2 1 1 42 25765 1 1 19 GLY HA3 H -1.708 -8.282 0.077 1.00 . A A . 19 GLY HA3 1 1 42 25766 1 1 19 GLY N N -3.184 -6.831 0.054 1.00 . A A . 19 GLY N 1 1 42 25767 1 1 19 GLY O O -0.437 -7.679 -2.081 1.00 . A A . 19 GLY O 1 1 42 25768 1 1 20 THR C C 0.188 -4.735 -2.629 1.00 . A A . 20 THR C 1 1 42 25769 1 1 20 THR CA C -1.141 -5.236 -3.186 1.00 . A A . 20 THR CA 1 1 42 25770 1 1 20 THR CB C -1.964 -4.057 -3.709 1.00 . A A . 20 THR CB 1 1 42 25771 1 1 20 THR CG2 C -1.270 -3.283 -4.809 1.00 . A A . 20 THR CG2 1 1 42 25772 1 1 20 THR H H -2.723 -5.579 -1.824 1.00 . A A . 20 THR H 1 1 42 25773 1 1 20 THR HA H -0.943 -5.915 -4.001 1.00 . A A . 20 THR HA 1 1 42 25774 1 1 20 THR HB H -2.154 -3.374 -2.894 1.00 . A A . 20 THR HB 1 1 42 25775 1 1 20 THR HG1 H -3.755 -3.743 -4.437 1.00 . A A . 20 THR HG1 1 1 42 25776 1 1 20 THR HG21 H -0.281 -2.999 -4.481 1.00 . A A . 20 THR HG21 1 1 42 25777 1 1 20 THR HG22 H -1.193 -3.901 -5.691 1.00 . A A . 20 THR HG22 1 1 42 25778 1 1 20 THR HG23 H -1.841 -2.396 -5.040 1.00 . A A . 20 THR HG23 1 1 42 25779 1 1 20 THR N N -1.890 -5.963 -2.169 1.00 . A A . 20 THR N 1 1 42 25780 1 1 20 THR O O 0.226 -3.792 -1.839 1.00 . A A . 20 THR O 1 1 42 25781 1 1 20 THR OG1 O -3.209 -4.502 -4.217 1.00 . A A . 20 THR OG1 1 1 42 25782 1 1 21 THR C C 2.996 -3.620 -3.130 1.00 . A A . 21 THR C 1 1 42 25783 1 1 21 THR CA C 2.608 -4.992 -2.587 1.00 . A A . 21 THR CA 1 1 42 25784 1 1 21 THR CB C 3.641 -6.039 -3.016 1.00 . A A . 21 THR CB 1 1 42 25785 1 1 21 THR CG2 C 4.294 -6.746 -1.848 1.00 . A A . 21 THR CG2 1 1 42 25786 1 1 21 THR H H 1.183 -6.118 -3.676 1.00 . A A . 21 THR H 1 1 42 25787 1 1 21 THR HA H 2.584 -4.944 -1.508 1.00 . A A . 21 THR HA 1 1 42 25788 1 1 21 THR HB H 4.421 -5.551 -3.584 1.00 . A A . 21 THR HB 1 1 42 25789 1 1 21 THR HG1 H 2.853 -6.655 -4.700 1.00 . A A . 21 THR HG1 1 1 42 25790 1 1 21 THR HG21 H 3.682 -6.627 -0.966 1.00 . A A . 21 THR HG21 1 1 42 25791 1 1 21 THR HG22 H 4.398 -7.796 -2.075 1.00 . A A . 21 THR HG22 1 1 42 25792 1 1 21 THR HG23 H 5.270 -6.319 -1.668 1.00 . A A . 21 THR HG23 1 1 42 25793 1 1 21 THR N N 1.277 -5.373 -3.045 1.00 . A A . 21 THR N 1 1 42 25794 1 1 21 THR O O 2.743 -3.307 -4.293 1.00 . A A . 21 THR O 1 1 42 25795 1 1 21 THR OG1 O 3.046 -7.028 -3.837 1.00 . A A . 21 THR OG1 1 1 42 25796 1 1 22 CYS C C 5.553 -1.328 -2.586 1.00 . A A . 22 CYS C 1 1 42 25797 1 1 22 CYS CA C 4.036 -1.467 -2.673 1.00 . A A . 22 CYS CA 1 1 42 25798 1 1 22 CYS CB C 3.365 -0.416 -1.787 1.00 . A A . 22 CYS CB 1 1 42 25799 1 1 22 CYS H H 3.787 -3.112 -1.365 1.00 . A A . 22 CYS H 1 1 42 25800 1 1 22 CYS HA H 3.731 -1.310 -3.697 1.00 . A A . 22 CYS HA 1 1 42 25801 1 1 22 CYS HB2 H 3.644 0.568 -2.134 1.00 . A A . 22 CYS HB2 1 1 42 25802 1 1 22 CYS HB3 H 2.293 -0.527 -1.860 1.00 . A A . 22 CYS HB3 1 1 42 25803 1 1 22 CYS N N 3.613 -2.806 -2.279 1.00 . A A . 22 CYS N 1 1 42 25804 1 1 22 CYS O O 6.181 -0.717 -3.450 1.00 . A A . 22 CYS O 1 1 42 25805 1 1 22 CYS SG S 3.817 -0.529 -0.026 1.00 . A A . 22 CYS SG 1 1 42 25806 1 1 23 TRP C C 8.261 -3.069 -1.929 1.00 . A A . 23 TRP C 1 1 42 25807 1 1 23 TRP CA C 7.578 -1.841 -1.337 1.00 . A A . 23 TRP CA 1 1 42 25808 1 1 23 TRP CB C 7.903 -1.732 0.154 1.00 . A A . 23 TRP CB 1 1 42 25809 1 1 23 TRP CD1 C 9.118 0.505 0.446 1.00 . A A . 23 TRP CD1 1 1 42 25810 1 1 23 TRP CD2 C 10.413 -1.293 0.767 1.00 . A A . 23 TRP CD2 1 1 42 25811 1 1 23 TRP CE2 C 11.194 -0.137 0.955 1.00 . A A . 23 TRP CE2 1 1 42 25812 1 1 23 TRP CE3 C 11.015 -2.546 0.918 1.00 . A A . 23 TRP CE3 1 1 42 25813 1 1 23 TRP CG C 9.087 -0.860 0.442 1.00 . A A . 23 TRP CG 1 1 42 25814 1 1 23 TRP CH2 C 13.109 -1.437 1.428 1.00 . A A . 23 TRP CH2 1 1 42 25815 1 1 23 TRP CZ2 C 12.546 -0.198 1.287 1.00 . A A . 23 TRP CZ2 1 1 42 25816 1 1 23 TRP CZ3 C 12.356 -2.604 1.247 1.00 . A A . 23 TRP CZ3 1 1 42 25817 1 1 23 TRP H H 5.581 -2.374 -0.882 1.00 . A A . 23 TRP H 1 1 42 25818 1 1 23 TRP HA H 7.946 -0.960 -1.841 1.00 . A A . 23 TRP HA 1 1 42 25819 1 1 23 TRP HB2 H 7.051 -1.319 0.672 1.00 . A A . 23 TRP HB2 1 1 42 25820 1 1 23 TRP HB3 H 8.112 -2.718 0.543 1.00 . A A . 23 TRP HB3 1 1 42 25821 1 1 23 TRP HD1 H 8.265 1.133 0.235 1.00 . A A . 23 TRP HD1 1 1 42 25822 1 1 23 TRP HE1 H 10.656 1.886 0.819 1.00 . A A . 23 TRP HE1 1 1 42 25823 1 1 23 TRP HE3 H 10.451 -3.456 0.782 1.00 . A A . 23 TRP HE3 1 1 42 25824 1 1 23 TRP HH2 H 14.154 -1.531 1.684 1.00 . A A . 23 TRP HH2 1 1 42 25825 1 1 23 TRP HZ2 H 13.140 0.692 1.430 1.00 . A A . 23 TRP HZ2 1 1 42 25826 1 1 23 TRP HZ3 H 12.838 -3.563 1.367 1.00 . A A . 23 TRP HZ3 1 1 42 25827 1 1 23 TRP N N 6.135 -1.901 -1.537 1.00 . A A . 23 TRP N 1 1 42 25828 1 1 23 TRP NE1 N 10.381 0.947 0.754 1.00 . A A . 23 TRP NE1 1 1 42 25829 1 1 23 TRP O O 8.516 -4.049 -1.229 1.00 . A A . 23 TRP O 1 1 42 25830 1 1 24 ARG C C 10.572 -3.697 -4.447 1.00 . A A . 24 ARG C 1 1 42 25831 1 1 24 ARG CA C 9.207 -4.118 -3.912 1.00 . A A . 24 ARG CA 1 1 42 25832 1 1 24 ARG CB C 8.330 -4.620 -5.061 1.00 . A A . 24 ARG CB 1 1 42 25833 1 1 24 ARG CD C 6.237 -5.819 -5.765 1.00 . A A . 24 ARG CD 1 1 42 25834 1 1 24 ARG CG C 7.140 -5.446 -4.601 1.00 . A A . 24 ARG CG 1 1 42 25835 1 1 24 ARG CZ C 6.307 -8.276 -5.594 1.00 . A A . 24 ARG CZ 1 1 42 25836 1 1 24 ARG H H 8.325 -2.202 -3.730 1.00 . A A . 24 ARG H 1 1 42 25837 1 1 24 ARG HA H 9.344 -4.917 -3.199 1.00 . A A . 24 ARG HA 1 1 42 25838 1 1 24 ARG HB2 H 7.960 -3.770 -5.614 1.00 . A A . 24 ARG HB2 1 1 42 25839 1 1 24 ARG HB3 H 8.932 -5.231 -5.717 1.00 . A A . 24 ARG HB3 1 1 42 25840 1 1 24 ARG HD2 H 5.457 -5.078 -5.851 1.00 . A A . 24 ARG HD2 1 1 42 25841 1 1 24 ARG HD3 H 6.825 -5.827 -6.671 1.00 . A A . 24 ARG HD3 1 1 42 25842 1 1 24 ARG HE H 4.655 -7.166 -5.450 1.00 . A A . 24 ARG HE 1 1 42 25843 1 1 24 ARG HG2 H 7.500 -6.350 -4.134 1.00 . A A . 24 ARG HG2 1 1 42 25844 1 1 24 ARG HG3 H 6.571 -4.871 -3.885 1.00 . A A . 24 ARG HG3 1 1 42 25845 1 1 24 ARG HH11 H 8.107 -7.406 -5.905 1.00 . A A . 24 ARG HH11 1 1 42 25846 1 1 24 ARG HH12 H 8.129 -9.133 -5.781 1.00 . A A . 24 ARG HH12 1 1 42 25847 1 1 24 ARG HH21 H 4.682 -9.437 -5.286 1.00 . A A . 24 ARG HH21 1 1 42 25848 1 1 24 ARG HH22 H 6.184 -10.287 -5.430 1.00 . A A . 24 ARG HH22 1 1 42 25849 1 1 24 ARG N N 8.554 -3.010 -3.225 1.00 . A A . 24 ARG N 1 1 42 25850 1 1 24 ARG NE N 5.625 -7.133 -5.585 1.00 . A A . 24 ARG NE 1 1 42 25851 1 1 24 ARG NH1 N 7.622 -8.271 -5.775 1.00 . A A . 24 ARG NH1 1 1 42 25852 1 1 24 ARG NH2 N 5.672 -9.428 -5.422 1.00 . A A . 24 ARG NH2 1 1 42 25853 1 1 24 ARG O O 10.668 -2.848 -5.333 1.00 . A A . 24 ARG O 1 1 42 25854 1 1 25 THR C C 13.814 -5.255 -4.479 1.00 . A A . 25 THR C 1 1 42 25855 1 1 25 THR CA C 12.986 -3.983 -4.324 1.00 . A A . 25 THR CA 1 1 42 25856 1 1 25 THR CB C 13.653 -3.048 -3.314 1.00 . A A . 25 THR CB 1 1 42 25857 1 1 25 THR CG2 C 12.781 -1.877 -2.916 1.00 . A A . 25 THR CG2 1 1 42 25858 1 1 25 THR H H 11.485 -4.965 -3.199 1.00 . A A . 25 THR H 1 1 42 25859 1 1 25 THR HA H 12.930 -3.485 -5.280 1.00 . A A . 25 THR HA 1 1 42 25860 1 1 25 THR HB H 14.559 -2.652 -3.750 1.00 . A A . 25 THR HB 1 1 42 25861 1 1 25 THR HG1 H 13.207 -4.134 -1.747 1.00 . A A . 25 THR HG1 1 1 42 25862 1 1 25 THR HG21 H 11.756 -2.206 -2.824 1.00 . A A . 25 THR HG21 1 1 42 25863 1 1 25 THR HG22 H 13.118 -1.481 -1.970 1.00 . A A . 25 THR HG22 1 1 42 25864 1 1 25 THR HG23 H 12.845 -1.107 -3.671 1.00 . A A . 25 THR HG23 1 1 42 25865 1 1 25 THR N N 11.626 -4.296 -3.902 1.00 . A A . 25 THR N 1 1 42 25866 1 1 25 THR O O 15.024 -5.252 -4.252 1.00 . A A . 25 THR O 1 1 42 25867 1 1 25 THR OG1 O 13.997 -3.748 -2.132 1.00 . A A . 25 THR OG1 1 1 42 25868 1 1 26 SER C C 14.463 -8.095 -3.752 1.00 . A A . 26 SER C 1 1 42 25869 1 1 26 SER CA C 13.828 -7.620 -5.054 1.00 . A A . 26 SER CA 1 1 42 25870 1 1 26 SER CB C 14.896 -7.504 -6.143 1.00 . A A . 26 SER CB 1 1 42 25871 1 1 26 SER H H 12.189 -6.280 -5.034 1.00 . A A . 26 SER H 1 1 42 25872 1 1 26 SER HA H 13.088 -8.343 -5.365 1.00 . A A . 26 SER HA 1 1 42 25873 1 1 26 SER HB2 H 15.720 -6.912 -5.774 1.00 . A A . 26 SER HB2 1 1 42 25874 1 1 26 SER HB3 H 15.250 -8.490 -6.404 1.00 . A A . 26 SER HB3 1 1 42 25875 1 1 26 SER HG H 14.052 -6.006 -7.083 1.00 . A A . 26 SER HG 1 1 42 25876 1 1 26 SER N N 13.153 -6.341 -4.868 1.00 . A A . 26 SER N 1 1 42 25877 1 1 26 SER O O 15.495 -8.767 -3.761 1.00 . A A . 26 SER O 1 1 42 25878 1 1 26 SER OG O 14.375 -6.883 -7.306 1.00 . A A . 26 SER OG 1 1 42 25879 1 1 27 VAL C C 13.204 -8.505 -0.381 1.00 . A A . 27 VAL C 1 1 42 25880 1 1 27 VAL CA C 14.344 -8.133 -1.321 1.00 . A A . 27 VAL CA 1 1 42 25881 1 1 27 VAL CB C 15.177 -7.007 -0.680 1.00 . A A . 27 VAL CB 1 1 42 25882 1 1 27 VAL CG1 C 15.859 -7.501 0.586 1.00 . A A . 27 VAL CG1 1 1 42 25883 1 1 27 VAL CG2 C 16.199 -6.469 -1.670 1.00 . A A . 27 VAL CG2 1 1 42 25884 1 1 27 VAL H H 13.021 -7.207 -2.689 1.00 . A A . 27 VAL H 1 1 42 25885 1 1 27 VAL HA H 14.980 -8.993 -1.453 1.00 . A A . 27 VAL HA 1 1 42 25886 1 1 27 VAL HB H 14.509 -6.202 -0.411 1.00 . A A . 27 VAL HB 1 1 42 25887 1 1 27 VAL HG11 H 16.173 -8.525 0.450 1.00 . A A . 27 VAL HG11 1 1 42 25888 1 1 27 VAL HG12 H 16.721 -6.885 0.795 1.00 . A A . 27 VAL HG12 1 1 42 25889 1 1 27 VAL HG13 H 15.167 -7.444 1.413 1.00 . A A . 27 VAL HG13 1 1 42 25890 1 1 27 VAL HG21 H 16.430 -7.232 -2.399 1.00 . A A . 27 VAL HG21 1 1 42 25891 1 1 27 VAL HG22 H 15.793 -5.603 -2.172 1.00 . A A . 27 VAL HG22 1 1 42 25892 1 1 27 VAL HG23 H 17.099 -6.191 -1.143 1.00 . A A . 27 VAL HG23 1 1 42 25893 1 1 27 VAL N N 13.839 -7.742 -2.632 1.00 . A A . 27 VAL N 1 1 42 25894 1 1 27 VAL O O 13.257 -9.525 0.305 1.00 . A A . 27 VAL O 1 1 42 25895 1 1 28 SER C C 9.725 -7.527 -0.219 1.00 . A A . 28 SER C 1 1 42 25896 1 1 28 SER CA C 11.017 -7.903 0.499 1.00 . A A . 28 SER CA 1 1 42 25897 1 1 28 SER CB C 11.145 -7.103 1.797 1.00 . A A . 28 SER CB 1 1 42 25898 1 1 28 SER H H 12.195 -6.873 -0.926 1.00 . A A . 28 SER H 1 1 42 25899 1 1 28 SER HA H 10.989 -8.956 0.737 1.00 . A A . 28 SER HA 1 1 42 25900 1 1 28 SER HB2 H 11.732 -6.216 1.614 1.00 . A A . 28 SER HB2 1 1 42 25901 1 1 28 SER HB3 H 10.161 -6.819 2.140 1.00 . A A . 28 SER HB3 1 1 42 25902 1 1 28 SER HG H 12.244 -7.282 3.409 1.00 . A A . 28 SER HG 1 1 42 25903 1 1 28 SER N N 12.175 -7.668 -0.356 1.00 . A A . 28 SER N 1 1 42 25904 1 1 28 SER O O 9.741 -7.154 -1.392 1.00 . A A . 28 SER O 1 1 42 25905 1 1 28 SER OG O 11.778 -7.868 2.808 1.00 . A A . 28 SER OG 1 1 42 25906 1 1 29 SER C C 6.374 -6.730 0.990 1.00 . A A . 29 SER C 1 1 42 25907 1 1 29 SER CA C 7.307 -7.297 -0.076 1.00 . A A . 29 SER CA 1 1 42 25908 1 1 29 SER CB C 6.677 -8.536 -0.714 1.00 . A A . 29 SER CB 1 1 42 25909 1 1 29 SER H H 8.660 -7.930 1.424 1.00 . A A . 29 SER H 1 1 42 25910 1 1 29 SER HA H 7.459 -6.548 -0.838 1.00 . A A . 29 SER HA 1 1 42 25911 1 1 29 SER HB2 H 7.041 -9.421 -0.213 1.00 . A A . 29 SER HB2 1 1 42 25912 1 1 29 SER HB3 H 5.602 -8.483 -0.615 1.00 . A A . 29 SER HB3 1 1 42 25913 1 1 29 SER HG H 7.922 -8.891 -2.184 1.00 . A A . 29 SER HG 1 1 42 25914 1 1 29 SER N N 8.608 -7.627 0.494 1.00 . A A . 29 SER N 1 1 42 25915 1 1 29 SER O O 6.090 -7.386 1.993 1.00 . A A . 29 SER O 1 1 42 25916 1 1 29 SER OG O 7.005 -8.624 -2.090 1.00 . A A . 29 SER OG 1 1 42 25917 1 1 30 HIS C C 3.572 -4.839 1.175 1.00 . A A . 30 HIS C 1 1 42 25918 1 1 30 HIS CA C 5.001 -4.853 1.708 1.00 . A A . 30 HIS CA 1 1 42 25919 1 1 30 HIS CB C 5.470 -3.423 1.984 1.00 . A A . 30 HIS CB 1 1 42 25920 1 1 30 HIS CD2 C 7.884 -4.169 2.569 1.00 . A A . 30 HIS CD2 1 1 42 25921 1 1 30 HIS CE1 C 8.397 -2.541 3.945 1.00 . A A . 30 HIS CE1 1 1 42 25922 1 1 30 HIS CG C 6.809 -3.350 2.649 1.00 . A A . 30 HIS CG 1 1 42 25923 1 1 30 HIS H H 6.165 -5.036 -0.051 1.00 . A A . 30 HIS H 1 1 42 25924 1 1 30 HIS HA H 5.022 -5.413 2.631 1.00 . A A . 30 HIS HA 1 1 42 25925 1 1 30 HIS HB2 H 5.534 -2.887 1.049 1.00 . A A . 30 HIS HB2 1 1 42 25926 1 1 30 HIS HB3 H 4.751 -2.934 2.625 1.00 . A A . 30 HIS HB3 1 1 42 25927 1 1 30 HIS HD1 H 6.594 -1.588 3.786 1.00 . A A . 30 HIS HD1 1 1 42 25928 1 1 30 HIS HD2 H 7.962 -5.069 1.975 1.00 . A A . 30 HIS HD2 1 1 42 25929 1 1 30 HIS HE1 H 8.938 -1.911 4.635 1.00 . A A . 30 HIS HE1 1 1 42 25930 1 1 30 HIS HE2 H 9.776 -3.975 3.459 1.00 . A A . 30 HIS HE2 1 1 42 25931 1 1 30 HIS N N 5.902 -5.508 0.767 1.00 . A A . 30 HIS N 1 1 42 25932 1 1 30 HIS ND1 N 7.163 -2.340 3.520 1.00 . A A . 30 HIS ND1 1 1 42 25933 1 1 30 HIS NE2 N 8.857 -3.644 3.384 1.00 . A A . 30 HIS NE2 1 1 42 25934 1 1 30 HIS O O 3.125 -3.848 0.598 1.00 . A A . 30 HIS O 1 1 42 25935 1 1 31 TYR C C 0.602 -4.995 1.558 1.00 . A A . 31 TYR C 1 1 42 25936 1 1 31 TYR CA C 1.483 -6.059 0.911 1.00 . A A . 31 TYR CA 1 1 42 25937 1 1 31 TYR CB C 0.933 -7.452 1.224 1.00 . A A . 31 TYR CB 1 1 42 25938 1 1 31 TYR CD1 C 1.966 -9.752 1.101 1.00 . A A . 31 TYR CD1 1 1 42 25939 1 1 31 TYR CD2 C 1.944 -8.421 -0.877 1.00 . A A . 31 TYR CD2 1 1 42 25940 1 1 31 TYR CE1 C 2.600 -10.770 0.414 1.00 . A A . 31 TYR CE1 1 1 42 25941 1 1 31 TYR CE2 C 2.579 -9.434 -1.570 1.00 . A A . 31 TYR CE2 1 1 42 25942 1 1 31 TYR CG C 1.627 -8.562 0.469 1.00 . A A . 31 TYR CG 1 1 42 25943 1 1 31 TYR CZ C 2.904 -10.606 -0.921 1.00 . A A . 31 TYR CZ 1 1 42 25944 1 1 31 TYR H H 3.274 -6.701 1.839 1.00 . A A . 31 TYR H 1 1 42 25945 1 1 31 TYR HA H 1.478 -5.912 -0.158 1.00 . A A . 31 TYR HA 1 1 42 25946 1 1 31 TYR HB2 H 1.048 -7.647 2.280 1.00 . A A . 31 TYR HB2 1 1 42 25947 1 1 31 TYR HB3 H -0.116 -7.482 0.970 1.00 . A A . 31 TYR HB3 1 1 42 25948 1 1 31 TYR HD1 H 1.726 -9.878 2.146 1.00 . A A . 31 TYR HD1 1 1 42 25949 1 1 31 TYR HD2 H 1.689 -7.501 -1.382 1.00 . A A . 31 TYR HD2 1 1 42 25950 1 1 31 TYR HE1 H 2.855 -11.688 0.923 1.00 . A A . 31 TYR HE1 1 1 42 25951 1 1 31 TYR HE2 H 2.817 -9.305 -2.616 1.00 . A A . 31 TYR HE2 1 1 42 25952 1 1 31 TYR HH H 4.307 -11.265 -2.059 1.00 . A A . 31 TYR HH 1 1 42 25953 1 1 31 TYR N N 2.862 -5.944 1.372 1.00 . A A . 31 TYR N 1 1 42 25954 1 1 31 TYR O O 0.863 -4.557 2.679 1.00 . A A . 31 TYR O 1 1 42 25955 1 1 31 TYR OH O 3.536 -11.617 -1.609 1.00 . A A . 31 TYR OH 1 1 42 25956 1 1 32 CYS C C -2.363 -4.185 2.322 1.00 . A A . 32 CYS C 1 1 42 25957 1 1 32 CYS CA C -1.360 -3.571 1.351 1.00 . A A . 32 CYS CA 1 1 42 25958 1 1 32 CYS CB C -2.100 -2.899 0.194 1.00 . A A . 32 CYS CB 1 1 42 25959 1 1 32 CYS H H -0.597 -4.970 -0.041 1.00 . A A . 32 CYS H 1 1 42 25960 1 1 32 CYS HA H -0.779 -2.828 1.875 1.00 . A A . 32 CYS HA 1 1 42 25961 1 1 32 CYS HB2 H -1.468 -2.908 -0.681 1.00 . A A . 32 CYS HB2 1 1 42 25962 1 1 32 CYS HB3 H -3.004 -3.454 -0.016 1.00 . A A . 32 CYS HB3 1 1 42 25963 1 1 32 CYS N N -0.441 -4.583 0.845 1.00 . A A . 32 CYS N 1 1 42 25964 1 1 32 CYS O O -2.776 -5.333 2.160 1.00 . A A . 32 CYS O 1 1 42 25965 1 1 32 CYS SG S -2.572 -1.170 0.518 1.00 . A A . 32 CYS SG 1 1 42 25966 1 1 33 THR C C -5.120 -3.389 4.009 1.00 . A A . 33 THR C 1 1 42 25967 1 1 33 THR CA C -3.709 -3.881 4.326 1.00 . A A . 33 THR CA 1 1 42 25968 1 1 33 THR CB C -3.295 -3.411 5.721 1.00 . A A . 33 THR CB 1 1 42 25969 1 1 33 THR CG2 C -1.818 -3.589 6.000 1.00 . A A . 33 THR CG2 1 1 42 25970 1 1 33 THR H H -2.388 -2.505 3.406 1.00 . A A . 33 THR H 1 1 42 25971 1 1 33 THR HA H -3.705 -4.961 4.305 1.00 . A A . 33 THR HA 1 1 42 25972 1 1 33 THR HB H -3.842 -3.981 6.459 1.00 . A A . 33 THR HB 1 1 42 25973 1 1 33 THR HG1 H -3.810 -1.876 6.824 1.00 . A A . 33 THR HG1 1 1 42 25974 1 1 33 THR HG21 H -1.336 -4.006 5.128 1.00 . A A . 33 THR HG21 1 1 42 25975 1 1 33 THR HG22 H -1.378 -2.631 6.232 1.00 . A A . 33 THR HG22 1 1 42 25976 1 1 33 THR HG23 H -1.688 -4.258 6.838 1.00 . A A . 33 THR HG23 1 1 42 25977 1 1 33 THR N N -2.752 -3.412 3.330 1.00 . A A . 33 THR N 1 1 42 25978 1 1 33 THR O O -6.015 -3.467 4.850 1.00 . A A . 33 THR O 1 1 42 25979 1 1 33 THR OG1 O -3.604 -2.040 5.901 1.00 . A A . 33 THR OG1 1 1 42 25980 1 1 34 GLY C C -7.232 -1.448 3.417 1.00 . A A . 34 GLY C 1 1 42 25981 1 1 34 GLY CA C -6.621 -2.387 2.393 1.00 . A A . 34 GLY CA 1 1 42 25982 1 1 34 GLY H H -4.566 -2.844 2.161 1.00 . A A . 34 GLY H 1 1 42 25983 1 1 34 GLY HA2 H -7.284 -3.228 2.252 1.00 . A A . 34 GLY HA2 1 1 42 25984 1 1 34 GLY HA3 H -6.522 -1.861 1.455 1.00 . A A . 34 GLY HA3 1 1 42 25985 1 1 34 GLY N N -5.314 -2.882 2.793 1.00 . A A . 34 GLY N 1 1 42 25986 1 1 34 GLY O O -8.454 -1.337 3.514 1.00 . A A . 34 GLY O 1 1 42 25987 1 1 35 ARG C C -6.301 1.557 4.961 1.00 . A A . 35 ARG C 1 1 42 25988 1 1 35 ARG CA C -6.845 0.156 5.207 1.00 . A A . 35 ARG CA 1 1 42 25989 1 1 35 ARG CB C -6.427 -0.332 6.597 1.00 . A A . 35 ARG CB 1 1 42 25990 1 1 35 ARG CD C -7.424 -1.233 8.720 1.00 . A A . 35 ARG CD 1 1 42 25991 1 1 35 ARG CG C -7.505 -0.153 7.653 1.00 . A A . 35 ARG CG 1 1 42 25992 1 1 35 ARG CZ C -9.003 -2.616 10.011 1.00 . A A . 35 ARG CZ 1 1 42 25993 1 1 35 ARG H H -5.418 -0.907 4.061 1.00 . A A . 35 ARG H 1 1 42 25994 1 1 35 ARG HA H -7.920 0.190 5.158 1.00 . A A . 35 ARG HA 1 1 42 25995 1 1 35 ARG HB2 H -6.182 -1.382 6.538 1.00 . A A . 35 ARG HB2 1 1 42 25996 1 1 35 ARG HB3 H -5.552 0.217 6.911 1.00 . A A . 35 ARG HB3 1 1 42 25997 1 1 35 ARG HD2 H -7.041 -2.137 8.271 1.00 . A A . 35 ARG HD2 1 1 42 25998 1 1 35 ARG HD3 H -6.748 -0.904 9.496 1.00 . A A . 35 ARG HD3 1 1 42 25999 1 1 35 ARG HE H -9.436 -0.849 9.189 1.00 . A A . 35 ARG HE 1 1 42 26000 1 1 35 ARG HG2 H -7.381 0.811 8.121 1.00 . A A . 35 ARG HG2 1 1 42 26001 1 1 35 ARG HG3 H -8.474 -0.202 7.177 1.00 . A A . 35 ARG HG3 1 1 42 26002 1 1 35 ARG HH11 H -7.153 -3.412 9.822 1.00 . A A . 35 ARG HH11 1 1 42 26003 1 1 35 ARG HH12 H -8.282 -4.364 10.725 1.00 . A A . 35 ARG HH12 1 1 42 26004 1 1 35 ARG HH21 H -10.923 -2.101 10.377 1.00 . A A . 35 ARG HH21 1 1 42 26005 1 1 35 ARG HH22 H -10.422 -3.621 11.040 1.00 . A A . 35 ARG HH22 1 1 42 26006 1 1 35 ARG N N -6.381 -0.775 4.184 1.00 . A A . 35 ARG N 1 1 42 26007 1 1 35 ARG NE N -8.728 -1.515 9.315 1.00 . A A . 35 ARG NE 1 1 42 26008 1 1 35 ARG NH1 N -8.069 -3.540 10.201 1.00 . A A . 35 ARG NH1 1 1 42 26009 1 1 35 ARG NH2 N -10.215 -2.794 10.518 1.00 . A A . 35 ARG NH2 1 1 42 26010 1 1 35 ARG O O -7.046 2.474 4.614 1.00 . A A . 35 ARG O 1 1 42 26011 1 1 36 SER C C -3.319 2.928 3.821 1.00 . A A . 36 SER C 1 1 42 26012 1 1 36 SER CA C -4.345 3.003 4.947 1.00 . A A . 36 SER CA 1 1 42 26013 1 1 36 SER CB C -3.666 3.458 6.240 1.00 . A A . 36 SER CB 1 1 42 26014 1 1 36 SER H H -4.461 0.944 5.423 1.00 . A A . 36 SER H 1 1 42 26015 1 1 36 SER HA H -5.104 3.722 4.678 1.00 . A A . 36 SER HA 1 1 42 26016 1 1 36 SER HB2 H -3.251 2.600 6.748 1.00 . A A . 36 SER HB2 1 1 42 26017 1 1 36 SER HB3 H -2.873 4.153 6.003 1.00 . A A . 36 SER HB3 1 1 42 26018 1 1 36 SER HG H -4.613 3.634 7.946 1.00 . A A . 36 SER HG 1 1 42 26019 1 1 36 SER N N -4.997 1.714 5.145 1.00 . A A . 36 SER N 1 1 42 26020 1 1 36 SER O O -2.727 1.877 3.576 1.00 . A A . 36 SER O 1 1 42 26021 1 1 36 SER OG O -4.590 4.096 7.105 1.00 . A A . 36 SER OG 1 1 42 26022 1 1 37 CYS C C -0.722 4.078 2.558 1.00 . A A . 37 CYS C 1 1 42 26023 1 1 37 CYS CA C -2.158 4.112 2.039 1.00 . A A . 37 CYS CA 1 1 42 26024 1 1 37 CYS CB C -2.384 5.379 1.211 1.00 . A A . 37 CYS CB 1 1 42 26025 1 1 37 CYS H H -3.615 4.856 3.382 1.00 . A A . 37 CYS H 1 1 42 26026 1 1 37 CYS HA H -2.321 3.250 1.411 1.00 . A A . 37 CYS HA 1 1 42 26027 1 1 37 CYS HB2 H -3.392 5.730 1.372 1.00 . A A . 37 CYS HB2 1 1 42 26028 1 1 37 CYS HB3 H -1.688 6.139 1.533 1.00 . A A . 37 CYS HB3 1 1 42 26029 1 1 37 CYS N N -3.113 4.050 3.139 1.00 . A A . 37 CYS N 1 1 42 26030 1 1 37 CYS O O 0.204 3.739 1.822 1.00 . A A . 37 CYS O 1 1 42 26031 1 1 37 CYS SG S -2.161 5.145 -0.582 1.00 . A A . 37 CYS SG 1 1 42 26032 1 1 38 GLU C C 1.349 3.028 4.524 1.00 . A A . 38 GLU C 1 1 42 26033 1 1 38 GLU CA C 0.781 4.441 4.438 1.00 . A A . 38 GLU CA 1 1 42 26034 1 1 38 GLU CB C 0.717 5.063 5.835 1.00 . A A . 38 GLU CB 1 1 42 26035 1 1 38 GLU CD C 0.606 7.175 7.216 1.00 . A A . 38 GLU CD 1 1 42 26036 1 1 38 GLU CG C 0.626 6.580 5.821 1.00 . A A . 38 GLU CG 1 1 42 26037 1 1 38 GLU H H -1.319 4.694 4.366 1.00 . A A . 38 GLU H 1 1 42 26038 1 1 38 GLU HA H 1.429 5.040 3.816 1.00 . A A . 38 GLU HA 1 1 42 26039 1 1 38 GLU HB2 H -0.149 4.675 6.350 1.00 . A A . 38 GLU HB2 1 1 42 26040 1 1 38 GLU HB3 H 1.605 4.782 6.382 1.00 . A A . 38 GLU HB3 1 1 42 26041 1 1 38 GLU HG2 H 1.479 6.975 5.291 1.00 . A A . 38 GLU HG2 1 1 42 26042 1 1 38 GLU HG3 H -0.281 6.868 5.309 1.00 . A A . 38 GLU HG3 1 1 42 26043 1 1 38 GLU N N -0.543 4.433 3.827 1.00 . A A . 38 GLU N 1 1 42 26044 1 1 38 GLU O O 0.967 2.246 5.395 1.00 . A A . 38 GLU O 1 1 42 26045 1 1 38 GLU OE1 O -0.418 7.788 7.584 1.00 . A A . 38 GLU OE1 1 1 42 26046 1 1 38 GLU OE2 O 1.613 7.027 7.939 1.00 . A A . 38 GLU OE2 1 1 42 26047 1 1 39 CYS C C 3.623 1.106 4.893 1.00 . A A . 39 CYS C 1 1 42 26048 1 1 39 CYS CA C 2.885 1.388 3.587 1.00 . A A . 39 CYS CA 1 1 42 26049 1 1 39 CYS CB C 3.853 1.282 2.407 1.00 . A A . 39 CYS CB 1 1 42 26050 1 1 39 CYS H H 2.527 3.374 2.945 1.00 . A A . 39 CYS H 1 1 42 26051 1 1 39 CYS HA H 2.101 0.656 3.464 1.00 . A A . 39 CYS HA 1 1 42 26052 1 1 39 CYS HB2 H 4.486 2.157 2.391 1.00 . A A . 39 CYS HB2 1 1 42 26053 1 1 39 CYS HB3 H 4.467 0.403 2.533 1.00 . A A . 39 CYS HB3 1 1 42 26054 1 1 39 CYS N N 2.263 2.707 3.614 1.00 . A A . 39 CYS N 1 1 42 26055 1 1 39 CYS O O 4.122 2.024 5.544 1.00 . A A . 39 CYS O 1 1 42 26056 1 1 39 CYS SG S 3.036 1.161 0.783 1.00 . A A . 39 CYS SG 1 1 42 26057 1 1 40 PRO C C 5.897 -0.411 6.434 1.00 . A A . 40 PRO C 1 1 42 26058 1 1 40 PRO CA C 4.384 -0.573 6.530 1.00 . A A . 40 PRO CA 1 1 42 26059 1 1 40 PRO CB C 4.013 -2.050 6.680 1.00 . A A . 40 PRO CB 1 1 42 26060 1 1 40 PRO CD C 3.134 -1.331 4.577 1.00 . A A . 40 PRO CD 1 1 42 26061 1 1 40 PRO CG C 3.729 -2.512 5.293 1.00 . A A . 40 PRO CG 1 1 42 26062 1 1 40 PRO HA H 4.017 -0.018 7.381 1.00 . A A . 40 PRO HA 1 1 42 26063 1 1 40 PRO HB2 H 4.841 -2.590 7.116 1.00 . A A . 40 PRO HB2 1 1 42 26064 1 1 40 PRO HB3 H 3.142 -2.143 7.312 1.00 . A A . 40 PRO HB3 1 1 42 26065 1 1 40 PRO HD2 H 3.436 -1.327 3.540 1.00 . A A . 40 PRO HD2 1 1 42 26066 1 1 40 PRO HD3 H 2.057 -1.343 4.658 1.00 . A A . 40 PRO HD3 1 1 42 26067 1 1 40 PRO HG2 H 4.647 -2.819 4.813 1.00 . A A . 40 PRO HG2 1 1 42 26068 1 1 40 PRO HG3 H 3.024 -3.330 5.315 1.00 . A A . 40 PRO HG3 1 1 42 26069 1 1 40 PRO N N 3.702 -0.174 5.295 1.00 . A A . 40 PRO N 1 1 42 26070 1 1 40 PRO O O 6.426 -0.032 5.389 1.00 . A A . 40 PRO O 1 1 42 26071 1 1 41 SER C C 8.680 -1.911 7.983 1.00 . A A . 41 SER C 1 1 42 26072 1 1 41 SER CA C 8.042 -0.588 7.571 1.00 . A A . 41 SER CA 1 1 42 26073 1 1 41 SER CB C 8.462 0.517 8.542 1.00 . A A . 41 SER CB 1 1 42 26074 1 1 41 SER H H 6.110 -0.999 8.333 1.00 . A A . 41 SER H 1 1 42 26075 1 1 41 SER HA H 8.382 -0.332 6.579 1.00 . A A . 41 SER HA 1 1 42 26076 1 1 41 SER HB2 H 7.730 1.310 8.519 1.00 . A A . 41 SER HB2 1 1 42 26077 1 1 41 SER HB3 H 8.522 0.112 9.541 1.00 . A A . 41 SER HB3 1 1 42 26078 1 1 41 SER HG H 10.313 1.014 8.948 1.00 . A A . 41 SER HG 1 1 42 26079 1 1 41 SER N N 6.589 -0.702 7.531 1.00 . A A . 41 SER N 1 1 42 26080 1 1 41 SER O O 9.694 -1.933 8.681 1.00 . A A . 41 SER O 1 1 42 26081 1 1 41 SER OG O 9.725 1.053 8.190 1.00 . A A . 41 SER OG 1 1 42 26082 1 1 42 TYR C C 8.018 -5.390 6.917 1.00 . A A . 42 TYR C 1 1 42 26083 1 1 42 TYR CA C 8.588 -4.341 7.869 1.00 . A A . 42 TYR CA 1 1 42 26084 1 1 42 TYR CB C 8.242 -4.705 9.314 1.00 . A A . 42 TYR CB 1 1 42 26085 1 1 42 TYR CD1 C 5.800 -5.331 9.172 1.00 . A A . 42 TYR CD1 1 1 42 26086 1 1 42 TYR CD2 C 6.401 -3.433 10.482 1.00 . A A . 42 TYR CD2 1 1 42 26087 1 1 42 TYR CE1 C 4.470 -5.134 9.488 1.00 . A A . 42 TYR CE1 1 1 42 26088 1 1 42 TYR CE2 C 5.072 -3.229 10.803 1.00 . A A . 42 TYR CE2 1 1 42 26089 1 1 42 TYR CG C 6.787 -4.486 9.663 1.00 . A A . 42 TYR CG 1 1 42 26090 1 1 42 TYR CZ C 4.111 -4.081 10.304 1.00 . A A . 42 TYR CZ 1 1 42 26091 1 1 42 TYR H H 7.274 -2.932 6.993 1.00 . A A . 42 TYR H 1 1 42 26092 1 1 42 TYR HA H 9.662 -4.319 7.760 1.00 . A A . 42 TYR HA 1 1 42 26093 1 1 42 TYR HB2 H 8.468 -5.748 9.479 1.00 . A A . 42 TYR HB2 1 1 42 26094 1 1 42 TYR HB3 H 8.839 -4.102 9.982 1.00 . A A . 42 TYR HB3 1 1 42 26095 1 1 42 TYR HD1 H 6.084 -6.155 8.533 1.00 . A A . 42 TYR HD1 1 1 42 26096 1 1 42 TYR HD2 H 7.156 -2.766 10.871 1.00 . A A . 42 TYR HD2 1 1 42 26097 1 1 42 TYR HE1 H 3.717 -5.802 9.097 1.00 . A A . 42 TYR HE1 1 1 42 26098 1 1 42 TYR HE2 H 4.792 -2.404 11.442 1.00 . A A . 42 TYR HE2 1 1 42 26099 1 1 42 TYR HH H 2.267 -3.840 9.815 1.00 . A A . 42 TYR HH 1 1 42 26100 1 1 42 TYR N N 8.079 -3.013 7.546 1.00 . A A . 42 TYR N 1 1 42 26101 1 1 42 TYR O O 6.954 -5.194 6.330 1.00 . A A . 42 TYR O 1 1 42 26102 1 1 42 TYR OH O 2.787 -3.882 10.621 1.00 . A A . 42 TYR OH 1 1 42 26103 1 1 43 PRO C C 7.055 -8.332 6.408 1.00 . A A . 43 PRO C 1 1 42 26104 1 1 43 PRO CA C 8.281 -7.605 5.866 1.00 . A A . 43 PRO CA 1 1 42 26105 1 1 43 PRO CB C 9.486 -8.546 5.824 1.00 . A A . 43 PRO CB 1 1 42 26106 1 1 43 PRO CD C 10.002 -6.838 7.415 1.00 . A A . 43 PRO CD 1 1 42 26107 1 1 43 PRO CG C 10.207 -8.294 7.103 1.00 . A A . 43 PRO CG 1 1 42 26108 1 1 43 PRO HA H 8.070 -7.240 4.871 1.00 . A A . 43 PRO HA 1 1 42 26109 1 1 43 PRO HB2 H 9.146 -9.569 5.756 1.00 . A A . 43 PRO HB2 1 1 42 26110 1 1 43 PRO HB3 H 10.104 -8.308 4.971 1.00 . A A . 43 PRO HB3 1 1 42 26111 1 1 43 PRO HD2 H 9.931 -6.686 8.482 1.00 . A A . 43 PRO HD2 1 1 42 26112 1 1 43 PRO HD3 H 10.805 -6.246 7.001 1.00 . A A . 43 PRO HD3 1 1 42 26113 1 1 43 PRO HG2 H 9.788 -8.908 7.887 1.00 . A A . 43 PRO HG2 1 1 42 26114 1 1 43 PRO HG3 H 11.259 -8.507 6.980 1.00 . A A . 43 PRO HG3 1 1 42 26115 1 1 43 PRO N N 8.722 -6.523 6.752 1.00 . A A . 43 PRO N 1 1 42 26116 1 1 43 PRO O O 7.048 -8.791 7.550 1.00 . A A . 43 PRO O 1 1 42 26117 1 1 44 GLY C C 4.977 -10.611 6.096 1.00 . A A . 44 GLY C 1 1 42 26118 1 1 44 GLY CA C 4.803 -9.108 5.995 1.00 . A A . 44 GLY CA 1 1 42 26119 1 1 44 GLY H H 6.083 -8.050 4.681 1.00 . A A . 44 GLY H 1 1 42 26120 1 1 44 GLY HA2 H 4.025 -8.894 5.278 1.00 . A A . 44 GLY HA2 1 1 42 26121 1 1 44 GLY HA3 H 4.504 -8.726 6.960 1.00 . A A . 44 GLY HA3 1 1 42 26122 1 1 44 GLY N N 6.020 -8.435 5.581 1.00 . A A . 44 GLY N 1 1 42 26123 1 1 44 GLY O O 4.031 -11.289 6.547 1.00 . A A . 44 GLY O 1 1 42 26124 1 1 44 GLY OXT O 6.060 -11.109 5.722 1.00 . A A . 44 GLY OXT 1 1 43 26125 1 1 1 ALA C C -7.022 15.788 0.079 1.00 . A A . 1 ALA C 1 1 43 26126 1 1 1 ALA CA C -5.979 15.855 -1.031 1.00 . A A . 1 ALA CA 1 1 43 26127 1 1 1 ALA CB C -6.125 17.151 -1.814 1.00 . A A . 1 ALA CB 1 1 43 26128 1 1 1 ALA H1 H -7.098 14.580 -2.194 1.00 . A A . 1 ALA H1 1 1 43 26129 1 1 1 ALA H2 H -5.515 14.884 -2.784 1.00 . A A . 1 ALA H2 1 1 43 26130 1 1 1 ALA H3 H -5.742 13.852 -1.434 1.00 . A A . 1 ALA H3 1 1 43 26131 1 1 1 ALA HA H -4.995 15.843 -0.585 1.00 . A A . 1 ALA HA 1 1 43 26132 1 1 1 ALA HB1 H -6.992 17.089 -2.455 1.00 . A A . 1 ALA HB1 1 1 43 26133 1 1 1 ALA HB2 H -5.243 17.310 -2.416 1.00 . A A . 1 ALA HB2 1 1 43 26134 1 1 1 ALA HB3 H -6.245 17.976 -1.127 1.00 . A A . 1 ALA HB3 1 1 43 26135 1 1 1 ALA N N -6.094 14.688 -1.943 1.00 . A A . 1 ALA N 1 1 43 26136 1 1 1 ALA O O -8.132 16.301 -0.066 1.00 . A A . 1 ALA O 1 1 43 26137 1 1 2 MET C C -8.828 14.261 1.925 1.00 . A A . 2 MET C 1 1 43 26138 1 1 2 MET CA C -7.564 15.017 2.323 1.00 . A A . 2 MET CA 1 1 43 26139 1 1 2 MET CB C -7.933 16.395 2.874 1.00 . A A . 2 MET CB 1 1 43 26140 1 1 2 MET CE C -9.968 17.728 5.946 1.00 . A A . 2 MET CE 1 1 43 26141 1 1 2 MET CG C -8.084 16.425 4.386 1.00 . A A . 2 MET CG 1 1 43 26142 1 1 2 MET H H -5.761 14.763 1.243 1.00 . A A . 2 MET H 1 1 43 26143 1 1 2 MET HA H -7.051 14.457 3.091 1.00 . A A . 2 MET HA 1 1 43 26144 1 1 2 MET HB2 H -7.162 17.099 2.597 1.00 . A A . 2 MET HB2 1 1 43 26145 1 1 2 MET HB3 H -8.869 16.708 2.434 1.00 . A A . 2 MET HB3 1 1 43 26146 1 1 2 MET HE1 H -9.124 18.382 5.785 1.00 . A A . 2 MET HE1 1 1 43 26147 1 1 2 MET HE2 H -10.880 18.247 5.692 1.00 . A A . 2 MET HE2 1 1 43 26148 1 1 2 MET HE3 H -10.000 17.432 6.984 1.00 . A A . 2 MET HE3 1 1 43 26149 1 1 2 MET HG2 H -7.519 15.607 4.807 1.00 . A A . 2 MET HG2 1 1 43 26150 1 1 2 MET HG3 H -7.690 17.360 4.755 1.00 . A A . 2 MET HG3 1 1 43 26151 1 1 2 MET N N -6.659 15.151 1.187 1.00 . A A . 2 MET N 1 1 43 26152 1 1 2 MET O O -9.909 14.517 2.454 1.00 . A A . 2 MET O 1 1 43 26153 1 1 2 MET SD S -9.801 16.273 4.915 1.00 . A A . 2 MET SD 1 1 43 26154 1 1 3 ASP C C -9.353 11.456 -0.456 1.00 . A A . 3 ASP C 1 1 43 26155 1 1 3 ASP CA C -9.813 12.535 0.519 1.00 . A A . 3 ASP CA 1 1 43 26156 1 1 3 ASP CB C -10.852 13.435 -0.151 1.00 . A A . 3 ASP CB 1 1 43 26157 1 1 3 ASP CG C -10.250 14.302 -1.240 1.00 . A A . 3 ASP CG 1 1 43 26158 1 1 3 ASP H H -7.796 13.170 0.604 1.00 . A A . 3 ASP H 1 1 43 26159 1 1 3 ASP HA H -10.263 12.059 1.378 1.00 . A A . 3 ASP HA 1 1 43 26160 1 1 3 ASP HB2 H -11.622 12.820 -0.592 1.00 . A A . 3 ASP HB2 1 1 43 26161 1 1 3 ASP HB3 H -11.295 14.080 0.594 1.00 . A A . 3 ASP HB3 1 1 43 26162 1 1 3 ASP N N -8.683 13.329 0.988 1.00 . A A . 3 ASP N 1 1 43 26163 1 1 3 ASP O O -8.199 11.446 -0.885 1.00 . A A . 3 ASP O 1 1 43 26164 1 1 3 ASP OD1 O -10.601 15.499 -1.308 1.00 . A A . 3 ASP OD1 1 1 43 26165 1 1 3 ASP OD2 O -9.427 13.784 -2.024 1.00 . A A . 3 ASP OD2 1 1 43 26166 1 1 4 CYS C C -8.943 8.483 -1.133 1.00 . A A . 4 CYS C 1 1 43 26167 1 1 4 CYS CA C -9.959 9.460 -1.727 1.00 . A A . 4 CYS CA 1 1 43 26168 1 1 4 CYS CB C -9.425 10.020 -3.046 1.00 . A A . 4 CYS CB 1 1 43 26169 1 1 4 CYS H H -11.166 10.613 -0.422 1.00 . A A . 4 CYS H 1 1 43 26170 1 1 4 CYS HA H -10.877 8.927 -1.922 1.00 . A A . 4 CYS HA 1 1 43 26171 1 1 4 CYS HB2 H -9.009 10.999 -2.869 1.00 . A A . 4 CYS HB2 1 1 43 26172 1 1 4 CYS HB3 H -8.649 9.367 -3.417 1.00 . A A . 4 CYS HB3 1 1 43 26173 1 1 4 CYS N N -10.264 10.549 -0.800 1.00 . A A . 4 CYS N 1 1 43 26174 1 1 4 CYS O O -8.444 7.599 -1.830 1.00 . A A . 4 CYS O 1 1 43 26175 1 1 4 CYS SG S -10.685 10.184 -4.352 1.00 . A A . 4 CYS SG 1 1 43 26176 1 1 5 THR C C -6.357 7.728 0.063 1.00 . A A . 5 THR C 1 1 43 26177 1 1 5 THR CA C -7.680 7.771 0.823 1.00 . A A . 5 THR CA 1 1 43 26178 1 1 5 THR CB C -8.253 6.359 0.960 1.00 . A A . 5 THR CB 1 1 43 26179 1 1 5 THR CG2 C -7.796 5.646 2.214 1.00 . A A . 5 THR CG2 1 1 43 26180 1 1 5 THR H H -9.063 9.362 0.658 1.00 . A A . 5 THR H 1 1 43 26181 1 1 5 THR HA H -7.500 8.174 1.809 1.00 . A A . 5 THR HA 1 1 43 26182 1 1 5 THR HB H -7.937 5.770 0.111 1.00 . A A . 5 THR HB 1 1 43 26183 1 1 5 THR HG1 H -10.012 5.727 0.376 1.00 . A A . 5 THR HG1 1 1 43 26184 1 1 5 THR HG21 H -7.719 6.356 3.024 1.00 . A A . 5 THR HG21 1 1 43 26185 1 1 5 THR HG22 H -8.511 4.880 2.473 1.00 . A A . 5 THR HG22 1 1 43 26186 1 1 5 THR HG23 H -6.831 5.194 2.039 1.00 . A A . 5 THR HG23 1 1 43 26187 1 1 5 THR N N -8.638 8.644 0.151 1.00 . A A . 5 THR N 1 1 43 26188 1 1 5 THR O O -5.953 6.682 -0.445 1.00 . A A . 5 THR O 1 1 43 26189 1 1 5 THR OG1 O -9.669 6.393 0.976 1.00 . A A . 5 THR OG1 1 1 43 26190 1 1 6 THR C C -3.309 8.259 0.063 1.00 . A A . 6 THR C 1 1 43 26191 1 1 6 THR CA C -4.413 8.969 -0.713 1.00 . A A . 6 THR CA 1 1 43 26192 1 1 6 THR CB C -4.037 10.435 -0.933 1.00 . A A . 6 THR CB 1 1 43 26193 1 1 6 THR CG2 C -4.541 10.991 -2.247 1.00 . A A . 6 THR CG2 1 1 43 26194 1 1 6 THR H H -6.062 9.674 0.411 1.00 . A A . 6 THR H 1 1 43 26195 1 1 6 THR HA H -4.526 8.489 -1.673 1.00 . A A . 6 THR HA 1 1 43 26196 1 1 6 THR HB H -2.960 10.525 -0.928 1.00 . A A . 6 THR HB 1 1 43 26197 1 1 6 THR HG1 H -3.968 11.991 0.254 1.00 . A A . 6 THR HG1 1 1 43 26198 1 1 6 THR HG21 H -5.052 10.212 -2.795 1.00 . A A . 6 THR HG21 1 1 43 26199 1 1 6 THR HG22 H -5.226 11.804 -2.056 1.00 . A A . 6 THR HG22 1 1 43 26200 1 1 6 THR HG23 H -3.707 11.352 -2.830 1.00 . A A . 6 THR HG23 1 1 43 26201 1 1 6 THR N N -5.688 8.874 -0.013 1.00 . A A . 6 THR N 1 1 43 26202 1 1 6 THR O O -3.462 7.959 1.247 1.00 . A A . 6 THR O 1 1 43 26203 1 1 6 THR OG1 O -4.556 11.248 0.105 1.00 . A A . 6 THR OG1 1 1 43 26204 1 1 7 GLY C C -0.303 6.442 -0.940 1.00 . A A . 7 GLY C 1 1 43 26205 1 1 7 GLY CA C -1.083 7.316 0.026 1.00 . A A . 7 GLY CA 1 1 43 26206 1 1 7 GLY H H -2.133 8.253 -1.556 1.00 . A A . 7 GLY H 1 1 43 26207 1 1 7 GLY HA2 H -1.462 6.699 0.827 1.00 . A A . 7 GLY HA2 1 1 43 26208 1 1 7 GLY HA3 H -0.417 8.058 0.441 1.00 . A A . 7 GLY HA3 1 1 43 26209 1 1 7 GLY N N -2.197 7.991 -0.614 1.00 . A A . 7 GLY N 1 1 43 26210 1 1 7 GLY O O -0.644 6.362 -2.120 1.00 . A A . 7 GLY O 1 1 43 26211 1 1 8 PRO C C 0.884 3.589 -1.652 1.00 . A A . 8 PRO C 1 1 43 26212 1 1 8 PRO CA C 1.584 4.899 -1.307 1.00 . A A . 8 PRO CA 1 1 43 26213 1 1 8 PRO CB C 2.813 4.635 -0.437 1.00 . A A . 8 PRO CB 1 1 43 26214 1 1 8 PRO CD C 1.239 5.809 0.931 1.00 . A A . 8 PRO CD 1 1 43 26215 1 1 8 PRO CG C 2.318 4.759 0.962 1.00 . A A . 8 PRO CG 1 1 43 26216 1 1 8 PRO HA H 1.883 5.397 -2.217 1.00 . A A . 8 PRO HA 1 1 43 26217 1 1 8 PRO HB2 H 3.192 3.643 -0.637 1.00 . A A . 8 PRO HB2 1 1 43 26218 1 1 8 PRO HB3 H 3.575 5.369 -0.652 1.00 . A A . 8 PRO HB3 1 1 43 26219 1 1 8 PRO HD2 H 0.446 5.554 1.618 1.00 . A A . 8 PRO HD2 1 1 43 26220 1 1 8 PRO HD3 H 1.650 6.778 1.169 1.00 . A A . 8 PRO HD3 1 1 43 26221 1 1 8 PRO HG2 H 1.912 3.814 1.292 1.00 . A A . 8 PRO HG2 1 1 43 26222 1 1 8 PRO HG3 H 3.124 5.070 1.610 1.00 . A A . 8 PRO HG3 1 1 43 26223 1 1 8 PRO N N 0.759 5.770 -0.464 1.00 . A A . 8 PRO N 1 1 43 26224 1 1 8 PRO O O 1.163 2.979 -2.684 1.00 . A A . 8 PRO O 1 1 43 26225 1 1 9 CYS C C -2.236 2.198 -1.272 1.00 . A A . 9 CYS C 1 1 43 26226 1 1 9 CYS CA C -0.762 1.919 -0.997 1.00 . A A . 9 CYS CA 1 1 43 26227 1 1 9 CYS CB C -0.621 1.003 0.221 1.00 . A A . 9 CYS CB 1 1 43 26228 1 1 9 CYS H H -0.203 3.688 0.024 1.00 . A A . 9 CYS H 1 1 43 26229 1 1 9 CYS HA H -0.335 1.425 -1.857 1.00 . A A . 9 CYS HA 1 1 43 26230 1 1 9 CYS HB2 H 0.340 1.174 0.682 1.00 . A A . 9 CYS HB2 1 1 43 26231 1 1 9 CYS HB3 H -1.401 1.238 0.930 1.00 . A A . 9 CYS HB3 1 1 43 26232 1 1 9 CYS N N -0.025 3.159 -0.782 1.00 . A A . 9 CYS N 1 1 43 26233 1 1 9 CYS O O -3.105 1.873 -0.462 1.00 . A A . 9 CYS O 1 1 43 26234 1 1 9 CYS SG S -0.739 -0.773 -0.167 1.00 . A A . 9 CYS SG 1 1 43 26235 1 1 10 CYS C C -4.143 2.755 -4.262 1.00 . A A . 10 CYS C 1 1 43 26236 1 1 10 CYS CA C -3.883 3.125 -2.805 1.00 . A A . 10 CYS CA 1 1 43 26237 1 1 10 CYS CB C -4.160 4.614 -2.589 1.00 . A A . 10 CYS CB 1 1 43 26238 1 1 10 CYS H H -1.780 3.036 -3.029 1.00 . A A . 10 CYS H 1 1 43 26239 1 1 10 CYS HA H -4.546 2.550 -2.177 1.00 . A A . 10 CYS HA 1 1 43 26240 1 1 10 CYS HB2 H -3.737 5.174 -3.409 1.00 . A A . 10 CYS HB2 1 1 43 26241 1 1 10 CYS HB3 H -5.228 4.774 -2.565 1.00 . A A . 10 CYS HB3 1 1 43 26242 1 1 10 CYS N N -2.513 2.802 -2.423 1.00 . A A . 10 CYS N 1 1 43 26243 1 1 10 CYS O O -3.263 2.235 -4.948 1.00 . A A . 10 CYS O 1 1 43 26244 1 1 10 CYS SG S -3.463 5.285 -1.044 1.00 . A A . 10 CYS SG 1 1 43 26245 1 1 11 ARG C C -6.362 3.939 -6.777 1.00 . A A . 11 ARG C 1 1 43 26246 1 1 11 ARG CA C -5.735 2.722 -6.104 1.00 . A A . 11 ARG CA 1 1 43 26247 1 1 11 ARG CB C -6.710 1.544 -6.138 1.00 . A A . 11 ARG CB 1 1 43 26248 1 1 11 ARG CD C -7.479 -0.412 -7.516 1.00 . A A . 11 ARG CD 1 1 43 26249 1 1 11 ARG CG C -6.991 1.027 -7.540 1.00 . A A . 11 ARG CG 1 1 43 26250 1 1 11 ARG CZ C -8.251 -0.786 -9.825 1.00 . A A . 11 ARG CZ 1 1 43 26251 1 1 11 ARG H H -6.016 3.441 -4.133 1.00 . A A . 11 ARG H 1 1 43 26252 1 1 11 ARG HA H -4.838 2.452 -6.641 1.00 . A A . 11 ARG HA 1 1 43 26253 1 1 11 ARG HB2 H -6.298 0.733 -5.555 1.00 . A A . 11 ARG HB2 1 1 43 26254 1 1 11 ARG HB3 H -7.646 1.853 -5.697 1.00 . A A . 11 ARG HB3 1 1 43 26255 1 1 11 ARG HD2 H -6.640 -1.066 -7.702 1.00 . A A . 11 ARG HD2 1 1 43 26256 1 1 11 ARG HD3 H -7.889 -0.623 -6.539 1.00 . A A . 11 ARG HD3 1 1 43 26257 1 1 11 ARG HE H -9.433 -0.734 -8.218 1.00 . A A . 11 ARG HE 1 1 43 26258 1 1 11 ARG HG2 H -7.749 1.646 -7.996 1.00 . A A . 11 ARG HG2 1 1 43 26259 1 1 11 ARG HG3 H -6.082 1.081 -8.121 1.00 . A A . 11 ARG HG3 1 1 43 26260 1 1 11 ARG HH11 H -6.254 -0.522 -9.642 1.00 . A A . 11 ARG HH11 1 1 43 26261 1 1 11 ARG HH12 H -6.823 -0.787 -11.256 1.00 . A A . 11 ARG HH12 1 1 43 26262 1 1 11 ARG HH21 H -10.183 -1.083 -10.340 1.00 . A A . 11 ARG HH21 1 1 43 26263 1 1 11 ARG HH22 H -9.053 -1.105 -11.653 1.00 . A A . 11 ARG HH22 1 1 43 26264 1 1 11 ARG N N -5.358 3.026 -4.728 1.00 . A A . 11 ARG N 1 1 43 26265 1 1 11 ARG NE N -8.505 -0.659 -8.525 1.00 . A A . 11 ARG NE 1 1 43 26266 1 1 11 ARG NH1 N -7.007 -0.690 -10.278 1.00 . A A . 11 ARG NH1 1 1 43 26267 1 1 11 ARG NH2 N -9.244 -1.010 -10.676 1.00 . A A . 11 ARG NH2 1 1 43 26268 1 1 11 ARG O O -7.370 3.822 -7.474 1.00 . A A . 11 ARG O 1 1 43 26269 1 1 12 GLN C C -7.287 7.026 -6.239 1.00 . A A . 12 GLN C 1 1 43 26270 1 1 12 GLN CA C -6.231 6.370 -7.132 1.00 . A A . 12 GLN CA 1 1 43 26271 1 1 12 GLN CB C -6.772 6.163 -8.559 1.00 . A A . 12 GLN CB 1 1 43 26272 1 1 12 GLN CD C -8.942 7.440 -8.800 1.00 . A A . 12 GLN CD 1 1 43 26273 1 1 12 GLN CG C -8.290 6.078 -8.656 1.00 . A A . 12 GLN CG 1 1 43 26274 1 1 12 GLN H H -4.955 5.122 -5.990 1.00 . A A . 12 GLN H 1 1 43 26275 1 1 12 GLN HA H -5.381 7.034 -7.183 1.00 . A A . 12 GLN HA 1 1 43 26276 1 1 12 GLN HB2 H -6.444 6.987 -9.175 1.00 . A A . 12 GLN HB2 1 1 43 26277 1 1 12 GLN HB3 H -6.358 5.247 -8.955 1.00 . A A . 12 GLN HB3 1 1 43 26278 1 1 12 GLN HE21 H -10.725 6.590 -9.028 1.00 . A A . 12 GLN HE21 1 1 43 26279 1 1 12 GLN HE22 H -10.703 8.316 -9.087 1.00 . A A . 12 GLN HE22 1 1 43 26280 1 1 12 GLN HG2 H -8.551 5.479 -9.516 1.00 . A A . 12 GLN HG2 1 1 43 26281 1 1 12 GLN HG3 H -8.670 5.606 -7.762 1.00 . A A . 12 GLN HG3 1 1 43 26282 1 1 12 GLN N N -5.754 5.107 -6.558 1.00 . A A . 12 GLN N 1 1 43 26283 1 1 12 GLN NE2 N -10.256 7.449 -8.991 1.00 . A A . 12 GLN NE2 1 1 43 26284 1 1 12 GLN O O -7.358 8.252 -6.149 1.00 . A A . 12 GLN O 1 1 43 26285 1 1 12 GLN OE1 O -8.272 8.471 -8.739 1.00 . A A . 12 GLN OE1 1 1 43 26286 1 1 13 CYS C C -9.761 5.593 -3.873 1.00 . A A . 13 CYS C 1 1 43 26287 1 1 13 CYS CA C -9.148 6.718 -4.702 1.00 . A A . 13 CYS CA 1 1 43 26288 1 1 13 CYS CB C -10.236 7.417 -5.520 1.00 . A A . 13 CYS CB 1 1 43 26289 1 1 13 CYS H H -8.003 5.242 -5.691 1.00 . A A . 13 CYS H 1 1 43 26290 1 1 13 CYS HA H -8.696 7.436 -4.034 1.00 . A A . 13 CYS HA 1 1 43 26291 1 1 13 CYS HB2 H -9.774 8.131 -6.185 1.00 . A A . 13 CYS HB2 1 1 43 26292 1 1 13 CYS HB3 H -10.767 6.680 -6.104 1.00 . A A . 13 CYS HB3 1 1 43 26293 1 1 13 CYS N N -8.104 6.208 -5.582 1.00 . A A . 13 CYS N 1 1 43 26294 1 1 13 CYS O O -10.950 5.620 -3.557 1.00 . A A . 13 CYS O 1 1 43 26295 1 1 13 CYS SG S -11.463 8.315 -4.514 1.00 . A A . 13 CYS SG 1 1 43 26296 1 1 14 LYS C C -8.235 2.668 -2.191 1.00 . A A . 14 LYS C 1 1 43 26297 1 1 14 LYS CA C -9.410 3.474 -2.731 1.00 . A A . 14 LYS CA 1 1 43 26298 1 1 14 LYS CB C -10.317 2.575 -3.573 1.00 . A A . 14 LYS CB 1 1 43 26299 1 1 14 LYS CD C -11.849 0.587 -3.439 1.00 . A A . 14 LYS CD 1 1 43 26300 1 1 14 LYS CE C -11.123 -0.623 -2.877 1.00 . A A . 14 LYS CE 1 1 43 26301 1 1 14 LYS CG C -11.396 1.872 -2.765 1.00 . A A . 14 LYS CG 1 1 43 26302 1 1 14 LYS H H -8.004 4.637 -3.804 1.00 . A A . 14 LYS H 1 1 43 26303 1 1 14 LYS HA H -9.977 3.864 -1.899 1.00 . A A . 14 LYS HA 1 1 43 26304 1 1 14 LYS HB2 H -10.799 3.176 -4.330 1.00 . A A . 14 LYS HB2 1 1 43 26305 1 1 14 LYS HB3 H -9.711 1.822 -4.056 1.00 . A A . 14 LYS HB3 1 1 43 26306 1 1 14 LYS HD2 H -12.910 0.464 -3.281 1.00 . A A . 14 LYS HD2 1 1 43 26307 1 1 14 LYS HD3 H -11.647 0.658 -4.498 1.00 . A A . 14 LYS HD3 1 1 43 26308 1 1 14 LYS HE2 H -10.059 -0.471 -2.984 1.00 . A A . 14 LYS HE2 1 1 43 26309 1 1 14 LYS HE3 H -11.368 -0.720 -1.829 1.00 . A A . 14 LYS HE3 1 1 43 26310 1 1 14 LYS HG2 H -11.002 1.634 -1.788 1.00 . A A . 14 LYS HG2 1 1 43 26311 1 1 14 LYS HG3 H -12.244 2.533 -2.662 1.00 . A A . 14 LYS HG3 1 1 43 26312 1 1 14 LYS HZ1 H -11.414 -1.752 -4.610 1.00 . A A . 14 LYS HZ1 1 1 43 26313 1 1 14 LYS HZ2 H -10.887 -2.659 -3.282 1.00 . A A . 14 LYS HZ2 1 1 43 26314 1 1 14 LYS HZ3 H -12.490 -2.127 -3.360 1.00 . A A . 14 LYS HZ3 1 1 43 26315 1 1 14 LYS N N -8.943 4.605 -3.524 1.00 . A A . 14 LYS N 1 1 43 26316 1 1 14 LYS NZ N -11.505 -1.878 -3.581 1.00 . A A . 14 LYS NZ 1 1 43 26317 1 1 14 LYS O O -7.196 2.554 -2.842 1.00 . A A . 14 LYS O 1 1 43 26318 1 1 15 LEU C C -6.919 0.174 -1.289 1.00 . A A . 15 LEU C 1 1 43 26319 1 1 15 LEU CA C -7.359 1.310 -0.370 1.00 . A A . 15 LEU CA 1 1 43 26320 1 1 15 LEU CB C -7.853 0.744 0.964 1.00 . A A . 15 LEU CB 1 1 43 26321 1 1 15 LEU CD1 C -5.529 0.438 1.854 1.00 . A A . 15 LEU CD1 1 1 43 26322 1 1 15 LEU CD2 C -6.856 2.461 2.492 1.00 . A A . 15 LEU CD2 1 1 43 26323 1 1 15 LEU CG C -6.919 0.980 2.152 1.00 . A A . 15 LEU CG 1 1 43 26324 1 1 15 LEU H H -9.257 2.234 -0.529 1.00 . A A . 15 LEU H 1 1 43 26325 1 1 15 LEU HA H -6.515 1.956 -0.187 1.00 . A A . 15 LEU HA 1 1 43 26326 1 1 15 LEU HB2 H -8.809 1.196 1.190 1.00 . A A . 15 LEU HB2 1 1 43 26327 1 1 15 LEU HB3 H -7.995 -0.320 0.853 1.00 . A A . 15 LEU HB3 1 1 43 26328 1 1 15 LEU HD11 H -5.577 -0.237 1.012 1.00 . A A . 15 LEU HD11 1 1 43 26329 1 1 15 LEU HD12 H -4.865 1.257 1.620 1.00 . A A . 15 LEU HD12 1 1 43 26330 1 1 15 LEU HD13 H -5.156 -0.091 2.719 1.00 . A A . 15 LEU HD13 1 1 43 26331 1 1 15 LEU HD21 H -7.846 2.816 2.740 1.00 . A A . 15 LEU HD21 1 1 43 26332 1 1 15 LEU HD22 H -6.199 2.610 3.335 1.00 . A A . 15 LEU HD22 1 1 43 26333 1 1 15 LEU HD23 H -6.480 3.010 1.641 1.00 . A A . 15 LEU HD23 1 1 43 26334 1 1 15 LEU HG H -7.304 0.454 3.014 1.00 . A A . 15 LEU HG 1 1 43 26335 1 1 15 LEU N N -8.406 2.108 -0.998 1.00 . A A . 15 LEU N 1 1 43 26336 1 1 15 LEU O O -7.746 -0.593 -1.782 1.00 . A A . 15 LEU O 1 1 43 26337 1 1 16 LYS C C -5.540 -2.351 -1.934 1.00 . A A . 16 LYS C 1 1 43 26338 1 1 16 LYS CA C -5.068 -0.969 -2.382 1.00 . A A . 16 LYS CA 1 1 43 26339 1 1 16 LYS CB C -3.539 -0.914 -2.382 1.00 . A A . 16 LYS CB 1 1 43 26340 1 1 16 LYS CD C -1.654 -0.352 -3.945 1.00 . A A . 16 LYS CD 1 1 43 26341 1 1 16 LYS CE C -1.440 -0.002 -5.409 1.00 . A A . 16 LYS CE 1 1 43 26342 1 1 16 LYS CG C -2.921 -1.168 -3.747 1.00 . A A . 16 LYS CG 1 1 43 26343 1 1 16 LYS H H -5.002 0.716 -1.100 1.00 . A A . 16 LYS H 1 1 43 26344 1 1 16 LYS HA H -5.426 -0.786 -3.385 1.00 . A A . 16 LYS HA 1 1 43 26345 1 1 16 LYS HB2 H -3.226 0.063 -2.046 1.00 . A A . 16 LYS HB2 1 1 43 26346 1 1 16 LYS HB3 H -3.163 -1.658 -1.696 1.00 . A A . 16 LYS HB3 1 1 43 26347 1 1 16 LYS HD2 H -1.733 0.562 -3.376 1.00 . A A . 16 LYS HD2 1 1 43 26348 1 1 16 LYS HD3 H -0.809 -0.926 -3.594 1.00 . A A . 16 LYS HD3 1 1 43 26349 1 1 16 LYS HE2 H -2.392 -0.041 -5.918 1.00 . A A . 16 LYS HE2 1 1 43 26350 1 1 16 LYS HE3 H -1.040 0.999 -5.472 1.00 . A A . 16 LYS HE3 1 1 43 26351 1 1 16 LYS HG2 H -2.679 -2.216 -3.832 1.00 . A A . 16 LYS HG2 1 1 43 26352 1 1 16 LYS HG3 H -3.636 -0.898 -4.511 1.00 . A A . 16 LYS HG3 1 1 43 26353 1 1 16 LYS HZ1 H 0.270 -1.201 -5.420 1.00 . A A . 16 LYS HZ1 1 1 43 26354 1 1 16 LYS HZ2 H -0.999 -1.809 -6.360 1.00 . A A . 16 LYS HZ2 1 1 43 26355 1 1 16 LYS HZ3 H -0.084 -0.501 -6.918 1.00 . A A . 16 LYS HZ3 1 1 43 26356 1 1 16 LYS N N -5.613 0.074 -1.519 1.00 . A A . 16 LYS N 1 1 43 26357 1 1 16 LYS NZ N -0.497 -0.944 -6.073 1.00 . A A . 16 LYS NZ 1 1 43 26358 1 1 16 LYS O O -5.764 -2.584 -0.746 1.00 . A A . 16 LYS O 1 1 43 26359 1 1 17 PRO C C -5.326 -5.298 -1.465 1.00 . A A . 17 PRO C 1 1 43 26360 1 1 17 PRO CA C -6.147 -4.653 -2.577 1.00 . A A . 17 PRO CA 1 1 43 26361 1 1 17 PRO CB C -5.940 -5.399 -3.897 1.00 . A A . 17 PRO CB 1 1 43 26362 1 1 17 PRO CD C -5.453 -3.098 -4.325 1.00 . A A . 17 PRO CD 1 1 43 26363 1 1 17 PRO CG C -6.022 -4.345 -4.945 1.00 . A A . 17 PRO CG 1 1 43 26364 1 1 17 PRO HA H -7.193 -4.673 -2.309 1.00 . A A . 17 PRO HA 1 1 43 26365 1 1 17 PRO HB2 H -4.973 -5.881 -3.893 1.00 . A A . 17 PRO HB2 1 1 43 26366 1 1 17 PRO HB3 H -6.717 -6.139 -4.021 1.00 . A A . 17 PRO HB3 1 1 43 26367 1 1 17 PRO HD2 H -4.396 -3.024 -4.530 1.00 . A A . 17 PRO HD2 1 1 43 26368 1 1 17 PRO HD3 H -5.972 -2.224 -4.690 1.00 . A A . 17 PRO HD3 1 1 43 26369 1 1 17 PRO HG2 H -5.437 -4.636 -5.805 1.00 . A A . 17 PRO HG2 1 1 43 26370 1 1 17 PRO HG3 H -7.052 -4.186 -5.227 1.00 . A A . 17 PRO HG3 1 1 43 26371 1 1 17 PRO N N -5.698 -3.290 -2.883 1.00 . A A . 17 PRO N 1 1 43 26372 1 1 17 PRO O O -4.097 -5.222 -1.463 1.00 . A A . 17 PRO O 1 1 43 26373 1 1 18 ALA C C -4.381 -7.662 0.107 1.00 . A A . 18 ALA C 1 1 43 26374 1 1 18 ALA CA C -5.349 -6.591 0.597 1.00 . A A . 18 ALA CA 1 1 43 26375 1 1 18 ALA CB C -6.379 -7.199 1.538 1.00 . A A . 18 ALA CB 1 1 43 26376 1 1 18 ALA H H -6.992 -5.958 -0.578 1.00 . A A . 18 ALA H 1 1 43 26377 1 1 18 ALA HA H -4.795 -5.841 1.144 1.00 . A A . 18 ALA HA 1 1 43 26378 1 1 18 ALA HB1 H -7.323 -6.689 1.416 1.00 . A A . 18 ALA HB1 1 1 43 26379 1 1 18 ALA HB2 H -6.503 -8.246 1.307 1.00 . A A . 18 ALA HB2 1 1 43 26380 1 1 18 ALA HB3 H -6.041 -7.092 2.558 1.00 . A A . 18 ALA HB3 1 1 43 26381 1 1 18 ALA N N -6.014 -5.932 -0.521 1.00 . A A . 18 ALA N 1 1 43 26382 1 1 18 ALA O O -4.788 -8.644 -0.513 1.00 . A A . 18 ALA O 1 1 43 26383 1 1 19 GLY C C -1.324 -7.961 -1.255 1.00 . A A . 19 GLY C 1 1 43 26384 1 1 19 GLY CA C -2.091 -8.423 -0.030 1.00 . A A . 19 GLY CA 1 1 43 26385 1 1 19 GLY H H -2.831 -6.664 0.886 1.00 . A A . 19 GLY H 1 1 43 26386 1 1 19 GLY HA2 H -2.575 -9.361 -0.256 1.00 . A A . 19 GLY HA2 1 1 43 26387 1 1 19 GLY HA3 H -1.394 -8.574 0.781 1.00 . A A . 19 GLY HA3 1 1 43 26388 1 1 19 GLY N N -3.097 -7.465 0.389 1.00 . A A . 19 GLY N 1 1 43 26389 1 1 19 GLY O O -0.811 -8.778 -2.018 1.00 . A A . 19 GLY O 1 1 43 26390 1 1 20 THR C C 0.559 -5.123 -2.118 1.00 . A A . 20 THR C 1 1 43 26391 1 1 20 THR CA C -0.537 -6.078 -2.582 1.00 . A A . 20 THR CA 1 1 43 26392 1 1 20 THR CB C -1.513 -5.344 -3.503 1.00 . A A . 20 THR CB 1 1 43 26393 1 1 20 THR CG2 C -0.845 -4.720 -4.709 1.00 . A A . 20 THR CG2 1 1 43 26394 1 1 20 THR H H -1.676 -6.046 -0.798 1.00 . A A . 20 THR H 1 1 43 26395 1 1 20 THR HA H -0.082 -6.890 -3.128 1.00 . A A . 20 THR HA 1 1 43 26396 1 1 20 THR HB H -1.994 -4.554 -2.945 1.00 . A A . 20 THR HB 1 1 43 26397 1 1 20 THR HG1 H -3.105 -5.755 -4.568 1.00 . A A . 20 THR HG1 1 1 43 26398 1 1 20 THR HG21 H 0.224 -4.695 -4.556 1.00 . A A . 20 THR HG21 1 1 43 26399 1 1 20 THR HG22 H -1.069 -5.305 -5.589 1.00 . A A . 20 THR HG22 1 1 43 26400 1 1 20 THR HG23 H -1.213 -3.713 -4.844 1.00 . A A . 20 THR HG23 1 1 43 26401 1 1 20 THR N N -1.246 -6.647 -1.442 1.00 . A A . 20 THR N 1 1 43 26402 1 1 20 THR O O 0.278 -4.068 -1.550 1.00 . A A . 20 THR O 1 1 43 26403 1 1 20 THR OG1 O -2.515 -6.227 -3.976 1.00 . A A . 20 THR OG1 1 1 43 26404 1 1 21 THR C C 2.883 -3.308 -2.641 1.00 . A A . 21 THR C 1 1 43 26405 1 1 21 THR CA C 2.947 -4.678 -1.974 1.00 . A A . 21 THR CA 1 1 43 26406 1 1 21 THR CB C 4.256 -5.377 -2.343 1.00 . A A . 21 THR CB 1 1 43 26407 1 1 21 THR CG2 C 4.258 -5.938 -3.749 1.00 . A A . 21 THR CG2 1 1 43 26408 1 1 21 THR H H 1.969 -6.353 -2.823 1.00 . A A . 21 THR H 1 1 43 26409 1 1 21 THR HA H 2.909 -4.547 -0.903 1.00 . A A . 21 THR HA 1 1 43 26410 1 1 21 THR HB H 4.418 -6.197 -1.660 1.00 . A A . 21 THR HB 1 1 43 26411 1 1 21 THR HG1 H 5.329 -4.054 -1.377 1.00 . A A . 21 THR HG1 1 1 43 26412 1 1 21 THR HG21 H 3.291 -5.775 -4.202 1.00 . A A . 21 THR HG21 1 1 43 26413 1 1 21 THR HG22 H 5.018 -5.441 -4.333 1.00 . A A . 21 THR HG22 1 1 43 26414 1 1 21 THR HG23 H 4.465 -6.997 -3.713 1.00 . A A . 21 THR HG23 1 1 43 26415 1 1 21 THR N N 1.808 -5.501 -2.365 1.00 . A A . 21 THR N 1 1 43 26416 1 1 21 THR O O 2.385 -3.172 -3.758 1.00 . A A . 21 THR O 1 1 43 26417 1 1 21 THR OG1 O 5.350 -4.483 -2.235 1.00 . A A . 21 THR OG1 1 1 43 26418 1 1 22 CYS C C 4.766 -0.559 -3.014 1.00 . A A . 22 CYS C 1 1 43 26419 1 1 22 CYS CA C 3.390 -0.933 -2.472 1.00 . A A . 22 CYS CA 1 1 43 26420 1 1 22 CYS CB C 2.972 0.056 -1.384 1.00 . A A . 22 CYS CB 1 1 43 26421 1 1 22 CYS H H 3.773 -2.464 -1.062 1.00 . A A . 22 CYS H 1 1 43 26422 1 1 22 CYS HA H 2.675 -0.890 -3.280 1.00 . A A . 22 CYS HA 1 1 43 26423 1 1 22 CYS HB2 H 3.093 1.063 -1.756 1.00 . A A . 22 CYS HB2 1 1 43 26424 1 1 22 CYS HB3 H 1.932 -0.108 -1.139 1.00 . A A . 22 CYS HB3 1 1 43 26425 1 1 22 CYS N N 3.390 -2.294 -1.947 1.00 . A A . 22 CYS N 1 1 43 26426 1 1 22 CYS O O 4.881 0.208 -3.970 1.00 . A A . 22 CYS O 1 1 43 26427 1 1 22 CYS SG S 3.934 -0.082 0.158 1.00 . A A . 22 CYS SG 1 1 43 26428 1 1 23 TRP C C 7.971 -2.122 -2.969 1.00 . A A . 23 TRP C 1 1 43 26429 1 1 23 TRP CA C 7.177 -0.829 -2.817 1.00 . A A . 23 TRP CA 1 1 43 26430 1 1 23 TRP CB C 7.867 0.090 -1.807 1.00 . A A . 23 TRP CB 1 1 43 26431 1 1 23 TRP CD1 C 9.262 1.479 -3.447 1.00 . A A . 23 TRP CD1 1 1 43 26432 1 1 23 TRP CD2 C 10.437 0.599 -1.757 1.00 . A A . 23 TRP CD2 1 1 43 26433 1 1 23 TRP CE2 C 11.314 1.332 -2.579 1.00 . A A . 23 TRP CE2 1 1 43 26434 1 1 23 TRP CE3 C 10.952 -0.045 -0.628 1.00 . A A . 23 TRP CE3 1 1 43 26435 1 1 23 TRP CG C 9.129 0.706 -2.330 1.00 . A A . 23 TRP CG 1 1 43 26436 1 1 23 TRP CH2 C 13.152 0.799 -1.196 1.00 . A A . 23 TRP CH2 1 1 43 26437 1 1 23 TRP CZ2 C 12.676 1.438 -2.307 1.00 . A A . 23 TRP CZ2 1 1 43 26438 1 1 23 TRP CZ3 C 12.304 0.062 -0.360 1.00 . A A . 23 TRP CZ3 1 1 43 26439 1 1 23 TRP H H 5.653 -1.709 -1.640 1.00 . A A . 23 TRP H 1 1 43 26440 1 1 23 TRP HA H 7.136 -0.331 -3.774 1.00 . A A . 23 TRP HA 1 1 43 26441 1 1 23 TRP HB2 H 7.193 0.890 -1.539 1.00 . A A . 23 TRP HB2 1 1 43 26442 1 1 23 TRP HB3 H 8.114 -0.479 -0.923 1.00 . A A . 23 TRP HB3 1 1 43 26443 1 1 23 TRP HD1 H 8.447 1.744 -4.104 1.00 . A A . 23 TRP HD1 1 1 43 26444 1 1 23 TRP HE1 H 10.920 2.418 -4.331 1.00 . A A . 23 TRP HE1 1 1 43 26445 1 1 23 TRP HE3 H 10.314 -0.617 0.028 1.00 . A A . 23 TRP HE3 1 1 43 26446 1 1 23 TRP HH2 H 14.202 0.854 -0.948 1.00 . A A . 23 TRP HH2 1 1 43 26447 1 1 23 TRP HZ2 H 13.343 2.003 -2.942 1.00 . A A . 23 TRP HZ2 1 1 43 26448 1 1 23 TRP HZ3 H 12.720 -0.429 0.508 1.00 . A A . 23 TRP HZ3 1 1 43 26449 1 1 23 TRP N N 5.808 -1.105 -2.396 1.00 . A A . 23 TRP N 1 1 43 26450 1 1 23 TRP NE1 N 10.573 1.859 -3.604 1.00 . A A . 23 TRP NE1 1 1 43 26451 1 1 23 TRP O O 8.286 -2.789 -1.984 1.00 . A A . 23 TRP O 1 1 43 26452 1 1 24 ARG C C 10.242 -3.384 -5.393 1.00 . A A . 24 ARG C 1 1 43 26453 1 1 24 ARG CA C 9.048 -3.685 -4.494 1.00 . A A . 24 ARG CA 1 1 43 26454 1 1 24 ARG CB C 8.148 -4.731 -5.155 1.00 . A A . 24 ARG CB 1 1 43 26455 1 1 24 ARG CD C 7.253 -5.295 -7.434 1.00 . A A . 24 ARG CD 1 1 43 26456 1 1 24 ARG CG C 7.411 -4.212 -6.379 1.00 . A A . 24 ARG CG 1 1 43 26457 1 1 24 ARG CZ C 7.279 -5.505 -9.889 1.00 . A A . 24 ARG CZ 1 1 43 26458 1 1 24 ARG H H 8.011 -1.899 -4.956 1.00 . A A . 24 ARG H 1 1 43 26459 1 1 24 ARG HA H 9.409 -4.076 -3.555 1.00 . A A . 24 ARG HA 1 1 43 26460 1 1 24 ARG HB2 H 8.754 -5.572 -5.456 1.00 . A A . 24 ARG HB2 1 1 43 26461 1 1 24 ARG HB3 H 7.415 -5.065 -4.435 1.00 . A A . 24 ARG HB3 1 1 43 26462 1 1 24 ARG HD2 H 8.022 -6.038 -7.287 1.00 . A A . 24 ARG HD2 1 1 43 26463 1 1 24 ARG HD3 H 6.282 -5.755 -7.316 1.00 . A A . 24 ARG HD3 1 1 43 26464 1 1 24 ARG HE H 7.508 -3.796 -8.884 1.00 . A A . 24 ARG HE 1 1 43 26465 1 1 24 ARG HG2 H 6.432 -3.869 -6.080 1.00 . A A . 24 ARG HG2 1 1 43 26466 1 1 24 ARG HG3 H 7.970 -3.389 -6.802 1.00 . A A . 24 ARG HG3 1 1 43 26467 1 1 24 ARG HH11 H 6.998 -7.248 -8.902 1.00 . A A . 24 ARG HH11 1 1 43 26468 1 1 24 ARG HH12 H 7.020 -7.369 -10.629 1.00 . A A . 24 ARG HH12 1 1 43 26469 1 1 24 ARG HH21 H 7.537 -3.952 -11.156 1.00 . A A . 24 ARG HH21 1 1 43 26470 1 1 24 ARG HH22 H 7.327 -5.498 -11.910 1.00 . A A . 24 ARG HH22 1 1 43 26471 1 1 24 ARG N N 8.291 -2.471 -4.211 1.00 . A A . 24 ARG N 1 1 43 26472 1 1 24 ARG NE N 7.363 -4.760 -8.789 1.00 . A A . 24 ARG NE 1 1 43 26473 1 1 24 ARG NH1 N 7.083 -6.815 -9.799 1.00 . A A . 24 ARG NH1 1 1 43 26474 1 1 24 ARG NH2 N 7.390 -4.939 -11.083 1.00 . A A . 24 ARG NH2 1 1 43 26475 1 1 24 ARG O O 10.149 -2.575 -6.316 1.00 . A A . 24 ARG O 1 1 43 26476 1 1 25 THR C C 13.391 -5.132 -5.979 1.00 . A A . 25 THR C 1 1 43 26477 1 1 25 THR CA C 12.578 -3.844 -5.902 1.00 . A A . 25 THR CA 1 1 43 26478 1 1 25 THR CB C 13.427 -2.727 -5.293 1.00 . A A . 25 THR CB 1 1 43 26479 1 1 25 THR CG2 C 14.242 -1.969 -6.319 1.00 . A A . 25 THR CG2 1 1 43 26480 1 1 25 THR H H 11.377 -4.674 -4.369 1.00 . A A . 25 THR H 1 1 43 26481 1 1 25 THR HA H 12.284 -3.557 -6.900 1.00 . A A . 25 THR HA 1 1 43 26482 1 1 25 THR HB H 14.114 -3.159 -4.579 1.00 . A A . 25 THR HB 1 1 43 26483 1 1 25 THR HG1 H 12.530 -2.044 -3.692 1.00 . A A . 25 THR HG1 1 1 43 26484 1 1 25 THR HG21 H 13.977 -2.306 -7.310 1.00 . A A . 25 THR HG21 1 1 43 26485 1 1 25 THR HG22 H 14.039 -0.912 -6.231 1.00 . A A . 25 THR HG22 1 1 43 26486 1 1 25 THR HG23 H 15.294 -2.149 -6.147 1.00 . A A . 25 THR HG23 1 1 43 26487 1 1 25 THR N N 11.364 -4.041 -5.117 1.00 . A A . 25 THR N 1 1 43 26488 1 1 25 THR O O 14.621 -5.102 -5.991 1.00 . A A . 25 THR O 1 1 43 26489 1 1 25 THR OG1 O 12.611 -1.789 -4.615 1.00 . A A . 25 THR OG1 1 1 43 26490 1 1 26 SER C C 14.239 -7.796 -4.891 1.00 . A A . 26 SER C 1 1 43 26491 1 1 26 SER CA C 13.352 -7.562 -6.109 1.00 . A A . 26 SER CA 1 1 43 26492 1 1 26 SER CB C 14.185 -7.661 -7.388 1.00 . A A . 26 SER CB 1 1 43 26493 1 1 26 SER H H 11.715 -6.223 -6.020 1.00 . A A . 26 SER H 1 1 43 26494 1 1 26 SER HA H 12.584 -8.321 -6.131 1.00 . A A . 26 SER HA 1 1 43 26495 1 1 26 SER HB2 H 15.164 -7.242 -7.211 1.00 . A A . 26 SER HB2 1 1 43 26496 1 1 26 SER HB3 H 14.283 -8.699 -7.672 1.00 . A A . 26 SER HB3 1 1 43 26497 1 1 26 SER HG H 13.789 -7.377 -9.286 1.00 . A A . 26 SER HG 1 1 43 26498 1 1 26 SER N N 12.694 -6.263 -6.033 1.00 . A A . 26 SER N 1 1 43 26499 1 1 26 SER O O 15.292 -8.427 -4.989 1.00 . A A . 26 SER O 1 1 43 26500 1 1 26 SER OG O 13.573 -6.953 -8.452 1.00 . A A . 26 SER OG 1 1 43 26501 1 1 27 VAL C C 13.670 -7.238 -1.288 1.00 . A A . 27 VAL C 1 1 43 26502 1 1 27 VAL CA C 14.563 -7.436 -2.506 1.00 . A A . 27 VAL CA 1 1 43 26503 1 1 27 VAL CB C 15.736 -6.441 -2.436 1.00 . A A . 27 VAL CB 1 1 43 26504 1 1 27 VAL CG1 C 16.862 -6.874 -3.361 1.00 . A A . 27 VAL CG1 1 1 43 26505 1 1 27 VAL CG2 C 15.265 -5.035 -2.778 1.00 . A A . 27 VAL CG2 1 1 43 26506 1 1 27 VAL H H 12.961 -6.791 -3.729 1.00 . A A . 27 VAL H 1 1 43 26507 1 1 27 VAL HA H 14.965 -8.436 -2.484 1.00 . A A . 27 VAL HA 1 1 43 26508 1 1 27 VAL HB H 16.115 -6.433 -1.424 1.00 . A A . 27 VAL HB 1 1 43 26509 1 1 27 VAL HG11 H 17.027 -7.936 -3.255 1.00 . A A . 27 VAL HG11 1 1 43 26510 1 1 27 VAL HG12 H 16.593 -6.652 -4.384 1.00 . A A . 27 VAL HG12 1 1 43 26511 1 1 27 VAL HG13 H 17.766 -6.342 -3.103 1.00 . A A . 27 VAL HG13 1 1 43 26512 1 1 27 VAL HG21 H 14.649 -5.068 -3.664 1.00 . A A . 27 VAL HG21 1 1 43 26513 1 1 27 VAL HG22 H 14.691 -4.637 -1.955 1.00 . A A . 27 VAL HG22 1 1 43 26514 1 1 27 VAL HG23 H 16.121 -4.403 -2.959 1.00 . A A . 27 VAL HG23 1 1 43 26515 1 1 27 VAL N N 13.808 -7.283 -3.744 1.00 . A A . 27 VAL N 1 1 43 26516 1 1 27 VAL O O 13.732 -8.004 -0.326 1.00 . A A . 27 VAL O 1 1 43 26517 1 1 28 SER C C 10.495 -5.770 -0.741 1.00 . A A . 28 SER C 1 1 43 26518 1 1 28 SER CA C 11.930 -5.899 -0.239 1.00 . A A . 28 SER CA 1 1 43 26519 1 1 28 SER CB C 12.356 -4.606 0.460 1.00 . A A . 28 SER CB 1 1 43 26520 1 1 28 SER H H 12.840 -5.632 -2.132 1.00 . A A . 28 SER H 1 1 43 26521 1 1 28 SER HA H 11.979 -6.713 0.469 1.00 . A A . 28 SER HA 1 1 43 26522 1 1 28 SER HB2 H 11.788 -4.488 1.371 1.00 . A A . 28 SER HB2 1 1 43 26523 1 1 28 SER HB3 H 13.409 -4.657 0.696 1.00 . A A . 28 SER HB3 1 1 43 26524 1 1 28 SER HG H 12.954 -3.208 -0.776 1.00 . A A . 28 SER HG 1 1 43 26525 1 1 28 SER N N 12.840 -6.204 -1.337 1.00 . A A . 28 SER N 1 1 43 26526 1 1 28 SER O O 10.196 -4.928 -1.587 1.00 . A A . 28 SER O 1 1 43 26527 1 1 28 SER OG O 12.128 -3.479 -0.368 1.00 . A A . 28 SER OG 1 1 43 26528 1 1 29 SER C C 7.299 -6.589 0.618 1.00 . A A . 29 SER C 1 1 43 26529 1 1 29 SER CA C 8.208 -6.591 -0.607 1.00 . A A . 29 SER CA 1 1 43 26530 1 1 29 SER CB C 7.888 -7.797 -1.491 1.00 . A A . 29 SER CB 1 1 43 26531 1 1 29 SER H H 9.911 -7.259 0.459 1.00 . A A . 29 SER H 1 1 43 26532 1 1 29 SER HA H 8.035 -5.686 -1.170 1.00 . A A . 29 SER HA 1 1 43 26533 1 1 29 SER HB2 H 6.885 -7.699 -1.881 1.00 . A A . 29 SER HB2 1 1 43 26534 1 1 29 SER HB3 H 8.590 -7.836 -2.311 1.00 . A A . 29 SER HB3 1 1 43 26535 1 1 29 SER HG H 7.297 -9.018 -0.078 1.00 . A A . 29 SER HG 1 1 43 26536 1 1 29 SER N N 9.612 -6.611 -0.212 1.00 . A A . 29 SER N 1 1 43 26537 1 1 29 SER O O 7.206 -7.584 1.337 1.00 . A A . 29 SER O 1 1 43 26538 1 1 29 SER OG O 7.975 -9.006 -0.757 1.00 . A A . 29 SER OG 1 1 43 26539 1 1 30 HIS C C 4.272 -5.340 1.533 1.00 . A A . 30 HIS C 1 1 43 26540 1 1 30 HIS CA C 5.728 -5.332 1.989 1.00 . A A . 30 HIS CA 1 1 43 26541 1 1 30 HIS CB C 6.027 -4.043 2.756 1.00 . A A . 30 HIS CB 1 1 43 26542 1 1 30 HIS CD2 C 8.596 -4.071 2.399 1.00 . A A . 30 HIS CD2 1 1 43 26543 1 1 30 HIS CE1 C 9.206 -3.452 4.413 1.00 . A A . 30 HIS CE1 1 1 43 26544 1 1 30 HIS CG C 7.469 -3.888 3.128 1.00 . A A . 30 HIS CG 1 1 43 26545 1 1 30 HIS H H 6.745 -4.705 0.242 1.00 . A A . 30 HIS H 1 1 43 26546 1 1 30 HIS HA H 5.893 -6.176 2.642 1.00 . A A . 30 HIS HA 1 1 43 26547 1 1 30 HIS HB2 H 5.749 -3.197 2.147 1.00 . A A . 30 HIS HB2 1 1 43 26548 1 1 30 HIS HB3 H 5.445 -4.032 3.667 1.00 . A A . 30 HIS HB3 1 1 43 26549 1 1 30 HIS HD1 H 7.301 -3.294 5.142 1.00 . A A . 30 HIS HD1 1 1 43 26550 1 1 30 HIS HD2 H 8.648 -4.378 1.364 1.00 . A A . 30 HIS HD2 1 1 43 26551 1 1 30 HIS HE1 H 9.810 -3.180 5.265 1.00 . A A . 30 HIS HE1 1 1 43 26552 1 1 30 HIS HE2 H 10.605 -3.923 2.993 1.00 . A A . 30 HIS HE2 1 1 43 26553 1 1 30 HIS N N 6.630 -5.464 0.850 1.00 . A A . 30 HIS N 1 1 43 26554 1 1 30 HIS ND1 N 7.886 -3.502 4.384 1.00 . A A . 30 HIS ND1 1 1 43 26555 1 1 30 HIS NE2 N 9.661 -3.794 3.221 1.00 . A A . 30 HIS NE2 1 1 43 26556 1 1 30 HIS O O 3.717 -4.300 1.177 1.00 . A A . 30 HIS O 1 1 43 26557 1 1 31 TYR C C 1.348 -5.844 2.038 1.00 . A A . 31 TYR C 1 1 43 26558 1 1 31 TYR CA C 2.267 -6.662 1.137 1.00 . A A . 31 TYR CA 1 1 43 26559 1 1 31 TYR CB C 1.853 -8.134 1.168 1.00 . A A . 31 TYR CB 1 1 43 26560 1 1 31 TYR CD1 C 3.081 -10.047 0.069 1.00 . A A . 31 TYR CD1 1 1 43 26561 1 1 31 TYR CD2 C 1.912 -8.509 -1.328 1.00 . A A . 31 TYR CD2 1 1 43 26562 1 1 31 TYR CE1 C 3.483 -10.759 -1.045 1.00 . A A . 31 TYR CE1 1 1 43 26563 1 1 31 TYR CE2 C 2.310 -9.216 -2.447 1.00 . A A . 31 TYR CE2 1 1 43 26564 1 1 31 TYR CG C 2.290 -8.911 -0.053 1.00 . A A . 31 TYR CG 1 1 43 26565 1 1 31 TYR CZ C 3.095 -10.340 -2.300 1.00 . A A . 31 TYR CZ 1 1 43 26566 1 1 31 TYR H H 4.154 -7.312 1.843 1.00 . A A . 31 TYR H 1 1 43 26567 1 1 31 TYR HA H 2.181 -6.293 0.126 1.00 . A A . 31 TYR HA 1 1 43 26568 1 1 31 TYR HB2 H 2.290 -8.606 2.035 1.00 . A A . 31 TYR HB2 1 1 43 26569 1 1 31 TYR HB3 H 0.776 -8.196 1.234 1.00 . A A . 31 TYR HB3 1 1 43 26570 1 1 31 TYR HD1 H 3.383 -10.372 1.053 1.00 . A A . 31 TYR HD1 1 1 43 26571 1 1 31 TYR HD2 H 1.298 -7.628 -1.440 1.00 . A A . 31 TYR HD2 1 1 43 26572 1 1 31 TYR HE1 H 4.098 -11.640 -0.929 1.00 . A A . 31 TYR HE1 1 1 43 26573 1 1 31 TYR HE2 H 2.006 -8.888 -3.429 1.00 . A A . 31 TYR HE2 1 1 43 26574 1 1 31 TYR HH H 2.812 -11.680 -3.649 1.00 . A A . 31 TYR HH 1 1 43 26575 1 1 31 TYR N N 3.659 -6.519 1.548 1.00 . A A . 31 TYR N 1 1 43 26576 1 1 31 TYR O O 1.507 -5.834 3.259 1.00 . A A . 31 TYR O 1 1 43 26577 1 1 31 TYR OH O 3.493 -11.047 -3.411 1.00 . A A . 31 TYR OH 1 1 43 26578 1 1 32 CYS C C -1.543 -5.204 2.952 1.00 . A A . 32 CYS C 1 1 43 26579 1 1 32 CYS CA C -0.557 -4.335 2.177 1.00 . A A . 32 CYS CA 1 1 43 26580 1 1 32 CYS CB C -1.315 -3.402 1.230 1.00 . A A . 32 CYS CB 1 1 43 26581 1 1 32 CYS H H 0.311 -5.204 0.452 1.00 . A A . 32 CYS H 1 1 43 26582 1 1 32 CYS HA H 0.007 -3.740 2.879 1.00 . A A . 32 CYS HA 1 1 43 26583 1 1 32 CYS HB2 H -0.952 -3.549 0.225 1.00 . A A . 32 CYS HB2 1 1 43 26584 1 1 32 CYS HB3 H -2.368 -3.640 1.265 1.00 . A A . 32 CYS HB3 1 1 43 26585 1 1 32 CYS N N 0.387 -5.157 1.429 1.00 . A A . 32 CYS N 1 1 43 26586 1 1 32 CYS O O -1.568 -6.425 2.794 1.00 . A A . 32 CYS O 1 1 43 26587 1 1 32 CYS SG S -1.133 -1.633 1.628 1.00 . A A . 32 CYS SG 1 1 43 26588 1 1 33 THR C C -4.765 -4.960 4.118 1.00 . A A . 33 THR C 1 1 43 26589 1 1 33 THR CA C -3.345 -5.275 4.588 1.00 . A A . 33 THR CA 1 1 43 26590 1 1 33 THR CB C -3.194 -4.908 6.065 1.00 . A A . 33 THR CB 1 1 43 26591 1 1 33 THR CG2 C -3.027 -3.422 6.298 1.00 . A A . 33 THR CG2 1 1 43 26592 1 1 33 THR H H -2.285 -3.590 3.868 1.00 . A A . 33 THR H 1 1 43 26593 1 1 33 THR HA H -3.167 -6.334 4.470 1.00 . A A . 33 THR HA 1 1 43 26594 1 1 33 THR HB H -2.319 -5.405 6.461 1.00 . A A . 33 THR HB 1 1 43 26595 1 1 33 THR HG1 H -4.228 -5.063 7.721 1.00 . A A . 33 THR HG1 1 1 43 26596 1 1 33 THR HG21 H -3.336 -2.883 5.414 1.00 . A A . 33 THR HG21 1 1 43 26597 1 1 33 THR HG22 H -3.636 -3.118 7.136 1.00 . A A . 33 THR HG22 1 1 43 26598 1 1 33 THR HG23 H -1.991 -3.204 6.508 1.00 . A A . 33 THR HG23 1 1 43 26599 1 1 33 THR N N -2.354 -4.565 3.788 1.00 . A A . 33 THR N 1 1 43 26600 1 1 33 THR O O -5.739 -5.355 4.759 1.00 . A A . 33 THR O 1 1 43 26601 1 1 33 THR OG1 O -4.323 -5.336 6.806 1.00 . A A . 33 THR OG1 1 1 43 26602 1 1 34 GLY C C -7.046 -3.167 3.485 1.00 . A A . 34 GLY C 1 1 43 26603 1 1 34 GLY CA C -6.187 -3.899 2.472 1.00 . A A . 34 GLY CA 1 1 43 26604 1 1 34 GLY H H -4.072 -3.959 2.525 1.00 . A A . 34 GLY H 1 1 43 26605 1 1 34 GLY HA2 H -6.695 -4.804 2.172 1.00 . A A . 34 GLY HA2 1 1 43 26606 1 1 34 GLY HA3 H -6.056 -3.269 1.605 1.00 . A A . 34 GLY HA3 1 1 43 26607 1 1 34 GLY N N -4.879 -4.249 2.998 1.00 . A A . 34 GLY N 1 1 43 26608 1 1 34 GLY O O -8.274 -3.240 3.434 1.00 . A A . 34 GLY O 1 1 43 26609 1 1 35 ARG C C -6.707 -0.245 5.430 1.00 . A A . 35 ARG C 1 1 43 26610 1 1 35 ARG CA C -7.115 -1.714 5.437 1.00 . A A . 35 ARG CA 1 1 43 26611 1 1 35 ARG CB C -6.849 -2.323 6.815 1.00 . A A . 35 ARG CB 1 1 43 26612 1 1 35 ARG CD C -7.104 -0.659 8.681 1.00 . A A . 35 ARG CD 1 1 43 26613 1 1 35 ARG CG C -7.764 -1.786 7.904 1.00 . A A . 35 ARG CG 1 1 43 26614 1 1 35 ARG CZ C -6.874 0.073 11.023 1.00 . A A . 35 ARG CZ 1 1 43 26615 1 1 35 ARG H H -5.421 -2.442 4.397 1.00 . A A . 35 ARG H 1 1 43 26616 1 1 35 ARG HA H -8.168 -1.781 5.222 1.00 . A A . 35 ARG HA 1 1 43 26617 1 1 35 ARG HB2 H -6.984 -3.392 6.756 1.00 . A A . 35 ARG HB2 1 1 43 26618 1 1 35 ARG HB3 H -5.828 -2.113 7.098 1.00 . A A . 35 ARG HB3 1 1 43 26619 1 1 35 ARG HD2 H -6.033 -0.743 8.573 1.00 . A A . 35 ARG HD2 1 1 43 26620 1 1 35 ARG HD3 H -7.433 0.285 8.271 1.00 . A A . 35 ARG HD3 1 1 43 26621 1 1 35 ARG HE H -8.127 -1.343 10.385 1.00 . A A . 35 ARG HE 1 1 43 26622 1 1 35 ARG HG2 H -8.670 -1.414 7.448 1.00 . A A . 35 ARG HG2 1 1 43 26623 1 1 35 ARG HG3 H -8.005 -2.589 8.585 1.00 . A A . 35 ARG HG3 1 1 43 26624 1 1 35 ARG HH11 H -5.662 1.036 9.721 1.00 . A A . 35 ARG HH11 1 1 43 26625 1 1 35 ARG HH12 H -5.520 1.532 11.374 1.00 . A A . 35 ARG HH12 1 1 43 26626 1 1 35 ARG HH21 H -7.941 -0.692 12.559 1.00 . A A . 35 ARG HH21 1 1 43 26627 1 1 35 ARG HH22 H -6.813 0.551 12.985 1.00 . A A . 35 ARG HH22 1 1 43 26628 1 1 35 ARG N N -6.400 -2.461 4.408 1.00 . A A . 35 ARG N 1 1 43 26629 1 1 35 ARG NE N -7.442 -0.703 10.102 1.00 . A A . 35 ARG NE 1 1 43 26630 1 1 35 ARG NH1 N -5.942 0.953 10.677 1.00 . A A . 35 ARG NH1 1 1 43 26631 1 1 35 ARG NH2 N -7.239 -0.031 12.293 1.00 . A A . 35 ARG NH2 1 1 43 26632 1 1 35 ARG O O -7.551 0.645 5.528 1.00 . A A . 35 ARG O 1 1 43 26633 1 1 36 SER C C -3.922 1.556 4.127 1.00 . A A . 36 SER C 1 1 43 26634 1 1 36 SER CA C -4.884 1.359 5.294 1.00 . A A . 36 SER CA 1 1 43 26635 1 1 36 SER CB C -4.174 1.673 6.612 1.00 . A A . 36 SER CB 1 1 43 26636 1 1 36 SER H H -4.787 -0.755 5.240 1.00 . A A . 36 SER H 1 1 43 26637 1 1 36 SER HA H -5.718 2.034 5.176 1.00 . A A . 36 SER HA 1 1 43 26638 1 1 36 SER HB2 H -3.293 1.055 6.701 1.00 . A A . 36 SER HB2 1 1 43 26639 1 1 36 SER HB3 H -3.886 2.714 6.624 1.00 . A A . 36 SER HB3 1 1 43 26640 1 1 36 SER HG H -5.838 1.913 7.617 1.00 . A A . 36 SER HG 1 1 43 26641 1 1 36 SER N N -5.408 -0.001 5.314 1.00 . A A . 36 SER N 1 1 43 26642 1 1 36 SER O O -3.235 0.622 3.712 1.00 . A A . 36 SER O 1 1 43 26643 1 1 36 SER OG O -5.021 1.421 7.721 1.00 . A A . 36 SER OG 1 1 43 26644 1 1 37 CYS C C -1.538 3.130 2.930 1.00 . A A . 37 CYS C 1 1 43 26645 1 1 37 CYS CA C -2.998 3.096 2.484 1.00 . A A . 37 CYS CA 1 1 43 26646 1 1 37 CYS CB C -3.389 4.441 1.869 1.00 . A A . 37 CYS CB 1 1 43 26647 1 1 37 CYS H H -4.448 3.479 3.978 1.00 . A A . 37 CYS H 1 1 43 26648 1 1 37 CYS HA H -3.115 2.323 1.739 1.00 . A A . 37 CYS HA 1 1 43 26649 1 1 37 CYS HB2 H -3.907 5.031 2.611 1.00 . A A . 37 CYS HB2 1 1 43 26650 1 1 37 CYS HB3 H -2.495 4.963 1.562 1.00 . A A . 37 CYS HB3 1 1 43 26651 1 1 37 CYS N N -3.877 2.776 3.602 1.00 . A A . 37 CYS N 1 1 43 26652 1 1 37 CYS O O -0.628 2.981 2.116 1.00 . A A . 37 CYS O 1 1 43 26653 1 1 37 CYS SG S -4.479 4.304 0.414 1.00 . A A . 37 CYS SG 1 1 43 26654 1 1 38 GLU C C 0.590 1.976 4.970 1.00 . A A . 38 GLU C 1 1 43 26655 1 1 38 GLU CA C 0.027 3.380 4.777 1.00 . A A . 38 GLU CA 1 1 43 26656 1 1 38 GLU CB C 0.028 4.131 6.111 1.00 . A A . 38 GLU CB 1 1 43 26657 1 1 38 GLU CD C 1.223 6.350 5.937 1.00 . A A . 38 GLU CD 1 1 43 26658 1 1 38 GLU CG C -0.115 5.637 5.961 1.00 . A A . 38 GLU CG 1 1 43 26659 1 1 38 GLU H H -2.088 3.440 4.829 1.00 . A A . 38 GLU H 1 1 43 26660 1 1 38 GLU HA H 0.651 3.912 4.075 1.00 . A A . 38 GLU HA 1 1 43 26661 1 1 38 GLU HB2 H -0.792 3.771 6.714 1.00 . A A . 38 GLU HB2 1 1 43 26662 1 1 38 GLU HB3 H 0.957 3.928 6.623 1.00 . A A . 38 GLU HB3 1 1 43 26663 1 1 38 GLU HG2 H -0.633 5.846 5.037 1.00 . A A . 38 GLU HG2 1 1 43 26664 1 1 38 GLU HG3 H -0.694 6.014 6.791 1.00 . A A . 38 GLU HG3 1 1 43 26665 1 1 38 GLU N N -1.323 3.328 4.227 1.00 . A A . 38 GLU N 1 1 43 26666 1 1 38 GLU O O 0.161 1.242 5.861 1.00 . A A . 38 GLU O 1 1 43 26667 1 1 38 GLU OE1 O 1.393 7.264 5.104 1.00 . A A . 38 GLU OE1 1 1 43 26668 1 1 38 GLU OE2 O 2.099 5.995 6.753 1.00 . A A . 38 GLU OE2 1 1 43 26669 1 1 39 CYS C C 2.830 0.078 5.570 1.00 . A A . 39 CYS C 1 1 43 26670 1 1 39 CYS CA C 2.173 0.291 4.208 1.00 . A A . 39 CYS CA 1 1 43 26671 1 1 39 CYS CB C 3.211 0.128 3.097 1.00 . A A . 39 CYS CB 1 1 43 26672 1 1 39 CYS H H 1.851 2.238 3.441 1.00 . A A . 39 CYS H 1 1 43 26673 1 1 39 CYS HA H 1.397 -0.448 4.075 1.00 . A A . 39 CYS HA 1 1 43 26674 1 1 39 CYS HB2 H 3.631 1.094 2.862 1.00 . A A . 39 CYS HB2 1 1 43 26675 1 1 39 CYS HB3 H 3.998 -0.527 3.443 1.00 . A A . 39 CYS HB3 1 1 43 26676 1 1 39 CYS N N 1.552 1.609 4.130 1.00 . A A . 39 CYS N 1 1 43 26677 1 1 39 CYS O O 3.333 1.022 6.179 1.00 . A A . 39 CYS O 1 1 43 26678 1 1 39 CYS SG S 2.544 -0.574 1.553 1.00 . A A . 39 CYS SG 1 1 43 26679 1 1 40 PRO C C 4.880 -1.023 7.471 1.00 . A A . 40 PRO C 1 1 43 26680 1 1 40 PRO CA C 3.436 -1.503 7.363 1.00 . A A . 40 PRO CA 1 1 43 26681 1 1 40 PRO CB C 3.378 -3.032 7.406 1.00 . A A . 40 PRO CB 1 1 43 26682 1 1 40 PRO CD C 2.258 -2.357 5.406 1.00 . A A . 40 PRO CD 1 1 43 26683 1 1 40 PRO CG C 2.258 -3.395 6.493 1.00 . A A . 40 PRO CG 1 1 43 26684 1 1 40 PRO HA H 2.861 -1.095 8.181 1.00 . A A . 40 PRO HA 1 1 43 26685 1 1 40 PRO HB2 H 4.317 -3.440 7.062 1.00 . A A . 40 PRO HB2 1 1 43 26686 1 1 40 PRO HB3 H 3.185 -3.360 8.416 1.00 . A A . 40 PRO HB3 1 1 43 26687 1 1 40 PRO HD2 H 2.875 -2.677 4.579 1.00 . A A . 40 PRO HD2 1 1 43 26688 1 1 40 PRO HD3 H 1.250 -2.160 5.073 1.00 . A A . 40 PRO HD3 1 1 43 26689 1 1 40 PRO HG2 H 2.429 -4.376 6.075 1.00 . A A . 40 PRO HG2 1 1 43 26690 1 1 40 PRO HG3 H 1.323 -3.373 7.032 1.00 . A A . 40 PRO HG3 1 1 43 26691 1 1 40 PRO N N 2.836 -1.172 6.067 1.00 . A A . 40 PRO N 1 1 43 26692 1 1 40 PRO O O 5.433 -0.470 6.521 1.00 . A A . 40 PRO O 1 1 43 26693 1 1 41 SER C C 7.814 -2.013 8.724 1.00 . A A . 41 SER C 1 1 43 26694 1 1 41 SER CA C 6.864 -0.829 8.867 1.00 . A A . 41 SER CA 1 1 43 26695 1 1 41 SER CB C 7.007 -0.211 10.260 1.00 . A A . 41 SER CB 1 1 43 26696 1 1 41 SER H H 4.990 -1.684 9.354 1.00 . A A . 41 SER H 1 1 43 26697 1 1 41 SER HA H 7.118 -0.086 8.126 1.00 . A A . 41 SER HA 1 1 43 26698 1 1 41 SER HB2 H 8.051 -0.029 10.465 1.00 . A A . 41 SER HB2 1 1 43 26699 1 1 41 SER HB3 H 6.465 0.722 10.294 1.00 . A A . 41 SER HB3 1 1 43 26700 1 1 41 SER HG H 7.157 -1.727 11.492 1.00 . A A . 41 SER HG 1 1 43 26701 1 1 41 SER N N 5.484 -1.239 8.635 1.00 . A A . 41 SER N 1 1 43 26702 1 1 41 SER O O 8.965 -1.852 8.315 1.00 . A A . 41 SER O 1 1 43 26703 1 1 41 SER OG O 6.491 -1.076 11.257 1.00 . A A . 41 SER OG 1 1 43 26704 1 1 42 TYR C C 8.030 -5.032 7.578 1.00 . A A . 42 TYR C 1 1 43 26705 1 1 42 TYR CA C 8.132 -4.414 8.970 1.00 . A A . 42 TYR CA 1 1 43 26706 1 1 42 TYR CB C 7.686 -5.428 10.025 1.00 . A A . 42 TYR CB 1 1 43 26707 1 1 42 TYR CD1 C 5.199 -5.206 10.399 1.00 . A A . 42 TYR CD1 1 1 43 26708 1 1 42 TYR CD2 C 5.984 -7.056 9.116 1.00 . A A . 42 TYR CD2 1 1 43 26709 1 1 42 TYR CE1 C 3.897 -5.639 10.235 1.00 . A A . 42 TYR CE1 1 1 43 26710 1 1 42 TYR CE2 C 4.684 -7.496 8.948 1.00 . A A . 42 TYR CE2 1 1 43 26711 1 1 42 TYR CG C 6.263 -5.906 9.843 1.00 . A A . 42 TYR CG 1 1 43 26712 1 1 42 TYR CZ C 3.645 -6.784 9.509 1.00 . A A . 42 TYR CZ 1 1 43 26713 1 1 42 TYR H H 6.401 -3.266 9.380 1.00 . A A . 42 TYR H 1 1 43 26714 1 1 42 TYR HA H 9.160 -4.142 9.156 1.00 . A A . 42 TYR HA 1 1 43 26715 1 1 42 TYR HB2 H 8.333 -6.291 9.980 1.00 . A A . 42 TYR HB2 1 1 43 26716 1 1 42 TYR HB3 H 7.764 -4.977 11.003 1.00 . A A . 42 TYR HB3 1 1 43 26717 1 1 42 TYR HD1 H 5.400 -4.310 10.967 1.00 . A A . 42 TYR HD1 1 1 43 26718 1 1 42 TYR HD2 H 6.800 -7.612 8.678 1.00 . A A . 42 TYR HD2 1 1 43 26719 1 1 42 TYR HE1 H 3.084 -5.082 10.675 1.00 . A A . 42 TYR HE1 1 1 43 26720 1 1 42 TYR HE2 H 4.487 -8.392 8.379 1.00 . A A . 42 TYR HE2 1 1 43 26721 1 1 42 TYR HH H 1.774 -6.463 9.203 1.00 . A A . 42 TYR HH 1 1 43 26722 1 1 42 TYR N N 7.326 -3.202 9.062 1.00 . A A . 42 TYR N 1 1 43 26723 1 1 42 TYR O O 7.094 -4.747 6.830 1.00 . A A . 42 TYR O 1 1 43 26724 1 1 42 TYR OH O 2.350 -7.219 9.344 1.00 . A A . 42 TYR OH 1 1 43 26725 1 1 43 PRO C C 7.691 -7.250 5.590 1.00 . A A . 43 PRO C 1 1 43 26726 1 1 43 PRO CA C 9.010 -6.551 5.900 1.00 . A A . 43 PRO CA 1 1 43 26727 1 1 43 PRO CB C 10.141 -7.574 6.028 1.00 . A A . 43 PRO CB 1 1 43 26728 1 1 43 PRO CD C 10.148 -6.288 8.042 1.00 . A A . 43 PRO CD 1 1 43 26729 1 1 43 PRO CG C 11.040 -7.016 7.076 1.00 . A A . 43 PRO CG 1 1 43 26730 1 1 43 PRO HA H 9.240 -5.852 5.109 1.00 . A A . 43 PRO HA 1 1 43 26731 1 1 43 PRO HB2 H 9.733 -8.530 6.324 1.00 . A A . 43 PRO HB2 1 1 43 26732 1 1 43 PRO HB3 H 10.651 -7.671 5.081 1.00 . A A . 43 PRO HB3 1 1 43 26733 1 1 43 PRO HD2 H 9.839 -6.946 8.840 1.00 . A A . 43 PRO HD2 1 1 43 26734 1 1 43 PRO HD3 H 10.652 -5.419 8.440 1.00 . A A . 43 PRO HD3 1 1 43 26735 1 1 43 PRO HG2 H 11.561 -7.818 7.578 1.00 . A A . 43 PRO HG2 1 1 43 26736 1 1 43 PRO HG3 H 11.745 -6.332 6.628 1.00 . A A . 43 PRO HG3 1 1 43 26737 1 1 43 PRO N N 8.996 -5.891 7.210 1.00 . A A . 43 PRO N 1 1 43 26738 1 1 43 PRO O O 6.740 -7.178 6.369 1.00 . A A . 43 PRO O 1 1 43 26739 1 1 44 GLY C C 6.198 -9.883 4.877 1.00 . A A . 44 GLY C 1 1 43 26740 1 1 44 GLY CA C 6.433 -8.631 4.055 1.00 . A A . 44 GLY CA 1 1 43 26741 1 1 44 GLY H H 8.429 -7.950 3.867 1.00 . A A . 44 GLY H 1 1 43 26742 1 1 44 GLY HA2 H 6.513 -8.907 3.014 1.00 . A A . 44 GLY HA2 1 1 43 26743 1 1 44 GLY HA3 H 5.589 -7.969 4.177 1.00 . A A . 44 GLY HA3 1 1 43 26744 1 1 44 GLY N N 7.641 -7.928 4.448 1.00 . A A . 44 GLY N 1 1 43 26745 1 1 44 GLY O O 5.881 -10.933 4.280 1.00 . A A . 44 GLY O 1 1 43 26746 1 1 44 GLY OXT O 6.331 -9.813 6.117 1.00 . A A . 44 GLY OXT 1 1 44 26747 1 1 1 ALA C C -14.330 14.044 -2.347 1.00 . A A . 1 ALA C 1 1 44 26748 1 1 1 ALA CA C -14.704 15.102 -3.379 1.00 . A A . 1 ALA CA 1 1 44 26749 1 1 1 ALA CB C -16.190 15.027 -3.696 1.00 . A A . 1 ALA CB 1 1 44 26750 1 1 1 ALA H1 H -12.928 14.717 -4.342 1.00 . A A . 1 ALA H1 1 1 44 26751 1 1 1 ALA H2 H -14.326 14.169 -5.173 1.00 . A A . 1 ALA H2 1 1 44 26752 1 1 1 ALA H3 H -13.947 15.840 -5.144 1.00 . A A . 1 ALA H3 1 1 44 26753 1 1 1 ALA HA H -14.499 16.079 -2.966 1.00 . A A . 1 ALA HA 1 1 44 26754 1 1 1 ALA HB1 H -16.358 15.348 -4.714 1.00 . A A . 1 ALA HB1 1 1 44 26755 1 1 1 ALA HB2 H -16.532 14.010 -3.578 1.00 . A A . 1 ALA HB2 1 1 44 26756 1 1 1 ALA HB3 H -16.735 15.671 -3.021 1.00 . A A . 1 ALA HB3 1 1 44 26757 1 1 1 ALA N N -13.904 14.943 -4.621 1.00 . A A . 1 ALA N 1 1 44 26758 1 1 1 ALA O O -13.701 13.038 -2.676 1.00 . A A . 1 ALA O 1 1 44 26759 1 1 2 MET C C -12.920 13.165 0.150 1.00 . A A . 2 MET C 1 1 44 26760 1 1 2 MET CA C -14.425 13.344 -0.018 1.00 . A A . 2 MET CA 1 1 44 26761 1 1 2 MET CB C -15.085 11.991 -0.291 1.00 . A A . 2 MET CB 1 1 44 26762 1 1 2 MET CE C -16.990 9.679 2.577 1.00 . A A . 2 MET CE 1 1 44 26763 1 1 2 MET CG C -15.289 11.150 0.958 1.00 . A A . 2 MET CG 1 1 44 26764 1 1 2 MET H H -15.218 15.098 -0.899 1.00 . A A . 2 MET H 1 1 44 26765 1 1 2 MET HA H -14.831 13.755 0.894 1.00 . A A . 2 MET HA 1 1 44 26766 1 1 2 MET HB2 H -16.049 12.159 -0.747 1.00 . A A . 2 MET HB2 1 1 44 26767 1 1 2 MET HB3 H -14.464 11.433 -0.977 1.00 . A A . 2 MET HB3 1 1 44 26768 1 1 2 MET HE1 H -16.471 10.397 3.196 1.00 . A A . 2 MET HE1 1 1 44 26769 1 1 2 MET HE2 H -18.045 9.704 2.805 1.00 . A A . 2 MET HE2 1 1 44 26770 1 1 2 MET HE3 H -16.603 8.690 2.772 1.00 . A A . 2 MET HE3 1 1 44 26771 1 1 2 MET HG2 H -14.417 10.530 1.104 1.00 . A A . 2 MET HG2 1 1 44 26772 1 1 2 MET HG3 H -15.404 11.811 1.805 1.00 . A A . 2 MET HG3 1 1 44 26773 1 1 2 MET N N -14.720 14.278 -1.099 1.00 . A A . 2 MET N 1 1 44 26774 1 1 2 MET O O -12.142 13.485 -0.748 1.00 . A A . 2 MET O 1 1 44 26775 1 1 2 MET SD S -16.742 10.088 0.851 1.00 . A A . 2 MET SD 1 1 44 26776 1 1 3 ASP C C -10.535 11.330 0.702 1.00 . A A . 3 ASP C 1 1 44 26777 1 1 3 ASP CA C -11.104 12.428 1.594 1.00 . A A . 3 ASP CA 1 1 44 26778 1 1 3 ASP CB C -10.913 12.056 3.066 1.00 . A A . 3 ASP CB 1 1 44 26779 1 1 3 ASP CG C -11.786 10.889 3.485 1.00 . A A . 3 ASP CG 1 1 44 26780 1 1 3 ASP H H -13.185 12.415 1.985 1.00 . A A . 3 ASP H 1 1 44 26781 1 1 3 ASP HA H -10.577 13.348 1.394 1.00 . A A . 3 ASP HA 1 1 44 26782 1 1 3 ASP HB2 H -9.881 11.786 3.231 1.00 . A A . 3 ASP HB2 1 1 44 26783 1 1 3 ASP HB3 H -11.162 12.908 3.681 1.00 . A A . 3 ASP HB3 1 1 44 26784 1 1 3 ASP N N -12.517 12.650 1.308 1.00 . A A . 3 ASP N 1 1 44 26785 1 1 3 ASP O O -11.256 10.433 0.267 1.00 . A A . 3 ASP O 1 1 44 26786 1 1 3 ASP OD1 O -11.735 9.838 2.812 1.00 . A A . 3 ASP OD1 1 1 44 26787 1 1 3 ASP OD2 O -12.521 11.026 4.485 1.00 . A A . 3 ASP OD2 1 1 44 26788 1 1 4 CYS C C -7.158 10.138 0.099 1.00 . A A . 4 CYS C 1 1 44 26789 1 1 4 CYS CA C -8.568 10.420 -0.407 1.00 . A A . 4 CYS CA 1 1 44 26790 1 1 4 CYS CB C -8.513 10.907 -1.857 1.00 . A A . 4 CYS CB 1 1 44 26791 1 1 4 CYS H H -8.713 12.147 0.809 1.00 . A A . 4 CYS H 1 1 44 26792 1 1 4 CYS HA H -9.143 9.507 -0.366 1.00 . A A . 4 CYS HA 1 1 44 26793 1 1 4 CYS HB2 H -7.993 11.853 -1.891 1.00 . A A . 4 CYS HB2 1 1 44 26794 1 1 4 CYS HB3 H -7.973 10.184 -2.451 1.00 . A A . 4 CYS HB3 1 1 44 26795 1 1 4 CYS N N -9.235 11.408 0.433 1.00 . A A . 4 CYS N 1 1 44 26796 1 1 4 CYS O O -6.301 11.022 0.105 1.00 . A A . 4 CYS O 1 1 44 26797 1 1 4 CYS SG S -10.148 11.147 -2.623 1.00 . A A . 4 CYS SG 1 1 44 26798 1 1 5 THR C C -4.593 8.437 -0.101 1.00 . A A . 5 THR C 1 1 44 26799 1 1 5 THR CA C -5.616 8.501 1.030 1.00 . A A . 5 THR CA 1 1 44 26800 1 1 5 THR CB C -5.710 7.143 1.729 1.00 . A A . 5 THR CB 1 1 44 26801 1 1 5 THR CG2 C -6.222 7.237 3.150 1.00 . A A . 5 THR CG2 1 1 44 26802 1 1 5 THR H H -7.647 8.239 0.492 1.00 . A A . 5 THR H 1 1 44 26803 1 1 5 THR HA H -5.297 9.243 1.746 1.00 . A A . 5 THR HA 1 1 44 26804 1 1 5 THR HB H -4.727 6.697 1.760 1.00 . A A . 5 THR HB 1 1 44 26805 1 1 5 THR HG1 H -6.366 6.311 0.082 1.00 . A A . 5 THR HG1 1 1 44 26806 1 1 5 THR HG21 H -6.642 8.217 3.318 1.00 . A A . 5 THR HG21 1 1 44 26807 1 1 5 THR HG22 H -6.982 6.487 3.309 1.00 . A A . 5 THR HG22 1 1 44 26808 1 1 5 THR HG23 H -5.405 7.072 3.838 1.00 . A A . 5 THR HG23 1 1 44 26809 1 1 5 THR N N -6.924 8.900 0.523 1.00 . A A . 5 THR N 1 1 44 26810 1 1 5 THR O O -4.094 7.364 -0.442 1.00 . A A . 5 THR O 1 1 44 26811 1 1 5 THR OG1 O -6.572 6.272 1.019 1.00 . A A . 5 THR OG1 1 1 44 26812 1 1 6 THR C C -1.969 9.120 -1.349 1.00 . A A . 6 THR C 1 1 44 26813 1 1 6 THR CA C -3.326 9.669 -1.775 1.00 . A A . 6 THR CA 1 1 44 26814 1 1 6 THR CB C -3.177 11.115 -2.251 1.00 . A A . 6 THR CB 1 1 44 26815 1 1 6 THR CG2 C -4.185 11.503 -3.311 1.00 . A A . 6 THR CG2 1 1 44 26816 1 1 6 THR H H -4.720 10.414 -0.367 1.00 . A A . 6 THR H 1 1 44 26817 1 1 6 THR HA H -3.703 9.070 -2.590 1.00 . A A . 6 THR HA 1 1 44 26818 1 1 6 THR HB H -2.190 11.246 -2.670 1.00 . A A . 6 THR HB 1 1 44 26819 1 1 6 THR HG1 H -2.643 11.845 -0.513 1.00 . A A . 6 THR HG1 1 1 44 26820 1 1 6 THR HG21 H -4.827 10.660 -3.523 1.00 . A A . 6 THR HG21 1 1 44 26821 1 1 6 THR HG22 H -4.782 12.330 -2.955 1.00 . A A . 6 THR HG22 1 1 44 26822 1 1 6 THR HG23 H -3.666 11.795 -4.212 1.00 . A A . 6 THR HG23 1 1 44 26823 1 1 6 THR N N -4.288 9.593 -0.681 1.00 . A A . 6 THR N 1 1 44 26824 1 1 6 THR O O -1.110 9.860 -0.869 1.00 . A A . 6 THR O 1 1 44 26825 1 1 6 THR OG1 O -3.324 12.017 -1.168 1.00 . A A . 6 THR OG1 1 1 44 26826 1 1 7 GLY C C -0.194 5.998 -2.035 1.00 . A A . 7 GLY C 1 1 44 26827 1 1 7 GLY CA C -0.529 7.188 -1.156 1.00 . A A . 7 GLY CA 1 1 44 26828 1 1 7 GLY H H -2.503 7.276 -1.913 1.00 . A A . 7 GLY H 1 1 44 26829 1 1 7 GLY HA2 H -0.594 6.856 -0.130 1.00 . A A . 7 GLY HA2 1 1 44 26830 1 1 7 GLY HA3 H 0.264 7.917 -1.238 1.00 . A A . 7 GLY HA3 1 1 44 26831 1 1 7 GLY N N -1.783 7.816 -1.527 1.00 . A A . 7 GLY N 1 1 44 26832 1 1 7 GLY O O -0.898 5.725 -3.007 1.00 . A A . 7 GLY O 1 1 44 26833 1 1 8 PRO C C 0.375 2.900 -2.297 1.00 . A A . 8 PRO C 1 1 44 26834 1 1 8 PRO CA C 1.304 4.094 -2.496 1.00 . A A . 8 PRO CA 1 1 44 26835 1 1 8 PRO CB C 2.697 3.784 -1.947 1.00 . A A . 8 PRO CB 1 1 44 26836 1 1 8 PRO CD C 1.785 5.517 -0.574 1.00 . A A . 8 PRO CD 1 1 44 26837 1 1 8 PRO CG C 2.677 4.306 -0.553 1.00 . A A . 8 PRO CG 1 1 44 26838 1 1 8 PRO HA H 1.371 4.324 -3.549 1.00 . A A . 8 PRO HA 1 1 44 26839 1 1 8 PRO HB2 H 2.866 2.717 -1.969 1.00 . A A . 8 PRO HB2 1 1 44 26840 1 1 8 PRO HB3 H 3.443 4.286 -2.545 1.00 . A A . 8 PRO HB3 1 1 44 26841 1 1 8 PRO HD2 H 1.225 5.590 0.347 1.00 . A A . 8 PRO HD2 1 1 44 26842 1 1 8 PRO HD3 H 2.368 6.412 -0.735 1.00 . A A . 8 PRO HD3 1 1 44 26843 1 1 8 PRO HG2 H 2.275 3.557 0.114 1.00 . A A . 8 PRO HG2 1 1 44 26844 1 1 8 PRO HG3 H 3.676 4.582 -0.249 1.00 . A A . 8 PRO HG3 1 1 44 26845 1 1 8 PRO N N 0.886 5.264 -1.717 1.00 . A A . 8 PRO N 1 1 44 26846 1 1 8 PRO O O 0.270 2.033 -3.165 1.00 . A A . 8 PRO O 1 1 44 26847 1 1 9 CYS C C -2.658 2.161 -1.139 1.00 . A A . 9 CYS C 1 1 44 26848 1 1 9 CYS CA C -1.212 1.768 -0.840 1.00 . A A . 9 CYS CA 1 1 44 26849 1 1 9 CYS CB C -1.072 1.361 0.628 1.00 . A A . 9 CYS CB 1 1 44 26850 1 1 9 CYS H H -0.169 3.578 -0.496 1.00 . A A . 9 CYS H 1 1 44 26851 1 1 9 CYS HA H -0.946 0.927 -1.463 1.00 . A A . 9 CYS HA 1 1 44 26852 1 1 9 CYS HB2 H -0.636 2.179 1.180 1.00 . A A . 9 CYS HB2 1 1 44 26853 1 1 9 CYS HB3 H -2.051 1.144 1.030 1.00 . A A . 9 CYS HB3 1 1 44 26854 1 1 9 CYS N N -0.295 2.859 -1.150 1.00 . A A . 9 CYS N 1 1 44 26855 1 1 9 CYS O O -3.592 1.606 -0.561 1.00 . A A . 9 CYS O 1 1 44 26856 1 1 9 CYS SG S -0.025 -0.106 0.895 1.00 . A A . 9 CYS SG 1 1 44 26857 1 1 10 CYS C C -4.215 3.946 -3.900 1.00 . A A . 10 CYS C 1 1 44 26858 1 1 10 CYS CA C -4.166 3.579 -2.420 1.00 . A A . 10 CYS CA 1 1 44 26859 1 1 10 CYS CB C -4.570 4.785 -1.571 1.00 . A A . 10 CYS CB 1 1 44 26860 1 1 10 CYS H H -2.051 3.521 -2.473 1.00 . A A . 10 CYS H 1 1 44 26861 1 1 10 CYS HA H -4.861 2.773 -2.238 1.00 . A A . 10 CYS HA 1 1 44 26862 1 1 10 CYS HB2 H -3.969 5.635 -1.856 1.00 . A A . 10 CYS HB2 1 1 44 26863 1 1 10 CYS HB3 H -5.611 5.010 -1.750 1.00 . A A . 10 CYS HB3 1 1 44 26864 1 1 10 CYS N N -2.834 3.117 -2.045 1.00 . A A . 10 CYS N 1 1 44 26865 1 1 10 CYS O O -3.212 4.365 -4.479 1.00 . A A . 10 CYS O 1 1 44 26866 1 1 10 CYS SG S -4.356 4.534 0.221 1.00 . A A . 10 CYS SG 1 1 44 26867 1 1 11 ARG C C -6.797 4.966 -6.139 1.00 . A A . 11 ARG C 1 1 44 26868 1 1 11 ARG CA C -5.562 4.098 -5.921 1.00 . A A . 11 ARG CA 1 1 44 26869 1 1 11 ARG CB C -5.679 2.811 -6.740 1.00 . A A . 11 ARG CB 1 1 44 26870 1 1 11 ARG CD C -6.039 3.269 -9.184 1.00 . A A . 11 ARG CD 1 1 44 26871 1 1 11 ARG CG C -5.028 2.900 -8.110 1.00 . A A . 11 ARG CG 1 1 44 26872 1 1 11 ARG CZ C -5.795 1.342 -10.700 1.00 . A A . 11 ARG CZ 1 1 44 26873 1 1 11 ARG H H -6.149 3.445 -3.995 1.00 . A A . 11 ARG H 1 1 44 26874 1 1 11 ARG HA H -4.690 4.644 -6.250 1.00 . A A . 11 ARG HA 1 1 44 26875 1 1 11 ARG HB2 H -5.208 2.006 -6.193 1.00 . A A . 11 ARG HB2 1 1 44 26876 1 1 11 ARG HB3 H -6.725 2.578 -6.876 1.00 . A A . 11 ARG HB3 1 1 44 26877 1 1 11 ARG HD2 H -6.870 3.777 -8.718 1.00 . A A . 11 ARG HD2 1 1 44 26878 1 1 11 ARG HD3 H -5.565 3.932 -9.893 1.00 . A A . 11 ARG HD3 1 1 44 26879 1 1 11 ARG HE H -7.480 1.852 -9.759 1.00 . A A . 11 ARG HE 1 1 44 26880 1 1 11 ARG HG2 H -4.256 3.654 -8.083 1.00 . A A . 11 ARG HG2 1 1 44 26881 1 1 11 ARG HG3 H -4.591 1.942 -8.353 1.00 . A A . 11 ARG HG3 1 1 44 26882 1 1 11 ARG HH11 H -4.109 2.432 -10.451 1.00 . A A . 11 ARG HH11 1 1 44 26883 1 1 11 ARG HH12 H -3.963 1.071 -11.512 1.00 . A A . 11 ARG HH12 1 1 44 26884 1 1 11 ARG HH21 H -7.290 0.061 -11.155 1.00 . A A . 11 ARG HH21 1 1 44 26885 1 1 11 ARG HH22 H -5.770 -0.274 -11.912 1.00 . A A . 11 ARG HH22 1 1 44 26886 1 1 11 ARG N N -5.386 3.784 -4.508 1.00 . A A . 11 ARG N 1 1 44 26887 1 1 11 ARG NE N -6.540 2.094 -9.892 1.00 . A A . 11 ARG NE 1 1 44 26888 1 1 11 ARG NH1 N -4.518 1.640 -10.904 1.00 . A A . 11 ARG NH1 1 1 44 26889 1 1 11 ARG NH2 N -6.329 0.290 -11.305 1.00 . A A . 11 ARG NH2 1 1 44 26890 1 1 11 ARG O O -7.896 4.618 -5.709 1.00 . A A . 11 ARG O 1 1 44 26891 1 1 12 GLN C C -8.206 7.680 -5.817 1.00 . A A . 12 GLN C 1 1 44 26892 1 1 12 GLN CA C -7.701 7.021 -7.095 1.00 . A A . 12 GLN CA 1 1 44 26893 1 1 12 GLN CB C -8.849 6.294 -7.800 1.00 . A A . 12 GLN CB 1 1 44 26894 1 1 12 GLN CD C -11.123 6.488 -8.882 1.00 . A A . 12 GLN CD 1 1 44 26895 1 1 12 GLN CG C -9.906 7.229 -8.364 1.00 . A A . 12 GLN CG 1 1 44 26896 1 1 12 GLN H H -5.705 6.316 -7.131 1.00 . A A . 12 GLN H 1 1 44 26897 1 1 12 GLN HA H -7.322 7.788 -7.749 1.00 . A A . 12 GLN HA 1 1 44 26898 1 1 12 GLN HB2 H -8.445 5.711 -8.614 1.00 . A A . 12 GLN HB2 1 1 44 26899 1 1 12 GLN HB3 H -9.327 5.629 -7.095 1.00 . A A . 12 GLN HB3 1 1 44 26900 1 1 12 GLN HE21 H -12.320 7.631 -7.779 1.00 . A A . 12 GLN HE21 1 1 44 26901 1 1 12 GLN HE22 H -13.105 6.428 -8.739 1.00 . A A . 12 GLN HE22 1 1 44 26902 1 1 12 GLN HG2 H -10.222 7.907 -7.584 1.00 . A A . 12 GLN HG2 1 1 44 26903 1 1 12 GLN HG3 H -9.473 7.794 -9.176 1.00 . A A . 12 GLN HG3 1 1 44 26904 1 1 12 GLN N N -6.606 6.097 -6.813 1.00 . A A . 12 GLN N 1 1 44 26905 1 1 12 GLN NE2 N -12.302 6.889 -8.420 1.00 . A A . 12 GLN NE2 1 1 44 26906 1 1 12 GLN O O -8.026 8.881 -5.611 1.00 . A A . 12 GLN O 1 1 44 26907 1 1 12 GLN OE1 O -11.006 5.566 -9.689 1.00 . A A . 12 GLN OE1 1 1 44 26908 1 1 13 CYS C C -9.959 6.252 -2.872 1.00 . A A . 13 CYS C 1 1 44 26909 1 1 13 CYS CA C -9.377 7.388 -3.706 1.00 . A A . 13 CYS CA 1 1 44 26910 1 1 13 CYS CB C -10.451 8.445 -3.971 1.00 . A A . 13 CYS CB 1 1 44 26911 1 1 13 CYS H H -8.951 5.942 -5.190 1.00 . A A . 13 CYS H 1 1 44 26912 1 1 13 CYS HA H -8.565 7.843 -3.157 1.00 . A A . 13 CYS HA 1 1 44 26913 1 1 13 CYS HB2 H -10.058 9.184 -4.653 1.00 . A A . 13 CYS HB2 1 1 44 26914 1 1 13 CYS HB3 H -11.310 7.969 -4.422 1.00 . A A . 13 CYS HB3 1 1 44 26915 1 1 13 CYS N N -8.840 6.887 -4.966 1.00 . A A . 13 CYS N 1 1 44 26916 1 1 13 CYS O O -10.975 6.421 -2.197 1.00 . A A . 13 CYS O 1 1 44 26917 1 1 13 CYS SG S -11.021 9.320 -2.478 1.00 . A A . 13 CYS SG 1 1 44 26918 1 1 14 LYS C C -8.589 3.057 -1.755 1.00 . A A . 14 LYS C 1 1 44 26919 1 1 14 LYS CA C -9.767 3.931 -2.169 1.00 . A A . 14 LYS CA 1 1 44 26920 1 1 14 LYS CB C -10.756 3.114 -3.002 1.00 . A A . 14 LYS CB 1 1 44 26921 1 1 14 LYS CD C -13.169 2.414 -2.966 1.00 . A A . 14 LYS CD 1 1 44 26922 1 1 14 LYS CE C -13.366 1.042 -3.590 1.00 . A A . 14 LYS CE 1 1 44 26923 1 1 14 LYS CG C -11.870 2.486 -2.180 1.00 . A A . 14 LYS CG 1 1 44 26924 1 1 14 LYS H H -8.506 5.016 -3.477 1.00 . A A . 14 LYS H 1 1 44 26925 1 1 14 LYS HA H -10.265 4.287 -1.280 1.00 . A A . 14 LYS HA 1 1 44 26926 1 1 14 LYS HB2 H -11.204 3.759 -3.743 1.00 . A A . 14 LYS HB2 1 1 44 26927 1 1 14 LYS HB3 H -10.219 2.323 -3.504 1.00 . A A . 14 LYS HB3 1 1 44 26928 1 1 14 LYS HD2 H -13.994 2.616 -2.299 1.00 . A A . 14 LYS HD2 1 1 44 26929 1 1 14 LYS HD3 H -13.146 3.157 -3.750 1.00 . A A . 14 LYS HD3 1 1 44 26930 1 1 14 LYS HE2 H -12.947 0.297 -2.931 1.00 . A A . 14 LYS HE2 1 1 44 26931 1 1 14 LYS HE3 H -14.425 0.863 -3.708 1.00 . A A . 14 LYS HE3 1 1 44 26932 1 1 14 LYS HG2 H -11.576 1.487 -1.897 1.00 . A A . 14 LYS HG2 1 1 44 26933 1 1 14 LYS HG3 H -12.029 3.082 -1.293 1.00 . A A . 14 LYS HG3 1 1 44 26934 1 1 14 LYS HZ1 H -11.700 1.190 -4.842 1.00 . A A . 14 LYS HZ1 1 1 44 26935 1 1 14 LYS HZ2 H -12.780 -0.036 -5.281 1.00 . A A . 14 LYS HZ2 1 1 44 26936 1 1 14 LYS HZ3 H -13.163 1.581 -5.598 1.00 . A A . 14 LYS HZ3 1 1 44 26937 1 1 14 LYS N N -9.310 5.093 -2.922 1.00 . A A . 14 LYS N 1 1 44 26938 1 1 14 LYS NZ N -12.706 0.937 -4.921 1.00 . A A . 14 LYS NZ 1 1 44 26939 1 1 14 LYS O O -7.728 2.730 -2.572 1.00 . A A . 14 LYS O 1 1 44 26940 1 1 15 LEU C C -7.302 0.592 -0.815 1.00 . A A . 15 LEU C 1 1 44 26941 1 1 15 LEU CA C -7.485 1.841 0.044 1.00 . A A . 15 LEU CA 1 1 44 26942 1 1 15 LEU CB C -7.783 1.444 1.492 1.00 . A A . 15 LEU CB 1 1 44 26943 1 1 15 LEU CD1 C -7.389 2.256 3.832 1.00 . A A . 15 LEU CD1 1 1 44 26944 1 1 15 LEU CD2 C -5.701 0.783 2.720 1.00 . A A . 15 LEU CD2 1 1 44 26945 1 1 15 LEU CG C -6.731 1.883 2.512 1.00 . A A . 15 LEU CG 1 1 44 26946 1 1 15 LEU H H -9.272 2.971 0.121 1.00 . A A . 15 LEU H 1 1 44 26947 1 1 15 LEU HA H -6.572 2.416 0.018 1.00 . A A . 15 LEU HA 1 1 44 26948 1 1 15 LEU HB2 H -8.731 1.880 1.773 1.00 . A A . 15 LEU HB2 1 1 44 26949 1 1 15 LEU HB3 H -7.872 0.369 1.542 1.00 . A A . 15 LEU HB3 1 1 44 26950 1 1 15 LEU HD11 H -8.225 2.912 3.644 1.00 . A A . 15 LEU HD11 1 1 44 26951 1 1 15 LEU HD12 H -7.738 1.361 4.326 1.00 . A A . 15 LEU HD12 1 1 44 26952 1 1 15 LEU HD13 H -6.671 2.758 4.463 1.00 . A A . 15 LEU HD13 1 1 44 26953 1 1 15 LEU HD21 H -6.202 -0.131 3.000 1.00 . A A . 15 LEU HD21 1 1 44 26954 1 1 15 LEU HD22 H -5.152 0.626 1.803 1.00 . A A . 15 LEU HD22 1 1 44 26955 1 1 15 LEU HD23 H -5.017 1.073 3.503 1.00 . A A . 15 LEU HD23 1 1 44 26956 1 1 15 LEU HG H -6.218 2.757 2.137 1.00 . A A . 15 LEU HG 1 1 44 26957 1 1 15 LEU N N -8.557 2.679 -0.481 1.00 . A A . 15 LEU N 1 1 44 26958 1 1 15 LEU O O -8.218 -0.218 -0.952 1.00 . A A . 15 LEU O 1 1 44 26959 1 1 16 LYS C C -6.162 -2.013 -1.537 1.00 . A A . 16 LYS C 1 1 44 26960 1 1 16 LYS CA C -5.811 -0.702 -2.241 1.00 . A A . 16 LYS CA 1 1 44 26961 1 1 16 LYS CB C -4.331 -0.699 -2.631 1.00 . A A . 16 LYS CB 1 1 44 26962 1 1 16 LYS CD C -2.751 -0.451 -4.569 1.00 . A A . 16 LYS CD 1 1 44 26963 1 1 16 LYS CE C -1.548 -0.094 -3.712 1.00 . A A . 16 LYS CE 1 1 44 26964 1 1 16 LYS CG C -4.048 0.027 -3.935 1.00 . A A . 16 LYS CG 1 1 44 26965 1 1 16 LYS H H -5.424 1.126 -1.247 1.00 . A A . 16 LYS H 1 1 44 26966 1 1 16 LYS HA H -6.409 -0.616 -3.136 1.00 . A A . 16 LYS HA 1 1 44 26967 1 1 16 LYS HB2 H -3.766 -0.218 -1.846 1.00 . A A . 16 LYS HB2 1 1 44 26968 1 1 16 LYS HB3 H -3.994 -1.720 -2.731 1.00 . A A . 16 LYS HB3 1 1 44 26969 1 1 16 LYS HD2 H -2.793 -1.524 -4.684 1.00 . A A . 16 LYS HD2 1 1 44 26970 1 1 16 LYS HD3 H -2.643 0.013 -5.538 1.00 . A A . 16 LYS HD3 1 1 44 26971 1 1 16 LYS HE2 H -1.682 0.904 -3.322 1.00 . A A . 16 LYS HE2 1 1 44 26972 1 1 16 LYS HE3 H -1.485 -0.794 -2.892 1.00 . A A . 16 LYS HE3 1 1 44 26973 1 1 16 LYS HG2 H -4.860 -0.155 -4.622 1.00 . A A . 16 LYS HG2 1 1 44 26974 1 1 16 LYS HG3 H -3.972 1.087 -3.737 1.00 . A A . 16 LYS HG3 1 1 44 26975 1 1 16 LYS HZ1 H -0.324 -0.898 -5.202 1.00 . A A . 16 LYS HZ1 1 1 44 26976 1 1 16 LYS HZ2 H -0.119 0.765 -4.971 1.00 . A A . 16 LYS HZ2 1 1 44 26977 1 1 16 LYS HZ3 H 0.523 -0.331 -3.853 1.00 . A A . 16 LYS HZ3 1 1 44 26978 1 1 16 LYS N N -6.114 0.445 -1.393 1.00 . A A . 16 LYS N 1 1 44 26979 1 1 16 LYS NZ N -0.278 -0.143 -4.489 1.00 . A A . 16 LYS NZ 1 1 44 26980 1 1 16 LYS O O -6.342 -2.043 -0.320 1.00 . A A . 16 LYS O 1 1 44 26981 1 1 17 PRO C C -5.548 -4.917 -0.740 1.00 . A A . 17 PRO C 1 1 44 26982 1 1 17 PRO CA C -6.594 -4.433 -1.738 1.00 . A A . 17 PRO CA 1 1 44 26983 1 1 17 PRO CB C -6.630 -5.353 -2.964 1.00 . A A . 17 PRO CB 1 1 44 26984 1 1 17 PRO CD C -6.063 -3.172 -3.755 1.00 . A A . 17 PRO CD 1 1 44 26985 1 1 17 PRO CG C -5.850 -4.635 -4.012 1.00 . A A . 17 PRO CG 1 1 44 26986 1 1 17 PRO HA H -7.564 -4.425 -1.263 1.00 . A A . 17 PRO HA 1 1 44 26987 1 1 17 PRO HB2 H -6.179 -6.303 -2.717 1.00 . A A . 17 PRO HB2 1 1 44 26988 1 1 17 PRO HB3 H -7.654 -5.505 -3.272 1.00 . A A . 17 PRO HB3 1 1 44 26989 1 1 17 PRO HD2 H -5.192 -2.605 -4.048 1.00 . A A . 17 PRO HD2 1 1 44 26990 1 1 17 PRO HD3 H -6.940 -2.820 -4.277 1.00 . A A . 17 PRO HD3 1 1 44 26991 1 1 17 PRO HG2 H -4.802 -4.883 -3.924 1.00 . A A . 17 PRO HG2 1 1 44 26992 1 1 17 PRO HG3 H -6.218 -4.902 -4.992 1.00 . A A . 17 PRO HG3 1 1 44 26993 1 1 17 PRO N N -6.263 -3.117 -2.297 1.00 . A A . 17 PRO N 1 1 44 26994 1 1 17 PRO O O -4.348 -4.742 -0.949 1.00 . A A . 17 PRO O 1 1 44 26995 1 1 18 ALA C C -4.145 -7.062 0.802 1.00 . A A . 18 ALA C 1 1 44 26996 1 1 18 ALA CA C -5.118 -6.039 1.378 1.00 . A A . 18 ALA CA 1 1 44 26997 1 1 18 ALA CB C -5.921 -6.653 2.514 1.00 . A A . 18 ALA CB 1 1 44 26998 1 1 18 ALA H H -6.980 -5.638 0.455 1.00 . A A . 18 ALA H 1 1 44 26999 1 1 18 ALA HA H -4.556 -5.206 1.775 1.00 . A A . 18 ALA HA 1 1 44 27000 1 1 18 ALA HB1 H -6.085 -5.911 3.281 1.00 . A A . 18 ALA HB1 1 1 44 27001 1 1 18 ALA HB2 H -5.376 -7.487 2.931 1.00 . A A . 18 ALA HB2 1 1 44 27002 1 1 18 ALA HB3 H -6.873 -6.998 2.138 1.00 . A A . 18 ALA HB3 1 1 44 27003 1 1 18 ALA N N -6.012 -5.528 0.346 1.00 . A A . 18 ALA N 1 1 44 27004 1 1 18 ALA O O -4.550 -8.130 0.344 1.00 . A A . 18 ALA O 1 1 44 27005 1 1 19 GLY C C -1.205 -7.103 -0.965 1.00 . A A . 19 GLY C 1 1 44 27006 1 1 19 GLY CA C -1.847 -7.627 0.305 1.00 . A A . 19 GLY CA 1 1 44 27007 1 1 19 GLY H H -2.595 -5.862 1.205 1.00 . A A . 19 GLY H 1 1 44 27008 1 1 19 GLY HA2 H -2.304 -8.583 0.097 1.00 . A A . 19 GLY HA2 1 1 44 27009 1 1 19 GLY HA3 H -1.080 -7.761 1.054 1.00 . A A . 19 GLY HA3 1 1 44 27010 1 1 19 GLY N N -2.859 -6.727 0.828 1.00 . A A . 19 GLY N 1 1 44 27011 1 1 19 GLY O O -0.695 -7.878 -1.775 1.00 . A A . 19 GLY O 1 1 44 27012 1 1 20 THR C C 0.774 -4.684 -2.036 1.00 . A A . 20 THR C 1 1 44 27013 1 1 20 THR CA C -0.646 -5.160 -2.321 1.00 . A A . 20 THR CA 1 1 44 27014 1 1 20 THR CB C -1.509 -3.984 -2.780 1.00 . A A . 20 THR CB 1 1 44 27015 1 1 20 THR CG2 C -1.068 -3.399 -4.104 1.00 . A A . 20 THR CG2 1 1 44 27016 1 1 20 THR H H -1.651 -5.220 -0.459 1.00 . A A . 20 THR H 1 1 44 27017 1 1 20 THR HA H -0.614 -5.900 -3.106 1.00 . A A . 20 THR HA 1 1 44 27018 1 1 20 THR HB H -1.455 -3.200 -2.038 1.00 . A A . 20 THR HB 1 1 44 27019 1 1 20 THR HG1 H -2.909 -5.216 -3.380 1.00 . A A . 20 THR HG1 1 1 44 27020 1 1 20 THR HG21 H -0.325 -4.042 -4.552 1.00 . A A . 20 THR HG21 1 1 44 27021 1 1 20 THR HG22 H -1.920 -3.320 -4.764 1.00 . A A . 20 THR HG22 1 1 44 27022 1 1 20 THR HG23 H -0.647 -2.418 -3.942 1.00 . A A . 20 THR HG23 1 1 44 27023 1 1 20 THR N N -1.230 -5.786 -1.140 1.00 . A A . 20 THR N 1 1 44 27024 1 1 20 THR O O 0.988 -3.801 -1.205 1.00 . A A . 20 THR O 1 1 44 27025 1 1 20 THR OG1 O -2.863 -4.378 -2.914 1.00 . A A . 20 THR OG1 1 1 44 27026 1 1 21 THR C C 3.384 -3.461 -2.964 1.00 . A A . 21 THR C 1 1 44 27027 1 1 21 THR CA C 3.142 -4.909 -2.549 1.00 . A A . 21 THR CA 1 1 44 27028 1 1 21 THR CB C 4.047 -5.845 -3.356 1.00 . A A . 21 THR CB 1 1 44 27029 1 1 21 THR CG2 C 5.047 -6.593 -2.501 1.00 . A A . 21 THR CG2 1 1 44 27030 1 1 21 THR H H 1.509 -5.971 -3.377 1.00 . A A . 21 THR H 1 1 44 27031 1 1 21 THR HA H 3.377 -5.013 -1.500 1.00 . A A . 21 THR HA 1 1 44 27032 1 1 21 THR HB H 4.601 -5.262 -4.078 1.00 . A A . 21 THR HB 1 1 44 27033 1 1 21 THR HG1 H 2.883 -7.419 -3.434 1.00 . A A . 21 THR HG1 1 1 44 27034 1 1 21 THR HG21 H 4.682 -6.648 -1.486 1.00 . A A . 21 THR HG21 1 1 44 27035 1 1 21 THR HG22 H 5.178 -7.592 -2.890 1.00 . A A . 21 THR HG22 1 1 44 27036 1 1 21 THR HG23 H 5.993 -6.073 -2.516 1.00 . A A . 21 THR HG23 1 1 44 27037 1 1 21 THR N N 1.742 -5.274 -2.729 1.00 . A A . 21 THR N 1 1 44 27038 1 1 21 THR O O 3.140 -3.084 -4.110 1.00 . A A . 21 THR O 1 1 44 27039 1 1 21 THR OG1 O 3.280 -6.808 -4.059 1.00 . A A . 21 THR OG1 1 1 44 27040 1 1 22 CYS C C 5.635 -0.959 -2.208 1.00 . A A . 22 CYS C 1 1 44 27041 1 1 22 CYS CA C 4.140 -1.247 -2.290 1.00 . A A . 22 CYS CA 1 1 44 27042 1 1 22 CYS CB C 3.383 -0.361 -1.299 1.00 . A A . 22 CYS CB 1 1 44 27043 1 1 22 CYS H H 4.038 -3.013 -1.128 1.00 . A A . 22 CYS H 1 1 44 27044 1 1 22 CYS HA H 3.797 -1.026 -3.290 1.00 . A A . 22 CYS HA 1 1 44 27045 1 1 22 CYS HB2 H 3.542 0.675 -1.559 1.00 . A A . 22 CYS HB2 1 1 44 27046 1 1 22 CYS HB3 H 2.328 -0.584 -1.360 1.00 . A A . 22 CYS HB3 1 1 44 27047 1 1 22 CYS N N 3.864 -2.654 -2.023 1.00 . A A . 22 CYS N 1 1 44 27048 1 1 22 CYS O O 6.047 0.139 -1.836 1.00 . A A . 22 CYS O 1 1 44 27049 1 1 22 CYS SG S 3.897 -0.579 0.436 1.00 . A A . 22 CYS SG 1 1 44 27050 1 1 23 TRP C C 8.581 -3.067 -3.045 1.00 . A A . 23 TRP C 1 1 44 27051 1 1 23 TRP CA C 7.895 -1.808 -2.523 1.00 . A A . 23 TRP CA 1 1 44 27052 1 1 23 TRP CB C 8.365 -1.510 -1.099 1.00 . A A . 23 TRP CB 1 1 44 27053 1 1 23 TRP CD1 C 9.617 0.681 -1.542 1.00 . A A . 23 TRP CD1 1 1 44 27054 1 1 23 TRP CD2 C 10.821 -0.863 -0.456 1.00 . A A . 23 TRP CD2 1 1 44 27055 1 1 23 TRP CE2 C 11.619 0.283 -0.635 1.00 . A A . 23 TRP CE2 1 1 44 27056 1 1 23 TRP CE3 C 11.368 -1.967 0.205 1.00 . A A . 23 TRP CE3 1 1 44 27057 1 1 23 TRP CG C 9.544 -0.588 -1.043 1.00 . A A . 23 TRP CG 1 1 44 27058 1 1 23 TRP CH2 C 13.441 -0.739 0.465 1.00 . A A . 23 TRP CH2 1 1 44 27059 1 1 23 TRP CZ2 C 12.932 0.356 -0.178 1.00 . A A . 23 TRP CZ2 1 1 44 27060 1 1 23 TRP CZ3 C 12.672 -1.894 0.658 1.00 . A A . 23 TRP CZ3 1 1 44 27061 1 1 23 TRP H H 6.056 -2.807 -2.846 1.00 . A A . 23 TRP H 1 1 44 27062 1 1 23 TRP HA H 8.159 -0.978 -3.161 1.00 . A A . 23 TRP HA 1 1 44 27063 1 1 23 TRP HB2 H 7.557 -1.051 -0.549 1.00 . A A . 23 TRP HB2 1 1 44 27064 1 1 23 TRP HB3 H 8.641 -2.437 -0.617 1.00 . A A . 23 TRP HB3 1 1 44 27065 1 1 23 TRP HD1 H 8.807 1.182 -2.051 1.00 . A A . 23 TRP HD1 1 1 44 27066 1 1 23 TRP HE1 H 11.158 2.108 -1.562 1.00 . A A . 23 TRP HE1 1 1 44 27067 1 1 23 TRP HE3 H 10.790 -2.866 0.363 1.00 . A A . 23 TRP HE3 1 1 44 27068 1 1 23 TRP HH2 H 14.455 -0.727 0.835 1.00 . A A . 23 TRP HH2 1 1 44 27069 1 1 23 TRP HZ2 H 13.538 1.238 -0.318 1.00 . A A . 23 TRP HZ2 1 1 44 27070 1 1 23 TRP HZ3 H 13.111 -2.737 1.170 1.00 . A A . 23 TRP HZ3 1 1 44 27071 1 1 23 TRP N N 6.444 -1.954 -2.558 1.00 . A A . 23 TRP N 1 1 44 27072 1 1 23 TRP NE1 N 10.861 1.211 -1.301 1.00 . A A . 23 TRP NE1 1 1 44 27073 1 1 23 TRP O O 8.958 -3.946 -2.270 1.00 . A A . 23 TRP O 1 1 44 27074 1 1 24 ARG C C 10.852 -4.015 -5.266 1.00 . A A . 24 ARG C 1 1 44 27075 1 1 24 ARG CA C 9.380 -4.298 -4.986 1.00 . A A . 24 ARG CA 1 1 44 27076 1 1 24 ARG CB C 8.663 -4.663 -6.287 1.00 . A A . 24 ARG CB 1 1 44 27077 1 1 24 ARG CD C 6.733 -5.842 -7.383 1.00 . A A . 24 ARG CD 1 1 44 27078 1 1 24 ARG CG C 7.516 -5.642 -6.096 1.00 . A A . 24 ARG CG 1 1 44 27079 1 1 24 ARG CZ C 6.904 -7.261 -9.390 1.00 . A A . 24 ARG CZ 1 1 44 27080 1 1 24 ARG H H 8.417 -2.413 -4.927 1.00 . A A . 24 ARG H 1 1 44 27081 1 1 24 ARG HA H 9.309 -5.129 -4.301 1.00 . A A . 24 ARG HA 1 1 44 27082 1 1 24 ARG HB2 H 8.268 -3.762 -6.733 1.00 . A A . 24 ARG HB2 1 1 44 27083 1 1 24 ARG HB3 H 9.376 -5.107 -6.966 1.00 . A A . 24 ARG HB3 1 1 44 27084 1 1 24 ARG HD2 H 5.802 -6.337 -7.150 1.00 . A A . 24 ARG HD2 1 1 44 27085 1 1 24 ARG HD3 H 6.526 -4.875 -7.818 1.00 . A A . 24 ARG HD3 1 1 44 27086 1 1 24 ARG HE H 8.437 -6.742 -8.222 1.00 . A A . 24 ARG HE 1 1 44 27087 1 1 24 ARG HG2 H 7.916 -6.593 -5.778 1.00 . A A . 24 ARG HG2 1 1 44 27088 1 1 24 ARG HG3 H 6.851 -5.257 -5.336 1.00 . A A . 24 ARG HG3 1 1 44 27089 1 1 24 ARG HH11 H 5.031 -6.621 -8.974 1.00 . A A . 24 ARG HH11 1 1 44 27090 1 1 24 ARG HH12 H 5.178 -7.620 -10.380 1.00 . A A . 24 ARG HH12 1 1 44 27091 1 1 24 ARG HH21 H 8.633 -8.057 -10.072 1.00 . A A . 24 ARG HH21 1 1 44 27092 1 1 24 ARG HH22 H 7.223 -8.436 -11.004 1.00 . A A . 24 ARG HH22 1 1 44 27093 1 1 24 ARG N N 8.739 -3.146 -4.362 1.00 . A A . 24 ARG N 1 1 44 27094 1 1 24 ARG NE N 7.470 -6.650 -8.352 1.00 . A A . 24 ARG NE 1 1 44 27095 1 1 24 ARG NH1 N 5.597 -7.159 -9.598 1.00 . A A . 24 ARG NH1 1 1 44 27096 1 1 24 ARG NH2 N 7.648 -7.977 -10.224 1.00 . A A . 24 ARG NH2 1 1 44 27097 1 1 24 ARG O O 11.217 -2.911 -5.669 1.00 . A A . 24 ARG O 1 1 44 27098 1 1 25 THR C C 13.726 -6.185 -5.793 1.00 . A A . 25 THR C 1 1 44 27099 1 1 25 THR CA C 13.127 -4.881 -5.277 1.00 . A A . 25 THR CA 1 1 44 27100 1 1 25 THR CB C 13.831 -4.455 -3.987 1.00 . A A . 25 THR CB 1 1 44 27101 1 1 25 THR CG2 C 13.747 -2.968 -3.722 1.00 . A A . 25 THR CG2 1 1 44 27102 1 1 25 THR H H 11.342 -5.877 -4.727 1.00 . A A . 25 THR H 1 1 44 27103 1 1 25 THR HA H 13.270 -4.116 -6.022 1.00 . A A . 25 THR HA 1 1 44 27104 1 1 25 THR HB H 14.877 -4.720 -4.056 1.00 . A A . 25 THR HB 1 1 44 27105 1 1 25 THR HG1 H 13.867 -5.037 -2.117 1.00 . A A . 25 THR HG1 1 1 44 27106 1 1 25 THR HG21 H 13.021 -2.524 -4.388 1.00 . A A . 25 THR HG21 1 1 44 27107 1 1 25 THR HG22 H 13.445 -2.801 -2.699 1.00 . A A . 25 THR HG22 1 1 44 27108 1 1 25 THR HG23 H 14.713 -2.516 -3.891 1.00 . A A . 25 THR HG23 1 1 44 27109 1 1 25 THR N N 11.694 -5.021 -5.048 1.00 . A A . 25 THR N 1 1 44 27110 1 1 25 THR O O 13.993 -6.329 -6.986 1.00 . A A . 25 THR O 1 1 44 27111 1 1 25 THR OG1 O 13.276 -5.123 -2.869 1.00 . A A . 25 THR OG1 1 1 44 27112 1 1 26 SER C C 14.567 -9.345 -4.029 1.00 . A A . 26 SER C 1 1 44 27113 1 1 26 SER CA C 14.501 -8.425 -5.243 1.00 . A A . 26 SER CA 1 1 44 27114 1 1 26 SER CB C 15.898 -8.247 -5.840 1.00 . A A . 26 SER CB 1 1 44 27115 1 1 26 SER H H 13.699 -6.951 -3.952 1.00 . A A . 26 SER H 1 1 44 27116 1 1 26 SER HA H 13.858 -8.874 -5.983 1.00 . A A . 26 SER HA 1 1 44 27117 1 1 26 SER HB2 H 15.846 -7.569 -6.679 1.00 . A A . 26 SER HB2 1 1 44 27118 1 1 26 SER HB3 H 16.559 -7.839 -5.088 1.00 . A A . 26 SER HB3 1 1 44 27119 1 1 26 SER HG H 17.280 -9.340 -6.697 1.00 . A A . 26 SER HG 1 1 44 27120 1 1 26 SER N N 13.934 -7.130 -4.885 1.00 . A A . 26 SER N 1 1 44 27121 1 1 26 SER O O 14.303 -10.543 -4.129 1.00 . A A . 26 SER O 1 1 44 27122 1 1 26 SER OG O 16.424 -9.485 -6.286 1.00 . A A . 26 SER OG 1 1 44 27123 1 1 27 VAL C C 13.772 -9.368 -0.791 1.00 . A A . 27 VAL C 1 1 44 27124 1 1 27 VAL CA C 15.023 -9.540 -1.647 1.00 . A A . 27 VAL CA 1 1 44 27125 1 1 27 VAL CB C 16.262 -9.123 -0.829 1.00 . A A . 27 VAL CB 1 1 44 27126 1 1 27 VAL CG1 C 16.165 -7.662 -0.414 1.00 . A A . 27 VAL CG1 1 1 44 27127 1 1 27 VAL CG2 C 16.429 -10.022 0.388 1.00 . A A . 27 VAL CG2 1 1 44 27128 1 1 27 VAL H H 15.119 -7.815 -2.870 1.00 . A A . 27 VAL H 1 1 44 27129 1 1 27 VAL HA H 15.126 -10.583 -1.909 1.00 . A A . 27 VAL HA 1 1 44 27130 1 1 27 VAL HB H 17.135 -9.236 -1.455 1.00 . A A . 27 VAL HB 1 1 44 27131 1 1 27 VAL HG11 H 15.215 -7.486 0.068 1.00 . A A . 27 VAL HG11 1 1 44 27132 1 1 27 VAL HG12 H 16.965 -7.429 0.272 1.00 . A A . 27 VAL HG12 1 1 44 27133 1 1 27 VAL HG13 H 16.246 -7.033 -1.288 1.00 . A A . 27 VAL HG13 1 1 44 27134 1 1 27 VAL HG21 H 15.483 -10.486 0.626 1.00 . A A . 27 VAL HG21 1 1 44 27135 1 1 27 VAL HG22 H 17.161 -10.786 0.173 1.00 . A A . 27 VAL HG22 1 1 44 27136 1 1 27 VAL HG23 H 16.762 -9.432 1.229 1.00 . A A . 27 VAL HG23 1 1 44 27137 1 1 27 VAL N N 14.921 -8.775 -2.883 1.00 . A A . 27 VAL N 1 1 44 27138 1 1 27 VAL O O 13.363 -10.285 -0.080 1.00 . A A . 27 VAL O 1 1 44 27139 1 1 28 SER C C 10.794 -7.578 -1.022 1.00 . A A . 28 SER C 1 1 44 27140 1 1 28 SER CA C 11.965 -7.891 -0.097 1.00 . A A . 28 SER CA 1 1 44 27141 1 1 28 SER CB C 12.213 -6.714 0.848 1.00 . A A . 28 SER CB 1 1 44 27142 1 1 28 SER H H 13.544 -7.494 -1.449 1.00 . A A . 28 SER H 1 1 44 27143 1 1 28 SER HA H 11.723 -8.766 0.488 1.00 . A A . 28 SER HA 1 1 44 27144 1 1 28 SER HB2 H 13.270 -6.634 1.051 1.00 . A A . 28 SER HB2 1 1 44 27145 1 1 28 SER HB3 H 11.865 -5.803 0.384 1.00 . A A . 28 SER HB3 1 1 44 27146 1 1 28 SER HG H 11.907 -6.314 2.742 1.00 . A A . 28 SER HG 1 1 44 27147 1 1 28 SER N N 13.170 -8.185 -0.864 1.00 . A A . 28 SER N 1 1 44 27148 1 1 28 SER O O 10.874 -7.785 -2.233 1.00 . A A . 28 SER O 1 1 44 27149 1 1 28 SER OG O 11.526 -6.891 2.075 1.00 . A A . 28 SER OG 1 1 44 27150 1 1 29 SER C C 7.567 -5.869 -0.402 1.00 . A A . 29 SER C 1 1 44 27151 1 1 29 SER CA C 8.518 -6.737 -1.218 1.00 . A A . 29 SER CA 1 1 44 27152 1 1 29 SER CB C 7.802 -8.008 -1.680 1.00 . A A . 29 SER CB 1 1 44 27153 1 1 29 SER H H 9.702 -6.937 0.526 1.00 . A A . 29 SER H 1 1 44 27154 1 1 29 SER HA H 8.837 -6.181 -2.083 1.00 . A A . 29 SER HA 1 1 44 27155 1 1 29 SER HB2 H 8.469 -8.851 -1.582 1.00 . A A . 29 SER HB2 1 1 44 27156 1 1 29 SER HB3 H 6.926 -8.169 -1.067 1.00 . A A . 29 SER HB3 1 1 44 27157 1 1 29 SER HG H 6.840 -8.651 -3.261 1.00 . A A . 29 SER HG 1 1 44 27158 1 1 29 SER N N 9.706 -7.079 -0.444 1.00 . A A . 29 SER N 1 1 44 27159 1 1 29 SER O O 7.024 -4.884 -0.901 1.00 . A A . 29 SER O 1 1 44 27160 1 1 29 SER OG O 7.398 -7.903 -3.034 1.00 . A A . 29 SER OG 1 1 44 27161 1 1 30 HIS C C 5.068 -5.456 1.194 1.00 . A A . 30 HIS C 1 1 44 27162 1 1 30 HIS CA C 6.488 -5.501 1.748 1.00 . A A . 30 HIS CA 1 1 44 27163 1 1 30 HIS CB C 7.013 -4.080 1.954 1.00 . A A . 30 HIS CB 1 1 44 27164 1 1 30 HIS CD2 C 9.573 -4.494 2.030 1.00 . A A . 30 HIS CD2 1 1 44 27165 1 1 30 HIS CE1 C 9.992 -3.555 3.967 1.00 . A A . 30 HIS CE1 1 1 44 27166 1 1 30 HIS CG C 8.399 -4.029 2.520 1.00 . A A . 30 HIS CG 1 1 44 27167 1 1 30 HIS H H 7.836 -7.037 1.193 1.00 . A A . 30 HIS H 1 1 44 27168 1 1 30 HIS HA H 6.474 -6.011 2.700 1.00 . A A . 30 HIS HA 1 1 44 27169 1 1 30 HIS HB2 H 7.024 -3.566 1.005 1.00 . A A . 30 HIS HB2 1 1 44 27170 1 1 30 HIS HB3 H 6.357 -3.556 2.634 1.00 . A A . 30 HIS HB3 1 1 44 27171 1 1 30 HIS HD1 H 8.052 -3.019 4.336 1.00 . A A . 30 HIS HD1 1 1 44 27172 1 1 30 HIS HD2 H 9.717 -5.010 1.091 1.00 . A A . 30 HIS HD2 1 1 44 27173 1 1 30 HIS HE1 H 10.510 -3.190 4.842 1.00 . A A . 30 HIS HE1 1 1 44 27174 1 1 30 HIS HE2 H 11.509 -4.322 2.825 1.00 . A A . 30 HIS HE2 1 1 44 27175 1 1 30 HIS N N 7.372 -6.243 0.856 1.00 . A A . 30 HIS N 1 1 44 27176 1 1 30 HIS ND1 N 8.696 -3.448 3.734 1.00 . A A . 30 HIS ND1 1 1 44 27177 1 1 30 HIS NE2 N 10.546 -4.186 2.949 1.00 . A A . 30 HIS NE2 1 1 44 27178 1 1 30 HIS O O 4.794 -4.755 0.219 1.00 . A A . 30 HIS O 1 1 44 27179 1 1 31 TYR C C 1.915 -5.318 2.238 1.00 . A A . 31 TYR C 1 1 44 27180 1 1 31 TYR CA C 2.776 -6.251 1.391 1.00 . A A . 31 TYR CA 1 1 44 27181 1 1 31 TYR CB C 2.238 -7.680 1.480 1.00 . A A . 31 TYR CB 1 1 44 27182 1 1 31 TYR CD1 C 2.240 -8.543 -0.893 1.00 . A A . 31 TYR CD1 1 1 44 27183 1 1 31 TYR CD2 C 3.777 -9.504 0.655 1.00 . A A . 31 TYR CD2 1 1 44 27184 1 1 31 TYR CE1 C 2.715 -9.376 -1.888 1.00 . A A . 31 TYR CE1 1 1 44 27185 1 1 31 TYR CE2 C 4.259 -10.339 -0.334 1.00 . A A . 31 TYR CE2 1 1 44 27186 1 1 31 TYR CG C 2.762 -8.593 0.394 1.00 . A A . 31 TYR CG 1 1 44 27187 1 1 31 TYR CZ C 3.724 -10.272 -1.604 1.00 . A A . 31 TYR CZ 1 1 44 27188 1 1 31 TYR H H 4.448 -6.742 2.593 1.00 . A A . 31 TYR H 1 1 44 27189 1 1 31 TYR HA H 2.736 -5.923 0.363 1.00 . A A . 31 TYR HA 1 1 44 27190 1 1 31 TYR HB2 H 2.518 -8.104 2.432 1.00 . A A . 31 TYR HB2 1 1 44 27191 1 1 31 TYR HB3 H 1.161 -7.657 1.404 1.00 . A A . 31 TYR HB3 1 1 44 27192 1 1 31 TYR HD1 H 1.450 -7.841 -1.112 1.00 . A A . 31 TYR HD1 1 1 44 27193 1 1 31 TYR HD2 H 4.193 -9.555 1.651 1.00 . A A . 31 TYR HD2 1 1 44 27194 1 1 31 TYR HE1 H 2.297 -9.323 -2.882 1.00 . A A . 31 TYR HE1 1 1 44 27195 1 1 31 TYR HE2 H 5.049 -11.041 -0.111 1.00 . A A . 31 TYR HE2 1 1 44 27196 1 1 31 TYR HH H 5.104 -10.858 -2.808 1.00 . A A . 31 TYR HH 1 1 44 27197 1 1 31 TYR N N 4.168 -6.206 1.821 1.00 . A A . 31 TYR N 1 1 44 27198 1 1 31 TYR O O 2.215 -5.070 3.406 1.00 . A A . 31 TYR O 1 1 44 27199 1 1 31 TYR OH O 4.201 -11.103 -2.592 1.00 . A A . 31 TYR OH 1 1 44 27200 1 1 32 CYS C C -1.065 -4.676 3.182 1.00 . A A . 32 CYS C 1 1 44 27201 1 1 32 CYS CA C -0.058 -3.898 2.341 1.00 . A A . 32 CYS CA 1 1 44 27202 1 1 32 CYS CB C -0.795 -3.005 1.341 1.00 . A A . 32 CYS CB 1 1 44 27203 1 1 32 CYS H H 0.658 -5.038 0.708 1.00 . A A . 32 CYS H 1 1 44 27204 1 1 32 CYS HA H 0.536 -3.277 2.995 1.00 . A A . 32 CYS HA 1 1 44 27205 1 1 32 CYS HB2 H -0.178 -2.873 0.465 1.00 . A A . 32 CYS HB2 1 1 44 27206 1 1 32 CYS HB3 H -1.720 -3.485 1.055 1.00 . A A . 32 CYS HB3 1 1 44 27207 1 1 32 CYS N N 0.845 -4.803 1.641 1.00 . A A . 32 CYS N 1 1 44 27208 1 1 32 CYS O O -1.290 -5.865 2.958 1.00 . A A . 32 CYS O 1 1 44 27209 1 1 32 CYS SG S -1.203 -1.350 1.983 1.00 . A A . 32 CYS SG 1 1 44 27210 1 1 33 THR C C -4.077 -4.246 4.620 1.00 . A A . 33 THR C 1 1 44 27211 1 1 33 THR CA C -2.652 -4.621 5.027 1.00 . A A . 33 THR CA 1 1 44 27212 1 1 33 THR CB C -2.404 -4.209 6.479 1.00 . A A . 33 THR CB 1 1 44 27213 1 1 33 THR CG2 C -2.168 -2.724 6.647 1.00 . A A . 33 THR CG2 1 1 44 27214 1 1 33 THR H H -1.446 -3.049 4.280 1.00 . A A . 33 THR H 1 1 44 27215 1 1 33 THR HA H -2.537 -5.691 4.943 1.00 . A A . 33 THR HA 1 1 44 27216 1 1 33 THR HB H -1.529 -4.727 6.845 1.00 . A A . 33 THR HB 1 1 44 27217 1 1 33 THR HG1 H -3.350 -4.263 8.194 1.00 . A A . 33 THR HG1 1 1 44 27218 1 1 33 THR HG21 H -2.496 -2.205 5.758 1.00 . A A . 33 THR HG21 1 1 44 27219 1 1 33 THR HG22 H -2.724 -2.365 7.500 1.00 . A A . 33 THR HG22 1 1 44 27220 1 1 33 THR HG23 H -1.114 -2.542 6.802 1.00 . A A . 33 THR HG23 1 1 44 27221 1 1 33 THR N N -1.667 -3.995 4.151 1.00 . A A . 33 THR N 1 1 44 27222 1 1 33 THR O O -5.038 -4.613 5.294 1.00 . A A . 33 THR O 1 1 44 27223 1 1 33 THR OG1 O -3.506 -4.565 7.296 1.00 . A A . 33 THR OG1 1 1 44 27224 1 1 34 GLY C C -6.318 -2.369 4.108 1.00 . A A . 34 GLY C 1 1 44 27225 1 1 34 GLY CA C -5.522 -3.107 3.048 1.00 . A A . 34 GLY CA 1 1 44 27226 1 1 34 GLY H H -3.411 -3.247 3.013 1.00 . A A . 34 GLY H 1 1 44 27227 1 1 34 GLY HA2 H -6.073 -3.987 2.748 1.00 . A A . 34 GLY HA2 1 1 44 27228 1 1 34 GLY HA3 H -5.403 -2.462 2.190 1.00 . A A . 34 GLY HA3 1 1 44 27229 1 1 34 GLY N N -4.209 -3.514 3.515 1.00 . A A . 34 GLY N 1 1 44 27230 1 1 34 GLY O O -7.548 -2.346 4.066 1.00 . A A . 34 GLY O 1 1 44 27231 1 1 35 ARG C C -5.884 0.450 6.092 1.00 . A A . 35 ARG C 1 1 44 27232 1 1 35 ARG CA C -6.266 -1.025 6.139 1.00 . A A . 35 ARG CA 1 1 44 27233 1 1 35 ARG CB C -5.888 -1.620 7.497 1.00 . A A . 35 ARG CB 1 1 44 27234 1 1 35 ARG CD C -6.808 -2.034 9.798 1.00 . A A . 35 ARG CD 1 1 44 27235 1 1 35 ARG CG C -6.680 -1.038 8.657 1.00 . A A . 35 ARG CG 1 1 44 27236 1 1 35 ARG CZ C -8.291 -2.365 11.738 1.00 . A A . 35 ARG CZ 1 1 44 27237 1 1 35 ARG H H -4.637 -1.820 5.044 1.00 . A A . 35 ARG H 1 1 44 27238 1 1 35 ARG HA H -7.332 -1.112 6.002 1.00 . A A . 35 ARG HA 1 1 44 27239 1 1 35 ARG HB2 H -6.059 -2.686 7.470 1.00 . A A . 35 ARG HB2 1 1 44 27240 1 1 35 ARG HB3 H -4.839 -1.437 7.677 1.00 . A A . 35 ARG HB3 1 1 44 27241 1 1 35 ARG HD2 H -7.168 -2.972 9.402 1.00 . A A . 35 ARG HD2 1 1 44 27242 1 1 35 ARG HD3 H -5.834 -2.181 10.241 1.00 . A A . 35 ARG HD3 1 1 44 27243 1 1 35 ARG HE H -7.950 -0.613 10.844 1.00 . A A . 35 ARG HE 1 1 44 27244 1 1 35 ARG HG2 H -6.174 -0.155 9.018 1.00 . A A . 35 ARG HG2 1 1 44 27245 1 1 35 ARG HG3 H -7.667 -0.773 8.309 1.00 . A A . 35 ARG HG3 1 1 44 27246 1 1 35 ARG HH11 H -7.395 -4.051 11.071 1.00 . A A . 35 ARG HH11 1 1 44 27247 1 1 35 ARG HH12 H -8.442 -4.257 12.434 1.00 . A A . 35 ARG HH12 1 1 44 27248 1 1 35 ARG HH21 H -9.328 -0.882 12.638 1.00 . A A . 35 ARG HH21 1 1 44 27249 1 1 35 ARG HH22 H -9.540 -2.458 13.324 1.00 . A A . 35 ARG HH22 1 1 44 27250 1 1 35 ARG N N -5.616 -1.766 5.063 1.00 . A A . 35 ARG N 1 1 44 27251 1 1 35 ARG NE N -7.733 -1.569 10.829 1.00 . A A . 35 ARG NE 1 1 44 27252 1 1 35 ARG NH1 N -8.020 -3.664 11.748 1.00 . A A . 35 ARG NH1 1 1 44 27253 1 1 35 ARG NH2 N -9.121 -1.860 12.641 1.00 . A A . 35 ARG NH2 1 1 44 27254 1 1 35 ARG O O -6.718 1.326 6.325 1.00 . A A . 35 ARG O 1 1 44 27255 1 1 36 SER C C -3.089 2.223 4.598 1.00 . A A . 36 SER C 1 1 44 27256 1 1 36 SER CA C -4.123 2.085 5.711 1.00 . A A . 36 SER CA 1 1 44 27257 1 1 36 SER CB C -3.510 2.506 7.048 1.00 . A A . 36 SER CB 1 1 44 27258 1 1 36 SER H H -4.005 -0.026 5.615 1.00 . A A . 36 SER H 1 1 44 27259 1 1 36 SER HA H -4.961 2.730 5.490 1.00 . A A . 36 SER HA 1 1 44 27260 1 1 36 SER HB2 H -3.959 1.932 7.844 1.00 . A A . 36 SER HB2 1 1 44 27261 1 1 36 SER HB3 H -2.446 2.322 7.027 1.00 . A A . 36 SER HB3 1 1 44 27262 1 1 36 SER HG H -3.395 4.401 6.565 1.00 . A A . 36 SER HG 1 1 44 27263 1 1 36 SER N N -4.620 0.717 5.790 1.00 . A A . 36 SER N 1 1 44 27264 1 1 36 SER O O -2.433 1.251 4.225 1.00 . A A . 36 SER O 1 1 44 27265 1 1 36 SER OG O -3.731 3.883 7.300 1.00 . A A . 36 SER OG 1 1 44 27266 1 1 37 CYS C C -0.561 3.648 3.528 1.00 . A A . 37 CYS C 1 1 44 27267 1 1 37 CYS CA C -1.993 3.696 3.003 1.00 . A A . 37 CYS CA 1 1 44 27268 1 1 37 CYS CB C -2.272 5.057 2.360 1.00 . A A . 37 CYS CB 1 1 44 27269 1 1 37 CYS H H -3.500 4.172 4.412 1.00 . A A . 37 CYS H 1 1 44 27270 1 1 37 CYS HA H -2.116 2.926 2.257 1.00 . A A . 37 CYS HA 1 1 44 27271 1 1 37 CYS HB2 H -3.201 5.446 2.747 1.00 . A A . 37 CYS HB2 1 1 44 27272 1 1 37 CYS HB3 H -1.471 5.738 2.610 1.00 . A A . 37 CYS HB3 1 1 44 27273 1 1 37 CYS N N -2.949 3.436 4.073 1.00 . A A . 37 CYS N 1 1 44 27274 1 1 37 CYS O O 0.377 3.387 2.775 1.00 . A A . 37 CYS O 1 1 44 27275 1 1 37 CYS SG S -2.409 5.005 0.545 1.00 . A A . 37 CYS SG 1 1 44 27276 1 1 38 GLU C C 1.541 2.494 5.366 1.00 . A A . 38 GLU C 1 1 44 27277 1 1 38 GLU CA C 0.919 3.884 5.446 1.00 . A A . 38 GLU CA 1 1 44 27278 1 1 38 GLU CB C 0.822 4.329 6.906 1.00 . A A . 38 GLU CB 1 1 44 27279 1 1 38 GLU CD C -0.686 6.301 7.374 1.00 . A A . 38 GLU CD 1 1 44 27280 1 1 38 GLU CG C 0.726 5.837 7.078 1.00 . A A . 38 GLU CG 1 1 44 27281 1 1 38 GLU H H -1.185 4.102 5.373 1.00 . A A . 38 GLU H 1 1 44 27282 1 1 38 GLU HA H 1.547 4.578 4.908 1.00 . A A . 38 GLU HA 1 1 44 27283 1 1 38 GLU HB2 H -0.056 3.882 7.349 1.00 . A A . 38 GLU HB2 1 1 44 27284 1 1 38 GLU HB3 H 1.697 3.983 7.435 1.00 . A A . 38 GLU HB3 1 1 44 27285 1 1 38 GLU HG2 H 1.366 6.134 7.895 1.00 . A A . 38 GLU HG2 1 1 44 27286 1 1 38 GLU HG3 H 1.063 6.311 6.167 1.00 . A A . 38 GLU HG3 1 1 44 27287 1 1 38 GLU N N -0.400 3.900 4.823 1.00 . A A . 38 GLU N 1 1 44 27288 1 1 38 GLU O O 1.244 1.623 6.184 1.00 . A A . 38 GLU O 1 1 44 27289 1 1 38 GLU OE1 O -1.633 5.734 6.790 1.00 . A A . 38 GLU OE1 1 1 44 27290 1 1 38 GLU OE2 O -0.845 7.233 8.191 1.00 . A A . 38 GLU OE2 1 1 44 27291 1 1 39 CYS C C 3.858 0.613 5.437 1.00 . A A . 39 CYS C 1 1 44 27292 1 1 39 CYS CA C 3.070 1.008 4.188 1.00 . A A . 39 CYS CA 1 1 44 27293 1 1 39 CYS CB C 4.007 1.070 2.981 1.00 . A A . 39 CYS CB 1 1 44 27294 1 1 39 CYS H H 2.600 3.027 3.756 1.00 . A A . 39 CYS H 1 1 44 27295 1 1 39 CYS HA H 2.308 0.266 4.002 1.00 . A A . 39 CYS HA 1 1 44 27296 1 1 39 CYS HB2 H 4.592 1.976 3.034 1.00 . A A . 39 CYS HB2 1 1 44 27297 1 1 39 CYS HB3 H 4.670 0.218 3.006 1.00 . A A . 39 CYS HB3 1 1 44 27298 1 1 39 CYS N N 2.405 2.293 4.376 1.00 . A A . 39 CYS N 1 1 44 27299 1 1 39 CYS O O 4.881 1.222 5.750 1.00 . A A . 39 CYS O 1 1 44 27300 1 1 39 CYS SG S 3.150 1.060 1.373 1.00 . A A . 39 CYS SG 1 1 44 27301 1 1 40 PRO C C 5.545 -1.178 7.153 1.00 . A A . 40 PRO C 1 1 44 27302 1 1 40 PRO CA C 4.068 -0.881 7.388 1.00 . A A . 40 PRO CA 1 1 44 27303 1 1 40 PRO CB C 3.315 -2.164 7.747 1.00 . A A . 40 PRO CB 1 1 44 27304 1 1 40 PRO CD C 2.181 -1.203 5.877 1.00 . A A . 40 PRO CD 1 1 44 27305 1 1 40 PRO CG C 1.968 -1.996 7.136 1.00 . A A . 40 PRO CG 1 1 44 27306 1 1 40 PRO HA H 3.970 -0.166 8.192 1.00 . A A . 40 PRO HA 1 1 44 27307 1 1 40 PRO HB2 H 3.834 -3.016 7.333 1.00 . A A . 40 PRO HB2 1 1 44 27308 1 1 40 PRO HB3 H 3.252 -2.260 8.820 1.00 . A A . 40 PRO HB3 1 1 44 27309 1 1 40 PRO HD2 H 2.345 -1.864 5.038 1.00 . A A . 40 PRO HD2 1 1 44 27310 1 1 40 PRO HD3 H 1.337 -0.556 5.691 1.00 . A A . 40 PRO HD3 1 1 44 27311 1 1 40 PRO HG2 H 1.546 -2.963 6.904 1.00 . A A . 40 PRO HG2 1 1 44 27312 1 1 40 PRO HG3 H 1.322 -1.457 7.813 1.00 . A A . 40 PRO HG3 1 1 44 27313 1 1 40 PRO N N 3.393 -0.415 6.171 1.00 . A A . 40 PRO N 1 1 44 27314 1 1 40 PRO O O 6.040 -1.069 6.032 1.00 . A A . 40 PRO O 1 1 44 27315 1 1 41 SER C C 7.901 -3.369 8.274 1.00 . A A . 41 SER C 1 1 44 27316 1 1 41 SER CA C 7.665 -1.869 8.129 1.00 . A A . 41 SER CA 1 1 44 27317 1 1 41 SER CB C 8.445 -1.111 9.206 1.00 . A A . 41 SER CB 1 1 44 27318 1 1 41 SER H H 5.793 -1.624 9.087 1.00 . A A . 41 SER H 1 1 44 27319 1 1 41 SER HA H 8.013 -1.554 7.157 1.00 . A A . 41 SER HA 1 1 44 27320 1 1 41 SER HB2 H 9.389 -1.606 9.379 1.00 . A A . 41 SER HB2 1 1 44 27321 1 1 41 SER HB3 H 8.625 -0.099 8.871 1.00 . A A . 41 SER HB3 1 1 44 27322 1 1 41 SER HG H 7.357 -1.935 10.611 1.00 . A A . 41 SER HG 1 1 44 27323 1 1 41 SER N N 6.244 -1.555 8.219 1.00 . A A . 41 SER N 1 1 44 27324 1 1 41 SER O O 8.858 -3.798 8.919 1.00 . A A . 41 SER O 1 1 44 27325 1 1 41 SER OG O 7.722 -1.067 10.424 1.00 . A A . 41 SER OG 1 1 44 27326 1 1 42 TYR C C 7.635 -6.179 6.404 1.00 . A A . 42 TYR C 1 1 44 27327 1 1 42 TYR CA C 7.134 -5.614 7.732 1.00 . A A . 42 TYR CA 1 1 44 27328 1 1 42 TYR CB C 5.782 -6.236 8.086 1.00 . A A . 42 TYR CB 1 1 44 27329 1 1 42 TYR CD1 C 6.273 -6.561 10.541 1.00 . A A . 42 TYR CD1 1 1 44 27330 1 1 42 TYR CD2 C 4.217 -5.519 9.932 1.00 . A A . 42 TYR CD2 1 1 44 27331 1 1 42 TYR CE1 C 5.943 -6.441 11.878 1.00 . A A . 42 TYR CE1 1 1 44 27332 1 1 42 TYR CE2 C 3.880 -5.395 11.267 1.00 . A A . 42 TYR CE2 1 1 44 27333 1 1 42 TYR CG C 5.418 -6.103 9.547 1.00 . A A . 42 TYR CG 1 1 44 27334 1 1 42 TYR CZ C 4.746 -5.858 12.235 1.00 . A A . 42 TYR CZ 1 1 44 27335 1 1 42 TYR H H 6.280 -3.760 7.171 1.00 . A A . 42 TYR H 1 1 44 27336 1 1 42 TYR HA H 7.847 -5.859 8.505 1.00 . A A . 42 TYR HA 1 1 44 27337 1 1 42 TYR HB2 H 5.009 -5.754 7.506 1.00 . A A . 42 TYR HB2 1 1 44 27338 1 1 42 TYR HB3 H 5.804 -7.289 7.843 1.00 . A A . 42 TYR HB3 1 1 44 27339 1 1 42 TYR HD1 H 7.211 -7.017 10.258 1.00 . A A . 42 TYR HD1 1 1 44 27340 1 1 42 TYR HD2 H 3.541 -5.159 9.172 1.00 . A A . 42 TYR HD2 1 1 44 27341 1 1 42 TYR HE1 H 6.622 -6.803 12.636 1.00 . A A . 42 TYR HE1 1 1 44 27342 1 1 42 TYR HE2 H 2.942 -4.939 11.546 1.00 . A A . 42 TYR HE2 1 1 44 27343 1 1 42 TYR HH H 4.020 -6.555 13.873 1.00 . A A . 42 TYR HH 1 1 44 27344 1 1 42 TYR N N 7.022 -4.162 7.670 1.00 . A A . 42 TYR N 1 1 44 27345 1 1 42 TYR O O 6.842 -6.538 5.534 1.00 . A A . 42 TYR O 1 1 44 27346 1 1 42 TYR OH O 4.414 -5.736 13.565 1.00 . A A . 42 TYR OH 1 1 44 27347 1 1 43 PRO C C 9.342 -8.289 4.840 1.00 . A A . 43 PRO C 1 1 44 27348 1 1 43 PRO CA C 9.569 -6.790 5.002 1.00 . A A . 43 PRO CA 1 1 44 27349 1 1 43 PRO CB C 11.059 -6.492 5.180 1.00 . A A . 43 PRO CB 1 1 44 27350 1 1 43 PRO CD C 9.984 -5.860 7.218 1.00 . A A . 43 PRO CD 1 1 44 27351 1 1 43 PRO CG C 11.259 -6.423 6.654 1.00 . A A . 43 PRO CG 1 1 44 27352 1 1 43 PRO HA H 9.198 -6.274 4.128 1.00 . A A . 43 PRO HA 1 1 44 27353 1 1 43 PRO HB2 H 11.644 -7.286 4.738 1.00 . A A . 43 PRO HB2 1 1 44 27354 1 1 43 PRO HB3 H 11.301 -5.552 4.706 1.00 . A A . 43 PRO HB3 1 1 44 27355 1 1 43 PRO HD2 H 9.776 -6.291 8.186 1.00 . A A . 43 PRO HD2 1 1 44 27356 1 1 43 PRO HD3 H 10.045 -4.784 7.288 1.00 . A A . 43 PRO HD3 1 1 44 27357 1 1 43 PRO HG2 H 11.437 -7.413 7.047 1.00 . A A . 43 PRO HG2 1 1 44 27358 1 1 43 PRO HG3 H 12.089 -5.772 6.883 1.00 . A A . 43 PRO HG3 1 1 44 27359 1 1 43 PRO N N 8.966 -6.265 6.231 1.00 . A A . 43 PRO N 1 1 44 27360 1 1 43 PRO O O 9.714 -9.081 5.706 1.00 . A A . 43 PRO O 1 1 44 27361 1 1 44 GLY C C 8.665 -10.449 2.014 1.00 . A A . 44 GLY C 1 1 44 27362 1 1 44 GLY CA C 8.461 -10.075 3.469 1.00 . A A . 44 GLY CA 1 1 44 27363 1 1 44 GLY H H 8.454 -7.996 3.070 1.00 . A A . 44 GLY H 1 1 44 27364 1 1 44 GLY HA2 H 7.440 -10.292 3.746 1.00 . A A . 44 GLY HA2 1 1 44 27365 1 1 44 GLY HA3 H 9.123 -10.673 4.079 1.00 . A A . 44 GLY HA3 1 1 44 27366 1 1 44 GLY N N 8.728 -8.672 3.725 1.00 . A A . 44 GLY N 1 1 44 27367 1 1 44 GLY O O 9.090 -11.594 1.750 1.00 . A A . 44 GLY O 1 1 44 27368 1 1 44 GLY OXT O 8.400 -9.598 1.140 1.00 . A A . 44 GLY OXT 1 1 stop_ save_
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