NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
634190 | 6mk4 | 30521 | cing | 4-filtered-FRED | STAR | entry | full | 399 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6mk4 # This FRED archive file contains, for PDB entry <6mk4>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_6mk4 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6mk4 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3831.69 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 $Beta_omega_theraphotoxin_Tp2a A . 1 1 stop_ save_ save_Beta_omega_theraphotoxin_Tp2a _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Beta omega theraphotoxin Tp2a" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code YCQKWMWTCDSERKCCKGMVCRLWCKKKLW _Entity.Number_of_monomers 30 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 TYR . 1 1 2 CYS . 1 1 3 GLN . 1 1 4 LYS . 1 1 5 TRP . 1 1 6 MET . 1 1 7 TRP . 1 1 8 THR . 1 1 9 CYS . 1 1 10 ASP . 1 1 11 SER . 1 1 12 GLU . 1 1 13 ARG . 1 1 14 LYS . 1 1 15 CYS . 1 1 16 CYS . 1 1 17 LYS . 1 1 18 GLY . 1 1 19 MET . 1 1 20 VAL . 1 1 21 CYS . 1 1 22 ARG . 1 1 23 LEU . 1 1 24 TRP . 1 1 25 CYS . 1 1 26 LYS . 1 1 27 LYS . 1 1 28 LYS . 1 1 29 LEU . 1 1 30 TRP . 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 TYR 1 1 1 1 CYS 2 2 1 1 GLN 3 3 1 1 LYS 4 4 1 1 TRP 5 5 1 1 MET 6 6 1 1 TRP 7 7 1 1 THR 8 8 1 1 CYS 9 9 1 1 ASP 10 10 1 1 SER 11 11 1 1 GLU 12 12 1 1 ARG 13 13 1 1 LYS 14 14 1 1 CYS 15 15 1 1 CYS 16 16 1 1 LYS 17 17 1 1 GLY 18 18 1 1 MET 19 19 1 1 VAL 20 20 1 1 CYS 21 21 1 1 ARG 22 22 1 1 LEU 23 23 1 1 TRP 24 24 1 1 CYS 25 25 1 1 LYS 26 26 1 1 LYS 27 27 1 1 LYS 28 28 1 1 LEU 29 29 1 1 TRP 30 30 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 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 4 LYS H . 4 . HN 1 1 1 1 2 1 1 7 TRP HZ3 . 7 . HZ3 1 1 2 1 1 1 1 3 GLN HA . 3 . HA 1 1 2 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 3 1 1 1 1 3 GLN HA . 3 . HA 1 1 3 1 2 1 1 7 TRP HZ3 . 7 . HZ3 1 1 4 1 1 1 1 2 CYS HA . 2 . HA 1 1 4 1 2 1 1 3 GLN H . 3 . HN 1 1 5 1 1 1 1 4 LYS H . 4 . HN 1 1 5 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 6 1 1 1 1 4 LYS H . 4 . HN 1 1 6 1 2 1 1 5 TRP H . 5 . HN 1 1 7 1 1 1 1 5 TRP HA . 5 . HA 1 1 7 1 2 1 1 6 MET H . 6 . HN 1 1 8 1 1 1 1 7 TRP HA . 7 . HA 1 1 8 1 2 1 1 8 THR H . 8 . HN 1 1 9 1 1 1 1 8 THR HA . 8 . HA 1 1 9 1 2 1 1 9 CYS H . 9 . HN 1 1 10 1 1 1 1 9 CYS HA . 9 . HA 1 1 10 1 2 1 1 10 ASP H . 10 . HN 1 1 11 1 1 1 1 10 ASP HA . 10 . HA 1 1 11 1 2 1 1 11 SER H . 11 . HN 1 1 12 1 1 1 1 13 ARG HA . 13 . HA 1 1 12 1 2 1 1 14 LYS H . 14 . HN 1 1 13 1 1 1 1 14 LYS HA . 14 . HA 1 1 13 1 2 1 1 15 CYS H . 15 . HN 1 1 14 1 1 1 1 15 CYS HA . 15 . HA 1 1 14 1 2 1 1 16 CYS H . 16 . HN 1 1 15 1 1 1 1 17 LYS HA . 17 . HA 1 1 15 1 2 1 1 18 GLY H . 18 . HN 1 1 16 1 1 1 1 19 MET HA . 19 . HA 1 1 16 1 2 1 1 20 VAL H . 20 . HN 1 1 17 1 1 1 1 23 LEU H . 23 . HN 1 1 17 1 2 1 1 23 LEU HA . 23 . HA 1 1 18 1 1 1 1 16 CYS HA . 16 . HA 1 1 18 1 2 1 1 17 LYS H . 17 . HN 1 1 19 1 1 1 1 22 ARG HA . 22 . HA 1 1 19 1 2 1 1 23 LEU H . 23 . HN 1 1 20 1 1 1 1 20 VAL HA . 20 . HA 1 1 20 1 2 1 1 21 CYS H . 21 . HN 1 1 21 1 1 1 1 24 TRP HA . 24 . HA 1 1 21 1 2 1 1 25 CYS H . 25 . HN 1 1 22 1 1 1 1 25 CYS HA . 25 . HA 1 1 22 1 2 1 1 26 LYS H . 26 . HN 1 1 23 1 1 1 1 26 LYS HA . 26 . HA 1 1 23 1 2 1 1 27 LYS H . 27 . HN 1 1 24 1 1 1 1 27 LYS HA . 27 . HA 1 1 24 1 2 1 1 28 LYS H . 28 . HN 1 1 25 1 1 1 1 28 LYS HA . 28 . HA 1 1 25 1 2 1 1 29 LEU H . 29 . HN 1 1 26 1 1 1 1 1 TYR HB2 . 1 . HB2 1 1 26 1 2 1 1 2 CYS H . 2 . HN 1 1 27 1 1 1 1 2 CYS HB3 . 2 . HB1 1 1 27 1 2 1 1 3 GLN H . 3 . HN 1 1 28 1 1 1 1 2 CYS HB2 . 2 . HB2 1 1 28 1 2 1 1 3 GLN H . 3 . HN 1 1 29 1 1 1 1 3 GLN H . 3 . HN 1 1 29 1 2 1 1 3 GLN HG3 . 3 . HG1 1 1 30 1 1 1 1 3 GLN HG3 . 3 . HG1 1 1 30 1 2 1 1 15 CYS H . 15 . HN 1 1 31 1 1 1 1 3 GLN H . 3 . HN 1 1 31 1 2 1 1 3 GLN HB2 . 3 . HB2 1 1 32 1 1 1 1 3 GLN H . 3 . HN 1 1 32 1 2 1 1 3 GLN HB3 . 3 . HB1 1 1 33 1 1 1 1 3 GLN H . 3 . HN 1 1 33 1 2 1 1 3 GLN HG2 . 3 . HG2 1 1 34 1 1 1 1 3 GLN HA . 3 . HA 1 1 34 1 2 1 1 3 GLN HG2 . 3 . HG2 1 1 35 1 1 1 1 3 GLN HG3 . 3 . HG1 1 1 35 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 36 1 1 1 1 3 GLN HG2 . 3 . HG2 1 1 36 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 37 1 1 1 1 3 GLN HB3 . 3 . HB1 1 1 37 1 2 1 1 3 GLN HE22 . 3 . HE22 1 1 38 1 1 1 1 3 GLN HB2 . 3 . HB2 1 1 38 1 2 1 1 3 GLN HE22 . 3 . HE22 1 1 39 1 1 1 1 3 GLN HE22 . 3 . HE22 1 1 39 1 2 1 1 3 GLN HG3 . 3 . HG1 1 1 40 1 1 1 1 3 GLN HA . 3 . HA 1 1 40 1 2 1 1 3 GLN HE22 . 3 . HE22 1 1 41 1 1 1 1 5 TRP H . 5 . HN 1 1 41 1 2 1 1 5 TRP QB . 5 . HB# 1 1 42 1 1 1 1 5 TRP QB . 5 . HB# 1 1 42 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 43 1 1 1 1 1 TYR HB3 . 1 . HB1 1 1 43 1 2 1 1 2 CYS H . 2 . HN 1 1 44 1 1 1 1 6 MET H . 6 . HN 1 1 44 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 45 1 1 1 1 6 MET H . 6 . HN 1 1 45 1 2 1 1 6 MET HG2 . 6 . HG2 1 1 46 1 1 1 1 6 MET HA . 6 . HA 1 1 46 1 2 1 1 6 MET HG2 . 6 . HG2 1 1 47 1 1 1 1 6 MET HA . 6 . HA 1 1 47 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 48 1 1 1 1 7 TRP H . 7 . HN 1 1 48 1 2 1 1 7 TRP HB2 . 7 . HB2 1 1 49 1 1 1 1 7 TRP H . 7 . HN 1 1 49 1 2 1 1 7 TRP HB3 . 7 . HB1 1 1 50 1 1 1 1 3 GLN HE22 . 3 . HE22 1 1 50 1 2 1 1 7 TRP HB3 . 7 . HB1 1 1 51 1 1 1 1 3 GLN HE22 . 3 . HE22 1 1 51 1 2 1 1 7 TRP HB2 . 7 . HB2 1 1 52 1 1 1 1 7 TRP HA . 7 . HA 1 1 52 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 53 1 1 1 1 7 TRP H . 7 . HN 1 1 53 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 54 1 1 1 1 8 THR HB . 8 . HB 1 1 54 1 2 1 1 9 CYS H . 9 . HN 1 1 55 1 1 1 1 8 THR H . 8 . HN 1 1 55 1 2 1 1 8 THR MG . 8 . HG2# 1 1 56 1 1 1 1 8 THR HA . 8 . HA 1 1 56 1 2 1 1 8 THR MG . 8 . HG2# 1 1 57 1 1 1 1 10 ASP HA . 10 . HA 1 1 57 1 2 1 1 10 ASP QB . 10 . HB# 1 1 58 1 1 1 1 11 SER H . 11 . HN 1 1 58 1 2 1 1 11 SER QB . 11 . HB# 1 1 59 1 1 1 1 11 SER QB . 11 . HB# 1 1 59 1 2 1 1 12 GLU H . 12 . HN 1 1 60 1 1 1 1 12 GLU HA . 12 . HA 1 1 60 1 2 1 1 12 GLU QG . 12 . HG# 1 1 61 1 1 1 1 12 GLU H . 12 . HN 1 1 61 1 2 1 1 12 GLU QG . 12 . HG# 1 1 62 1 1 1 1 12 GLU H . 12 . HN 1 1 62 1 2 1 1 12 GLU HB2 . 12 . HB2 1 1 63 1 1 1 1 12 GLU HB2 . 12 . HB2 1 1 63 1 2 1 1 13 ARG H . 13 . HN 1 1 64 1 1 1 1 12 GLU H . 12 . HN 1 1 64 1 2 1 1 12 GLU HB3 . 12 . HB1 1 1 65 1 1 1 1 12 GLU HB3 . 12 . HB1 1 1 65 1 2 1 1 13 ARG H . 13 . HN 1 1 66 1 1 1 1 13 ARG HA . 13 . HA 1 1 66 1 2 1 1 13 ARG QG . 13 . HG# 1 1 67 1 1 1 1 13 ARG HB2 . 13 . HB2 1 1 67 1 2 1 1 13 ARG HE . 13 . HE 1 1 68 1 1 1 1 13 ARG HE . 13 . HE 1 1 68 1 2 1 1 13 ARG QG . 13 . HG# 1 1 69 1 1 1 1 13 ARG HB3 . 13 . HB1 1 1 69 1 2 1 1 13 ARG HE . 13 . HE 1 1 70 1 1 1 1 13 ARG H . 13 . HN 1 1 70 1 2 1 1 13 ARG HB2 . 13 . HB2 1 1 71 1 1 1 1 13 ARG H . 13 . HN 1 1 71 1 2 1 1 13 ARG QG . 13 . HG# 1 1 72 1 1 1 1 13 ARG H . 13 . HN 1 1 72 1 2 1 1 13 ARG HB3 . 13 . HB1 1 1 73 1 1 1 1 12 GLU QG . 12 . HG# 1 1 73 1 2 1 1 13 ARG H . 13 . HN 1 1 74 1 1 1 1 14 LYS HA . 14 . HA 1 1 74 1 2 1 1 14 LYS QG . 14 . HG# 1 1 75 1 1 1 1 14 LYS H . 14 . HN 1 1 75 1 2 1 1 14 LYS HB2 . 14 . HB2 1 1 76 1 1 1 1 14 LYS H . 14 . HN 1 1 76 1 2 1 1 14 LYS HB3 . 14 . HB1 1 1 77 1 1 1 1 14 LYS H . 14 . HN 1 1 77 1 2 1 1 14 LYS QG . 14 . HG# 1 1 78 1 1 1 1 14 LYS HA . 14 . HA 1 1 78 1 2 1 1 14 LYS QE . 14 . HE# 1 1 79 1 1 1 1 15 CYS H . 15 . HN 1 1 79 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 80 1 1 1 1 15 CYS H . 15 . HN 1 1 80 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 81 1 1 1 1 16 CYS H . 16 . HN 1 1 81 1 2 1 1 16 CYS HB3 . 16 . HB1 1 1 82 1 1 1 1 16 CYS H . 16 . HN 1 1 82 1 2 1 1 16 CYS HB2 . 16 . HB2 1 1 83 1 1 1 1 16 CYS HB3 . 16 . HB1 1 1 83 1 2 1 1 17 LYS H . 17 . HN 1 1 84 1 1 1 1 16 CYS HB2 . 16 . HB2 1 1 84 1 2 1 1 17 LYS H . 17 . HN 1 1 85 1 1 1 1 23 LEU H . 23 . HN 1 1 85 1 2 1 1 23 LEU HB3 . 23 . HB1 1 1 86 1 1 1 1 29 LEU H . 29 . HN 1 1 86 1 2 1 1 29 LEU MD1 . 29 . HD1# 1 1 87 1 1 1 1 23 LEU H . 23 . HN 1 1 87 1 2 1 1 23 LEU MD2 . 23 . HD2# 1 1 88 1 1 1 1 29 LEU H . 29 . HN 1 1 88 1 2 1 1 29 LEU MD2 . 29 . HD2# 1 1 89 1 1 1 1 23 LEU H . 23 . HN 1 1 89 1 2 1 1 23 LEU HG . 23 . HG 1 1 90 1 1 1 1 17 LYS HB2 . 17 . HB2 1 1 90 1 2 1 1 17 LYS QZ . 17 . QZ 1 1 91 1 1 1 1 17 LYS HB3 . 17 . HB1 1 1 91 1 2 1 1 17 LYS QZ . 17 . QZ 1 1 92 1 1 1 1 17 LYS HA . 17 . HA 1 1 92 1 2 1 1 17 LYS QE . 17 . HE# 1 1 93 1 1 1 1 19 MET HA . 19 . HA 1 1 93 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 94 1 1 1 1 19 MET HA . 19 . HA 1 1 94 1 2 1 1 19 MET HG2 . 19 . HG2 1 1 95 1 1 1 1 19 MET H . 19 . HN 1 1 95 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 96 1 1 1 1 19 MET H . 19 . HN 1 1 96 1 2 1 1 19 MET HB2 . 19 . HB2 1 1 97 1 1 1 1 19 MET HB3 . 19 . HB1 1 1 97 1 2 1 1 20 VAL H . 20 . HN 1 1 98 1 1 1 1 21 CYS H . 21 . HN 1 1 98 1 2 1 1 21 CYS HB2 . 21 . HB2 1 1 99 1 1 1 1 21 CYS H . 21 . HN 1 1 99 1 2 1 1 21 CYS HB3 . 21 . HB1 1 1 100 1 1 1 1 22 ARG HB2 . 22 . HB2 1 1 100 1 2 1 1 22 ARG HE . 22 . HE 1 1 101 1 1 1 1 22 ARG HB3 . 22 . HB1 1 1 101 1 2 1 1 22 ARG HE . 22 . HE 1 1 102 1 1 1 1 22 ARG H . 22 . HN 1 1 102 1 2 1 1 22 ARG QG . 22 . HG# 1 1 103 1 1 1 1 22 ARG H . 22 . HN 1 1 103 1 2 1 1 22 ARG HB3 . 22 . HB1 1 1 104 1 1 1 1 22 ARG H . 22 . HN 1 1 104 1 2 1 1 22 ARG HB2 . 22 . HB2 1 1 105 1 1 1 1 22 ARG HA . 22 . HA 1 1 105 1 2 1 1 22 ARG HD2 . 22 . HD2 1 1 106 1 1 1 1 22 ARG HA . 22 . HA 1 1 106 1 2 1 1 22 ARG HD3 . 22 . HD1 1 1 107 1 1 1 1 22 ARG HA . 22 . HA 1 1 107 1 2 1 1 22 ARG QG . 22 . HG# 1 1 108 1 1 1 1 23 LEU HA . 23 . HA 1 1 108 1 2 1 1 23 LEU HG . 23 . HG 1 1 109 1 1 1 1 24 TRP H . 24 . HN 1 1 109 1 2 1 1 24 TRP HB2 . 24 . HB2 1 1 110 1 1 1 1 24 TRP H . 24 . HN 1 1 110 1 2 1 1 24 TRP HB3 . 24 . HB1 1 1 111 1 1 1 1 24 TRP HB3 . 24 . HB1 1 1 111 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 112 1 1 1 1 24 TRP HB2 . 24 . HB2 1 1 112 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 113 1 1 1 1 24 TRP HB3 . 24 . HB1 1 1 113 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 114 1 1 1 1 24 TRP HA . 24 . HA 1 1 114 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 115 1 1 1 1 24 TRP HA . 24 . HA 1 1 115 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 116 1 1 1 1 25 CYS H . 25 . HN 1 1 116 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1 117 1 1 1 1 25 CYS H . 25 . HN 1 1 117 1 2 1 1 25 CYS HB3 . 25 . HB1 1 1 118 1 1 1 1 26 LYS HG3 . 26 . HG1 1 1 118 1 2 1 1 26 LYS QZ . 26 . QZ 1 1 119 1 1 1 1 26 LYS H . 26 . HN 1 1 119 1 2 1 1 26 LYS HG2 . 26 . HG2 1 1 120 1 1 1 1 26 LYS H . 26 . HN 1 1 120 1 2 1 1 26 LYS HG3 . 26 . HG1 1 1 121 1 1 1 1 26 LYS H . 26 . HN 1 1 121 1 2 1 1 26 LYS HB2 . 26 . HB2 1 1 122 1 1 1 1 26 LYS H . 26 . HN 1 1 122 1 2 1 1 26 LYS HB3 . 26 . HB1 1 1 123 1 1 1 1 26 LYS HA . 26 . HA 1 1 123 1 2 1 1 26 LYS QE . 26 . HE# 1 1 124 1 1 1 1 26 LYS HA . 26 . HA 1 1 124 1 2 1 1 26 LYS HG3 . 26 . HG1 1 1 125 1 1 1 1 26 LYS HA . 26 . HA 1 1 125 1 2 1 1 26 LYS HG2 . 26 . HG2 1 1 126 1 1 1 1 27 LYS H . 27 . HN 1 1 126 1 2 1 1 27 LYS HB2 . 27 . HB2 1 1 127 1 1 1 1 27 LYS H . 27 . HN 1 1 127 1 2 1 1 27 LYS HB3 . 27 . HB1 1 1 128 1 1 1 1 27 LYS HB2 . 27 . HB2 1 1 128 1 2 1 1 27 LYS QZ . 27 . QZ 1 1 129 1 1 1 1 27 LYS HB3 . 27 . HB1 1 1 129 1 2 1 1 27 LYS QZ . 27 . QZ 1 1 130 1 1 1 1 28 LYS H . 28 . HN 1 1 130 1 2 1 1 28 LYS HB2 . 28 . HB2 1 1 131 1 1 1 1 28 LYS H . 28 . HN 1 1 131 1 2 1 1 28 LYS HB3 . 28 . HB1 1 1 132 1 1 1 1 28 LYS H . 28 . HN 1 1 132 1 2 1 1 28 LYS QG . 28 . HG# 1 1 133 1 1 1 1 28 LYS HB2 . 28 . HB2 1 1 133 1 2 1 1 28 LYS QZ . 28 . QZ 1 1 134 1 1 1 1 28 LYS HB3 . 28 . HB1 1 1 134 1 2 1 1 28 LYS QZ . 28 . QZ 1 1 135 1 1 1 1 28 LYS HA . 28 . HA 1 1 135 1 2 1 1 28 LYS QE . 28 . HE# 1 1 136 1 1 1 1 22 ARG QG . 22 . HG# 1 1 136 1 2 1 1 23 LEU H . 23 . HN 1 1 137 1 1 1 1 29 LEU H . 29 . HN 1 1 137 1 2 1 1 29 LEU QB . 29 . HB# 1 1 138 1 1 1 1 4 LYS HA . 4 . HA 1 1 138 1 2 1 1 4 LYS HG2 . 4 . HG2 1 1 139 1 1 1 1 4 LYS HA . 4 . HA 1 1 139 1 2 1 1 4 LYS QE . 4 . HE# 1 1 140 1 1 1 1 4 LYS HA . 4 . HA 1 1 140 1 2 1 1 5 TRP H . 5 . HN 1 1 141 1 1 1 1 19 MET HA . 19 . HA 1 1 141 1 2 1 1 28 LYS H . 28 . HN 1 1 142 1 1 1 1 22 ARG H . 22 . HN 1 1 142 1 2 1 1 25 CYS HA . 25 . HA 1 1 143 1 1 1 1 8 THR HA . 8 . HA 1 1 143 1 2 1 1 25 CYS H . 25 . HN 1 1 144 1 1 1 1 5 TRP HA . 5 . HA 1 1 144 1 2 1 1 7 TRP H . 7 . HN 1 1 145 1 1 1 1 5 TRP HA . 5 . HA 1 1 145 1 2 1 1 25 CYS H . 25 . HN 1 1 146 1 1 1 1 26 LYS H . 26 . HN 1 1 146 1 2 1 1 27 LYS HA . 27 . HA 1 1 147 1 1 1 1 20 VAL HA . 20 . HA 1 1 147 1 2 1 1 26 LYS H . 26 . HN 1 1 148 1 1 1 1 25 CYS HB3 . 25 . HB1 1 1 148 1 2 1 1 26 LYS H . 26 . HN 1 1 149 1 1 1 1 19 MET HG2 . 19 . HG2 1 1 149 1 2 1 1 26 LYS H . 26 . HN 1 1 150 1 1 1 1 19 MET HB3 . 19 . HB1 1 1 150 1 2 1 1 26 LYS H . 26 . HN 1 1 151 1 1 1 1 20 VAL H . 20 . HN 1 1 151 1 2 1 1 26 LYS HG3 . 26 . HG1 1 1 152 1 1 1 1 20 VAL H . 20 . HN 1 1 152 1 2 1 1 26 LYS HG2 . 26 . HG2 1 1 153 1 1 1 1 17 LYS HB3 . 17 . HB1 1 1 153 1 2 1 1 18 GLY H . 18 . HN 1 1 154 1 1 1 1 17 LYS HB2 . 17 . HB2 1 1 154 1 2 1 1 18 GLY H . 18 . HN 1 1 155 1 1 1 1 20 VAL HB . 20 . HB 1 1 155 1 2 1 1 21 CYS H . 21 . HN 1 1 156 1 1 1 1 24 TRP HB2 . 24 . HB2 1 1 156 1 2 1 1 25 CYS H . 25 . HN 1 1 157 1 1 1 1 24 TRP HB3 . 24 . HB1 1 1 157 1 2 1 1 25 CYS H . 25 . HN 1 1 158 1 1 1 1 9 CYS HB3 . 9 . HB1 1 1 158 1 2 1 1 10 ASP H . 10 . HN 1 1 159 1 1 1 1 9 CYS HB2 . 9 . HB2 1 1 159 1 2 1 1 10 ASP H . 10 . HN 1 1 160 1 1 1 1 7 TRP HB3 . 7 . HB1 1 1 160 1 2 1 1 8 THR H . 8 . HN 1 1 161 1 1 1 1 7 TRP HB2 . 7 . HB2 1 1 161 1 2 1 1 8 THR H . 8 . HN 1 1 162 1 1 1 1 9 CYS HB3 . 9 . HB1 1 1 162 1 2 1 1 15 CYS H . 15 . HN 1 1 163 1 1 1 1 9 CYS HB2 . 9 . HB2 1 1 163 1 2 1 1 15 CYS H . 15 . HN 1 1 164 1 1 1 1 5 TRP QB . 5 . HB# 1 1 164 1 2 1 1 6 MET H . 6 . HN 1 1 165 1 1 1 1 19 MET HB2 . 19 . HB2 1 1 165 1 2 1 1 20 VAL H . 20 . HN 1 1 166 1 1 1 1 19 MET HG2 . 19 . HG2 1 1 166 1 2 1 1 20 VAL H . 20 . HN 1 1 167 1 1 1 1 24 TRP HE1 . 24 . HE1 1 1 167 1 2 1 1 26 LYS HG3 . 26 . HG1 1 1 168 1 1 1 1 24 TRP HE1 . 24 . HE1 1 1 168 1 2 1 1 26 LYS QE . 26 . HE# 1 1 169 1 1 1 1 7 TRP HA . 7 . HA 1 1 169 1 2 1 1 7 TRP HE1 . 7 . HE1 1 1 170 1 1 1 1 20 VAL H . 20 . HN 1 1 170 1 2 1 1 26 LYS H . 26 . HN 1 1 171 1 1 1 1 25 CYS H . 25 . HN 1 1 171 1 2 1 1 26 LYS H . 26 . HN 1 1 172 1 1 1 1 26 LYS H . 26 . HN 1 1 172 1 2 1 1 27 LYS H . 27 . HN 1 1 173 1 1 1 1 22 ARG H . 22 . HN 1 1 173 1 2 1 1 26 LYS H . 26 . HN 1 1 174 1 1 1 1 5 TRP HD1 . 5 . HD1 1 1 174 1 2 1 1 6 MET H . 6 . HN 1 1 175 1 1 1 1 14 LYS H . 14 . HN 1 1 175 1 2 1 1 15 CYS H . 15 . HN 1 1 176 1 1 1 1 6 MET H . 6 . HN 1 1 176 1 2 1 1 7 TRP H . 7 . HN 1 1 177 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 177 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 178 1 1 1 1 18 GLY H . 18 . HN 1 1 178 1 2 1 1 19 MET H . 19 . HN 1 1 179 1 1 1 1 24 TRP HD1 . 24 . HD1 1 1 179 1 2 1 1 25 CYS H . 25 . HN 1 1 180 1 1 1 1 13 ARG H . 13 . HN 1 1 180 1 2 1 1 13 ARG HE . 13 . HE 1 1 181 1 1 1 1 1 TYR QD . 1 . HD# 1 1 181 1 2 1 1 2 CYS H . 2 . HN 1 1 182 1 1 1 1 29 LEU H . 29 . HN 1 1 182 1 2 1 1 30 TRP H . 30 . HN 1 1 183 1 1 1 1 24 TRP H . 24 . HN 1 1 183 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 184 1 1 1 1 10 ASP H . 10 . HN 1 1 184 1 2 1 1 13 ARG H . 13 . HN 1 1 185 1 1 1 1 27 LYS H . 27 . HN 1 1 185 1 2 1 1 28 LYS H . 28 . HN 1 1 186 1 1 1 1 11 SER H . 11 . HN 1 1 186 1 2 1 1 12 GLU H . 12 . HN 1 1 187 1 1 1 1 5 TRP H . 5 . HN 1 1 187 1 2 1 1 6 MET H . 6 . HN 1 1 188 1 1 1 1 19 MET H . 19 . HN 1 1 188 1 2 1 1 20 VAL H . 20 . HN 1 1 189 1 1 1 1 17 LYS H . 17 . HN 1 1 189 1 2 1 1 18 GLY H . 18 . HN 1 1 190 1 1 1 1 2 CYS H . 2 . HN 1 1 190 1 2 1 1 3 GLN H . 3 . HN 1 1 191 1 1 1 1 4 LYS HG3 . 4 . HG1 1 1 191 1 2 1 1 7 TRP HZ3 . 7 . HZ3 1 1 192 1 1 1 1 4 LYS HG3 . 4 . HG1 1 1 192 1 2 1 1 7 TRP HH2 . 7 . HH2 1 1 193 1 1 1 1 4 LYS HG3 . 4 . HG1 1 1 193 1 2 1 1 7 TRP HZ2 . 7 . HZ2 1 1 194 1 1 1 1 4 LYS HG3 . 4 . HG1 1 1 194 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 195 1 1 1 1 4 LYS HG3 . 4 . HG1 1 1 195 1 2 1 1 5 TRP H . 5 . HN 1 1 196 1 1 1 1 4 LYS HG2 . 4 . HG2 1 1 196 1 2 1 1 5 TRP H . 5 . HN 1 1 197 1 1 1 1 8 THR MG . 8 . HG2# 1 1 197 1 2 1 1 9 CYS H . 9 . HN 1 1 198 1 1 1 1 4 LYS HB3 . 4 . HB1 1 1 198 1 2 1 1 5 TRP H . 5 . HN 1 1 199 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 199 1 2 1 1 5 TRP H . 5 . HN 1 1 200 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 200 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 201 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 201 1 2 1 1 7 TRP HZ2 . 7 . HZ2 1 1 202 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 202 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 203 1 1 1 1 28 LYS QG . 28 . HG# 1 1 203 1 2 1 1 29 LEU H . 29 . HN 1 1 204 1 1 1 1 28 LYS QG . 28 . HG# 1 1 204 1 2 1 1 30 TRP H . 30 . HN 1 1 205 1 1 1 1 7 TRP HB3 . 7 . HB1 1 1 205 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 206 1 1 1 1 7 TRP HB2 . 7 . HB2 1 1 206 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 207 1 1 1 1 17 LYS HA . 17 . HA 1 1 207 1 2 1 1 19 MET H . 19 . HN 1 1 208 1 1 1 1 5 TRP HD1 . 5 . HD1 1 1 208 1 2 1 1 6 MET HA . 6 . HA 1 1 209 1 1 1 1 1 TYR HA . 1 . HA 1 1 209 1 2 1 1 1 TYR QD . 1 . HD# 1 1 210 1 1 1 1 8 THR HA . 8 . HA 1 1 210 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 211 1 1 1 1 27 LYS HA . 27 . HA 1 1 211 1 2 1 1 27 LYS QZ . 27 . QZ 1 1 212 1 1 1 1 9 CYS H . 9 . HN 1 1 212 1 2 1 1 24 TRP HA . 24 . HA 1 1 213 1 1 1 1 8 THR HA . 8 . HA 1 1 213 1 2 1 1 24 TRP HA . 24 . HA 1 1 214 1 1 1 1 8 THR MG . 8 . HG2# 1 1 214 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 215 1 1 1 1 6 MET HG2 . 6 . HG2 1 1 215 1 2 1 1 7 TRP H . 7 . HN 1 1 216 1 1 1 1 6 MET HG3 . 6 . HG1 1 1 216 1 2 1 1 7 TRP H . 7 . HN 1 1 217 1 1 1 1 6 MET HB2 . 6 . HB2 1 1 217 1 2 1 1 7 TRP H . 7 . HN 1 1 218 1 1 1 1 6 MET HB3 . 6 . HB1 1 1 218 1 2 1 1 7 TRP H . 7 . HN 1 1 219 1 1 1 1 10 ASP H . 10 . HN 1 1 219 1 2 1 1 13 ARG HB2 . 13 . HB2 1 1 220 1 1 1 1 10 ASP H . 10 . HN 1 1 220 1 2 1 1 13 ARG QG . 13 . HG# 1 1 221 1 1 1 1 10 ASP H . 10 . HN 1 1 221 1 2 1 1 13 ARG HB3 . 13 . HB1 1 1 222 1 1 1 1 8 THR MG . 8 . HG2# 1 1 222 1 2 1 1 25 CYS H . 25 . HN 1 1 223 1 1 1 1 9 CYS HA . 9 . HA 1 1 223 1 2 1 1 13 ARG H . 13 . HN 1 1 224 1 1 1 1 10 ASP QB . 10 . HB# 1 1 224 1 2 1 1 11 SER H . 11 . HN 1 1 225 1 1 1 1 21 CYS HB2 . 21 . HB2 1 1 225 1 2 1 1 22 ARG H . 22 . HN 1 1 226 1 1 1 1 21 CYS HB3 . 21 . HB1 1 1 226 1 2 1 1 22 ARG H . 22 . HN 1 1 227 1 1 1 1 10 ASP QB . 10 . HB# 1 1 227 1 2 1 1 12 GLU H . 12 . HN 1 1 228 1 1 1 1 10 ASP QB . 10 . HB# 1 1 228 1 2 1 1 13 ARG H . 13 . HN 1 1 229 1 1 1 1 13 ARG HB2 . 13 . HB2 1 1 229 1 2 1 1 14 LYS H . 14 . HN 1 1 230 1 1 1 1 13 ARG QG . 13 . HG# 1 1 230 1 2 1 1 14 LYS H . 14 . HN 1 1 231 1 1 1 1 13 ARG HB3 . 13 . HB1 1 1 231 1 2 1 1 14 LYS H . 14 . HN 1 1 232 1 1 1 1 14 LYS QG . 14 . HG# 1 1 232 1 2 1 1 15 CYS H . 15 . HN 1 1 233 1 1 1 1 14 LYS HB3 . 14 . HB1 1 1 233 1 2 1 1 15 CYS H . 15 . HN 1 1 234 1 1 1 1 14 LYS HB2 . 14 . HB2 1 1 234 1 2 1 1 15 CYS H . 15 . HN 1 1 235 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 235 1 2 1 1 7 TRP HE1 . 7 . HE1 1 1 236 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 236 1 2 1 1 7 TRP H . 7 . HN 1 1 237 1 1 1 1 23 LEU H . 23 . HN 1 1 237 1 2 1 1 23 LEU HB2 . 23 . HB2 1 1 238 1 1 1 1 23 LEU H . 23 . HN 1 1 238 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 1 239 1 1 1 1 26 LYS HG2 . 26 . HG2 1 1 239 1 2 1 1 27 LYS H . 27 . HN 1 1 240 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1 240 1 2 1 1 26 LYS H . 26 . HN 1 1 241 1 1 1 1 26 LYS HG3 . 26 . HG1 1 1 241 1 2 1 1 27 LYS H . 27 . HN 1 1 242 1 1 1 1 26 LYS HB2 . 26 . HB2 1 1 242 1 2 1 1 27 LYS H . 27 . HN 1 1 243 1 1 1 1 26 LYS HB3 . 26 . HB1 1 1 243 1 2 1 1 27 LYS H . 27 . HN 1 1 244 1 1 1 1 19 MET HG2 . 19 . HG2 1 1 244 1 2 1 1 27 LYS H . 27 . HN 1 1 245 1 1 1 1 27 LYS HB3 . 27 . HB1 1 1 245 1 2 1 1 28 LYS H . 28 . HN 1 1 246 1 1 1 1 27 LYS HB2 . 27 . HB2 1 1 246 1 2 1 1 28 LYS H . 28 . HN 1 1 247 1 1 1 1 29 LEU QB . 29 . HB# 1 1 247 1 2 1 1 30 TRP H . 30 . HN 1 1 248 1 1 1 1 29 LEU MD2 . 29 . HD2# 1 1 248 1 2 1 1 30 TRP H . 30 . HN 1 1 249 1 1 1 1 29 LEU MD1 . 29 . HD1# 1 1 249 1 2 1 1 30 TRP H . 30 . HN 1 1 250 1 1 1 1 3 GLN HB3 . 3 . HB1 1 1 250 1 2 1 1 3 GLN HE21 . 3 . HE21 1 1 251 1 1 1 1 3 GLN HB2 . 3 . HB2 1 1 251 1 2 1 1 3 GLN HE21 . 3 . HE21 1 1 252 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 252 1 2 1 1 3 GLN HG3 . 3 . HG1 1 1 253 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 253 1 2 1 1 9 CYS HA . 9 . HA 1 1 254 1 1 1 1 3 GLN HA . 3 . HA 1 1 254 1 2 1 1 3 GLN HE21 . 3 . HE21 1 1 255 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 255 1 2 1 1 7 TRP HB2 . 7 . HB2 1 1 256 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 256 1 2 1 1 7 TRP HB3 . 7 . HB1 1 1 257 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 257 1 2 1 1 13 ARG HD2 . 13 . HD2 1 1 258 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 258 1 2 1 1 9 CYS HB3 . 9 . HB1 1 1 259 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 259 1 2 1 1 13 ARG HD3 . 13 . HD1 1 1 260 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 260 1 2 1 1 13 ARG HB2 . 13 . HB2 1 1 261 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 261 1 2 1 1 13 ARG QG . 13 . HG# 1 1 262 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 262 1 2 1 1 13 ARG HB3 . 13 . HB1 1 1 263 1 1 1 1 10 ASP H . 10 . HN 1 1 263 1 2 1 1 11 SER H . 11 . HN 1 1 264 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 264 1 2 1 1 8 THR H . 8 . HN 1 1 265 1 1 1 1 5 TRP HA . 5 . HA 1 1 265 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 266 1 1 1 1 1 TYR HA . 1 . HA 1 1 266 1 2 1 1 1 TYR QE . 1 . HE# 1 1 267 1 1 1 1 7 TRP HA . 7 . HA 1 1 267 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 268 1 1 1 1 4 LYS H . 4 . HN 1 1 268 1 2 1 1 7 TRP HB2 . 7 . HB2 1 1 269 1 1 1 1 22 ARG HA . 22 . HA 1 1 269 1 2 1 1 23 LEU HA . 23 . HA 1 1 270 1 1 1 1 3 GLN HA . 3 . HA 1 1 270 1 2 1 1 7 TRP HB2 . 7 . HB2 1 1 271 1 1 1 1 3 GLN HA . 3 . HA 1 1 271 1 2 1 1 7 TRP HB3 . 7 . HB1 1 1 272 1 1 1 1 9 CYS HB2 . 9 . HB2 1 1 272 1 2 1 1 14 LYS HA . 14 . HA 1 1 273 1 1 1 1 9 CYS HB3 . 9 . HB1 1 1 273 1 2 1 1 14 LYS HA . 14 . HA 1 1 274 1 1 1 1 3 GLN HB2 . 3 . HB2 1 1 274 1 2 1 1 15 CYS HA . 15 . HA 1 1 275 1 1 1 1 3 GLN HB3 . 3 . HB1 1 1 275 1 2 1 1 15 CYS HA . 15 . HA 1 1 276 1 1 1 1 3 GLN HG3 . 3 . HG1 1 1 276 1 2 1 1 9 CYS HA . 9 . HA 1 1 277 1 1 1 1 3 GLN HB2 . 3 . HB2 1 1 277 1 2 1 1 4 LYS H . 4 . HN 1 1 278 1 1 1 1 3 GLN HB3 . 3 . HB1 1 1 278 1 2 1 1 4 LYS H . 4 . HN 1 1 279 1 1 1 1 9 CYS HA . 9 . HA 1 1 279 1 2 1 1 13 ARG HB2 . 13 . HB2 1 1 280 1 1 1 1 9 CYS HA . 9 . HA 1 1 280 1 2 1 1 13 ARG QG . 13 . HG# 1 1 281 1 1 1 1 9 CYS HA . 9 . HA 1 1 281 1 2 1 1 13 ARG HB3 . 13 . HB1 1 1 282 1 1 1 1 19 MET HA . 19 . HA 1 1 282 1 2 1 1 27 LYS HA . 27 . HA 1 1 283 1 1 1 1 3 GLN HG2 . 3 . HG2 1 1 283 1 2 1 1 15 CYS HA . 15 . HA 1 1 284 1 1 1 1 19 MET HG3 . 19 . HG1 1 1 284 1 2 1 1 27 LYS HA . 27 . HA 1 1 285 1 1 1 1 19 MET HG2 . 19 . HG2 1 1 285 1 2 1 1 27 LYS HA . 27 . HA 1 1 286 1 1 1 1 19 MET HB3 . 19 . HB1 1 1 286 1 2 1 1 27 LYS HA . 27 . HA 1 1 287 1 1 1 1 4 LYS H . 4 . HN 1 1 287 1 2 1 1 4 LYS HB2 . 4 . HB2 1 1 288 1 1 1 1 4 LYS H . 4 . HN 1 1 288 1 2 1 1 4 LYS HG3 . 4 . HG1 1 1 289 1 1 1 1 4 LYS H . 4 . HN 1 1 289 1 2 1 1 4 LYS HG2 . 4 . HG2 1 1 290 1 1 1 1 11 SER QB . 11 . HB# 1 1 290 1 2 1 1 12 GLU QG . 12 . HG# 1 1 291 1 1 1 1 3 GLN HG3 . 3 . HG1 1 1 291 1 2 1 1 15 CYS HA . 15 . HA 1 1 292 1 1 1 1 3 GLN HA . 3 . HA 1 1 292 1 2 1 1 4 LYS HG3 . 4 . HG1 1 1 293 1 1 1 1 1 TYR QB . 1 . HB# 1 1 293 1 2 1 1 2 CYS H . 2 . HN 1 1 294 1 1 1 1 2 CYS H . 2 . HN 1 1 294 1 2 1 1 2 CYS QB . 2 . HB# 1 1 295 1 1 1 1 2 CYS QB . 2 . HB# 1 1 295 1 2 1 1 3 GLN H . 3 . HN 1 1 296 1 1 1 1 3 GLN H . 3 . HN 1 1 296 1 2 1 1 3 GLN QB . 3 . HB# 1 1 297 1 1 1 1 3 GLN QB . 3 . HB# 1 1 297 1 2 1 1 3 GLN HE21 . 3 . HE21 1 1 298 1 1 1 1 3 GLN QB . 3 . HB# 1 1 298 1 2 1 1 3 GLN HE22 . 3 . HE22 1 1 299 1 1 1 1 3 GLN QB . 3 . HB# 1 1 299 1 2 1 1 4 LYS H . 4 . HN 1 1 300 1 1 1 1 3 GLN QB . 3 . HB# 1 1 300 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 301 1 1 1 1 3 GLN QB . 3 . HB# 1 1 301 1 2 1 1 15 CYS HA . 15 . HA 1 1 302 1 1 1 1 3 GLN QB . 3 . HB# 1 1 302 1 2 1 1 16 CYS H . 16 . HN 1 1 303 1 1 1 1 3 GLN HE21 . 3 . HE21 1 1 303 1 2 1 1 13 ARG QD . 13 . HD# 1 1 304 1 1 1 1 5 TRP HD1 . 5 . HD1 1 1 304 1 2 1 1 6 MET QB . 6 . HB# 1 1 305 1 1 1 1 5 TRP HE1 . 5 . HE1 1 1 305 1 2 1 1 6 MET QB . 6 . HB# 1 1 306 1 1 1 1 5 TRP HZ2 . 5 . HZ2 1 1 306 1 2 1 1 6 MET QB . 6 . HB# 1 1 307 1 1 1 1 6 MET HA . 6 . HA 1 1 307 1 2 1 1 6 MET QG . 6 . HG# 1 1 308 1 1 1 1 13 ARG HA . 13 . HA 1 1 308 1 2 1 1 13 ARG QD . 13 . HD# 1 1 309 1 1 1 1 14 LYS H . 14 . HN 1 1 309 1 2 1 1 14 LYS QB . 14 . HB# 1 1 310 1 1 1 1 14 LYS QB . 14 . HB# 1 1 310 1 2 1 1 15 CYS H . 15 . HN 1 1 311 1 1 1 1 15 CYS H . 15 . HN 1 1 311 1 2 1 1 15 CYS QB . 15 . HB# 1 1 312 1 1 1 1 15 CYS QB . 15 . HB# 1 1 312 1 2 1 1 16 CYS H . 16 . HN 1 1 313 1 1 1 1 16 CYS H . 16 . HN 1 1 313 1 2 1 1 16 CYS QB . 16 . HB# 1 1 314 1 1 1 1 16 CYS QB . 16 . HB# 1 1 314 1 2 1 1 17 LYS H . 17 . HN 1 1 315 1 1 1 1 17 LYS H . 17 . HN 1 1 315 1 2 1 1 17 LYS QB . 17 . HB# 1 1 316 1 1 1 1 17 LYS QB . 17 . HB# 1 1 316 1 2 1 1 17 LYS QZ . 17 . QZ 1 1 317 1 1 1 1 17 LYS QB . 17 . HB# 1 1 317 1 2 1 1 18 GLY H . 18 . HN 1 1 318 1 1 1 1 17 LYS QG . 17 . HG# 1 1 318 1 2 1 1 18 GLY H . 18 . HN 1 1 319 1 1 1 1 19 MET HA . 19 . HA 1 1 319 1 2 1 1 20 VAL QG . 20 . HG## 1 1 320 1 1 1 1 20 VAL H . 20 . HN 1 1 320 1 2 1 1 20 VAL QG . 20 . HG## 1 1 321 1 1 1 1 20 VAL H . 20 . HN 1 1 321 1 2 1 1 26 LYS QB . 26 . HB# 1 1 322 1 1 1 1 20 VAL QG . 20 . HG## 1 1 322 1 2 1 1 21 CYS H . 21 . HN 1 1 323 1 1 1 1 20 VAL QG . 20 . HG## 1 1 323 1 2 1 1 21 CYS HA . 21 . HA 1 1 324 1 1 1 1 20 VAL QG . 20 . HG## 1 1 324 1 2 1 1 22 ARG H . 22 . HN 1 1 325 1 1 1 1 20 VAL QG . 20 . HG## 1 1 325 1 2 1 1 26 LYS H . 26 . HN 1 1 326 1 1 1 1 21 CYS H . 21 . HN 1 1 326 1 2 1 1 21 CYS QB . 21 . HB# 1 1 327 1 1 1 1 22 ARG H . 22 . HN 1 1 327 1 2 1 1 22 ARG QB . 22 . HB# 1 1 328 1 1 1 1 22 ARG HA . 22 . HA 1 1 328 1 2 1 1 22 ARG QD . 22 . HD# 1 1 329 1 1 1 1 22 ARG QB . 22 . HB# 1 1 329 1 2 1 1 22 ARG HE . 22 . HE 1 1 330 1 1 1 1 22 ARG QB . 22 . HB# 1 1 330 1 2 1 1 23 LEU H . 23 . HN 1 1 331 1 1 1 1 23 LEU H . 23 . HN 1 1 331 1 2 1 1 23 LEU QB . 23 . HB# 1 1 332 1 1 1 1 23 LEU H . 23 . HN 1 1 332 1 2 1 1 23 LEU QD . 23 . HD## 1 1 333 1 1 1 1 23 LEU HA . 23 . HA 1 1 333 1 2 1 1 23 LEU QD . 23 . HD## 1 1 334 1 1 1 1 23 LEU QB . 23 . HB# 1 1 334 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 335 1 1 1 1 23 LEU QB . 23 . HB# 1 1 335 1 2 1 1 24 TRP HZ3 . 24 . HZ3 1 1 336 1 1 1 1 23 LEU QD . 23 . HD## 1 1 336 1 2 1 1 24 TRP H . 24 . HN 1 1 337 1 1 1 1 23 LEU QD . 23 . HD## 1 1 337 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 338 1 1 1 1 23 LEU QD . 23 . HD## 1 1 338 1 2 1 1 24 TRP HZ3 . 24 . HZ3 1 1 339 1 1 1 1 24 TRP HE1 . 24 . HE1 1 1 339 1 2 1 1 26 LYS QB . 26 . HB# 1 1 340 1 1 1 1 25 CYS H . 25 . HN 1 1 340 1 2 1 1 25 CYS QB . 25 . HB# 1 1 341 1 1 1 1 25 CYS QB . 25 . HB# 1 1 341 1 2 1 1 26 LYS H . 26 . HN 1 1 342 1 1 1 1 26 LYS H . 26 . HN 1 1 342 1 2 1 1 26 LYS QB . 26 . HB# 1 1 343 1 1 1 1 26 LYS QB . 26 . HB# 1 1 343 1 2 1 1 26 LYS QZ . 26 . QZ 1 1 344 1 1 1 1 26 LYS QB . 26 . HB# 1 1 344 1 2 1 1 27 LYS H . 27 . HN 1 1 345 1 1 1 1 27 LYS H . 27 . HN 1 1 345 1 2 1 1 27 LYS QB . 27 . HB# 1 1 346 1 1 1 1 27 LYS H . 27 . HN 1 1 346 1 2 1 1 27 LYS QG . 27 . HG# 1 1 347 1 1 1 1 27 LYS HA . 27 . HA 1 1 347 1 2 1 1 27 LYS QG . 27 . HG# 1 1 348 1 1 1 1 27 LYS QG . 27 . HG# 1 1 348 1 2 1 1 28 LYS H . 28 . HN 1 1 349 1 1 1 1 29 LEU H . 29 . HN 1 1 349 1 2 1 1 29 LEU QD . 29 . HD## 1 1 350 1 1 1 1 29 LEU HA . 29 . HA 1 1 350 1 2 1 1 29 LEU QD . 29 . HD## 1 1 351 1 1 1 1 29 LEU QD . 29 . HD## 1 1 351 1 2 1 1 30 TRP H . 30 . 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 . . . . . 4.71 0.0 4.71 1 1 2 1 . . . . . 3.32 0.0 3.32 1 1 3 1 . . . . . 4.2 0.0 4.2 1 1 4 1 . . . . . 3.12 0.0 3.12 1 1 5 1 . . . . . 3.77 0.0 3.77 1 1 6 1 . . . . . 5.17 0.0 5.17 1 1 7 1 . . . . . 3.57 0.0 3.57 1 1 8 1 . . . . . 3.05 0.0 3.05 1 1 9 1 . . . . . 3.02 0.0 3.02 1 1 10 1 . . . . . 3.11 0.0 3.11 1 1 11 1 . . . . . 3.51 0.0 3.51 1 1 12 1 . . . . . 2.94 0.0 2.94 1 1 13 1 . . . . . 2.98 0.0 2.98 1 1 14 1 . . . . . 2.99 0.0 2.99 1 1 15 1 . . . . . 2.85 0.0 2.85 1 1 16 1 . . . . . 3.08 0.0 3.08 1 1 17 1 . . . . . 2.88 0.0 2.88 1 1 18 1 . . . . . 2.78 0.0 2.78 1 1 19 1 . . . . . 2.86 0.0 2.86 1 1 20 1 . . . . . 2.9 0.0 2.9 1 1 21 1 . . . . . 3.19 0.0 3.19 1 1 22 1 . . . . . 2.94 0.0 2.94 1 1 23 1 . . . . . 3.07 0.0 3.07 1 1 24 1 . . . . . 3.02 0.0 3.02 1 1 25 1 . . . . . 3.01 0.0 3.01 1 1 26 1 . . . . . 3.84 0.0 3.84 1 1 27 1 . . . . . 4.14 0.0 4.14 1 1 28 1 . . . . . 4.14 0.0 4.14 1 1 29 1 . . . . . 4.59 0.0 4.59 1 1 30 1 . . . . . 4.92 0.0 4.92 1 1 31 1 . . . . . 4.06 0.0 4.06 1 1 32 1 . . . . . 4.06 0.0 4.06 1 1 33 1 . . . . . 3.42 0.0 3.42 1 1 34 1 . . . . . 4.03 0.0 4.03 1 1 35 1 . . . . . 5.43 0.0 5.43 1 1 36 1 . . . . . 5.23 0.0 5.23 1 1 37 1 . . . . . 5.21 0.0 5.21 1 1 38 1 . . . . . 5.21 0.0 5.21 1 1 39 1 . . . . . 4.09 0.0 4.09 1 1 40 1 . . . . . 5.04 0.0 5.04 1 1 41 1 . . . . . 2.85 0.0 2.85 1 1 42 1 . . . . . 3.28 0.0 3.28 1 1 43 1 . . . . . 3.84 0.0 3.84 1 1 44 1 . . . . . 4.61 0.0 4.61 1 1 45 1 . . . . . 4.61 0.0 4.61 1 1 46 1 . . . . . 4.07 0.0 4.07 1 1 47 1 . . . . . 4.07 0.0 4.07 1 1 48 1 . . . . . 3.32 0.0 3.32 1 1 49 1 . . . . . 3.86 0.0 3.86 1 1 50 1 . . . . . 4.15 0.0 4.15 1 1 51 1 . . . . . 4.83 0.0 4.83 1 1 52 1 . . . . . 3.48 0.0 3.48 1 1 53 1 . . . . . 3.84 0.0 3.84 1 1 54 1 . . . . . 3.58 0.0 3.58 1 1 55 1 . . . . . 3.37 0.0 3.37 1 1 56 1 . . . . . 3.52 0.0 3.52 1 1 57 1 . . . . . 2.76 0.0 2.76 1 1 58 1 . . . . . 3.31 0.0 3.31 1 1 59 1 . . . . . 4.14 0.0 4.14 1 1 60 1 . . . . . 3.76 0.0 3.76 1 1 61 1 . . . . . 3.92 0.0 3.92 1 1 62 1 . . . . . 4.09 0.0 4.09 1 1 63 1 . . . . . 4.31 0.0 4.31 1 1 64 1 . . . . . 4.09 0.0 4.09 1 1 65 1 . . . . . 4.31 0.0 4.31 1 1 66 1 . . . . . 3.49 0.0 3.49 1 1 67 1 . . . . . 3.89 0.0 3.89 1 1 68 1 . . . . . 3.63 0.0 3.63 1 1 69 1 . . . . . 4.14 0.0 4.14 1 1 70 1 . . . . . 3.49 0.0 3.49 1 1 71 1 . . . . . 3.52 0.0 3.52 1 1 72 1 . . . . . 3.89 0.0 3.89 1 1 73 1 . . . . . 4.43 0.0 4.43 1 1 74 1 . . . . . 3.68 0.0 3.68 1 1 75 1 . . . . . 3.89 0.0 3.89 1 1 76 1 . . . . . 3.89 0.0 3.89 1 1 77 1 . . . . . 3.37 0.0 3.37 1 1 78 1 . . . . . 5.46 0.0 5.46 1 1 79 1 . . . . . 3.67 0.0 3.67 1 1 80 1 . . . . . 3.67 0.0 3.67 1 1 81 1 . . . . . 3.9 0.0 3.9 1 1 82 1 . . . . . 3.9 0.0 3.9 1 1 83 1 . . . . . 3.98 0.0 3.98 1 1 84 1 . . . . . 3.98 0.0 3.98 1 1 85 1 . . . . . 4.18 0.0 4.18 1 1 86 1 . . . . . 4.6 0.0 4.6 1 1 87 1 . . . . . 4.53 0.0 4.53 1 1 88 1 . . . . . 4.6 0.0 4.6 1 1 89 1 . . . . . 5.5 0.0 5.5 1 1 90 1 . . . . . 5.5 0.0 5.5 1 1 91 1 . . . . . 5.5 0.0 5.5 1 1 92 1 . . . . . 5.38 0.0 5.38 1 1 93 1 . . . . . 3.94 0.0 3.94 1 1 94 1 . . . . . 3.83 0.0 3.83 1 1 95 1 . . . . . 3.99 0.0 3.99 1 1 96 1 . . . . . 3.17 0.0 3.17 1 1 97 1 . . . . . 3.33 0.0 3.33 1 1 98 1 . . . . . 3.43 0.0 3.43 1 1 99 1 . . . . . 3.43 0.0 3.43 1 1 100 1 . . . . . 4.71 0.0 4.71 1 1 101 1 . . . . . 4.71 0.0 4.71 1 1 102 1 . . . . . 4.44 0.0 4.44 1 1 103 1 . . . . . 3.89 0.0 3.89 1 1 104 1 . . . . . 3.89 0.0 3.89 1 1 105 1 . . . . . 4.57 0.0 4.57 1 1 106 1 . . . . . 4.57 0.0 4.57 1 1 107 1 . . . . . 3.76 0.0 3.76 1 1 108 1 . . . . . 3.99 0.0 3.99 1 1 109 1 . . . . . 4.06 0.0 4.06 1 1 110 1 . . . . . 4.2 0.0 4.2 1 1 111 1 . . . . . 3.71 0.0 3.71 1 1 112 1 . . . . . 3.88 0.0 3.88 1 1 113 1 . . . . . 3.88 0.0 3.88 1 1 114 1 . . . . . 4.46 0.0 4.46 1 1 115 1 . . . . . 5.13 0.0 5.13 1 1 116 1 . . . . . 3.81 0.0 3.81 1 1 117 1 . . . . . 3.81 0.0 3.81 1 1 118 1 . . . . . 4.75 0.0 4.75 1 1 119 1 . . . . . 4.5 0.0 4.5 1 1 120 1 . . . . . 4.75 0.0 4.75 1 1 121 1 . . . . . 4.1 0.0 4.1 1 1 122 1 . . . . . 4.1 0.0 4.1 1 1 123 1 . . . . . 5.5 0.0 5.5 1 1 124 1 . . . . . 4.11 0.0 4.11 1 1 125 1 . . . . . 4.15 0.0 4.15 1 1 126 1 . . . . . 3.65 0.0 3.65 1 1 127 1 . . . . . 3.65 0.0 3.65 1 1 128 1 . . . . . 4.44 0.0 4.44 1 1 129 1 . . . . . 4.44 0.0 4.44 1 1 130 1 . . . . . 3.66 0.0 3.66 1 1 131 1 . . . . . 3.66 0.0 3.66 1 1 132 1 . . . . . 4.21 0.0 4.21 1 1 133 1 . . . . . 5.25 0.0 5.25 1 1 134 1 . . . . . 5.25 0.0 5.25 1 1 135 1 . . . . . 5.5 0.0 5.5 1 1 136 1 . . . . . 3.34 0.0 3.34 1 1 137 1 . . . . . 3.6 0.0 3.6 1 1 138 1 . . . . . 4.06 0.0 4.06 1 1 139 1 . . . . . 5.5 0.0 5.5 1 1 140 1 . . . . . 3.29 0.0 3.29 1 1 141 1 . . . . . 3.96 0.0 3.96 1 1 142 1 . . . . . 4.34 0.0 4.34 1 1 143 1 . . . . . 4.21 0.0 4.21 1 1 144 1 . . . . . 4.37 0.0 4.37 1 1 145 1 . . . . . 4.83 0.0 4.83 1 1 146 1 . . . . . 5.16 0.0 5.16 1 1 147 1 . . . . . 5.29 0.0 5.29 1 1 148 1 . . . . . 4.79 0.0 4.79 1 1 149 1 . . . . . 4.65 0.0 4.65 1 1 150 1 . . . . . 4.21 0.0 4.21 1 1 151 1 . . . . . 5.5 0.0 5.5 1 1 152 1 . . . . . 4.75 0.0 4.75 1 1 153 1 . . . . . 4.65 0.0 4.65 1 1 154 1 . . . . . 4.65 0.0 4.65 1 1 155 1 . . . . . 4.35 0.0 4.35 1 1 156 1 . . . . . 3.52 0.0 3.52 1 1 157 1 . . . . . 4.51 0.0 4.51 1 1 158 1 . . . . . 4.43 0.0 4.43 1 1 159 1 . . . . . 3.84 0.0 3.84 1 1 160 1 . . . . . 3.52 0.0 3.52 1 1 161 1 . . . . . 4.21 0.0 4.21 1 1 162 1 . . . . . 4.27 0.0 4.27 1 1 163 1 . . . . . 4.71 0.0 4.71 1 1 164 1 . . . . . 4.06 0.0 4.06 1 1 165 1 . . . . . 4.19 0.0 4.19 1 1 166 1 . . . . . 4.49 0.0 4.49 1 1 167 1 . . . . . 4.78 0.0 4.78 1 1 168 1 . . . . . 5.16 0.0 5.16 1 1 169 1 . . . . . 5.35 0.0 5.35 1 1 170 1 . . . . . 3.84 0.0 3.84 1 1 171 1 . . . . . 4.93 0.0 4.93 1 1 172 1 . . . . . 4.87 0.0 4.87 1 1 173 1 . . . . . 5.31 0.0 5.31 1 1 174 1 . . . . . 3.69 0.0 3.69 1 1 175 1 . . . . . 4.62 0.0 4.62 1 1 176 1 . . . . . 3.69 0.0 3.69 1 1 177 1 . . . . . 4.48 0.0 4.48 1 1 178 1 . . . . . 3.47 0.0 3.47 1 1 179 1 . . . . . 4.58 0.0 4.58 1 1 180 1 . . . . . 4.57 0.0 4.57 1 1 181 1 . . . . . 4.34 0.0 4.34 1 1 182 1 . . . . . 3.86 0.0 3.86 1 1 183 1 . . . . . 3.93 0.0 3.93 1 1 184 1 . . . . . 3.64 0.0 3.64 1 1 185 1 . . . . . 4.71 0.0 4.71 1 1 186 1 . . . . . 3.54 0.0 3.54 1 1 187 1 . . . . . 5.02 0.0 5.02 1 1 188 1 . . . . . 4.74 0.0 4.74 1 1 189 1 . . . . . 4.82 0.0 4.82 1 1 190 1 . . . . . 4.58 0.0 4.58 1 1 191 1 . . . . . 5.5 0.0 5.5 1 1 192 1 . . . . . 5.5 0.0 5.5 1 1 193 1 . . . . . 5.5 0.0 5.5 1 1 194 1 . . . . . 5.5 0.0 5.5 1 1 195 1 . . . . . 5.37 0.0 5.37 1 1 196 1 . . . . . 4.65 0.0 4.65 1 1 197 1 . . . . . 3.97 0.0 3.97 1 1 198 1 . . . . . 3.11 0.0 3.11 1 1 199 1 . . . . . 3.73 0.0 3.73 1 1 200 1 . . . . . 5.22 0.0 5.22 1 1 201 1 . . . . . 5.5 0.0 5.5 1 1 202 1 . . . . . 5.29 0.0 5.29 1 1 203 1 . . . . . 4.59 0.0 4.59 1 1 204 1 . . . . . 4.5 0.0 4.5 1 1 205 1 . . . . . 3.65 0.0 3.65 1 1 206 1 . . . . . 3.94 0.0 3.94 1 1 207 1 . . . . . 4.04 0.0 4.04 1 1 208 1 . . . . . 5.22 0.0 5.22 1 1 209 1 . . . . . 4.03 0.0 4.03 1 1 210 1 . . . . . 4.99 0.0 4.99 1 1 211 1 . . . . . 5.1 0.0 5.1 1 1 212 1 . . . . . 3.72 0.0 3.72 1 1 213 1 . . . . . 3.61 0.0 3.61 1 1 214 1 . . . . . 4.5 0.0 4.5 1 1 215 1 . . . . . 4.84 0.0 4.84 1 1 216 1 . . . . . 4.84 0.0 4.84 1 1 217 1 . . . . . 5.5 0.0 5.5 1 1 218 1 . . . . . 5.5 0.0 5.5 1 1 219 1 . . . . . 3.62 0.0 3.62 1 1 220 1 . . . . . 4.67 0.0 4.67 1 1 221 1 . . . . . 4.15 0.0 4.15 1 1 222 1 . . . . . 4.81 0.0 4.81 1 1 223 1 . . . . . 5.46 0.0 5.46 1 1 224 1 . . . . . 2.81 0.0 2.81 1 1 225 1 . . . . . 4.45 0.0 4.45 1 1 226 1 . . . . . 4.45 0.0 4.45 1 1 227 1 . . . . . 3.71 0.0 3.71 1 1 228 1 . . . . . 4.16 0.0 4.16 1 1 229 1 . . . . . 4.59 0.0 4.59 1 1 230 1 . . . . . 4.52 0.0 4.52 1 1 231 1 . . . . . 3.84 0.0 3.84 1 1 232 1 . . . . . 4.23 0.0 4.23 1 1 233 1 . . . . . 4.3 0.0 4.3 1 1 234 1 . . . . . 4.3 0.0 4.3 1 1 235 1 . . . . . 5.36 0.0 5.36 1 1 236 1 . . . . . 5.5 0.0 5.5 1 1 237 1 . . . . . 4.18 0.0 4.18 1 1 238 1 . . . . . 4.53 0.0 4.53 1 1 239 1 . . . . . 4.56 0.0 4.56 1 1 240 1 . . . . . 4.79 0.0 4.79 1 1 241 1 . . . . . 3.44 0.0 3.44 1 1 242 1 . . . . . 4.5 0.0 4.5 1 1 243 1 . . . . . 4.5 0.0 4.5 1 1 244 1 . . . . . 4.79 0.0 4.79 1 1 245 1 . . . . . 3.88 0.0 3.88 1 1 246 1 . . . . . 3.88 0.0 3.88 1 1 247 1 . . . . . 4.06 0.0 4.06 1 1 248 1 . . . . . 5.11 0.0 5.11 1 1 249 1 . . . . . 5.11 0.0 5.11 1 1 250 1 . . . . . 4.54 0.0 4.54 1 1 251 1 . . . . . 4.54 0.0 4.54 1 1 252 1 . . . . . 3.5 0.0 3.5 1 1 253 1 . . . . . 4.93 0.0 4.93 1 1 254 1 . . . . . 4.9 0.0 4.9 1 1 255 1 . . . . . 4.54 0.0 4.54 1 1 256 1 . . . . . 3.98 0.0 3.98 1 1 257 1 . . . . . 5.3 0.0 5.3 1 1 258 1 . . . . . 5.5 0.0 5.5 1 1 259 1 . . . . . 5.3 0.0 5.3 1 1 260 1 . . . . . 5.21 0.0 5.21 1 1 261 1 . . . . . 5.12 0.0 5.12 1 1 262 1 . . . . . 4.49 0.0 4.49 1 1 263 1 . . . . . 5.17 0.0 5.17 1 1 264 1 . . . . . 5.23 0.0 5.23 1 1 265 1 . . . . . 4.87 0.0 4.87 1 1 266 1 . . . . . 5.5 0.0 5.5 1 1 267 1 . . . . . 5.3 0.0 5.3 1 1 268 1 . . . . . 4.44 0.0 4.44 1 1 269 1 . . . . . 4.48 0.0 4.48 1 1 270 1 . . . . . 4.85 0.0 4.85 1 1 271 1 . . . . . 4.78 0.0 4.78 1 1 272 1 . . . . . 4.61 0.0 4.61 1 1 273 1 . . . . . 4.92 0.0 4.92 1 1 274 1 . . . . . 3.8 0.0 3.8 1 1 275 1 . . . . . 3.8 0.0 3.8 1 1 276 1 . . . . . 4.32 0.0 4.32 1 1 277 1 . . . . . 4.73 0.0 4.73 1 1 278 1 . . . . . 4.73 0.0 4.73 1 1 279 1 . . . . . 4.11 0.0 4.11 1 1 280 1 . . . . . 5.06 0.0 5.06 1 1 281 1 . . . . . 4.35 0.0 4.35 1 1 282 1 . . . . . 4.43 0.0 4.43 1 1 283 1 . . . . . 4.47 0.0 4.47 1 1 284 1 . . . . . 4.23 0.0 4.23 1 1 285 1 . . . . . 3.43 0.0 3.43 1 1 286 1 . . . . . 4.31 0.0 4.31 1 1 287 1 . . . . . 4.01 0.0 4.01 1 1 288 1 . . . . . 4.12 0.0 4.12 1 1 289 1 . . . . . 4.64 0.0 4.64 1 1 290 1 . . . . . 5.04 0.0 5.04 1 1 291 1 . . . . . 4.82 0.0 4.82 1 1 292 1 . . . . . 5.43 0.0 5.43 1 1 293 1 . . . . . 3.33 0.0 3.33 1 1 294 1 . . . . . 3.44 0.0 3.44 1 1 295 1 . . . . . 3.27 0.0 3.27 1 1 296 1 . . . . . 3.43 0.0 3.43 1 1 297 1 . . . . . 3.78 0.0 3.78 1 1 298 1 . . . . . 4.58 0.0 4.58 1 1 299 1 . . . . . 4.15 0.0 4.15 1 1 300 1 . . . . . 4.75 0.0 4.75 1 1 301 1 . . . . . 3.22 0.0 3.22 1 1 302 1 . . . . . 3.54 0.0 3.54 1 1 303 1 . . . . . 4.48 0.0 4.48 1 1 304 1 . . . . . 4.48 0.0 4.48 1 1 305 1 . . . . . 4.91 0.0 4.91 1 1 306 1 . . . . . 4.85 0.0 4.85 1 1 307 1 . . . . . 3.51 0.0 3.51 1 1 308 1 . . . . . 4.43 0.0 4.43 1 1 309 1 . . . . . 3.13 0.0 3.13 1 1 310 1 . . . . . 3.45 0.0 3.45 1 1 311 1 . . . . . 3.12 0.0 3.12 1 1 312 1 . . . . . 3.48 0.0 3.48 1 1 313 1 . . . . . 3.2 0.0 3.2 1 1 314 1 . . . . . 3.14 0.0 3.14 1 1 315 1 . . . . . 3.14 0.0 3.14 1 1 316 1 . . . . . 4.74 0.0 4.74 1 1 317 1 . . . . . 3.98 0.0 3.98 1 1 318 1 . . . . . 4.04 0.0 4.04 1 1 319 1 . . . . . 4.78 0.0 4.78 1 1 320 1 . . . . . 3.42 0.0 3.42 1 1 321 1 . . . . . 4.48 0.0 4.48 1 1 322 1 . . . . . 3.78 0.0 3.78 1 1 323 1 . . . . . 4.66 0.0 4.66 1 1 324 1 . . . . . 4.61 0.0 4.61 1 1 325 1 . . . . . 4.38 0.0 4.38 1 1 326 1 . . . . . 2.99 0.0 2.99 1 1 327 1 . . . . . 3.32 0.0 3.32 1 1 328 1 . . . . . 3.8 0.0 3.8 1 1 329 1 . . . . . 3.96 0.0 3.96 1 1 330 1 . . . . . 4.22 0.0 4.22 1 1 331 1 . . . . . 3.39 0.0 3.39 1 1 332 1 . . . . . 3.89 0.0 3.89 1 1 333 1 . . . . . 3.45 0.0 3.45 1 1 334 1 . . . . . 4.03 0.0 4.03 1 1 335 1 . . . . . 4.72 0.0 4.72 1 1 336 1 . . . . . 4.99 0.0 4.99 1 1 337 1 . . . . . 4.41 0.0 4.41 1 1 338 1 . . . . . 3.98 0.0 3.98 1 1 339 1 . . . . . 4.88 0.0 4.88 1 1 340 1 . . . . . 3.11 0.0 3.11 1 1 341 1 . . . . . 4.02 0.0 4.02 1 1 342 1 . . . . . 3.33 0.0 3.33 1 1 343 1 . . . . . 4.52 0.0 4.52 1 1 344 1 . . . . . 3.9 0.0 3.9 1 1 345 1 . . . . . 3.14 0.0 3.14 1 1 346 1 . . . . . 3.57 0.0 3.57 1 1 347 1 . . . . . 3.61 0.0 3.61 1 1 348 1 . . . . . 4.06 0.0 4.06 1 1 349 1 . . . . . 4.0 0.0 4.0 1 1 350 1 . . . . . 3.68 0.0 3.68 1 1 351 1 . . . . . 4.5 0.0 4.5 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 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 4 LYS O . 4 . O 1 2 1 1 2 1 1 7 TRP H . 7 . HN 1 2 2 1 1 1 1 4 LYS O . 4 . O 1 2 2 1 2 1 1 7 TRP N . 7 . N 1 2 3 1 1 1 1 20 VAL O . 20 . O 1 2 3 1 2 1 1 26 LYS H . 26 . HN 1 2 4 1 1 1 1 20 VAL O . 20 . O 1 2 4 1 2 1 1 26 LYS N . 26 . N 1 2 5 1 1 1 1 20 VAL H . 20 . HN 1 2 5 1 2 1 1 26 LYS O . 26 . O 1 2 6 1 1 1 1 20 VAL N . 20 . N 1 2 6 1 2 1 1 26 LYS O . 26 . O 1 2 7 1 1 1 1 9 CYS H . 9 . HN 1 2 7 1 2 1 1 22 ARG O . 22 . O 1 2 8 1 1 1 1 9 CYS N . 9 . N 1 2 8 1 2 1 1 22 ARG O . 22 . O 1 2 9 1 1 1 1 16 CYS O . 16 . O 1 2 9 1 2 1 1 19 MET H . 19 . HN 1 2 10 1 1 1 1 16 CYS O . 16 . O 1 2 10 1 2 1 1 19 MET N . 19 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.3 0.0 2.3 1 2 2 1 . . . . . 3.3 0.0 3.3 1 2 3 1 . . . . . 2.3 0.0 2.3 1 2 4 1 . . . . . 3.3 0.0 3.3 1 2 5 1 . . . . . 2.3 0.0 2.3 1 2 6 1 . . . . . 3.3 0.0 3.3 1 2 7 1 . . . . . 2.3 0.0 2.3 1 2 8 1 . . . . . 3.3 0.0 3.3 1 2 9 1 . . . . . 2.3 0.0 2.3 1 2 10 1 . . . . . 3.3 0.0 3.3 1 2 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 TYR C 1 1 2 CYS N 1 1 2 CYS CA 1 1 2 CYS C -170.5 -75.7 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 2 CYS N 1 1 2 CYS CA 1 1 2 CYS C 1 1 3 GLN N 121.09999 186.7 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1 3 . 1 1 2 CYS C 1 1 3 GLN N 1 1 3 GLN CA 1 1 3 GLN C -128.4 -84.4 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 4 . 1 1 3 GLN C 1 1 4 LYS N 1 1 4 LYS CA 1 1 4 LYS C -94.2 -44.2 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 5 . 1 1 4 LYS N 1 1 4 LYS CA 1 1 4 LYS C 1 1 5 TRP N 114.299995 176.5 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 6 . 1 1 5 TRP C 1 1 6 MET N 1 1 6 MET CA 1 1 6 MET C -97.0 -37.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 7 . 1 1 6 MET N 1 1 6 MET CA 1 1 6 MET C 1 1 7 TRP N -51.8 8.2 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 8 . 1 1 7 TRP N 1 1 7 TRP CA 1 1 7 TRP CB 1 1 7 TRP CG -89.99999 -30.0 . 7 . N . 7 . CA . 7 . CB . 7 . CG 1 1 9 . 1 1 8 THR C 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS C -160.6 -120.59999 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 10 . 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS C 1 1 10 ASP N 141.3 181.29999 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 11 . 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS CB 1 1 9 CYS SG 30.0 89.99999 . 9 . N . 9 . CA . 9 . CB . 9 . SG 1 1 12 . 1 1 10 ASP C 1 1 11 SER N 1 1 11 SER CA 1 1 11 SER C -82.8 -42.799995 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 13 . 1 1 11 SER N 1 1 11 SER CA 1 1 11 SER C 1 1 12 GLU N -44.699997 -4.7 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1 14 . 1 1 12 GLU C 1 1 13 ARG N 1 1 13 ARG CA 1 1 13 ARG C -98.5 -52.5 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 15 . 1 1 13 ARG N 1 1 13 ARG CA 1 1 13 ARG C 1 1 14 LYS N 112.3 159.9 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 16 . 1 1 13 ARG C 1 1 14 LYS N 1 1 14 LYS CA 1 1 14 LYS C -104.8 -57.599995 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 17 . 1 1 14 LYS N 1 1 14 LYS CA 1 1 14 LYS C 1 1 15 CYS N 108.7 166.9 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1 18 . 1 1 14 LYS C 1 1 15 CYS N 1 1 15 CYS CA 1 1 15 CYS C -93.9 -53.9 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 19 . 1 1 15 CYS N 1 1 15 CYS CA 1 1 15 CYS C 1 1 16 CYS N 121.0 164.0 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1 20 . 1 1 16 CYS C 1 1 17 LYS N 1 1 17 LYS CA 1 1 17 LYS C -77.9 -37.9 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 21 . 1 1 17 LYS N 1 1 17 LYS CA 1 1 17 LYS C 1 1 18 GLY N 113.5 153.5 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 22 . 1 1 17 LYS C 1 1 18 GLY N 1 1 18 GLY CA 1 1 18 GLY C 72.0 112.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 23 . 1 1 18 GLY N 1 1 18 GLY CA 1 1 18 GLY C 1 1 19 MET N -21.3 18.7 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 24 . 1 1 18 GLY C 1 1 19 MET N 1 1 19 MET CA 1 1 19 MET C -144.3 -104.3 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 25 . 1 1 19 MET C 1 1 20 VAL N 1 1 20 VAL CA 1 1 20 VAL C -147.3 -107.3 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 26 . 1 1 20 VAL N 1 1 20 VAL CA 1 1 20 VAL C 1 1 21 CYS N 119.6 172.0 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 27 . 1 1 20 VAL C 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS C -90.7 -50.7 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 28 . 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS C 1 1 22 ARG N 106.0 166.0 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 29 . 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS CB 1 1 21 CYS SG 150.0 210.0 . 21 . N . 21 . CA . 21 . CB . 21 . SG 1 1 30 . 1 1 22 ARG C 1 1 23 LEU N 1 1 23 LEU CA 1 1 23 LEU C -81.9 -41.9 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 31 . 1 1 23 LEU N 1 1 23 LEU CA 1 1 23 LEU C 1 1 24 TRP N -58.300003 -18.3 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 32 . 1 1 24 TRP C 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS C -92.9 -52.899998 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 33 . 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS C 1 1 26 LYS N 113.4 161.4 . 25 . N . 25 . CA . 25 . C . 26 . N 1 1 34 . 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS CB 1 1 25 CYS SG -89.99999 -30.0 . 25 . N . 25 . CA . 25 . CB . 25 . SG 1 1 35 . 1 1 25 CYS C 1 1 26 LYS N 1 1 26 LYS CA 1 1 26 LYS C -164.3 -83.3 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 36 . 1 1 26 LYS N 1 1 26 LYS CA 1 1 26 LYS C 1 1 27 LYS N 118.5 181.89998 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 37 . 1 1 26 LYS C 1 1 27 LYS N 1 1 27 LYS CA 1 1 27 LYS C -96.2 -36.2 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 38 . 1 1 27 LYS N 1 1 27 LYS CA 1 1 27 LYS C 1 1 28 LYS N 112.5 172.5 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 TYR C C -9.810 0.484 2.468 1.00 . A A . 1 TYR C 1 1 1 2 1 1 1 TYR CA C -10.919 1.084 3.275 1.00 . A A . 1 TYR CA 1 1 1 3 1 1 1 TYR CB C -10.291 1.534 4.604 1.00 . A A . 1 TYR CB 1 1 1 4 1 1 1 TYR CD1 C -11.748 1.267 6.641 1.00 . A A . 1 TYR CD1 1 1 1 5 1 1 1 TYR CD2 C -11.545 3.431 5.680 1.00 . A A . 1 TYR CD2 1 1 1 6 1 1 1 TYR CE1 C -12.561 1.774 7.623 1.00 . A A . 1 TYR CE1 1 1 1 7 1 1 1 TYR CE2 C -12.367 3.943 6.656 1.00 . A A . 1 TYR CE2 1 1 1 8 1 1 1 TYR CG C -11.224 2.086 5.651 1.00 . A A . 1 TYR CG 1 1 1 9 1 1 1 TYR CZ C -12.870 3.111 7.625 1.00 . A A . 1 TYR CZ 1 1 1 10 1 1 1 TYR H1 H -12.299 -0.238 2.567 1.00 . A A . 1 TYR H1 1 1 1 11 1 1 1 TYR H2 H -12.731 0.415 4.061 1.00 . A A . 1 TYR H2 1 1 1 12 1 1 1 TYR H3 H -11.506 -0.760 3.944 1.00 . A A . 1 TYR H3 1 1 1 13 1 1 1 TYR HA H -11.350 1.936 2.773 1.00 . A A . 1 TYR HA 1 1 1 14 1 1 1 TYR HB2 H -9.788 0.686 5.044 1.00 . A A . 1 TYR HB2 1 1 1 15 1 1 1 TYR HB3 H -9.549 2.288 4.387 1.00 . A A . 1 TYR HB3 1 1 1 16 1 1 1 TYR HD1 H -11.510 0.213 6.641 1.00 . A A . 1 TYR HD1 1 1 1 17 1 1 1 TYR HD2 H -11.152 4.086 4.917 1.00 . A A . 1 TYR HD2 1 1 1 18 1 1 1 TYR HE1 H -12.959 1.121 8.386 1.00 . A A . 1 TYR HE1 1 1 1 19 1 1 1 TYR HE2 H -12.606 4.996 6.653 1.00 . A A . 1 TYR HE2 1 1 1 20 1 1 1 TYR HH H -14.296 4.261 8.273 1.00 . A A . 1 TYR HH 1 1 1 21 1 1 1 TYR N N -11.937 0.069 3.490 1.00 . A A . 1 TYR N 1 1 1 22 1 1 1 TYR O O -9.569 -0.724 2.552 1.00 . A A . 1 TYR O 1 1 1 23 1 1 1 TYR OH O -13.664 3.616 8.615 1.00 . A A . 1 TYR OH 1 1 1 24 1 1 2 CYS C C -6.821 1.213 2.024 1.00 . A A . 2 CYS C 1 1 1 25 1 1 2 CYS CA C -7.938 0.854 1.059 1.00 . A A . 2 CYS CA 1 1 1 26 1 1 2 CYS CB C -7.731 1.515 -0.315 1.00 . A A . 2 CYS CB 1 1 1 27 1 1 2 CYS H H -9.481 2.195 1.518 1.00 . A A . 2 CYS H 1 1 1 28 1 1 2 CYS HA H -7.980 -0.221 0.962 1.00 . A A . 2 CYS HA 1 1 1 29 1 1 2 CYS HB2 H -6.780 1.191 -0.708 1.00 . A A . 2 CYS HB2 1 1 1 30 1 1 2 CYS HB3 H -8.511 1.193 -0.988 1.00 . A A . 2 CYS HB3 1 1 1 31 1 1 2 CYS N N -9.153 1.283 1.682 1.00 . A A . 2 CYS N 1 1 1 32 1 1 2 CYS O O -6.995 2.123 2.867 1.00 . A A . 2 CYS O 1 1 1 33 1 1 2 CYS SG S -7.712 3.344 -0.309 1.00 . A A . 2 CYS SG 1 1 1 34 1 1 3 GLN C C -3.830 1.994 2.509 1.00 . A A . 3 GLN C 1 1 1 35 1 1 3 GLN CA C -4.656 0.780 2.882 1.00 . A A . 3 GLN CA 1 1 1 36 1 1 3 GLN CB C -3.789 -0.458 3.055 1.00 . A A . 3 GLN CB 1 1 1 37 1 1 3 GLN CD C -5.226 -1.552 4.803 1.00 . A A . 3 GLN CD 1 1 1 38 1 1 3 GLN CG C -4.544 -1.707 3.471 1.00 . A A . 3 GLN CG 1 1 1 39 1 1 3 GLN H H -5.586 -0.121 1.226 1.00 . A A . 3 GLN H 1 1 1 40 1 1 3 GLN HA H -5.144 0.994 3.818 1.00 . A A . 3 GLN HA 1 1 1 41 1 1 3 GLN HB2 H -3.251 -0.673 2.145 1.00 . A A . 3 GLN HB2 1 1 1 42 1 1 3 GLN HB3 H -3.062 -0.247 3.826 1.00 . A A . 3 GLN HB3 1 1 1 43 1 1 3 GLN HE21 H -3.587 -2.120 5.690 1.00 . A A . 3 GLN HE21 1 1 1 44 1 1 3 GLN HE22 H -4.913 -1.729 6.743 1.00 . A A . 3 GLN HE22 1 1 1 45 1 1 3 GLN HG2 H -5.295 -1.924 2.725 1.00 . A A . 3 GLN HG2 1 1 1 46 1 1 3 GLN HG3 H -3.848 -2.530 3.529 1.00 . A A . 3 GLN HG3 1 1 1 47 1 1 3 GLN N N -5.706 0.555 1.931 1.00 . A A . 3 GLN N 1 1 1 48 1 1 3 GLN NE2 N -4.514 -1.830 5.851 1.00 . A A . 3 GLN NE2 1 1 1 49 1 1 3 GLN O O -3.321 2.113 1.383 1.00 . A A . 3 GLN O 1 1 1 50 1 1 3 GLN OE1 O -6.375 -1.156 4.887 1.00 . A A . 3 GLN OE1 1 1 1 51 1 1 4 LYS C C -1.561 4.023 3.420 1.00 . A A . 4 LYS C 1 1 1 52 1 1 4 LYS CA C -3.078 4.176 3.330 1.00 . A A . 4 LYS CA 1 1 1 53 1 1 4 LYS CB C -3.610 5.118 4.418 1.00 . A A . 4 LYS CB 1 1 1 54 1 1 4 LYS CD C -5.667 6.260 5.399 1.00 . A A . 4 LYS CD 1 1 1 55 1 1 4 LYS CE C -5.073 7.659 5.366 1.00 . A A . 4 LYS CE 1 1 1 56 1 1 4 LYS CG C -5.112 5.368 4.297 1.00 . A A . 4 LYS CG 1 1 1 57 1 1 4 LYS H H -4.165 2.680 4.319 1.00 . A A . 4 LYS H 1 1 1 58 1 1 4 LYS HA H -3.337 4.590 2.368 1.00 . A A . 4 LYS HA 1 1 1 59 1 1 4 LYS HB2 H -3.417 4.666 5.382 1.00 . A A . 4 LYS HB2 1 1 1 60 1 1 4 LYS HB3 H -3.095 6.064 4.366 1.00 . A A . 4 LYS HB3 1 1 1 61 1 1 4 LYS HD2 H -6.739 6.336 5.285 1.00 . A A . 4 LYS HD2 1 1 1 62 1 1 4 LYS HD3 H -5.441 5.803 6.351 1.00 . A A . 4 LYS HD3 1 1 1 63 1 1 4 LYS HE2 H -4.018 7.589 5.585 1.00 . A A . 4 LYS HE2 1 1 1 64 1 1 4 LYS HE3 H -5.204 8.069 4.376 1.00 . A A . 4 LYS HE3 1 1 1 65 1 1 4 LYS HG2 H -5.307 5.839 3.344 1.00 . A A . 4 LYS HG2 1 1 1 66 1 1 4 LYS HG3 H -5.617 4.413 4.327 1.00 . A A . 4 LYS HG3 1 1 1 67 1 1 4 LYS HZ1 H -5.592 8.172 7.319 1.00 . A A . 4 LYS HZ1 1 1 1 68 1 1 4 LYS HZ2 H -6.717 8.693 6.178 1.00 . A A . 4 LYS HZ2 1 1 1 69 1 1 4 LYS HZ3 H -5.251 9.495 6.348 1.00 . A A . 4 LYS HZ3 1 1 1 70 1 1 4 LYS N N -3.748 2.898 3.463 1.00 . A A . 4 LYS N 1 1 1 71 1 1 4 LYS NZ N -5.703 8.559 6.359 1.00 . A A . 4 LYS NZ 1 1 1 72 1 1 4 LYS O O -1.063 2.946 3.734 1.00 . A A . 4 LYS O 1 1 1 73 1 1 5 TRP C C 1.244 4.630 4.479 1.00 . A A . 5 TRP C 1 1 1 74 1 1 5 TRP CA C 0.646 5.073 3.143 1.00 . A A . 5 TRP CA 1 1 1 75 1 1 5 TRP CB C 1.244 6.445 2.741 1.00 . A A . 5 TRP CB 1 1 1 76 1 1 5 TRP CD1 C 0.181 8.141 4.328 1.00 . A A . 5 TRP CD1 1 1 1 77 1 1 5 TRP CD2 C 2.372 7.903 4.603 1.00 . A A . 5 TRP CD2 1 1 1 78 1 1 5 TRP CE2 C 1.908 8.854 5.519 1.00 . A A . 5 TRP CE2 1 1 1 79 1 1 5 TRP CE3 C 3.728 7.582 4.593 1.00 . A A . 5 TRP CE3 1 1 1 80 1 1 5 TRP CG C 1.243 7.466 3.841 1.00 . A A . 5 TRP CG 1 1 1 81 1 1 5 TRP CH2 C 4.064 9.154 6.389 1.00 . A A . 5 TRP CH2 1 1 1 82 1 1 5 TRP CZ2 C 2.745 9.487 6.418 1.00 . A A . 5 TRP CZ2 1 1 1 83 1 1 5 TRP CZ3 C 4.560 8.211 5.489 1.00 . A A . 5 TRP CZ3 1 1 1 84 1 1 5 TRP H H -1.299 5.955 2.996 1.00 . A A . 5 TRP H 1 1 1 85 1 1 5 TRP HA H 0.923 4.347 2.394 1.00 . A A . 5 TRP HA 1 1 1 86 1 1 5 TRP HB2 H 2.268 6.305 2.434 1.00 . A A . 5 TRP HB2 1 1 1 87 1 1 5 TRP HB3 H 0.677 6.843 1.911 1.00 . A A . 5 TRP HB3 1 1 1 88 1 1 5 TRP HD1 H -0.822 8.010 3.961 1.00 . A A . 5 TRP HD1 1 1 1 89 1 1 5 TRP HE1 H -0.040 9.577 5.825 1.00 . A A . 5 TRP HE1 1 1 1 90 1 1 5 TRP HE3 H 4.129 6.854 3.902 1.00 . A A . 5 TRP HE3 1 1 1 91 1 1 5 TRP HH2 H 4.749 9.627 7.075 1.00 . A A . 5 TRP HH2 1 1 1 92 1 1 5 TRP HZ2 H 2.386 10.221 7.125 1.00 . A A . 5 TRP HZ2 1 1 1 93 1 1 5 TRP HZ3 H 5.616 7.977 5.500 1.00 . A A . 5 TRP HZ3 1 1 1 94 1 1 5 TRP N N -0.831 5.109 3.183 1.00 . A A . 5 TRP N 1 1 1 95 1 1 5 TRP NE1 N 0.566 8.982 5.328 1.00 . A A . 5 TRP NE1 1 1 1 96 1 1 5 TRP O O 2.293 3.989 4.518 1.00 . A A . 5 TRP O 1 1 1 97 1 1 6 MET C C 0.512 3.272 7.336 1.00 . A A . 6 MET C 1 1 1 98 1 1 6 MET CA C 1.084 4.612 6.872 1.00 . A A . 6 MET CA 1 1 1 99 1 1 6 MET CB C 0.850 5.726 7.923 1.00 . A A . 6 MET CB 1 1 1 100 1 1 6 MET CE C -0.011 8.711 8.845 1.00 . A A . 6 MET CE 1 1 1 101 1 1 6 MET CG C -0.604 6.048 8.231 1.00 . A A . 6 MET CG 1 1 1 102 1 1 6 MET H H -0.268 5.449 5.472 1.00 . A A . 6 MET H 1 1 1 103 1 1 6 MET HA H 2.144 4.521 6.692 1.00 . A A . 6 MET HA 1 1 1 104 1 1 6 MET HB2 H 1.323 5.432 8.848 1.00 . A A . 6 MET HB2 1 1 1 105 1 1 6 MET HB3 H 1.329 6.626 7.567 1.00 . A A . 6 MET HB3 1 1 1 106 1 1 6 MET HE1 H -0.078 9.536 9.538 1.00 . A A . 6 MET HE1 1 1 1 107 1 1 6 MET HE2 H -0.510 8.971 7.922 1.00 . A A . 6 MET HE2 1 1 1 108 1 1 6 MET HE3 H 1.029 8.498 8.643 1.00 . A A . 6 MET HE3 1 1 1 109 1 1 6 MET HG2 H -1.076 6.433 7.340 1.00 . A A . 6 MET HG2 1 1 1 110 1 1 6 MET HG3 H -1.100 5.139 8.533 1.00 . A A . 6 MET HG3 1 1 1 111 1 1 6 MET N N 0.575 4.959 5.568 1.00 . A A . 6 MET N 1 1 1 112 1 1 6 MET O O 0.701 2.851 8.478 1.00 . A A . 6 MET O 1 1 1 113 1 1 6 MET SD S -0.793 7.266 9.558 1.00 . A A . 6 MET SD 1 1 1 114 1 1 7 TRP C C 0.017 0.235 5.952 1.00 . A A . 7 TRP C 1 1 1 115 1 1 7 TRP CA C -0.786 1.311 6.687 1.00 . A A . 7 TRP CA 1 1 1 116 1 1 7 TRP CB C -2.277 1.294 6.234 1.00 . A A . 7 TRP CB 1 1 1 117 1 1 7 TRP CD1 C -2.852 3.159 7.919 1.00 . A A . 7 TRP CD1 1 1 1 118 1 1 7 TRP CD2 C -4.647 2.202 7.013 1.00 . A A . 7 TRP CD2 1 1 1 119 1 1 7 TRP CE2 C -5.073 3.199 7.905 1.00 . A A . 7 TRP CE2 1 1 1 120 1 1 7 TRP CE3 C -5.609 1.470 6.333 1.00 . A A . 7 TRP CE3 1 1 1 121 1 1 7 TRP CG C -3.205 2.194 7.034 1.00 . A A . 7 TRP CG 1 1 1 122 1 1 7 TRP CH2 C -7.336 2.739 7.440 1.00 . A A . 7 TRP CH2 1 1 1 123 1 1 7 TRP CZ2 C -6.419 3.476 8.125 1.00 . A A . 7 TRP CZ2 1 1 1 124 1 1 7 TRP CZ3 C -6.942 1.742 6.551 1.00 . A A . 7 TRP CZ3 1 1 1 125 1 1 7 TRP H H -0.275 2.961 5.520 1.00 . A A . 7 TRP H 1 1 1 126 1 1 7 TRP HA H -0.729 1.126 7.748 1.00 . A A . 7 TRP HA 1 1 1 127 1 1 7 TRP HB2 H -2.326 1.623 5.206 1.00 . A A . 7 TRP HB2 1 1 1 128 1 1 7 TRP HB3 H -2.655 0.283 6.290 1.00 . A A . 7 TRP HB3 1 1 1 129 1 1 7 TRP HD1 H -1.824 3.388 8.159 1.00 . A A . 7 TRP HD1 1 1 1 130 1 1 7 TRP HE1 H -3.968 4.493 9.101 1.00 . A A . 7 TRP HE1 1 1 1 131 1 1 7 TRP HE3 H -5.334 0.681 5.650 1.00 . A A . 7 TRP HE3 1 1 1 132 1 1 7 TRP HH2 H -8.392 2.920 7.583 1.00 . A A . 7 TRP HH2 1 1 1 133 1 1 7 TRP HZ2 H -6.747 4.242 8.813 1.00 . A A . 7 TRP HZ2 1 1 1 134 1 1 7 TRP HZ3 H -7.694 1.175 6.024 1.00 . A A . 7 TRP HZ3 1 1 1 135 1 1 7 TRP N N -0.178 2.605 6.430 1.00 . A A . 7 TRP N 1 1 1 136 1 1 7 TRP NE1 N -3.961 3.764 8.440 1.00 . A A . 7 TRP NE1 1 1 1 137 1 1 7 TRP O O 1.055 0.536 5.314 1.00 . A A . 7 TRP O 1 1 1 138 1 1 8 THR C C -0.781 -2.923 4.650 1.00 . A A . 8 THR C 1 1 1 139 1 1 8 THR CA C 0.258 -2.112 5.426 1.00 . A A . 8 THR CA 1 1 1 140 1 1 8 THR CB C 0.877 -3.004 6.526 1.00 . A A . 8 THR CB 1 1 1 141 1 1 8 THR CG2 C 1.933 -2.237 7.319 1.00 . A A . 8 THR CG2 1 1 1 142 1 1 8 THR H H -1.230 -1.189 6.567 1.00 . A A . 8 THR H 1 1 1 143 1 1 8 THR HA H 1.034 -1.723 4.784 1.00 . A A . 8 THR HA 1 1 1 144 1 1 8 THR HB H 1.331 -3.868 6.063 1.00 . A A . 8 THR HB 1 1 1 145 1 1 8 THR HG1 H 0.117 -3.216 8.332 1.00 . A A . 8 THR HG1 1 1 1 146 1 1 8 THR HG21 H 1.472 -1.387 7.798 1.00 . A A . 8 THR HG21 1 1 1 147 1 1 8 THR HG22 H 2.712 -1.885 6.656 1.00 . A A . 8 THR HG22 1 1 1 148 1 1 8 THR HG23 H 2.359 -2.886 8.069 1.00 . A A . 8 THR HG23 1 1 1 149 1 1 8 THR N N -0.418 -0.991 6.052 1.00 . A A . 8 THR N 1 1 1 150 1 1 8 THR O O -1.981 -2.719 4.877 1.00 . A A . 8 THR O 1 1 1 151 1 1 8 THR OG1 O -0.164 -3.436 7.435 1.00 . A A . 8 THR OG1 1 1 1 152 1 1 9 CYS C C -1.213 -6.101 3.283 1.00 . A A . 9 CYS C 1 1 1 153 1 1 9 CYS CA C -1.429 -4.604 3.102 1.00 . A A . 9 CYS CA 1 1 1 154 1 1 9 CYS CB C -1.609 -4.229 1.637 1.00 . A A . 9 CYS CB 1 1 1 155 1 1 9 CYS H H 0.547 -4.001 3.483 1.00 . A A . 9 CYS H 1 1 1 156 1 1 9 CYS HA H -2.339 -4.361 3.632 1.00 . A A . 9 CYS HA 1 1 1 157 1 1 9 CYS HB2 H -2.480 -4.733 1.247 1.00 . A A . 9 CYS HB2 1 1 1 158 1 1 9 CYS HB3 H -1.763 -3.162 1.568 1.00 . A A . 9 CYS HB3 1 1 1 159 1 1 9 CYS N N -0.389 -3.828 3.746 1.00 . A A . 9 CYS N 1 1 1 160 1 1 9 CYS O O -0.238 -6.538 3.928 1.00 . A A . 9 CYS O 1 1 1 161 1 1 9 CYS SG S -0.226 -4.654 0.575 1.00 . A A . 9 CYS SG 1 1 1 162 1 1 10 ASP C C -2.770 -8.864 1.560 1.00 . A A . 10 ASP C 1 1 1 163 1 1 10 ASP CA C -2.141 -8.324 2.847 1.00 . A A . 10 ASP CA 1 1 1 164 1 1 10 ASP CB C -2.993 -8.698 4.092 1.00 . A A . 10 ASP CB 1 1 1 165 1 1 10 ASP CG C -3.071 -10.182 4.384 1.00 . A A . 10 ASP CG 1 1 1 166 1 1 10 ASP H H -2.798 -6.488 2.128 1.00 . A A . 10 ASP H 1 1 1 167 1 1 10 ASP HA H -1.131 -8.687 2.958 1.00 . A A . 10 ASP HA 1 1 1 168 1 1 10 ASP HB2 H -2.598 -8.205 4.967 1.00 . A A . 10 ASP HB2 1 1 1 169 1 1 10 ASP HB3 H -3.996 -8.345 3.908 1.00 . A A . 10 ASP HB3 1 1 1 170 1 1 10 ASP N N -2.114 -6.880 2.720 1.00 . A A . 10 ASP N 1 1 1 171 1 1 10 ASP O O -2.922 -8.113 0.615 1.00 . A A . 10 ASP O 1 1 1 172 1 1 10 ASP OD1 O -2.106 -10.755 4.901 1.00 . A A . 10 ASP OD1 1 1 1 173 1 1 10 ASP OD2 O -4.116 -10.793 4.068 1.00 . A A . 10 ASP OD2 1 1 1 174 1 1 11 SER C C -5.216 -10.160 0.271 1.00 . A A . 11 SER C 1 1 1 175 1 1 11 SER CA C -3.781 -10.695 0.368 1.00 . A A . 11 SER CA 1 1 1 176 1 1 11 SER CB C -3.788 -12.212 0.521 1.00 . A A . 11 SER CB 1 1 1 177 1 1 11 SER H H -3.019 -10.686 2.311 1.00 . A A . 11 SER H 1 1 1 178 1 1 11 SER HA H -3.224 -10.422 -0.515 1.00 . A A . 11 SER HA 1 1 1 179 1 1 11 SER HB2 H -4.469 -12.492 1.310 1.00 . A A . 11 SER HB2 1 1 1 180 1 1 11 SER HB3 H -4.101 -12.669 -0.407 1.00 . A A . 11 SER HB3 1 1 1 181 1 1 11 SER HG H -1.853 -12.081 0.430 1.00 . A A . 11 SER HG 1 1 1 182 1 1 11 SER N N -3.146 -10.115 1.523 1.00 . A A . 11 SER N 1 1 1 183 1 1 11 SER O O -5.785 -10.039 -0.812 1.00 . A A . 11 SER O 1 1 1 184 1 1 11 SER OG O -2.483 -12.683 0.846 1.00 . A A . 11 SER OG 1 1 1 185 1 1 12 GLU C C -7.046 -7.751 1.464 1.00 . A A . 12 GLU C 1 1 1 186 1 1 12 GLU CA C -7.120 -9.271 1.469 1.00 . A A . 12 GLU CA 1 1 1 187 1 1 12 GLU CB C -7.858 -9.735 2.709 1.00 . A A . 12 GLU CB 1 1 1 188 1 1 12 GLU CD C -8.716 -11.636 4.079 1.00 . A A . 12 GLU CD 1 1 1 189 1 1 12 GLU CG C -7.927 -11.242 2.867 1.00 . A A . 12 GLU CG 1 1 1 190 1 1 12 GLU H H -5.285 -9.993 2.250 1.00 . A A . 12 GLU H 1 1 1 191 1 1 12 GLU HA H -7.654 -9.602 0.592 1.00 . A A . 12 GLU HA 1 1 1 192 1 1 12 GLU HB2 H -7.371 -9.315 3.573 1.00 . A A . 12 GLU HB2 1 1 1 193 1 1 12 GLU HB3 H -8.868 -9.354 2.667 1.00 . A A . 12 GLU HB3 1 1 1 194 1 1 12 GLU HG2 H -8.391 -11.671 1.992 1.00 . A A . 12 GLU HG2 1 1 1 195 1 1 12 GLU HG3 H -6.923 -11.627 2.966 1.00 . A A . 12 GLU HG3 1 1 1 196 1 1 12 GLU N N -5.787 -9.831 1.423 1.00 . A A . 12 GLU N 1 1 1 197 1 1 12 GLU O O -7.660 -7.097 0.634 1.00 . A A . 12 GLU O 1 1 1 198 1 1 12 GLU OE1 O -9.950 -11.747 3.980 1.00 . A A . 12 GLU OE1 1 1 1 199 1 1 12 GLU OE2 O -8.113 -11.832 5.169 1.00 . A A . 12 GLU OE2 1 1 1 200 1 1 13 ARG C C -5.298 -5.225 1.342 1.00 . A A . 13 ARG C 1 1 1 201 1 1 13 ARG CA C -6.133 -5.749 2.506 1.00 . A A . 13 ARG CA 1 1 1 202 1 1 13 ARG CB C -5.444 -5.363 3.833 1.00 . A A . 13 ARG CB 1 1 1 203 1 1 13 ARG CD C -5.453 -5.287 6.361 1.00 . A A . 13 ARG CD 1 1 1 204 1 1 13 ARG CG C -6.191 -5.767 5.103 1.00 . A A . 13 ARG CG 1 1 1 205 1 1 13 ARG CZ C -2.996 -5.262 6.919 1.00 . A A . 13 ARG CZ 1 1 1 206 1 1 13 ARG H H -5.805 -7.788 3.015 1.00 . A A . 13 ARG H 1 1 1 207 1 1 13 ARG HA H -7.117 -5.304 2.474 1.00 . A A . 13 ARG HA 1 1 1 208 1 1 13 ARG HB2 H -4.470 -5.829 3.862 1.00 . A A . 13 ARG HB2 1 1 1 209 1 1 13 ARG HB3 H -5.310 -4.292 3.847 1.00 . A A . 13 ARG HB3 1 1 1 210 1 1 13 ARG HD2 H -5.333 -4.216 6.294 1.00 . A A . 13 ARG HD2 1 1 1 211 1 1 13 ARG HD3 H -6.051 -5.523 7.228 1.00 . A A . 13 ARG HD3 1 1 1 212 1 1 13 ARG HE H -4.071 -6.868 6.310 1.00 . A A . 13 ARG HE 1 1 1 213 1 1 13 ARG HG2 H -7.179 -5.332 5.085 1.00 . A A . 13 ARG HG2 1 1 1 214 1 1 13 ARG HG3 H -6.270 -6.845 5.132 1.00 . A A . 13 ARG HG3 1 1 1 215 1 1 13 ARG HH11 H -3.920 -3.491 7.351 1.00 . A A . 13 ARG HH11 1 1 1 216 1 1 13 ARG HH12 H -2.241 -3.497 7.602 1.00 . A A . 13 ARG HH12 1 1 1 217 1 1 13 ARG HH21 H -1.719 -6.879 6.766 1.00 . A A . 13 ARG HH21 1 1 1 218 1 1 13 ARG HH22 H -0.995 -5.425 7.268 1.00 . A A . 13 ARG HH22 1 1 1 219 1 1 13 ARG N N -6.283 -7.201 2.397 1.00 . A A . 13 ARG N 1 1 1 220 1 1 13 ARG NE N -4.110 -5.906 6.515 1.00 . A A . 13 ARG NE 1 1 1 221 1 1 13 ARG NH1 N -3.061 -4.008 7.319 1.00 . A A . 13 ARG NH1 1 1 1 222 1 1 13 ARG NH2 N -1.833 -5.907 6.990 1.00 . A A . 13 ARG NH2 1 1 1 223 1 1 13 ARG O O -4.161 -5.629 1.187 1.00 . A A . 13 ARG O 1 1 1 224 1 1 14 LYS C C -4.775 -2.340 -0.315 1.00 . A A . 14 LYS C 1 1 1 225 1 1 14 LYS CA C -5.143 -3.785 -0.603 1.00 . A A . 14 LYS CA 1 1 1 226 1 1 14 LYS CB C -5.977 -3.821 -1.883 1.00 . A A . 14 LYS CB 1 1 1 227 1 1 14 LYS CD C -7.075 -5.092 -3.712 1.00 . A A . 14 LYS CD 1 1 1 228 1 1 14 LYS CE C -7.332 -6.452 -4.324 1.00 . A A . 14 LYS CE 1 1 1 229 1 1 14 LYS CG C -6.295 -5.198 -2.417 1.00 . A A . 14 LYS CG 1 1 1 230 1 1 14 LYS H H -6.800 -4.103 0.667 1.00 . A A . 14 LYS H 1 1 1 231 1 1 14 LYS HA H -4.242 -4.357 -0.760 1.00 . A A . 14 LYS HA 1 1 1 232 1 1 14 LYS HB2 H -6.913 -3.317 -1.697 1.00 . A A . 14 LYS HB2 1 1 1 233 1 1 14 LYS HB3 H -5.441 -3.278 -2.647 1.00 . A A . 14 LYS HB3 1 1 1 234 1 1 14 LYS HD2 H -8.023 -4.613 -3.512 1.00 . A A . 14 LYS HD2 1 1 1 235 1 1 14 LYS HD3 H -6.512 -4.491 -4.410 1.00 . A A . 14 LYS HD3 1 1 1 236 1 1 14 LYS HE2 H -6.385 -6.935 -4.508 1.00 . A A . 14 LYS HE2 1 1 1 237 1 1 14 LYS HE3 H -7.914 -7.048 -3.638 1.00 . A A . 14 LYS HE3 1 1 1 238 1 1 14 LYS HG2 H -5.371 -5.721 -2.610 1.00 . A A . 14 LYS HG2 1 1 1 239 1 1 14 LYS HG3 H -6.884 -5.739 -1.691 1.00 . A A . 14 LYS HG3 1 1 1 240 1 1 14 LYS HZ1 H -7.521 -5.770 -6.283 1.00 . A A . 14 LYS HZ1 1 1 1 241 1 1 14 LYS HZ2 H -8.969 -5.850 -5.463 1.00 . A A . 14 LYS HZ2 1 1 1 242 1 1 14 LYS HZ3 H -8.249 -7.270 -6.017 1.00 . A A . 14 LYS HZ3 1 1 1 243 1 1 14 LYS N N -5.866 -4.370 0.522 1.00 . A A . 14 LYS N 1 1 1 244 1 1 14 LYS NZ N -8.061 -6.338 -5.600 1.00 . A A . 14 LYS NZ 1 1 1 245 1 1 14 LYS O O -5.547 -1.614 0.309 1.00 . A A . 14 LYS O 1 1 1 246 1 1 15 CYS C C -3.912 0.315 -1.627 1.00 . A A . 15 CYS C 1 1 1 247 1 1 15 CYS CA C -3.185 -0.535 -0.622 1.00 . A A . 15 CYS CA 1 1 1 248 1 1 15 CYS CB C -1.675 -0.387 -0.826 1.00 . A A . 15 CYS CB 1 1 1 249 1 1 15 CYS H H -3.013 -2.560 -1.206 1.00 . A A . 15 CYS H 1 1 1 250 1 1 15 CYS HA H -3.450 -0.178 0.359 1.00 . A A . 15 CYS HA 1 1 1 251 1 1 15 CYS HB2 H -1.420 -0.725 -1.820 1.00 . A A . 15 CYS HB2 1 1 1 252 1 1 15 CYS HB3 H -1.408 0.656 -0.729 1.00 . A A . 15 CYS HB3 1 1 1 253 1 1 15 CYS N N -3.608 -1.925 -0.763 1.00 . A A . 15 CYS N 1 1 1 254 1 1 15 CYS O O -4.312 -0.182 -2.682 1.00 . A A . 15 CYS O 1 1 1 255 1 1 15 CYS SG S -0.661 -1.332 0.347 1.00 . A A . 15 CYS SG 1 1 1 256 1 1 16 CYS C C -3.929 2.645 -3.479 1.00 . A A . 16 CYS C 1 1 1 257 1 1 16 CYS CA C -4.764 2.495 -2.197 1.00 . A A . 16 CYS CA 1 1 1 258 1 1 16 CYS CB C -4.935 3.854 -1.520 1.00 . A A . 16 CYS CB 1 1 1 259 1 1 16 CYS H H -3.825 1.880 -0.410 1.00 . A A . 16 CYS H 1 1 1 260 1 1 16 CYS HA H -5.734 2.093 -2.447 1.00 . A A . 16 CYS HA 1 1 1 261 1 1 16 CYS HB2 H -3.957 4.280 -1.355 1.00 . A A . 16 CYS HB2 1 1 1 262 1 1 16 CYS HB3 H -5.500 4.502 -2.173 1.00 . A A . 16 CYS HB3 1 1 1 263 1 1 16 CYS N N -4.114 1.565 -1.297 1.00 . A A . 16 CYS N 1 1 1 264 1 1 16 CYS O O -2.684 2.610 -3.427 1.00 . A A . 16 CYS O 1 1 1 265 1 1 16 CYS SG S -5.780 3.813 0.104 1.00 . A A . 16 CYS SG 1 1 1 266 1 1 17 LYS C C -3.039 4.103 -5.946 1.00 . A A . 17 LYS C 1 1 1 267 1 1 17 LYS CA C -3.965 2.894 -5.914 1.00 . A A . 17 LYS CA 1 1 1 268 1 1 17 LYS CB C -5.005 2.994 -7.026 1.00 . A A . 17 LYS CB 1 1 1 269 1 1 17 LYS CD C -6.940 1.989 -8.258 1.00 . A A . 17 LYS CD 1 1 1 270 1 1 17 LYS CE C -7.891 0.812 -8.359 1.00 . A A . 17 LYS CE 1 1 1 271 1 1 17 LYS CG C -5.930 1.793 -7.138 1.00 . A A . 17 LYS CG 1 1 1 272 1 1 17 LYS H H -5.590 2.810 -4.568 1.00 . A A . 17 LYS H 1 1 1 273 1 1 17 LYS HA H -3.374 2.003 -6.066 1.00 . A A . 17 LYS HA 1 1 1 274 1 1 17 LYS HB2 H -5.618 3.862 -6.836 1.00 . A A . 17 LYS HB2 1 1 1 275 1 1 17 LYS HB3 H -4.496 3.122 -7.969 1.00 . A A . 17 LYS HB3 1 1 1 276 1 1 17 LYS HD2 H -7.510 2.886 -8.068 1.00 . A A . 17 LYS HD2 1 1 1 277 1 1 17 LYS HD3 H -6.409 2.092 -9.192 1.00 . A A . 17 LYS HD3 1 1 1 278 1 1 17 LYS HE2 H -7.325 -0.086 -8.557 1.00 . A A . 17 LYS HE2 1 1 1 279 1 1 17 LYS HE3 H -8.406 0.706 -7.417 1.00 . A A . 17 LYS HE3 1 1 1 280 1 1 17 LYS HG2 H -5.338 0.913 -7.345 1.00 . A A . 17 LYS HG2 1 1 1 281 1 1 17 LYS HG3 H -6.457 1.665 -6.204 1.00 . A A . 17 LYS HG3 1 1 1 282 1 1 17 LYS HZ1 H -9.529 1.795 -9.219 1.00 . A A . 17 LYS HZ1 1 1 1 283 1 1 17 LYS HZ2 H -9.467 0.145 -9.556 1.00 . A A . 17 LYS HZ2 1 1 1 284 1 1 17 LYS HZ3 H -8.430 1.192 -10.345 1.00 . A A . 17 LYS HZ3 1 1 1 285 1 1 17 LYS N N -4.609 2.775 -4.613 1.00 . A A . 17 LYS N 1 1 1 286 1 1 17 LYS NZ N -8.892 1.003 -9.433 1.00 . A A . 17 LYS NZ 1 1 1 287 1 1 17 LYS O O -3.391 5.190 -5.462 1.00 . A A . 17 LYS O 1 1 1 288 1 1 18 GLY C C 0.273 4.509 -5.594 1.00 . A A . 18 GLY C 1 1 1 289 1 1 18 GLY CA C -0.861 4.949 -6.480 1.00 . A A . 18 GLY CA 1 1 1 290 1 1 18 GLY H H -1.677 3.052 -6.929 1.00 . A A . 18 GLY H 1 1 1 291 1 1 18 GLY HA2 H -0.500 5.117 -7.484 1.00 . A A . 18 GLY HA2 1 1 1 292 1 1 18 GLY HA3 H -1.282 5.861 -6.085 1.00 . A A . 18 GLY HA3 1 1 1 293 1 1 18 GLY N N -1.871 3.913 -6.495 1.00 . A A . 18 GLY N 1 1 1 294 1 1 18 GLY O O 1.382 5.059 -5.620 1.00 . A A . 18 GLY O 1 1 1 295 1 1 19 MET C C 0.917 1.404 -4.312 1.00 . A A . 19 MET C 1 1 1 296 1 1 19 MET CA C 0.916 2.861 -3.942 1.00 . A A . 19 MET CA 1 1 1 297 1 1 19 MET CB C 0.541 3.041 -2.461 1.00 . A A . 19 MET CB 1 1 1 298 1 1 19 MET CE C -1.503 4.351 -0.315 1.00 . A A . 19 MET CE 1 1 1 299 1 1 19 MET CG C 0.723 4.461 -1.953 1.00 . A A . 19 MET CG 1 1 1 300 1 1 19 MET H H -0.949 3.177 -4.787 1.00 . A A . 19 MET H 1 1 1 301 1 1 19 MET HA H 1.894 3.278 -4.126 1.00 . A A . 19 MET HA 1 1 1 302 1 1 19 MET HB2 H -0.496 2.765 -2.334 1.00 . A A . 19 MET HB2 1 1 1 303 1 1 19 MET HB3 H 1.154 2.383 -1.864 1.00 . A A . 19 MET HB3 1 1 1 304 1 1 19 MET HE1 H -1.933 4.464 0.668 1.00 . A A . 19 MET HE1 1 1 1 305 1 1 19 MET HE2 H -1.664 3.340 -0.660 1.00 . A A . 19 MET HE2 1 1 1 306 1 1 19 MET HE3 H -1.968 5.048 -0.995 1.00 . A A . 19 MET HE3 1 1 1 307 1 1 19 MET HG2 H 1.776 4.682 -1.995 1.00 . A A . 19 MET HG2 1 1 1 308 1 1 19 MET HG3 H 0.165 5.149 -2.571 1.00 . A A . 19 MET HG3 1 1 1 309 1 1 19 MET N N -0.026 3.516 -4.799 1.00 . A A . 19 MET N 1 1 1 310 1 1 19 MET O O -0.022 0.935 -4.961 1.00 . A A . 19 MET O 1 1 1 311 1 1 19 MET SD S 0.251 4.692 -0.235 1.00 . A A . 19 MET SD 1 1 1 312 1 1 20 VAL C C 1.784 -1.524 -3.016 1.00 . A A . 20 VAL C 1 1 1 313 1 1 20 VAL CA C 2.021 -0.693 -4.259 1.00 . A A . 20 VAL CA 1 1 1 314 1 1 20 VAL CB C 3.379 -1.074 -4.922 1.00 . A A . 20 VAL CB 1 1 1 315 1 1 20 VAL CG1 C 3.536 -0.374 -6.261 1.00 . A A . 20 VAL CG1 1 1 1 316 1 1 20 VAL CG2 C 4.559 -0.747 -4.013 1.00 . A A . 20 VAL CG2 1 1 1 317 1 1 20 VAL H H 2.660 1.120 -3.415 1.00 . A A . 20 VAL H 1 1 1 318 1 1 20 VAL HA H 1.226 -0.907 -4.958 1.00 . A A . 20 VAL HA 1 1 1 319 1 1 20 VAL HB H 3.368 -2.138 -5.105 1.00 . A A . 20 VAL HB 1 1 1 320 1 1 20 VAL HG11 H 3.523 0.695 -6.111 1.00 . A A . 20 VAL HG11 1 1 1 321 1 1 20 VAL HG12 H 2.723 -0.656 -6.913 1.00 . A A . 20 VAL HG12 1 1 1 322 1 1 20 VAL HG13 H 4.475 -0.664 -6.710 1.00 . A A . 20 VAL HG13 1 1 1 323 1 1 20 VAL HG21 H 5.480 -1.014 -4.507 1.00 . A A . 20 VAL HG21 1 1 1 324 1 1 20 VAL HG22 H 4.469 -1.304 -3.093 1.00 . A A . 20 VAL HG22 1 1 1 325 1 1 20 VAL HG23 H 4.561 0.311 -3.794 1.00 . A A . 20 VAL HG23 1 1 1 326 1 1 20 VAL N N 1.935 0.700 -3.943 1.00 . A A . 20 VAL N 1 1 1 327 1 1 20 VAL O O 2.152 -1.115 -1.897 1.00 . A A . 20 VAL O 1 1 1 328 1 1 21 CYS C C 2.089 -4.359 -1.792 1.00 . A A . 21 CYS C 1 1 1 329 1 1 21 CYS CA C 0.843 -3.534 -2.110 1.00 . A A . 21 CYS CA 1 1 1 330 1 1 21 CYS CB C -0.356 -4.429 -2.472 1.00 . A A . 21 CYS CB 1 1 1 331 1 1 21 CYS H H 0.842 -2.889 -4.102 1.00 . A A . 21 CYS H 1 1 1 332 1 1 21 CYS HA H 0.593 -2.931 -1.249 1.00 . A A . 21 CYS HA 1 1 1 333 1 1 21 CYS HB2 H -1.155 -3.806 -2.846 1.00 . A A . 21 CYS HB2 1 1 1 334 1 1 21 CYS HB3 H -0.050 -5.109 -3.253 1.00 . A A . 21 CYS HB3 1 1 1 335 1 1 21 CYS N N 1.138 -2.644 -3.198 1.00 . A A . 21 CYS N 1 1 1 336 1 1 21 CYS O O 2.693 -4.985 -2.689 1.00 . A A . 21 CYS O 1 1 1 337 1 1 21 CYS SG S -1.051 -5.427 -1.103 1.00 . A A . 21 CYS SG 1 1 1 338 1 1 22 ARG C C 3.425 -5.139 1.491 1.00 . A A . 22 ARG C 1 1 1 339 1 1 22 ARG CA C 3.641 -4.970 -0.033 1.00 . A A . 22 ARG CA 1 1 1 340 1 1 22 ARG CB C 4.859 -4.040 -0.372 1.00 . A A . 22 ARG CB 1 1 1 341 1 1 22 ARG CD C 6.499 -5.937 -0.693 1.00 . A A . 22 ARG CD 1 1 1 342 1 1 22 ARG CG C 6.266 -4.572 -0.071 1.00 . A A . 22 ARG CG 1 1 1 343 1 1 22 ARG CZ C 5.623 -7.045 -2.737 1.00 . A A . 22 ARG CZ 1 1 1 344 1 1 22 ARG H H 1.919 -3.864 0.129 1.00 . A A . 22 ARG H 1 1 1 345 1 1 22 ARG HA H 3.762 -5.931 -0.508 1.00 . A A . 22 ARG HA 1 1 1 346 1 1 22 ARG HB2 H 4.824 -3.818 -1.427 1.00 . A A . 22 ARG HB2 1 1 1 347 1 1 22 ARG HB3 H 4.724 -3.114 0.168 1.00 . A A . 22 ARG HB3 1 1 1 348 1 1 22 ARG HD2 H 7.538 -6.197 -0.569 1.00 . A A . 22 ARG HD2 1 1 1 349 1 1 22 ARG HD3 H 5.889 -6.654 -0.169 1.00 . A A . 22 ARG HD3 1 1 1 350 1 1 22 ARG HE H 6.387 -5.158 -2.621 1.00 . A A . 22 ARG HE 1 1 1 351 1 1 22 ARG HG2 H 6.993 -3.881 -0.472 1.00 . A A . 22 ARG HG2 1 1 1 352 1 1 22 ARG HG3 H 6.393 -4.641 1.000 1.00 . A A . 22 ARG HG3 1 1 1 353 1 1 22 ARG HH11 H 5.545 -8.227 -1.067 1.00 . A A . 22 ARG HH11 1 1 1 354 1 1 22 ARG HH12 H 4.940 -8.951 -2.493 1.00 . A A . 22 ARG HH12 1 1 1 355 1 1 22 ARG HH21 H 5.535 -6.178 -4.577 1.00 . A A . 22 ARG HH21 1 1 1 356 1 1 22 ARG HH22 H 4.937 -7.773 -4.517 1.00 . A A . 22 ARG HH22 1 1 1 357 1 1 22 ARG N N 2.471 -4.330 -0.540 1.00 . A A . 22 ARG N 1 1 1 358 1 1 22 ARG NE N 6.173 -5.981 -2.120 1.00 . A A . 22 ARG NE 1 1 1 359 1 1 22 ARG NH1 N 5.353 -8.151 -2.049 1.00 . A A . 22 ARG NH1 1 1 1 360 1 1 22 ARG NH2 N 5.346 -6.996 -4.029 1.00 . A A . 22 ARG NH2 1 1 1 361 1 1 22 ARG O O 2.298 -4.835 2.012 1.00 . A A . 22 ARG O 1 1 1 362 1 1 23 LEU C C 3.922 -4.466 4.306 1.00 . A A . 23 LEU C 1 1 1 363 1 1 23 LEU CA C 4.454 -5.741 3.669 1.00 . A A . 23 LEU CA 1 1 1 364 1 1 23 LEU CB C 5.872 -6.024 4.185 1.00 . A A . 23 LEU CB 1 1 1 365 1 1 23 LEU CD1 C 7.942 -7.428 4.256 1.00 . A A . 23 LEU CD1 1 1 1 366 1 1 23 LEU CD2 C 5.705 -8.523 4.343 1.00 . A A . 23 LEU CD2 1 1 1 367 1 1 23 LEU CG C 6.502 -7.358 3.774 1.00 . A A . 23 LEU CG 1 1 1 368 1 1 23 LEU H H 5.236 -5.961 1.716 1.00 . A A . 23 LEU H 1 1 1 369 1 1 23 LEU HA H 3.810 -6.565 3.936 1.00 . A A . 23 LEU HA 1 1 1 370 1 1 23 LEU HB2 H 6.515 -5.238 3.821 1.00 . A A . 23 LEU HB2 1 1 1 371 1 1 23 LEU HB3 H 5.852 -5.978 5.263 1.00 . A A . 23 LEU HB3 1 1 1 372 1 1 23 LEU HD11 H 7.965 -7.344 5.332 1.00 . A A . 23 LEU HD11 1 1 1 373 1 1 23 LEU HD12 H 8.510 -6.620 3.819 1.00 . A A . 23 LEU HD12 1 1 1 374 1 1 23 LEU HD13 H 8.374 -8.374 3.961 1.00 . A A . 23 LEU HD13 1 1 1 375 1 1 23 LEU HD21 H 4.699 -8.505 3.951 1.00 . A A . 23 LEU HD21 1 1 1 376 1 1 23 LEU HD22 H 5.673 -8.441 5.419 1.00 . A A . 23 LEU HD22 1 1 1 377 1 1 23 LEU HD23 H 6.181 -9.452 4.070 1.00 . A A . 23 LEU HD23 1 1 1 378 1 1 23 LEU HG H 6.503 -7.438 2.697 1.00 . A A . 23 LEU HG 1 1 1 379 1 1 23 LEU N N 4.458 -5.623 2.203 1.00 . A A . 23 LEU N 1 1 1 380 1 1 23 LEU O O 3.279 -4.502 5.348 1.00 . A A . 23 LEU O 1 1 1 381 1 1 24 TRP C C 3.247 -1.397 2.744 1.00 . A A . 24 TRP C 1 1 1 382 1 1 24 TRP CA C 3.654 -2.095 4.047 1.00 . A A . 24 TRP CA 1 1 1 383 1 1 24 TRP CB C 4.689 -1.264 4.829 1.00 . A A . 24 TRP CB 1 1 1 384 1 1 24 TRP CD1 C 5.755 0.634 3.546 1.00 . A A . 24 TRP CD1 1 1 1 385 1 1 24 TRP CD2 C 6.935 -1.251 3.462 1.00 . A A . 24 TRP CD2 1 1 1 386 1 1 24 TRP CE2 C 7.609 -0.270 2.713 1.00 . A A . 24 TRP CE2 1 1 1 387 1 1 24 TRP CE3 C 7.493 -2.526 3.555 1.00 . A A . 24 TRP CE3 1 1 1 388 1 1 24 TRP CG C 5.751 -0.640 3.983 1.00 . A A . 24 TRP CG 1 1 1 389 1 1 24 TRP CH2 C 9.328 -1.780 2.171 1.00 . A A . 24 TRP CH2 1 1 1 390 1 1 24 TRP CZ2 C 8.807 -0.524 2.062 1.00 . A A . 24 TRP CZ2 1 1 1 391 1 1 24 TRP CZ3 C 8.683 -2.779 2.909 1.00 . A A . 24 TRP CZ3 1 1 1 392 1 1 24 TRP H H 4.742 -3.365 2.855 1.00 . A A . 24 TRP H 1 1 1 393 1 1 24 TRP HA H 2.789 -2.299 4.657 1.00 . A A . 24 TRP HA 1 1 1 394 1 1 24 TRP HB2 H 4.178 -0.470 5.352 1.00 . A A . 24 TRP HB2 1 1 1 395 1 1 24 TRP HB3 H 5.169 -1.904 5.554 1.00 . A A . 24 TRP HB3 1 1 1 396 1 1 24 TRP HD1 H 4.953 1.314 3.798 1.00 . A A . 24 TRP HD1 1 1 1 397 1 1 24 TRP HE1 H 7.093 1.724 2.346 1.00 . A A . 24 TRP HE1 1 1 1 398 1 1 24 TRP HE3 H 7.004 -3.299 4.127 1.00 . A A . 24 TRP HE3 1 1 1 399 1 1 24 TRP HH2 H 10.257 -2.019 1.678 1.00 . A A . 24 TRP HH2 1 1 1 400 1 1 24 TRP HZ2 H 9.325 0.233 1.492 1.00 . A A . 24 TRP HZ2 1 1 1 401 1 1 24 TRP HZ3 H 9.132 -3.761 2.969 1.00 . A A . 24 TRP HZ3 1 1 1 402 1 1 24 TRP N N 4.190 -3.353 3.666 1.00 . A A . 24 TRP N 1 1 1 403 1 1 24 TRP NE1 N 6.864 0.871 2.776 1.00 . A A . 24 TRP NE1 1 1 1 404 1 1 24 TRP O O 3.708 -1.807 1.670 1.00 . A A . 24 TRP O 1 1 1 405 1 1 25 CYS C C 3.077 1.313 1.198 1.00 . A A . 25 CYS C 1 1 1 406 1 1 25 CYS CA C 2.014 0.312 1.602 1.00 . A A . 25 CYS CA 1 1 1 407 1 1 25 CYS CB C 0.662 0.976 1.777 1.00 . A A . 25 CYS CB 1 1 1 408 1 1 25 CYS H H 2.045 -0.095 3.668 1.00 . A A . 25 CYS H 1 1 1 409 1 1 25 CYS HA H 1.945 -0.428 0.818 1.00 . A A . 25 CYS HA 1 1 1 410 1 1 25 CYS HB2 H 0.697 1.635 2.632 1.00 . A A . 25 CYS HB2 1 1 1 411 1 1 25 CYS HB3 H 0.425 1.546 0.891 1.00 . A A . 25 CYS HB3 1 1 1 412 1 1 25 CYS N N 2.411 -0.395 2.808 1.00 . A A . 25 CYS N 1 1 1 413 1 1 25 CYS O O 3.416 2.225 1.960 1.00 . A A . 25 CYS O 1 1 1 414 1 1 25 CYS SG S -0.675 -0.220 2.044 1.00 . A A . 25 CYS SG 1 1 1 415 1 1 26 LYS C C 4.287 2.699 -1.704 1.00 . A A . 26 LYS C 1 1 1 416 1 1 26 LYS CA C 4.694 1.952 -0.458 1.00 . A A . 26 LYS CA 1 1 1 417 1 1 26 LYS CB C 5.909 1.057 -0.743 1.00 . A A . 26 LYS CB 1 1 1 418 1 1 26 LYS CD C 8.359 0.924 -1.379 1.00 . A A . 26 LYS CD 1 1 1 419 1 1 26 LYS CE C 8.253 -0.154 -2.458 1.00 . A A . 26 LYS CE 1 1 1 420 1 1 26 LYS CG C 7.110 1.804 -1.293 1.00 . A A . 26 LYS CG 1 1 1 421 1 1 26 LYS H H 3.227 0.456 -0.580 1.00 . A A . 26 LYS H 1 1 1 422 1 1 26 LYS HA H 4.960 2.656 0.316 1.00 . A A . 26 LYS HA 1 1 1 423 1 1 26 LYS HB2 H 6.204 0.571 0.174 1.00 . A A . 26 LYS HB2 1 1 1 424 1 1 26 LYS HB3 H 5.617 0.304 -1.460 1.00 . A A . 26 LYS HB3 1 1 1 425 1 1 26 LYS HD2 H 9.212 1.548 -1.599 1.00 . A A . 26 LYS HD2 1 1 1 426 1 1 26 LYS HD3 H 8.508 0.447 -0.422 1.00 . A A . 26 LYS HD3 1 1 1 427 1 1 26 LYS HE2 H 9.113 -0.804 -2.385 1.00 . A A . 26 LYS HE2 1 1 1 428 1 1 26 LYS HE3 H 7.357 -0.732 -2.288 1.00 . A A . 26 LYS HE3 1 1 1 429 1 1 26 LYS HG2 H 6.852 2.138 -2.288 1.00 . A A . 26 LYS HG2 1 1 1 430 1 1 26 LYS HG3 H 7.283 2.663 -0.670 1.00 . A A . 26 LYS HG3 1 1 1 431 1 1 26 LYS HZ1 H 8.195 -0.326 -4.542 1.00 . A A . 26 LYS HZ1 1 1 1 432 1 1 26 LYS HZ2 H 9.048 1.016 -3.988 1.00 . A A . 26 LYS HZ2 1 1 1 433 1 1 26 LYS HZ3 H 7.389 1.041 -3.975 1.00 . A A . 26 LYS HZ3 1 1 1 434 1 1 26 LYS N N 3.602 1.143 0.014 1.00 . A A . 26 LYS N 1 1 1 435 1 1 26 LYS NZ N 8.209 0.423 -3.821 1.00 . A A . 26 LYS NZ 1 1 1 436 1 1 26 LYS O O 3.694 2.116 -2.584 1.00 . A A . 26 LYS O 1 1 1 437 1 1 27 LYS C C 4.942 4.254 -4.172 1.00 . A A . 27 LYS C 1 1 1 438 1 1 27 LYS CA C 4.281 4.808 -2.929 1.00 . A A . 27 LYS CA 1 1 1 439 1 1 27 LYS CB C 4.661 6.274 -2.702 1.00 . A A . 27 LYS CB 1 1 1 440 1 1 27 LYS CD C 6.394 7.983 -2.113 1.00 . A A . 27 LYS CD 1 1 1 441 1 1 27 LYS CE C 7.863 8.232 -1.826 1.00 . A A . 27 LYS CE 1 1 1 442 1 1 27 LYS CG C 6.122 6.512 -2.353 1.00 . A A . 27 LYS CG 1 1 1 443 1 1 27 LYS H H 5.015 4.414 -0.985 1.00 . A A . 27 LYS H 1 1 1 444 1 1 27 LYS HA H 3.222 4.751 -3.120 1.00 . A A . 27 LYS HA 1 1 1 445 1 1 27 LYS HB2 H 4.443 6.821 -3.608 1.00 . A A . 27 LYS HB2 1 1 1 446 1 1 27 LYS HB3 H 4.045 6.665 -1.908 1.00 . A A . 27 LYS HB3 1 1 1 447 1 1 27 LYS HD2 H 6.102 8.544 -2.987 1.00 . A A . 27 LYS HD2 1 1 1 448 1 1 27 LYS HD3 H 5.811 8.313 -1.267 1.00 . A A . 27 LYS HD3 1 1 1 449 1 1 27 LYS HE2 H 8.148 7.664 -0.954 1.00 . A A . 27 LYS HE2 1 1 1 450 1 1 27 LYS HE3 H 8.442 7.893 -2.671 1.00 . A A . 27 LYS HE3 1 1 1 451 1 1 27 LYS HG2 H 6.365 5.956 -1.460 1.00 . A A . 27 LYS HG2 1 1 1 452 1 1 27 LYS HG3 H 6.737 6.166 -3.171 1.00 . A A . 27 LYS HG3 1 1 1 453 1 1 27 LYS HZ1 H 9.158 9.816 -1.410 1.00 . A A . 27 LYS HZ1 1 1 1 454 1 1 27 LYS HZ2 H 7.638 10.028 -0.758 1.00 . A A . 27 LYS HZ2 1 1 1 455 1 1 27 LYS HZ3 H 7.875 10.231 -2.420 1.00 . A A . 27 LYS HZ3 1 1 1 456 1 1 27 LYS N N 4.584 3.989 -1.758 1.00 . A A . 27 LYS N 1 1 1 457 1 1 27 LYS NZ N 8.146 9.664 -1.591 1.00 . A A . 27 LYS NZ 1 1 1 458 1 1 27 LYS O O 6.083 3.766 -4.130 1.00 . A A . 27 LYS O 1 1 1 459 1 1 28 LYS C C 5.669 4.712 -7.145 1.00 . A A . 28 LYS C 1 1 1 460 1 1 28 LYS CA C 4.698 3.750 -6.485 1.00 . A A . 28 LYS CA 1 1 1 461 1 1 28 LYS CB C 3.519 3.385 -7.394 1.00 . A A . 28 LYS CB 1 1 1 462 1 1 28 LYS CD C 2.650 2.175 -9.385 1.00 . A A . 28 LYS CD 1 1 1 463 1 1 28 LYS CE C 2.968 1.490 -10.708 1.00 . A A . 28 LYS CE 1 1 1 464 1 1 28 LYS CG C 3.893 2.682 -8.681 1.00 . A A . 28 LYS CG 1 1 1 465 1 1 28 LYS H H 3.343 4.735 -5.235 1.00 . A A . 28 LYS H 1 1 1 466 1 1 28 LYS HA H 5.236 2.847 -6.237 1.00 . A A . 28 LYS HA 1 1 1 467 1 1 28 LYS HB2 H 2.847 2.743 -6.845 1.00 . A A . 28 LYS HB2 1 1 1 468 1 1 28 LYS HB3 H 2.992 4.294 -7.644 1.00 . A A . 28 LYS HB3 1 1 1 469 1 1 28 LYS HD2 H 2.148 1.470 -8.740 1.00 . A A . 28 LYS HD2 1 1 1 470 1 1 28 LYS HD3 H 1.998 3.014 -9.571 1.00 . A A . 28 LYS HD3 1 1 1 471 1 1 28 LYS HE2 H 2.048 1.101 -11.118 1.00 . A A . 28 LYS HE2 1 1 1 472 1 1 28 LYS HE3 H 3.379 2.219 -11.387 1.00 . A A . 28 LYS HE3 1 1 1 473 1 1 28 LYS HG2 H 4.411 3.374 -9.327 1.00 . A A . 28 LYS HG2 1 1 1 474 1 1 28 LYS HG3 H 4.536 1.844 -8.454 1.00 . A A . 28 LYS HG3 1 1 1 475 1 1 28 LYS HZ1 H 4.867 0.703 -10.289 1.00 . A A . 28 LYS HZ1 1 1 1 476 1 1 28 LYS HZ2 H 4.020 -0.120 -11.483 1.00 . A A . 28 LYS HZ2 1 1 1 477 1 1 28 LYS HZ3 H 3.588 -0.335 -9.879 1.00 . A A . 28 LYS HZ3 1 1 1 478 1 1 28 LYS N N 4.225 4.299 -5.257 1.00 . A A . 28 LYS N 1 1 1 479 1 1 28 LYS NZ N 3.917 0.368 -10.567 1.00 . A A . 28 LYS NZ 1 1 1 480 1 1 28 LYS O O 5.278 5.707 -7.762 1.00 . A A . 28 LYS O 1 1 1 481 1 1 29 LEU C C 8.294 4.730 -8.890 1.00 . A A . 29 LEU C 1 1 1 482 1 1 29 LEU CA C 8.003 5.236 -7.487 1.00 . A A . 29 LEU CA 1 1 1 483 1 1 29 LEU CB C 9.238 5.101 -6.585 1.00 . A A . 29 LEU CB 1 1 1 484 1 1 29 LEU CD1 C 10.153 7.430 -6.809 1.00 . A A . 29 LEU CD1 1 1 1 485 1 1 29 LEU CD2 C 11.628 5.572 -6.037 1.00 . A A . 29 LEU CD2 1 1 1 486 1 1 29 LEU CG C 10.463 5.946 -6.934 1.00 . A A . 29 LEU CG 1 1 1 487 1 1 29 LEU H H 7.144 3.680 -6.362 1.00 . A A . 29 LEU H 1 1 1 488 1 1 29 LEU HA H 7.696 6.269 -7.532 1.00 . A A . 29 LEU HA 1 1 1 489 1 1 29 LEU HB2 H 8.939 5.363 -5.581 1.00 . A A . 29 LEU HB2 1 1 1 490 1 1 29 LEU HB3 H 9.534 4.063 -6.586 1.00 . A A . 29 LEU HB3 1 1 1 491 1 1 29 LEU HD11 H 9.354 7.685 -7.491 1.00 . A A . 29 LEU HD11 1 1 1 492 1 1 29 LEU HD12 H 11.033 8.005 -7.054 1.00 . A A . 29 LEU HD12 1 1 1 493 1 1 29 LEU HD13 H 9.846 7.651 -5.797 1.00 . A A . 29 LEU HD13 1 1 1 494 1 1 29 LEU HD21 H 11.879 4.531 -6.185 1.00 . A A . 29 LEU HD21 1 1 1 495 1 1 29 LEU HD22 H 11.352 5.732 -5.007 1.00 . A A . 29 LEU HD22 1 1 1 496 1 1 29 LEU HD23 H 12.484 6.185 -6.280 1.00 . A A . 29 LEU HD23 1 1 1 497 1 1 29 LEU HG H 10.747 5.749 -7.958 1.00 . A A . 29 LEU HG 1 1 1 498 1 1 29 LEU N N 6.927 4.448 -6.934 1.00 . A A . 29 LEU N 1 1 1 499 1 1 29 LEU O O 8.741 5.477 -9.767 1.00 . A A . 29 LEU O 1 1 1 500 1 1 30 TRP C C 6.833 2.254 -10.753 1.00 . A A . 30 TRP C 1 1 1 501 1 1 30 TRP CA C 8.171 2.823 -10.358 1.00 . A A . 30 TRP CA 1 1 1 502 1 1 30 TRP CB C 9.218 1.709 -10.251 1.00 . A A . 30 TRP CB 1 1 1 503 1 1 30 TRP CD1 C 10.756 1.539 -12.286 1.00 . A A . 30 TRP CD1 1 1 1 504 1 1 30 TRP CD2 C 9.066 0.076 -12.326 1.00 . A A . 30 TRP CD2 1 1 1 505 1 1 30 TRP CE2 C 9.850 -0.115 -13.477 1.00 . A A . 30 TRP CE2 1 1 1 506 1 1 30 TRP CE3 C 7.946 -0.731 -12.138 1.00 . A A . 30 TRP CE3 1 1 1 507 1 1 30 TRP CG C 9.671 1.142 -11.570 1.00 . A A . 30 TRP CG 1 1 1 508 1 1 30 TRP CH2 C 8.440 -1.853 -14.217 1.00 . A A . 30 TRP CH2 1 1 1 509 1 1 30 TRP CZ2 C 9.545 -1.079 -14.431 1.00 . A A . 30 TRP CZ2 1 1 1 510 1 1 30 TRP CZ3 C 7.642 -1.686 -13.086 1.00 . A A . 30 TRP CZ3 1 1 1 511 1 1 30 TRP H H 7.605 2.946 -8.368 1.00 . A A . 30 TRP H 1 1 1 512 1 1 30 TRP HA H 8.486 3.559 -11.083 1.00 . A A . 30 TRP HA 1 1 1 513 1 1 30 TRP HB2 H 10.092 2.101 -9.754 1.00 . A A . 30 TRP HB2 1 1 1 514 1 1 30 TRP HB3 H 8.810 0.902 -9.661 1.00 . A A . 30 TRP HB3 1 1 1 515 1 1 30 TRP HD1 H 11.424 2.331 -11.978 1.00 . A A . 30 TRP HD1 1 1 1 516 1 1 30 TRP HE1 H 11.584 0.873 -14.107 1.00 . A A . 30 TRP HE1 1 1 1 517 1 1 30 TRP HE3 H 7.319 -0.607 -11.266 1.00 . A A . 30 TRP HE3 1 1 1 518 1 1 30 TRP HH2 H 8.164 -2.613 -14.933 1.00 . A A . 30 TRP HH2 1 1 1 519 1 1 30 TRP HZ2 H 10.152 -1.224 -15.314 1.00 . A A . 30 TRP HZ2 1 1 1 520 1 1 30 TRP HZ3 H 6.778 -2.321 -12.955 1.00 . A A . 30 TRP HZ3 1 1 1 521 1 1 30 TRP N N 7.993 3.472 -9.098 1.00 . A A . 30 TRP N 1 1 1 522 1 1 30 TRP NE1 N 10.877 0.784 -13.427 1.00 . A A . 30 TRP NE1 1 1 1 523 1 1 30 TRP O O 6.402 1.260 -10.141 1.00 . A A . 30 TRP O 1 1 1 524 1 1 30 TRP OXT O 6.183 2.806 -11.660 1.00 . A A . 30 TRP OXT 1 1 2 525 1 1 1 TYR C C -10.184 -0.141 2.192 1.00 . A A . 1 TYR C 1 1 2 526 1 1 1 TYR CA C -11.033 -0.494 3.392 1.00 . A A . 1 TYR CA 1 1 2 527 1 1 1 TYR CB C -10.271 -1.570 4.194 1.00 . A A . 1 TYR CB 1 1 2 528 1 1 1 TYR CD1 C -11.944 -2.962 5.496 1.00 . A A . 1 TYR CD1 1 1 2 529 1 1 1 TYR CD2 C -10.374 -1.654 6.706 1.00 . A A . 1 TYR CD2 1 1 2 530 1 1 1 TYR CE1 C -12.457 -3.442 6.674 1.00 . A A . 1 TYR CE1 1 1 2 531 1 1 1 TYR CE2 C -10.891 -2.122 7.888 1.00 . A A . 1 TYR CE2 1 1 2 532 1 1 1 TYR CG C -10.890 -2.055 5.489 1.00 . A A . 1 TYR CG 1 1 2 533 1 1 1 TYR CZ C -11.930 -3.017 7.867 1.00 . A A . 1 TYR CZ 1 1 2 534 1 1 1 TYR H1 H -12.940 -1.247 3.717 1.00 . A A . 1 TYR H1 1 1 2 535 1 1 1 TYR H2 H -12.183 -1.824 2.317 1.00 . A A . 1 TYR H2 1 1 2 536 1 1 1 TYR H3 H -12.778 -0.259 2.359 1.00 . A A . 1 TYR H3 1 1 2 537 1 1 1 TYR HA H -11.186 0.376 4.013 1.00 . A A . 1 TYR HA 1 1 2 538 1 1 1 TYR HB2 H -10.154 -2.444 3.573 1.00 . A A . 1 TYR HB2 1 1 2 539 1 1 1 TYR HB3 H -9.286 -1.185 4.421 1.00 . A A . 1 TYR HB3 1 1 2 540 1 1 1 TYR HD1 H -12.374 -3.298 4.564 1.00 . A A . 1 TYR HD1 1 1 2 541 1 1 1 TYR HD2 H -9.556 -0.947 6.724 1.00 . A A . 1 TYR HD2 1 1 2 542 1 1 1 TYR HE1 H -13.278 -4.147 6.653 1.00 . A A . 1 TYR HE1 1 1 2 543 1 1 1 TYR HE2 H -10.470 -1.783 8.825 1.00 . A A . 1 TYR HE2 1 1 2 544 1 1 1 TYR HH H -12.398 -2.825 9.715 1.00 . A A . 1 TYR HH 1 1 2 545 1 1 1 TYR N N -12.318 -0.993 2.928 1.00 . A A . 1 TYR N 1 1 2 546 1 1 1 TYR O O -10.437 -0.620 1.075 1.00 . A A . 1 TYR O 1 1 2 547 1 1 1 TYR OH O -12.424 -3.513 9.038 1.00 . A A . 1 TYR OH 1 1 2 548 1 1 2 CYS C C -7.015 1.345 2.270 1.00 . A A . 2 CYS C 1 1 2 549 1 1 2 CYS CA C -8.199 0.994 1.453 1.00 . A A . 2 CYS CA 1 1 2 550 1 1 2 CYS CB C -8.566 2.164 0.560 1.00 . A A . 2 CYS CB 1 1 2 551 1 1 2 CYS H H -9.134 1.150 3.277 1.00 . A A . 2 CYS H 1 1 2 552 1 1 2 CYS HA H -7.990 0.108 0.872 1.00 . A A . 2 CYS HA 1 1 2 553 1 1 2 CYS HB2 H -9.579 2.056 0.210 1.00 . A A . 2 CYS HB2 1 1 2 554 1 1 2 CYS HB3 H -8.453 3.036 1.182 1.00 . A A . 2 CYS HB3 1 1 2 555 1 1 2 CYS N N -9.211 0.689 2.413 1.00 . A A . 2 CYS N 1 1 2 556 1 1 2 CYS O O -7.126 2.121 3.235 1.00 . A A . 2 CYS O 1 1 2 557 1 1 2 CYS SG S -7.469 2.391 -0.894 1.00 . A A . 2 CYS SG 1 1 2 558 1 1 3 GLN C C -3.999 2.196 2.421 1.00 . A A . 3 GLN C 1 1 2 559 1 1 3 GLN CA C -4.761 0.953 2.768 1.00 . A A . 3 GLN CA 1 1 2 560 1 1 3 GLN CB C -3.848 -0.272 2.764 1.00 . A A . 3 GLN CB 1 1 2 561 1 1 3 GLN CD C -5.138 -1.558 4.515 1.00 . A A . 3 GLN CD 1 1 2 562 1 1 3 GLN CG C -4.534 -1.575 3.130 1.00 . A A . 3 GLN CG 1 1 2 563 1 1 3 GLN H H -5.932 0.320 1.082 1.00 . A A . 3 GLN H 1 1 2 564 1 1 3 GLN HA H -5.157 1.079 3.762 1.00 . A A . 3 GLN HA 1 1 2 565 1 1 3 GLN HB2 H -3.352 -0.381 1.814 1.00 . A A . 3 GLN HB2 1 1 2 566 1 1 3 GLN HB3 H -3.082 -0.095 3.505 1.00 . A A . 3 GLN HB3 1 1 2 567 1 1 3 GLN HE21 H -3.426 -2.179 5.301 1.00 . A A . 3 GLN HE21 1 1 2 568 1 1 3 GLN HE22 H -4.738 -1.949 6.398 1.00 . A A . 3 GLN HE22 1 1 2 569 1 1 3 GLN HG2 H -5.324 -1.764 2.418 1.00 . A A . 3 GLN HG2 1 1 2 570 1 1 3 GLN HG3 H -3.810 -2.375 3.081 1.00 . A A . 3 GLN HG3 1 1 2 571 1 1 3 GLN N N -5.921 0.796 1.938 1.00 . A A . 3 GLN N 1 1 2 572 1 1 3 GLN NE2 N -4.357 -1.923 5.495 1.00 . A A . 3 GLN NE2 1 1 2 573 1 1 3 GLN O O -3.732 2.472 1.254 1.00 . A A . 3 GLN O 1 1 2 574 1 1 3 GLN OE1 O -6.291 -1.205 4.701 1.00 . A A . 3 GLN OE1 1 1 2 575 1 1 4 LYS C C -1.469 3.868 3.396 1.00 . A A . 4 LYS C 1 1 2 576 1 1 4 LYS CA C -2.948 4.170 3.310 1.00 . A A . 4 LYS CA 1 1 2 577 1 1 4 LYS CB C -3.332 5.123 4.442 1.00 . A A . 4 LYS CB 1 1 2 578 1 1 4 LYS CD C -5.263 6.313 3.300 1.00 . A A . 4 LYS CD 1 1 2 579 1 1 4 LYS CE C -4.639 7.703 3.299 1.00 . A A . 4 LYS CE 1 1 2 580 1 1 4 LYS CG C -4.808 5.477 4.493 1.00 . A A . 4 LYS CG 1 1 2 581 1 1 4 LYS H H -3.969 2.654 4.329 1.00 . A A . 4 LYS H 1 1 2 582 1 1 4 LYS HA H -3.179 4.634 2.363 1.00 . A A . 4 LYS HA 1 1 2 583 1 1 4 LYS HB2 H -3.072 4.647 5.376 1.00 . A A . 4 LYS HB2 1 1 2 584 1 1 4 LYS HB3 H -2.756 6.030 4.338 1.00 . A A . 4 LYS HB3 1 1 2 585 1 1 4 LYS HD2 H -4.991 5.809 2.387 1.00 . A A . 4 LYS HD2 1 1 2 586 1 1 4 LYS HD3 H -6.337 6.415 3.343 1.00 . A A . 4 LYS HD3 1 1 2 587 1 1 4 LYS HE2 H -3.566 7.597 3.293 1.00 . A A . 4 LYS HE2 1 1 2 588 1 1 4 LYS HE3 H -4.949 8.223 2.406 1.00 . A A . 4 LYS HE3 1 1 2 589 1 1 4 LYS HG2 H -5.339 4.538 4.463 1.00 . A A . 4 LYS HG2 1 1 2 590 1 1 4 LYS HG3 H -5.027 5.996 5.416 1.00 . A A . 4 LYS HG3 1 1 2 591 1 1 4 LYS HZ1 H -4.611 9.451 4.457 1.00 . A A . 4 LYS HZ1 1 1 2 592 1 1 4 LYS HZ2 H -4.679 8.046 5.356 1.00 . A A . 4 LYS HZ2 1 1 2 593 1 1 4 LYS HZ3 H -6.060 8.581 4.568 1.00 . A A . 4 LYS HZ3 1 1 2 594 1 1 4 LYS N N -3.688 2.948 3.439 1.00 . A A . 4 LYS N 1 1 2 595 1 1 4 LYS NZ N -5.027 8.499 4.487 1.00 . A A . 4 LYS NZ 1 1 2 596 1 1 4 LYS O O -1.075 2.776 3.817 1.00 . A A . 4 LYS O 1 1 2 597 1 1 5 TRP C C 1.338 4.561 4.518 1.00 . A A . 5 TRP C 1 1 2 598 1 1 5 TRP CA C 0.812 4.679 3.092 1.00 . A A . 5 TRP CA 1 1 2 599 1 1 5 TRP CB C 1.533 5.839 2.364 1.00 . A A . 5 TRP CB 1 1 2 600 1 1 5 TRP CD1 C 0.679 8.010 3.463 1.00 . A A . 5 TRP CD1 1 1 2 601 1 1 5 TRP CD2 C 2.864 7.638 3.755 1.00 . A A . 5 TRP CD2 1 1 2 602 1 1 5 TRP CE2 C 2.530 8.839 4.395 1.00 . A A . 5 TRP CE2 1 1 2 603 1 1 5 TRP CE3 C 4.189 7.199 3.805 1.00 . A A . 5 TRP CE3 1 1 2 604 1 1 5 TRP CG C 1.660 7.117 3.163 1.00 . A A . 5 TRP CG 1 1 2 605 1 1 5 TRP CH2 C 4.754 9.149 5.107 1.00 . A A . 5 TRP CH2 1 1 2 606 1 1 5 TRP CZ2 C 3.471 9.605 5.076 1.00 . A A . 5 TRP CZ2 1 1 2 607 1 1 5 TRP CZ3 C 5.118 7.961 4.480 1.00 . A A . 5 TRP CZ3 1 1 2 608 1 1 5 TRP H H -1.056 5.722 2.875 1.00 . A A . 5 TRP H 1 1 2 609 1 1 5 TRP HA H 1.019 3.753 2.576 1.00 . A A . 5 TRP HA 1 1 2 610 1 1 5 TRP HB2 H 2.532 5.519 2.110 1.00 . A A . 5 TRP HB2 1 1 2 611 1 1 5 TRP HB3 H 0.995 6.062 1.455 1.00 . A A . 5 TRP HB3 1 1 2 612 1 1 5 TRP HD1 H -0.353 7.905 3.165 1.00 . A A . 5 TRP HD1 1 1 2 613 1 1 5 TRP HE1 H 0.678 9.812 4.548 1.00 . A A . 5 TRP HE1 1 1 2 614 1 1 5 TRP HE3 H 4.491 6.281 3.323 1.00 . A A . 5 TRP HE3 1 1 2 615 1 1 5 TRP HH2 H 5.514 9.716 5.626 1.00 . A A . 5 TRP HH2 1 1 2 616 1 1 5 TRP HZ2 H 3.219 10.531 5.570 1.00 . A A . 5 TRP HZ2 1 1 2 617 1 1 5 TRP HZ3 H 6.147 7.637 4.533 1.00 . A A . 5 TRP HZ3 1 1 2 618 1 1 5 TRP N N -0.651 4.859 3.101 1.00 . A A . 5 TRP N 1 1 2 619 1 1 5 TRP NE1 N 1.193 9.045 4.208 1.00 . A A . 5 TRP NE1 1 1 2 620 1 1 5 TRP O O 2.491 4.212 4.746 1.00 . A A . 5 TRP O 1 1 2 621 1 1 6 MET C C 0.549 3.384 7.391 1.00 . A A . 6 MET C 1 1 2 622 1 1 6 MET CA C 0.839 4.790 6.861 1.00 . A A . 6 MET CA 1 1 2 623 1 1 6 MET CB C 0.068 5.835 7.682 1.00 . A A . 6 MET CB 1 1 2 624 1 1 6 MET CE C -1.678 6.630 10.248 1.00 . A A . 6 MET CE 1 1 2 625 1 1 6 MET CG C -1.441 5.635 7.672 1.00 . A A . 6 MET CG 1 1 2 626 1 1 6 MET H H -0.404 5.178 5.195 1.00 . A A . 6 MET H 1 1 2 627 1 1 6 MET HA H 1.895 5.001 6.925 1.00 . A A . 6 MET HA 1 1 2 628 1 1 6 MET HB2 H 0.409 5.785 8.704 1.00 . A A . 6 MET HB2 1 1 2 629 1 1 6 MET HB3 H 0.284 6.817 7.288 1.00 . A A . 6 MET HB3 1 1 2 630 1 1 6 MET HE1 H -0.623 6.858 10.236 1.00 . A A . 6 MET HE1 1 1 2 631 1 1 6 MET HE2 H -1.818 5.600 10.540 1.00 . A A . 6 MET HE2 1 1 2 632 1 1 6 MET HE3 H -2.181 7.279 10.950 1.00 . A A . 6 MET HE3 1 1 2 633 1 1 6 MET HG2 H -1.779 5.667 6.647 1.00 . A A . 6 MET HG2 1 1 2 634 1 1 6 MET HG3 H -1.660 4.660 8.083 1.00 . A A . 6 MET HG3 1 1 2 635 1 1 6 MET N N 0.487 4.874 5.464 1.00 . A A . 6 MET N 1 1 2 636 1 1 6 MET O O 0.868 3.059 8.529 1.00 . A A . 6 MET O 1 1 2 637 1 1 6 MET SD S -2.348 6.880 8.608 1.00 . A A . 6 MET SD 1 1 2 638 1 1 7 TRP C C 0.330 0.203 6.096 1.00 . A A . 7 TRP C 1 1 2 639 1 1 7 TRP CA C -0.416 1.203 6.955 1.00 . A A . 7 TRP CA 1 1 2 640 1 1 7 TRP CB C -1.930 0.942 6.826 1.00 . A A . 7 TRP CB 1 1 2 641 1 1 7 TRP CD1 C -2.512 2.517 8.766 1.00 . A A . 7 TRP CD1 1 1 2 642 1 1 7 TRP CD2 C -4.166 2.176 7.320 1.00 . A A . 7 TRP CD2 1 1 2 643 1 1 7 TRP CE2 C -4.617 3.067 8.301 1.00 . A A . 7 TRP CE2 1 1 2 644 1 1 7 TRP CE3 C -5.030 1.800 6.310 1.00 . A A . 7 TRP CE3 1 1 2 645 1 1 7 TRP CG C -2.813 1.859 7.616 1.00 . A A . 7 TRP CG 1 1 2 646 1 1 7 TRP CH2 C -6.732 3.198 7.279 1.00 . A A . 7 TRP CH2 1 1 2 647 1 1 7 TRP CZ2 C -5.903 3.589 8.291 1.00 . A A . 7 TRP CZ2 1 1 2 648 1 1 7 TRP CZ3 C -6.305 2.310 6.296 1.00 . A A . 7 TRP CZ3 1 1 2 649 1 1 7 TRP H H -0.266 2.831 5.642 1.00 . A A . 7 TRP H 1 1 2 650 1 1 7 TRP HA H -0.123 1.067 7.986 1.00 . A A . 7 TRP HA 1 1 2 651 1 1 7 TRP HB2 H -2.211 1.047 5.788 1.00 . A A . 7 TRP HB2 1 1 2 652 1 1 7 TRP HB3 H -2.138 -0.072 7.135 1.00 . A A . 7 TRP HB3 1 1 2 653 1 1 7 TRP HD1 H -1.549 2.471 9.257 1.00 . A A . 7 TRP HD1 1 1 2 654 1 1 7 TRP HE1 H -3.615 3.847 9.963 1.00 . A A . 7 TRP HE1 1 1 2 655 1 1 7 TRP HE3 H -4.703 1.103 5.555 1.00 . A A . 7 TRP HE3 1 1 2 656 1 1 7 TRP HH2 H -7.743 3.574 7.228 1.00 . A A . 7 TRP HH2 1 1 2 657 1 1 7 TRP HZ2 H -6.254 4.281 9.043 1.00 . A A . 7 TRP HZ2 1 1 2 658 1 1 7 TRP HZ3 H -6.990 2.024 5.509 1.00 . A A . 7 TRP HZ3 1 1 2 659 1 1 7 TRP N N -0.063 2.554 6.561 1.00 . A A . 7 TRP N 1 1 2 660 1 1 7 TRP NE1 N -3.587 3.267 9.169 1.00 . A A . 7 TRP NE1 1 1 2 661 1 1 7 TRP O O 1.192 0.570 5.282 1.00 . A A . 7 TRP O 1 1 2 662 1 1 8 THR C C -0.506 -2.891 4.844 1.00 . A A . 8 THR C 1 1 2 663 1 1 8 THR CA C 0.614 -2.123 5.555 1.00 . A A . 8 THR CA 1 1 2 664 1 1 8 THR CB C 1.327 -3.058 6.566 1.00 . A A . 8 THR CB 1 1 2 665 1 1 8 THR CG2 C 2.447 -2.329 7.300 1.00 . A A . 8 THR CG2 1 1 2 666 1 1 8 THR H H -0.677 -1.285 6.935 1.00 . A A . 8 THR H 1 1 2 667 1 1 8 THR HA H 1.332 -1.718 4.857 1.00 . A A . 8 THR HA 1 1 2 668 1 1 8 THR HB H 1.740 -3.901 6.033 1.00 . A A . 8 THR HB 1 1 2 669 1 1 8 THR HG1 H 0.314 -4.489 7.434 1.00 . A A . 8 THR HG1 1 1 2 670 1 1 8 THR HG21 H 2.929 -3.010 7.984 1.00 . A A . 8 THR HG21 1 1 2 671 1 1 8 THR HG22 H 2.026 -1.502 7.853 1.00 . A A . 8 THR HG22 1 1 2 672 1 1 8 THR HG23 H 3.169 -1.953 6.592 1.00 . A A . 8 THR HG23 1 1 2 673 1 1 8 THR N N 0.010 -1.042 6.276 1.00 . A A . 8 THR N 1 1 2 674 1 1 8 THR O O -1.683 -2.731 5.226 1.00 . A A . 8 THR O 1 1 2 675 1 1 8 THR OG1 O 0.376 -3.531 7.539 1.00 . A A . 8 THR OG1 1 1 2 676 1 1 9 CYS C C -1.056 -5.932 3.328 1.00 . A A . 9 CYS C 1 1 2 677 1 1 9 CYS CA C -1.305 -4.455 3.264 1.00 . A A . 9 CYS CA 1 1 2 678 1 1 9 CYS CB C -1.722 -3.980 1.852 1.00 . A A . 9 CYS CB 1 1 2 679 1 1 9 CYS H H 0.683 -3.843 3.455 1.00 . A A . 9 CYS H 1 1 2 680 1 1 9 CYS HA H -2.137 -4.273 3.934 1.00 . A A . 9 CYS HA 1 1 2 681 1 1 9 CYS HB2 H -2.410 -4.707 1.447 1.00 . A A . 9 CYS HB2 1 1 2 682 1 1 9 CYS HB3 H -2.235 -3.031 1.901 1.00 . A A . 9 CYS HB3 1 1 2 683 1 1 9 CYS N N -0.220 -3.698 3.833 1.00 . A A . 9 CYS N 1 1 2 684 1 1 9 CYS O O 0.073 -6.403 3.198 1.00 . A A . 9 CYS O 1 1 2 685 1 1 9 CYS SG S -0.379 -3.827 0.649 1.00 . A A . 9 CYS SG 1 1 2 686 1 1 10 ASP C C -2.559 -8.563 2.305 1.00 . A A . 10 ASP C 1 1 2 687 1 1 10 ASP CA C -2.087 -8.079 3.660 1.00 . A A . 10 ASP CA 1 1 2 688 1 1 10 ASP CB C -3.015 -8.582 4.783 1.00 . A A . 10 ASP CB 1 1 2 689 1 1 10 ASP CG C -2.600 -8.085 6.163 1.00 . A A . 10 ASP CG 1 1 2 690 1 1 10 ASP H H -2.929 -6.192 3.863 1.00 . A A . 10 ASP H 1 1 2 691 1 1 10 ASP HA H -1.075 -8.416 3.838 1.00 . A A . 10 ASP HA 1 1 2 692 1 1 10 ASP HB2 H -4.022 -8.246 4.588 1.00 . A A . 10 ASP HB2 1 1 2 693 1 1 10 ASP HB3 H -3.000 -9.661 4.791 1.00 . A A . 10 ASP HB3 1 1 2 694 1 1 10 ASP N N -2.096 -6.643 3.624 1.00 . A A . 10 ASP N 1 1 2 695 1 1 10 ASP O O -2.731 -7.741 1.392 1.00 . A A . 10 ASP O 1 1 2 696 1 1 10 ASP OD1 O -2.003 -8.854 6.934 1.00 . A A . 10 ASP OD1 1 1 2 697 1 1 10 ASP OD2 O -2.835 -6.899 6.491 1.00 . A A . 10 ASP OD2 1 1 2 698 1 1 11 SER C C -4.533 -9.853 0.403 1.00 . A A . 11 SER C 1 1 2 699 1 1 11 SER CA C -3.182 -10.406 0.888 1.00 . A A . 11 SER CA 1 1 2 700 1 1 11 SER CB C -3.243 -11.915 1.017 1.00 . A A . 11 SER CB 1 1 2 701 1 1 11 SER H H -2.748 -10.443 2.936 1.00 . A A . 11 SER H 1 1 2 702 1 1 11 SER HA H -2.417 -10.151 0.171 1.00 . A A . 11 SER HA 1 1 2 703 1 1 11 SER HB2 H -4.121 -12.201 1.576 1.00 . A A . 11 SER HB2 1 1 2 704 1 1 11 SER HB3 H -3.292 -12.350 0.030 1.00 . A A . 11 SER HB3 1 1 2 705 1 1 11 SER HG H -2.401 -13.106 2.266 1.00 . A A . 11 SER HG 1 1 2 706 1 1 11 SER N N -2.810 -9.838 2.168 1.00 . A A . 11 SER N 1 1 2 707 1 1 11 SER O O -4.670 -9.427 -0.755 1.00 . A A . 11 SER O 1 1 2 708 1 1 11 SER OG O -2.079 -12.414 1.675 1.00 . A A . 11 SER OG 1 1 2 709 1 1 12 GLU C C -6.977 -7.831 1.179 1.00 . A A . 12 GLU C 1 1 2 710 1 1 12 GLU CA C -6.827 -9.316 0.930 1.00 . A A . 12 GLU CA 1 1 2 711 1 1 12 GLU CB C -7.913 -10.094 1.652 1.00 . A A . 12 GLU CB 1 1 2 712 1 1 12 GLU CD C -8.297 -11.718 -0.199 1.00 . A A . 12 GLU CD 1 1 2 713 1 1 12 GLU CG C -7.984 -11.547 1.260 1.00 . A A . 12 GLU CG 1 1 2 714 1 1 12 GLU H H -5.344 -10.106 2.214 1.00 . A A . 12 GLU H 1 1 2 715 1 1 12 GLU HA H -6.939 -9.485 -0.132 1.00 . A A . 12 GLU HA 1 1 2 716 1 1 12 GLU HB2 H -7.721 -10.046 2.712 1.00 . A A . 12 GLU HB2 1 1 2 717 1 1 12 GLU HB3 H -8.870 -9.637 1.444 1.00 . A A . 12 GLU HB3 1 1 2 718 1 1 12 GLU HG2 H -7.018 -11.987 1.459 1.00 . A A . 12 GLU HG2 1 1 2 719 1 1 12 GLU HG3 H -8.741 -12.040 1.849 1.00 . A A . 12 GLU HG3 1 1 2 720 1 1 12 GLU N N -5.507 -9.798 1.295 1.00 . A A . 12 GLU N 1 1 2 721 1 1 12 GLU O O -8.030 -7.250 0.911 1.00 . A A . 12 GLU O 1 1 2 722 1 1 12 GLU OE1 O -9.471 -11.517 -0.601 1.00 . A A . 12 GLU OE1 1 1 2 723 1 1 12 GLU OE2 O -7.391 -12.060 -0.979 1.00 . A A . 12 GLU OE2 1 1 2 724 1 1 13 ARG C C -5.609 -5.078 0.647 1.00 . A A . 13 ARG C 1 1 2 725 1 1 13 ARG CA C -6.009 -5.785 1.900 1.00 . A A . 13 ARG CA 1 1 2 726 1 1 13 ARG CB C -5.166 -5.284 3.062 1.00 . A A . 13 ARG CB 1 1 2 727 1 1 13 ARG CD C -7.085 -5.362 4.719 1.00 . A A . 13 ARG CD 1 1 2 728 1 1 13 ARG CG C -5.618 -5.688 4.460 1.00 . A A . 13 ARG CG 1 1 2 729 1 1 13 ARG CZ C -9.276 -6.395 4.132 1.00 . A A . 13 ARG CZ 1 1 2 730 1 1 13 ARG H H -5.141 -7.728 1.896 1.00 . A A . 13 ARG H 1 1 2 731 1 1 13 ARG HA H -7.046 -5.550 2.091 1.00 . A A . 13 ARG HA 1 1 2 732 1 1 13 ARG HB2 H -4.171 -5.671 2.916 1.00 . A A . 13 ARG HB2 1 1 2 733 1 1 13 ARG HB3 H -5.126 -4.206 3.013 1.00 . A A . 13 ARG HB3 1 1 2 734 1 1 13 ARG HD2 H -7.225 -5.188 5.773 1.00 . A A . 13 ARG HD2 1 1 2 735 1 1 13 ARG HD3 H -7.347 -4.471 4.169 1.00 . A A . 13 ARG HD3 1 1 2 736 1 1 13 ARG HE H -7.484 -7.317 4.194 1.00 . A A . 13 ARG HE 1 1 2 737 1 1 13 ARG HG2 H -5.489 -6.753 4.560 1.00 . A A . 13 ARG HG2 1 1 2 738 1 1 13 ARG HG3 H -5.006 -5.171 5.183 1.00 . A A . 13 ARG HG3 1 1 2 739 1 1 13 ARG HH11 H -9.394 -4.375 4.331 1.00 . A A . 13 ARG HH11 1 1 2 740 1 1 13 ARG HH12 H -10.892 -5.164 4.065 1.00 . A A . 13 ARG HH12 1 1 2 741 1 1 13 ARG HH21 H -9.543 -8.421 3.867 1.00 . A A . 13 ARG HH21 1 1 2 742 1 1 13 ARG HH22 H -10.969 -7.507 3.784 1.00 . A A . 13 ARG HH22 1 1 2 743 1 1 13 ARG N N -5.949 -7.209 1.697 1.00 . A A . 13 ARG N 1 1 2 744 1 1 13 ARG NE N -7.957 -6.458 4.293 1.00 . A A . 13 ARG NE 1 1 2 745 1 1 13 ARG NH1 N -9.897 -5.226 4.179 1.00 . A A . 13 ARG NH1 1 1 2 746 1 1 13 ARG NH2 N -9.973 -7.514 3.911 1.00 . A A . 13 ARG NH2 1 1 2 747 1 1 13 ARG O O -4.484 -5.219 0.156 1.00 . A A . 13 ARG O 1 1 2 748 1 1 14 LYS C C -5.798 -2.229 -0.723 1.00 . A A . 14 LYS C 1 1 2 749 1 1 14 LYS CA C -6.305 -3.606 -1.072 1.00 . A A . 14 LYS CA 1 1 2 750 1 1 14 LYS CB C -7.590 -3.550 -1.899 1.00 . A A . 14 LYS CB 1 1 2 751 1 1 14 LYS CD C -9.429 -4.897 -3.042 1.00 . A A . 14 LYS CD 1 1 2 752 1 1 14 LYS CE C -9.311 -4.211 -4.394 1.00 . A A . 14 LYS CE 1 1 2 753 1 1 14 LYS CG C -8.103 -4.939 -2.291 1.00 . A A . 14 LYS CG 1 1 2 754 1 1 14 LYS H H -7.374 -4.291 0.599 1.00 . A A . 14 LYS H 1 1 2 755 1 1 14 LYS HA H -5.538 -4.115 -1.636 1.00 . A A . 14 LYS HA 1 1 2 756 1 1 14 LYS HB2 H -8.351 -3.051 -1.317 1.00 . A A . 14 LYS HB2 1 1 2 757 1 1 14 LYS HB3 H -7.406 -2.986 -2.800 1.00 . A A . 14 LYS HB3 1 1 2 758 1 1 14 LYS HD2 H -9.763 -5.911 -3.199 1.00 . A A . 14 LYS HD2 1 1 2 759 1 1 14 LYS HD3 H -10.156 -4.370 -2.440 1.00 . A A . 14 LYS HD3 1 1 2 760 1 1 14 LYS HE2 H -9.028 -3.181 -4.241 1.00 . A A . 14 LYS HE2 1 1 2 761 1 1 14 LYS HE3 H -8.551 -4.711 -4.974 1.00 . A A . 14 LYS HE3 1 1 2 762 1 1 14 LYS HG2 H -7.367 -5.410 -2.926 1.00 . A A . 14 LYS HG2 1 1 2 763 1 1 14 LYS HG3 H -8.222 -5.528 -1.395 1.00 . A A . 14 LYS HG3 1 1 2 764 1 1 14 LYS HZ1 H -10.871 -5.238 -5.306 1.00 . A A . 14 LYS HZ1 1 1 2 765 1 1 14 LYS HZ2 H -10.491 -3.787 -6.066 1.00 . A A . 14 LYS HZ2 1 1 2 766 1 1 14 LYS HZ3 H -11.351 -3.777 -4.609 1.00 . A A . 14 LYS HZ3 1 1 2 767 1 1 14 LYS N N -6.517 -4.346 0.128 1.00 . A A . 14 LYS N 1 1 2 768 1 1 14 LYS NZ N -10.592 -4.250 -5.139 1.00 . A A . 14 LYS NZ 1 1 2 769 1 1 14 LYS O O -6.510 -1.408 -0.122 1.00 . A A . 14 LYS O 1 1 2 770 1 1 15 CYS C C -4.316 0.240 -1.841 1.00 . A A . 15 CYS C 1 1 2 771 1 1 15 CYS CA C -3.901 -0.757 -0.770 1.00 . A A . 15 CYS CA 1 1 2 772 1 1 15 CYS CB C -2.381 -0.973 -0.731 1.00 . A A . 15 CYS CB 1 1 2 773 1 1 15 CYS H H -4.056 -2.722 -1.484 1.00 . A A . 15 CYS H 1 1 2 774 1 1 15 CYS HA H -4.249 -0.392 0.183 1.00 . A A . 15 CYS HA 1 1 2 775 1 1 15 CYS HB2 H -2.164 -1.835 -0.119 1.00 . A A . 15 CYS HB2 1 1 2 776 1 1 15 CYS HB3 H -2.034 -1.164 -1.736 1.00 . A A . 15 CYS HB3 1 1 2 777 1 1 15 CYS N N -4.557 -2.008 -1.040 1.00 . A A . 15 CYS N 1 1 2 778 1 1 15 CYS O O -4.673 -0.172 -2.962 1.00 . A A . 15 CYS O 1 1 2 779 1 1 15 CYS SG S -1.423 0.415 -0.067 1.00 . A A . 15 CYS SG 1 1 2 780 1 1 16 CYS C C -3.985 2.633 -3.719 1.00 . A A . 16 CYS C 1 1 2 781 1 1 16 CYS CA C -4.792 2.542 -2.420 1.00 . A A . 16 CYS CA 1 1 2 782 1 1 16 CYS CB C -4.912 3.882 -1.700 1.00 . A A . 16 CYS CB 1 1 2 783 1 1 16 CYS H H -3.955 1.799 -0.641 1.00 . A A . 16 CYS H 1 1 2 784 1 1 16 CYS HA H -5.786 2.226 -2.700 1.00 . A A . 16 CYS HA 1 1 2 785 1 1 16 CYS HB2 H -3.956 4.138 -1.266 1.00 . A A . 16 CYS HB2 1 1 2 786 1 1 16 CYS HB3 H -5.202 4.644 -2.408 1.00 . A A . 16 CYS HB3 1 1 2 787 1 1 16 CYS N N -4.309 1.510 -1.514 1.00 . A A . 16 CYS N 1 1 2 788 1 1 16 CYS O O -2.777 2.352 -3.753 1.00 . A A . 16 CYS O 1 1 2 789 1 1 16 CYS SG S -6.163 3.863 -0.349 1.00 . A A . 16 CYS SG 1 1 2 790 1 1 17 LYS C C -3.047 4.147 -6.195 1.00 . A A . 17 LYS C 1 1 2 791 1 1 17 LYS CA C -4.072 3.028 -6.105 1.00 . A A . 17 LYS CA 1 1 2 792 1 1 17 LYS CB C -5.149 3.150 -7.188 1.00 . A A . 17 LYS CB 1 1 2 793 1 1 17 LYS CD C -5.754 3.051 -9.609 1.00 . A A . 17 LYS CD 1 1 2 794 1 1 17 LYS CE C -5.247 2.868 -11.026 1.00 . A A . 17 LYS CE 1 1 2 795 1 1 17 LYS CG C -4.620 3.075 -8.612 1.00 . A A . 17 LYS CG 1 1 2 796 1 1 17 LYS H H -5.614 3.247 -4.701 1.00 . A A . 17 LYS H 1 1 2 797 1 1 17 LYS HA H -3.554 2.090 -6.238 1.00 . A A . 17 LYS HA 1 1 2 798 1 1 17 LYS HB2 H -5.863 2.351 -7.053 1.00 . A A . 17 LYS HB2 1 1 2 799 1 1 17 LYS HB3 H -5.661 4.094 -7.063 1.00 . A A . 17 LYS HB3 1 1 2 800 1 1 17 LYS HD2 H -6.415 2.235 -9.363 1.00 . A A . 17 LYS HD2 1 1 2 801 1 1 17 LYS HD3 H -6.297 3.983 -9.546 1.00 . A A . 17 LYS HD3 1 1 2 802 1 1 17 LYS HE2 H -4.703 3.752 -11.320 1.00 . A A . 17 LYS HE2 1 1 2 803 1 1 17 LYS HE3 H -4.586 2.014 -11.051 1.00 . A A . 17 LYS HE3 1 1 2 804 1 1 17 LYS HG2 H -3.997 3.936 -8.804 1.00 . A A . 17 LYS HG2 1 1 2 805 1 1 17 LYS HG3 H -4.037 2.174 -8.720 1.00 . A A . 17 LYS HG3 1 1 2 806 1 1 17 LYS HZ1 H -6.892 1.799 -11.703 1.00 . A A . 17 LYS HZ1 1 1 2 807 1 1 17 LYS HZ2 H -5.979 2.528 -12.934 1.00 . A A . 17 LYS HZ2 1 1 2 808 1 1 17 LYS HZ3 H -7.004 3.461 -11.966 1.00 . A A . 17 LYS HZ3 1 1 2 809 1 1 17 LYS N N -4.671 2.985 -4.794 1.00 . A A . 17 LYS N 1 1 2 810 1 1 17 LYS NZ N -6.355 2.648 -11.973 1.00 . A A . 17 LYS NZ 1 1 2 811 1 1 17 LYS O O -3.328 5.300 -5.863 1.00 . A A . 17 LYS O 1 1 2 812 1 1 18 GLY C C 0.284 4.302 -5.711 1.00 . A A . 18 GLY C 1 1 2 813 1 1 18 GLY CA C -0.776 4.730 -6.690 1.00 . A A . 18 GLY CA 1 1 2 814 1 1 18 GLY H H -1.746 2.877 -6.960 1.00 . A A . 18 GLY H 1 1 2 815 1 1 18 GLY HA2 H -0.364 4.749 -7.690 1.00 . A A . 18 GLY HA2 1 1 2 816 1 1 18 GLY HA3 H -1.125 5.715 -6.422 1.00 . A A . 18 GLY HA3 1 1 2 817 1 1 18 GLY N N -1.877 3.798 -6.646 1.00 . A A . 18 GLY N 1 1 2 818 1 1 18 GLY O O 1.446 4.714 -5.793 1.00 . A A . 18 GLY O 1 1 2 819 1 1 19 MET C C 1.088 1.457 -4.270 1.00 . A A . 19 MET C 1 1 2 820 1 1 19 MET CA C 0.774 2.860 -3.837 1.00 . A A . 19 MET CA 1 1 2 821 1 1 19 MET CB C 0.104 2.820 -2.456 1.00 . A A . 19 MET CB 1 1 2 822 1 1 19 MET CE C -1.469 5.858 -0.121 1.00 . A A . 19 MET CE 1 1 2 823 1 1 19 MET CG C -0.198 4.179 -1.883 1.00 . A A . 19 MET CG 1 1 2 824 1 1 19 MET H H -1.051 3.151 -4.797 1.00 . A A . 19 MET H 1 1 2 825 1 1 19 MET HA H 1.678 3.447 -3.783 1.00 . A A . 19 MET HA 1 1 2 826 1 1 19 MET HB2 H -0.826 2.276 -2.540 1.00 . A A . 19 MET HB2 1 1 2 827 1 1 19 MET HB3 H 0.754 2.296 -1.771 1.00 . A A . 19 MET HB3 1 1 2 828 1 1 19 MET HE1 H -2.035 6.241 -0.957 1.00 . A A . 19 MET HE1 1 1 2 829 1 1 19 MET HE2 H -0.528 6.384 -0.056 1.00 . A A . 19 MET HE2 1 1 2 830 1 1 19 MET HE3 H -2.029 6.001 0.791 1.00 . A A . 19 MET HE3 1 1 2 831 1 1 19 MET HG2 H 0.761 4.600 -1.625 1.00 . A A . 19 MET HG2 1 1 2 832 1 1 19 MET HG3 H -0.703 4.790 -2.617 1.00 . A A . 19 MET HG3 1 1 2 833 1 1 19 MET N N -0.112 3.435 -4.813 1.00 . A A . 19 MET N 1 1 2 834 1 1 19 MET O O 0.352 0.869 -5.078 1.00 . A A . 19 MET O 1 1 2 835 1 1 19 MET SD S -1.166 4.116 -0.369 1.00 . A A . 19 MET SD 1 1 2 836 1 1 20 VAL C C 2.206 -1.270 -2.886 1.00 . A A . 20 VAL C 1 1 2 837 1 1 20 VAL CA C 2.502 -0.427 -4.088 1.00 . A A . 20 VAL CA 1 1 2 838 1 1 20 VAL CB C 3.997 -0.569 -4.501 1.00 . A A . 20 VAL CB 1 1 2 839 1 1 20 VAL CG1 C 4.370 -2.035 -4.715 1.00 . A A . 20 VAL CG1 1 1 2 840 1 1 20 VAL CG2 C 4.262 0.211 -5.777 1.00 . A A . 20 VAL CG2 1 1 2 841 1 1 20 VAL H H 2.702 1.449 -3.161 1.00 . A A . 20 VAL H 1 1 2 842 1 1 20 VAL HA H 1.872 -0.748 -4.906 1.00 . A A . 20 VAL HA 1 1 2 843 1 1 20 VAL HB H 4.619 -0.161 -3.717 1.00 . A A . 20 VAL HB 1 1 2 844 1 1 20 VAL HG11 H 3.756 -2.451 -5.499 1.00 . A A . 20 VAL HG11 1 1 2 845 1 1 20 VAL HG12 H 4.204 -2.586 -3.799 1.00 . A A . 20 VAL HG12 1 1 2 846 1 1 20 VAL HG13 H 5.410 -2.108 -4.995 1.00 . A A . 20 VAL HG13 1 1 2 847 1 1 20 VAL HG21 H 5.312 0.157 -6.025 1.00 . A A . 20 VAL HG21 1 1 2 848 1 1 20 VAL HG22 H 3.962 1.238 -5.645 1.00 . A A . 20 VAL HG22 1 1 2 849 1 1 20 VAL HG23 H 3.684 -0.223 -6.579 1.00 . A A . 20 VAL HG23 1 1 2 850 1 1 20 VAL N N 2.144 0.921 -3.777 1.00 . A A . 20 VAL N 1 1 2 851 1 1 20 VAL O O 2.674 -0.975 -1.775 1.00 . A A . 20 VAL O 1 1 2 852 1 1 21 CYS C C 2.114 -4.112 -1.783 1.00 . A A . 21 CYS C 1 1 2 853 1 1 21 CYS CA C 0.988 -3.138 -2.038 1.00 . A A . 21 CYS CA 1 1 2 854 1 1 21 CYS CB C -0.311 -3.878 -2.392 1.00 . A A . 21 CYS CB 1 1 2 855 1 1 21 CYS H H 1.030 -2.408 -3.994 1.00 . A A . 21 CYS H 1 1 2 856 1 1 21 CYS HA H 0.829 -2.546 -1.149 1.00 . A A . 21 CYS HA 1 1 2 857 1 1 21 CYS HB2 H -1.045 -3.160 -2.731 1.00 . A A . 21 CYS HB2 1 1 2 858 1 1 21 CYS HB3 H -0.111 -4.579 -3.187 1.00 . A A . 21 CYS HB3 1 1 2 859 1 1 21 CYS N N 1.378 -2.259 -3.090 1.00 . A A . 21 CYS N 1 1 2 860 1 1 21 CYS O O 2.680 -4.695 -2.720 1.00 . A A . 21 CYS O 1 1 2 861 1 1 21 CYS SG S -1.055 -4.806 -1.000 1.00 . A A . 21 CYS SG 1 1 2 862 1 1 22 ARG C C 3.243 -5.355 1.349 1.00 . A A . 22 ARG C 1 1 2 863 1 1 22 ARG CA C 3.520 -5.087 -0.129 1.00 . A A . 22 ARG CA 1 1 2 864 1 1 22 ARG CB C 4.847 -4.299 -0.302 1.00 . A A . 22 ARG CB 1 1 2 865 1 1 22 ARG CD C 6.286 -5.768 -1.805 1.00 . A A . 22 ARG CD 1 1 2 866 1 1 22 ARG CG C 6.137 -5.114 -0.427 1.00 . A A . 22 ARG CG 1 1 2 867 1 1 22 ARG CZ C 5.245 -7.546 -3.190 1.00 . A A . 22 ARG CZ 1 1 2 868 1 1 22 ARG H H 1.966 -3.789 0.163 1.00 . A A . 22 ARG H 1 1 2 869 1 1 22 ARG HA H 3.534 -5.995 -0.709 1.00 . A A . 22 ARG HA 1 1 2 870 1 1 22 ARG HB2 H 4.764 -3.692 -1.192 1.00 . A A . 22 ARG HB2 1 1 2 871 1 1 22 ARG HB3 H 4.947 -3.635 0.545 1.00 . A A . 22 ARG HB3 1 1 2 872 1 1 22 ARG HD2 H 6.155 -5.001 -2.555 1.00 . A A . 22 ARG HD2 1 1 2 873 1 1 22 ARG HD3 H 7.279 -6.178 -1.893 1.00 . A A . 22 ARG HD3 1 1 2 874 1 1 22 ARG HE H 4.673 -7.016 -1.348 1.00 . A A . 22 ARG HE 1 1 2 875 1 1 22 ARG HG2 H 6.978 -4.454 -0.271 1.00 . A A . 22 ARG HG2 1 1 2 876 1 1 22 ARG HG3 H 6.149 -5.883 0.331 1.00 . A A . 22 ARG HG3 1 1 2 877 1 1 22 ARG HH11 H 6.826 -6.628 -4.115 1.00 . A A . 22 ARG HH11 1 1 2 878 1 1 22 ARG HH12 H 6.100 -7.871 -5.022 1.00 . A A . 22 ARG HH12 1 1 2 879 1 1 22 ARG HH21 H 3.647 -8.684 -2.589 1.00 . A A . 22 ARG HH21 1 1 2 880 1 1 22 ARG HH22 H 4.253 -9.073 -4.127 1.00 . A A . 22 ARG HH22 1 1 2 881 1 1 22 ARG N N 2.457 -4.254 -0.550 1.00 . A A . 22 ARG N 1 1 2 882 1 1 22 ARG NE N 5.305 -6.823 -2.075 1.00 . A A . 22 ARG NE 1 1 2 883 1 1 22 ARG NH1 N 6.112 -7.331 -4.177 1.00 . A A . 22 ARG NH1 1 1 2 884 1 1 22 ARG NH2 N 4.319 -8.492 -3.311 1.00 . A A . 22 ARG NH2 1 1 2 885 1 1 22 ARG O O 2.147 -4.969 1.861 1.00 . A A . 22 ARG O 1 1 2 886 1 1 23 LEU C C 3.801 -4.872 4.219 1.00 . A A . 23 LEU C 1 1 2 887 1 1 23 LEU CA C 4.129 -6.184 3.497 1.00 . A A . 23 LEU CA 1 1 2 888 1 1 23 LEU CB C 5.452 -6.764 4.023 1.00 . A A . 23 LEU CB 1 1 2 889 1 1 23 LEU CD1 C 7.225 -8.544 3.994 1.00 . A A . 23 LEU CD1 1 1 2 890 1 1 23 LEU CD2 C 4.832 -9.188 3.715 1.00 . A A . 23 LEU CD2 1 1 2 891 1 1 23 LEU CG C 5.880 -8.118 3.439 1.00 . A A . 23 LEU CG 1 1 2 892 1 1 23 LEU H H 4.957 -6.351 1.553 1.00 . A A . 23 LEU H 1 1 2 893 1 1 23 LEU HA H 3.333 -6.888 3.684 1.00 . A A . 23 LEU HA 1 1 2 894 1 1 23 LEU HB2 H 6.237 -6.051 3.817 1.00 . A A . 23 LEU HB2 1 1 2 895 1 1 23 LEU HB3 H 5.366 -6.875 5.093 1.00 . A A . 23 LEU HB3 1 1 2 896 1 1 23 LEU HD11 H 7.968 -7.799 3.749 1.00 . A A . 23 LEU HD11 1 1 2 897 1 1 23 LEU HD12 H 7.508 -9.490 3.560 1.00 . A A . 23 LEU HD12 1 1 2 898 1 1 23 LEU HD13 H 7.155 -8.645 5.066 1.00 . A A . 23 LEU HD13 1 1 2 899 1 1 23 LEU HD21 H 3.897 -8.911 3.248 1.00 . A A . 23 LEU HD21 1 1 2 900 1 1 23 LEU HD22 H 4.689 -9.283 4.780 1.00 . A A . 23 LEU HD22 1 1 2 901 1 1 23 LEU HD23 H 5.167 -10.131 3.311 1.00 . A A . 23 LEU HD23 1 1 2 902 1 1 23 LEU HG H 5.994 -8.021 2.371 1.00 . A A . 23 LEU HG 1 1 2 903 1 1 23 LEU N N 4.201 -5.967 2.044 1.00 . A A . 23 LEU N 1 1 2 904 1 1 23 LEU O O 3.265 -4.876 5.317 1.00 . A A . 23 LEU O 1 1 2 905 1 1 24 TRP C C 3.273 -1.699 2.758 1.00 . A A . 24 TRP C 1 1 2 906 1 1 24 TRP CA C 3.776 -2.454 4.003 1.00 . A A . 24 TRP CA 1 1 2 907 1 1 24 TRP CB C 4.996 -1.733 4.616 1.00 . A A . 24 TRP CB 1 1 2 908 1 1 24 TRP CD1 C 6.122 -0.009 3.127 1.00 . A A . 24 TRP CD1 1 1 2 909 1 1 24 TRP CD2 C 7.043 -2.035 2.970 1.00 . A A . 24 TRP CD2 1 1 2 910 1 1 24 TRP CE2 C 7.733 -1.162 2.107 1.00 . A A . 24 TRP CE2 1 1 2 911 1 1 24 TRP CE3 C 7.445 -3.369 3.038 1.00 . A A . 24 TRP CE3 1 1 2 912 1 1 24 TRP CG C 6.014 -1.265 3.615 1.00 . A A . 24 TRP CG 1 1 2 913 1 1 24 TRP CH2 C 9.171 -2.892 1.406 1.00 . A A . 24 TRP CH2 1 1 2 914 1 1 24 TRP CZ2 C 8.800 -1.579 1.319 1.00 . A A . 24 TRP CZ2 1 1 2 915 1 1 24 TRP CZ3 C 8.505 -3.785 2.257 1.00 . A A . 24 TRP CZ3 1 1 2 916 1 1 24 TRP H H 4.602 -3.837 2.715 1.00 . A A . 24 TRP H 1 1 2 917 1 1 24 TRP HA H 2.992 -2.561 4.735 1.00 . A A . 24 TRP HA 1 1 2 918 1 1 24 TRP HB2 H 4.657 -0.868 5.165 1.00 . A A . 24 TRP HB2 1 1 2 919 1 1 24 TRP HB3 H 5.486 -2.408 5.302 1.00 . A A . 24 TRP HB3 1 1 2 920 1 1 24 TRP HD1 H 5.464 0.793 3.436 1.00 . A A . 24 TRP HD1 1 1 2 921 1 1 24 TRP HE1 H 7.414 0.889 1.752 1.00 . A A . 24 TRP HE1 1 1 2 922 1 1 24 TRP HE3 H 6.942 -4.065 3.693 1.00 . A A . 24 TRP HE3 1 1 2 923 1 1 24 TRP HH2 H 9.994 -3.259 0.812 1.00 . A A . 24 TRP HH2 1 1 2 924 1 1 24 TRP HZ2 H 9.328 -0.909 0.656 1.00 . A A . 24 TRP HZ2 1 1 2 925 1 1 24 TRP HZ3 H 8.832 -4.814 2.292 1.00 . A A . 24 TRP HZ3 1 1 2 926 1 1 24 TRP N N 4.125 -3.765 3.568 1.00 . A A . 24 TRP N 1 1 2 927 1 1 24 TRP NE1 N 7.152 0.070 2.228 1.00 . A A . 24 TRP NE1 1 1 2 928 1 1 24 TRP O O 3.559 -2.128 1.642 1.00 . A A . 24 TRP O 1 1 2 929 1 1 25 CYS C C 3.177 1.182 1.464 1.00 . A A . 25 CYS C 1 1 2 930 1 1 25 CYS CA C 2.123 0.156 1.773 1.00 . A A . 25 CYS CA 1 1 2 931 1 1 25 CYS CB C 0.763 0.817 1.951 1.00 . A A . 25 CYS CB 1 1 2 932 1 1 25 CYS H H 2.214 -0.363 3.814 1.00 . A A . 25 CYS H 1 1 2 933 1 1 25 CYS HA H 2.077 -0.523 0.934 1.00 . A A . 25 CYS HA 1 1 2 934 1 1 25 CYS HB2 H 0.686 1.201 2.957 1.00 . A A . 25 CYS HB2 1 1 2 935 1 1 25 CYS HB3 H 0.677 1.636 1.253 1.00 . A A . 25 CYS HB3 1 1 2 936 1 1 25 CYS N N 2.516 -0.643 2.923 1.00 . A A . 25 CYS N 1 1 2 937 1 1 25 CYS O O 3.633 1.917 2.357 1.00 . A A . 25 CYS O 1 1 2 938 1 1 25 CYS SG S -0.645 -0.292 1.681 1.00 . A A . 25 CYS SG 1 1 2 939 1 1 26 LYS C C 4.002 3.128 -1.143 1.00 . A A . 26 LYS C 1 1 2 940 1 1 26 LYS CA C 4.611 2.109 -0.215 1.00 . A A . 26 LYS CA 1 1 2 941 1 1 26 LYS CB C 5.684 1.284 -0.941 1.00 . A A . 26 LYS CB 1 1 2 942 1 1 26 LYS CD C 7.864 1.196 -2.163 1.00 . A A . 26 LYS CD 1 1 2 943 1 1 26 LYS CE C 9.037 1.994 -2.711 1.00 . A A . 26 LYS CE 1 1 2 944 1 1 26 LYS CG C 6.859 2.089 -1.462 1.00 . A A . 26 LYS CG 1 1 2 945 1 1 26 LYS H H 3.116 0.681 -0.446 1.00 . A A . 26 LYS H 1 1 2 946 1 1 26 LYS HA H 5.053 2.597 0.640 1.00 . A A . 26 LYS HA 1 1 2 947 1 1 26 LYS HB2 H 6.067 0.540 -0.260 1.00 . A A . 26 LYS HB2 1 1 2 948 1 1 26 LYS HB3 H 5.220 0.782 -1.776 1.00 . A A . 26 LYS HB3 1 1 2 949 1 1 26 LYS HD2 H 8.238 0.468 -1.458 1.00 . A A . 26 LYS HD2 1 1 2 950 1 1 26 LYS HD3 H 7.373 0.686 -2.979 1.00 . A A . 26 LYS HD3 1 1 2 951 1 1 26 LYS HE2 H 9.698 1.326 -3.243 1.00 . A A . 26 LYS HE2 1 1 2 952 1 1 26 LYS HE3 H 8.653 2.732 -3.398 1.00 . A A . 26 LYS HE3 1 1 2 953 1 1 26 LYS HG2 H 6.497 2.829 -2.161 1.00 . A A . 26 LYS HG2 1 1 2 954 1 1 26 LYS HG3 H 7.342 2.580 -0.632 1.00 . A A . 26 LYS HG3 1 1 2 955 1 1 26 LYS HZ1 H 9.213 3.373 -1.133 1.00 . A A . 26 LYS HZ1 1 1 2 956 1 1 26 LYS HZ2 H 10.625 3.185 -2.021 1.00 . A A . 26 LYS HZ2 1 1 2 957 1 1 26 LYS HZ3 H 10.149 1.995 -0.947 1.00 . A A . 26 LYS HZ3 1 1 2 958 1 1 26 LYS N N 3.571 1.234 0.228 1.00 . A A . 26 LYS N 1 1 2 959 1 1 26 LYS NZ N 9.798 2.681 -1.643 1.00 . A A . 26 LYS NZ 1 1 2 960 1 1 26 LYS O O 3.375 2.760 -2.130 1.00 . A A . 26 LYS O 1 1 2 961 1 1 27 LYS C C 4.488 5.719 -2.821 1.00 . A A . 27 LYS C 1 1 2 962 1 1 27 LYS CA C 3.579 5.437 -1.635 1.00 . A A . 27 LYS CA 1 1 2 963 1 1 27 LYS CB C 3.354 6.718 -0.806 1.00 . A A . 27 LYS CB 1 1 2 964 1 1 27 LYS CD C 4.295 8.728 0.355 1.00 . A A . 27 LYS CD 1 1 2 965 1 1 27 LYS CE C 5.489 9.661 0.438 1.00 . A A . 27 LYS CE 1 1 2 966 1 1 27 LYS CG C 4.613 7.497 -0.468 1.00 . A A . 27 LYS CG 1 1 2 967 1 1 27 LYS H H 4.735 4.622 -0.063 1.00 . A A . 27 LYS H 1 1 2 968 1 1 27 LYS HA H 2.634 5.081 -2.010 1.00 . A A . 27 LYS HA 1 1 2 969 1 1 27 LYS HB2 H 2.704 7.380 -1.356 1.00 . A A . 27 LYS HB2 1 1 2 970 1 1 27 LYS HB3 H 2.869 6.447 0.119 1.00 . A A . 27 LYS HB3 1 1 2 971 1 1 27 LYS HD2 H 3.471 9.255 -0.106 1.00 . A A . 27 LYS HD2 1 1 2 972 1 1 27 LYS HD3 H 4.015 8.422 1.352 1.00 . A A . 27 LYS HD3 1 1 2 973 1 1 27 LYS HE2 H 5.696 10.039 -0.551 1.00 . A A . 27 LYS HE2 1 1 2 974 1 1 27 LYS HE3 H 5.238 10.486 1.088 1.00 . A A . 27 LYS HE3 1 1 2 975 1 1 27 LYS HG2 H 5.277 6.865 0.100 1.00 . A A . 27 LYS HG2 1 1 2 976 1 1 27 LYS HG3 H 5.097 7.801 -1.386 1.00 . A A . 27 LYS HG3 1 1 2 977 1 1 27 LYS HZ1 H 6.571 8.598 1.902 1.00 . A A . 27 LYS HZ1 1 1 2 978 1 1 27 LYS HZ2 H 7.490 9.670 0.981 1.00 . A A . 27 LYS HZ2 1 1 2 979 1 1 27 LYS HZ3 H 7.008 8.227 0.319 1.00 . A A . 27 LYS HZ3 1 1 2 980 1 1 27 LYS N N 4.167 4.390 -0.831 1.00 . A A . 27 LYS N 1 1 2 981 1 1 27 LYS NZ N 6.700 8.993 0.950 1.00 . A A . 27 LYS NZ 1 1 2 982 1 1 27 LYS O O 5.615 5.182 -2.892 1.00 . A A . 27 LYS O 1 1 2 983 1 1 28 LYS C C 5.993 7.759 -4.471 1.00 . A A . 28 LYS C 1 1 2 984 1 1 28 LYS CA C 4.826 6.865 -4.900 1.00 . A A . 28 LYS CA 1 1 2 985 1 1 28 LYS CB C 3.973 7.475 -6.014 1.00 . A A . 28 LYS CB 1 1 2 986 1 1 28 LYS CD C 2.247 9.092 -6.713 1.00 . A A . 28 LYS CD 1 1 2 987 1 1 28 LYS CE C 1.670 10.473 -6.536 1.00 . A A . 28 LYS CE 1 1 2 988 1 1 28 LYS CG C 3.311 8.787 -5.688 1.00 . A A . 28 LYS CG 1 1 2 989 1 1 28 LYS H H 3.101 6.855 -3.667 1.00 . A A . 28 LYS H 1 1 2 990 1 1 28 LYS HA H 5.251 5.939 -5.253 1.00 . A A . 28 LYS HA 1 1 2 991 1 1 28 LYS HB2 H 4.604 7.630 -6.876 1.00 . A A . 28 LYS HB2 1 1 2 992 1 1 28 LYS HB3 H 3.206 6.763 -6.279 1.00 . A A . 28 LYS HB3 1 1 2 993 1 1 28 LYS HD2 H 2.676 9.004 -7.699 1.00 . A A . 28 LYS HD2 1 1 2 994 1 1 28 LYS HD3 H 1.456 8.364 -6.610 1.00 . A A . 28 LYS HD3 1 1 2 995 1 1 28 LYS HE2 H 0.764 10.552 -7.117 1.00 . A A . 28 LYS HE2 1 1 2 996 1 1 28 LYS HE3 H 1.449 10.567 -5.484 1.00 . A A . 28 LYS HE3 1 1 2 997 1 1 28 LYS HG2 H 2.861 8.724 -4.708 1.00 . A A . 28 LYS HG2 1 1 2 998 1 1 28 LYS HG3 H 4.052 9.574 -5.702 1.00 . A A . 28 LYS HG3 1 1 2 999 1 1 28 LYS HZ1 H 2.928 11.414 -7.915 1.00 . A A . 28 LYS HZ1 1 1 2 1000 1 1 28 LYS HZ2 H 3.457 11.588 -6.312 1.00 . A A . 28 LYS HZ2 1 1 2 1001 1 1 28 LYS HZ3 H 2.144 12.470 -6.871 1.00 . A A . 28 LYS HZ3 1 1 2 1002 1 1 28 LYS N N 4.017 6.511 -3.755 1.00 . A A . 28 LYS N 1 1 2 1003 1 1 28 LYS NZ N 2.614 11.543 -6.930 1.00 . A A . 28 LYS NZ 1 1 2 1004 1 1 28 LYS O O 5.916 8.428 -3.418 1.00 . A A . 28 LYS O 1 1 2 1005 1 1 29 LEU C C 8.091 9.916 -4.628 1.00 . A A . 29 LEU C 1 1 2 1006 1 1 29 LEU CA C 8.312 8.438 -4.942 1.00 . A A . 29 LEU CA 1 1 2 1007 1 1 29 LEU CB C 9.320 8.261 -6.091 1.00 . A A . 29 LEU CB 1 1 2 1008 1 1 29 LEU CD1 C 11.404 8.183 -4.674 1.00 . A A . 29 LEU CD1 1 1 2 1009 1 1 29 LEU CD2 C 11.573 8.635 -7.121 1.00 . A A . 29 LEU CD2 1 1 2 1010 1 1 29 LEU CG C 10.729 8.834 -5.874 1.00 . A A . 29 LEU CG 1 1 2 1011 1 1 29 LEU H H 6.997 7.263 -6.110 1.00 . A A . 29 LEU H 1 1 2 1012 1 1 29 LEU HA H 8.714 7.964 -4.059 1.00 . A A . 29 LEU HA 1 1 2 1013 1 1 29 LEU HB2 H 9.415 7.206 -6.294 1.00 . A A . 29 LEU HB2 1 1 2 1014 1 1 29 LEU HB3 H 8.902 8.733 -6.968 1.00 . A A . 29 LEU HB3 1 1 2 1015 1 1 29 LEU HD11 H 12.396 8.592 -4.554 1.00 . A A . 29 LEU HD11 1 1 2 1016 1 1 29 LEU HD12 H 11.471 7.116 -4.832 1.00 . A A . 29 LEU HD12 1 1 2 1017 1 1 29 LEU HD13 H 10.826 8.378 -3.784 1.00 . A A . 29 LEU HD13 1 1 2 1018 1 1 29 LEU HD21 H 11.108 9.135 -7.956 1.00 . A A . 29 LEU HD21 1 1 2 1019 1 1 29 LEU HD22 H 11.652 7.580 -7.336 1.00 . A A . 29 LEU HD22 1 1 2 1020 1 1 29 LEU HD23 H 12.560 9.043 -6.960 1.00 . A A . 29 LEU HD23 1 1 2 1021 1 1 29 LEU HG H 10.656 9.894 -5.681 1.00 . A A . 29 LEU HG 1 1 2 1022 1 1 29 LEU N N 7.056 7.751 -5.260 1.00 . A A . 29 LEU N 1 1 2 1023 1 1 29 LEU O O 8.655 10.444 -3.655 1.00 . A A . 29 LEU O 1 1 2 1024 1 1 30 TRP C C 5.578 12.195 -5.818 1.00 . A A . 30 TRP C 1 1 2 1025 1 1 30 TRP CA C 6.935 11.940 -5.206 1.00 . A A . 30 TRP CA 1 1 2 1026 1 1 30 TRP CB C 8.012 12.871 -5.788 1.00 . A A . 30 TRP CB 1 1 2 1027 1 1 30 TRP CD1 C 7.564 15.292 -6.515 1.00 . A A . 30 TRP CD1 1 1 2 1028 1 1 30 TRP CD2 C 7.703 15.022 -4.297 1.00 . A A . 30 TRP CD2 1 1 2 1029 1 1 30 TRP CE2 C 7.471 16.382 -4.567 1.00 . A A . 30 TRP CE2 1 1 2 1030 1 1 30 TRP CE3 C 7.821 14.614 -2.968 1.00 . A A . 30 TRP CE3 1 1 2 1031 1 1 30 TRP CG C 7.768 14.339 -5.561 1.00 . A A . 30 TRP CG 1 1 2 1032 1 1 30 TRP CH2 C 7.476 16.905 -2.270 1.00 . A A . 30 TRP CH2 1 1 2 1033 1 1 30 TRP CZ2 C 7.357 17.334 -3.561 1.00 . A A . 30 TRP CZ2 1 1 2 1034 1 1 30 TRP CZ3 C 7.705 15.561 -1.968 1.00 . A A . 30 TRP CZ3 1 1 2 1035 1 1 30 TRP H H 6.879 10.107 -6.195 1.00 . A A . 30 TRP H 1 1 2 1036 1 1 30 TRP HA H 6.864 12.095 -4.139 1.00 . A A . 30 TRP HA 1 1 2 1037 1 1 30 TRP HB2 H 8.958 12.628 -5.328 1.00 . A A . 30 TRP HB2 1 1 2 1038 1 1 30 TRP HB3 H 8.089 12.701 -6.850 1.00 . A A . 30 TRP HB3 1 1 2 1039 1 1 30 TRP HD1 H 7.554 15.092 -7.577 1.00 . A A . 30 TRP HD1 1 1 2 1040 1 1 30 TRP HE1 H 7.249 17.374 -6.399 1.00 . A A . 30 TRP HE1 1 1 2 1041 1 1 30 TRP HE3 H 8.000 13.580 -2.719 1.00 . A A . 30 TRP HE3 1 1 2 1042 1 1 30 TRP HH2 H 7.392 17.608 -1.454 1.00 . A A . 30 TRP HH2 1 1 2 1043 1 1 30 TRP HZ2 H 7.178 18.377 -3.775 1.00 . A A . 30 TRP HZ2 1 1 2 1044 1 1 30 TRP HZ3 H 7.794 15.262 -0.934 1.00 . A A . 30 TRP HZ3 1 1 2 1045 1 1 30 TRP N N 7.277 10.563 -5.422 1.00 . A A . 30 TRP N 1 1 2 1046 1 1 30 TRP NE1 N 7.396 16.523 -5.924 1.00 . A A . 30 TRP NE1 1 1 2 1047 1 1 30 TRP O O 5.490 12.522 -7.001 1.00 . A A . 30 TRP O 1 1 2 1048 1 1 30 TRP OXT O 4.564 12.009 -5.122 1.00 . A A . 30 TRP OXT 1 1 3 1049 1 1 1 TYR C C -10.275 0.751 1.087 1.00 . A A . 1 TYR C 1 1 3 1050 1 1 1 TYR CA C -11.567 1.295 1.676 1.00 . A A . 1 TYR CA 1 1 3 1051 1 1 1 TYR CB C -11.714 2.809 1.389 1.00 . A A . 1 TYR CB 1 1 3 1052 1 1 1 TYR CD1 C -10.880 3.387 -0.938 1.00 . A A . 1 TYR CD1 1 1 3 1053 1 1 1 TYR CD2 C -13.228 3.297 -0.580 1.00 . A A . 1 TYR CD2 1 1 3 1054 1 1 1 TYR CE1 C -11.088 3.720 -2.258 1.00 . A A . 1 TYR CE1 1 1 3 1055 1 1 1 TYR CE2 C -13.444 3.629 -1.900 1.00 . A A . 1 TYR CE2 1 1 3 1056 1 1 1 TYR CG C -11.942 3.168 -0.073 1.00 . A A . 1 TYR CG 1 1 3 1057 1 1 1 TYR CZ C -12.370 3.838 -2.734 1.00 . A A . 1 TYR CZ 1 1 3 1058 1 1 1 TYR H1 H -10.795 1.494 3.607 1.00 . A A . 1 TYR H1 1 1 3 1059 1 1 1 TYR H2 H -11.528 0.018 3.305 1.00 . A A . 1 TYR H2 1 1 3 1060 1 1 1 TYR H3 H -12.474 1.385 3.526 1.00 . A A . 1 TYR H3 1 1 3 1061 1 1 1 TYR HA H -12.393 0.760 1.236 1.00 . A A . 1 TYR HA 1 1 3 1062 1 1 1 TYR HB2 H -12.550 3.196 1.951 1.00 . A A . 1 TYR HB2 1 1 3 1063 1 1 1 TYR HB3 H -10.815 3.311 1.713 1.00 . A A . 1 TYR HB3 1 1 3 1064 1 1 1 TYR HD1 H -9.868 3.293 -0.569 1.00 . A A . 1 TYR HD1 1 1 3 1065 1 1 1 TYR HD2 H -14.072 3.135 0.075 1.00 . A A . 1 TYR HD2 1 1 3 1066 1 1 1 TYR HE1 H -10.239 3.881 -2.907 1.00 . A A . 1 TYR HE1 1 1 3 1067 1 1 1 TYR HE2 H -14.459 3.719 -2.261 1.00 . A A . 1 TYR HE2 1 1 3 1068 1 1 1 TYR HH H -13.257 4.859 -4.082 1.00 . A A . 1 TYR HH 1 1 3 1069 1 1 1 TYR N N -11.585 1.037 3.114 1.00 . A A . 1 TYR N 1 1 3 1070 1 1 1 TYR O O -10.288 -0.172 0.265 1.00 . A A . 1 TYR O 1 1 3 1071 1 1 1 TYR OH O -12.580 4.170 -4.050 1.00 . A A . 1 TYR OH 1 1 3 1072 1 1 2 CYS C C -6.818 1.219 2.078 1.00 . A A . 2 CYS C 1 1 3 1073 1 1 2 CYS CA C -7.865 0.851 1.058 1.00 . A A . 2 CYS CA 1 1 3 1074 1 1 2 CYS CB C -7.522 1.428 -0.331 1.00 . A A . 2 CYS CB 1 1 3 1075 1 1 2 CYS H H -9.153 2.032 2.168 1.00 . A A . 2 CYS H 1 1 3 1076 1 1 2 CYS HA H -7.907 -0.227 0.991 1.00 . A A . 2 CYS HA 1 1 3 1077 1 1 2 CYS HB2 H -6.522 1.119 -0.598 1.00 . A A . 2 CYS HB2 1 1 3 1078 1 1 2 CYS HB3 H -8.217 1.026 -1.053 1.00 . A A . 2 CYS HB3 1 1 3 1079 1 1 2 CYS N N -9.157 1.301 1.512 1.00 . A A . 2 CYS N 1 1 3 1080 1 1 2 CYS O O -7.058 2.080 2.932 1.00 . A A . 2 CYS O 1 1 3 1081 1 1 2 CYS SG S -7.577 3.258 -0.459 1.00 . A A . 2 CYS SG 1 1 3 1082 1 1 3 GLN C C -3.823 2.022 2.448 1.00 . A A . 3 GLN C 1 1 3 1083 1 1 3 GLN CA C -4.622 0.829 2.931 1.00 . A A . 3 GLN CA 1 1 3 1084 1 1 3 GLN CB C -3.717 -0.396 3.039 1.00 . A A . 3 GLN CB 1 1 3 1085 1 1 3 GLN CD C -5.241 -1.653 4.604 1.00 . A A . 3 GLN CD 1 1 3 1086 1 1 3 GLN CG C -4.451 -1.698 3.325 1.00 . A A . 3 GLN CG 1 1 3 1087 1 1 3 GLN H H -5.584 -0.128 1.336 1.00 . A A . 3 GLN H 1 1 3 1088 1 1 3 GLN HA H -5.044 1.045 3.901 1.00 . A A . 3 GLN HA 1 1 3 1089 1 1 3 GLN HB2 H -3.152 -0.509 2.126 1.00 . A A . 3 GLN HB2 1 1 3 1090 1 1 3 GLN HB3 H -3.019 -0.227 3.844 1.00 . A A . 3 GLN HB3 1 1 3 1091 1 1 3 GLN HE21 H -3.654 -2.248 5.597 1.00 . A A . 3 GLN HE21 1 1 3 1092 1 1 3 GLN HE22 H -5.075 -1.937 6.543 1.00 . A A . 3 GLN HE22 1 1 3 1093 1 1 3 GLN HG2 H -5.140 -1.877 2.511 1.00 . A A . 3 GLN HG2 1 1 3 1094 1 1 3 GLN HG3 H -3.739 -2.509 3.364 1.00 . A A . 3 GLN HG3 1 1 3 1095 1 1 3 GLN N N -5.694 0.576 2.012 1.00 . A A . 3 GLN N 1 1 3 1096 1 1 3 GLN NE2 N -4.601 -1.985 5.685 1.00 . A A . 3 GLN NE2 1 1 3 1097 1 1 3 GLN O O -3.454 2.098 1.279 1.00 . A A . 3 GLN O 1 1 3 1098 1 1 3 GLN OE1 O -6.421 -1.308 4.617 1.00 . A A . 3 GLN OE1 1 1 3 1099 1 1 4 LYS C C -1.379 3.929 3.156 1.00 . A A . 4 LYS C 1 1 3 1100 1 1 4 LYS CA C -2.886 4.179 3.053 1.00 . A A . 4 LYS CA 1 1 3 1101 1 1 4 LYS CB C -3.305 5.270 4.034 1.00 . A A . 4 LYS CB 1 1 3 1102 1 1 4 LYS CD C -5.141 6.578 5.132 1.00 . A A . 4 LYS CD 1 1 3 1103 1 1 4 LYS CE C -6.643 6.783 5.262 1.00 . A A . 4 LYS CE 1 1 3 1104 1 1 4 LYS CG C -4.803 5.508 4.105 1.00 . A A . 4 LYS CG 1 1 3 1105 1 1 4 LYS H H -3.942 2.806 4.250 1.00 . A A . 4 LYS H 1 1 3 1106 1 1 4 LYS HA H -3.131 4.489 2.048 1.00 . A A . 4 LYS HA 1 1 3 1107 1 1 4 LYS HB2 H -2.959 5.000 5.021 1.00 . A A . 4 LYS HB2 1 1 3 1108 1 1 4 LYS HB3 H -2.832 6.192 3.735 1.00 . A A . 4 LYS HB3 1 1 3 1109 1 1 4 LYS HD2 H -4.746 6.277 6.091 1.00 . A A . 4 LYS HD2 1 1 3 1110 1 1 4 LYS HD3 H -4.682 7.508 4.829 1.00 . A A . 4 LYS HD3 1 1 3 1111 1 1 4 LYS HE2 H -7.096 5.852 5.569 1.00 . A A . 4 LYS HE2 1 1 3 1112 1 1 4 LYS HE3 H -6.825 7.532 6.017 1.00 . A A . 4 LYS HE3 1 1 3 1113 1 1 4 LYS HG2 H -5.161 5.823 3.137 1.00 . A A . 4 LYS HG2 1 1 3 1114 1 1 4 LYS HG3 H -5.289 4.585 4.388 1.00 . A A . 4 LYS HG3 1 1 3 1115 1 1 4 LYS HZ1 H -7.163 6.510 3.235 1.00 . A A . 4 LYS HZ1 1 1 3 1116 1 1 4 LYS HZ2 H -6.855 8.102 3.643 1.00 . A A . 4 LYS HZ2 1 1 3 1117 1 1 4 LYS HZ3 H -8.281 7.378 4.125 1.00 . A A . 4 LYS HZ3 1 1 3 1118 1 1 4 LYS N N -3.608 2.955 3.342 1.00 . A A . 4 LYS N 1 1 3 1119 1 1 4 LYS NZ N -7.262 7.214 3.995 1.00 . A A . 4 LYS NZ 1 1 3 1120 1 1 4 LYS O O -0.961 2.854 3.557 1.00 . A A . 4 LYS O 1 1 3 1121 1 1 5 TRP C C 1.488 4.481 4.198 1.00 . A A . 5 TRP C 1 1 3 1122 1 1 5 TRP CA C 0.884 4.796 2.819 1.00 . A A . 5 TRP CA 1 1 3 1123 1 1 5 TRP CB C 1.553 6.051 2.208 1.00 . A A . 5 TRP CB 1 1 3 1124 1 1 5 TRP CD1 C 2.186 7.774 4.005 1.00 . A A . 5 TRP CD1 1 1 3 1125 1 1 5 TRP CD2 C 0.325 8.292 2.879 1.00 . A A . 5 TRP CD2 1 1 3 1126 1 1 5 TRP CE2 C 0.569 9.291 3.836 1.00 . A A . 5 TRP CE2 1 1 3 1127 1 1 5 TRP CE3 C -0.794 8.415 2.055 1.00 . A A . 5 TRP CE3 1 1 3 1128 1 1 5 TRP CG C 1.373 7.318 3.009 1.00 . A A . 5 TRP CG 1 1 3 1129 1 1 5 TRP CH2 C -1.344 10.482 3.174 1.00 . A A . 5 TRP CH2 1 1 3 1130 1 1 5 TRP CZ2 C -0.259 10.387 3.993 1.00 . A A . 5 TRP CZ2 1 1 3 1131 1 1 5 TRP CZ3 C -1.616 9.511 2.210 1.00 . A A . 5 TRP CZ3 1 1 3 1132 1 1 5 TRP H H -0.973 5.816 2.675 1.00 . A A . 5 TRP H 1 1 3 1133 1 1 5 TRP HA H 1.091 3.957 2.174 1.00 . A A . 5 TRP HA 1 1 3 1134 1 1 5 TRP HB2 H 2.614 5.873 2.118 1.00 . A A . 5 TRP HB2 1 1 3 1135 1 1 5 TRP HB3 H 1.145 6.219 1.221 1.00 . A A . 5 TRP HB3 1 1 3 1136 1 1 5 TRP HD1 H 3.074 7.263 4.348 1.00 . A A . 5 TRP HD1 1 1 3 1137 1 1 5 TRP HE1 H 2.111 9.472 5.235 1.00 . A A . 5 TRP HE1 1 1 3 1138 1 1 5 TRP HE3 H -1.022 7.678 1.300 1.00 . A A . 5 TRP HE3 1 1 3 1139 1 1 5 TRP HH2 H -2.012 11.327 3.265 1.00 . A A . 5 TRP HH2 1 1 3 1140 1 1 5 TRP HZ2 H -0.061 11.141 4.739 1.00 . A A . 5 TRP HZ2 1 1 3 1141 1 1 5 TRP HZ3 H -2.487 9.624 1.581 1.00 . A A . 5 TRP HZ3 1 1 3 1142 1 1 5 TRP N N -0.578 4.940 2.863 1.00 . A A . 5 TRP N 1 1 3 1143 1 1 5 TRP NE1 N 1.701 8.951 4.507 1.00 . A A . 5 TRP NE1 1 1 3 1144 1 1 5 TRP O O 2.556 3.893 4.294 1.00 . A A . 5 TRP O 1 1 3 1145 1 1 6 MET C C 0.740 3.279 7.104 1.00 . A A . 6 MET C 1 1 3 1146 1 1 6 MET CA C 1.292 4.623 6.606 1.00 . A A . 6 MET CA 1 1 3 1147 1 1 6 MET CB C 0.889 5.780 7.537 1.00 . A A . 6 MET CB 1 1 3 1148 1 1 6 MET CE C -0.636 7.116 10.060 1.00 . A A . 6 MET CE 1 1 3 1149 1 1 6 MET CG C 1.438 5.643 8.936 1.00 . A A . 6 MET CG 1 1 3 1150 1 1 6 MET H H -0.021 5.385 5.126 1.00 . A A . 6 MET H 1 1 3 1151 1 1 6 MET HA H 2.369 4.556 6.561 1.00 . A A . 6 MET HA 1 1 3 1152 1 1 6 MET HB2 H 1.234 6.715 7.115 1.00 . A A . 6 MET HB2 1 1 3 1153 1 1 6 MET HB3 H -0.188 5.812 7.596 1.00 . A A . 6 MET HB3 1 1 3 1154 1 1 6 MET HE1 H -0.990 6.182 10.469 1.00 . A A . 6 MET HE1 1 1 3 1155 1 1 6 MET HE2 H -1.041 7.258 9.069 1.00 . A A . 6 MET HE2 1 1 3 1156 1 1 6 MET HE3 H -0.949 7.928 10.698 1.00 . A A . 6 MET HE3 1 1 3 1157 1 1 6 MET HG2 H 0.973 4.780 9.393 1.00 . A A . 6 MET HG2 1 1 3 1158 1 1 6 MET HG3 H 2.492 5.461 8.821 1.00 . A A . 6 MET HG3 1 1 3 1159 1 1 6 MET N N 0.812 4.881 5.254 1.00 . A A . 6 MET N 1 1 3 1160 1 1 6 MET O O 1.084 2.773 8.182 1.00 . A A . 6 MET O 1 1 3 1161 1 1 6 MET SD S 1.154 7.085 9.984 1.00 . A A . 6 MET SD 1 1 3 1162 1 1 7 TRP C C 0.066 0.315 5.954 1.00 . A A . 7 TRP C 1 1 3 1163 1 1 7 TRP CA C -0.729 1.444 6.585 1.00 . A A . 7 TRP CA 1 1 3 1164 1 1 7 TRP CB C -2.186 1.426 6.060 1.00 . A A . 7 TRP CB 1 1 3 1165 1 1 7 TRP CD1 C -2.823 3.640 7.233 1.00 . A A . 7 TRP CD1 1 1 3 1166 1 1 7 TRP CD2 C -4.550 2.285 6.831 1.00 . A A . 7 TRP CD2 1 1 3 1167 1 1 7 TRP CE2 C -5.024 3.443 7.468 1.00 . A A . 7 TRP CE2 1 1 3 1168 1 1 7 TRP CE3 C -5.462 1.296 6.479 1.00 . A A . 7 TRP CE3 1 1 3 1169 1 1 7 TRP CG C -3.129 2.419 6.701 1.00 . A A . 7 TRP CG 1 1 3 1170 1 1 7 TRP CH2 C -7.239 2.650 7.394 1.00 . A A . 7 TRP CH2 1 1 3 1171 1 1 7 TRP CZ2 C -6.371 3.636 7.755 1.00 . A A . 7 TRP CZ2 1 1 3 1172 1 1 7 TRP CZ3 C -6.796 1.487 6.760 1.00 . A A . 7 TRP CZ3 1 1 3 1173 1 1 7 TRP H H -0.212 3.124 5.416 1.00 . A A . 7 TRP H 1 1 3 1174 1 1 7 TRP HA H -0.735 1.313 7.656 1.00 . A A . 7 TRP HA 1 1 3 1175 1 1 7 TRP HB2 H -2.180 1.630 5.000 1.00 . A A . 7 TRP HB2 1 1 3 1176 1 1 7 TRP HB3 H -2.594 0.437 6.210 1.00 . A A . 7 TRP HB3 1 1 3 1177 1 1 7 TRP HD1 H -1.820 4.043 7.282 1.00 . A A . 7 TRP HD1 1 1 3 1178 1 1 7 TRP HE1 H -3.988 5.125 8.149 1.00 . A A . 7 TRP HE1 1 1 3 1179 1 1 7 TRP HE3 H -5.144 0.386 5.988 1.00 . A A . 7 TRP HE3 1 1 3 1180 1 1 7 TRP HH2 H -8.295 2.757 7.596 1.00 . A A . 7 TRP HH2 1 1 3 1181 1 1 7 TRP HZ2 H -6.734 4.527 8.246 1.00 . A A . 7 TRP HZ2 1 1 3 1182 1 1 7 TRP HZ3 H -7.515 0.727 6.489 1.00 . A A . 7 TRP HZ3 1 1 3 1183 1 1 7 TRP N N -0.080 2.701 6.290 1.00 . A A . 7 TRP N 1 1 3 1184 1 1 7 TRP NE1 N -3.953 4.246 7.705 1.00 . A A . 7 TRP NE1 1 1 3 1185 1 1 7 TRP O O 1.132 0.537 5.359 1.00 . A A . 7 TRP O 1 1 3 1186 1 1 8 THR C C -0.777 -2.872 4.781 1.00 . A A . 8 THR C 1 1 3 1187 1 1 8 THR CA C 0.242 -2.041 5.560 1.00 . A A . 8 THR CA 1 1 3 1188 1 1 8 THR CB C 0.840 -2.864 6.737 1.00 . A A . 8 THR CB 1 1 3 1189 1 1 8 THR CG2 C 1.961 -2.106 7.438 1.00 . A A . 8 THR CG2 1 1 3 1190 1 1 8 THR H H -1.301 -1.007 6.512 1.00 . A A . 8 THR H 1 1 3 1191 1 1 8 THR HA H 1.030 -1.686 4.917 1.00 . A A . 8 THR HA 1 1 3 1192 1 1 8 THR HB H 1.229 -3.794 6.349 1.00 . A A . 8 THR HB 1 1 3 1193 1 1 8 THR HG1 H -0.440 -2.296 8.098 1.00 . A A . 8 THR HG1 1 1 3 1194 1 1 8 THR HG21 H 1.571 -1.169 7.806 1.00 . A A . 8 THR HG21 1 1 3 1195 1 1 8 THR HG22 H 2.778 -1.907 6.761 1.00 . A A . 8 THR HG22 1 1 3 1196 1 1 8 THR HG23 H 2.317 -2.690 8.274 1.00 . A A . 8 THR HG23 1 1 3 1197 1 1 8 THR N N -0.429 -0.878 6.078 1.00 . A A . 8 THR N 1 1 3 1198 1 1 8 THR O O -1.978 -2.751 5.060 1.00 . A A . 8 THR O 1 1 3 1199 1 1 8 THR OG1 O -0.182 -3.143 7.708 1.00 . A A . 8 THR OG1 1 1 3 1200 1 1 9 CYS C C -1.069 -5.925 3.058 1.00 . A A . 9 CYS C 1 1 3 1201 1 1 9 CYS CA C -1.378 -4.443 3.104 1.00 . A A . 9 CYS CA 1 1 3 1202 1 1 9 CYS CB C -1.664 -3.860 1.713 1.00 . A A . 9 CYS CB 1 1 3 1203 1 1 9 CYS H H 0.569 -3.830 3.522 1.00 . A A . 9 CYS H 1 1 3 1204 1 1 9 CYS HA H -2.274 -4.340 3.697 1.00 . A A . 9 CYS HA 1 1 3 1205 1 1 9 CYS HB2 H -2.422 -4.458 1.229 1.00 . A A . 9 CYS HB2 1 1 3 1206 1 1 9 CYS HB3 H -2.040 -2.853 1.833 1.00 . A A . 9 CYS HB3 1 1 3 1207 1 1 9 CYS N N -0.367 -3.690 3.805 1.00 . A A . 9 CYS N 1 1 3 1208 1 1 9 CYS O O -0.024 -6.382 3.568 1.00 . A A . 9 CYS O 1 1 3 1209 1 1 9 CYS SG S -0.244 -3.792 0.598 1.00 . A A . 9 CYS SG 1 1 3 1210 1 1 10 ASP C C -2.608 -8.496 1.119 1.00 . A A . 10 ASP C 1 1 3 1211 1 1 10 ASP CA C -1.906 -8.115 2.387 1.00 . A A . 10 ASP CA 1 1 3 1212 1 1 10 ASP CB C -2.632 -8.809 3.561 1.00 . A A . 10 ASP CB 1 1 3 1213 1 1 10 ASP CG C -1.956 -8.682 4.903 1.00 . A A . 10 ASP CG 1 1 3 1214 1 1 10 ASP H H -2.761 -6.248 2.060 1.00 . A A . 10 ASP H 1 1 3 1215 1 1 10 ASP HA H -0.873 -8.422 2.359 1.00 . A A . 10 ASP HA 1 1 3 1216 1 1 10 ASP HB2 H -3.622 -8.390 3.657 1.00 . A A . 10 ASP HB2 1 1 3 1217 1 1 10 ASP HB3 H -2.726 -9.857 3.325 1.00 . A A . 10 ASP HB3 1 1 3 1218 1 1 10 ASP N N -1.984 -6.671 2.492 1.00 . A A . 10 ASP N 1 1 3 1219 1 1 10 ASP O O -2.899 -7.626 0.296 1.00 . A A . 10 ASP O 1 1 3 1220 1 1 10 ASP OD1 O -2.346 -7.821 5.692 1.00 . A A . 10 ASP OD1 1 1 3 1221 1 1 10 ASP OD2 O -1.053 -9.484 5.212 1.00 . A A . 10 ASP OD2 1 1 3 1222 1 1 11 SER C C -5.112 -9.771 0.079 1.00 . A A . 11 SER C 1 1 3 1223 1 1 11 SER CA C -3.661 -10.166 -0.189 1.00 . A A . 11 SER CA 1 1 3 1224 1 1 11 SER CB C -3.527 -11.676 -0.452 1.00 . A A . 11 SER CB 1 1 3 1225 1 1 11 SER H H -2.570 -10.440 1.575 1.00 . A A . 11 SER H 1 1 3 1226 1 1 11 SER HA H -3.299 -9.611 -1.042 1.00 . A A . 11 SER HA 1 1 3 1227 1 1 11 SER HB2 H -2.483 -11.953 -0.444 1.00 . A A . 11 SER HB2 1 1 3 1228 1 1 11 SER HB3 H -4.048 -12.223 0.320 1.00 . A A . 11 SER HB3 1 1 3 1229 1 1 11 SER HG H -5.011 -11.743 -1.740 1.00 . A A . 11 SER HG 1 1 3 1230 1 1 11 SER N N -2.893 -9.762 0.942 1.00 . A A . 11 SER N 1 1 3 1231 1 1 11 SER O O -5.820 -9.337 -0.814 1.00 . A A . 11 SER O 1 1 3 1232 1 1 11 SER OG O -4.087 -12.035 -1.718 1.00 . A A . 11 SER OG 1 1 3 1233 1 1 12 GLU C C -6.996 -7.995 1.805 1.00 . A A . 12 GLU C 1 1 3 1234 1 1 12 GLU CA C -6.861 -9.509 1.747 1.00 . A A . 12 GLU CA 1 1 3 1235 1 1 12 GLU CB C -7.203 -10.088 3.107 1.00 . A A . 12 GLU CB 1 1 3 1236 1 1 12 GLU CD C -7.648 -12.077 4.509 1.00 . A A . 12 GLU CD 1 1 3 1237 1 1 12 GLU CG C -7.221 -11.591 3.164 1.00 . A A . 12 GLU CG 1 1 3 1238 1 1 12 GLU H H -4.908 -10.293 1.990 1.00 . A A . 12 GLU H 1 1 3 1239 1 1 12 GLU HA H -7.555 -9.899 1.019 1.00 . A A . 12 GLU HA 1 1 3 1240 1 1 12 GLU HB2 H -6.472 -9.736 3.820 1.00 . A A . 12 GLU HB2 1 1 3 1241 1 1 12 GLU HB3 H -8.174 -9.724 3.405 1.00 . A A . 12 GLU HB3 1 1 3 1242 1 1 12 GLU HG2 H -7.916 -11.959 2.425 1.00 . A A . 12 GLU HG2 1 1 3 1243 1 1 12 GLU HG3 H -6.234 -11.971 2.952 1.00 . A A . 12 GLU HG3 1 1 3 1244 1 1 12 GLU N N -5.524 -9.897 1.338 1.00 . A A . 12 GLU N 1 1 3 1245 1 1 12 GLU O O -7.860 -7.417 1.156 1.00 . A A . 12 GLU O 1 1 3 1246 1 1 12 GLU OE1 O -6.807 -12.193 5.416 1.00 . A A . 12 GLU OE1 1 1 3 1247 1 1 12 GLU OE2 O -8.855 -12.342 4.699 1.00 . A A . 12 GLU OE2 1 1 3 1248 1 1 13 ARG C C -5.585 -5.241 1.541 1.00 . A A . 13 ARG C 1 1 3 1249 1 1 13 ARG CA C -6.187 -5.917 2.753 1.00 . A A . 13 ARG CA 1 1 3 1250 1 1 13 ARG CB C -5.459 -5.475 4.024 1.00 . A A . 13 ARG CB 1 1 3 1251 1 1 13 ARG CD C -5.354 -5.456 6.530 1.00 . A A . 13 ARG CD 1 1 3 1252 1 1 13 ARG CG C -6.071 -6.005 5.309 1.00 . A A . 13 ARG CG 1 1 3 1253 1 1 13 ARG CZ C -2.969 -5.156 7.176 1.00 . A A . 13 ARG CZ 1 1 3 1254 1 1 13 ARG H H -5.462 -7.884 3.064 1.00 . A A . 13 ARG H 1 1 3 1255 1 1 13 ARG HA H -7.225 -5.632 2.828 1.00 . A A . 13 ARG HA 1 1 3 1256 1 1 13 ARG HB2 H -4.435 -5.816 3.972 1.00 . A A . 13 ARG HB2 1 1 3 1257 1 1 13 ARG HB3 H -5.462 -4.395 4.067 1.00 . A A . 13 ARG HB3 1 1 3 1258 1 1 13 ARG HD2 H -5.419 -4.378 6.510 1.00 . A A . 13 ARG HD2 1 1 3 1259 1 1 13 ARG HD3 H -5.846 -5.826 7.417 1.00 . A A . 13 ARG HD3 1 1 3 1260 1 1 13 ARG HE H -3.672 -6.684 6.127 1.00 . A A . 13 ARG HE 1 1 3 1261 1 1 13 ARG HG2 H -7.109 -5.715 5.351 1.00 . A A . 13 ARG HG2 1 1 3 1262 1 1 13 ARG HG3 H -5.997 -7.082 5.311 1.00 . A A . 13 ARG HG3 1 1 3 1263 1 1 13 ARG HH11 H -4.166 -3.660 7.887 1.00 . A A . 13 ARG HH11 1 1 3 1264 1 1 13 ARG HH12 H -2.525 -3.483 8.265 1.00 . A A . 13 ARG HH12 1 1 3 1265 1 1 13 ARG HH21 H -1.571 -6.495 6.658 1.00 . A A . 13 ARG HH21 1 1 3 1266 1 1 13 ARG HH22 H -0.957 -5.158 7.572 1.00 . A A . 13 ARG HH22 1 1 3 1267 1 1 13 ARG N N -6.143 -7.362 2.595 1.00 . A A . 13 ARG N 1 1 3 1268 1 1 13 ARG NE N -3.937 -5.841 6.574 1.00 . A A . 13 ARG NE 1 1 3 1269 1 1 13 ARG NH1 N -3.236 -4.032 7.819 1.00 . A A . 13 ARG NH1 1 1 3 1270 1 1 13 ARG NH2 N -1.735 -5.625 7.142 1.00 . A A . 13 ARG NH2 1 1 3 1271 1 1 13 ARG O O -4.381 -5.336 1.311 1.00 . A A . 13 ARG O 1 1 3 1272 1 1 14 LYS C C -5.483 -2.546 -0.166 1.00 . A A . 14 LYS C 1 1 3 1273 1 1 14 LYS CA C -5.997 -3.919 -0.444 1.00 . A A . 14 LYS CA 1 1 3 1274 1 1 14 LYS CB C -7.136 -3.832 -1.442 1.00 . A A . 14 LYS CB 1 1 3 1275 1 1 14 LYS CD C -6.737 -6.107 -2.424 1.00 . A A . 14 LYS CD 1 1 3 1276 1 1 14 LYS CE C -7.389 -7.429 -2.786 1.00 . A A . 14 LYS CE 1 1 3 1277 1 1 14 LYS CG C -7.743 -5.160 -1.805 1.00 . A A . 14 LYS CG 1 1 3 1278 1 1 14 LYS H H -7.358 -4.482 1.053 1.00 . A A . 14 LYS H 1 1 3 1279 1 1 14 LYS HA H -5.203 -4.505 -0.878 1.00 . A A . 14 LYS HA 1 1 3 1280 1 1 14 LYS HB2 H -7.915 -3.211 -1.025 1.00 . A A . 14 LYS HB2 1 1 3 1281 1 1 14 LYS HB3 H -6.769 -3.368 -2.346 1.00 . A A . 14 LYS HB3 1 1 3 1282 1 1 14 LYS HD2 H -6.326 -5.656 -3.315 1.00 . A A . 14 LYS HD2 1 1 3 1283 1 1 14 LYS HD3 H -5.949 -6.292 -1.709 1.00 . A A . 14 LYS HD3 1 1 3 1284 1 1 14 LYS HE2 H -7.819 -7.864 -1.896 1.00 . A A . 14 LYS HE2 1 1 3 1285 1 1 14 LYS HE3 H -8.172 -7.240 -3.504 1.00 . A A . 14 LYS HE3 1 1 3 1286 1 1 14 LYS HG2 H -8.109 -5.602 -0.894 1.00 . A A . 14 LYS HG2 1 1 3 1287 1 1 14 LYS HG3 H -8.547 -4.980 -2.502 1.00 . A A . 14 LYS HG3 1 1 3 1288 1 1 14 LYS HZ1 H -6.904 -9.281 -3.597 1.00 . A A . 14 LYS HZ1 1 1 3 1289 1 1 14 LYS HZ2 H -5.685 -8.603 -2.672 1.00 . A A . 14 LYS HZ2 1 1 3 1290 1 1 14 LYS HZ3 H -5.984 -8.017 -4.232 1.00 . A A . 14 LYS HZ3 1 1 3 1291 1 1 14 LYS N N -6.419 -4.564 0.781 1.00 . A A . 14 LYS N 1 1 3 1292 1 1 14 LYS NZ N -6.429 -8.385 -3.367 1.00 . A A . 14 LYS NZ 1 1 3 1293 1 1 14 LYS O O -6.038 -1.811 0.646 1.00 . A A . 14 LYS O 1 1 3 1294 1 1 15 CYS C C -4.381 0.090 -1.658 1.00 . A A . 15 CYS C 1 1 3 1295 1 1 15 CYS CA C -3.805 -0.936 -0.666 1.00 . A A . 15 CYS CA 1 1 3 1296 1 1 15 CYS CB C -2.293 -1.134 -0.835 1.00 . A A . 15 CYS CB 1 1 3 1297 1 1 15 CYS H H -4.193 -2.822 -1.556 1.00 . A A . 15 CYS H 1 1 3 1298 1 1 15 CYS HA H -4.017 -0.595 0.336 1.00 . A A . 15 CYS HA 1 1 3 1299 1 1 15 CYS HB2 H -1.986 -1.981 -0.240 1.00 . A A . 15 CYS HB2 1 1 3 1300 1 1 15 CYS HB3 H -2.081 -1.349 -1.871 1.00 . A A . 15 CYS HB3 1 1 3 1301 1 1 15 CYS N N -4.472 -2.198 -0.852 1.00 . A A . 15 CYS N 1 1 3 1302 1 1 15 CYS O O -5.029 -0.293 -2.646 1.00 . A A . 15 CYS O 1 1 3 1303 1 1 15 CYS SG S -1.263 0.273 -0.331 1.00 . A A . 15 CYS SG 1 1 3 1304 1 1 16 CYS C C -4.038 2.502 -3.595 1.00 . A A . 16 CYS C 1 1 3 1305 1 1 16 CYS CA C -4.759 2.417 -2.245 1.00 . A A . 16 CYS CA 1 1 3 1306 1 1 16 CYS CB C -4.733 3.780 -1.539 1.00 . A A . 16 CYS CB 1 1 3 1307 1 1 16 CYS H H -3.683 1.641 -0.593 1.00 . A A . 16 CYS H 1 1 3 1308 1 1 16 CYS HA H -5.789 2.153 -2.437 1.00 . A A . 16 CYS HA 1 1 3 1309 1 1 16 CYS HB2 H -3.709 4.027 -1.297 1.00 . A A . 16 CYS HB2 1 1 3 1310 1 1 16 CYS HB3 H -5.122 4.528 -2.214 1.00 . A A . 16 CYS HB3 1 1 3 1311 1 1 16 CYS N N -4.203 1.371 -1.387 1.00 . A A . 16 CYS N 1 1 3 1312 1 1 16 CYS O O -2.862 2.091 -3.738 1.00 . A A . 16 CYS O 1 1 3 1313 1 1 16 CYS SG S -5.700 3.877 0.023 1.00 . A A . 16 CYS SG 1 1 3 1314 1 1 17 LYS C C -3.109 4.263 -5.828 1.00 . A A . 17 LYS C 1 1 3 1315 1 1 17 LYS CA C -4.170 3.176 -5.911 1.00 . A A . 17 LYS CA 1 1 3 1316 1 1 17 LYS CB C -5.246 3.540 -6.949 1.00 . A A . 17 LYS CB 1 1 3 1317 1 1 17 LYS CD C -5.821 3.938 -9.394 1.00 . A A . 17 LYS CD 1 1 3 1318 1 1 17 LYS CE C -6.294 5.385 -9.261 1.00 . A A . 17 LYS CE 1 1 3 1319 1 1 17 LYS CG C -4.726 3.581 -8.390 1.00 . A A . 17 LYS CG 1 1 3 1320 1 1 17 LYS H H -5.688 3.234 -4.456 1.00 . A A . 17 LYS H 1 1 3 1321 1 1 17 LYS HA H -3.693 2.248 -6.193 1.00 . A A . 17 LYS HA 1 1 3 1322 1 1 17 LYS HB2 H -6.041 2.811 -6.896 1.00 . A A . 17 LYS HB2 1 1 3 1323 1 1 17 LYS HB3 H -5.645 4.513 -6.702 1.00 . A A . 17 LYS HB3 1 1 3 1324 1 1 17 LYS HD2 H -5.438 3.793 -10.392 1.00 . A A . 17 LYS HD2 1 1 3 1325 1 1 17 LYS HD3 H -6.660 3.277 -9.234 1.00 . A A . 17 LYS HD3 1 1 3 1326 1 1 17 LYS HE2 H -7.104 5.551 -9.955 1.00 . A A . 17 LYS HE2 1 1 3 1327 1 1 17 LYS HE3 H -6.653 5.550 -8.256 1.00 . A A . 17 LYS HE3 1 1 3 1328 1 1 17 LYS HG2 H -3.943 4.321 -8.454 1.00 . A A . 17 LYS HG2 1 1 3 1329 1 1 17 LYS HG3 H -4.320 2.612 -8.638 1.00 . A A . 17 LYS HG3 1 1 3 1330 1 1 17 LYS HZ1 H -4.430 6.278 -8.872 1.00 . A A . 17 LYS HZ1 1 1 3 1331 1 1 17 LYS HZ2 H -5.564 7.332 -9.513 1.00 . A A . 17 LYS HZ2 1 1 3 1332 1 1 17 LYS HZ3 H -4.822 6.190 -10.507 1.00 . A A . 17 LYS HZ3 1 1 3 1333 1 1 17 LYS N N -4.747 2.992 -4.601 1.00 . A A . 17 LYS N 1 1 3 1334 1 1 17 LYS NZ N -5.211 6.356 -9.556 1.00 . A A . 17 LYS NZ 1 1 3 1335 1 1 17 LYS O O -3.297 5.289 -5.145 1.00 . A A . 17 LYS O 1 1 3 1336 1 1 18 GLY C C 0.068 4.496 -5.357 1.00 . A A . 18 GLY C 1 1 3 1337 1 1 18 GLY CA C -0.908 4.950 -6.403 1.00 . A A . 18 GLY CA 1 1 3 1338 1 1 18 GLY H H -1.919 3.221 -7.023 1.00 . A A . 18 GLY H 1 1 3 1339 1 1 18 GLY HA2 H -0.416 4.995 -7.364 1.00 . A A . 18 GLY HA2 1 1 3 1340 1 1 18 GLY HA3 H -1.276 5.928 -6.139 1.00 . A A . 18 GLY HA3 1 1 3 1341 1 1 18 GLY N N -2.005 4.033 -6.476 1.00 . A A . 18 GLY N 1 1 3 1342 1 1 18 GLY O O 1.015 5.201 -5.005 1.00 . A A . 18 GLY O 1 1 3 1343 1 1 19 MET C C 1.054 1.338 -4.327 1.00 . A A . 19 MET C 1 1 3 1344 1 1 19 MET CA C 0.682 2.720 -3.861 1.00 . A A . 19 MET CA 1 1 3 1345 1 1 19 MET CB C 0.008 2.667 -2.494 1.00 . A A . 19 MET CB 1 1 3 1346 1 1 19 MET CE C -1.532 5.810 -0.307 1.00 . A A . 19 MET CE 1 1 3 1347 1 1 19 MET CG C -0.193 4.031 -1.896 1.00 . A A . 19 MET CG 1 1 3 1348 1 1 19 MET H H -1.028 2.865 -5.039 1.00 . A A . 19 MET H 1 1 3 1349 1 1 19 MET HA H 1.576 3.322 -3.788 1.00 . A A . 19 MET HA 1 1 3 1350 1 1 19 MET HB2 H -0.957 2.193 -2.599 1.00 . A A . 19 MET HB2 1 1 3 1351 1 1 19 MET HB3 H 0.618 2.083 -1.822 1.00 . A A . 19 MET HB3 1 1 3 1352 1 1 19 MET HE1 H -1.989 6.216 -1.197 1.00 . A A . 19 MET HE1 1 1 3 1353 1 1 19 MET HE2 H -0.566 6.270 -0.163 1.00 . A A . 19 MET HE2 1 1 3 1354 1 1 19 MET HE3 H -2.164 6.005 0.546 1.00 . A A . 19 MET HE3 1 1 3 1355 1 1 19 MET HG2 H 0.784 4.315 -1.529 1.00 . A A . 19 MET HG2 1 1 3 1356 1 1 19 MET HG3 H -0.531 4.721 -2.654 1.00 . A A . 19 MET HG3 1 1 3 1357 1 1 19 MET N N -0.191 3.331 -4.817 1.00 . A A . 19 MET N 1 1 3 1358 1 1 19 MET O O 0.377 0.756 -5.185 1.00 . A A . 19 MET O 1 1 3 1359 1 1 19 MET SD S -1.316 4.048 -0.500 1.00 . A A . 19 MET SD 1 1 3 1360 1 1 20 VAL C C 2.278 -1.338 -2.898 1.00 . A A . 20 VAL C 1 1 3 1361 1 1 20 VAL CA C 2.586 -0.474 -4.095 1.00 . A A . 20 VAL CA 1 1 3 1362 1 1 20 VAL CB C 4.120 -0.459 -4.346 1.00 . A A . 20 VAL CB 1 1 3 1363 1 1 20 VAL CG1 C 4.644 -1.847 -4.649 1.00 . A A . 20 VAL CG1 1 1 3 1364 1 1 20 VAL CG2 C 4.484 0.499 -5.468 1.00 . A A . 20 VAL CG2 1 1 3 1365 1 1 20 VAL H H 2.575 1.364 -3.108 1.00 . A A . 20 VAL H 1 1 3 1366 1 1 20 VAL HA H 2.075 -0.849 -4.969 1.00 . A A . 20 VAL HA 1 1 3 1367 1 1 20 VAL HB H 4.600 -0.117 -3.444 1.00 . A A . 20 VAL HB 1 1 3 1368 1 1 20 VAL HG11 H 5.708 -1.802 -4.831 1.00 . A A . 20 VAL HG11 1 1 3 1369 1 1 20 VAL HG12 H 4.141 -2.238 -5.521 1.00 . A A . 20 VAL HG12 1 1 3 1370 1 1 20 VAL HG13 H 4.451 -2.495 -3.806 1.00 . A A . 20 VAL HG13 1 1 3 1371 1 1 20 VAL HG21 H 3.997 0.183 -6.380 1.00 . A A . 20 VAL HG21 1 1 3 1372 1 1 20 VAL HG22 H 5.554 0.497 -5.612 1.00 . A A . 20 VAL HG22 1 1 3 1373 1 1 20 VAL HG23 H 4.156 1.495 -5.211 1.00 . A A . 20 VAL HG23 1 1 3 1374 1 1 20 VAL N N 2.100 0.835 -3.792 1.00 . A A . 20 VAL N 1 1 3 1375 1 1 20 VAL O O 2.631 -0.980 -1.762 1.00 . A A . 20 VAL O 1 1 3 1376 1 1 21 CYS C C 2.384 -4.182 -1.654 1.00 . A A . 21 CYS C 1 1 3 1377 1 1 21 CYS CA C 1.218 -3.287 -2.043 1.00 . A A . 21 CYS CA 1 1 3 1378 1 1 21 CYS CB C -0.022 -4.113 -2.405 1.00 . A A . 21 CYS CB 1 1 3 1379 1 1 21 CYS H H 1.383 -2.688 -4.046 1.00 . A A . 21 CYS H 1 1 3 1380 1 1 21 CYS HA H 0.984 -2.651 -1.202 1.00 . A A . 21 CYS HA 1 1 3 1381 1 1 21 CYS HB2 H -0.769 -3.463 -2.837 1.00 . A A . 21 CYS HB2 1 1 3 1382 1 1 21 CYS HB3 H 0.257 -4.867 -3.129 1.00 . A A . 21 CYS HB3 1 1 3 1383 1 1 21 CYS N N 1.605 -2.431 -3.126 1.00 . A A . 21 CYS N 1 1 3 1384 1 1 21 CYS O O 3.040 -4.784 -2.513 1.00 . A A . 21 CYS O 1 1 3 1385 1 1 21 CYS SG S -0.781 -4.964 -0.978 1.00 . A A . 21 CYS SG 1 1 3 1386 1 1 22 ARG C C 3.353 -5.250 1.633 1.00 . A A . 22 ARG C 1 1 3 1387 1 1 22 ARG CA C 3.730 -4.990 0.161 1.00 . A A . 22 ARG CA 1 1 3 1388 1 1 22 ARG CB C 5.015 -4.107 0.067 1.00 . A A . 22 ARG CB 1 1 3 1389 1 1 22 ARG CD C 6.561 -5.677 -1.144 1.00 . A A . 22 ARG CD 1 1 3 1390 1 1 22 ARG CG C 6.341 -4.852 0.118 1.00 . A A . 22 ARG CG 1 1 3 1391 1 1 22 ARG CZ C 6.516 -5.222 -3.601 1.00 . A A . 22 ARG CZ 1 1 3 1392 1 1 22 ARG H H 2.069 -3.779 0.266 1.00 . A A . 22 ARG H 1 1 3 1393 1 1 22 ARG HA H 3.863 -5.914 -0.379 1.00 . A A . 22 ARG HA 1 1 3 1394 1 1 22 ARG HB2 H 4.985 -3.562 -0.865 1.00 . A A . 22 ARG HB2 1 1 3 1395 1 1 22 ARG HB3 H 4.993 -3.396 0.879 1.00 . A A . 22 ARG HB3 1 1 3 1396 1 1 22 ARG HD2 H 7.431 -6.300 -1.009 1.00 . A A . 22 ARG HD2 1 1 3 1397 1 1 22 ARG HD3 H 5.695 -6.301 -1.305 1.00 . A A . 22 ARG HD3 1 1 3 1398 1 1 22 ARG HE H 7.149 -3.955 -2.143 1.00 . A A . 22 ARG HE 1 1 3 1399 1 1 22 ARG HG2 H 7.139 -4.132 0.208 1.00 . A A . 22 ARG HG2 1 1 3 1400 1 1 22 ARG HG3 H 6.358 -5.509 0.975 1.00 . A A . 22 ARG HG3 1 1 3 1401 1 1 22 ARG HH11 H 5.712 -7.051 -3.118 1.00 . A A . 22 ARG HH11 1 1 3 1402 1 1 22 ARG HH12 H 5.767 -6.738 -4.783 1.00 . A A . 22 ARG HH12 1 1 3 1403 1 1 22 ARG HH21 H 7.238 -3.504 -4.476 1.00 . A A . 22 ARG HH21 1 1 3 1404 1 1 22 ARG HH22 H 6.628 -4.663 -5.566 1.00 . A A . 22 ARG HH22 1 1 3 1405 1 1 22 ARG N N 2.646 -4.245 -0.380 1.00 . A A . 22 ARG N 1 1 3 1406 1 1 22 ARG NE N 6.766 -4.841 -2.336 1.00 . A A . 22 ARG NE 1 1 3 1407 1 1 22 ARG NH1 N 5.962 -6.413 -3.852 1.00 . A A . 22 ARG NH1 1 1 3 1408 1 1 22 ARG NH2 N 6.818 -4.407 -4.615 1.00 . A A . 22 ARG NH2 1 1 3 1409 1 1 22 ARG O O 2.181 -4.956 2.048 1.00 . A A . 22 ARG O 1 1 3 1410 1 1 23 LEU C C 3.596 -4.642 4.510 1.00 . A A . 23 LEU C 1 1 3 1411 1 1 23 LEU CA C 4.092 -5.943 3.881 1.00 . A A . 23 LEU CA 1 1 3 1412 1 1 23 LEU CB C 5.374 -6.408 4.581 1.00 . A A . 23 LEU CB 1 1 3 1413 1 1 23 LEU CD1 C 7.211 -8.064 4.943 1.00 . A A . 23 LEU CD1 1 1 3 1414 1 1 23 LEU CD2 C 4.904 -8.877 4.440 1.00 . A A . 23 LEU CD2 1 1 3 1415 1 1 23 LEU CG C 5.928 -7.777 4.182 1.00 . A A . 23 LEU CG 1 1 3 1416 1 1 23 LEU H H 5.150 -6.055 2.046 1.00 . A A . 23 LEU H 1 1 3 1417 1 1 23 LEU HA H 3.323 -6.691 4.005 1.00 . A A . 23 LEU HA 1 1 3 1418 1 1 23 LEU HB2 H 6.143 -5.676 4.388 1.00 . A A . 23 LEU HB2 1 1 3 1419 1 1 23 LEU HB3 H 5.179 -6.424 5.643 1.00 . A A . 23 LEU HB3 1 1 3 1420 1 1 23 LEU HD11 H 7.589 -9.033 4.656 1.00 . A A . 23 LEU HD11 1 1 3 1421 1 1 23 LEU HD12 H 7.010 -8.055 6.003 1.00 . A A . 23 LEU HD12 1 1 3 1422 1 1 23 LEU HD13 H 7.945 -7.307 4.709 1.00 . A A . 23 LEU HD13 1 1 3 1423 1 1 23 LEU HD21 H 5.330 -9.834 4.172 1.00 . A A . 23 LEU HD21 1 1 3 1424 1 1 23 LEU HD22 H 4.023 -8.702 3.840 1.00 . A A . 23 LEU HD22 1 1 3 1425 1 1 23 LEU HD23 H 4.634 -8.884 5.486 1.00 . A A . 23 LEU HD23 1 1 3 1426 1 1 23 LEU HG H 6.161 -7.767 3.129 1.00 . A A . 23 LEU HG 1 1 3 1427 1 1 23 LEU N N 4.303 -5.759 2.437 1.00 . A A . 23 LEU N 1 1 3 1428 1 1 23 LEU O O 2.857 -4.654 5.482 1.00 . A A . 23 LEU O 1 1 3 1429 1 1 24 TRP C C 3.112 -1.556 2.976 1.00 . A A . 24 TRP C 1 1 3 1430 1 1 24 TRP CA C 3.519 -2.243 4.287 1.00 . A A . 24 TRP CA 1 1 3 1431 1 1 24 TRP CB C 4.609 -1.434 5.018 1.00 . A A . 24 TRP CB 1 1 3 1432 1 1 24 TRP CD1 C 5.858 0.187 3.533 1.00 . A A . 24 TRP CD1 1 1 3 1433 1 1 24 TRP CD2 C 6.857 -1.790 3.726 1.00 . A A . 24 TRP CD2 1 1 3 1434 1 1 24 TRP CE2 C 7.627 -0.986 2.874 1.00 . A A . 24 TRP CE2 1 1 3 1435 1 1 24 TRP CE3 C 7.288 -3.085 4.002 1.00 . A A . 24 TRP CE3 1 1 3 1436 1 1 24 TRP CG C 5.730 -1.014 4.132 1.00 . A A . 24 TRP CG 1 1 3 1437 1 1 24 TRP CH2 C 9.195 -2.703 2.575 1.00 . A A . 24 TRP CH2 1 1 3 1438 1 1 24 TRP CZ2 C 8.800 -1.433 2.290 1.00 . A A . 24 TRP CZ2 1 1 3 1439 1 1 24 TRP CZ3 C 8.452 -3.528 3.423 1.00 . A A . 24 TRP CZ3 1 1 3 1440 1 1 24 TRP H H 4.618 -3.584 3.168 1.00 . A A . 24 TRP H 1 1 3 1441 1 1 24 TRP HA H 2.671 -2.412 4.928 1.00 . A A . 24 TRP HA 1 1 3 1442 1 1 24 TRP HB2 H 4.168 -0.542 5.437 1.00 . A A . 24 TRP HB2 1 1 3 1443 1 1 24 TRP HB3 H 5.017 -2.036 5.817 1.00 . A A . 24 TRP HB3 1 1 3 1444 1 1 24 TRP HD1 H 5.128 0.974 3.664 1.00 . A A . 24 TRP HD1 1 1 3 1445 1 1 24 TRP HE1 H 7.307 0.981 2.238 1.00 . A A . 24 TRP HE1 1 1 3 1446 1 1 24 TRP HE3 H 6.726 -3.730 4.659 1.00 . A A . 24 TRP HE3 1 1 3 1447 1 1 24 TRP HH2 H 10.104 -3.091 2.139 1.00 . A A . 24 TRP HH2 1 1 3 1448 1 1 24 TRP HZ2 H 9.391 -0.815 1.630 1.00 . A A . 24 TRP HZ2 1 1 3 1449 1 1 24 TRP HZ3 H 8.803 -4.531 3.623 1.00 . A A . 24 TRP HZ3 1 1 3 1450 1 1 24 TRP N N 3.994 -3.539 3.924 1.00 . A A . 24 TRP N 1 1 3 1451 1 1 24 TRP NE1 N 6.993 0.216 2.771 1.00 . A A . 24 TRP NE1 1 1 3 1452 1 1 24 TRP O O 3.431 -2.077 1.912 1.00 . A A . 24 TRP O 1 1 3 1453 1 1 25 CYS C C 3.221 1.184 1.395 1.00 . A A . 25 CYS C 1 1 3 1454 1 1 25 CYS CA C 2.115 0.238 1.787 1.00 . A A . 25 CYS CA 1 1 3 1455 1 1 25 CYS CB C 0.763 0.935 1.811 1.00 . A A . 25 CYS CB 1 1 3 1456 1 1 25 CYS H H 2.117 -0.058 3.868 1.00 . A A . 25 CYS H 1 1 3 1457 1 1 25 CYS HA H 2.091 -0.532 1.028 1.00 . A A . 25 CYS HA 1 1 3 1458 1 1 25 CYS HB2 H 0.633 1.420 2.767 1.00 . A A . 25 CYS HB2 1 1 3 1459 1 1 25 CYS HB3 H 0.736 1.679 1.029 1.00 . A A . 25 CYS HB3 1 1 3 1460 1 1 25 CYS N N 2.423 -0.454 3.022 1.00 . A A . 25 CYS N 1 1 3 1461 1 1 25 CYS O O 3.671 2.018 2.191 1.00 . A A . 25 CYS O 1 1 3 1462 1 1 25 CYS SG S -0.654 -0.183 1.564 1.00 . A A . 25 CYS SG 1 1 3 1463 1 1 26 LYS C C 4.127 2.767 -1.363 1.00 . A A . 26 LYS C 1 1 3 1464 1 1 26 LYS CA C 4.731 1.827 -0.349 1.00 . A A . 26 LYS CA 1 1 3 1465 1 1 26 LYS CB C 5.761 0.893 -1.013 1.00 . A A . 26 LYS CB 1 1 3 1466 1 1 26 LYS CD C 7.795 0.613 -2.459 1.00 . A A . 26 LYS CD 1 1 3 1467 1 1 26 LYS CE C 8.950 1.315 -3.162 1.00 . A A . 26 LYS CE 1 1 3 1468 1 1 26 LYS CG C 6.919 1.597 -1.708 1.00 . A A . 26 LYS CG 1 1 3 1469 1 1 26 LYS H H 3.214 0.409 -0.413 1.00 . A A . 26 LYS H 1 1 3 1470 1 1 26 LYS HA H 5.203 2.380 0.448 1.00 . A A . 26 LYS HA 1 1 3 1471 1 1 26 LYS HB2 H 6.180 0.261 -0.243 1.00 . A A . 26 LYS HB2 1 1 3 1472 1 1 26 LYS HB3 H 5.255 0.264 -1.726 1.00 . A A . 26 LYS HB3 1 1 3 1473 1 1 26 LYS HD2 H 8.190 -0.107 -1.759 1.00 . A A . 26 LYS HD2 1 1 3 1474 1 1 26 LYS HD3 H 7.193 0.100 -3.198 1.00 . A A . 26 LYS HD3 1 1 3 1475 1 1 26 LYS HE2 H 8.553 2.041 -3.856 1.00 . A A . 26 LYS HE2 1 1 3 1476 1 1 26 LYS HE3 H 9.551 1.820 -2.420 1.00 . A A . 26 LYS HE3 1 1 3 1477 1 1 26 LYS HG2 H 6.523 2.319 -2.407 1.00 . A A . 26 LYS HG2 1 1 3 1478 1 1 26 LYS HG3 H 7.516 2.104 -0.965 1.00 . A A . 26 LYS HG3 1 1 3 1479 1 1 26 LYS HZ1 H 10.594 0.842 -4.372 1.00 . A A . 26 LYS HZ1 1 1 3 1480 1 1 26 LYS HZ2 H 9.246 -0.132 -4.628 1.00 . A A . 26 LYS HZ2 1 1 3 1481 1 1 26 LYS HZ3 H 10.197 -0.357 -3.257 1.00 . A A . 26 LYS HZ3 1 1 3 1482 1 1 26 LYS N N 3.663 1.045 0.187 1.00 . A A . 26 LYS N 1 1 3 1483 1 1 26 LYS NZ N 9.803 0.360 -3.901 1.00 . A A . 26 LYS NZ 1 1 3 1484 1 1 26 LYS O O 3.106 2.455 -1.938 1.00 . A A . 26 LYS O 1 1 3 1485 1 1 27 LYS C C 4.688 4.484 -3.913 1.00 . A A . 27 LYS C 1 1 3 1486 1 1 27 LYS CA C 4.197 4.845 -2.519 1.00 . A A . 27 LYS CA 1 1 3 1487 1 1 27 LYS CB C 4.645 6.250 -2.140 1.00 . A A . 27 LYS CB 1 1 3 1488 1 1 27 LYS CD C 4.807 7.977 -0.316 1.00 . A A . 27 LYS CD 1 1 3 1489 1 1 27 LYS CE C 4.314 8.383 1.060 1.00 . A A . 27 LYS CE 1 1 3 1490 1 1 27 LYS CG C 4.166 6.679 -0.761 1.00 . A A . 27 LYS CG 1 1 3 1491 1 1 27 LYS H H 5.540 4.102 -1.074 1.00 . A A . 27 LYS H 1 1 3 1492 1 1 27 LYS HA H 3.119 4.798 -2.495 1.00 . A A . 27 LYS HA 1 1 3 1493 1 1 27 LYS HB2 H 5.724 6.283 -2.174 1.00 . A A . 27 LYS HB2 1 1 3 1494 1 1 27 LYS HB3 H 4.255 6.945 -2.867 1.00 . A A . 27 LYS HB3 1 1 3 1495 1 1 27 LYS HD2 H 5.878 7.842 -0.281 1.00 . A A . 27 LYS HD2 1 1 3 1496 1 1 27 LYS HD3 H 4.561 8.752 -1.026 1.00 . A A . 27 LYS HD3 1 1 3 1497 1 1 27 LYS HE2 H 3.260 8.609 0.996 1.00 . A A . 27 LYS HE2 1 1 3 1498 1 1 27 LYS HE3 H 4.452 7.552 1.734 1.00 . A A . 27 LYS HE3 1 1 3 1499 1 1 27 LYS HG2 H 3.095 6.810 -0.786 1.00 . A A . 27 LYS HG2 1 1 3 1500 1 1 27 LYS HG3 H 4.414 5.901 -0.054 1.00 . A A . 27 LYS HG3 1 1 3 1501 1 1 27 LYS HZ1 H 6.035 9.357 1.725 1.00 . A A . 27 LYS HZ1 1 1 3 1502 1 1 27 LYS HZ2 H 4.630 9.857 2.511 1.00 . A A . 27 LYS HZ2 1 1 3 1503 1 1 27 LYS HZ3 H 4.945 10.388 0.956 1.00 . A A . 27 LYS HZ3 1 1 3 1504 1 1 27 LYS N N 4.716 3.897 -1.563 1.00 . A A . 27 LYS N 1 1 3 1505 1 1 27 LYS NZ N 5.025 9.568 1.592 1.00 . A A . 27 LYS NZ 1 1 3 1506 1 1 27 LYS O O 5.783 3.954 -4.069 1.00 . A A . 27 LYS O 1 1 3 1507 1 1 28 LYS C C 4.918 5.748 -6.759 1.00 . A A . 28 LYS C 1 1 3 1508 1 1 28 LYS CA C 4.250 4.479 -6.279 1.00 . A A . 28 LYS CA 1 1 3 1509 1 1 28 LYS CB C 2.989 4.205 -7.125 1.00 . A A . 28 LYS CB 1 1 3 1510 1 1 28 LYS CD C 3.672 2.215 -8.531 1.00 . A A . 28 LYS CD 1 1 3 1511 1 1 28 LYS CE C 3.531 1.553 -9.902 1.00 . A A . 28 LYS CE 1 1 3 1512 1 1 28 LYS CG C 3.193 3.662 -8.543 1.00 . A A . 28 LYS CG 1 1 3 1513 1 1 28 LYS H H 2.979 5.089 -4.703 1.00 . A A . 28 LYS H 1 1 3 1514 1 1 28 LYS HA H 4.929 3.640 -6.327 1.00 . A A . 28 LYS HA 1 1 3 1515 1 1 28 LYS HB2 H 2.377 3.492 -6.594 1.00 . A A . 28 LYS HB2 1 1 3 1516 1 1 28 LYS HB3 H 2.434 5.129 -7.195 1.00 . A A . 28 LYS HB3 1 1 3 1517 1 1 28 LYS HD2 H 4.711 2.190 -8.239 1.00 . A A . 28 LYS HD2 1 1 3 1518 1 1 28 LYS HD3 H 3.083 1.662 -7.813 1.00 . A A . 28 LYS HD3 1 1 3 1519 1 1 28 LYS HE2 H 3.798 0.511 -9.811 1.00 . A A . 28 LYS HE2 1 1 3 1520 1 1 28 LYS HE3 H 2.499 1.625 -10.207 1.00 . A A . 28 LYS HE3 1 1 3 1521 1 1 28 LYS HG2 H 2.256 3.715 -9.078 1.00 . A A . 28 LYS HG2 1 1 3 1522 1 1 28 LYS HG3 H 3.928 4.273 -9.048 1.00 . A A . 28 LYS HG3 1 1 3 1523 1 1 28 LYS HZ1 H 4.160 1.771 -11.875 1.00 . A A . 28 LYS HZ1 1 1 3 1524 1 1 28 LYS HZ2 H 5.388 1.957 -10.758 1.00 . A A . 28 LYS HZ2 1 1 3 1525 1 1 28 LYS HZ3 H 4.303 3.205 -10.998 1.00 . A A . 28 LYS HZ3 1 1 3 1526 1 1 28 LYS N N 3.870 4.723 -4.900 1.00 . A A . 28 LYS N 1 1 3 1527 1 1 28 LYS NZ N 4.385 2.165 -10.939 1.00 . A A . 28 LYS NZ 1 1 3 1528 1 1 28 LYS O O 4.248 6.776 -6.921 1.00 . A A . 28 LYS O 1 1 3 1529 1 1 29 LEU C C 6.786 7.079 -8.819 1.00 . A A . 29 LEU C 1 1 3 1530 1 1 29 LEU CA C 6.945 6.898 -7.328 1.00 . A A . 29 LEU CA 1 1 3 1531 1 1 29 LEU CB C 8.448 6.842 -6.961 1.00 . A A . 29 LEU CB 1 1 3 1532 1 1 29 LEU CD1 C 8.564 5.415 -4.863 1.00 . A A . 29 LEU CD1 1 1 3 1533 1 1 29 LEU CD2 C 10.298 7.165 -5.282 1.00 . A A . 29 LEU CD2 1 1 3 1534 1 1 29 LEU CG C 8.838 6.781 -5.469 1.00 . A A . 29 LEU CG 1 1 3 1535 1 1 29 LEU H H 6.686 4.876 -6.727 1.00 . A A . 29 LEU H 1 1 3 1536 1 1 29 LEU HA H 6.492 7.746 -6.836 1.00 . A A . 29 LEU HA 1 1 3 1537 1 1 29 LEU HB2 H 8.868 5.971 -7.440 1.00 . A A . 29 LEU HB2 1 1 3 1538 1 1 29 LEU HB3 H 8.920 7.712 -7.395 1.00 . A A . 29 LEU HB3 1 1 3 1539 1 1 29 LEU HD11 H 8.860 5.419 -3.825 1.00 . A A . 29 LEU HD11 1 1 3 1540 1 1 29 LEU HD12 H 9.127 4.664 -5.395 1.00 . A A . 29 LEU HD12 1 1 3 1541 1 1 29 LEU HD13 H 7.509 5.194 -4.935 1.00 . A A . 29 LEU HD13 1 1 3 1542 1 1 29 LEU HD21 H 10.457 8.171 -5.640 1.00 . A A . 29 LEU HD21 1 1 3 1543 1 1 29 LEU HD22 H 10.922 6.483 -5.841 1.00 . A A . 29 LEU HD22 1 1 3 1544 1 1 29 LEU HD23 H 10.553 7.110 -4.234 1.00 . A A . 29 LEU HD23 1 1 3 1545 1 1 29 LEU HG H 8.237 7.498 -4.929 1.00 . A A . 29 LEU HG 1 1 3 1546 1 1 29 LEU N N 6.213 5.719 -6.905 1.00 . A A . 29 LEU N 1 1 3 1547 1 1 29 LEU O O 6.459 8.179 -9.303 1.00 . A A . 29 LEU O 1 1 3 1548 1 1 30 TRP C C 6.040 4.797 -11.357 1.00 . A A . 30 TRP C 1 1 3 1549 1 1 30 TRP CA C 6.860 5.998 -10.975 1.00 . A A . 30 TRP CA 1 1 3 1550 1 1 30 TRP CB C 8.240 5.932 -11.667 1.00 . A A . 30 TRP CB 1 1 3 1551 1 1 30 TRP CD1 C 9.117 8.319 -11.923 1.00 . A A . 30 TRP CD1 1 1 3 1552 1 1 30 TRP CD2 C 10.214 7.110 -10.403 1.00 . A A . 30 TRP CD2 1 1 3 1553 1 1 30 TRP CE2 C 10.782 8.395 -10.443 1.00 . A A . 30 TRP CE2 1 1 3 1554 1 1 30 TRP CE3 C 10.743 6.172 -9.519 1.00 . A A . 30 TRP CE3 1 1 3 1555 1 1 30 TRP CG C 9.143 7.086 -11.354 1.00 . A A . 30 TRP CG 1 1 3 1556 1 1 30 TRP CH2 C 12.345 7.824 -8.782 1.00 . A A . 30 TRP CH2 1 1 3 1557 1 1 30 TRP CZ2 C 11.849 8.763 -9.635 1.00 . A A . 30 TRP CZ2 1 1 3 1558 1 1 30 TRP CZ3 C 11.804 6.538 -8.719 1.00 . A A . 30 TRP CZ3 1 1 3 1559 1 1 30 TRP H H 7.210 5.163 -9.089 1.00 . A A . 30 TRP H 1 1 3 1560 1 1 30 TRP HA H 6.346 6.897 -11.279 1.00 . A A . 30 TRP HA 1 1 3 1561 1 1 30 TRP HB2 H 8.745 5.030 -11.356 1.00 . A A . 30 TRP HB2 1 1 3 1562 1 1 30 TRP HB3 H 8.091 5.901 -12.736 1.00 . A A . 30 TRP HB3 1 1 3 1563 1 1 30 TRP HD1 H 8.417 8.619 -12.690 1.00 . A A . 30 TRP HD1 1 1 3 1564 1 1 30 TRP HE1 H 10.256 10.052 -11.631 1.00 . A A . 30 TRP HE1 1 1 3 1565 1 1 30 TRP HE3 H 10.339 5.172 -9.454 1.00 . A A . 30 TRP HE3 1 1 3 1566 1 1 30 TRP HH2 H 13.176 8.067 -8.136 1.00 . A A . 30 TRP HH2 1 1 3 1567 1 1 30 TRP HZ2 H 12.282 9.751 -9.664 1.00 . A A . 30 TRP HZ2 1 1 3 1568 1 1 30 TRP HZ3 H 12.227 5.825 -8.028 1.00 . A A . 30 TRP HZ3 1 1 3 1569 1 1 30 TRP N N 6.989 6.007 -9.539 1.00 . A A . 30 TRP N 1 1 3 1570 1 1 30 TRP NE1 N 10.091 9.115 -11.375 1.00 . A A . 30 TRP NE1 1 1 3 1571 1 1 30 TRP O O 4.795 4.884 -11.382 1.00 . A A . 30 TRP O 1 1 3 1572 1 1 30 TRP OXT O 6.622 3.720 -11.562 1.00 . A A . 30 TRP OXT 1 1 4 1573 1 1 1 TYR C C -9.760 0.621 2.325 1.00 . A A . 1 TYR C 1 1 4 1574 1 1 1 TYR CA C -10.815 0.233 3.324 1.00 . A A . 1 TYR CA 1 1 4 1575 1 1 1 TYR CB C -12.196 0.743 2.897 1.00 . A A . 1 TYR CB 1 1 4 1576 1 1 1 TYR CD1 C -13.135 -1.245 1.665 1.00 . A A . 1 TYR CD1 1 1 4 1577 1 1 1 TYR CD2 C -12.884 0.796 0.467 1.00 . A A . 1 TYR CD2 1 1 4 1578 1 1 1 TYR CE1 C -13.653 -1.848 0.546 1.00 . A A . 1 TYR CE1 1 1 4 1579 1 1 1 TYR CE2 C -13.397 0.198 -0.659 1.00 . A A . 1 TYR CE2 1 1 4 1580 1 1 1 TYR CG C -12.741 0.086 1.650 1.00 . A A . 1 TYR CG 1 1 4 1581 1 1 1 TYR CZ C -13.782 -1.126 -0.613 1.00 . A A . 1 TYR CZ 1 1 4 1582 1 1 1 TYR H1 H -11.113 0.545 5.368 1.00 . A A . 1 TYR H1 1 1 4 1583 1 1 1 TYR H2 H -10.347 1.812 4.585 1.00 . A A . 1 TYR H2 1 1 4 1584 1 1 1 TYR H3 H -9.509 0.406 4.908 1.00 . A A . 1 TYR H3 1 1 4 1585 1 1 1 TYR HA H -10.828 -0.845 3.404 1.00 . A A . 1 TYR HA 1 1 4 1586 1 1 1 TYR HB2 H -12.904 0.567 3.693 1.00 . A A . 1 TYR HB2 1 1 4 1587 1 1 1 TYR HB3 H -12.133 1.805 2.712 1.00 . A A . 1 TYR HB3 1 1 4 1588 1 1 1 TYR HD1 H -13.034 -1.817 2.577 1.00 . A A . 1 TYR HD1 1 1 4 1589 1 1 1 TYR HD2 H -12.583 1.833 0.429 1.00 . A A . 1 TYR HD2 1 1 4 1590 1 1 1 TYR HE1 H -13.952 -2.886 0.587 1.00 . A A . 1 TYR HE1 1 1 4 1591 1 1 1 TYR HE2 H -13.494 0.777 -1.566 1.00 . A A . 1 TYR HE2 1 1 4 1592 1 1 1 TYR HH H -15.082 -2.240 -1.460 1.00 . A A . 1 TYR HH 1 1 4 1593 1 1 1 TYR N N -10.434 0.780 4.617 1.00 . A A . 1 TYR N 1 1 4 1594 1 1 1 TYR O O -9.087 -0.239 1.752 1.00 . A A . 1 TYR O 1 1 4 1595 1 1 1 TYR OH O -14.314 -1.720 -1.728 1.00 . A A . 1 TYR OH 1 1 4 1596 1 1 2 CYS C C -7.358 2.449 2.263 1.00 . A A . 2 CYS C 1 1 4 1597 1 1 2 CYS CA C -8.514 2.360 1.320 1.00 . A A . 2 CYS CA 1 1 4 1598 1 1 2 CYS CB C -8.782 3.715 0.696 1.00 . A A . 2 CYS CB 1 1 4 1599 1 1 2 CYS H H -10.191 2.576 2.512 1.00 . A A . 2 CYS H 1 1 4 1600 1 1 2 CYS HA H -8.305 1.620 0.559 1.00 . A A . 2 CYS HA 1 1 4 1601 1 1 2 CYS HB2 H -9.761 3.725 0.247 1.00 . A A . 2 CYS HB2 1 1 4 1602 1 1 2 CYS HB3 H -8.716 4.442 1.490 1.00 . A A . 2 CYS HB3 1 1 4 1603 1 1 2 CYS N N -9.598 1.906 2.113 1.00 . A A . 2 CYS N 1 1 4 1604 1 1 2 CYS O O -7.530 2.838 3.425 1.00 . A A . 2 CYS O 1 1 4 1605 1 1 2 CYS SG S -7.565 4.199 -0.581 1.00 . A A . 2 CYS SG 1 1 4 1606 1 1 3 GLN C C -4.221 3.204 2.593 1.00 . A A . 3 GLN C 1 1 4 1607 1 1 3 GLN CA C -5.103 1.995 2.690 1.00 . A A . 3 GLN CA 1 1 4 1608 1 1 3 GLN CB C -4.316 0.706 2.468 1.00 . A A . 3 GLN CB 1 1 4 1609 1 1 3 GLN CD C -5.773 -0.674 4.044 1.00 . A A . 3 GLN CD 1 1 4 1610 1 1 3 GLN CG C -5.134 -0.575 2.665 1.00 . A A . 3 GLN CG 1 1 4 1611 1 1 3 GLN H H -6.156 1.950 0.845 1.00 . A A . 3 GLN H 1 1 4 1612 1 1 3 GLN HA H -5.524 1.967 3.682 1.00 . A A . 3 GLN HA 1 1 4 1613 1 1 3 GLN HB2 H -3.928 0.717 1.461 1.00 . A A . 3 GLN HB2 1 1 4 1614 1 1 3 GLN HB3 H -3.485 0.688 3.159 1.00 . A A . 3 GLN HB3 1 1 4 1615 1 1 3 GLN HE21 H -4.175 -1.597 4.761 1.00 . A A . 3 GLN HE21 1 1 4 1616 1 1 3 GLN HE22 H -5.476 -1.305 5.875 1.00 . A A . 3 GLN HE22 1 1 4 1617 1 1 3 GLN HG2 H -5.919 -0.599 1.926 1.00 . A A . 3 GLN HG2 1 1 4 1618 1 1 3 GLN HG3 H -4.484 -1.426 2.522 1.00 . A A . 3 GLN HG3 1 1 4 1619 1 1 3 GLN N N -6.223 2.092 1.810 1.00 . A A . 3 GLN N 1 1 4 1620 1 1 3 GLN NE2 N -5.068 -1.254 4.983 1.00 . A A . 3 GLN NE2 1 1 4 1621 1 1 3 GLN O O -4.042 3.777 1.516 1.00 . A A . 3 GLN O 1 1 4 1622 1 1 3 GLN OE1 O -6.903 -0.235 4.258 1.00 . A A . 3 GLN OE1 1 1 4 1623 1 1 4 LYS C C -1.405 4.239 3.776 1.00 . A A . 4 LYS C 1 1 4 1624 1 1 4 LYS CA C -2.830 4.738 3.834 1.00 . A A . 4 LYS CA 1 1 4 1625 1 1 4 LYS CB C -3.046 5.450 5.175 1.00 . A A . 4 LYS CB 1 1 4 1626 1 1 4 LYS CD C -4.606 6.592 6.774 1.00 . A A . 4 LYS CD 1 1 4 1627 1 1 4 LYS CE C -6.044 6.998 7.035 1.00 . A A . 4 LYS CE 1 1 4 1628 1 1 4 LYS CG C -4.471 5.899 5.425 1.00 . A A . 4 LYS CG 1 1 4 1629 1 1 4 LYS H H -3.931 3.102 4.536 1.00 . A A . 4 LYS H 1 1 4 1630 1 1 4 LYS HA H -3.030 5.426 3.027 1.00 . A A . 4 LYS HA 1 1 4 1631 1 1 4 LYS HB2 H -2.763 4.778 5.972 1.00 . A A . 4 LYS HB2 1 1 4 1632 1 1 4 LYS HB3 H -2.404 6.319 5.210 1.00 . A A . 4 LYS HB3 1 1 4 1633 1 1 4 LYS HD2 H -4.284 5.913 7.552 1.00 . A A . 4 LYS HD2 1 1 4 1634 1 1 4 LYS HD3 H -3.980 7.472 6.780 1.00 . A A . 4 LYS HD3 1 1 4 1635 1 1 4 LYS HE2 H -6.361 7.678 6.260 1.00 . A A . 4 LYS HE2 1 1 4 1636 1 1 4 LYS HE3 H -6.655 6.108 7.003 1.00 . A A . 4 LYS HE3 1 1 4 1637 1 1 4 LYS HG2 H -4.763 6.584 4.644 1.00 . A A . 4 LYS HG2 1 1 4 1638 1 1 4 LYS HG3 H -5.117 5.035 5.406 1.00 . A A . 4 LYS HG3 1 1 4 1639 1 1 4 LYS HZ1 H -5.864 7.056 9.115 1.00 . A A . 4 LYS HZ1 1 1 4 1640 1 1 4 LYS HZ2 H -7.236 7.805 8.534 1.00 . A A . 4 LYS HZ2 1 1 4 1641 1 1 4 LYS HZ3 H -5.742 8.580 8.390 1.00 . A A . 4 LYS HZ3 1 1 4 1642 1 1 4 LYS N N -3.712 3.606 3.728 1.00 . A A . 4 LYS N 1 1 4 1643 1 1 4 LYS NZ N -6.223 7.658 8.348 1.00 . A A . 4 LYS NZ 1 1 4 1644 1 1 4 LYS O O -1.164 3.045 3.928 1.00 . A A . 4 LYS O 1 1 4 1645 1 1 5 TRP C C 1.436 4.215 4.887 1.00 . A A . 5 TRP C 1 1 4 1646 1 1 5 TRP CA C 0.987 4.849 3.568 1.00 . A A . 5 TRP CA 1 1 4 1647 1 1 5 TRP CB C 1.795 6.157 3.357 1.00 . A A . 5 TRP CB 1 1 4 1648 1 1 5 TRP CD1 C 0.685 7.897 4.900 1.00 . A A . 5 TRP CD1 1 1 4 1649 1 1 5 TRP CD2 C 2.738 7.307 5.550 1.00 . A A . 5 TRP CD2 1 1 4 1650 1 1 5 TRP CE2 C 2.227 8.241 6.468 1.00 . A A . 5 TRP CE2 1 1 4 1651 1 1 5 TRP CE3 C 4.018 6.795 5.757 1.00 . A A . 5 TRP CE3 1 1 4 1652 1 1 5 TRP CG C 1.728 7.100 4.547 1.00 . A A . 5 TRP CG 1 1 4 1653 1 1 5 TRP CH2 C 4.201 8.148 7.751 1.00 . A A . 5 TRP CH2 1 1 4 1654 1 1 5 TRP CZ2 C 2.951 8.669 7.576 1.00 . A A . 5 TRP CZ2 1 1 4 1655 1 1 5 TRP CZ3 C 4.736 7.220 6.854 1.00 . A A . 5 TRP CZ3 1 1 4 1656 1 1 5 TRP H H -0.742 6.097 3.551 1.00 . A A . 5 TRP H 1 1 4 1657 1 1 5 TRP HA H 1.175 4.177 2.745 1.00 . A A . 5 TRP HA 1 1 4 1658 1 1 5 TRP HB2 H 2.831 5.909 3.188 1.00 . A A . 5 TRP HB2 1 1 4 1659 1 1 5 TRP HB3 H 1.406 6.678 2.493 1.00 . A A . 5 TRP HB3 1 1 4 1660 1 1 5 TRP HD1 H -0.239 7.960 4.347 1.00 . A A . 5 TRP HD1 1 1 4 1661 1 1 5 TRP HE1 H 0.373 9.214 6.504 1.00 . A A . 5 TRP HE1 1 1 4 1662 1 1 5 TRP HE3 H 4.449 6.076 5.074 1.00 . A A . 5 TRP HE3 1 1 4 1663 1 1 5 TRP HH2 H 4.798 8.452 8.598 1.00 . A A . 5 TRP HH2 1 1 4 1664 1 1 5 TRP HZ2 H 2.554 9.385 8.281 1.00 . A A . 5 TRP HZ2 1 1 4 1665 1 1 5 TRP HZ3 H 5.729 6.828 7.026 1.00 . A A . 5 TRP HZ3 1 1 4 1666 1 1 5 TRP N N -0.462 5.162 3.629 1.00 . A A . 5 TRP N 1 1 4 1667 1 1 5 TRP NE1 N 0.972 8.578 6.051 1.00 . A A . 5 TRP NE1 1 1 4 1668 1 1 5 TRP O O 2.432 3.500 4.956 1.00 . A A . 5 TRP O 1 1 4 1669 1 1 6 MET C C 0.566 2.661 7.478 1.00 . A A . 6 MET C 1 1 4 1670 1 1 6 MET CA C 0.961 4.111 7.254 1.00 . A A . 6 MET CA 1 1 4 1671 1 1 6 MET CB C 0.221 5.035 8.223 1.00 . A A . 6 MET CB 1 1 4 1672 1 1 6 MET CE C 0.543 7.411 10.345 1.00 . A A . 6 MET CE 1 1 4 1673 1 1 6 MET CG C 0.430 4.710 9.690 1.00 . A A . 6 MET CG 1 1 4 1674 1 1 6 MET H H -0.119 5.060 5.746 1.00 . A A . 6 MET H 1 1 4 1675 1 1 6 MET HA H 2.018 4.265 7.388 1.00 . A A . 6 MET HA 1 1 4 1676 1 1 6 MET HB2 H 0.557 6.045 8.049 1.00 . A A . 6 MET HB2 1 1 4 1677 1 1 6 MET HB3 H -0.836 4.980 8.010 1.00 . A A . 6 MET HB3 1 1 4 1678 1 1 6 MET HE1 H 1.598 7.266 10.517 1.00 . A A . 6 MET HE1 1 1 4 1679 1 1 6 MET HE2 H 0.194 8.230 10.956 1.00 . A A . 6 MET HE2 1 1 4 1680 1 1 6 MET HE3 H 0.375 7.644 9.305 1.00 . A A . 6 MET HE3 1 1 4 1681 1 1 6 MET HG2 H 0.007 3.735 9.886 1.00 . A A . 6 MET HG2 1 1 4 1682 1 1 6 MET HG3 H 1.491 4.682 9.875 1.00 . A A . 6 MET HG3 1 1 4 1683 1 1 6 MET N N 0.675 4.518 5.919 1.00 . A A . 6 MET N 1 1 4 1684 1 1 6 MET O O 1.119 1.975 8.337 1.00 . A A . 6 MET O 1 1 4 1685 1 1 6 MET SD S -0.348 5.914 10.791 1.00 . A A . 6 MET SD 1 1 4 1686 1 1 7 TRP C C -0.104 -0.079 5.909 1.00 . A A . 7 TRP C 1 1 4 1687 1 1 7 TRP CA C -0.846 0.848 6.840 1.00 . A A . 7 TRP CA 1 1 4 1688 1 1 7 TRP CB C -2.368 0.743 6.642 1.00 . A A . 7 TRP CB 1 1 4 1689 1 1 7 TRP CD1 C -2.815 1.876 8.915 1.00 . A A . 7 TRP CD1 1 1 4 1690 1 1 7 TRP CD2 C -4.480 2.078 7.439 1.00 . A A . 7 TRP CD2 1 1 4 1691 1 1 7 TRP CE2 C -4.844 2.752 8.617 1.00 . A A . 7 TRP CE2 1 1 4 1692 1 1 7 TRP CE3 C -5.368 2.062 6.378 1.00 . A A . 7 TRP CE3 1 1 4 1693 1 1 7 TRP CG C -3.170 1.544 7.636 1.00 . A A . 7 TRP CG 1 1 4 1694 1 1 7 TRP CH2 C -6.918 3.368 7.686 1.00 . A A . 7 TRP CH2 1 1 4 1695 1 1 7 TRP CZ2 C -6.065 3.404 8.753 1.00 . A A . 7 TRP CZ2 1 1 4 1696 1 1 7 TRP CZ3 C -6.580 2.702 6.508 1.00 . A A . 7 TRP CZ3 1 1 4 1697 1 1 7 TRP H H -0.681 2.749 5.950 1.00 . A A . 7 TRP H 1 1 4 1698 1 1 7 TRP HA H -0.606 0.549 7.851 1.00 . A A . 7 TRP HA 1 1 4 1699 1 1 7 TRP HB2 H -2.618 1.100 5.655 1.00 . A A . 7 TRP HB2 1 1 4 1700 1 1 7 TRP HB3 H -2.664 -0.292 6.727 1.00 . A A . 7 TRP HB3 1 1 4 1701 1 1 7 TRP HD1 H -1.876 1.607 9.379 1.00 . A A . 7 TRP HD1 1 1 4 1702 1 1 7 TRP HE1 H -3.785 2.994 10.410 1.00 . A A . 7 TRP HE1 1 1 4 1703 1 1 7 TRP HE3 H -5.116 1.539 5.469 1.00 . A A . 7 TRP HE3 1 1 4 1704 1 1 7 TRP HH2 H -7.880 3.856 7.745 1.00 . A A . 7 TRP HH2 1 1 4 1705 1 1 7 TRP HZ2 H -6.347 3.925 9.656 1.00 . A A . 7 TRP HZ2 1 1 4 1706 1 1 7 TRP HZ3 H -7.279 2.694 5.684 1.00 . A A . 7 TRP HZ3 1 1 4 1707 1 1 7 TRP N N -0.364 2.194 6.693 1.00 . A A . 7 TRP N 1 1 4 1708 1 1 7 TRP NE1 N -3.812 2.617 9.500 1.00 . A A . 7 TRP NE1 1 1 4 1709 1 1 7 TRP O O 0.734 0.354 5.112 1.00 . A A . 7 TRP O 1 1 4 1710 1 1 8 THR C C -0.720 -3.128 4.455 1.00 . A A . 8 THR C 1 1 4 1711 1 1 8 THR CA C 0.306 -2.335 5.266 1.00 . A A . 8 THR CA 1 1 4 1712 1 1 8 THR CB C 1.042 -3.270 6.250 1.00 . A A . 8 THR CB 1 1 4 1713 1 1 8 THR CG2 C 2.039 -2.480 7.111 1.00 . A A . 8 THR CG2 1 1 4 1714 1 1 8 THR H H -1.067 -1.636 6.651 1.00 . A A . 8 THR H 1 1 4 1715 1 1 8 THR HA H 1.022 -1.856 4.619 1.00 . A A . 8 THR HA 1 1 4 1716 1 1 8 THR HB H 1.571 -4.030 5.695 1.00 . A A . 8 THR HB 1 1 4 1717 1 1 8 THR HG1 H 0.180 -3.509 8.014 1.00 . A A . 8 THR HG1 1 1 4 1718 1 1 8 THR HG21 H 2.587 -3.155 7.752 1.00 . A A . 8 THR HG21 1 1 4 1719 1 1 8 THR HG22 H 1.492 -1.778 7.722 1.00 . A A . 8 THR HG22 1 1 4 1720 1 1 8 THR HG23 H 2.728 -1.920 6.494 1.00 . A A . 8 THR HG23 1 1 4 1721 1 1 8 THR N N -0.377 -1.334 6.025 1.00 . A A . 8 THR N 1 1 4 1722 1 1 8 THR O O -1.938 -2.890 4.615 1.00 . A A . 8 THR O 1 1 4 1723 1 1 8 THR OG1 O 0.075 -3.882 7.129 1.00 . A A . 8 THR OG1 1 1 4 1724 1 1 9 CYS C C -1.057 -6.314 3.216 1.00 . A A . 9 CYS C 1 1 4 1725 1 1 9 CYS CA C -1.288 -4.844 2.923 1.00 . A A . 9 CYS CA 1 1 4 1726 1 1 9 CYS CB C -1.357 -4.599 1.415 1.00 . A A . 9 CYS CB 1 1 4 1727 1 1 9 CYS H H 0.656 -4.187 3.338 1.00 . A A . 9 CYS H 1 1 4 1728 1 1 9 CYS HA H -2.236 -4.573 3.365 1.00 . A A . 9 CYS HA 1 1 4 1729 1 1 9 CYS HB2 H -2.306 -4.964 1.051 1.00 . A A . 9 CYS HB2 1 1 4 1730 1 1 9 CYS HB3 H -1.301 -3.536 1.233 1.00 . A A . 9 CYS HB3 1 1 4 1731 1 1 9 CYS N N -0.289 -4.039 3.576 1.00 . A A . 9 CYS N 1 1 4 1732 1 1 9 CYS O O -0.011 -6.698 3.784 1.00 . A A . 9 CYS O 1 1 4 1733 1 1 9 CYS SG S -0.070 -5.404 0.430 1.00 . A A . 9 CYS SG 1 1 4 1734 1 1 10 ASP C C -2.546 -9.115 1.742 1.00 . A A . 10 ASP C 1 1 4 1735 1 1 10 ASP CA C -1.988 -8.557 3.032 1.00 . A A . 10 ASP CA 1 1 4 1736 1 1 10 ASP CB C -2.910 -9.015 4.188 1.00 . A A . 10 ASP CB 1 1 4 1737 1 1 10 ASP CG C -2.748 -8.281 5.505 1.00 . A A . 10 ASP CG 1 1 4 1738 1 1 10 ASP H H -2.810 -6.739 2.398 1.00 . A A . 10 ASP H 1 1 4 1739 1 1 10 ASP HA H -0.973 -8.886 3.188 1.00 . A A . 10 ASP HA 1 1 4 1740 1 1 10 ASP HB2 H -3.932 -8.889 3.869 1.00 . A A . 10 ASP HB2 1 1 4 1741 1 1 10 ASP HB3 H -2.735 -10.067 4.358 1.00 . A A . 10 ASP HB3 1 1 4 1742 1 1 10 ASP N N -2.027 -7.119 2.858 1.00 . A A . 10 ASP N 1 1 4 1743 1 1 10 ASP O O -2.432 -8.471 0.697 1.00 . A A . 10 ASP O 1 1 4 1744 1 1 10 ASP OD1 O -3.732 -7.665 5.965 1.00 . A A . 10 ASP OD1 1 1 4 1745 1 1 10 ASP OD2 O -1.657 -8.306 6.119 1.00 . A A . 10 ASP OD2 1 1 4 1746 1 1 11 SER C C -5.159 -10.114 0.417 1.00 . A A . 11 SER C 1 1 4 1747 1 1 11 SER CA C -3.792 -10.786 0.593 1.00 . A A . 11 SER CA 1 1 4 1748 1 1 11 SER CB C -3.923 -12.299 0.640 1.00 . A A . 11 SER CB 1 1 4 1749 1 1 11 SER H H -3.127 -10.828 2.594 1.00 . A A . 11 SER H 1 1 4 1750 1 1 11 SER HA H -3.176 -10.510 -0.249 1.00 . A A . 11 SER HA 1 1 4 1751 1 1 11 SER HB2 H -4.536 -12.580 1.484 1.00 . A A . 11 SER HB2 1 1 4 1752 1 1 11 SER HB3 H -4.385 -12.649 -0.271 1.00 . A A . 11 SER HB3 1 1 4 1753 1 1 11 SER HG H -2.045 -12.250 1.152 1.00 . A A . 11 SER HG 1 1 4 1754 1 1 11 SER N N -3.138 -10.285 1.776 1.00 . A A . 11 SER N 1 1 4 1755 1 1 11 SER O O -5.545 -9.779 -0.694 1.00 . A A . 11 SER O 1 1 4 1756 1 1 11 SER OG O -2.641 -12.902 0.765 1.00 . A A . 11 SER OG 1 1 4 1757 1 1 12 GLU C C -7.109 -7.744 1.451 1.00 . A A . 12 GLU C 1 1 4 1758 1 1 12 GLU CA C -7.186 -9.265 1.445 1.00 . A A . 12 GLU CA 1 1 4 1759 1 1 12 GLU CB C -8.157 -9.780 2.517 1.00 . A A . 12 GLU CB 1 1 4 1760 1 1 12 GLU CD C -7.575 -12.256 2.422 1.00 . A A . 12 GLU CD 1 1 4 1761 1 1 12 GLU CG C -8.654 -11.211 2.317 1.00 . A A . 12 GLU CG 1 1 4 1762 1 1 12 GLU H H -5.496 -10.132 2.394 1.00 . A A . 12 GLU H 1 1 4 1763 1 1 12 GLU HA H -7.570 -9.543 0.475 1.00 . A A . 12 GLU HA 1 1 4 1764 1 1 12 GLU HB2 H -7.661 -9.743 3.474 1.00 . A A . 12 GLU HB2 1 1 4 1765 1 1 12 GLU HB3 H -9.015 -9.125 2.545 1.00 . A A . 12 GLU HB3 1 1 4 1766 1 1 12 GLU HG2 H -9.396 -11.421 3.072 1.00 . A A . 12 GLU HG2 1 1 4 1767 1 1 12 GLU HG3 H -9.114 -11.279 1.342 1.00 . A A . 12 GLU HG3 1 1 4 1768 1 1 12 GLU N N -5.867 -9.880 1.523 1.00 . A A . 12 GLU N 1 1 4 1769 1 1 12 GLU O O -7.652 -7.099 0.551 1.00 . A A . 12 GLU O 1 1 4 1770 1 1 12 GLU OE1 O -7.212 -12.634 3.550 1.00 . A A . 12 GLU OE1 1 1 4 1771 1 1 12 GLU OE2 O -7.082 -12.738 1.395 1.00 . A A . 12 GLU OE2 1 1 4 1772 1 1 13 ARG C C -5.261 -5.374 1.396 1.00 . A A . 13 ARG C 1 1 4 1773 1 1 13 ARG CA C -6.283 -5.704 2.451 1.00 . A A . 13 ARG CA 1 1 4 1774 1 1 13 ARG CB C -5.751 -5.153 3.786 1.00 . A A . 13 ARG CB 1 1 4 1775 1 1 13 ARG CD C -5.976 -4.654 6.217 1.00 . A A . 13 ARG CD 1 1 4 1776 1 1 13 ARG CG C -6.655 -5.277 4.999 1.00 . A A . 13 ARG CG 1 1 4 1777 1 1 13 ARG CZ C -3.553 -4.605 6.898 1.00 . A A . 13 ARG CZ 1 1 4 1778 1 1 13 ARG H H -6.142 -7.698 3.210 1.00 . A A . 13 ARG H 1 1 4 1779 1 1 13 ARG HA H -7.224 -5.232 2.207 1.00 . A A . 13 ARG HA 1 1 4 1780 1 1 13 ARG HB2 H -4.834 -5.670 4.022 1.00 . A A . 13 ARG HB2 1 1 4 1781 1 1 13 ARG HB3 H -5.517 -4.107 3.645 1.00 . A A . 13 ARG HB3 1 1 4 1782 1 1 13 ARG HD2 H -5.870 -3.592 6.050 1.00 . A A . 13 ARG HD2 1 1 4 1783 1 1 13 ARG HD3 H -6.588 -4.827 7.090 1.00 . A A . 13 ARG HD3 1 1 4 1784 1 1 13 ARG HE H -4.544 -6.195 6.192 1.00 . A A . 13 ARG HE 1 1 4 1785 1 1 13 ARG HG2 H -7.582 -4.758 4.805 1.00 . A A . 13 ARG HG2 1 1 4 1786 1 1 13 ARG HG3 H -6.851 -6.318 5.201 1.00 . A A . 13 ARG HG3 1 1 4 1787 1 1 13 ARG HH11 H -4.490 -2.849 7.365 1.00 . A A . 13 ARG HH11 1 1 4 1788 1 1 13 ARG HH12 H -2.812 -2.887 7.686 1.00 . A A . 13 ARG HH12 1 1 4 1789 1 1 13 ARG HH21 H -2.335 -6.213 6.638 1.00 . A A . 13 ARG HH21 1 1 4 1790 1 1 13 ARG HH22 H -1.528 -4.826 7.222 1.00 . A A . 13 ARG HH22 1 1 4 1791 1 1 13 ARG N N -6.475 -7.156 2.462 1.00 . A A . 13 ARG N 1 1 4 1792 1 1 13 ARG NE N -4.643 -5.242 6.442 1.00 . A A . 13 ARG NE 1 1 4 1793 1 1 13 ARG NH1 N -3.627 -3.361 7.344 1.00 . A A . 13 ARG NH1 1 1 4 1794 1 1 13 ARG NH2 N -2.393 -5.253 6.935 1.00 . A A . 13 ARG NH2 1 1 4 1795 1 1 13 ARG O O -4.107 -5.758 1.528 1.00 . A A . 13 ARG O 1 1 4 1796 1 1 14 LYS C C -4.539 -2.816 -0.598 1.00 . A A . 14 LYS C 1 1 4 1797 1 1 14 LYS CA C -4.750 -4.311 -0.679 1.00 . A A . 14 LYS CA 1 1 4 1798 1 1 14 LYS CB C -5.200 -4.750 -2.075 1.00 . A A . 14 LYS CB 1 1 4 1799 1 1 14 LYS CD C -6.950 -4.838 -3.832 1.00 . A A . 14 LYS CD 1 1 4 1800 1 1 14 LYS CE C -8.388 -4.541 -4.167 1.00 . A A . 14 LYS CE 1 1 4 1801 1 1 14 LYS CG C -6.587 -4.301 -2.467 1.00 . A A . 14 LYS CG 1 1 4 1802 1 1 14 LYS H H -6.626 -4.512 0.257 1.00 . A A . 14 LYS H 1 1 4 1803 1 1 14 LYS HA H -3.813 -4.793 -0.451 1.00 . A A . 14 LYS HA 1 1 4 1804 1 1 14 LYS HB2 H -4.507 -4.351 -2.801 1.00 . A A . 14 LYS HB2 1 1 4 1805 1 1 14 LYS HB3 H -5.166 -5.828 -2.122 1.00 . A A . 14 LYS HB3 1 1 4 1806 1 1 14 LYS HD2 H -6.315 -4.377 -4.573 1.00 . A A . 14 LYS HD2 1 1 4 1807 1 1 14 LYS HD3 H -6.798 -5.907 -3.842 1.00 . A A . 14 LYS HD3 1 1 4 1808 1 1 14 LYS HE2 H -8.654 -5.068 -5.071 1.00 . A A . 14 LYS HE2 1 1 4 1809 1 1 14 LYS HE3 H -8.963 -4.924 -3.340 1.00 . A A . 14 LYS HE3 1 1 4 1810 1 1 14 LYS HG2 H -7.294 -4.668 -1.739 1.00 . A A . 14 LYS HG2 1 1 4 1811 1 1 14 LYS HG3 H -6.616 -3.222 -2.491 1.00 . A A . 14 LYS HG3 1 1 4 1812 1 1 14 LYS HZ1 H -9.666 -2.930 -4.519 1.00 . A A . 14 LYS HZ1 1 1 4 1813 1 1 14 LYS HZ2 H -8.122 -2.692 -5.113 1.00 . A A . 14 LYS HZ2 1 1 4 1814 1 1 14 LYS HZ3 H -8.417 -2.564 -3.458 1.00 . A A . 14 LYS HZ3 1 1 4 1815 1 1 14 LYS N N -5.674 -4.733 0.345 1.00 . A A . 14 LYS N 1 1 4 1816 1 1 14 LYS NZ N -8.661 -3.095 -4.320 1.00 . A A . 14 LYS NZ 1 1 4 1817 1 1 14 LYS O O -5.441 -2.086 -0.193 1.00 . A A . 14 LYS O 1 1 4 1818 1 1 15 CYS C C -3.751 -0.286 -2.124 1.00 . A A . 15 CYS C 1 1 4 1819 1 1 15 CYS CA C -3.082 -0.941 -0.929 1.00 . A A . 15 CYS CA 1 1 4 1820 1 1 15 CYS CB C -1.573 -0.688 -0.949 1.00 . A A . 15 CYS CB 1 1 4 1821 1 1 15 CYS H H -2.668 -2.990 -1.224 1.00 . A A . 15 CYS H 1 1 4 1822 1 1 15 CYS HA H -3.505 -0.536 -0.022 1.00 . A A . 15 CYS HA 1 1 4 1823 1 1 15 CYS HB2 H -1.165 -1.052 -1.880 1.00 . A A . 15 CYS HB2 1 1 4 1824 1 1 15 CYS HB3 H -1.392 0.374 -0.873 1.00 . A A . 15 CYS HB3 1 1 4 1825 1 1 15 CYS N N -3.364 -2.363 -0.948 1.00 . A A . 15 CYS N 1 1 4 1826 1 1 15 CYS O O -3.891 -0.916 -3.185 1.00 . A A . 15 CYS O 1 1 4 1827 1 1 15 CYS SG S -0.672 -1.506 0.410 1.00 . A A . 15 CYS SG 1 1 4 1828 1 1 16 CYS C C -3.901 2.023 -4.154 1.00 . A A . 16 CYS C 1 1 4 1829 1 1 16 CYS CA C -4.855 1.640 -3.034 1.00 . A A . 16 CYS CA 1 1 4 1830 1 1 16 CYS CB C -5.602 2.857 -2.490 1.00 . A A . 16 CYS CB 1 1 4 1831 1 1 16 CYS H H -4.020 1.419 -1.127 1.00 . A A . 16 CYS H 1 1 4 1832 1 1 16 CYS HA H -5.578 0.948 -3.438 1.00 . A A . 16 CYS HA 1 1 4 1833 1 1 16 CYS HB2 H -4.899 3.490 -1.968 1.00 . A A . 16 CYS HB2 1 1 4 1834 1 1 16 CYS HB3 H -6.048 3.405 -3.306 1.00 . A A . 16 CYS HB3 1 1 4 1835 1 1 16 CYS N N -4.171 0.941 -1.969 1.00 . A A . 16 CYS N 1 1 4 1836 1 1 16 CYS O O -2.673 1.980 -3.981 1.00 . A A . 16 CYS O 1 1 4 1837 1 1 16 CYS SG S -6.925 2.420 -1.315 1.00 . A A . 16 CYS SG 1 1 4 1838 1 1 17 LYS C C -2.947 4.013 -6.153 1.00 . A A . 17 LYS C 1 1 4 1839 1 1 17 LYS CA C -3.695 2.725 -6.463 1.00 . A A . 17 LYS CA 1 1 4 1840 1 1 17 LYS CB C -4.615 2.877 -7.668 1.00 . A A . 17 LYS CB 1 1 4 1841 1 1 17 LYS CD C -4.895 3.164 -10.112 1.00 . A A . 17 LYS CD 1 1 4 1842 1 1 17 LYS CE C -4.240 3.477 -11.439 1.00 . A A . 17 LYS CE 1 1 4 1843 1 1 17 LYS CG C -3.908 3.184 -8.970 1.00 . A A . 17 LYS CG 1 1 4 1844 1 1 17 LYS H H -5.436 2.275 -5.389 1.00 . A A . 17 LYS H 1 1 4 1845 1 1 17 LYS HA H -2.976 1.943 -6.659 1.00 . A A . 17 LYS HA 1 1 4 1846 1 1 17 LYS HB2 H -5.170 1.959 -7.797 1.00 . A A . 17 LYS HB2 1 1 4 1847 1 1 17 LYS HB3 H -5.313 3.676 -7.466 1.00 . A A . 17 LYS HB3 1 1 4 1848 1 1 17 LYS HD2 H -5.346 2.186 -10.162 1.00 . A A . 17 LYS HD2 1 1 4 1849 1 1 17 LYS HD3 H -5.662 3.897 -9.911 1.00 . A A . 17 LYS HD3 1 1 4 1850 1 1 17 LYS HE2 H -3.387 2.826 -11.555 1.00 . A A . 17 LYS HE2 1 1 4 1851 1 1 17 LYS HE3 H -4.949 3.281 -12.230 1.00 . A A . 17 LYS HE3 1 1 4 1852 1 1 17 LYS HG2 H -3.451 4.160 -8.906 1.00 . A A . 17 LYS HG2 1 1 4 1853 1 1 17 LYS HG3 H -3.149 2.437 -9.145 1.00 . A A . 17 LYS HG3 1 1 4 1854 1 1 17 LYS HZ1 H -3.369 5.090 -12.450 1.00 . A A . 17 LYS HZ1 1 1 4 1855 1 1 17 LYS HZ2 H -3.079 5.116 -10.794 1.00 . A A . 17 LYS HZ2 1 1 4 1856 1 1 17 LYS HZ3 H -4.588 5.528 -11.387 1.00 . A A . 17 LYS HZ3 1 1 4 1857 1 1 17 LYS N N -4.460 2.326 -5.308 1.00 . A A . 17 LYS N 1 1 4 1858 1 1 17 LYS NZ N -3.785 4.880 -11.523 1.00 . A A . 17 LYS NZ 1 1 4 1859 1 1 17 LYS O O -3.520 4.963 -5.623 1.00 . A A . 17 LYS O 1 1 4 1860 1 1 18 GLY C C 0.166 4.570 -5.064 1.00 . A A . 18 GLY C 1 1 4 1861 1 1 18 GLY CA C -0.814 5.103 -6.069 1.00 . A A . 18 GLY CA 1 1 4 1862 1 1 18 GLY H H -1.308 3.278 -6.984 1.00 . A A . 18 GLY H 1 1 4 1863 1 1 18 GLY HA2 H -0.290 5.484 -6.934 1.00 . A A . 18 GLY HA2 1 1 4 1864 1 1 18 GLY HA3 H -1.395 5.889 -5.610 1.00 . A A . 18 GLY HA3 1 1 4 1865 1 1 18 GLY N N -1.684 4.023 -6.465 1.00 . A A . 18 GLY N 1 1 4 1866 1 1 18 GLY O O 1.158 5.210 -4.707 1.00 . A A . 18 GLY O 1 1 4 1867 1 1 19 MET C C 0.743 1.228 -4.262 1.00 . A A . 19 MET C 1 1 4 1868 1 1 19 MET CA C 0.685 2.618 -3.719 1.00 . A A . 19 MET CA 1 1 4 1869 1 1 19 MET CB C 0.057 2.533 -2.325 1.00 . A A . 19 MET CB 1 1 4 1870 1 1 19 MET CE C -1.202 5.370 0.366 1.00 . A A . 19 MET CE 1 1 4 1871 1 1 19 MET CG C -0.152 3.846 -1.639 1.00 . A A . 19 MET CG 1 1 4 1872 1 1 19 MET H H -0.979 2.961 -4.890 1.00 . A A . 19 MET H 1 1 4 1873 1 1 19 MET HA H 1.671 3.051 -3.652 1.00 . A A . 19 MET HA 1 1 4 1874 1 1 19 MET HB2 H -0.904 2.053 -2.413 1.00 . A A . 19 MET HB2 1 1 4 1875 1 1 19 MET HB3 H 0.692 1.920 -1.701 1.00 . A A . 19 MET HB3 1 1 4 1876 1 1 19 MET HE1 H -1.722 5.441 1.309 1.00 . A A . 19 MET HE1 1 1 4 1877 1 1 19 MET HE2 H -1.769 5.875 -0.401 1.00 . A A . 19 MET HE2 1 1 4 1878 1 1 19 MET HE3 H -0.230 5.831 0.459 1.00 . A A . 19 MET HE3 1 1 4 1879 1 1 19 MET HG2 H 0.822 4.270 -1.446 1.00 . A A . 19 MET HG2 1 1 4 1880 1 1 19 MET HG3 H -0.727 4.499 -2.278 1.00 . A A . 19 MET HG3 1 1 4 1881 1 1 19 MET N N -0.134 3.376 -4.611 1.00 . A A . 19 MET N 1 1 4 1882 1 1 19 MET O O -0.137 0.819 -5.043 1.00 . A A . 19 MET O 1 1 4 1883 1 1 19 MET SD S -0.996 3.659 -0.071 1.00 . A A . 19 MET SD 1 1 4 1884 1 1 20 VAL C C 1.601 -1.693 -3.026 1.00 . A A . 20 VAL C 1 1 4 1885 1 1 20 VAL CA C 1.826 -0.858 -4.258 1.00 . A A . 20 VAL CA 1 1 4 1886 1 1 20 VAL CB C 3.167 -1.232 -4.953 1.00 . A A . 20 VAL CB 1 1 4 1887 1 1 20 VAL CG1 C 3.281 -0.518 -6.287 1.00 . A A . 20 VAL CG1 1 1 4 1888 1 1 20 VAL CG2 C 4.371 -0.905 -4.073 1.00 . A A . 20 VAL CG2 1 1 4 1889 1 1 20 VAL H H 2.460 0.920 -3.362 1.00 . A A . 20 VAL H 1 1 4 1890 1 1 20 VAL HA H 1.011 -1.047 -4.941 1.00 . A A . 20 VAL HA 1 1 4 1891 1 1 20 VAL HB H 3.157 -2.296 -5.145 1.00 . A A . 20 VAL HB 1 1 4 1892 1 1 20 VAL HG11 H 4.205 -0.800 -6.765 1.00 . A A . 20 VAL HG11 1 1 4 1893 1 1 20 VAL HG12 H 3.270 0.550 -6.123 1.00 . A A . 20 VAL HG12 1 1 4 1894 1 1 20 VAL HG13 H 2.448 -0.794 -6.917 1.00 . A A . 20 VAL HG13 1 1 4 1895 1 1 20 VAL HG21 H 4.384 0.155 -3.863 1.00 . A A . 20 VAL HG21 1 1 4 1896 1 1 20 VAL HG22 H 5.279 -1.180 -4.588 1.00 . A A . 20 VAL HG22 1 1 4 1897 1 1 20 VAL HG23 H 4.299 -1.455 -3.146 1.00 . A A . 20 VAL HG23 1 1 4 1898 1 1 20 VAL N N 1.741 0.513 -3.902 1.00 . A A . 20 VAL N 1 1 4 1899 1 1 20 VAL O O 1.999 -1.286 -1.901 1.00 . A A . 20 VAL O 1 1 4 1900 1 1 21 CYS C C 1.944 -4.368 -1.781 1.00 . A A . 21 CYS C 1 1 4 1901 1 1 21 CYS CA C 0.634 -3.718 -2.138 1.00 . A A . 21 CYS CA 1 1 4 1902 1 1 21 CYS CB C -0.404 -4.763 -2.593 1.00 . A A . 21 CYS CB 1 1 4 1903 1 1 21 CYS H H 0.555 -2.987 -4.102 1.00 . A A . 21 CYS H 1 1 4 1904 1 1 21 CYS HA H 0.256 -3.170 -1.287 1.00 . A A . 21 CYS HA 1 1 4 1905 1 1 21 CYS HB2 H -1.266 -4.246 -2.988 1.00 . A A . 21 CYS HB2 1 1 4 1906 1 1 21 CYS HB3 H 0.033 -5.356 -3.384 1.00 . A A . 21 CYS HB3 1 1 4 1907 1 1 21 CYS N N 0.901 -2.790 -3.205 1.00 . A A . 21 CYS N 1 1 4 1908 1 1 21 CYS O O 2.511 -5.120 -2.569 1.00 . A A . 21 CYS O 1 1 4 1909 1 1 21 CYS SG S -1.019 -5.922 -1.297 1.00 . A A . 21 CYS SG 1 1 4 1910 1 1 22 ARG C C 3.678 -4.730 1.299 1.00 . A A . 22 ARG C 1 1 4 1911 1 1 22 ARG CA C 3.715 -4.493 -0.223 1.00 . A A . 22 ARG CA 1 1 4 1912 1 1 22 ARG CB C 4.716 -3.391 -0.588 1.00 . A A . 22 ARG CB 1 1 4 1913 1 1 22 ARG CD C 5.952 -4.574 -2.435 1.00 . A A . 22 ARG CD 1 1 4 1914 1 1 22 ARG CG C 6.062 -3.868 -1.087 1.00 . A A . 22 ARG CG 1 1 4 1915 1 1 22 ARG CZ C 7.519 -5.533 -4.125 1.00 . A A . 22 ARG CZ 1 1 4 1916 1 1 22 ARG H H 1.926 -3.482 -0.009 1.00 . A A . 22 ARG H 1 1 4 1917 1 1 22 ARG HA H 3.970 -5.399 -0.749 1.00 . A A . 22 ARG HA 1 1 4 1918 1 1 22 ARG HB2 H 4.277 -2.779 -1.362 1.00 . A A . 22 ARG HB2 1 1 4 1919 1 1 22 ARG HB3 H 4.871 -2.775 0.285 1.00 . A A . 22 ARG HB3 1 1 4 1920 1 1 22 ARG HD2 H 5.363 -5.471 -2.322 1.00 . A A . 22 ARG HD2 1 1 4 1921 1 1 22 ARG HD3 H 5.471 -3.912 -3.141 1.00 . A A . 22 ARG HD3 1 1 4 1922 1 1 22 ARG HE H 8.024 -4.700 -2.363 1.00 . A A . 22 ARG HE 1 1 4 1923 1 1 22 ARG HG2 H 6.721 -3.018 -1.191 1.00 . A A . 22 ARG HG2 1 1 4 1924 1 1 22 ARG HG3 H 6.467 -4.556 -0.360 1.00 . A A . 22 ARG HG3 1 1 4 1925 1 1 22 ARG HH11 H 5.563 -5.671 -4.726 1.00 . A A . 22 ARG HH11 1 1 4 1926 1 1 22 ARG HH12 H 6.698 -6.319 -5.817 1.00 . A A . 22 ARG HH12 1 1 4 1927 1 1 22 ARG HH21 H 9.544 -5.531 -3.895 1.00 . A A . 22 ARG HH21 1 1 4 1928 1 1 22 ARG HH22 H 9.009 -6.235 -5.345 1.00 . A A . 22 ARG HH22 1 1 4 1929 1 1 22 ARG N N 2.443 -4.041 -0.630 1.00 . A A . 22 ARG N 1 1 4 1930 1 1 22 ARG NE N 7.271 -4.937 -2.955 1.00 . A A . 22 ARG NE 1 1 4 1931 1 1 22 ARG NH1 N 6.526 -5.858 -4.944 1.00 . A A . 22 ARG NH1 1 1 4 1932 1 1 22 ARG NH2 N 8.768 -5.782 -4.482 1.00 . A A . 22 ARG NH2 1 1 4 1933 1 1 22 ARG O O 2.561 -4.684 1.925 1.00 . A A . 22 ARG O 1 1 4 1934 1 1 23 LEU C C 4.288 -4.152 4.112 1.00 . A A . 23 LEU C 1 1 4 1935 1 1 23 LEU CA C 5.056 -5.200 3.350 1.00 . A A . 23 LEU CA 1 1 4 1936 1 1 23 LEU CB C 6.543 -5.109 3.718 1.00 . A A . 23 LEU CB 1 1 4 1937 1 1 23 LEU CD1 C 8.929 -5.789 3.390 1.00 . A A . 23 LEU CD1 1 1 4 1938 1 1 23 LEU CD2 C 7.128 -7.519 3.276 1.00 . A A . 23 LEU CD2 1 1 4 1939 1 1 23 LEU CG C 7.491 -6.066 2.988 1.00 . A A . 23 LEU CG 1 1 4 1940 1 1 23 LEU H H 5.682 -4.977 1.335 1.00 . A A . 23 LEU H 1 1 4 1941 1 1 23 LEU HA H 4.680 -6.180 3.601 1.00 . A A . 23 LEU HA 1 1 4 1942 1 1 23 LEU HB2 H 6.873 -4.100 3.521 1.00 . A A . 23 LEU HB2 1 1 4 1943 1 1 23 LEU HB3 H 6.636 -5.289 4.778 1.00 . A A . 23 LEU HB3 1 1 4 1944 1 1 23 LEU HD11 H 9.185 -4.774 3.132 1.00 . A A . 23 LEU HD11 1 1 4 1945 1 1 23 LEU HD12 H 9.585 -6.471 2.869 1.00 . A A . 23 LEU HD12 1 1 4 1946 1 1 23 LEU HD13 H 9.039 -5.928 4.456 1.00 . A A . 23 LEU HD13 1 1 4 1947 1 1 23 LEU HD21 H 7.183 -7.701 4.339 1.00 . A A . 23 LEU HD21 1 1 4 1948 1 1 23 LEU HD22 H 7.825 -8.168 2.767 1.00 . A A . 23 LEU HD22 1 1 4 1949 1 1 23 LEU HD23 H 6.128 -7.721 2.925 1.00 . A A . 23 LEU HD23 1 1 4 1950 1 1 23 LEU HG H 7.403 -5.896 1.926 1.00 . A A . 23 LEU HG 1 1 4 1951 1 1 23 LEU N N 4.880 -4.965 1.896 1.00 . A A . 23 LEU N 1 1 4 1952 1 1 23 LEU O O 3.554 -4.449 5.055 1.00 . A A . 23 LEU O 1 1 4 1953 1 1 24 TRP C C 3.239 -1.143 2.817 1.00 . A A . 24 TRP C 1 1 4 1954 1 1 24 TRP CA C 3.681 -1.834 4.096 1.00 . A A . 24 TRP CA 1 1 4 1955 1 1 24 TRP CB C 4.490 -0.887 5.023 1.00 . A A . 24 TRP CB 1 1 4 1956 1 1 24 TRP CD1 C 5.516 1.024 3.718 1.00 . A A . 24 TRP CD1 1 1 4 1957 1 1 24 TRP CD2 C 6.988 -0.549 4.270 1.00 . A A . 24 TRP CD2 1 1 4 1958 1 1 24 TRP CE2 C 7.657 0.454 3.542 1.00 . A A . 24 TRP CE2 1 1 4 1959 1 1 24 TRP CE3 C 7.715 -1.646 4.729 1.00 . A A . 24 TRP CE3 1 1 4 1960 1 1 24 TRP CG C 5.611 -0.157 4.354 1.00 . A A . 24 TRP CG 1 1 4 1961 1 1 24 TRP CH2 C 9.706 -0.696 3.729 1.00 . A A . 24 TRP CH2 1 1 4 1962 1 1 24 TRP CZ2 C 9.016 0.391 3.266 1.00 . A A . 24 TRP CZ2 1 1 4 1963 1 1 24 TRP CZ3 C 9.067 -1.708 4.455 1.00 . A A . 24 TRP CZ3 1 1 4 1964 1 1 24 TRP H H 5.106 -2.774 2.953 1.00 . A A . 24 TRP H 1 1 4 1965 1 1 24 TRP HA H 2.829 -2.246 4.609 1.00 . A A . 24 TRP HA 1 1 4 1966 1 1 24 TRP HB2 H 3.823 -0.144 5.433 1.00 . A A . 24 TRP HB2 1 1 4 1967 1 1 24 TRP HB3 H 4.905 -1.468 5.835 1.00 . A A . 24 TRP HB3 1 1 4 1968 1 1 24 TRP HD1 H 4.572 1.547 3.636 1.00 . A A . 24 TRP HD1 1 1 4 1969 1 1 24 TRP HE1 H 6.913 2.223 2.704 1.00 . A A . 24 TRP HE1 1 1 4 1970 1 1 24 TRP HE3 H 7.238 -2.434 5.290 1.00 . A A . 24 TRP HE3 1 1 4 1971 1 1 24 TRP HH2 H 10.764 -0.788 3.537 1.00 . A A . 24 TRP HH2 1 1 4 1972 1 1 24 TRP HZ2 H 9.527 1.163 2.707 1.00 . A A . 24 TRP HZ2 1 1 4 1973 1 1 24 TRP HZ3 H 9.647 -2.552 4.802 1.00 . A A . 24 TRP HZ3 1 1 4 1974 1 1 24 TRP N N 4.450 -2.941 3.662 1.00 . A A . 24 TRP N 1 1 4 1975 1 1 24 TRP NE1 N 6.737 1.397 3.215 1.00 . A A . 24 TRP NE1 1 1 4 1976 1 1 24 TRP O O 3.862 -1.392 1.768 1.00 . A A . 24 TRP O 1 1 4 1977 1 1 25 CYS C C 2.771 1.328 1.186 1.00 . A A . 25 CYS C 1 1 4 1978 1 1 25 CYS CA C 1.746 0.328 1.651 1.00 . A A . 25 CYS CA 1 1 4 1979 1 1 25 CYS CB C 0.369 0.951 1.837 1.00 . A A . 25 CYS CB 1 1 4 1980 1 1 25 CYS H H 1.732 -0.145 3.700 1.00 . A A . 25 CYS H 1 1 4 1981 1 1 25 CYS HA H 1.683 -0.439 0.892 1.00 . A A . 25 CYS HA 1 1 4 1982 1 1 25 CYS HB2 H 0.374 1.565 2.725 1.00 . A A . 25 CYS HB2 1 1 4 1983 1 1 25 CYS HB3 H 0.134 1.564 0.978 1.00 . A A . 25 CYS HB3 1 1 4 1984 1 1 25 CYS N N 2.201 -0.339 2.856 1.00 . A A . 25 CYS N 1 1 4 1985 1 1 25 CYS O O 3.030 2.354 1.839 1.00 . A A . 25 CYS O 1 1 4 1986 1 1 25 CYS SG S -0.954 -0.292 2.017 1.00 . A A . 25 CYS SG 1 1 4 1987 1 1 26 LYS C C 4.019 2.606 -1.610 1.00 . A A . 26 LYS C 1 1 4 1988 1 1 26 LYS CA C 4.449 1.785 -0.436 1.00 . A A . 26 LYS CA 1 1 4 1989 1 1 26 LYS CB C 5.584 0.829 -0.812 1.00 . A A . 26 LYS CB 1 1 4 1990 1 1 26 LYS CD C 7.978 0.529 -1.449 1.00 . A A . 26 LYS CD 1 1 4 1991 1 1 26 LYS CE C 9.282 1.235 -1.777 1.00 . A A . 26 LYS CE 1 1 4 1992 1 1 26 LYS CG C 6.835 1.512 -1.297 1.00 . A A . 26 LYS CG 1 1 4 1993 1 1 26 LYS H H 3.014 0.271 -0.472 1.00 . A A . 26 LYS H 1 1 4 1994 1 1 26 LYS HA H 4.799 2.430 0.354 1.00 . A A . 26 LYS HA 1 1 4 1995 1 1 26 LYS HB2 H 5.839 0.237 0.055 1.00 . A A . 26 LYS HB2 1 1 4 1996 1 1 26 LYS HB3 H 5.233 0.167 -1.589 1.00 . A A . 26 LYS HB3 1 1 4 1997 1 1 26 LYS HD2 H 8.098 -0.017 -0.523 1.00 . A A . 26 LYS HD2 1 1 4 1998 1 1 26 LYS HD3 H 7.738 -0.161 -2.243 1.00 . A A . 26 LYS HD3 1 1 4 1999 1 1 26 LYS HE2 H 9.524 1.909 -0.970 1.00 . A A . 26 LYS HE2 1 1 4 2000 1 1 26 LYS HE3 H 10.064 0.494 -1.865 1.00 . A A . 26 LYS HE3 1 1 4 2001 1 1 26 LYS HG2 H 6.626 1.957 -2.260 1.00 . A A . 26 LYS HG2 1 1 4 2002 1 1 26 LYS HG3 H 7.098 2.286 -0.597 1.00 . A A . 26 LYS HG3 1 1 4 2003 1 1 26 LYS HZ1 H 10.122 2.472 -3.201 1.00 . A A . 26 LYS HZ1 1 1 4 2004 1 1 26 LYS HZ2 H 8.492 2.760 -2.960 1.00 . A A . 26 LYS HZ2 1 1 4 2005 1 1 26 LYS HZ3 H 9.000 1.392 -3.845 1.00 . A A . 26 LYS HZ3 1 1 4 2006 1 1 26 LYS N N 3.353 1.028 0.058 1.00 . A A . 26 LYS N 1 1 4 2007 1 1 26 LYS NZ N 9.207 2.009 -3.032 1.00 . A A . 26 LYS NZ 1 1 4 2008 1 1 26 LYS O O 3.444 2.070 -2.543 1.00 . A A . 26 LYS O 1 1 4 2009 1 1 27 LYS C C 4.585 4.441 -3.908 1.00 . A A . 27 LYS C 1 1 4 2010 1 1 27 LYS CA C 3.909 4.808 -2.621 1.00 . A A . 27 LYS CA 1 1 4 2011 1 1 27 LYS CB C 4.260 6.256 -2.290 1.00 . A A . 27 LYS CB 1 1 4 2012 1 1 27 LYS CD C 1.944 7.069 -1.747 1.00 . A A . 27 LYS CD 1 1 4 2013 1 1 27 LYS CE C 1.102 7.860 -0.755 1.00 . A A . 27 LYS CE 1 1 4 2014 1 1 27 LYS CG C 3.378 6.915 -1.261 1.00 . A A . 27 LYS CG 1 1 4 2015 1 1 27 LYS H H 4.683 4.255 -0.732 1.00 . A A . 27 LYS H 1 1 4 2016 1 1 27 LYS HA H 2.842 4.751 -2.768 1.00 . A A . 27 LYS HA 1 1 4 2017 1 1 27 LYS HB2 H 5.275 6.284 -1.923 1.00 . A A . 27 LYS HB2 1 1 4 2018 1 1 27 LYS HB3 H 4.210 6.835 -3.201 1.00 . A A . 27 LYS HB3 1 1 4 2019 1 1 27 LYS HD2 H 1.947 7.588 -2.695 1.00 . A A . 27 LYS HD2 1 1 4 2020 1 1 27 LYS HD3 H 1.503 6.094 -1.879 1.00 . A A . 27 LYS HD3 1 1 4 2021 1 1 27 LYS HE2 H 0.072 7.870 -1.074 1.00 . A A . 27 LYS HE2 1 1 4 2022 1 1 27 LYS HE3 H 1.169 7.376 0.209 1.00 . A A . 27 LYS HE3 1 1 4 2023 1 1 27 LYS HG2 H 3.372 6.287 -0.384 1.00 . A A . 27 LYS HG2 1 1 4 2024 1 1 27 LYS HG3 H 3.787 7.887 -1.039 1.00 . A A . 27 LYS HG3 1 1 4 2025 1 1 27 LYS HZ1 H 1.567 9.724 -1.538 1.00 . A A . 27 LYS HZ1 1 1 4 2026 1 1 27 LYS HZ2 H 2.531 9.297 -0.232 1.00 . A A . 27 LYS HZ2 1 1 4 2027 1 1 27 LYS HZ3 H 0.939 9.794 0.013 1.00 . A A . 27 LYS HZ3 1 1 4 2028 1 1 27 LYS N N 4.256 3.902 -1.543 1.00 . A A . 27 LYS N 1 1 4 2029 1 1 27 LYS NZ N 1.565 9.250 -0.612 1.00 . A A . 27 LYS NZ 1 1 4 2030 1 1 27 LYS O O 5.712 3.921 -3.934 1.00 . A A . 27 LYS O 1 1 4 2031 1 1 28 LYS C C 5.319 5.692 -6.543 1.00 . A A . 28 LYS C 1 1 4 2032 1 1 28 LYS CA C 4.424 4.505 -6.266 1.00 . A A . 28 LYS CA 1 1 4 2033 1 1 28 LYS CB C 3.286 4.420 -7.287 1.00 . A A . 28 LYS CB 1 1 4 2034 1 1 28 LYS CD C 2.549 3.965 -9.634 1.00 . A A . 28 LYS CD 1 1 4 2035 1 1 28 LYS CE C 2.957 3.489 -11.019 1.00 . A A . 28 LYS CE 1 1 4 2036 1 1 28 LYS CG C 3.726 4.014 -8.680 1.00 . A A . 28 LYS CG 1 1 4 2037 1 1 28 LYS H H 3.004 5.092 -4.818 1.00 . A A . 28 LYS H 1 1 4 2038 1 1 28 LYS HA H 5.007 3.596 -6.272 1.00 . A A . 28 LYS HA 1 1 4 2039 1 1 28 LYS HB2 H 2.562 3.698 -6.939 1.00 . A A . 28 LYS HB2 1 1 4 2040 1 1 28 LYS HB3 H 2.808 5.386 -7.350 1.00 . A A . 28 LYS HB3 1 1 4 2041 1 1 28 LYS HD2 H 1.801 3.293 -9.239 1.00 . A A . 28 LYS HD2 1 1 4 2042 1 1 28 LYS HD3 H 2.133 4.957 -9.714 1.00 . A A . 28 LYS HD3 1 1 4 2043 1 1 28 LYS HE2 H 2.109 3.563 -11.681 1.00 . A A . 28 LYS HE2 1 1 4 2044 1 1 28 LYS HE3 H 3.744 4.134 -11.383 1.00 . A A . 28 LYS HE3 1 1 4 2045 1 1 28 LYS HG2 H 4.445 4.734 -9.045 1.00 . A A . 28 LYS HG2 1 1 4 2046 1 1 28 LYS HG3 H 4.184 3.038 -8.631 1.00 . A A . 28 LYS HG3 1 1 4 2047 1 1 28 LYS HZ1 H 2.745 1.448 -10.589 1.00 . A A . 28 LYS HZ1 1 1 4 2048 1 1 28 LYS HZ2 H 4.336 1.998 -10.477 1.00 . A A . 28 LYS HZ2 1 1 4 2049 1 1 28 LYS HZ3 H 3.620 1.766 -11.983 1.00 . A A . 28 LYS HZ3 1 1 4 2050 1 1 28 LYS N N 3.900 4.710 -4.960 1.00 . A A . 28 LYS N 1 1 4 2051 1 1 28 LYS NZ N 3.448 2.088 -11.010 1.00 . A A . 28 LYS NZ 1 1 4 2052 1 1 28 LYS O O 4.935 6.830 -6.253 1.00 . A A . 28 LYS O 1 1 4 2053 1 1 29 LEU C C 7.016 7.597 -8.212 1.00 . A A . 29 LEU C 1 1 4 2054 1 1 29 LEU CA C 7.499 6.483 -7.277 1.00 . A A . 29 LEU CA 1 1 4 2055 1 1 29 LEU CB C 8.866 5.871 -7.679 1.00 . A A . 29 LEU CB 1 1 4 2056 1 1 29 LEU CD1 C 8.707 5.488 -10.177 1.00 . A A . 29 LEU CD1 1 1 4 2057 1 1 29 LEU CD2 C 10.173 4.040 -8.787 1.00 . A A . 29 LEU CD2 1 1 4 2058 1 1 29 LEU CG C 8.893 4.842 -8.824 1.00 . A A . 29 LEU CG 1 1 4 2059 1 1 29 LEU H H 6.743 4.512 -7.271 1.00 . A A . 29 LEU H 1 1 4 2060 1 1 29 LEU HA H 7.619 6.952 -6.312 1.00 . A A . 29 LEU HA 1 1 4 2061 1 1 29 LEU HB2 H 9.522 6.681 -7.958 1.00 . A A . 29 LEU HB2 1 1 4 2062 1 1 29 LEU HB3 H 9.284 5.400 -6.802 1.00 . A A . 29 LEU HB3 1 1 4 2063 1 1 29 LEU HD11 H 7.754 5.995 -10.204 1.00 . A A . 29 LEU HD11 1 1 4 2064 1 1 29 LEU HD12 H 8.733 4.729 -10.945 1.00 . A A . 29 LEU HD12 1 1 4 2065 1 1 29 LEU HD13 H 9.498 6.202 -10.347 1.00 . A A . 29 LEU HD13 1 1 4 2066 1 1 29 LEU HD21 H 10.171 3.328 -9.600 1.00 . A A . 29 LEU HD21 1 1 4 2067 1 1 29 LEU HD22 H 10.242 3.512 -7.847 1.00 . A A . 29 LEU HD22 1 1 4 2068 1 1 29 LEU HD23 H 11.019 4.704 -8.892 1.00 . A A . 29 LEU HD23 1 1 4 2069 1 1 29 LEU HG H 8.072 4.155 -8.682 1.00 . A A . 29 LEU HG 1 1 4 2070 1 1 29 LEU N N 6.504 5.437 -7.053 1.00 . A A . 29 LEU N 1 1 4 2071 1 1 29 LEU O O 7.439 8.746 -8.088 1.00 . A A . 29 LEU O 1 1 4 2072 1 1 30 TRP C C 4.245 7.578 -10.504 1.00 . A A . 30 TRP C 1 1 4 2073 1 1 30 TRP CA C 5.520 8.198 -10.003 1.00 . A A . 30 TRP CA 1 1 4 2074 1 1 30 TRP CB C 6.459 8.559 -11.171 1.00 . A A . 30 TRP CB 1 1 4 2075 1 1 30 TRP CD1 C 5.321 9.487 -13.280 1.00 . A A . 30 TRP CD1 1 1 4 2076 1 1 30 TRP CD2 C 5.978 11.060 -11.838 1.00 . A A . 30 TRP CD2 1 1 4 2077 1 1 30 TRP CE2 C 5.383 11.691 -12.945 1.00 . A A . 30 TRP CE2 1 1 4 2078 1 1 30 TRP CE3 C 6.466 11.850 -10.800 1.00 . A A . 30 TRP CE3 1 1 4 2079 1 1 30 TRP CG C 5.934 9.646 -12.075 1.00 . A A . 30 TRP CG 1 1 4 2080 1 1 30 TRP CH2 C 5.755 13.824 -12.006 1.00 . A A . 30 TRP CH2 1 1 4 2081 1 1 30 TRP CZ2 C 5.266 13.076 -13.041 1.00 . A A . 30 TRP CZ2 1 1 4 2082 1 1 30 TRP CZ3 C 6.350 13.224 -10.891 1.00 . A A . 30 TRP CZ3 1 1 4 2083 1 1 30 TRP H H 5.827 6.323 -9.175 1.00 . A A . 30 TRP H 1 1 4 2084 1 1 30 TRP HA H 5.276 9.085 -9.438 1.00 . A A . 30 TRP HA 1 1 4 2085 1 1 30 TRP HB2 H 7.405 8.895 -10.768 1.00 . A A . 30 TRP HB2 1 1 4 2086 1 1 30 TRP HB3 H 6.627 7.676 -11.771 1.00 . A A . 30 TRP HB3 1 1 4 2087 1 1 30 TRP HD1 H 5.135 8.528 -13.741 1.00 . A A . 30 TRP HD1 1 1 4 2088 1 1 30 TRP HE1 H 4.541 10.849 -14.673 1.00 . A A . 30 TRP HE1 1 1 4 2089 1 1 30 TRP HE3 H 6.926 11.393 -9.937 1.00 . A A . 30 TRP HE3 1 1 4 2090 1 1 30 TRP HH2 H 5.684 14.900 -12.038 1.00 . A A . 30 TRP HH2 1 1 4 2091 1 1 30 TRP HZ2 H 4.810 13.556 -13.894 1.00 . A A . 30 TRP HZ2 1 1 4 2092 1 1 30 TRP HZ3 H 6.724 13.848 -10.093 1.00 . A A . 30 TRP HZ3 1 1 4 2093 1 1 30 TRP N N 6.123 7.255 -9.107 1.00 . A A . 30 TRP N 1 1 4 2094 1 1 30 TRP NE1 N 4.989 10.713 -13.807 1.00 . A A . 30 TRP NE1 1 1 4 2095 1 1 30 TRP O O 4.314 6.711 -11.394 1.00 . A A . 30 TRP O 1 1 4 2096 1 1 30 TRP OXT O 3.171 7.912 -9.964 1.00 . A A . 30 TRP OXT 1 1 5 2097 1 1 1 TYR C C -10.549 -0.049 2.682 1.00 . A A . 1 TYR C 1 1 5 2098 1 1 1 TYR CA C -11.803 0.287 3.499 1.00 . A A . 1 TYR CA 1 1 5 2099 1 1 1 TYR CB C -12.646 1.388 2.817 1.00 . A A . 1 TYR CB 1 1 5 2100 1 1 1 TYR CD1 C -14.232 0.152 1.286 1.00 . A A . 1 TYR CD1 1 1 5 2101 1 1 1 TYR CD2 C -12.612 1.588 0.297 1.00 . A A . 1 TYR CD2 1 1 5 2102 1 1 1 TYR CE1 C -14.717 -0.168 0.037 1.00 . A A . 1 TYR CE1 1 1 5 2103 1 1 1 TYR CE2 C -13.093 1.275 -0.954 1.00 . A A . 1 TYR CE2 1 1 5 2104 1 1 1 TYR CG C -13.170 1.033 1.440 1.00 . A A . 1 TYR CG 1 1 5 2105 1 1 1 TYR CZ C -14.143 0.399 -1.079 1.00 . A A . 1 TYR CZ 1 1 5 2106 1 1 1 TYR H1 H -10.813 1.547 4.804 1.00 . A A . 1 TYR H1 1 1 5 2107 1 1 1 TYR H2 H -10.912 -0.065 5.305 1.00 . A A . 1 TYR H2 1 1 5 2108 1 1 1 TYR H3 H -12.278 0.933 5.390 1.00 . A A . 1 TYR H3 1 1 5 2109 1 1 1 TYR HA H -12.395 -0.611 3.590 1.00 . A A . 1 TYR HA 1 1 5 2110 1 1 1 TYR HB2 H -13.501 1.609 3.439 1.00 . A A . 1 TYR HB2 1 1 5 2111 1 1 1 TYR HB3 H -12.045 2.280 2.725 1.00 . A A . 1 TYR HB3 1 1 5 2112 1 1 1 TYR HD1 H -14.683 -0.295 2.161 1.00 . A A . 1 TYR HD1 1 1 5 2113 1 1 1 TYR HD2 H -11.785 2.279 0.390 1.00 . A A . 1 TYR HD2 1 1 5 2114 1 1 1 TYR HE1 H -15.543 -0.857 -0.053 1.00 . A A . 1 TYR HE1 1 1 5 2115 1 1 1 TYR HE2 H -12.638 1.722 -1.827 1.00 . A A . 1 TYR HE2 1 1 5 2116 1 1 1 TYR HH H -15.582 0.110 -2.327 1.00 . A A . 1 TYR HH 1 1 5 2117 1 1 1 TYR N N -11.426 0.708 4.838 1.00 . A A . 1 TYR N 1 1 5 2118 1 1 1 TYR O O -10.345 -1.197 2.279 1.00 . A A . 1 TYR O 1 1 5 2119 1 1 1 TYR OH O -14.616 0.081 -2.326 1.00 . A A . 1 TYR OH 1 1 5 2120 1 1 2 CYS C C -7.303 1.154 2.568 1.00 . A A . 2 CYS C 1 1 5 2121 1 1 2 CYS CA C -8.493 0.752 1.706 1.00 . A A . 2 CYS CA 1 1 5 2122 1 1 2 CYS CB C -8.583 1.611 0.439 1.00 . A A . 2 CYS CB 1 1 5 2123 1 1 2 CYS H H -9.823 1.812 2.891 1.00 . A A . 2 CYS H 1 1 5 2124 1 1 2 CYS HA H -8.406 -0.290 1.435 1.00 . A A . 2 CYS HA 1 1 5 2125 1 1 2 CYS HB2 H -9.486 1.358 -0.093 1.00 . A A . 2 CYS HB2 1 1 5 2126 1 1 2 CYS HB3 H -8.626 2.645 0.749 1.00 . A A . 2 CYS HB3 1 1 5 2127 1 1 2 CYS N N -9.695 0.927 2.487 1.00 . A A . 2 CYS N 1 1 5 2128 1 1 2 CYS O O -7.473 1.864 3.567 1.00 . A A . 2 CYS O 1 1 5 2129 1 1 2 CYS SG S -7.202 1.452 -0.746 1.00 . A A . 2 CYS SG 1 1 5 2130 1 1 3 GLN C C -4.253 2.232 2.594 1.00 . A A . 3 GLN C 1 1 5 2131 1 1 3 GLN CA C -4.947 0.957 3.011 1.00 . A A . 3 GLN CA 1 1 5 2132 1 1 3 GLN CB C -3.968 -0.220 3.000 1.00 . A A . 3 GLN CB 1 1 5 2133 1 1 3 GLN CD C -5.146 -1.415 4.869 1.00 . A A . 3 GLN CD 1 1 5 2134 1 1 3 GLN CG C -4.572 -1.527 3.481 1.00 . A A . 3 GLN CG 1 1 5 2135 1 1 3 GLN H H -6.070 0.162 1.391 1.00 . A A . 3 GLN H 1 1 5 2136 1 1 3 GLN HA H -5.297 1.095 4.023 1.00 . A A . 3 GLN HA 1 1 5 2137 1 1 3 GLN HB2 H -3.573 -0.361 2.007 1.00 . A A . 3 GLN HB2 1 1 5 2138 1 1 3 GLN HB3 H -3.146 0.023 3.657 1.00 . A A . 3 GLN HB3 1 1 5 2139 1 1 3 GLN HE21 H -3.419 -1.936 5.647 1.00 . A A . 3 GLN HE21 1 1 5 2140 1 1 3 GLN HE22 H -4.707 -1.606 6.764 1.00 . A A . 3 GLN HE22 1 1 5 2141 1 1 3 GLN HG2 H -5.363 -1.813 2.803 1.00 . A A . 3 GLN HG2 1 1 5 2142 1 1 3 GLN HG3 H -3.806 -2.289 3.480 1.00 . A A . 3 GLN HG3 1 1 5 2143 1 1 3 GLN N N -6.131 0.693 2.216 1.00 . A A . 3 GLN N 1 1 5 2144 1 1 3 GLN NE2 N -4.348 -1.679 5.853 1.00 . A A . 3 GLN NE2 1 1 5 2145 1 1 3 GLN O O -4.161 2.550 1.402 1.00 . A A . 3 GLN O 1 1 5 2146 1 1 3 GLN OE1 O -6.319 -1.092 5.051 1.00 . A A . 3 GLN OE1 1 1 5 2147 1 1 4 LYS C C -1.595 3.922 3.431 1.00 . A A . 4 LYS C 1 1 5 2148 1 1 4 LYS CA C -3.097 4.211 3.411 1.00 . A A . 4 LYS CA 1 1 5 2149 1 1 4 LYS CB C -3.463 5.141 4.572 1.00 . A A . 4 LYS CB 1 1 5 2150 1 1 4 LYS CD C -5.297 6.169 5.967 1.00 . A A . 4 LYS CD 1 1 5 2151 1 1 4 LYS CE C -6.777 6.107 6.324 1.00 . A A . 4 LYS CE 1 1 5 2152 1 1 4 LYS CG C -4.967 5.245 4.816 1.00 . A A . 4 LYS CG 1 1 5 2153 1 1 4 LYS H H -3.934 2.625 4.496 1.00 . A A . 4 LYS H 1 1 5 2154 1 1 4 LYS HA H -3.388 4.663 2.476 1.00 . A A . 4 LYS HA 1 1 5 2155 1 1 4 LYS HB2 H -2.998 4.767 5.473 1.00 . A A . 4 LYS HB2 1 1 5 2156 1 1 4 LYS HB3 H -3.080 6.129 4.365 1.00 . A A . 4 LYS HB3 1 1 5 2157 1 1 4 LYS HD2 H -4.715 5.881 6.829 1.00 . A A . 4 LYS HD2 1 1 5 2158 1 1 4 LYS HD3 H -5.048 7.182 5.686 1.00 . A A . 4 LYS HD3 1 1 5 2159 1 1 4 LYS HE2 H -7.012 5.106 6.653 1.00 . A A . 4 LYS HE2 1 1 5 2160 1 1 4 LYS HE3 H -6.955 6.797 7.134 1.00 . A A . 4 LYS HE3 1 1 5 2161 1 1 4 LYS HG2 H -5.438 5.634 3.925 1.00 . A A . 4 LYS HG2 1 1 5 2162 1 1 4 LYS HG3 H -5.355 4.260 5.030 1.00 . A A . 4 LYS HG3 1 1 5 2163 1 1 4 LYS HZ1 H -7.505 7.424 4.863 1.00 . A A . 4 LYS HZ1 1 1 5 2164 1 1 4 LYS HZ2 H -8.659 6.389 5.484 1.00 . A A . 4 LYS HZ2 1 1 5 2165 1 1 4 LYS HZ3 H -7.545 5.807 4.388 1.00 . A A . 4 LYS HZ3 1 1 5 2166 1 1 4 LYS N N -3.802 2.959 3.586 1.00 . A A . 4 LYS N 1 1 5 2167 1 1 4 LYS NZ N -7.663 6.453 5.193 1.00 . A A . 4 LYS NZ 1 1 5 2168 1 1 4 LYS O O -1.196 2.837 3.847 1.00 . A A . 4 LYS O 1 1 5 2169 1 1 5 TRP C C 1.263 4.464 4.401 1.00 . A A . 5 TRP C 1 1 5 2170 1 1 5 TRP CA C 0.716 4.724 3.008 1.00 . A A . 5 TRP CA 1 1 5 2171 1 1 5 TRP CB C 1.424 5.973 2.419 1.00 . A A . 5 TRP CB 1 1 5 2172 1 1 5 TRP CD1 C 0.451 8.038 3.594 1.00 . A A . 5 TRP CD1 1 1 5 2173 1 1 5 TRP CD2 C 2.565 7.613 4.139 1.00 . A A . 5 TRP CD2 1 1 5 2174 1 1 5 TRP CE2 C 2.146 8.754 4.833 1.00 . A A . 5 TRP CE2 1 1 5 2175 1 1 5 TRP CE3 C 3.865 7.153 4.330 1.00 . A A . 5 TRP CE3 1 1 5 2176 1 1 5 TRP CG C 1.457 7.170 3.340 1.00 . A A . 5 TRP CG 1 1 5 2177 1 1 5 TRP CH2 C 4.241 8.967 5.871 1.00 . A A . 5 TRP CH2 1 1 5 2178 1 1 5 TRP CZ2 C 2.976 9.443 5.703 1.00 . A A . 5 TRP CZ2 1 1 5 2179 1 1 5 TRP CZ3 C 4.689 7.836 5.196 1.00 . A A . 5 TRP CZ3 1 1 5 2180 1 1 5 TRP H H -1.154 5.749 2.748 1.00 . A A . 5 TRP H 1 1 5 2181 1 1 5 TRP HA H 0.931 3.869 2.384 1.00 . A A . 5 TRP HA 1 1 5 2182 1 1 5 TRP HB2 H 2.445 5.717 2.177 1.00 . A A . 5 TRP HB2 1 1 5 2183 1 1 5 TRP HB3 H 0.912 6.263 1.511 1.00 . A A . 5 TRP HB3 1 1 5 2184 1 1 5 TRP HD1 H -0.526 7.972 3.150 1.00 . A A . 5 TRP HD1 1 1 5 2185 1 1 5 TRP HE1 H 0.300 9.733 4.810 1.00 . A A . 5 TRP HE1 1 1 5 2186 1 1 5 TRP HE3 H 4.228 6.275 3.817 1.00 . A A . 5 TRP HE3 1 1 5 2187 1 1 5 TRP HH2 H 4.924 9.470 6.540 1.00 . A A . 5 TRP HH2 1 1 5 2188 1 1 5 TRP HZ2 H 2.647 10.322 6.237 1.00 . A A . 5 TRP HZ2 1 1 5 2189 1 1 5 TRP HZ3 H 5.700 7.496 5.360 1.00 . A A . 5 TRP HZ3 1 1 5 2190 1 1 5 TRP N N -0.767 4.902 3.051 1.00 . A A . 5 TRP N 1 1 5 2191 1 1 5 TRP NE1 N 0.857 8.993 4.480 1.00 . A A . 5 TRP NE1 1 1 5 2192 1 1 5 TRP O O 2.334 3.890 4.578 1.00 . A A . 5 TRP O 1 1 5 2193 1 1 6 MET C C 0.588 3.356 7.248 1.00 . A A . 6 MET C 1 1 5 2194 1 1 6 MET CA C 0.869 4.783 6.753 1.00 . A A . 6 MET CA 1 1 5 2195 1 1 6 MET CB C 0.085 5.818 7.566 1.00 . A A . 6 MET CB 1 1 5 2196 1 1 6 MET CE C -2.177 6.881 9.526 1.00 . A A . 6 MET CE 1 1 5 2197 1 1 6 MET CG C 0.336 5.771 9.058 1.00 . A A . 6 MET CG 1 1 5 2198 1 1 6 MET H H -0.318 5.360 5.120 1.00 . A A . 6 MET H 1 1 5 2199 1 1 6 MET HA H 1.918 5.025 6.808 1.00 . A A . 6 MET HA 1 1 5 2200 1 1 6 MET HB2 H 0.345 6.805 7.212 1.00 . A A . 6 MET HB2 1 1 5 2201 1 1 6 MET HB3 H -0.967 5.654 7.392 1.00 . A A . 6 MET HB3 1 1 5 2202 1 1 6 MET HE1 H -2.780 7.625 10.025 1.00 . A A . 6 MET HE1 1 1 5 2203 1 1 6 MET HE2 H -2.484 5.894 9.840 1.00 . A A . 6 MET HE2 1 1 5 2204 1 1 6 MET HE3 H -2.304 6.975 8.459 1.00 . A A . 6 MET HE3 1 1 5 2205 1 1 6 MET HG2 H -0.053 4.835 9.434 1.00 . A A . 6 MET HG2 1 1 5 2206 1 1 6 MET HG3 H 1.403 5.801 9.213 1.00 . A A . 6 MET HG3 1 1 5 2207 1 1 6 MET N N 0.514 4.910 5.374 1.00 . A A . 6 MET N 1 1 5 2208 1 1 6 MET O O 1.138 2.893 8.245 1.00 . A A . 6 MET O 1 1 5 2209 1 1 6 MET SD S -0.452 7.134 9.950 1.00 . A A . 6 MET SD 1 1 5 2210 1 1 7 TRP C C 0.094 0.311 5.974 1.00 . A A . 7 TRP C 1 1 5 2211 1 1 7 TRP CA C -0.641 1.317 6.862 1.00 . A A . 7 TRP CA 1 1 5 2212 1 1 7 TRP CB C -2.170 1.148 6.716 1.00 . A A . 7 TRP CB 1 1 5 2213 1 1 7 TRP CD1 C -2.597 2.816 8.670 1.00 . A A . 7 TRP CD1 1 1 5 2214 1 1 7 TRP CD2 C -4.435 2.206 7.549 1.00 . A A . 7 TRP CD2 1 1 5 2215 1 1 7 TRP CE2 C -4.806 3.108 8.562 1.00 . A A . 7 TRP CE2 1 1 5 2216 1 1 7 TRP CE3 C -5.426 1.690 6.722 1.00 . A A . 7 TRP CE3 1 1 5 2217 1 1 7 TRP CG C -3.015 2.035 7.619 1.00 . A A . 7 TRP CG 1 1 5 2218 1 1 7 TRP CH2 C -7.068 2.972 7.936 1.00 . A A . 7 TRP CH2 1 1 5 2219 1 1 7 TRP CZ2 C -6.123 3.497 8.762 1.00 . A A . 7 TRP CZ2 1 1 5 2220 1 1 7 TRP CZ3 C -6.732 2.076 6.925 1.00 . A A . 7 TRP CZ3 1 1 5 2221 1 1 7 TRP H H -0.556 3.051 5.674 1.00 . A A . 7 TRP H 1 1 5 2222 1 1 7 TRP HA H -0.362 1.143 7.891 1.00 . A A . 7 TRP HA 1 1 5 2223 1 1 7 TRP HB2 H -2.442 1.383 5.698 1.00 . A A . 7 TRP HB2 1 1 5 2224 1 1 7 TRP HB3 H -2.434 0.120 6.912 1.00 . A A . 7 TRP HB3 1 1 5 2225 1 1 7 TRP HD1 H -1.569 2.902 8.991 1.00 . A A . 7 TRP HD1 1 1 5 2226 1 1 7 TRP HE1 H -3.659 4.097 9.991 1.00 . A A . 7 TRP HE1 1 1 5 2227 1 1 7 TRP HE3 H -5.183 0.986 5.940 1.00 . A A . 7 TRP HE3 1 1 5 2228 1 1 7 TRP HH2 H -8.106 3.248 8.062 1.00 . A A . 7 TRP HH2 1 1 5 2229 1 1 7 TRP HZ2 H -6.406 4.191 9.540 1.00 . A A . 7 TRP HZ2 1 1 5 2230 1 1 7 TRP HZ3 H -7.513 1.686 6.289 1.00 . A A . 7 TRP HZ3 1 1 5 2231 1 1 7 TRP N N -0.236 2.663 6.516 1.00 . A A . 7 TRP N 1 1 5 2232 1 1 7 TRP NE1 N -3.674 3.469 9.230 1.00 . A A . 7 TRP NE1 1 1 5 2233 1 1 7 TRP O O 0.827 0.693 5.048 1.00 . A A . 7 TRP O 1 1 5 2234 1 1 8 THR C C -0.537 -2.754 4.747 1.00 . A A . 8 THR C 1 1 5 2235 1 1 8 THR CA C 0.568 -1.987 5.505 1.00 . A A . 8 THR CA 1 1 5 2236 1 1 8 THR CB C 1.341 -2.923 6.476 1.00 . A A . 8 THR CB 1 1 5 2237 1 1 8 THR CG2 C 2.450 -2.153 7.195 1.00 . A A . 8 THR CG2 1 1 5 2238 1 1 8 THR H H -0.619 -1.212 7.023 1.00 . A A . 8 THR H 1 1 5 2239 1 1 8 THR HA H 1.259 -1.523 4.814 1.00 . A A . 8 THR HA 1 1 5 2240 1 1 8 THR HB H 1.787 -3.728 5.911 1.00 . A A . 8 THR HB 1 1 5 2241 1 1 8 THR HG1 H 1.003 -3.855 8.162 1.00 . A A . 8 THR HG1 1 1 5 2242 1 1 8 THR HG21 H 2.995 -2.825 7.843 1.00 . A A . 8 THR HG21 1 1 5 2243 1 1 8 THR HG22 H 2.009 -1.366 7.787 1.00 . A A . 8 THR HG22 1 1 5 2244 1 1 8 THR HG23 H 3.127 -1.716 6.475 1.00 . A A . 8 THR HG23 1 1 5 2245 1 1 8 THR N N -0.057 -0.940 6.265 1.00 . A A . 8 THR N 1 1 5 2246 1 1 8 THR O O -1.730 -2.502 5.012 1.00 . A A . 8 THR O 1 1 5 2247 1 1 8 THR OG1 O 0.451 -3.470 7.466 1.00 . A A . 8 THR OG1 1 1 5 2248 1 1 9 CYS C C -1.053 -5.850 3.065 1.00 . A A . 9 CYS C 1 1 5 2249 1 1 9 CYS CA C -1.308 -4.362 3.151 1.00 . A A . 9 CYS CA 1 1 5 2250 1 1 9 CYS CB C -1.638 -3.761 1.790 1.00 . A A . 9 CYS CB 1 1 5 2251 1 1 9 CYS H H 0.702 -3.877 3.505 1.00 . A A . 9 CYS H 1 1 5 2252 1 1 9 CYS HA H -2.164 -4.231 3.796 1.00 . A A . 9 CYS HA 1 1 5 2253 1 1 9 CYS HB2 H -2.440 -4.329 1.342 1.00 . A A . 9 CYS HB2 1 1 5 2254 1 1 9 CYS HB3 H -1.964 -2.741 1.928 1.00 . A A . 9 CYS HB3 1 1 5 2255 1 1 9 CYS N N -0.213 -3.655 3.804 1.00 . A A . 9 CYS N 1 1 5 2256 1 1 9 CYS O O 0.014 -6.334 3.483 1.00 . A A . 9 CYS O 1 1 5 2257 1 1 9 CYS SG S -0.258 -3.756 0.624 1.00 . A A . 9 CYS SG 1 1 5 2258 1 1 10 ASP C C -2.708 -8.448 1.214 1.00 . A A . 10 ASP C 1 1 5 2259 1 1 10 ASP CA C -1.986 -8.028 2.458 1.00 . A A . 10 ASP CA 1 1 5 2260 1 1 10 ASP CB C -2.700 -8.667 3.660 1.00 . A A . 10 ASP CB 1 1 5 2261 1 1 10 ASP CG C -1.962 -8.568 4.960 1.00 . A A . 10 ASP CG 1 1 5 2262 1 1 10 ASP H H -2.804 -6.134 2.138 1.00 . A A . 10 ASP H 1 1 5 2263 1 1 10 ASP HA H -0.959 -8.361 2.430 1.00 . A A . 10 ASP HA 1 1 5 2264 1 1 10 ASP HB2 H -3.647 -8.166 3.790 1.00 . A A . 10 ASP HB2 1 1 5 2265 1 1 10 ASP HB3 H -2.888 -9.710 3.448 1.00 . A A . 10 ASP HB3 1 1 5 2266 1 1 10 ASP N N -2.023 -6.575 2.542 1.00 . A A . 10 ASP N 1 1 5 2267 1 1 10 ASP O O -2.962 -7.618 0.337 1.00 . A A . 10 ASP O 1 1 5 2268 1 1 10 ASP OD1 O -1.240 -9.510 5.315 1.00 . A A . 10 ASP OD1 1 1 5 2269 1 1 10 ASP OD2 O -2.118 -7.573 5.667 1.00 . A A . 10 ASP OD2 1 1 5 2270 1 1 11 SER C C -5.228 -9.694 0.083 1.00 . A A . 11 SER C 1 1 5 2271 1 1 11 SER CA C -3.800 -10.225 0.023 1.00 . A A . 11 SER CA 1 1 5 2272 1 1 11 SER CB C -3.769 -11.753 0.051 1.00 . A A . 11 SER CB 1 1 5 2273 1 1 11 SER H H -2.769 -10.360 1.814 1.00 . A A . 11 SER H 1 1 5 2274 1 1 11 SER HA H -3.336 -9.881 -0.889 1.00 . A A . 11 SER HA 1 1 5 2275 1 1 11 SER HB2 H -4.475 -12.139 -0.668 1.00 . A A . 11 SER HB2 1 1 5 2276 1 1 11 SER HB3 H -2.778 -12.105 -0.193 1.00 . A A . 11 SER HB3 1 1 5 2277 1 1 11 SER HG H -4.403 -13.158 1.190 1.00 . A A . 11 SER HG 1 1 5 2278 1 1 11 SER N N -3.045 -9.715 1.129 1.00 . A A . 11 SER N 1 1 5 2279 1 1 11 SER O O -5.784 -9.261 -0.928 1.00 . A A . 11 SER O 1 1 5 2280 1 1 11 SER OG O -4.116 -12.247 1.344 1.00 . A A . 11 SER OG 1 1 5 2281 1 1 12 GLU C C -7.193 -7.735 1.742 1.00 . A A . 12 GLU C 1 1 5 2282 1 1 12 GLU CA C -7.152 -9.222 1.444 1.00 . A A . 12 GLU CA 1 1 5 2283 1 1 12 GLU CB C -7.895 -10.006 2.502 1.00 . A A . 12 GLU CB 1 1 5 2284 1 1 12 GLU CD C -8.873 -12.183 3.187 1.00 . A A . 12 GLU CD 1 1 5 2285 1 1 12 GLU CG C -7.999 -11.486 2.202 1.00 . A A . 12 GLU CG 1 1 5 2286 1 1 12 GLU H H -5.303 -10.051 2.039 1.00 . A A . 12 GLU H 1 1 5 2287 1 1 12 GLU HA H -7.647 -9.375 0.497 1.00 . A A . 12 GLU HA 1 1 5 2288 1 1 12 GLU HB2 H -7.392 -9.884 3.449 1.00 . A A . 12 GLU HB2 1 1 5 2289 1 1 12 GLU HB3 H -8.897 -9.610 2.588 1.00 . A A . 12 GLU HB3 1 1 5 2290 1 1 12 GLU HG2 H -8.409 -11.617 1.212 1.00 . A A . 12 GLU HG2 1 1 5 2291 1 1 12 GLU HG3 H -7.011 -11.920 2.244 1.00 . A A . 12 GLU HG3 1 1 5 2292 1 1 12 GLU N N -5.803 -9.696 1.276 1.00 . A A . 12 GLU N 1 1 5 2293 1 1 12 GLU O O -8.077 -7.036 1.260 1.00 . A A . 12 GLU O 1 1 5 2294 1 1 12 GLU OE1 O -8.375 -12.606 4.241 1.00 . A A . 12 GLU OE1 1 1 5 2295 1 1 12 GLU OE2 O -10.101 -12.278 2.945 1.00 . A A . 12 GLU OE2 1 1 5 2296 1 1 13 ARG C C -5.684 -5.109 1.559 1.00 . A A . 13 ARG C 1 1 5 2297 1 1 13 ARG CA C -6.218 -5.805 2.797 1.00 . A A . 13 ARG CA 1 1 5 2298 1 1 13 ARG CB C -5.391 -5.427 4.035 1.00 . A A . 13 ARG CB 1 1 5 2299 1 1 13 ARG CD C -5.204 -5.364 6.544 1.00 . A A . 13 ARG CD 1 1 5 2300 1 1 13 ARG CG C -5.942 -5.960 5.351 1.00 . A A . 13 ARG CG 1 1 5 2301 1 1 13 ARG CZ C -2.801 -4.894 7.067 1.00 . A A . 13 ARG CZ 1 1 5 2302 1 1 13 ARG H H -5.609 -7.842 2.971 1.00 . A A . 13 ARG H 1 1 5 2303 1 1 13 ARG HA H -7.243 -5.493 2.935 1.00 . A A . 13 ARG HA 1 1 5 2304 1 1 13 ARG HB2 H -4.389 -5.812 3.911 1.00 . A A . 13 ARG HB2 1 1 5 2305 1 1 13 ARG HB3 H -5.341 -4.350 4.100 1.00 . A A . 13 ARG HB3 1 1 5 2306 1 1 13 ARG HD2 H -5.351 -4.293 6.539 1.00 . A A . 13 ARG HD2 1 1 5 2307 1 1 13 ARG HD3 H -5.617 -5.777 7.452 1.00 . A A . 13 ARG HD3 1 1 5 2308 1 1 13 ARG HE H -3.465 -6.451 6.020 1.00 . A A . 13 ARG HE 1 1 5 2309 1 1 13 ARG HG2 H -6.990 -5.707 5.422 1.00 . A A . 13 ARG HG2 1 1 5 2310 1 1 13 ARG HG3 H -5.830 -7.034 5.369 1.00 . A A . 13 ARG HG3 1 1 5 2311 1 1 13 ARG HH11 H -4.044 -3.512 7.911 1.00 . A A . 13 ARG HH11 1 1 5 2312 1 1 13 ARG HH12 H -2.388 -3.257 8.209 1.00 . A A . 13 ARG HH12 1 1 5 2313 1 1 13 ARG HH21 H -1.323 -6.095 6.415 1.00 . A A . 13 ARG HH21 1 1 5 2314 1 1 13 ARG HH22 H -0.780 -4.711 7.303 1.00 . A A . 13 ARG HH22 1 1 5 2315 1 1 13 ARG N N -6.259 -7.240 2.554 1.00 . A A . 13 ARG N 1 1 5 2316 1 1 13 ARG NE N -3.763 -5.640 6.504 1.00 . A A . 13 ARG NE 1 1 5 2317 1 1 13 ARG NH1 N -3.099 -3.817 7.771 1.00 . A A . 13 ARG NH1 1 1 5 2318 1 1 13 ARG NH2 N -1.543 -5.256 6.930 1.00 . A A . 13 ARG NH2 1 1 5 2319 1 1 13 ARG O O -4.501 -5.238 1.223 1.00 . A A . 13 ARG O 1 1 5 2320 1 1 14 LYS C C -5.571 -2.430 -0.173 1.00 . A A . 14 LYS C 1 1 5 2321 1 1 14 LYS CA C -6.259 -3.751 -0.362 1.00 . A A . 14 LYS CA 1 1 5 2322 1 1 14 LYS CB C -7.549 -3.535 -1.159 1.00 . A A . 14 LYS CB 1 1 5 2323 1 1 14 LYS CD C -9.591 -4.499 -2.306 1.00 . A A . 14 LYS CD 1 1 5 2324 1 1 14 LYS CE C -9.344 -3.718 -3.597 1.00 . A A . 14 LYS CE 1 1 5 2325 1 1 14 LYS CG C -8.282 -4.811 -1.566 1.00 . A A . 14 LYS CG 1 1 5 2326 1 1 14 LYS H H -7.423 -4.206 1.322 1.00 . A A . 14 LYS H 1 1 5 2327 1 1 14 LYS HA H -5.620 -4.414 -0.923 1.00 . A A . 14 LYS HA 1 1 5 2328 1 1 14 LYS HB2 H -8.223 -2.939 -0.562 1.00 . A A . 14 LYS HB2 1 1 5 2329 1 1 14 LYS HB3 H -7.300 -2.983 -2.053 1.00 . A A . 14 LYS HB3 1 1 5 2330 1 1 14 LYS HD2 H -10.086 -5.425 -2.551 1.00 . A A . 14 LYS HD2 1 1 5 2331 1 1 14 LYS HD3 H -10.227 -3.915 -1.657 1.00 . A A . 14 LYS HD3 1 1 5 2332 1 1 14 LYS HE2 H -8.824 -2.801 -3.359 1.00 . A A . 14 LYS HE2 1 1 5 2333 1 1 14 LYS HE3 H -8.732 -4.317 -4.253 1.00 . A A . 14 LYS HE3 1 1 5 2334 1 1 14 LYS HG2 H -7.643 -5.389 -2.217 1.00 . A A . 14 LYS HG2 1 1 5 2335 1 1 14 LYS HG3 H -8.506 -5.386 -0.679 1.00 . A A . 14 LYS HG3 1 1 5 2336 1 1 14 LYS HZ1 H -10.373 -2.822 -5.147 1.00 . A A . 14 LYS HZ1 1 1 5 2337 1 1 14 LYS HZ2 H -11.214 -2.786 -3.689 1.00 . A A . 14 LYS HZ2 1 1 5 2338 1 1 14 LYS HZ3 H -11.125 -4.217 -4.583 1.00 . A A . 14 LYS HZ3 1 1 5 2339 1 1 14 LYS N N -6.549 -4.374 0.910 1.00 . A A . 14 LYS N 1 1 5 2340 1 1 14 LYS NZ N -10.601 -3.368 -4.292 1.00 . A A . 14 LYS NZ 1 1 5 2341 1 1 14 LYS O O -6.058 -1.568 0.561 1.00 . A A . 14 LYS O 1 1 5 2342 1 1 15 CYS C C -4.164 -0.174 -1.915 1.00 . A A . 15 CYS C 1 1 5 2343 1 1 15 CYS CA C -3.743 -1.017 -0.742 1.00 . A A . 15 CYS CA 1 1 5 2344 1 1 15 CYS CB C -2.240 -1.240 -0.748 1.00 . A A . 15 CYS CB 1 1 5 2345 1 1 15 CYS H H -4.107 -2.988 -1.381 1.00 . A A . 15 CYS H 1 1 5 2346 1 1 15 CYS HA H -4.041 -0.510 0.162 1.00 . A A . 15 CYS HA 1 1 5 2347 1 1 15 CYS HB2 H -1.986 -2.011 -0.041 1.00 . A A . 15 CYS HB2 1 1 5 2348 1 1 15 CYS HB3 H -1.956 -1.556 -1.739 1.00 . A A . 15 CYS HB3 1 1 5 2349 1 1 15 CYS N N -4.454 -2.263 -0.816 1.00 . A A . 15 CYS N 1 1 5 2350 1 1 15 CYS O O -4.378 -0.699 -3.012 1.00 . A A . 15 CYS O 1 1 5 2351 1 1 15 CYS SG S -1.258 0.237 -0.344 1.00 . A A . 15 CYS SG 1 1 5 2352 1 1 16 CYS C C -3.761 2.148 -3.867 1.00 . A A . 16 CYS C 1 1 5 2353 1 1 16 CYS CA C -4.788 1.980 -2.737 1.00 . A A . 16 CYS CA 1 1 5 2354 1 1 16 CYS CB C -5.158 3.341 -2.149 1.00 . A A . 16 CYS CB 1 1 5 2355 1 1 16 CYS H H -4.077 1.460 -0.821 1.00 . A A . 16 CYS H 1 1 5 2356 1 1 16 CYS HA H -5.679 1.531 -3.148 1.00 . A A . 16 CYS HA 1 1 5 2357 1 1 16 CYS HB2 H -4.276 3.770 -1.699 1.00 . A A . 16 CYS HB2 1 1 5 2358 1 1 16 CYS HB3 H -5.477 3.984 -2.956 1.00 . A A . 16 CYS HB3 1 1 5 2359 1 1 16 CYS N N -4.303 1.094 -1.704 1.00 . A A . 16 CYS N 1 1 5 2360 1 1 16 CYS O O -2.537 2.158 -3.632 1.00 . A A . 16 CYS O 1 1 5 2361 1 1 16 CYS SG S -6.474 3.347 -0.862 1.00 . A A . 16 CYS SG 1 1 5 2362 1 1 17 LYS C C -2.748 3.814 -6.122 1.00 . A A . 17 LYS C 1 1 5 2363 1 1 17 LYS CA C -3.402 2.461 -6.240 1.00 . A A . 17 LYS CA 1 1 5 2364 1 1 17 LYS CB C -4.182 2.317 -7.538 1.00 . A A . 17 LYS CB 1 1 5 2365 1 1 17 LYS CD C -5.465 0.784 -9.059 1.00 . A A . 17 LYS CD 1 1 5 2366 1 1 17 LYS CE C -5.710 -0.670 -9.450 1.00 . A A . 17 LYS CE 1 1 5 2367 1 1 17 LYS CG C -4.597 0.887 -7.824 1.00 . A A . 17 LYS CG 1 1 5 2368 1 1 17 LYS H H -5.222 2.157 -5.219 1.00 . A A . 17 LYS H 1 1 5 2369 1 1 17 LYS HA H -2.622 1.715 -6.208 1.00 . A A . 17 LYS HA 1 1 5 2370 1 1 17 LYS HB2 H -5.069 2.931 -7.480 1.00 . A A . 17 LYS HB2 1 1 5 2371 1 1 17 LYS HB3 H -3.569 2.663 -8.357 1.00 . A A . 17 LYS HB3 1 1 5 2372 1 1 17 LYS HD2 H -6.416 1.256 -8.860 1.00 . A A . 17 LYS HD2 1 1 5 2373 1 1 17 LYS HD3 H -4.974 1.290 -9.876 1.00 . A A . 17 LYS HD3 1 1 5 2374 1 1 17 LYS HE2 H -6.387 -0.684 -10.293 1.00 . A A . 17 LYS HE2 1 1 5 2375 1 1 17 LYS HE3 H -4.771 -1.109 -9.750 1.00 . A A . 17 LYS HE3 1 1 5 2376 1 1 17 LYS HG2 H -3.709 0.290 -7.969 1.00 . A A . 17 LYS HG2 1 1 5 2377 1 1 17 LYS HG3 H -5.144 0.509 -6.973 1.00 . A A . 17 LYS HG3 1 1 5 2378 1 1 17 LYS HZ1 H -6.550 -2.418 -8.717 1.00 . A A . 17 LYS HZ1 1 1 5 2379 1 1 17 LYS HZ2 H -7.150 -1.028 -7.964 1.00 . A A . 17 LYS HZ2 1 1 5 2380 1 1 17 LYS HZ3 H -5.604 -1.604 -7.589 1.00 . A A . 17 LYS HZ3 1 1 5 2381 1 1 17 LYS N N -4.253 2.235 -5.092 1.00 . A A . 17 LYS N 1 1 5 2382 1 1 17 LYS NZ N -6.296 -1.475 -8.355 1.00 . A A . 17 LYS NZ 1 1 5 2383 1 1 17 LYS O O -3.374 4.779 -5.683 1.00 . A A . 17 LYS O 1 1 5 2384 1 1 18 GLY C C 0.341 4.692 -5.256 1.00 . A A . 18 GLY C 1 1 5 2385 1 1 18 GLY CA C -0.719 5.049 -6.260 1.00 . A A . 18 GLY CA 1 1 5 2386 1 1 18 GLY H H -1.085 3.121 -6.950 1.00 . A A . 18 GLY H 1 1 5 2387 1 1 18 GLY HA2 H -0.265 5.374 -7.185 1.00 . A A . 18 GLY HA2 1 1 5 2388 1 1 18 GLY HA3 H -1.337 5.834 -5.851 1.00 . A A . 18 GLY HA3 1 1 5 2389 1 1 18 GLY N N -1.514 3.878 -6.494 1.00 . A A . 18 GLY N 1 1 5 2390 1 1 18 GLY O O 1.303 5.445 -5.010 1.00 . A A . 18 GLY O 1 1 5 2391 1 1 19 MET C C 1.264 1.505 -4.222 1.00 . A A . 19 MET C 1 1 5 2392 1 1 19 MET CA C 1.034 2.919 -3.752 1.00 . A A . 19 MET CA 1 1 5 2393 1 1 19 MET CB C 0.477 2.922 -2.327 1.00 . A A . 19 MET CB 1 1 5 2394 1 1 19 MET CE C -2.028 3.994 -0.570 1.00 . A A . 19 MET CE 1 1 5 2395 1 1 19 MET CG C 0.482 4.289 -1.678 1.00 . A A . 19 MET CG 1 1 5 2396 1 1 19 MET H H -0.717 3.069 -4.820 1.00 . A A . 19 MET H 1 1 5 2397 1 1 19 MET HA H 1.969 3.462 -3.774 1.00 . A A . 19 MET HA 1 1 5 2398 1 1 19 MET HB2 H -0.541 2.561 -2.359 1.00 . A A . 19 MET HB2 1 1 5 2399 1 1 19 MET HB3 H 1.066 2.251 -1.718 1.00 . A A . 19 MET HB3 1 1 5 2400 1 1 19 MET HE1 H -2.662 4.025 0.302 1.00 . A A . 19 MET HE1 1 1 5 2401 1 1 19 MET HE2 H -2.082 3.011 -1.013 1.00 . A A . 19 MET HE2 1 1 5 2402 1 1 19 MET HE3 H -2.362 4.733 -1.284 1.00 . A A . 19 MET HE3 1 1 5 2403 1 1 19 MET HG2 H 1.516 4.520 -1.479 1.00 . A A . 19 MET HG2 1 1 5 2404 1 1 19 MET HG3 H 0.048 5.018 -2.346 1.00 . A A . 19 MET HG3 1 1 5 2405 1 1 19 MET N N 0.126 3.543 -4.653 1.00 . A A . 19 MET N 1 1 5 2406 1 1 19 MET O O 0.482 0.972 -5.034 1.00 . A A . 19 MET O 1 1 5 2407 1 1 19 MET SD S -0.351 4.349 -0.097 1.00 . A A . 19 MET SD 1 1 5 2408 1 1 20 VAL C C 2.313 -1.286 -2.876 1.00 . A A . 20 VAL C 1 1 5 2409 1 1 20 VAL CA C 2.655 -0.436 -4.070 1.00 . A A . 20 VAL CA 1 1 5 2410 1 1 20 VAL CB C 4.183 -0.557 -4.368 1.00 . A A . 20 VAL CB 1 1 5 2411 1 1 20 VAL CG1 C 4.566 -1.979 -4.769 1.00 . A A . 20 VAL CG1 1 1 5 2412 1 1 20 VAL CG2 C 4.608 0.431 -5.445 1.00 . A A . 20 VAL CG2 1 1 5 2413 1 1 20 VAL H H 2.872 1.401 -3.101 1.00 . A A . 20 VAL H 1 1 5 2414 1 1 20 VAL HA H 2.089 -0.753 -4.933 1.00 . A A . 20 VAL HA 1 1 5 2415 1 1 20 VAL HB H 4.717 -0.318 -3.460 1.00 . A A . 20 VAL HB 1 1 5 2416 1 1 20 VAL HG11 H 4.302 -2.661 -3.975 1.00 . A A . 20 VAL HG11 1 1 5 2417 1 1 20 VAL HG12 H 5.629 -2.028 -4.947 1.00 . A A . 20 VAL HG12 1 1 5 2418 1 1 20 VAL HG13 H 4.040 -2.253 -5.672 1.00 . A A . 20 VAL HG13 1 1 5 2419 1 1 20 VAL HG21 H 4.401 1.437 -5.114 1.00 . A A . 20 VAL HG21 1 1 5 2420 1 1 20 VAL HG22 H 4.056 0.231 -6.353 1.00 . A A . 20 VAL HG22 1 1 5 2421 1 1 20 VAL HG23 H 5.666 0.325 -5.637 1.00 . A A . 20 VAL HG23 1 1 5 2422 1 1 20 VAL N N 2.299 0.911 -3.736 1.00 . A A . 20 VAL N 1 1 5 2423 1 1 20 VAL O O 2.691 -0.953 -1.739 1.00 . A A . 20 VAL O 1 1 5 2424 1 1 21 CYS C C 2.201 -4.227 -1.769 1.00 . A A . 21 CYS C 1 1 5 2425 1 1 21 CYS CA C 1.143 -3.190 -2.053 1.00 . A A . 21 CYS CA 1 1 5 2426 1 1 21 CYS CB C -0.186 -3.867 -2.409 1.00 . A A . 21 CYS CB 1 1 5 2427 1 1 21 CYS H H 1.376 -2.583 -4.039 1.00 . A A . 21 CYS H 1 1 5 2428 1 1 21 CYS HA H 1.001 -2.580 -1.172 1.00 . A A . 21 CYS HA 1 1 5 2429 1 1 21 CYS HB2 H -0.886 -3.124 -2.761 1.00 . A A . 21 CYS HB2 1 1 5 2430 1 1 21 CYS HB3 H -0.012 -4.588 -3.195 1.00 . A A . 21 CYS HB3 1 1 5 2431 1 1 21 CYS N N 1.586 -2.340 -3.112 1.00 . A A . 21 CYS N 1 1 5 2432 1 1 21 CYS O O 2.733 -4.859 -2.692 1.00 . A A . 21 CYS O 1 1 5 2433 1 1 21 CYS SG S -0.964 -4.753 -1.005 1.00 . A A . 21 CYS SG 1 1 5 2434 1 1 22 ARG C C 3.379 -5.370 1.451 1.00 . A A . 22 ARG C 1 1 5 2435 1 1 22 ARG CA C 3.501 -5.317 -0.076 1.00 . A A . 22 ARG CA 1 1 5 2436 1 1 22 ARG CB C 4.908 -4.822 -0.501 1.00 . A A . 22 ARG CB 1 1 5 2437 1 1 22 ARG CD C 5.530 -6.769 -1.969 1.00 . A A . 22 ARG CD 1 1 5 2438 1 1 22 ARG CG C 5.927 -5.924 -0.764 1.00 . A A . 22 ARG CG 1 1 5 2439 1 1 22 ARG CZ C 6.434 -8.673 -3.304 1.00 . A A . 22 ARG CZ 1 1 5 2440 1 1 22 ARG H H 2.080 -3.843 0.178 1.00 . A A . 22 ARG H 1 1 5 2441 1 1 22 ARG HA H 3.300 -6.289 -0.499 1.00 . A A . 22 ARG HA 1 1 5 2442 1 1 22 ARG HB2 H 4.812 -4.246 -1.409 1.00 . A A . 22 ARG HB2 1 1 5 2443 1 1 22 ARG HB3 H 5.298 -4.182 0.277 1.00 . A A . 22 ARG HB3 1 1 5 2444 1 1 22 ARG HD2 H 4.581 -7.240 -1.773 1.00 . A A . 22 ARG HD2 1 1 5 2445 1 1 22 ARG HD3 H 5.441 -6.124 -2.831 1.00 . A A . 22 ARG HD3 1 1 5 2446 1 1 22 ARG HE H 7.259 -7.869 -1.625 1.00 . A A . 22 ARG HE 1 1 5 2447 1 1 22 ARG HG2 H 6.883 -5.466 -0.965 1.00 . A A . 22 ARG HG2 1 1 5 2448 1 1 22 ARG HG3 H 6.006 -6.562 0.102 1.00 . A A . 22 ARG HG3 1 1 5 2449 1 1 22 ARG HH11 H 4.730 -7.865 -4.139 1.00 . A A . 22 ARG HH11 1 1 5 2450 1 1 22 ARG HH12 H 5.376 -9.208 -4.960 1.00 . A A . 22 ARG HH12 1 1 5 2451 1 1 22 ARG HH21 H 8.122 -9.732 -2.831 1.00 . A A . 22 ARG HH21 1 1 5 2452 1 1 22 ARG HH22 H 7.297 -10.267 -4.232 1.00 . A A . 22 ARG HH22 1 1 5 2453 1 1 22 ARG N N 2.527 -4.381 -0.513 1.00 . A A . 22 ARG N 1 1 5 2454 1 1 22 ARG NE N 6.512 -7.817 -2.265 1.00 . A A . 22 ARG NE 1 1 5 2455 1 1 22 ARG NH1 N 5.446 -8.567 -4.191 1.00 . A A . 22 ARG NH1 1 1 5 2456 1 1 22 ARG NH2 N 7.350 -9.619 -3.464 1.00 . A A . 22 ARG NH2 1 1 5 2457 1 1 22 ARG O O 2.281 -5.024 2.019 1.00 . A A . 22 ARG O 1 1 5 2458 1 1 23 LEU C C 4.062 -4.528 4.157 1.00 . A A . 23 LEU C 1 1 5 2459 1 1 23 LEU CA C 4.568 -5.841 3.563 1.00 . A A . 23 LEU CA 1 1 5 2460 1 1 23 LEU CB C 6.039 -6.167 3.970 1.00 . A A . 23 LEU CB 1 1 5 2461 1 1 23 LEU CD1 C 7.738 -7.119 5.557 1.00 . A A . 23 LEU CD1 1 1 5 2462 1 1 23 LEU CD2 C 6.308 -5.266 6.352 1.00 . A A . 23 LEU CD2 1 1 5 2463 1 1 23 LEU CG C 6.353 -6.503 5.457 1.00 . A A . 23 LEU CG 1 1 5 2464 1 1 23 LEU H H 5.253 -6.061 1.595 1.00 . A A . 23 LEU H 1 1 5 2465 1 1 23 LEU HA H 3.919 -6.639 3.893 1.00 . A A . 23 LEU HA 1 1 5 2466 1 1 23 LEU HB2 H 6.350 -7.016 3.380 1.00 . A A . 23 LEU HB2 1 1 5 2467 1 1 23 LEU HB3 H 6.653 -5.330 3.676 1.00 . A A . 23 LEU HB3 1 1 5 2468 1 1 23 LEU HD11 H 8.471 -6.420 5.181 1.00 . A A . 23 LEU HD11 1 1 5 2469 1 1 23 LEU HD12 H 7.772 -8.028 4.975 1.00 . A A . 23 LEU HD12 1 1 5 2470 1 1 23 LEU HD13 H 7.956 -7.347 6.592 1.00 . A A . 23 LEU HD13 1 1 5 2471 1 1 23 LEU HD21 H 7.048 -4.553 6.022 1.00 . A A . 23 LEU HD21 1 1 5 2472 1 1 23 LEU HD22 H 6.513 -5.550 7.374 1.00 . A A . 23 LEU HD22 1 1 5 2473 1 1 23 LEU HD23 H 5.326 -4.817 6.293 1.00 . A A . 23 LEU HD23 1 1 5 2474 1 1 23 LEU HG H 5.637 -7.226 5.821 1.00 . A A . 23 LEU HG 1 1 5 2475 1 1 23 LEU N N 4.473 -5.774 2.114 1.00 . A A . 23 LEU N 1 1 5 2476 1 1 23 LEU O O 3.372 -4.532 5.153 1.00 . A A . 23 LEU O 1 1 5 2477 1 1 24 TRP C C 3.352 -1.462 2.582 1.00 . A A . 24 TRP C 1 1 5 2478 1 1 24 TRP CA C 3.829 -2.147 3.863 1.00 . A A . 24 TRP CA 1 1 5 2479 1 1 24 TRP CB C 4.903 -1.294 4.579 1.00 . A A . 24 TRP CB 1 1 5 2480 1 1 24 TRP CD1 C 6.020 0.469 3.122 1.00 . A A . 24 TRP CD1 1 1 5 2481 1 1 24 TRP CD2 C 7.164 -1.440 3.244 1.00 . A A . 24 TRP CD2 1 1 5 2482 1 1 24 TRP CE2 C 7.870 -0.551 2.413 1.00 . A A . 24 TRP CE2 1 1 5 2483 1 1 24 TRP CE3 C 7.690 -2.707 3.473 1.00 . A A . 24 TRP CE3 1 1 5 2484 1 1 24 TRP CG C 5.984 -0.764 3.683 1.00 . A A . 24 TRP CG 1 1 5 2485 1 1 24 TRP CH2 C 9.561 -2.144 2.054 1.00 . A A . 24 TRP CH2 1 1 5 2486 1 1 24 TRP CZ2 C 9.071 -0.893 1.810 1.00 . A A . 24 TRP CZ2 1 1 5 2487 1 1 24 TRP CZ3 C 8.882 -3.048 2.876 1.00 . A A . 24 TRP CZ3 1 1 5 2488 1 1 24 TRP H H 4.905 -3.465 2.684 1.00 . A A . 24 TRP H 1 1 5 2489 1 1 24 TRP HA H 2.992 -2.323 4.520 1.00 . A A . 24 TRP HA 1 1 5 2490 1 1 24 TRP HB2 H 4.425 -0.446 5.045 1.00 . A A . 24 TRP HB2 1 1 5 2491 1 1 24 TRP HB3 H 5.369 -1.896 5.344 1.00 . A A . 24 TRP HB3 1 1 5 2492 1 1 24 TRP HD1 H 5.234 1.192 3.289 1.00 . A A . 24 TRP HD1 1 1 5 2493 1 1 24 TRP HE1 H 7.420 1.401 1.834 1.00 . A A . 24 TRP HE1 1 1 5 2494 1 1 24 TRP HE3 H 7.175 -3.410 4.110 1.00 . A A . 24 TRP HE3 1 1 5 2495 1 1 24 TRP HH2 H 10.492 -2.455 1.607 1.00 . A A . 24 TRP HH2 1 1 5 2496 1 1 24 TRP HZ2 H 9.613 -0.210 1.172 1.00 . A A . 24 TRP HZ2 1 1 5 2497 1 1 24 TRP HZ3 H 9.306 -4.028 3.040 1.00 . A A . 24 TRP HZ3 1 1 5 2498 1 1 24 TRP N N 4.350 -3.430 3.490 1.00 . A A . 24 TRP N 1 1 5 2499 1 1 24 TRP NE1 N 7.153 0.607 2.349 1.00 . A A . 24 TRP NE1 1 1 5 2500 1 1 24 TRP O O 3.670 -1.943 1.489 1.00 . A A . 24 TRP O 1 1 5 2501 1 1 25 CYS C C 3.258 1.372 1.183 1.00 . A A . 25 CYS C 1 1 5 2502 1 1 25 CYS CA C 2.192 0.354 1.519 1.00 . A A . 25 CYS CA 1 1 5 2503 1 1 25 CYS CB C 0.829 1.029 1.688 1.00 . A A . 25 CYS CB 1 1 5 2504 1 1 25 CYS H H 2.270 -0.084 3.568 1.00 . A A . 25 CYS H 1 1 5 2505 1 1 25 CYS HA H 2.141 -0.349 0.700 1.00 . A A . 25 CYS HA 1 1 5 2506 1 1 25 CYS HB2 H 0.784 1.491 2.664 1.00 . A A . 25 CYS HB2 1 1 5 2507 1 1 25 CYS HB3 H 0.717 1.791 0.932 1.00 . A A . 25 CYS HB3 1 1 5 2508 1 1 25 CYS N N 2.583 -0.401 2.694 1.00 . A A . 25 CYS N 1 1 5 2509 1 1 25 CYS O O 3.507 2.306 1.950 1.00 . A A . 25 CYS O 1 1 5 2510 1 1 25 CYS SG S -0.590 -0.106 1.554 1.00 . A A . 25 CYS SG 1 1 5 2511 1 1 26 LYS C C 4.434 2.996 -1.408 1.00 . A A . 26 LYS C 1 1 5 2512 1 1 26 LYS CA C 4.976 2.019 -0.389 1.00 . A A . 26 LYS CA 1 1 5 2513 1 1 26 LYS CB C 6.098 1.144 -0.981 1.00 . A A . 26 LYS CB 1 1 5 2514 1 1 26 LYS CD C 8.331 0.932 -2.090 1.00 . A A . 26 LYS CD 1 1 5 2515 1 1 26 LYS CE C 9.389 1.594 -2.964 1.00 . A A . 26 LYS CE 1 1 5 2516 1 1 26 LYS CG C 7.237 1.897 -1.659 1.00 . A A . 26 LYS CG 1 1 5 2517 1 1 26 LYS H H 3.606 0.426 -0.507 1.00 . A A . 26 LYS H 1 1 5 2518 1 1 26 LYS HA H 5.358 2.560 0.464 1.00 . A A . 26 LYS HA 1 1 5 2519 1 1 26 LYS HB2 H 6.525 0.554 -0.182 1.00 . A A . 26 LYS HB2 1 1 5 2520 1 1 26 LYS HB3 H 5.658 0.472 -1.700 1.00 . A A . 26 LYS HB3 1 1 5 2521 1 1 26 LYS HD2 H 8.812 0.538 -1.207 1.00 . A A . 26 LYS HD2 1 1 5 2522 1 1 26 LYS HD3 H 7.877 0.120 -2.641 1.00 . A A . 26 LYS HD3 1 1 5 2523 1 1 26 LYS HE2 H 10.153 0.862 -3.179 1.00 . A A . 26 LYS HE2 1 1 5 2524 1 1 26 LYS HE3 H 8.922 1.907 -3.886 1.00 . A A . 26 LYS HE3 1 1 5 2525 1 1 26 LYS HG2 H 6.851 2.408 -2.528 1.00 . A A . 26 LYS HG2 1 1 5 2526 1 1 26 LYS HG3 H 7.651 2.613 -0.967 1.00 . A A . 26 LYS HG3 1 1 5 2527 1 1 26 LYS HZ1 H 10.464 2.492 -1.417 1.00 . A A . 26 LYS HZ1 1 1 5 2528 1 1 26 LYS HZ2 H 9.360 3.534 -2.157 1.00 . A A . 26 LYS HZ2 1 1 5 2529 1 1 26 LYS HZ3 H 10.785 3.143 -2.929 1.00 . A A . 26 LYS HZ3 1 1 5 2530 1 1 26 LYS N N 3.898 1.172 0.064 1.00 . A A . 26 LYS N 1 1 5 2531 1 1 26 LYS NZ N 10.032 2.758 -2.322 1.00 . A A . 26 LYS NZ 1 1 5 2532 1 1 26 LYS O O 3.937 2.594 -2.448 1.00 . A A . 26 LYS O 1 1 5 2533 1 1 27 LYS C C 4.878 5.669 -3.103 1.00 . A A . 27 LYS C 1 1 5 2534 1 1 27 LYS CA C 3.945 5.263 -1.987 1.00 . A A . 27 LYS CA 1 1 5 2535 1 1 27 LYS CB C 3.439 6.483 -1.202 1.00 . A A . 27 LYS CB 1 1 5 2536 1 1 27 LYS CD C 3.867 8.367 0.383 1.00 . A A . 27 LYS CD 1 1 5 2537 1 1 27 LYS CE C 4.851 9.035 1.325 1.00 . A A . 27 LYS CE 1 1 5 2538 1 1 27 LYS CG C 4.476 7.167 -0.322 1.00 . A A . 27 LYS CG 1 1 5 2539 1 1 27 LYS H H 4.976 4.536 -0.293 1.00 . A A . 27 LYS H 1 1 5 2540 1 1 27 LYS HA H 3.097 4.807 -2.473 1.00 . A A . 27 LYS HA 1 1 5 2541 1 1 27 LYS HB2 H 3.074 7.214 -1.907 1.00 . A A . 27 LYS HB2 1 1 5 2542 1 1 27 LYS HB3 H 2.617 6.173 -0.572 1.00 . A A . 27 LYS HB3 1 1 5 2543 1 1 27 LYS HD2 H 3.552 9.082 -0.361 1.00 . A A . 27 LYS HD2 1 1 5 2544 1 1 27 LYS HD3 H 3.007 8.036 0.947 1.00 . A A . 27 LYS HD3 1 1 5 2545 1 1 27 LYS HE2 H 5.147 8.324 2.082 1.00 . A A . 27 LYS HE2 1 1 5 2546 1 1 27 LYS HE3 H 5.720 9.338 0.760 1.00 . A A . 27 LYS HE3 1 1 5 2547 1 1 27 LYS HG2 H 4.833 6.466 0.416 1.00 . A A . 27 LYS HG2 1 1 5 2548 1 1 27 LYS HG3 H 5.298 7.501 -0.939 1.00 . A A . 27 LYS HG3 1 1 5 2549 1 1 27 LYS HZ1 H 4.067 10.967 1.285 1.00 . A A . 27 LYS HZ1 1 1 5 2550 1 1 27 LYS HZ2 H 4.908 10.622 2.697 1.00 . A A . 27 LYS HZ2 1 1 5 2551 1 1 27 LYS HZ3 H 3.362 9.983 2.449 1.00 . A A . 27 LYS HZ3 1 1 5 2552 1 1 27 LYS N N 4.513 4.262 -1.113 1.00 . A A . 27 LYS N 1 1 5 2553 1 1 27 LYS NZ N 4.262 10.224 1.986 1.00 . A A . 27 LYS NZ 1 1 5 2554 1 1 27 LYS O O 6.113 5.632 -2.959 1.00 . A A . 27 LYS O 1 1 5 2555 1 1 28 LYS C C 5.490 7.899 -5.124 1.00 . A A . 28 LYS C 1 1 5 2556 1 1 28 LYS CA C 5.010 6.491 -5.377 1.00 . A A . 28 LYS CA 1 1 5 2557 1 1 28 LYS CB C 4.137 6.456 -6.639 1.00 . A A . 28 LYS CB 1 1 5 2558 1 1 28 LYS CD C 5.061 4.336 -7.611 1.00 . A A . 28 LYS CD 1 1 5 2559 1 1 28 LYS CE C 4.739 2.988 -8.220 1.00 . A A . 28 LYS CE 1 1 5 2560 1 1 28 LYS CG C 3.808 5.060 -7.153 1.00 . A A . 28 LYS CG 1 1 5 2561 1 1 28 LYS H H 3.306 5.943 -4.289 1.00 . A A . 28 LYS H 1 1 5 2562 1 1 28 LYS HA H 5.869 5.855 -5.527 1.00 . A A . 28 LYS HA 1 1 5 2563 1 1 28 LYS HB2 H 3.207 6.958 -6.422 1.00 . A A . 28 LYS HB2 1 1 5 2564 1 1 28 LYS HB3 H 4.644 6.997 -7.424 1.00 . A A . 28 LYS HB3 1 1 5 2565 1 1 28 LYS HD2 H 5.563 4.938 -8.354 1.00 . A A . 28 LYS HD2 1 1 5 2566 1 1 28 LYS HD3 H 5.716 4.189 -6.766 1.00 . A A . 28 LYS HD3 1 1 5 2567 1 1 28 LYS HE2 H 4.266 2.371 -7.471 1.00 . A A . 28 LYS HE2 1 1 5 2568 1 1 28 LYS HE3 H 4.062 3.132 -9.047 1.00 . A A . 28 LYS HE3 1 1 5 2569 1 1 28 LYS HG2 H 3.345 4.493 -6.359 1.00 . A A . 28 LYS HG2 1 1 5 2570 1 1 28 LYS HG3 H 3.123 5.143 -7.985 1.00 . A A . 28 LYS HG3 1 1 5 2571 1 1 28 LYS HZ1 H 6.622 2.126 -7.926 1.00 . A A . 28 LYS HZ1 1 1 5 2572 1 1 28 LYS HZ2 H 6.443 2.906 -9.400 1.00 . A A . 28 LYS HZ2 1 1 5 2573 1 1 28 LYS HZ3 H 5.722 1.408 -9.160 1.00 . A A . 28 LYS HZ3 1 1 5 2574 1 1 28 LYS N N 4.284 6.009 -4.229 1.00 . A A . 28 LYS N 1 1 5 2575 1 1 28 LYS NZ N 5.957 2.310 -8.702 1.00 . A A . 28 LYS NZ 1 1 5 2576 1 1 28 LYS O O 4.845 8.671 -4.406 1.00 . A A . 28 LYS O 1 1 5 2577 1 1 29 LEU C C 6.958 10.361 -6.784 1.00 . A A . 29 LEU C 1 1 5 2578 1 1 29 LEU CA C 7.193 9.537 -5.534 1.00 . A A . 29 LEU CA 1 1 5 2579 1 1 29 LEU CB C 8.690 9.421 -5.236 1.00 . A A . 29 LEU CB 1 1 5 2580 1 1 29 LEU CD1 C 10.566 8.602 -3.802 1.00 . A A . 29 LEU CD1 1 1 5 2581 1 1 29 LEU CD2 C 8.426 9.302 -2.728 1.00 . A A . 29 LEU CD2 1 1 5 2582 1 1 29 LEU CG C 9.063 8.661 -3.957 1.00 . A A . 29 LEU CG 1 1 5 2583 1 1 29 LEU H H 7.069 7.567 -6.262 1.00 . A A . 29 LEU H 1 1 5 2584 1 1 29 LEU HA H 6.703 10.022 -4.704 1.00 . A A . 29 LEU HA 1 1 5 2585 1 1 29 LEU HB2 H 9.156 8.922 -6.072 1.00 . A A . 29 LEU HB2 1 1 5 2586 1 1 29 LEU HB3 H 9.100 10.417 -5.165 1.00 . A A . 29 LEU HB3 1 1 5 2587 1 1 29 LEU HD11 H 10.818 8.065 -2.899 1.00 . A A . 29 LEU HD11 1 1 5 2588 1 1 29 LEU HD12 H 10.958 9.607 -3.752 1.00 . A A . 29 LEU HD12 1 1 5 2589 1 1 29 LEU HD13 H 10.984 8.092 -4.656 1.00 . A A . 29 LEU HD13 1 1 5 2590 1 1 29 LEU HD21 H 8.730 8.764 -1.844 1.00 . A A . 29 LEU HD21 1 1 5 2591 1 1 29 LEU HD22 H 7.350 9.262 -2.816 1.00 . A A . 29 LEU HD22 1 1 5 2592 1 1 29 LEU HD23 H 8.744 10.332 -2.652 1.00 . A A . 29 LEU HD23 1 1 5 2593 1 1 29 LEU HG H 8.701 7.646 -4.038 1.00 . A A . 29 LEU HG 1 1 5 2594 1 1 29 LEU N N 6.610 8.225 -5.696 1.00 . A A . 29 LEU N 1 1 5 2595 1 1 29 LEU O O 7.390 11.505 -6.870 1.00 . A A . 29 LEU O 1 1 5 2596 1 1 30 TRP C C 7.100 10.593 -9.889 1.00 . A A . 30 TRP C 1 1 5 2597 1 1 30 TRP CA C 5.886 10.350 -9.019 1.00 . A A . 30 TRP CA 1 1 5 2598 1 1 30 TRP CB C 5.041 11.632 -8.847 1.00 . A A . 30 TRP CB 1 1 5 2599 1 1 30 TRP CD1 C 3.435 11.332 -6.867 1.00 . A A . 30 TRP CD1 1 1 5 2600 1 1 30 TRP CD2 C 2.450 11.200 -8.869 1.00 . A A . 30 TRP CD2 1 1 5 2601 1 1 30 TRP CE2 C 1.470 11.021 -7.873 1.00 . A A . 30 TRP CE2 1 1 5 2602 1 1 30 TRP CE3 C 2.063 11.159 -10.211 1.00 . A A . 30 TRP CE3 1 1 5 2603 1 1 30 TRP CG C 3.704 11.396 -8.201 1.00 . A A . 30 TRP CG 1 1 5 2604 1 1 30 TRP CH2 C -0.220 10.771 -9.498 1.00 . A A . 30 TRP CH2 1 1 5 2605 1 1 30 TRP CZ2 C 0.129 10.806 -8.177 1.00 . A A . 30 TRP CZ2 1 1 5 2606 1 1 30 TRP CZ3 C 0.731 10.945 -10.512 1.00 . A A . 30 TRP CZ3 1 1 5 2607 1 1 30 TRP H H 6.041 8.809 -7.576 1.00 . A A . 30 TRP H 1 1 5 2608 1 1 30 TRP HA H 5.288 9.605 -9.524 1.00 . A A . 30 TRP HA 1 1 5 2609 1 1 30 TRP HB2 H 5.585 12.332 -8.232 1.00 . A A . 30 TRP HB2 1 1 5 2610 1 1 30 TRP HB3 H 4.872 12.071 -9.819 1.00 . A A . 30 TRP HB3 1 1 5 2611 1 1 30 TRP HD1 H 4.181 11.442 -6.095 1.00 . A A . 30 TRP HD1 1 1 5 2612 1 1 30 TRP HE1 H 1.666 11.016 -5.784 1.00 . A A . 30 TRP HE1 1 1 5 2613 1 1 30 TRP HE3 H 2.787 11.290 -11.002 1.00 . A A . 30 TRP HE3 1 1 5 2614 1 1 30 TRP HH2 H -1.250 10.605 -9.779 1.00 . A A . 30 TRP HH2 1 1 5 2615 1 1 30 TRP HZ2 H -0.623 10.671 -7.413 1.00 . A A . 30 TRP HZ2 1 1 5 2616 1 1 30 TRP HZ3 H 0.412 10.908 -11.544 1.00 . A A . 30 TRP HZ3 1 1 5 2617 1 1 30 TRP N N 6.269 9.747 -7.738 1.00 . A A . 30 TRP N 1 1 5 2618 1 1 30 TRP NE1 N 2.096 11.103 -6.664 1.00 . A A . 30 TRP NE1 1 1 5 2619 1 1 30 TRP O O 7.664 11.690 -9.873 1.00 . A A . 30 TRP O 1 1 5 2620 1 1 30 TRP OXT O 7.534 9.644 -10.575 1.00 . A A . 30 TRP OXT 1 1 6 2621 1 1 1 TYR C C -10.609 1.152 2.742 1.00 . A A . 1 TYR C 1 1 6 2622 1 1 1 TYR CA C -11.560 1.640 3.807 1.00 . A A . 1 TYR CA 1 1 6 2623 1 1 1 TYR CB C -11.040 1.219 5.186 1.00 . A A . 1 TYR CB 1 1 6 2624 1 1 1 TYR CD1 C -12.723 0.765 7.001 1.00 . A A . 1 TYR CD1 1 1 6 2625 1 1 1 TYR CD2 C -11.919 2.986 6.742 1.00 . A A . 1 TYR CD2 1 1 6 2626 1 1 1 TYR CE1 C -13.520 1.171 8.045 1.00 . A A . 1 TYR CE1 1 1 6 2627 1 1 1 TYR CE2 C -12.713 3.397 7.781 1.00 . A A . 1 TYR CE2 1 1 6 2628 1 1 1 TYR CG C -11.907 1.664 6.333 1.00 . A A . 1 TYR CG 1 1 6 2629 1 1 1 TYR CZ C -13.511 2.486 8.429 1.00 . A A . 1 TYR CZ 1 1 6 2630 1 1 1 TYR H1 H -12.848 0.052 3.612 1.00 . A A . 1 TYR H1 1 1 6 2631 1 1 1 TYR H2 H -13.174 1.348 2.601 1.00 . A A . 1 TYR H2 1 1 6 2632 1 1 1 TYR H3 H -13.579 1.459 4.240 1.00 . A A . 1 TYR H3 1 1 6 2633 1 1 1 TYR HA H -11.623 2.717 3.761 1.00 . A A . 1 TYR HA 1 1 6 2634 1 1 1 TYR HB2 H -10.976 0.142 5.222 1.00 . A A . 1 TYR HB2 1 1 6 2635 1 1 1 TYR HB3 H -10.051 1.631 5.333 1.00 . A A . 1 TYR HB3 1 1 6 2636 1 1 1 TYR HD1 H -12.727 -0.272 6.699 1.00 . A A . 1 TYR HD1 1 1 6 2637 1 1 1 TYR HD2 H -11.292 3.704 6.234 1.00 . A A . 1 TYR HD2 1 1 6 2638 1 1 1 TYR HE1 H -14.147 0.453 8.554 1.00 . A A . 1 TYR HE1 1 1 6 2639 1 1 1 TYR HE2 H -12.701 4.436 8.076 1.00 . A A . 1 TYR HE2 1 1 6 2640 1 1 1 TYR HH H -14.752 3.706 9.213 1.00 . A A . 1 TYR HH 1 1 6 2641 1 1 1 TYR N N -12.883 1.089 3.565 1.00 . A A . 1 TYR N 1 1 6 2642 1 1 1 TYR O O -10.942 0.252 1.966 1.00 . A A . 1 TYR O 1 1 6 2643 1 1 1 TYR OH O -14.297 2.893 9.470 1.00 . A A . 1 TYR OH 1 1 6 2644 1 1 2 CYS C C -7.133 1.598 2.590 1.00 . A A . 2 CYS C 1 1 6 2645 1 1 2 CYS CA C -8.403 1.384 1.808 1.00 . A A . 2 CYS CA 1 1 6 2646 1 1 2 CYS CB C -8.444 2.280 0.560 1.00 . A A . 2 CYS CB 1 1 6 2647 1 1 2 CYS H H -9.254 2.462 3.339 1.00 . A A . 2 CYS H 1 1 6 2648 1 1 2 CYS HA H -8.502 0.344 1.538 1.00 . A A . 2 CYS HA 1 1 6 2649 1 1 2 CYS HB2 H -9.420 2.215 0.108 1.00 . A A . 2 CYS HB2 1 1 6 2650 1 1 2 CYS HB3 H -8.262 3.296 0.877 1.00 . A A . 2 CYS HB3 1 1 6 2651 1 1 2 CYS N N -9.457 1.735 2.706 1.00 . A A . 2 CYS N 1 1 6 2652 1 1 2 CYS O O -7.151 2.330 3.594 1.00 . A A . 2 CYS O 1 1 6 2653 1 1 2 CYS SG S -7.216 1.881 -0.733 1.00 . A A . 2 CYS SG 1 1 6 2654 1 1 3 GLN C C -4.080 2.333 2.689 1.00 . A A . 3 GLN C 1 1 6 2655 1 1 3 GLN CA C -4.859 1.069 2.967 1.00 . A A . 3 GLN CA 1 1 6 2656 1 1 3 GLN CB C -3.982 -0.162 2.794 1.00 . A A . 3 GLN CB 1 1 6 2657 1 1 3 GLN CD C -5.278 -1.533 4.449 1.00 . A A . 3 GLN CD 1 1 6 2658 1 1 3 GLN CG C -4.671 -1.484 3.074 1.00 . A A . 3 GLN CG 1 1 6 2659 1 1 3 GLN H H -6.067 0.523 1.321 1.00 . A A . 3 GLN H 1 1 6 2660 1 1 3 GLN HA H -5.184 1.112 3.994 1.00 . A A . 3 GLN HA 1 1 6 2661 1 1 3 GLN HB2 H -3.586 -0.183 1.793 1.00 . A A . 3 GLN HB2 1 1 6 2662 1 1 3 GLN HB3 H -3.149 -0.073 3.477 1.00 . A A . 3 GLN HB3 1 1 6 2663 1 1 3 GLN HE21 H -3.577 -2.197 5.212 1.00 . A A . 3 GLN HE21 1 1 6 2664 1 1 3 GLN HE22 H -4.880 -1.990 6.324 1.00 . A A . 3 GLN HE22 1 1 6 2665 1 1 3 GLN HG2 H -5.457 -1.626 2.346 1.00 . A A . 3 GLN HG2 1 1 6 2666 1 1 3 GLN HG3 H -3.949 -2.282 2.983 1.00 . A A . 3 GLN HG3 1 1 6 2667 1 1 3 GLN N N -6.058 0.998 2.179 1.00 . A A . 3 GLN N 1 1 6 2668 1 1 3 GLN NE2 N -4.510 -1.942 5.417 1.00 . A A . 3 GLN NE2 1 1 6 2669 1 1 3 GLN O O -3.877 2.724 1.530 1.00 . A A . 3 GLN O 1 1 6 2670 1 1 3 GLN OE1 O -6.439 -1.186 4.641 1.00 . A A . 3 GLN OE1 1 1 6 2671 1 1 4 LYS C C -1.434 3.847 3.693 1.00 . A A . 4 LYS C 1 1 6 2672 1 1 4 LYS CA C -2.909 4.200 3.671 1.00 . A A . 4 LYS CA 1 1 6 2673 1 1 4 LYS CB C -3.236 5.126 4.839 1.00 . A A . 4 LYS CB 1 1 6 2674 1 1 4 LYS CD C -4.943 6.486 6.124 1.00 . A A . 4 LYS CD 1 1 6 2675 1 1 4 LYS CE C -4.546 5.866 7.461 1.00 . A A . 4 LYS CE 1 1 6 2676 1 1 4 LYS CG C -4.706 5.525 4.954 1.00 . A A . 4 LYS CG 1 1 6 2677 1 1 4 LYS H H -3.921 2.627 4.630 1.00 . A A . 4 LYS H 1 1 6 2678 1 1 4 LYS HA H -3.134 4.701 2.743 1.00 . A A . 4 LYS HA 1 1 6 2679 1 1 4 LYS HB2 H -2.951 4.625 5.753 1.00 . A A . 4 LYS HB2 1 1 6 2680 1 1 4 LYS HB3 H -2.648 6.022 4.728 1.00 . A A . 4 LYS HB3 1 1 6 2681 1 1 4 LYS HD2 H -4.351 7.376 5.969 1.00 . A A . 4 LYS HD2 1 1 6 2682 1 1 4 LYS HD3 H -5.989 6.751 6.154 1.00 . A A . 4 LYS HD3 1 1 6 2683 1 1 4 LYS HE2 H -5.132 4.973 7.619 1.00 . A A . 4 LYS HE2 1 1 6 2684 1 1 4 LYS HE3 H -3.501 5.599 7.432 1.00 . A A . 4 LYS HE3 1 1 6 2685 1 1 4 LYS HG2 H -5.010 6.011 4.039 1.00 . A A . 4 LYS HG2 1 1 6 2686 1 1 4 LYS HG3 H -5.300 4.635 5.106 1.00 . A A . 4 LYS HG3 1 1 6 2687 1 1 4 LYS HZ1 H -4.471 6.346 9.488 1.00 . A A . 4 LYS HZ1 1 1 6 2688 1 1 4 LYS HZ2 H -5.776 7.021 8.703 1.00 . A A . 4 LYS HZ2 1 1 6 2689 1 1 4 LYS HZ3 H -4.246 7.668 8.488 1.00 . A A . 4 LYS HZ3 1 1 6 2690 1 1 4 LYS N N -3.686 2.988 3.753 1.00 . A A . 4 LYS N 1 1 6 2691 1 1 4 LYS NZ N -4.772 6.776 8.592 1.00 . A A . 4 LYS NZ 1 1 6 2692 1 1 4 LYS O O -1.083 2.718 3.971 1.00 . A A . 4 LYS O 1 1 6 2693 1 1 5 TRP C C 1.475 4.222 4.745 1.00 . A A . 5 TRP C 1 1 6 2694 1 1 5 TRP CA C 0.868 4.636 3.395 1.00 . A A . 5 TRP CA 1 1 6 2695 1 1 5 TRP CB C 1.543 5.919 2.888 1.00 . A A . 5 TRP CB 1 1 6 2696 1 1 5 TRP CD1 C 2.136 7.476 4.830 1.00 . A A . 5 TRP CD1 1 1 6 2697 1 1 5 TRP CD2 C 0.277 8.052 3.741 1.00 . A A . 5 TRP CD2 1 1 6 2698 1 1 5 TRP CE2 C 0.486 8.963 4.791 1.00 . A A . 5 TRP CE2 1 1 6 2699 1 1 5 TRP CE3 C -0.835 8.221 2.913 1.00 . A A . 5 TRP CE3 1 1 6 2700 1 1 5 TRP CG C 1.342 7.101 3.791 1.00 . A A . 5 TRP CG 1 1 6 2701 1 1 5 TRP CH2 C -1.450 10.157 4.209 1.00 . A A . 5 TRP CH2 1 1 6 2702 1 1 5 TRP CZ2 C -0.373 10.017 5.037 1.00 . A A . 5 TRP CZ2 1 1 6 2703 1 1 5 TRP CZ3 C -1.684 9.275 3.157 1.00 . A A . 5 TRP CZ3 1 1 6 2704 1 1 5 TRP H H -0.941 5.736 3.345 1.00 . A A . 5 TRP H 1 1 6 2705 1 1 5 TRP HA H 1.055 3.849 2.680 1.00 . A A . 5 TRP HA 1 1 6 2706 1 1 5 TRP HB2 H 2.604 5.759 2.784 1.00 . A A . 5 TRP HB2 1 1 6 2707 1 1 5 TRP HB3 H 1.122 6.165 1.924 1.00 . A A . 5 TRP HB3 1 1 6 2708 1 1 5 TRP HD1 H 3.032 6.954 5.129 1.00 . A A . 5 TRP HD1 1 1 6 2709 1 1 5 TRP HE1 H 2.022 9.023 6.225 1.00 . A A . 5 TRP HE1 1 1 6 2710 1 1 5 TRP HE3 H -1.033 7.553 2.088 1.00 . A A . 5 TRP HE3 1 1 6 2711 1 1 5 TRP HH2 H -2.147 10.968 4.359 1.00 . A A . 5 TRP HH2 1 1 6 2712 1 1 5 TRP HZ2 H -0.209 10.709 5.850 1.00 . A A . 5 TRP HZ2 1 1 6 2713 1 1 5 TRP HZ3 H -2.550 9.426 2.529 1.00 . A A . 5 TRP HZ3 1 1 6 2714 1 1 5 TRP N N -0.589 4.830 3.473 1.00 . A A . 5 TRP N 1 1 6 2715 1 1 5 TRP NE1 N 1.619 8.582 5.441 1.00 . A A . 5 TRP NE1 1 1 6 2716 1 1 5 TRP O O 2.553 3.636 4.798 1.00 . A A . 5 TRP O 1 1 6 2717 1 1 6 MET C C 0.821 2.786 7.461 1.00 . A A . 6 MET C 1 1 6 2718 1 1 6 MET CA C 1.250 4.206 7.162 1.00 . A A . 6 MET CA 1 1 6 2719 1 1 6 MET CB C 0.635 5.137 8.197 1.00 . A A . 6 MET CB 1 1 6 2720 1 1 6 MET CE C -1.345 5.239 10.761 1.00 . A A . 6 MET CE 1 1 6 2721 1 1 6 MET CG C 1.137 4.890 9.604 1.00 . A A . 6 MET CG 1 1 6 2722 1 1 6 MET H H -0.022 5.101 5.721 1.00 . A A . 6 MET H 1 1 6 2723 1 1 6 MET HA H 2.327 4.282 7.201 1.00 . A A . 6 MET HA 1 1 6 2724 1 1 6 MET HB2 H 0.853 6.158 7.921 1.00 . A A . 6 MET HB2 1 1 6 2725 1 1 6 MET HB3 H -0.435 4.997 8.187 1.00 . A A . 6 MET HB3 1 1 6 2726 1 1 6 MET HE1 H -1.319 4.177 10.963 1.00 . A A . 6 MET HE1 1 1 6 2727 1 1 6 MET HE2 H -1.759 5.411 9.779 1.00 . A A . 6 MET HE2 1 1 6 2728 1 1 6 MET HE3 H -1.967 5.723 11.499 1.00 . A A . 6 MET HE3 1 1 6 2729 1 1 6 MET HG2 H 0.975 3.847 9.837 1.00 . A A . 6 MET HG2 1 1 6 2730 1 1 6 MET HG3 H 2.195 5.091 9.593 1.00 . A A . 6 MET HG3 1 1 6 2731 1 1 6 MET N N 0.793 4.568 5.825 1.00 . A A . 6 MET N 1 1 6 2732 1 1 6 MET O O 1.371 2.101 8.325 1.00 . A A . 6 MET O 1 1 6 2733 1 1 6 MET SD S 0.315 5.905 10.854 1.00 . A A . 6 MET SD 1 1 6 2734 1 1 7 TRP C C 0.022 0.091 6.013 1.00 . A A . 7 TRP C 1 1 6 2735 1 1 7 TRP CA C -0.725 1.062 6.894 1.00 . A A . 7 TRP CA 1 1 6 2736 1 1 7 TRP CB C -2.235 1.036 6.577 1.00 . A A . 7 TRP CB 1 1 6 2737 1 1 7 TRP CD1 C -2.722 2.477 8.671 1.00 . A A . 7 TRP CD1 1 1 6 2738 1 1 7 TRP CD2 C -4.544 1.851 7.534 1.00 . A A . 7 TRP CD2 1 1 6 2739 1 1 7 TRP CE2 C -4.950 2.627 8.631 1.00 . A A . 7 TRP CE2 1 1 6 2740 1 1 7 TRP CE3 C -5.518 1.347 6.679 1.00 . A A . 7 TRP CE3 1 1 6 2741 1 1 7 TRP CG C -3.113 1.767 7.566 1.00 . A A . 7 TRP CG 1 1 6 2742 1 1 7 TRP CH2 C -7.215 2.405 8.029 1.00 . A A . 7 TRP CH2 1 1 6 2743 1 1 7 TRP CZ2 C -6.285 2.911 8.887 1.00 . A A . 7 TRP CZ2 1 1 6 2744 1 1 7 TRP CZ3 C -6.842 1.627 6.934 1.00 . A A . 7 TRP CZ3 1 1 6 2745 1 1 7 TRP H H -0.482 2.963 6.036 1.00 . A A . 7 TRP H 1 1 6 2746 1 1 7 TRP HA H -0.580 0.767 7.923 1.00 . A A . 7 TRP HA 1 1 6 2747 1 1 7 TRP HB2 H -2.392 1.492 5.611 1.00 . A A . 7 TRP HB2 1 1 6 2748 1 1 7 TRP HB3 H -2.566 0.009 6.531 1.00 . A A . 7 TRP HB3 1 1 6 2749 1 1 7 TRP HD1 H -1.691 2.598 8.977 1.00 . A A . 7 TRP HD1 1 1 6 2750 1 1 7 TRP HE1 H -3.825 3.550 10.129 1.00 . A A . 7 TRP HE1 1 1 6 2751 1 1 7 TRP HE3 H -5.255 0.733 5.831 1.00 . A A . 7 TRP HE3 1 1 6 2752 1 1 7 TRP HH2 H -8.263 2.600 8.192 1.00 . A A . 7 TRP HH2 1 1 6 2753 1 1 7 TRP HZ2 H -6.597 3.512 9.729 1.00 . A A . 7 TRP HZ2 1 1 6 2754 1 1 7 TRP HZ3 H -7.607 1.243 6.275 1.00 . A A . 7 TRP HZ3 1 1 6 2755 1 1 7 TRP N N -0.167 2.370 6.747 1.00 . A A . 7 TRP N 1 1 6 2756 1 1 7 TRP NE1 N -3.825 2.996 9.313 1.00 . A A . 7 TRP NE1 1 1 6 2757 1 1 7 TRP O O 0.900 0.474 5.227 1.00 . A A . 7 TRP O 1 1 6 2758 1 1 8 THR C C -0.722 -2.956 4.692 1.00 . A A . 8 THR C 1 1 6 2759 1 1 8 THR CA C 0.344 -2.176 5.435 1.00 . A A . 8 THR CA 1 1 6 2760 1 1 8 THR CB C 1.093 -3.077 6.455 1.00 . A A . 8 THR CB 1 1 6 2761 1 1 8 THR CG2 C 2.106 -2.250 7.254 1.00 . A A . 8 THR CG2 1 1 6 2762 1 1 8 THR H H -1.072 -1.375 6.709 1.00 . A A . 8 THR H 1 1 6 2763 1 1 8 THR HA H 1.045 -1.731 4.747 1.00 . A A . 8 THR HA 1 1 6 2764 1 1 8 THR HB H 1.614 -3.866 5.933 1.00 . A A . 8 THR HB 1 1 6 2765 1 1 8 THR HG1 H -0.393 -2.909 7.715 1.00 . A A . 8 THR HG1 1 1 6 2766 1 1 8 THR HG21 H 2.649 -2.896 7.926 1.00 . A A . 8 THR HG21 1 1 6 2767 1 1 8 THR HG22 H 1.572 -1.505 7.826 1.00 . A A . 8 THR HG22 1 1 6 2768 1 1 8 THR HG23 H 2.796 -1.742 6.593 1.00 . A A . 8 THR HG23 1 1 6 2769 1 1 8 THR N N -0.313 -1.134 6.136 1.00 . A A . 8 THR N 1 1 6 2770 1 1 8 THR O O -1.921 -2.741 4.961 1.00 . A A . 8 THR O 1 1 6 2771 1 1 8 THR OG1 O 0.148 -3.637 7.390 1.00 . A A . 8 THR OG1 1 1 6 2772 1 1 9 CYS C C -1.287 -6.030 3.340 1.00 . A A . 9 CYS C 1 1 6 2773 1 1 9 CYS CA C -1.435 -4.542 3.125 1.00 . A A . 9 CYS CA 1 1 6 2774 1 1 9 CYS CB C -1.526 -4.202 1.645 1.00 . A A . 9 CYS CB 1 1 6 2775 1 1 9 CYS H H 0.560 -4.006 3.495 1.00 . A A . 9 CYS H 1 1 6 2776 1 1 9 CYS HA H -2.351 -4.231 3.607 1.00 . A A . 9 CYS HA 1 1 6 2777 1 1 9 CYS HB2 H -2.437 -4.617 1.244 1.00 . A A . 9 CYS HB2 1 1 6 2778 1 1 9 CYS HB3 H -1.549 -3.126 1.533 1.00 . A A . 9 CYS HB3 1 1 6 2779 1 1 9 CYS N N -0.371 -3.826 3.769 1.00 . A A . 9 CYS N 1 1 6 2780 1 1 9 CYS O O -0.299 -6.484 3.935 1.00 . A A . 9 CYS O 1 1 6 2781 1 1 9 CYS SG S -0.168 -4.829 0.648 1.00 . A A . 9 CYS SG 1 1 6 2782 1 1 10 ASP C C -2.766 -8.733 1.654 1.00 . A A . 10 ASP C 1 1 6 2783 1 1 10 ASP CA C -2.316 -8.214 2.989 1.00 . A A . 10 ASP CA 1 1 6 2784 1 1 10 ASP CB C -3.376 -8.673 4.038 1.00 . A A . 10 ASP CB 1 1 6 2785 1 1 10 ASP CG C -3.127 -8.235 5.457 1.00 . A A . 10 ASP CG 1 1 6 2786 1 1 10 ASP H H -2.973 -6.338 2.346 1.00 . A A . 10 ASP H 1 1 6 2787 1 1 10 ASP HA H -1.345 -8.606 3.247 1.00 . A A . 10 ASP HA 1 1 6 2788 1 1 10 ASP HB2 H -4.340 -8.283 3.749 1.00 . A A . 10 ASP HB2 1 1 6 2789 1 1 10 ASP HB3 H -3.431 -9.752 4.019 1.00 . A A . 10 ASP HB3 1 1 6 2790 1 1 10 ASP N N -2.259 -6.771 2.870 1.00 . A A . 10 ASP N 1 1 6 2791 1 1 10 ASP O O -2.761 -8.005 0.665 1.00 . A A . 10 ASP O 1 1 6 2792 1 1 10 ASP OD1 O -2.237 -8.798 6.128 1.00 . A A . 10 ASP OD1 1 1 6 2793 1 1 10 ASP OD2 O -3.863 -7.349 5.947 1.00 . A A . 10 ASP OD2 1 1 6 2794 1 1 11 SER C C -5.188 -10.031 0.299 1.00 . A A . 11 SER C 1 1 6 2795 1 1 11 SER CA C -3.742 -10.538 0.455 1.00 . A A . 11 SER CA 1 1 6 2796 1 1 11 SER CB C -3.671 -12.040 0.623 1.00 . A A . 11 SER CB 1 1 6 2797 1 1 11 SER H H -3.032 -10.552 2.391 1.00 . A A . 11 SER H 1 1 6 2798 1 1 11 SER HA H -3.161 -10.247 -0.405 1.00 . A A . 11 SER HA 1 1 6 2799 1 1 11 SER HB2 H -4.448 -12.510 0.038 1.00 . A A . 11 SER HB2 1 1 6 2800 1 1 11 SER HB3 H -2.703 -12.402 0.307 1.00 . A A . 11 SER HB3 1 1 6 2801 1 1 11 SER HG H -4.441 -13.129 2.066 1.00 . A A . 11 SER HG 1 1 6 2802 1 1 11 SER N N -3.155 -9.958 1.619 1.00 . A A . 11 SER N 1 1 6 2803 1 1 11 SER O O -5.672 -9.784 -0.813 1.00 . A A . 11 SER O 1 1 6 2804 1 1 11 SER OG O -3.852 -12.366 2.007 1.00 . A A . 11 SER OG 1 1 6 2805 1 1 12 GLU C C -7.262 -7.820 1.393 1.00 . A A . 12 GLU C 1 1 6 2806 1 1 12 GLU CA C -7.209 -9.355 1.459 1.00 . A A . 12 GLU CA 1 1 6 2807 1 1 12 GLU CB C -7.928 -9.864 2.709 1.00 . A A . 12 GLU CB 1 1 6 2808 1 1 12 GLU CD C -8.027 -9.849 5.211 1.00 . A A . 12 GLU CD 1 1 6 2809 1 1 12 GLU CG C -7.220 -9.516 4.006 1.00 . A A . 12 GLU CG 1 1 6 2810 1 1 12 GLU H H -5.384 -10.059 2.261 1.00 . A A . 12 GLU H 1 1 6 2811 1 1 12 GLU HA H -7.711 -9.750 0.589 1.00 . A A . 12 GLU HA 1 1 6 2812 1 1 12 GLU HB2 H -8.919 -9.437 2.742 1.00 . A A . 12 GLU HB2 1 1 6 2813 1 1 12 GLU HB3 H -8.013 -10.941 2.650 1.00 . A A . 12 GLU HB3 1 1 6 2814 1 1 12 GLU HG2 H -6.292 -10.066 4.053 1.00 . A A . 12 GLU HG2 1 1 6 2815 1 1 12 GLU HG3 H -7.007 -8.458 4.005 1.00 . A A . 12 GLU HG3 1 1 6 2816 1 1 12 GLU N N -5.846 -9.839 1.427 1.00 . A A . 12 GLU N 1 1 6 2817 1 1 12 GLU O O -8.109 -7.253 0.726 1.00 . A A . 12 GLU O 1 1 6 2818 1 1 12 GLU OE1 O -7.772 -10.885 5.841 1.00 . A A . 12 GLU OE1 1 1 6 2819 1 1 12 GLU OE2 O -8.928 -9.061 5.565 1.00 . A A . 12 GLU OE2 1 1 6 2820 1 1 13 ARG C C -5.287 -5.233 1.137 1.00 . A A . 13 ARG C 1 1 6 2821 1 1 13 ARG CA C -6.339 -5.709 2.098 1.00 . A A . 13 ARG CA 1 1 6 2822 1 1 13 ARG CB C -6.028 -5.152 3.492 1.00 . A A . 13 ARG CB 1 1 6 2823 1 1 13 ARG CD C -6.709 -4.819 5.878 1.00 . A A . 13 ARG CD 1 1 6 2824 1 1 13 ARG CG C -7.044 -5.500 4.563 1.00 . A A . 13 ARG CG 1 1 6 2825 1 1 13 ARG CZ C -4.762 -4.640 7.430 1.00 . A A . 13 ARG CZ 1 1 6 2826 1 1 13 ARG H H -5.694 -7.653 2.601 1.00 . A A . 13 ARG H 1 1 6 2827 1 1 13 ARG HA H -7.309 -5.358 1.782 1.00 . A A . 13 ARG HA 1 1 6 2828 1 1 13 ARG HB2 H -5.069 -5.535 3.808 1.00 . A A . 13 ARG HB2 1 1 6 2829 1 1 13 ARG HB3 H -5.963 -4.075 3.424 1.00 . A A . 13 ARG HB3 1 1 6 2830 1 1 13 ARG HD2 H -6.694 -3.754 5.707 1.00 . A A . 13 ARG HD2 1 1 6 2831 1 1 13 ARG HD3 H -7.471 -5.057 6.603 1.00 . A A . 13 ARG HD3 1 1 6 2832 1 1 13 ARG HE H -4.951 -5.997 5.977 1.00 . A A . 13 ARG HE 1 1 6 2833 1 1 13 ARG HG2 H -8.020 -5.174 4.241 1.00 . A A . 13 ARG HG2 1 1 6 2834 1 1 13 ARG HG3 H -7.049 -6.569 4.714 1.00 . A A . 13 ARG HG3 1 1 6 2835 1 1 13 ARG HH11 H -6.194 -3.222 7.804 1.00 . A A . 13 ARG HH11 1 1 6 2836 1 1 13 ARG HH12 H -4.862 -3.164 8.847 1.00 . A A . 13 ARG HH12 1 1 6 2837 1 1 13 ARG HH21 H -3.150 -5.880 7.354 1.00 . A A . 13 ARG HH21 1 1 6 2838 1 1 13 ARG HH22 H -3.076 -4.700 8.576 1.00 . A A . 13 ARG HH22 1 1 6 2839 1 1 13 ARG N N -6.367 -7.159 2.094 1.00 . A A . 13 ARG N 1 1 6 2840 1 1 13 ARG NE N -5.396 -5.222 6.408 1.00 . A A . 13 ARG NE 1 1 6 2841 1 1 13 ARG NH1 N -5.303 -3.609 8.060 1.00 . A A . 13 ARG NH1 1 1 6 2842 1 1 13 ARG NH2 N -3.589 -5.098 7.812 1.00 . A A . 13 ARG NH2 1 1 6 2843 1 1 13 ARG O O -4.132 -5.517 1.335 1.00 . A A . 13 ARG O 1 1 6 2844 1 1 14 LYS C C -4.540 -2.540 -0.695 1.00 . A A . 14 LYS C 1 1 6 2845 1 1 14 LYS CA C -4.718 -4.043 -0.860 1.00 . A A . 14 LYS CA 1 1 6 2846 1 1 14 LYS CB C -5.135 -4.385 -2.296 1.00 . A A . 14 LYS CB 1 1 6 2847 1 1 14 LYS CD C -5.549 -6.181 -4.038 1.00 . A A . 14 LYS CD 1 1 6 2848 1 1 14 LYS CE C -6.936 -5.698 -4.441 1.00 . A A . 14 LYS CE 1 1 6 2849 1 1 14 LYS CG C -5.216 -5.884 -2.576 1.00 . A A . 14 LYS CG 1 1 6 2850 1 1 14 LYS H H -6.625 -4.344 -0.025 1.00 . A A . 14 LYS H 1 1 6 2851 1 1 14 LYS HA H -3.771 -4.518 -0.650 1.00 . A A . 14 LYS HA 1 1 6 2852 1 1 14 LYS HB2 H -6.104 -3.945 -2.484 1.00 . A A . 14 LYS HB2 1 1 6 2853 1 1 14 LYS HB3 H -4.420 -3.951 -2.977 1.00 . A A . 14 LYS HB3 1 1 6 2854 1 1 14 LYS HD2 H -4.820 -5.694 -4.669 1.00 . A A . 14 LYS HD2 1 1 6 2855 1 1 14 LYS HD3 H -5.494 -7.249 -4.191 1.00 . A A . 14 LYS HD3 1 1 6 2856 1 1 14 LYS HE2 H -7.012 -4.636 -4.253 1.00 . A A . 14 LYS HE2 1 1 6 2857 1 1 14 LYS HE3 H -7.067 -5.879 -5.499 1.00 . A A . 14 LYS HE3 1 1 6 2858 1 1 14 LYS HG2 H -4.264 -6.334 -2.338 1.00 . A A . 14 LYS HG2 1 1 6 2859 1 1 14 LYS HG3 H -5.982 -6.314 -1.946 1.00 . A A . 14 LYS HG3 1 1 6 2860 1 1 14 LYS HZ1 H -7.961 -6.209 -2.679 1.00 . A A . 14 LYS HZ1 1 1 6 2861 1 1 14 LYS HZ2 H -7.935 -7.421 -3.823 1.00 . A A . 14 LYS HZ2 1 1 6 2862 1 1 14 LYS HZ3 H -8.947 -6.098 -4.036 1.00 . A A . 14 LYS HZ3 1 1 6 2863 1 1 14 LYS N N -5.675 -4.551 0.103 1.00 . A A . 14 LYS N 1 1 6 2864 1 1 14 LYS NZ N -8.007 -6.390 -3.703 1.00 . A A . 14 LYS NZ 1 1 6 2865 1 1 14 LYS O O -5.455 -1.840 -0.240 1.00 . A A . 14 LYS O 1 1 6 2866 1 1 15 CYS C C -3.808 0.096 -2.107 1.00 . A A . 15 CYS C 1 1 6 2867 1 1 15 CYS CA C -3.095 -0.620 -0.973 1.00 . A A . 15 CYS CA 1 1 6 2868 1 1 15 CYS CB C -1.587 -0.373 -1.037 1.00 . A A . 15 CYS CB 1 1 6 2869 1 1 15 CYS H H -2.686 -2.644 -1.398 1.00 . A A . 15 CYS H 1 1 6 2870 1 1 15 CYS HA H -3.488 -0.241 -0.046 1.00 . A A . 15 CYS HA 1 1 6 2871 1 1 15 CYS HB2 H -1.226 -0.648 -2.017 1.00 . A A . 15 CYS HB2 1 1 6 2872 1 1 15 CYS HB3 H -1.394 0.677 -0.870 1.00 . A A . 15 CYS HB3 1 1 6 2873 1 1 15 CYS N N -3.380 -2.044 -1.056 1.00 . A A . 15 CYS N 1 1 6 2874 1 1 15 CYS O O -4.106 -0.526 -3.137 1.00 . A A . 15 CYS O 1 1 6 2875 1 1 15 CYS SG S -0.627 -1.321 0.194 1.00 . A A . 15 CYS SG 1 1 6 2876 1 1 16 CYS C C -4.022 2.287 -4.215 1.00 . A A . 16 CYS C 1 1 6 2877 1 1 16 CYS CA C -4.843 2.135 -2.924 1.00 . A A . 16 CYS CA 1 1 6 2878 1 1 16 CYS CB C -5.181 3.521 -2.379 1.00 . A A . 16 CYS CB 1 1 6 2879 1 1 16 CYS H H -3.880 1.807 -1.078 1.00 . A A . 16 CYS H 1 1 6 2880 1 1 16 CYS HA H -5.762 1.614 -3.144 1.00 . A A . 16 CYS HA 1 1 6 2881 1 1 16 CYS HB2 H -4.266 4.082 -2.259 1.00 . A A . 16 CYS HB2 1 1 6 2882 1 1 16 CYS HB3 H -5.812 4.029 -3.094 1.00 . A A . 16 CYS HB3 1 1 6 2883 1 1 16 CYS N N -4.119 1.360 -1.919 1.00 . A A . 16 CYS N 1 1 6 2884 1 1 16 CYS O O -2.795 2.050 -4.227 1.00 . A A . 16 CYS O 1 1 6 2885 1 1 16 CYS SG S -6.043 3.535 -0.767 1.00 . A A . 16 CYS SG 1 1 6 2886 1 1 17 LYS C C -3.092 4.080 -6.422 1.00 . A A . 17 LYS C 1 1 6 2887 1 1 17 LYS CA C -4.025 2.887 -6.565 1.00 . A A . 17 LYS CA 1 1 6 2888 1 1 17 LYS CB C -5.037 3.112 -7.690 1.00 . A A . 17 LYS CB 1 1 6 2889 1 1 17 LYS CD C -6.926 2.174 -9.100 1.00 . A A . 17 LYS CD 1 1 6 2890 1 1 17 LYS CE C -6.252 2.435 -10.447 1.00 . A A . 17 LYS CE 1 1 6 2891 1 1 17 LYS CG C -5.924 1.909 -7.973 1.00 . A A . 17 LYS CG 1 1 6 2892 1 1 17 LYS H H -5.667 2.742 -5.249 1.00 . A A . 17 LYS H 1 1 6 2893 1 1 17 LYS HA H -3.431 2.012 -6.784 1.00 . A A . 17 LYS HA 1 1 6 2894 1 1 17 LYS HB2 H -5.668 3.951 -7.435 1.00 . A A . 17 LYS HB2 1 1 6 2895 1 1 17 LYS HB3 H -4.489 3.342 -8.590 1.00 . A A . 17 LYS HB3 1 1 6 2896 1 1 17 LYS HD2 H -7.563 1.311 -9.198 1.00 . A A . 17 LYS HD2 1 1 6 2897 1 1 17 LYS HD3 H -7.527 3.031 -8.834 1.00 . A A . 17 LYS HD3 1 1 6 2898 1 1 17 LYS HE2 H -7.016 2.654 -11.179 1.00 . A A . 17 LYS HE2 1 1 6 2899 1 1 17 LYS HE3 H -5.599 3.289 -10.355 1.00 . A A . 17 LYS HE3 1 1 6 2900 1 1 17 LYS HG2 H -5.294 1.079 -8.252 1.00 . A A . 17 LYS HG2 1 1 6 2901 1 1 17 LYS HG3 H -6.463 1.659 -7.071 1.00 . A A . 17 LYS HG3 1 1 6 2902 1 1 17 LYS HZ1 H -4.720 1.022 -10.245 1.00 . A A . 17 LYS HZ1 1 1 6 2903 1 1 17 LYS HZ2 H -4.986 1.516 -11.808 1.00 . A A . 17 LYS HZ2 1 1 6 2904 1 1 17 LYS HZ3 H -6.072 0.445 -11.083 1.00 . A A . 17 LYS HZ3 1 1 6 2905 1 1 17 LYS N N -4.691 2.643 -5.301 1.00 . A A . 17 LYS N 1 1 6 2906 1 1 17 LYS NZ N -5.469 1.277 -10.919 1.00 . A A . 17 LYS NZ 1 1 6 2907 1 1 17 LYS O O -3.503 5.159 -5.975 1.00 . A A . 17 LYS O 1 1 6 2908 1 1 18 GLY C C 0.153 4.416 -5.533 1.00 . A A . 18 GLY C 1 1 6 2909 1 1 18 GLY CA C -0.835 4.888 -6.575 1.00 . A A . 18 GLY CA 1 1 6 2910 1 1 18 GLY H H -1.622 3.033 -7.221 1.00 . A A . 18 GLY H 1 1 6 2911 1 1 18 GLY HA2 H -0.319 5.072 -7.506 1.00 . A A . 18 GLY HA2 1 1 6 2912 1 1 18 GLY HA3 H -1.295 5.801 -6.229 1.00 . A A . 18 GLY HA3 1 1 6 2913 1 1 18 GLY N N -1.852 3.879 -6.780 1.00 . A A . 18 GLY N 1 1 6 2914 1 1 18 GLY O O 1.176 5.059 -5.262 1.00 . A A . 18 GLY O 1 1 6 2915 1 1 19 MET C C 0.858 1.219 -4.400 1.00 . A A . 19 MET C 1 1 6 2916 1 1 19 MET CA C 0.663 2.643 -3.963 1.00 . A A . 19 MET CA 1 1 6 2917 1 1 19 MET CB C 0.008 2.638 -2.577 1.00 . A A . 19 MET CB 1 1 6 2918 1 1 19 MET CE C -1.177 5.634 0.035 1.00 . A A . 19 MET CE 1 1 6 2919 1 1 19 MET CG C -0.155 3.993 -1.938 1.00 . A A . 19 MET CG 1 1 6 2920 1 1 19 MET H H -1.038 2.881 -5.141 1.00 . A A . 19 MET H 1 1 6 2921 1 1 19 MET HA H 1.614 3.150 -3.910 1.00 . A A . 19 MET HA 1 1 6 2922 1 1 19 MET HB2 H -0.973 2.197 -2.666 1.00 . A A . 19 MET HB2 1 1 6 2923 1 1 19 MET HB3 H 0.605 2.022 -1.922 1.00 . A A . 19 MET HB3 1 1 6 2924 1 1 19 MET HE1 H -1.723 6.155 -0.738 1.00 . A A . 19 MET HE1 1 1 6 2925 1 1 19 MET HE2 H -0.184 6.049 0.115 1.00 . A A . 19 MET HE2 1 1 6 2926 1 1 19 MET HE3 H -1.695 5.742 0.977 1.00 . A A . 19 MET HE3 1 1 6 2927 1 1 19 MET HG2 H 0.839 4.356 -1.720 1.00 . A A . 19 MET HG2 1 1 6 2928 1 1 19 MET HG3 H -0.663 4.661 -2.616 1.00 . A A . 19 MET HG3 1 1 6 2929 1 1 19 MET N N -0.174 3.301 -4.932 1.00 . A A . 19 MET N 1 1 6 2930 1 1 19 MET O O 0.064 0.697 -5.198 1.00 . A A . 19 MET O 1 1 6 2931 1 1 19 MET SD S -1.067 3.900 -0.387 1.00 . A A . 19 MET SD 1 1 6 2932 1 1 20 VAL C C 1.826 -1.571 -2.933 1.00 . A A . 20 VAL C 1 1 6 2933 1 1 20 VAL CA C 2.123 -0.779 -4.192 1.00 . A A . 20 VAL CA 1 1 6 2934 1 1 20 VAL CB C 3.580 -1.059 -4.715 1.00 . A A . 20 VAL CB 1 1 6 2935 1 1 20 VAL CG1 C 4.645 -0.671 -3.703 1.00 . A A . 20 VAL CG1 1 1 6 2936 1 1 20 VAL CG2 C 3.746 -2.515 -5.139 1.00 . A A . 20 VAL CG2 1 1 6 2937 1 1 20 VAL H H 2.516 1.094 -3.338 1.00 . A A . 20 VAL H 1 1 6 2938 1 1 20 VAL HA H 1.409 -1.083 -4.943 1.00 . A A . 20 VAL HA 1 1 6 2939 1 1 20 VAL HB H 3.732 -0.440 -5.588 1.00 . A A . 20 VAL HB 1 1 6 2940 1 1 20 VAL HG11 H 5.624 -0.883 -4.106 1.00 . A A . 20 VAL HG11 1 1 6 2941 1 1 20 VAL HG12 H 4.498 -1.237 -2.795 1.00 . A A . 20 VAL HG12 1 1 6 2942 1 1 20 VAL HG13 H 4.563 0.384 -3.487 1.00 . A A . 20 VAL HG13 1 1 6 2943 1 1 20 VAL HG21 H 3.055 -2.741 -5.937 1.00 . A A . 20 VAL HG21 1 1 6 2944 1 1 20 VAL HG22 H 3.542 -3.159 -4.295 1.00 . A A . 20 VAL HG22 1 1 6 2945 1 1 20 VAL HG23 H 4.758 -2.677 -5.481 1.00 . A A . 20 VAL HG23 1 1 6 2946 1 1 20 VAL N N 1.886 0.605 -3.920 1.00 . A A . 20 VAL N 1 1 6 2947 1 1 20 VAL O O 2.163 -1.132 -1.812 1.00 . A A . 20 VAL O 1 1 6 2948 1 1 21 CYS C C 2.044 -4.315 -1.642 1.00 . A A . 21 CYS C 1 1 6 2949 1 1 21 CYS CA C 0.803 -3.529 -2.006 1.00 . A A . 21 CYS CA 1 1 6 2950 1 1 21 CYS CB C -0.363 -4.457 -2.389 1.00 . A A . 21 CYS CB 1 1 6 2951 1 1 21 CYS H H 0.847 -2.928 -4.001 1.00 . A A . 21 CYS H 1 1 6 2952 1 1 21 CYS HA H 0.517 -2.912 -1.166 1.00 . A A . 21 CYS HA 1 1 6 2953 1 1 21 CYS HB2 H -1.180 -3.854 -2.753 1.00 . A A . 21 CYS HB2 1 1 6 2954 1 1 21 CYS HB3 H -0.033 -5.114 -3.181 1.00 . A A . 21 CYS HB3 1 1 6 2955 1 1 21 CYS N N 1.136 -2.669 -3.100 1.00 . A A . 21 CYS N 1 1 6 2956 1 1 21 CYS O O 2.557 -5.110 -2.446 1.00 . A A . 21 CYS O 1 1 6 2957 1 1 21 CYS SG S -1.045 -5.504 -1.046 1.00 . A A . 21 CYS SG 1 1 6 2958 1 1 22 ARG C C 3.547 -4.882 1.540 1.00 . A A . 22 ARG C 1 1 6 2959 1 1 22 ARG CA C 3.734 -4.659 0.016 1.00 . A A . 22 ARG CA 1 1 6 2960 1 1 22 ARG CB C 4.917 -3.681 -0.250 1.00 . A A . 22 ARG CB 1 1 6 2961 1 1 22 ARG CD C 6.600 -4.895 -1.731 1.00 . A A . 22 ARG CD 1 1 6 2962 1 1 22 ARG CG C 6.322 -4.296 -0.348 1.00 . A A . 22 ARG CG 1 1 6 2963 1 1 22 ARG CZ C 5.548 -6.482 -3.337 1.00 . A A . 22 ARG CZ 1 1 6 2964 1 1 22 ARG H H 2.086 -3.426 0.136 1.00 . A A . 22 ARG H 1 1 6 2965 1 1 22 ARG HA H 3.901 -5.590 -0.502 1.00 . A A . 22 ARG HA 1 1 6 2966 1 1 22 ARG HB2 H 4.725 -3.169 -1.180 1.00 . A A . 22 ARG HB2 1 1 6 2967 1 1 22 ARG HB3 H 4.924 -2.948 0.543 1.00 . A A . 22 ARG HB3 1 1 6 2968 1 1 22 ARG HD2 H 6.517 -4.114 -2.470 1.00 . A A . 22 ARG HD2 1 1 6 2969 1 1 22 ARG HD3 H 7.611 -5.276 -1.735 1.00 . A A . 22 ARG HD3 1 1 6 2970 1 1 22 ARG HE H 5.148 -6.354 -1.365 1.00 . A A . 22 ARG HE 1 1 6 2971 1 1 22 ARG HG2 H 7.052 -3.523 -0.158 1.00 . A A . 22 ARG HG2 1 1 6 2972 1 1 22 ARG HG3 H 6.427 -5.071 0.395 1.00 . A A . 22 ARG HG3 1 1 6 2973 1 1 22 ARG HH11 H 6.952 -5.274 -4.209 1.00 . A A . 22 ARG HH11 1 1 6 2974 1 1 22 ARG HH12 H 6.226 -6.382 -5.269 1.00 . A A . 22 ARG HH12 1 1 6 2975 1 1 22 ARG HH21 H 4.098 -7.829 -2.830 1.00 . A A . 22 ARG HH21 1 1 6 2976 1 1 22 ARG HH22 H 4.557 -7.873 -4.469 1.00 . A A . 22 ARG HH22 1 1 6 2977 1 1 22 ARG N N 2.546 -4.052 -0.464 1.00 . A A . 22 ARG N 1 1 6 2978 1 1 22 ARG NE N 5.684 -5.982 -2.102 1.00 . A A . 22 ARG NE 1 1 6 2979 1 1 22 ARG NH1 N 6.283 -6.009 -4.340 1.00 . A A . 22 ARG NH1 1 1 6 2980 1 1 22 ARG NH2 N 4.675 -7.457 -3.565 1.00 . A A . 22 ARG NH2 1 1 6 2981 1 1 22 ARG O O 2.412 -4.696 2.093 1.00 . A A . 22 ARG O 1 1 6 2982 1 1 23 LEU C C 4.205 -4.142 4.383 1.00 . A A . 23 LEU C 1 1 6 2983 1 1 23 LEU CA C 4.676 -5.413 3.680 1.00 . A A . 23 LEU CA 1 1 6 2984 1 1 23 LEU CB C 6.087 -5.768 4.134 1.00 . A A . 23 LEU CB 1 1 6 2985 1 1 23 LEU CD1 C 8.095 -7.243 4.045 1.00 . A A . 23 LEU CD1 1 1 6 2986 1 1 23 LEU CD2 C 5.824 -8.255 3.817 1.00 . A A . 23 LEU CD2 1 1 6 2987 1 1 23 LEU CG C 6.691 -7.034 3.525 1.00 . A A . 23 LEU CG 1 1 6 2988 1 1 23 LEU H H 5.454 -5.451 1.721 1.00 . A A . 23 LEU H 1 1 6 2989 1 1 23 LEU HA H 4.008 -6.220 3.937 1.00 . A A . 23 LEU HA 1 1 6 2990 1 1 23 LEU HB2 H 6.733 -4.937 3.893 1.00 . A A . 23 LEU HB2 1 1 6 2991 1 1 23 LEU HB3 H 6.073 -5.886 5.208 1.00 . A A . 23 LEU HB3 1 1 6 2992 1 1 23 LEU HD11 H 8.075 -7.338 5.120 1.00 . A A . 23 LEU HD11 1 1 6 2993 1 1 23 LEU HD12 H 8.710 -6.400 3.767 1.00 . A A . 23 LEU HD12 1 1 6 2994 1 1 23 LEU HD13 H 8.503 -8.144 3.613 1.00 . A A . 23 LEU HD13 1 1 6 2995 1 1 23 LEU HD21 H 5.714 -8.375 4.884 1.00 . A A . 23 LEU HD21 1 1 6 2996 1 1 23 LEU HD22 H 6.297 -9.134 3.404 1.00 . A A . 23 LEU HD22 1 1 6 2997 1 1 23 LEU HD23 H 4.852 -8.128 3.364 1.00 . A A . 23 LEU HD23 1 1 6 2998 1 1 23 LEU HG H 6.754 -6.908 2.455 1.00 . A A . 23 LEU HG 1 1 6 2999 1 1 23 LEU N N 4.640 -5.244 2.222 1.00 . A A . 23 LEU N 1 1 6 3000 1 1 23 LEU O O 3.859 -4.165 5.552 1.00 . A A . 23 LEU O 1 1 6 3001 1 1 24 TRP C C 3.163 -1.165 2.782 1.00 . A A . 24 TRP C 1 1 6 3002 1 1 24 TRP CA C 3.670 -1.813 4.069 1.00 . A A . 24 TRP CA 1 1 6 3003 1 1 24 TRP CB C 4.680 -0.902 4.805 1.00 . A A . 24 TRP CB 1 1 6 3004 1 1 24 TRP CD1 C 5.542 0.993 3.377 1.00 . A A . 24 TRP CD1 1 1 6 3005 1 1 24 TRP CD2 C 6.948 -0.730 3.494 1.00 . A A . 24 TRP CD2 1 1 6 3006 1 1 24 TRP CE2 C 7.522 0.256 2.667 1.00 . A A . 24 TRP CE2 1 1 6 3007 1 1 24 TRP CE3 C 7.651 -1.911 3.723 1.00 . A A . 24 TRP CE3 1 1 6 3008 1 1 24 TRP CG C 5.678 -0.231 3.923 1.00 . A A . 24 TRP CG 1 1 6 3009 1 1 24 TRP CH2 C 9.430 -1.075 2.316 1.00 . A A . 24 TRP CH2 1 1 6 3010 1 1 24 TRP CZ2 C 8.765 0.091 2.074 1.00 . A A . 24 TRP CZ2 1 1 6 3011 1 1 24 TRP CZ3 C 8.886 -2.072 3.132 1.00 . A A . 24 TRP CZ3 1 1 6 3012 1 1 24 TRP H H 4.666 -3.049 2.776 1.00 . A A . 24 TRP H 1 1 6 3013 1 1 24 TRP HA H 2.843 -2.069 4.708 1.00 . A A . 24 TRP HA 1 1 6 3014 1 1 24 TRP HB2 H 4.139 -0.127 5.329 1.00 . A A . 24 TRP HB2 1 1 6 3015 1 1 24 TRP HB3 H 5.219 -1.499 5.526 1.00 . A A . 24 TRP HB3 1 1 6 3016 1 1 24 TRP HD1 H 4.649 1.577 3.559 1.00 . A A . 24 TRP HD1 1 1 6 3017 1 1 24 TRP HE1 H 6.769 2.133 2.094 1.00 . A A . 24 TRP HE1 1 1 6 3018 1 1 24 TRP HE3 H 7.245 -2.689 4.351 1.00 . A A . 24 TRP HE3 1 1 6 3019 1 1 24 TRP HH2 H 10.401 -1.241 1.874 1.00 . A A . 24 TRP HH2 1 1 6 3020 1 1 24 TRP HZ2 H 9.204 0.849 1.441 1.00 . A A . 24 TRP HZ2 1 1 6 3021 1 1 24 TRP HZ3 H 9.446 -2.981 3.299 1.00 . A A . 24 TRP HZ3 1 1 6 3022 1 1 24 TRP N N 4.250 -3.043 3.664 1.00 . A A . 24 TRP N 1 1 6 3023 1 1 24 TRP NE1 N 6.640 1.301 2.605 1.00 . A A . 24 TRP NE1 1 1 6 3024 1 1 24 TRP O O 3.576 -1.595 1.695 1.00 . A A . 24 TRP O 1 1 6 3025 1 1 25 CYS C C 2.815 1.500 1.215 1.00 . A A . 25 CYS C 1 1 6 3026 1 1 25 CYS CA C 1.832 0.448 1.652 1.00 . A A . 25 CYS CA 1 1 6 3027 1 1 25 CYS CB C 0.432 1.006 1.798 1.00 . A A . 25 CYS CB 1 1 6 3028 1 1 25 CYS H H 1.929 0.097 3.726 1.00 . A A . 25 CYS H 1 1 6 3029 1 1 25 CYS HA H 1.825 -0.314 0.887 1.00 . A A . 25 CYS HA 1 1 6 3030 1 1 25 CYS HB2 H 0.381 1.612 2.691 1.00 . A A . 25 CYS HB2 1 1 6 3031 1 1 25 CYS HB3 H 0.195 1.613 0.937 1.00 . A A . 25 CYS HB3 1 1 6 3032 1 1 25 CYS N N 2.286 -0.204 2.860 1.00 . A A . 25 CYS N 1 1 6 3033 1 1 25 CYS O O 3.010 2.526 1.880 1.00 . A A . 25 CYS O 1 1 6 3034 1 1 25 CYS SG S -0.832 -0.289 1.931 1.00 . A A . 25 CYS SG 1 1 6 3035 1 1 26 LYS C C 3.963 2.864 -1.571 1.00 . A A . 26 LYS C 1 1 6 3036 1 1 26 LYS CA C 4.471 2.088 -0.392 1.00 . A A . 26 LYS CA 1 1 6 3037 1 1 26 LYS CB C 5.679 1.230 -0.776 1.00 . A A . 26 LYS CB 1 1 6 3038 1 1 26 LYS CD C 7.976 1.076 -1.733 1.00 . A A . 26 LYS CD 1 1 6 3039 1 1 26 LYS CE C 9.081 1.815 -2.453 1.00 . A A . 26 LYS CE 1 1 6 3040 1 1 26 LYS CG C 6.811 1.988 -1.432 1.00 . A A . 26 LYS CG 1 1 6 3041 1 1 26 LYS H H 3.145 0.475 -0.430 1.00 . A A . 26 LYS H 1 1 6 3042 1 1 26 LYS HA H 4.763 2.770 0.390 1.00 . A A . 26 LYS HA 1 1 6 3043 1 1 26 LYS HB2 H 6.065 0.764 0.120 1.00 . A A . 26 LYS HB2 1 1 6 3044 1 1 26 LYS HB3 H 5.350 0.453 -1.450 1.00 . A A . 26 LYS HB3 1 1 6 3045 1 1 26 LYS HD2 H 8.363 0.678 -0.807 1.00 . A A . 26 LYS HD2 1 1 6 3046 1 1 26 LYS HD3 H 7.631 0.265 -2.358 1.00 . A A . 26 LYS HD3 1 1 6 3047 1 1 26 LYS HE2 H 8.692 2.202 -3.383 1.00 . A A . 26 LYS HE2 1 1 6 3048 1 1 26 LYS HE3 H 9.412 2.636 -1.835 1.00 . A A . 26 LYS HE3 1 1 6 3049 1 1 26 LYS HG2 H 6.447 2.415 -2.355 1.00 . A A . 26 LYS HG2 1 1 6 3050 1 1 26 LYS HG3 H 7.127 2.781 -0.774 1.00 . A A . 26 LYS HG3 1 1 6 3051 1 1 26 LYS HZ1 H 10.943 1.424 -3.321 1.00 . A A . 26 LYS HZ1 1 1 6 3052 1 1 26 LYS HZ2 H 9.917 0.084 -3.251 1.00 . A A . 26 LYS HZ2 1 1 6 3053 1 1 26 LYS HZ3 H 10.679 0.622 -1.863 1.00 . A A . 26 LYS HZ3 1 1 6 3054 1 1 26 LYS N N 3.430 1.248 0.105 1.00 . A A . 26 LYS N 1 1 6 3055 1 1 26 LYS NZ N 10.228 0.938 -2.744 1.00 . A A . 26 LYS NZ 1 1 6 3056 1 1 26 LYS O O 3.316 2.308 -2.436 1.00 . A A . 26 LYS O 1 1 6 3057 1 1 27 LYS C C 4.630 4.732 -3.917 1.00 . A A . 27 LYS C 1 1 6 3058 1 1 27 LYS CA C 3.791 4.976 -2.682 1.00 . A A . 27 LYS CA 1 1 6 3059 1 1 27 LYS CB C 3.840 6.452 -2.293 1.00 . A A . 27 LYS CB 1 1 6 3060 1 1 27 LYS CD C 5.165 8.436 -1.545 1.00 . A A . 27 LYS CD 1 1 6 3061 1 1 27 LYS CE C 6.519 8.934 -1.101 1.00 . A A . 27 LYS CE 1 1 6 3062 1 1 27 LYS CG C 5.205 6.953 -1.857 1.00 . A A . 27 LYS CG 1 1 6 3063 1 1 27 LYS H H 4.764 4.522 -0.868 1.00 . A A . 27 LYS H 1 1 6 3064 1 1 27 LYS HA H 2.769 4.711 -2.905 1.00 . A A . 27 LYS HA 1 1 6 3065 1 1 27 LYS HB2 H 3.532 7.040 -3.143 1.00 . A A . 27 LYS HB2 1 1 6 3066 1 1 27 LYS HB3 H 3.142 6.607 -1.487 1.00 . A A . 27 LYS HB3 1 1 6 3067 1 1 27 LYS HD2 H 4.869 8.976 -2.432 1.00 . A A . 27 LYS HD2 1 1 6 3068 1 1 27 LYS HD3 H 4.450 8.616 -0.757 1.00 . A A . 27 LYS HD3 1 1 6 3069 1 1 27 LYS HE2 H 6.813 8.397 -0.211 1.00 . A A . 27 LYS HE2 1 1 6 3070 1 1 27 LYS HE3 H 7.232 8.740 -1.888 1.00 . A A . 27 LYS HE3 1 1 6 3071 1 1 27 LYS HG2 H 5.511 6.415 -0.972 1.00 . A A . 27 LYS HG2 1 1 6 3072 1 1 27 LYS HG3 H 5.916 6.777 -2.651 1.00 . A A . 27 LYS HG3 1 1 6 3073 1 1 27 LYS HZ1 H 6.167 10.921 -1.622 1.00 . A A . 27 LYS HZ1 1 1 6 3074 1 1 27 LYS HZ2 H 7.483 10.672 -0.591 1.00 . A A . 27 LYS HZ2 1 1 6 3075 1 1 27 LYS HZ3 H 5.923 10.588 0.028 1.00 . A A . 27 LYS HZ3 1 1 6 3076 1 1 27 LYS N N 4.232 4.137 -1.593 1.00 . A A . 27 LYS N 1 1 6 3077 1 1 27 LYS NZ N 6.510 10.379 -0.804 1.00 . A A . 27 LYS NZ 1 1 6 3078 1 1 27 LYS O O 5.813 4.374 -3.823 1.00 . A A . 27 LYS O 1 1 6 3079 1 1 28 LYS C C 5.288 6.085 -6.681 1.00 . A A . 28 LYS C 1 1 6 3080 1 1 28 LYS CA C 4.740 4.718 -6.289 1.00 . A A . 28 LYS CA 1 1 6 3081 1 1 28 LYS CB C 3.804 4.141 -7.375 1.00 . A A . 28 LYS CB 1 1 6 3082 1 1 28 LYS CD C 5.461 2.483 -8.379 1.00 . A A . 28 LYS CD 1 1 6 3083 1 1 28 LYS CE C 4.727 1.208 -7.934 1.00 . A A . 28 LYS CE 1 1 6 3084 1 1 28 LYS CG C 4.510 3.663 -8.648 1.00 . A A . 28 LYS CG 1 1 6 3085 1 1 28 LYS H H 3.076 5.112 -5.074 1.00 . A A . 28 LYS H 1 1 6 3086 1 1 28 LYS HA H 5.567 4.048 -6.117 1.00 . A A . 28 LYS HA 1 1 6 3087 1 1 28 LYS HB2 H 3.258 3.309 -6.957 1.00 . A A . 28 LYS HB2 1 1 6 3088 1 1 28 LYS HB3 H 3.095 4.904 -7.654 1.00 . A A . 28 LYS HB3 1 1 6 3089 1 1 28 LYS HD2 H 6.001 2.262 -9.287 1.00 . A A . 28 LYS HD2 1 1 6 3090 1 1 28 LYS HD3 H 6.167 2.769 -7.614 1.00 . A A . 28 LYS HD3 1 1 6 3091 1 1 28 LYS HE2 H 5.464 0.467 -7.660 1.00 . A A . 28 LYS HE2 1 1 6 3092 1 1 28 LYS HE3 H 4.120 1.433 -7.070 1.00 . A A . 28 LYS HE3 1 1 6 3093 1 1 28 LYS HG2 H 3.764 3.346 -9.363 1.00 . A A . 28 LYS HG2 1 1 6 3094 1 1 28 LYS HG3 H 5.077 4.483 -9.062 1.00 . A A . 28 LYS HG3 1 1 6 3095 1 1 28 LYS HZ1 H 4.444 0.349 -9.815 1.00 . A A . 28 LYS HZ1 1 1 6 3096 1 1 28 LYS HZ2 H 3.146 1.316 -9.331 1.00 . A A . 28 LYS HZ2 1 1 6 3097 1 1 28 LYS HZ3 H 3.363 -0.199 -8.653 1.00 . A A . 28 LYS HZ3 1 1 6 3098 1 1 28 LYS N N 4.030 4.878 -5.056 1.00 . A A . 28 LYS N 1 1 6 3099 1 1 28 LYS NZ N 3.867 0.643 -9.002 1.00 . A A . 28 LYS NZ 1 1 6 3100 1 1 28 LYS O O 4.541 7.071 -6.721 1.00 . A A . 28 LYS O 1 1 6 3101 1 1 29 LEU C C 7.118 7.707 -8.704 1.00 . A A . 29 LEU C 1 1 6 3102 1 1 29 LEU CA C 7.224 7.418 -7.229 1.00 . A A . 29 LEU CA 1 1 6 3103 1 1 29 LEU CB C 8.714 7.442 -6.791 1.00 . A A . 29 LEU CB 1 1 6 3104 1 1 29 LEU CD1 C 8.346 8.572 -4.556 1.00 . A A . 29 LEU CD1 1 1 6 3105 1 1 29 LEU CD2 C 8.700 6.095 -4.621 1.00 . A A . 29 LEU CD2 1 1 6 3106 1 1 29 LEU CG C 9.034 7.428 -5.274 1.00 . A A . 29 LEU CG 1 1 6 3107 1 1 29 LEU H H 7.128 5.344 -6.889 1.00 . A A . 29 LEU H 1 1 6 3108 1 1 29 LEU HA H 6.697 8.195 -6.697 1.00 . A A . 29 LEU HA 1 1 6 3109 1 1 29 LEU HB2 H 9.200 6.584 -7.232 1.00 . A A . 29 LEU HB2 1 1 6 3110 1 1 29 LEU HB3 H 9.164 8.327 -7.216 1.00 . A A . 29 LEU HB3 1 1 6 3111 1 1 29 LEU HD11 H 8.631 8.562 -3.515 1.00 . A A . 29 LEU HD11 1 1 6 3112 1 1 29 LEU HD12 H 7.275 8.455 -4.633 1.00 . A A . 29 LEU HD12 1 1 6 3113 1 1 29 LEU HD13 H 8.642 9.509 -5.002 1.00 . A A . 29 LEU HD13 1 1 6 3114 1 1 29 LEU HD21 H 9.271 5.312 -5.095 1.00 . A A . 29 LEU HD21 1 1 6 3115 1 1 29 LEU HD22 H 7.645 5.891 -4.737 1.00 . A A . 29 LEU HD22 1 1 6 3116 1 1 29 LEU HD23 H 8.945 6.135 -3.569 1.00 . A A . 29 LEU HD23 1 1 6 3117 1 1 29 LEU HG H 10.095 7.601 -5.165 1.00 . A A . 29 LEU HG 1 1 6 3118 1 1 29 LEU N N 6.577 6.156 -6.912 1.00 . A A . 29 LEU N 1 1 6 3119 1 1 29 LEU O O 7.028 8.864 -9.120 1.00 . A A . 29 LEU O 1 1 6 3120 1 1 30 TRP C C 5.965 5.846 -11.421 1.00 . A A . 30 TRP C 1 1 6 3121 1 1 30 TRP CA C 7.033 6.784 -10.914 1.00 . A A . 30 TRP CA 1 1 6 3122 1 1 30 TRP CB C 8.380 6.477 -11.585 1.00 . A A . 30 TRP CB 1 1 6 3123 1 1 30 TRP CD1 C 10.411 7.214 -10.200 1.00 . A A . 30 TRP CD1 1 1 6 3124 1 1 30 TRP CD2 C 9.791 8.683 -11.770 1.00 . A A . 30 TRP CD2 1 1 6 3125 1 1 30 TRP CE2 C 10.905 9.204 -11.083 1.00 . A A . 30 TRP CE2 1 1 6 3126 1 1 30 TRP CE3 C 9.227 9.433 -12.803 1.00 . A A . 30 TRP CE3 1 1 6 3127 1 1 30 TRP CG C 9.490 7.408 -11.188 1.00 . A A . 30 TRP CG 1 1 6 3128 1 1 30 TRP CH2 C 10.889 11.147 -12.412 1.00 . A A . 30 TRP CH2 1 1 6 3129 1 1 30 TRP CZ2 C 11.462 10.437 -11.398 1.00 . A A . 30 TRP CZ2 1 1 6 3130 1 1 30 TRP CZ3 C 9.782 10.657 -13.113 1.00 . A A . 30 TRP CZ3 1 1 6 3131 1 1 30 TRP H H 7.200 5.763 -9.101 1.00 . A A . 30 TRP H 1 1 6 3132 1 1 30 TRP HA H 6.749 7.800 -11.144 1.00 . A A . 30 TRP HA 1 1 6 3133 1 1 30 TRP HB2 H 8.681 5.475 -11.320 1.00 . A A . 30 TRP HB2 1 1 6 3134 1 1 30 TRP HB3 H 8.257 6.538 -12.656 1.00 . A A . 30 TRP HB3 1 1 6 3135 1 1 30 TRP HD1 H 10.450 6.336 -9.571 1.00 . A A . 30 TRP HD1 1 1 6 3136 1 1 30 TRP HE1 H 12.019 8.387 -9.507 1.00 . A A . 30 TRP HE1 1 1 6 3137 1 1 30 TRP HE3 H 8.375 9.069 -13.355 1.00 . A A . 30 TRP HE3 1 1 6 3138 1 1 30 TRP HH2 H 11.288 12.111 -12.687 1.00 . A A . 30 TRP HH2 1 1 6 3139 1 1 30 TRP HZ2 H 12.316 10.837 -10.870 1.00 . A A . 30 TRP HZ2 1 1 6 3140 1 1 30 TRP HZ3 H 9.358 11.252 -13.909 1.00 . A A . 30 TRP HZ3 1 1 6 3141 1 1 30 TRP N N 7.128 6.661 -9.488 1.00 . A A . 30 TRP N 1 1 6 3142 1 1 30 TRP NE1 N 11.268 8.287 -10.136 1.00 . A A . 30 TRP NE1 1 1 6 3143 1 1 30 TRP O O 6.261 4.662 -11.656 1.00 . A A . 30 TRP O 1 1 6 3144 1 1 30 TRP OXT O 4.804 6.269 -11.581 1.00 . A A . 30 TRP OXT 1 1 7 3145 1 1 1 TYR C C -10.999 1.296 1.748 1.00 . A A . 1 TYR C 1 1 7 3146 1 1 1 TYR CA C -12.314 1.346 2.496 1.00 . A A . 1 TYR CA 1 1 7 3147 1 1 1 TYR CB C -12.895 2.767 2.370 1.00 . A A . 1 TYR CB 1 1 7 3148 1 1 1 TYR CD1 C -14.395 3.516 4.255 1.00 . A A . 1 TYR CD1 1 1 7 3149 1 1 1 TYR CD2 C -15.414 2.669 2.279 1.00 . A A . 1 TYR CD2 1 1 7 3150 1 1 1 TYR CE1 C -15.635 3.738 4.808 1.00 . A A . 1 TYR CE1 1 1 7 3151 1 1 1 TYR CE2 C -16.659 2.883 2.827 1.00 . A A . 1 TYR CE2 1 1 7 3152 1 1 1 TYR CG C -14.260 2.980 2.983 1.00 . A A . 1 TYR CG 1 1 7 3153 1 1 1 TYR CZ C -16.763 3.421 4.089 1.00 . A A . 1 TYR CZ 1 1 7 3154 1 1 1 TYR H1 H -13.031 0.969 4.407 1.00 . A A . 1 TYR H1 1 1 7 3155 1 1 1 TYR H2 H -11.455 1.568 4.394 1.00 . A A . 1 TYR H2 1 1 7 3156 1 1 1 TYR H3 H -11.765 -0.016 3.933 1.00 . A A . 1 TYR H3 1 1 7 3157 1 1 1 TYR HA H -12.996 0.648 2.038 1.00 . A A . 1 TYR HA 1 1 7 3158 1 1 1 TYR HB2 H -12.220 3.469 2.837 1.00 . A A . 1 TYR HB2 1 1 7 3159 1 1 1 TYR HB3 H -12.963 3.011 1.320 1.00 . A A . 1 TYR HB3 1 1 7 3160 1 1 1 TYR HD1 H -13.510 3.766 4.822 1.00 . A A . 1 TYR HD1 1 1 7 3161 1 1 1 TYR HD2 H -15.331 2.247 1.289 1.00 . A A . 1 TYR HD2 1 1 7 3162 1 1 1 TYR HE1 H -15.710 4.157 5.801 1.00 . A A . 1 TYR HE1 1 1 7 3163 1 1 1 TYR HE2 H -17.546 2.634 2.264 1.00 . A A . 1 TYR HE2 1 1 7 3164 1 1 1 TYR HH H -18.041 4.554 4.940 1.00 . A A . 1 TYR HH 1 1 7 3165 1 1 1 TYR N N -12.129 0.957 3.892 1.00 . A A . 1 TYR N 1 1 7 3166 1 1 1 TYR O O -10.873 0.607 0.742 1.00 . A A . 1 TYR O 1 1 7 3167 1 1 1 TYR OH O -18.000 3.639 4.635 1.00 . A A . 1 TYR OH 1 1 7 3168 1 1 2 CYS C C -7.634 1.972 2.561 1.00 . A A . 2 CYS C 1 1 7 3169 1 1 2 CYS CA C -8.764 2.145 1.561 1.00 . A A . 2 CYS CA 1 1 7 3170 1 1 2 CYS CB C -8.708 3.540 0.896 1.00 . A A . 2 CYS CB 1 1 7 3171 1 1 2 CYS H H -10.101 2.494 3.090 1.00 . A A . 2 CYS H 1 1 7 3172 1 1 2 CYS HA H -8.698 1.391 0.793 1.00 . A A . 2 CYS HA 1 1 7 3173 1 1 2 CYS HB2 H -9.530 3.627 0.202 1.00 . A A . 2 CYS HB2 1 1 7 3174 1 1 2 CYS HB3 H -8.820 4.281 1.672 1.00 . A A . 2 CYS HB3 1 1 7 3175 1 1 2 CYS N N -10.024 2.017 2.237 1.00 . A A . 2 CYS N 1 1 7 3176 1 1 2 CYS O O -7.849 2.075 3.773 1.00 . A A . 2 CYS O 1 1 7 3177 1 1 2 CYS SG S -7.183 3.939 -0.038 1.00 . A A . 2 CYS SG 1 1 7 3178 1 1 3 GLN C C -4.380 2.720 2.609 1.00 . A A . 3 GLN C 1 1 7 3179 1 1 3 GLN CA C -5.276 1.542 2.867 1.00 . A A . 3 GLN CA 1 1 7 3180 1 1 3 GLN CB C -4.493 0.261 2.548 1.00 . A A . 3 GLN CB 1 1 7 3181 1 1 3 GLN CD C -5.646 -1.192 4.265 1.00 . A A . 3 GLN CD 1 1 7 3182 1 1 3 GLN CG C -5.216 -1.046 2.824 1.00 . A A . 3 GLN CG 1 1 7 3183 1 1 3 GLN H H -6.383 1.635 1.077 1.00 . A A . 3 GLN H 1 1 7 3184 1 1 3 GLN HA H -5.589 1.530 3.898 1.00 . A A . 3 GLN HA 1 1 7 3185 1 1 3 GLN HB2 H -4.227 0.290 1.504 1.00 . A A . 3 GLN HB2 1 1 7 3186 1 1 3 GLN HB3 H -3.581 0.273 3.129 1.00 . A A . 3 GLN HB3 1 1 7 3187 1 1 3 GLN HE21 H -3.890 -1.991 4.774 1.00 . A A . 3 GLN HE21 1 1 7 3188 1 1 3 GLN HE22 H -5.039 -1.834 6.034 1.00 . A A . 3 GLN HE22 1 1 7 3189 1 1 3 GLN HG2 H -6.099 -1.090 2.201 1.00 . A A . 3 GLN HG2 1 1 7 3190 1 1 3 GLN HG3 H -4.561 -1.865 2.573 1.00 . A A . 3 GLN HG3 1 1 7 3191 1 1 3 GLN N N -6.459 1.686 2.055 1.00 . A A . 3 GLN N 1 1 7 3192 1 1 3 GLN NE2 N -4.780 -1.717 5.095 1.00 . A A . 3 GLN NE2 1 1 7 3193 1 1 3 GLN O O -4.172 3.108 1.446 1.00 . A A . 3 GLN O 1 1 7 3194 1 1 3 GLN OE1 O -6.756 -0.811 4.631 1.00 . A A . 3 GLN OE1 1 1 7 3195 1 1 4 LYS C C -1.552 3.920 3.477 1.00 . A A . 4 LYS C 1 1 7 3196 1 1 4 LYS CA C -2.975 4.412 3.526 1.00 . A A . 4 LYS CA 1 1 7 3197 1 1 4 LYS CB C -3.119 5.404 4.679 1.00 . A A . 4 LYS CB 1 1 7 3198 1 1 4 LYS CD C -4.452 7.149 5.855 1.00 . A A . 4 LYS CD 1 1 7 3199 1 1 4 LYS CE C -5.791 7.851 5.954 1.00 . A A . 4 LYS CE 1 1 7 3200 1 1 4 LYS CG C -4.459 6.095 4.765 1.00 . A A . 4 LYS CG 1 1 7 3201 1 1 4 LYS H H -4.107 2.971 4.546 1.00 . A A . 4 LYS H 1 1 7 3202 1 1 4 LYS HA H -3.197 4.922 2.602 1.00 . A A . 4 LYS HA 1 1 7 3203 1 1 4 LYS HB2 H -2.965 4.870 5.605 1.00 . A A . 4 LYS HB2 1 1 7 3204 1 1 4 LYS HB3 H -2.353 6.157 4.580 1.00 . A A . 4 LYS HB3 1 1 7 3205 1 1 4 LYS HD2 H -4.235 6.676 6.800 1.00 . A A . 4 LYS HD2 1 1 7 3206 1 1 4 LYS HD3 H -3.685 7.877 5.632 1.00 . A A . 4 LYS HD3 1 1 7 3207 1 1 4 LYS HE2 H -6.051 8.253 4.985 1.00 . A A . 4 LYS HE2 1 1 7 3208 1 1 4 LYS HE3 H -6.531 7.128 6.255 1.00 . A A . 4 LYS HE3 1 1 7 3209 1 1 4 LYS HG2 H -4.659 6.573 3.820 1.00 . A A . 4 LYS HG2 1 1 7 3210 1 1 4 LYS HG3 H -5.225 5.364 4.980 1.00 . A A . 4 LYS HG3 1 1 7 3211 1 1 4 LYS HZ1 H -5.055 9.663 6.656 1.00 . A A . 4 LYS HZ1 1 1 7 3212 1 1 4 LYS HZ2 H -5.504 8.602 7.883 1.00 . A A . 4 LYS HZ2 1 1 7 3213 1 1 4 LYS HZ3 H -6.683 9.416 6.995 1.00 . A A . 4 LYS HZ3 1 1 7 3214 1 1 4 LYS N N -3.876 3.303 3.655 1.00 . A A . 4 LYS N 1 1 7 3215 1 1 4 LYS NZ N -5.757 8.947 6.938 1.00 . A A . 4 LYS NZ 1 1 7 3216 1 1 4 LYS O O -1.256 2.809 3.889 1.00 . A A . 4 LYS O 1 1 7 3217 1 1 5 TRP C C 1.364 4.296 4.308 1.00 . A A . 5 TRP C 1 1 7 3218 1 1 5 TRP CA C 0.757 4.536 2.921 1.00 . A A . 5 TRP CA 1 1 7 3219 1 1 5 TRP CB C 1.423 5.759 2.271 1.00 . A A . 5 TRP CB 1 1 7 3220 1 1 5 TRP CD1 C 2.073 7.586 3.957 1.00 . A A . 5 TRP CD1 1 1 7 3221 1 1 5 TRP CD2 C 0.065 7.889 3.022 1.00 . A A . 5 TRP CD2 1 1 7 3222 1 1 5 TRP CE2 C 0.296 8.927 3.938 1.00 . A A . 5 TRP CE2 1 1 7 3223 1 1 5 TRP CE3 C -1.140 7.878 2.312 1.00 . A A . 5 TRP CE3 1 1 7 3224 1 1 5 TRP CG C 1.216 7.032 3.053 1.00 . A A . 5 TRP CG 1 1 7 3225 1 1 5 TRP CH2 C -1.785 9.897 3.455 1.00 . A A . 5 TRP CH2 1 1 7 3226 1 1 5 TRP CZ2 C -0.623 9.935 4.161 1.00 . A A . 5 TRP CZ2 1 1 7 3227 1 1 5 TRP CZ3 C -2.049 8.883 2.538 1.00 . A A . 5 TRP CZ3 1 1 7 3228 1 1 5 TRP H H -1.024 5.650 2.724 1.00 . A A . 5 TRP H 1 1 7 3229 1 1 5 TRP HA H 0.922 3.674 2.293 1.00 . A A . 5 TRP HA 1 1 7 3230 1 1 5 TRP HB2 H 2.486 5.581 2.202 1.00 . A A . 5 TRP HB2 1 1 7 3231 1 1 5 TRP HB3 H 1.017 5.902 1.280 1.00 . A A . 5 TRP HB3 1 1 7 3232 1 1 5 TRP HD1 H 3.040 7.174 4.211 1.00 . A A . 5 TRP HD1 1 1 7 3233 1 1 5 TRP HE1 H 1.942 9.295 5.171 1.00 . A A . 5 TRP HE1 1 1 7 3234 1 1 5 TRP HE3 H -1.369 7.108 1.590 1.00 . A A . 5 TRP HE3 1 1 7 3235 1 1 5 TRP HH2 H -2.527 10.667 3.601 1.00 . A A . 5 TRP HH2 1 1 7 3236 1 1 5 TRP HZ2 H -0.447 10.734 4.866 1.00 . A A . 5 TRP HZ2 1 1 7 3237 1 1 5 TRP HZ3 H -2.988 8.894 2.004 1.00 . A A . 5 TRP HZ3 1 1 7 3238 1 1 5 TRP N N -0.682 4.782 3.023 1.00 . A A . 5 TRP N 1 1 7 3239 1 1 5 TRP NE1 N 1.521 8.719 4.493 1.00 . A A . 5 TRP NE1 1 1 7 3240 1 1 5 TRP O O 2.383 3.644 4.454 1.00 . A A . 5 TRP O 1 1 7 3241 1 1 6 MET C C 0.742 3.367 7.256 1.00 . A A . 6 MET C 1 1 7 3242 1 1 6 MET CA C 1.135 4.728 6.698 1.00 . A A . 6 MET CA 1 1 7 3243 1 1 6 MET CB C 0.518 5.853 7.550 1.00 . A A . 6 MET CB 1 1 7 3244 1 1 6 MET CE C -1.040 6.897 10.176 1.00 . A A . 6 MET CE 1 1 7 3245 1 1 6 MET CG C -1.002 5.844 7.594 1.00 . A A . 6 MET CG 1 1 7 3246 1 1 6 MET H H -0.077 5.386 5.093 1.00 . A A . 6 MET H 1 1 7 3247 1 1 6 MET HA H 2.211 4.821 6.725 1.00 . A A . 6 MET HA 1 1 7 3248 1 1 6 MET HB2 H 0.879 5.749 8.562 1.00 . A A . 6 MET HB2 1 1 7 3249 1 1 6 MET HB3 H 0.842 6.806 7.158 1.00 . A A . 6 MET HB3 1 1 7 3250 1 1 6 MET HE1 H 0.037 6.953 10.135 1.00 . A A . 6 MET HE1 1 1 7 3251 1 1 6 MET HE2 H -1.340 5.915 10.511 1.00 . A A . 6 MET HE2 1 1 7 3252 1 1 6 MET HE3 H -1.413 7.641 10.863 1.00 . A A . 6 MET HE3 1 1 7 3253 1 1 6 MET HG2 H -1.368 5.915 6.581 1.00 . A A . 6 MET HG2 1 1 7 3254 1 1 6 MET HG3 H -1.331 4.910 8.025 1.00 . A A . 6 MET HG3 1 1 7 3255 1 1 6 MET N N 0.711 4.851 5.313 1.00 . A A . 6 MET N 1 1 7 3256 1 1 6 MET O O 1.161 2.985 8.350 1.00 . A A . 6 MET O 1 1 7 3257 1 1 6 MET SD S -1.713 7.204 8.542 1.00 . A A . 6 MET SD 1 1 7 3258 1 1 7 TRP C C 0.177 0.307 6.046 1.00 . A A . 7 TRP C 1 1 7 3259 1 1 7 TRP CA C -0.509 1.341 6.916 1.00 . A A . 7 TRP CA 1 1 7 3260 1 1 7 TRP CB C -2.044 1.201 6.812 1.00 . A A . 7 TRP CB 1 1 7 3261 1 1 7 TRP CD1 C -2.414 2.906 8.709 1.00 . A A . 7 TRP CD1 1 1 7 3262 1 1 7 TRP CD2 C -4.171 2.619 7.366 1.00 . A A . 7 TRP CD2 1 1 7 3263 1 1 7 TRP CE2 C -4.499 3.589 8.326 1.00 . A A . 7 TRP CE2 1 1 7 3264 1 1 7 TRP CE3 C -5.123 2.264 6.425 1.00 . A A . 7 TRP CE3 1 1 7 3265 1 1 7 TRP CG C -2.824 2.214 7.606 1.00 . A A . 7 TRP CG 1 1 7 3266 1 1 7 TRP CH2 C -6.659 3.837 7.422 1.00 . A A . 7 TRP CH2 1 1 7 3267 1 1 7 TRP CZ2 C -5.744 4.207 8.362 1.00 . A A . 7 TRP CZ2 1 1 7 3268 1 1 7 TRP CZ3 C -6.360 2.872 6.461 1.00 . A A . 7 TRP CZ3 1 1 7 3269 1 1 7 TRP H H -0.336 2.956 5.620 1.00 . A A . 7 TRP H 1 1 7 3270 1 1 7 TRP HA H -0.201 1.196 7.940 1.00 . A A . 7 TRP HA 1 1 7 3271 1 1 7 TRP HB2 H -2.333 1.311 5.778 1.00 . A A . 7 TRP HB2 1 1 7 3272 1 1 7 TRP HB3 H -2.334 0.215 7.149 1.00 . A A . 7 TRP HB3 1 1 7 3273 1 1 7 TRP HD1 H -1.433 2.813 9.155 1.00 . A A . 7 TRP HD1 1 1 7 3274 1 1 7 TRP HE1 H -3.353 4.375 9.889 1.00 . A A . 7 TRP HE1 1 1 7 3275 1 1 7 TRP HE3 H -4.897 1.512 5.684 1.00 . A A . 7 TRP HE3 1 1 7 3276 1 1 7 TRP HH2 H -7.640 4.288 7.418 1.00 . A A . 7 TRP HH2 1 1 7 3277 1 1 7 TRP HZ2 H -6.002 4.953 9.097 1.00 . A A . 7 TRP HZ2 1 1 7 3278 1 1 7 TRP HZ3 H -7.112 2.607 5.731 1.00 . A A . 7 TRP HZ3 1 1 7 3279 1 1 7 TRP N N -0.063 2.645 6.509 1.00 . A A . 7 TRP N 1 1 7 3280 1 1 7 TRP NE1 N -3.406 3.756 9.127 1.00 . A A . 7 TRP NE1 1 1 7 3281 1 1 7 TRP O O 1.080 0.637 5.252 1.00 . A A . 7 TRP O 1 1 7 3282 1 1 8 THR C C -0.681 -2.729 4.645 1.00 . A A . 8 THR C 1 1 7 3283 1 1 8 THR CA C 0.395 -1.977 5.453 1.00 . A A . 8 THR CA 1 1 7 3284 1 1 8 THR CB C 1.098 -2.927 6.465 1.00 . A A . 8 THR CB 1 1 7 3285 1 1 8 THR CG2 C 2.190 -2.191 7.254 1.00 . A A . 8 THR CG2 1 1 7 3286 1 1 8 THR H H -0.991 -1.127 6.750 1.00 . A A . 8 THR H 1 1 7 3287 1 1 8 THR HA H 1.135 -1.536 4.802 1.00 . A A . 8 THR HA 1 1 7 3288 1 1 8 THR HB H 1.547 -3.746 5.921 1.00 . A A . 8 THR HB 1 1 7 3289 1 1 8 THR HG1 H -0.273 -2.711 7.865 1.00 . A A . 8 THR HG1 1 1 7 3290 1 1 8 THR HG21 H 2.921 -1.774 6.577 1.00 . A A . 8 THR HG21 1 1 7 3291 1 1 8 THR HG22 H 2.681 -2.880 7.924 1.00 . A A . 8 THR HG22 1 1 7 3292 1 1 8 THR HG23 H 1.740 -1.394 7.826 1.00 . A A . 8 THR HG23 1 1 7 3293 1 1 8 THR N N -0.227 -0.913 6.172 1.00 . A A . 8 THR N 1 1 7 3294 1 1 8 THR O O -1.879 -2.418 4.786 1.00 . A A . 8 THR O 1 1 7 3295 1 1 8 THR OG1 O 0.136 -3.456 7.400 1.00 . A A . 8 THR OG1 1 1 7 3296 1 1 9 CYS C C -0.950 -5.901 2.980 1.00 . A A . 9 CYS C 1 1 7 3297 1 1 9 CYS CA C -1.331 -4.433 3.104 1.00 . A A . 9 CYS CA 1 1 7 3298 1 1 9 CYS CB C -1.709 -3.808 1.758 1.00 . A A . 9 CYS CB 1 1 7 3299 1 1 9 CYS H H 0.626 -3.909 3.541 1.00 . A A . 9 CYS H 1 1 7 3300 1 1 9 CYS HA H -2.195 -4.394 3.752 1.00 . A A . 9 CYS HA 1 1 7 3301 1 1 9 CYS HB2 H -2.520 -4.374 1.323 1.00 . A A . 9 CYS HB2 1 1 7 3302 1 1 9 CYS HB3 H -2.050 -2.797 1.934 1.00 . A A . 9 CYS HB3 1 1 7 3303 1 1 9 CYS N N -0.306 -3.678 3.779 1.00 . A A . 9 CYS N 1 1 7 3304 1 1 9 CYS O O 0.126 -6.319 3.461 1.00 . A A . 9 CYS O 1 1 7 3305 1 1 9 CYS SG S -0.388 -3.743 0.529 1.00 . A A . 9 CYS SG 1 1 7 3306 1 1 10 ASP C C -2.573 -8.563 1.103 1.00 . A A . 10 ASP C 1 1 7 3307 1 1 10 ASP CA C -1.656 -8.112 2.252 1.00 . A A . 10 ASP CA 1 1 7 3308 1 1 10 ASP CB C -2.041 -8.787 3.598 1.00 . A A . 10 ASP CB 1 1 7 3309 1 1 10 ASP CG C -1.780 -10.273 3.645 1.00 . A A . 10 ASP CG 1 1 7 3310 1 1 10 ASP H H -2.643 -6.296 1.990 1.00 . A A . 10 ASP H 1 1 7 3311 1 1 10 ASP HA H -0.628 -8.325 2.005 1.00 . A A . 10 ASP HA 1 1 7 3312 1 1 10 ASP HB2 H -1.477 -8.326 4.396 1.00 . A A . 10 ASP HB2 1 1 7 3313 1 1 10 ASP HB3 H -3.093 -8.618 3.774 1.00 . A A . 10 ASP HB3 1 1 7 3314 1 1 10 ASP N N -1.827 -6.680 2.390 1.00 . A A . 10 ASP N 1 1 7 3315 1 1 10 ASP O O -2.953 -7.740 0.268 1.00 . A A . 10 ASP O 1 1 7 3316 1 1 10 ASP OD1 O -0.626 -10.685 3.759 1.00 . A A . 10 ASP OD1 1 1 7 3317 1 1 10 ASP OD2 O -2.750 -11.059 3.563 1.00 . A A . 10 ASP OD2 1 1 7 3318 1 1 11 SER C C -5.233 -9.999 0.449 1.00 . A A . 11 SER C 1 1 7 3319 1 1 11 SER CA C -3.793 -10.305 0.032 1.00 . A A . 11 SER CA 1 1 7 3320 1 1 11 SER CB C -3.568 -11.800 -0.131 1.00 . A A . 11 SER CB 1 1 7 3321 1 1 11 SER H H -2.547 -10.468 1.678 1.00 . A A . 11 SER H 1 1 7 3322 1 1 11 SER HA H -3.574 -9.806 -0.900 1.00 . A A . 11 SER HA 1 1 7 3323 1 1 11 SER HB2 H -3.915 -12.315 0.752 1.00 . A A . 11 SER HB2 1 1 7 3324 1 1 11 SER HB3 H -4.107 -12.153 -0.997 1.00 . A A . 11 SER HB3 1 1 7 3325 1 1 11 SER HG H -2.028 -13.010 -0.151 1.00 . A A . 11 SER HG 1 1 7 3326 1 1 11 SER N N -2.905 -9.817 1.034 1.00 . A A . 11 SER N 1 1 7 3327 1 1 11 SER O O -6.105 -9.782 -0.391 1.00 . A A . 11 SER O 1 1 7 3328 1 1 11 SER OG O -2.179 -12.069 -0.313 1.00 . A A . 11 SER OG 1 1 7 3329 1 1 12 GLU C C -7.046 -8.142 2.243 1.00 . A A . 12 GLU C 1 1 7 3330 1 1 12 GLU CA C -6.786 -9.655 2.280 1.00 . A A . 12 GLU CA 1 1 7 3331 1 1 12 GLU CB C -7.007 -10.258 3.681 1.00 . A A . 12 GLU CB 1 1 7 3332 1 1 12 GLU CD C -6.309 -10.412 6.092 1.00 . A A . 12 GLU CD 1 1 7 3333 1 1 12 GLU CG C -6.005 -9.828 4.738 1.00 . A A . 12 GLU CG 1 1 7 3334 1 1 12 GLU H H -4.730 -10.163 2.377 1.00 . A A . 12 GLU H 1 1 7 3335 1 1 12 GLU HA H -7.483 -10.108 1.589 1.00 . A A . 12 GLU HA 1 1 7 3336 1 1 12 GLU HB2 H -7.990 -9.977 4.027 1.00 . A A . 12 GLU HB2 1 1 7 3337 1 1 12 GLU HB3 H -6.971 -11.335 3.601 1.00 . A A . 12 GLU HB3 1 1 7 3338 1 1 12 GLU HG2 H -5.018 -10.146 4.437 1.00 . A A . 12 GLU HG2 1 1 7 3339 1 1 12 GLU HG3 H -6.028 -8.752 4.810 1.00 . A A . 12 GLU HG3 1 1 7 3340 1 1 12 GLU N N -5.466 -9.963 1.762 1.00 . A A . 12 GLU N 1 1 7 3341 1 1 12 GLU O O -8.114 -7.696 1.834 1.00 . A A . 12 GLU O 1 1 7 3342 1 1 12 GLU OE1 O -5.662 -11.396 6.486 1.00 . A A . 12 GLU OE1 1 1 7 3343 1 1 12 GLU OE2 O -7.214 -9.894 6.788 1.00 . A A . 12 GLU OE2 1 1 7 3344 1 1 13 ARG C C -5.406 -5.455 1.403 1.00 . A A . 13 ARG C 1 1 7 3345 1 1 13 ARG CA C -6.189 -5.914 2.579 1.00 . A A . 13 ARG CA 1 1 7 3346 1 1 13 ARG CB C -5.692 -5.176 3.821 1.00 . A A . 13 ARG CB 1 1 7 3347 1 1 13 ARG CD C -7.946 -4.682 4.885 1.00 . A A . 13 ARG CD 1 1 7 3348 1 1 13 ARG CG C -6.554 -5.298 5.063 1.00 . A A . 13 ARG CG 1 1 7 3349 1 1 13 ARG CZ C -9.883 -5.124 3.362 1.00 . A A . 13 ARG CZ 1 1 7 3350 1 1 13 ARG H H -5.284 -7.744 3.102 1.00 . A A . 13 ARG H 1 1 7 3351 1 1 13 ARG HA H -7.230 -5.674 2.420 1.00 . A A . 13 ARG HA 1 1 7 3352 1 1 13 ARG HB2 H -4.717 -5.566 4.068 1.00 . A A . 13 ARG HB2 1 1 7 3353 1 1 13 ARG HB3 H -5.588 -4.129 3.578 1.00 . A A . 13 ARG HB3 1 1 7 3354 1 1 13 ARG HD2 H -8.404 -4.565 5.855 1.00 . A A . 13 ARG HD2 1 1 7 3355 1 1 13 ARG HD3 H -7.838 -3.713 4.421 1.00 . A A . 13 ARG HD3 1 1 7 3356 1 1 13 ARG HE H -8.525 -6.463 4.012 1.00 . A A . 13 ARG HE 1 1 7 3357 1 1 13 ARG HG2 H -6.674 -6.355 5.236 1.00 . A A . 13 ARG HG2 1 1 7 3358 1 1 13 ARG HG3 H -6.043 -4.834 5.891 1.00 . A A . 13 ARG HG3 1 1 7 3359 1 1 13 ARG HH11 H -9.795 -3.138 3.891 1.00 . A A . 13 ARG HH11 1 1 7 3360 1 1 13 ARG HH12 H -11.091 -3.525 2.885 1.00 . A A . 13 ARG HH12 1 1 7 3361 1 1 13 ARG HH21 H -10.247 -6.969 2.617 1.00 . A A . 13 ARG HH21 1 1 7 3362 1 1 13 ARG HH22 H -11.372 -5.789 2.117 1.00 . A A . 13 ARG HH22 1 1 7 3363 1 1 13 ARG N N -6.083 -7.354 2.694 1.00 . A A . 13 ARG N 1 1 7 3364 1 1 13 ARG NE N -8.805 -5.518 4.042 1.00 . A A . 13 ARG NE 1 1 7 3365 1 1 13 ARG NH1 N -10.278 -3.853 3.378 1.00 . A A . 13 ARG NH1 1 1 7 3366 1 1 13 ARG NH2 N -10.549 -6.010 2.649 1.00 . A A . 13 ARG NH2 1 1 7 3367 1 1 13 ARG O O -4.189 -5.518 1.406 1.00 . A A . 13 ARG O 1 1 7 3368 1 1 14 LYS C C -5.129 -3.041 -0.599 1.00 . A A . 14 LYS C 1 1 7 3369 1 1 14 LYS CA C -5.423 -4.491 -0.757 1.00 . A A . 14 LYS CA 1 1 7 3370 1 1 14 LYS CB C -6.241 -4.734 -2.016 1.00 . A A . 14 LYS CB 1 1 7 3371 1 1 14 LYS CD C -5.039 -6.805 -2.758 1.00 . A A . 14 LYS CD 1 1 7 3372 1 1 14 LYS CE C -5.172 -8.277 -3.120 1.00 . A A . 14 LYS CE 1 1 7 3373 1 1 14 LYS CG C -6.379 -6.192 -2.377 1.00 . A A . 14 LYS CG 1 1 7 3374 1 1 14 LYS H H -7.057 -4.964 0.502 1.00 . A A . 14 LYS H 1 1 7 3375 1 1 14 LYS HA H -4.483 -5.013 -0.846 1.00 . A A . 14 LYS HA 1 1 7 3376 1 1 14 LYS HB2 H -7.229 -4.321 -1.870 1.00 . A A . 14 LYS HB2 1 1 7 3377 1 1 14 LYS HB3 H -5.767 -4.222 -2.840 1.00 . A A . 14 LYS HB3 1 1 7 3378 1 1 14 LYS HD2 H -4.638 -6.274 -3.608 1.00 . A A . 14 LYS HD2 1 1 7 3379 1 1 14 LYS HD3 H -4.360 -6.713 -1.924 1.00 . A A . 14 LYS HD3 1 1 7 3380 1 1 14 LYS HE2 H -4.196 -8.656 -3.384 1.00 . A A . 14 LYS HE2 1 1 7 3381 1 1 14 LYS HE3 H -5.540 -8.813 -2.258 1.00 . A A . 14 LYS HE3 1 1 7 3382 1 1 14 LYS HG2 H -6.745 -6.702 -1.500 1.00 . A A . 14 LYS HG2 1 1 7 3383 1 1 14 LYS HG3 H -7.070 -6.287 -3.199 1.00 . A A . 14 LYS HG3 1 1 7 3384 1 1 14 LYS HZ1 H -6.108 -9.511 -4.498 1.00 . A A . 14 LYS HZ1 1 1 7 3385 1 1 14 LYS HZ2 H -5.793 -7.966 -5.097 1.00 . A A . 14 LYS HZ2 1 1 7 3386 1 1 14 LYS HZ3 H -7.059 -8.217 -4.021 1.00 . A A . 14 LYS HZ3 1 1 7 3387 1 1 14 LYS N N -6.079 -4.990 0.421 1.00 . A A . 14 LYS N 1 1 7 3388 1 1 14 LYS NZ N -6.085 -8.499 -4.257 1.00 . A A . 14 LYS NZ 1 1 7 3389 1 1 14 LYS O O -5.956 -2.271 -0.099 1.00 . A A . 14 LYS O 1 1 7 3390 1 1 15 CYS C C -4.091 -0.539 -2.082 1.00 . A A . 15 CYS C 1 1 7 3391 1 1 15 CYS CA C -3.554 -1.301 -0.890 1.00 . A A . 15 CYS CA 1 1 7 3392 1 1 15 CYS CB C -2.035 -1.173 -0.789 1.00 . A A . 15 CYS CB 1 1 7 3393 1 1 15 CYS H H -3.388 -3.359 -1.396 1.00 . A A . 15 CYS H 1 1 7 3394 1 1 15 CYS HA H -4.013 -0.908 0.003 1.00 . A A . 15 CYS HA 1 1 7 3395 1 1 15 CYS HB2 H -1.660 -1.934 -0.123 1.00 . A A . 15 CYS HB2 1 1 7 3396 1 1 15 CYS HB3 H -1.606 -1.321 -1.768 1.00 . A A . 15 CYS HB3 1 1 7 3397 1 1 15 CYS N N -3.963 -2.671 -1.001 1.00 . A A . 15 CYS N 1 1 7 3398 1 1 15 CYS O O -4.342 -1.128 -3.149 1.00 . A A . 15 CYS O 1 1 7 3399 1 1 15 CYS SG S -1.455 0.440 -0.167 1.00 . A A . 15 CYS SG 1 1 7 3400 1 1 16 CYS C C -3.840 1.997 -3.953 1.00 . A A . 16 CYS C 1 1 7 3401 1 1 16 CYS CA C -4.864 1.547 -2.928 1.00 . A A . 16 CYS CA 1 1 7 3402 1 1 16 CYS CB C -5.526 2.728 -2.261 1.00 . A A . 16 CYS CB 1 1 7 3403 1 1 16 CYS H H -3.981 1.152 -1.082 1.00 . A A . 16 CYS H 1 1 7 3404 1 1 16 CYS HA H -5.628 0.968 -3.423 1.00 . A A . 16 CYS HA 1 1 7 3405 1 1 16 CYS HB2 H -4.770 3.352 -1.810 1.00 . A A . 16 CYS HB2 1 1 7 3406 1 1 16 CYS HB3 H -6.078 3.300 -2.992 1.00 . A A . 16 CYS HB3 1 1 7 3407 1 1 16 CYS N N -4.269 0.727 -1.918 1.00 . A A . 16 CYS N 1 1 7 3408 1 1 16 CYS O O -2.620 2.000 -3.688 1.00 . A A . 16 CYS O 1 1 7 3409 1 1 16 CYS SG S -6.687 2.215 -0.961 1.00 . A A . 16 CYS SG 1 1 7 3410 1 1 17 LYS C C -2.808 4.106 -5.804 1.00 . A A . 17 LYS C 1 1 7 3411 1 1 17 LYS CA C -3.497 2.809 -6.198 1.00 . A A . 17 LYS CA 1 1 7 3412 1 1 17 LYS CB C -4.309 2.955 -7.483 1.00 . A A . 17 LYS CB 1 1 7 3413 1 1 17 LYS CD C -5.706 1.756 -9.237 1.00 . A A . 17 LYS CD 1 1 7 3414 1 1 17 LYS CE C -6.876 2.725 -9.145 1.00 . A A . 17 LYS CE 1 1 7 3415 1 1 17 LYS CG C -4.946 1.639 -7.925 1.00 . A A . 17 LYS CG 1 1 7 3416 1 1 17 LYS H H -5.303 2.312 -5.258 1.00 . A A . 17 LYS H 1 1 7 3417 1 1 17 LYS HA H -2.733 2.060 -6.346 1.00 . A A . 17 LYS HA 1 1 7 3418 1 1 17 LYS HB2 H -5.090 3.682 -7.320 1.00 . A A . 17 LYS HB2 1 1 7 3419 1 1 17 LYS HB3 H -3.661 3.299 -8.276 1.00 . A A . 17 LYS HB3 1 1 7 3420 1 1 17 LYS HD2 H -5.025 2.107 -9.998 1.00 . A A . 17 LYS HD2 1 1 7 3421 1 1 17 LYS HD3 H -6.078 0.780 -9.515 1.00 . A A . 17 LYS HD3 1 1 7 3422 1 1 17 LYS HE2 H -7.516 2.431 -8.328 1.00 . A A . 17 LYS HE2 1 1 7 3423 1 1 17 LYS HE3 H -6.488 3.716 -8.958 1.00 . A A . 17 LYS HE3 1 1 7 3424 1 1 17 LYS HG2 H -4.170 0.897 -8.040 1.00 . A A . 17 LYS HG2 1 1 7 3425 1 1 17 LYS HG3 H -5.627 1.316 -7.151 1.00 . A A . 17 LYS HG3 1 1 7 3426 1 1 17 LYS HZ1 H -7.072 3.042 -11.194 1.00 . A A . 17 LYS HZ1 1 1 7 3427 1 1 17 LYS HZ2 H -8.468 3.394 -10.328 1.00 . A A . 17 LYS HZ2 1 1 7 3428 1 1 17 LYS HZ3 H -8.027 1.798 -10.608 1.00 . A A . 17 LYS HZ3 1 1 7 3429 1 1 17 LYS N N -4.332 2.351 -5.120 1.00 . A A . 17 LYS N 1 1 7 3430 1 1 17 LYS NZ N -7.658 2.746 -10.387 1.00 . A A . 17 LYS NZ 1 1 7 3431 1 1 17 LYS O O -3.382 4.945 -5.094 1.00 . A A . 17 LYS O 1 1 7 3432 1 1 18 GLY C C 0.353 4.793 -4.954 1.00 . A A . 18 GLY C 1 1 7 3433 1 1 18 GLY CA C -0.751 5.332 -5.822 1.00 . A A . 18 GLY CA 1 1 7 3434 1 1 18 GLY H H -1.198 3.568 -6.830 1.00 . A A . 18 GLY H 1 1 7 3435 1 1 18 GLY HA2 H -0.336 5.810 -6.698 1.00 . A A . 18 GLY HA2 1 1 7 3436 1 1 18 GLY HA3 H -1.329 6.042 -5.251 1.00 . A A . 18 GLY HA3 1 1 7 3437 1 1 18 GLY N N -1.584 4.235 -6.222 1.00 . A A . 18 GLY N 1 1 7 3438 1 1 18 GLY O O 1.423 5.404 -4.802 1.00 . A A . 18 GLY O 1 1 7 3439 1 1 19 MET C C 1.224 1.546 -4.202 1.00 . A A . 19 MET C 1 1 7 3440 1 1 19 MET CA C 1.056 2.919 -3.613 1.00 . A A . 19 MET CA 1 1 7 3441 1 1 19 MET CB C 0.651 2.779 -2.122 1.00 . A A . 19 MET CB 1 1 7 3442 1 1 19 MET CE C -2.138 4.097 -1.096 1.00 . A A . 19 MET CE 1 1 7 3443 1 1 19 MET CG C 0.621 4.072 -1.311 1.00 . A A . 19 MET CG 1 1 7 3444 1 1 19 MET H H -0.789 3.218 -4.497 1.00 . A A . 19 MET H 1 1 7 3445 1 1 19 MET HA H 1.996 3.446 -3.675 1.00 . A A . 19 MET HA 1 1 7 3446 1 1 19 MET HB2 H -0.331 2.333 -2.075 1.00 . A A . 19 MET HB2 1 1 7 3447 1 1 19 MET HB3 H 1.350 2.102 -1.651 1.00 . A A . 19 MET HB3 1 1 7 3448 1 1 19 MET HE1 H -2.170 3.187 -1.676 1.00 . A A . 19 MET HE1 1 1 7 3449 1 1 19 MET HE2 H -3.070 4.630 -1.217 1.00 . A A . 19 MET HE2 1 1 7 3450 1 1 19 MET HE3 H -1.997 3.856 -0.053 1.00 . A A . 19 MET HE3 1 1 7 3451 1 1 19 MET HG2 H 0.630 3.839 -0.258 1.00 . A A . 19 MET HG2 1 1 7 3452 1 1 19 MET HG3 H 1.518 4.625 -1.542 1.00 . A A . 19 MET HG3 1 1 7 3453 1 1 19 MET N N 0.096 3.633 -4.388 1.00 . A A . 19 MET N 1 1 7 3454 1 1 19 MET O O 0.441 1.126 -5.059 1.00 . A A . 19 MET O 1 1 7 3455 1 1 19 MET SD S -0.791 5.134 -1.657 1.00 . A A . 19 MET SD 1 1 7 3456 1 1 20 VAL C C 2.110 -1.334 -2.981 1.00 . A A . 20 VAL C 1 1 7 3457 1 1 20 VAL CA C 2.485 -0.482 -4.156 1.00 . A A . 20 VAL CA 1 1 7 3458 1 1 20 VAL CB C 3.993 -0.715 -4.472 1.00 . A A . 20 VAL CB 1 1 7 3459 1 1 20 VAL CG1 C 4.242 -2.132 -4.980 1.00 . A A . 20 VAL CG1 1 1 7 3460 1 1 20 VAL CG2 C 4.520 0.315 -5.455 1.00 . A A . 20 VAL CG2 1 1 7 3461 1 1 20 VAL H H 2.837 1.299 -3.124 1.00 . A A . 20 VAL H 1 1 7 3462 1 1 20 VAL HA H 1.883 -0.732 -5.018 1.00 . A A . 20 VAL HA 1 1 7 3463 1 1 20 VAL HB H 4.535 -0.609 -3.543 1.00 . A A . 20 VAL HB 1 1 7 3464 1 1 20 VAL HG11 H 3.658 -2.301 -5.872 1.00 . A A . 20 VAL HG11 1 1 7 3465 1 1 20 VAL HG12 H 3.953 -2.845 -4.222 1.00 . A A . 20 VAL HG12 1 1 7 3466 1 1 20 VAL HG13 H 5.291 -2.255 -5.208 1.00 . A A . 20 VAL HG13 1 1 7 3467 1 1 20 VAL HG21 H 4.435 1.297 -5.013 1.00 . A A . 20 VAL HG21 1 1 7 3468 1 1 20 VAL HG22 H 3.936 0.277 -6.363 1.00 . A A . 20 VAL HG22 1 1 7 3469 1 1 20 VAL HG23 H 5.556 0.108 -5.680 1.00 . A A . 20 VAL HG23 1 1 7 3470 1 1 20 VAL N N 2.224 0.867 -3.760 1.00 . A A . 20 VAL N 1 1 7 3471 1 1 20 VAL O O 2.477 -1.009 -1.833 1.00 . A A . 20 VAL O 1 1 7 3472 1 1 21 CYS C C 2.113 -4.158 -1.841 1.00 . A A . 21 CYS C 1 1 7 3473 1 1 21 CYS CA C 0.957 -3.232 -2.157 1.00 . A A . 21 CYS CA 1 1 7 3474 1 1 21 CYS CB C -0.309 -4.015 -2.507 1.00 . A A . 21 CYS CB 1 1 7 3475 1 1 21 CYS H H 1.082 -2.580 -4.142 1.00 . A A . 21 CYS H 1 1 7 3476 1 1 21 CYS HA H 0.772 -2.611 -1.292 1.00 . A A . 21 CYS HA 1 1 7 3477 1 1 21 CYS HB2 H -1.017 -3.359 -2.989 1.00 . A A . 21 CYS HB2 1 1 7 3478 1 1 21 CYS HB3 H -0.042 -4.814 -3.182 1.00 . A A . 21 CYS HB3 1 1 7 3479 1 1 21 CYS N N 1.354 -2.373 -3.224 1.00 . A A . 21 CYS N 1 1 7 3480 1 1 21 CYS O O 2.771 -4.685 -2.752 1.00 . A A . 21 CYS O 1 1 7 3481 1 1 21 CYS SG S -1.138 -4.773 -1.063 1.00 . A A . 21 CYS SG 1 1 7 3482 1 1 22 ARG C C 3.225 -5.259 1.393 1.00 . A A . 22 ARG C 1 1 7 3483 1 1 22 ARG CA C 3.483 -5.057 -0.104 1.00 . A A . 22 ARG CA 1 1 7 3484 1 1 22 ARG CB C 4.760 -4.197 -0.332 1.00 . A A . 22 ARG CB 1 1 7 3485 1 1 22 ARG CD C 6.216 -5.969 -1.348 1.00 . A A . 22 ARG CD 1 1 7 3486 1 1 22 ARG CG C 6.095 -4.918 -0.260 1.00 . A A . 22 ARG CG 1 1 7 3487 1 1 22 ARG CZ C 7.914 -7.623 -2.100 1.00 . A A . 22 ARG CZ 1 1 7 3488 1 1 22 ARG H H 1.785 -3.926 0.102 1.00 . A A . 22 ARG H 1 1 7 3489 1 1 22 ARG HA H 3.563 -5.995 -0.630 1.00 . A A . 22 ARG HA 1 1 7 3490 1 1 22 ARG HB2 H 4.690 -3.746 -1.312 1.00 . A A . 22 ARG HB2 1 1 7 3491 1 1 22 ARG HB3 H 4.761 -3.406 0.403 1.00 . A A . 22 ARG HB3 1 1 7 3492 1 1 22 ARG HD2 H 5.491 -6.750 -1.173 1.00 . A A . 22 ARG HD2 1 1 7 3493 1 1 22 ARG HD3 H 6.019 -5.504 -2.302 1.00 . A A . 22 ARG HD3 1 1 7 3494 1 1 22 ARG HE H 8.217 -6.083 -0.831 1.00 . A A . 22 ARG HE 1 1 7 3495 1 1 22 ARG HG2 H 6.882 -4.191 -0.393 1.00 . A A . 22 ARG HG2 1 1 7 3496 1 1 22 ARG HG3 H 6.208 -5.388 0.705 1.00 . A A . 22 ARG HG3 1 1 7 3497 1 1 22 ARG HH11 H 6.032 -8.068 -2.764 1.00 . A A . 22 ARG HH11 1 1 7 3498 1 1 22 ARG HH12 H 7.248 -9.121 -3.322 1.00 . A A . 22 ARG HH12 1 1 7 3499 1 1 22 ARG HH21 H 9.902 -7.532 -1.602 1.00 . A A . 22 ARG HH21 1 1 7 3500 1 1 22 ARG HH22 H 9.504 -8.790 -2.660 1.00 . A A . 22 ARG HH22 1 1 7 3501 1 1 22 ARG N N 2.376 -4.312 -0.582 1.00 . A A . 22 ARG N 1 1 7 3502 1 1 22 ARG NE N 7.552 -6.561 -1.377 1.00 . A A . 22 ARG NE 1 1 7 3503 1 1 22 ARG NH1 N 7.004 -8.316 -2.777 1.00 . A A . 22 ARG NH1 1 1 7 3504 1 1 22 ARG NH2 N 9.184 -8.007 -2.119 1.00 . A A . 22 ARG NH2 1 1 7 3505 1 1 22 ARG O O 2.115 -4.905 1.890 1.00 . A A . 22 ARG O 1 1 7 3506 1 1 23 LEU C C 3.733 -4.649 4.231 1.00 . A A . 23 LEU C 1 1 7 3507 1 1 23 LEU CA C 4.169 -5.960 3.566 1.00 . A A . 23 LEU CA 1 1 7 3508 1 1 23 LEU CB C 5.544 -6.407 4.092 1.00 . A A . 23 LEU CB 1 1 7 3509 1 1 23 LEU CD1 C 4.755 -7.718 6.102 1.00 . A A . 23 LEU CD1 1 1 7 3510 1 1 23 LEU CD2 C 7.119 -6.900 5.985 1.00 . A A . 23 LEU CD2 1 1 7 3511 1 1 23 LEU CG C 5.675 -6.606 5.610 1.00 . A A . 23 LEU CG 1 1 7 3512 1 1 23 LEU H H 4.991 -6.161 1.631 1.00 . A A . 23 LEU H 1 1 7 3513 1 1 23 LEU HA H 3.439 -6.724 3.791 1.00 . A A . 23 LEU HA 1 1 7 3514 1 1 23 LEU HB2 H 5.789 -7.343 3.615 1.00 . A A . 23 LEU HB2 1 1 7 3515 1 1 23 LEU HB3 H 6.277 -5.675 3.783 1.00 . A A . 23 LEU HB3 1 1 7 3516 1 1 23 LEU HD11 H 5.012 -8.643 5.607 1.00 . A A . 23 LEU HD11 1 1 7 3517 1 1 23 LEU HD12 H 3.729 -7.464 5.885 1.00 . A A . 23 LEU HD12 1 1 7 3518 1 1 23 LEU HD13 H 4.877 -7.838 7.169 1.00 . A A . 23 LEU HD13 1 1 7 3519 1 1 23 LEU HD21 H 7.192 -7.038 7.054 1.00 . A A . 23 LEU HD21 1 1 7 3520 1 1 23 LEU HD22 H 7.744 -6.070 5.687 1.00 . A A . 23 LEU HD22 1 1 7 3521 1 1 23 LEU HD23 H 7.447 -7.797 5.482 1.00 . A A . 23 LEU HD23 1 1 7 3522 1 1 23 LEU HG H 5.376 -5.695 6.107 1.00 . A A . 23 LEU HG 1 1 7 3523 1 1 23 LEU N N 4.217 -5.803 2.112 1.00 . A A . 23 LEU N 1 1 7 3524 1 1 23 LEU O O 3.091 -4.660 5.262 1.00 . A A . 23 LEU O 1 1 7 3525 1 1 24 TRP C C 3.201 -1.501 2.732 1.00 . A A . 24 TRP C 1 1 7 3526 1 1 24 TRP CA C 3.625 -2.239 4.005 1.00 . A A . 24 TRP CA 1 1 7 3527 1 1 24 TRP CB C 4.739 -1.466 4.742 1.00 . A A . 24 TRP CB 1 1 7 3528 1 1 24 TRP CD1 C 6.046 0.168 3.307 1.00 . A A . 24 TRP CD1 1 1 7 3529 1 1 24 TRP CD2 C 7.006 -1.839 3.461 1.00 . A A . 24 TRP CD2 1 1 7 3530 1 1 24 TRP CE2 C 7.809 -1.027 2.644 1.00 . A A . 24 TRP CE2 1 1 7 3531 1 1 24 TRP CE3 C 7.407 -3.150 3.707 1.00 . A A . 24 TRP CE3 1 1 7 3532 1 1 24 TRP CG C 5.883 -1.049 3.872 1.00 . A A . 24 TRP CG 1 1 7 3533 1 1 24 TRP CH2 C 9.356 -2.774 2.329 1.00 . A A . 24 TRP CH2 1 1 7 3534 1 1 24 TRP CZ2 C 8.987 -1.486 2.071 1.00 . A A . 24 TRP CZ2 1 1 7 3535 1 1 24 TRP CZ3 C 8.577 -3.605 3.139 1.00 . A A . 24 TRP CZ3 1 1 7 3536 1 1 24 TRP H H 4.615 -3.587 2.787 1.00 . A A . 24 TRP H 1 1 7 3537 1 1 24 TRP HA H 2.779 -2.393 4.654 1.00 . A A . 24 TRP HA 1 1 7 3538 1 1 24 TRP HB2 H 4.319 -0.572 5.175 1.00 . A A . 24 TRP HB2 1 1 7 3539 1 1 24 TRP HB3 H 5.129 -2.089 5.533 1.00 . A A . 24 TRP HB3 1 1 7 3540 1 1 24 TRP HD1 H 5.325 0.960 3.459 1.00 . A A . 24 TRP HD1 1 1 7 3541 1 1 24 TRP HE1 H 7.546 0.969 2.060 1.00 . A A . 24 TRP HE1 1 1 7 3542 1 1 24 TRP HE3 H 6.814 -3.794 4.338 1.00 . A A . 24 TRP HE3 1 1 7 3543 1 1 24 TRP HH2 H 10.264 -3.172 1.903 1.00 . A A . 24 TRP HH2 1 1 7 3544 1 1 24 TRP HZ2 H 9.604 -0.859 1.444 1.00 . A A . 24 TRP HZ2 1 1 7 3545 1 1 24 TRP HZ3 H 8.905 -4.620 3.318 1.00 . A A . 24 TRP HZ3 1 1 7 3546 1 1 24 TRP N N 4.069 -3.540 3.598 1.00 . A A . 24 TRP N 1 1 7 3547 1 1 24 TRP NE1 N 7.206 0.196 2.565 1.00 . A A . 24 TRP NE1 1 1 7 3548 1 1 24 TRP O O 3.580 -1.930 1.638 1.00 . A A . 24 TRP O 1 1 7 3549 1 1 25 CYS C C 3.192 1.249 1.279 1.00 . A A . 25 CYS C 1 1 7 3550 1 1 25 CYS CA C 2.069 0.306 1.659 1.00 . A A . 25 CYS CA 1 1 7 3551 1 1 25 CYS CB C 0.747 1.061 1.820 1.00 . A A . 25 CYS CB 1 1 7 3552 1 1 25 CYS H H 2.092 -0.142 3.714 1.00 . A A . 25 CYS H 1 1 7 3553 1 1 25 CYS HA H 1.966 -0.413 0.858 1.00 . A A . 25 CYS HA 1 1 7 3554 1 1 25 CYS HB2 H 0.732 1.533 2.792 1.00 . A A . 25 CYS HB2 1 1 7 3555 1 1 25 CYS HB3 H 0.682 1.818 1.055 1.00 . A A . 25 CYS HB3 1 1 7 3556 1 1 25 CYS N N 2.423 -0.450 2.842 1.00 . A A . 25 CYS N 1 1 7 3557 1 1 25 CYS O O 3.507 2.203 2.002 1.00 . A A . 25 CYS O 1 1 7 3558 1 1 25 CYS SG S -0.746 0.018 1.701 1.00 . A A . 25 CYS SG 1 1 7 3559 1 1 26 LYS C C 4.424 2.797 -1.288 1.00 . A A . 26 LYS C 1 1 7 3560 1 1 26 LYS CA C 4.913 1.749 -0.312 1.00 . A A . 26 LYS CA 1 1 7 3561 1 1 26 LYS CB C 5.922 0.827 -1.001 1.00 . A A . 26 LYS CB 1 1 7 3562 1 1 26 LYS CD C 8.075 0.584 -2.304 1.00 . A A . 26 LYS CD 1 1 7 3563 1 1 26 LYS CE C 8.573 -0.552 -1.423 1.00 . A A . 26 LYS CE 1 1 7 3564 1 1 26 LYS CG C 7.159 1.536 -1.544 1.00 . A A . 26 LYS CG 1 1 7 3565 1 1 26 LYS H H 3.475 0.218 -0.377 1.00 . A A . 26 LYS H 1 1 7 3566 1 1 26 LYS HA H 5.387 2.214 0.537 1.00 . A A . 26 LYS HA 1 1 7 3567 1 1 26 LYS HB2 H 6.245 0.086 -0.285 1.00 . A A . 26 LYS HB2 1 1 7 3568 1 1 26 LYS HB3 H 5.428 0.327 -1.821 1.00 . A A . 26 LYS HB3 1 1 7 3569 1 1 26 LYS HD2 H 7.528 0.167 -3.135 1.00 . A A . 26 LYS HD2 1 1 7 3570 1 1 26 LYS HD3 H 8.924 1.140 -2.677 1.00 . A A . 26 LYS HD3 1 1 7 3571 1 1 26 LYS HE2 H 9.059 -0.133 -0.553 1.00 . A A . 26 LYS HE2 1 1 7 3572 1 1 26 LYS HE3 H 7.728 -1.145 -1.107 1.00 . A A . 26 LYS HE3 1 1 7 3573 1 1 26 LYS HG2 H 6.845 2.324 -2.212 1.00 . A A . 26 LYS HG2 1 1 7 3574 1 1 26 LYS HG3 H 7.705 1.966 -0.716 1.00 . A A . 26 LYS HG3 1 1 7 3575 1 1 26 LYS HZ1 H 9.864 -2.175 -1.496 1.00 . A A . 26 LYS HZ1 1 1 7 3576 1 1 26 LYS HZ2 H 10.361 -0.892 -2.452 1.00 . A A . 26 LYS HZ2 1 1 7 3577 1 1 26 LYS HZ3 H 9.095 -1.876 -2.955 1.00 . A A . 26 LYS HZ3 1 1 7 3578 1 1 26 LYS N N 3.800 0.975 0.161 1.00 . A A . 26 LYS N 1 1 7 3579 1 1 26 LYS NZ N 9.528 -1.420 -2.127 1.00 . A A . 26 LYS NZ 1 1 7 3580 1 1 26 LYS O O 3.788 2.459 -2.265 1.00 . A A . 26 LYS O 1 1 7 3581 1 1 27 LYS C C 5.109 5.021 -3.194 1.00 . A A . 27 LYS C 1 1 7 3582 1 1 27 LYS CA C 4.315 5.126 -1.925 1.00 . A A . 27 LYS CA 1 1 7 3583 1 1 27 LYS CB C 4.548 6.495 -1.312 1.00 . A A . 27 LYS CB 1 1 7 3584 1 1 27 LYS CD C 3.999 8.157 0.529 1.00 . A A . 27 LYS CD 1 1 7 3585 1 1 27 LYS CE C 3.777 9.312 -0.453 1.00 . A A . 27 LYS CE 1 1 7 3586 1 1 27 LYS CG C 3.703 6.785 -0.084 1.00 . A A . 27 LYS CG 1 1 7 3587 1 1 27 LYS H H 5.192 4.259 -0.196 1.00 . A A . 27 LYS H 1 1 7 3588 1 1 27 LYS HA H 3.268 5.015 -2.157 1.00 . A A . 27 LYS HA 1 1 7 3589 1 1 27 LYS HB2 H 5.597 6.562 -1.079 1.00 . A A . 27 LYS HB2 1 1 7 3590 1 1 27 LYS HB3 H 4.334 7.240 -2.065 1.00 . A A . 27 LYS HB3 1 1 7 3591 1 1 27 LYS HD2 H 3.352 8.303 1.381 1.00 . A A . 27 LYS HD2 1 1 7 3592 1 1 27 LYS HD3 H 5.028 8.171 0.860 1.00 . A A . 27 LYS HD3 1 1 7 3593 1 1 27 LYS HE2 H 4.004 10.239 0.054 1.00 . A A . 27 LYS HE2 1 1 7 3594 1 1 27 LYS HE3 H 4.460 9.194 -1.281 1.00 . A A . 27 LYS HE3 1 1 7 3595 1 1 27 LYS HG2 H 2.660 6.748 -0.360 1.00 . A A . 27 LYS HG2 1 1 7 3596 1 1 27 LYS HG3 H 3.905 6.022 0.653 1.00 . A A . 27 LYS HG3 1 1 7 3597 1 1 27 LYS HZ1 H 2.091 8.531 -1.477 1.00 . A A . 27 LYS HZ1 1 1 7 3598 1 1 27 LYS HZ2 H 2.347 10.162 -1.671 1.00 . A A . 27 LYS HZ2 1 1 7 3599 1 1 27 LYS HZ3 H 1.692 9.613 -0.228 1.00 . A A . 27 LYS HZ3 1 1 7 3600 1 1 27 LYS N N 4.698 4.055 -1.018 1.00 . A A . 27 LYS N 1 1 7 3601 1 1 27 LYS NZ N 2.382 9.392 -0.973 1.00 . A A . 27 LYS NZ 1 1 7 3602 1 1 27 LYS O O 6.330 4.837 -3.154 1.00 . A A . 27 LYS O 1 1 7 3603 1 1 28 LYS C C 5.130 6.394 -6.217 1.00 . A A . 28 LYS C 1 1 7 3604 1 1 28 LYS CA C 5.082 5.032 -5.565 1.00 . A A . 28 LYS CA 1 1 7 3605 1 1 28 LYS CB C 4.379 4.022 -6.475 1.00 . A A . 28 LYS CB 1 1 7 3606 1 1 28 LYS CD C 4.438 2.708 -8.618 1.00 . A A . 28 LYS CD 1 1 7 3607 1 1 28 LYS CE C 5.314 2.222 -9.769 1.00 . A A . 28 LYS CE 1 1 7 3608 1 1 28 LYS CG C 5.188 3.664 -7.712 1.00 . A A . 28 LYS CG 1 1 7 3609 1 1 28 LYS H H 3.481 5.348 -4.231 1.00 . A A . 28 LYS H 1 1 7 3610 1 1 28 LYS HA H 6.094 4.702 -5.385 1.00 . A A . 28 LYS HA 1 1 7 3611 1 1 28 LYS HB2 H 4.186 3.120 -5.915 1.00 . A A . 28 LYS HB2 1 1 7 3612 1 1 28 LYS HB3 H 3.437 4.443 -6.797 1.00 . A A . 28 LYS HB3 1 1 7 3613 1 1 28 LYS HD2 H 4.114 1.855 -8.041 1.00 . A A . 28 LYS HD2 1 1 7 3614 1 1 28 LYS HD3 H 3.575 3.217 -9.023 1.00 . A A . 28 LYS HD3 1 1 7 3615 1 1 28 LYS HE2 H 6.143 1.665 -9.360 1.00 . A A . 28 LYS HE2 1 1 7 3616 1 1 28 LYS HE3 H 4.725 1.568 -10.395 1.00 . A A . 28 LYS HE3 1 1 7 3617 1 1 28 LYS HG2 H 5.408 4.566 -8.263 1.00 . A A . 28 LYS HG2 1 1 7 3618 1 1 28 LYS HG3 H 6.113 3.201 -7.400 1.00 . A A . 28 LYS HG3 1 1 7 3619 1 1 28 LYS HZ1 H 6.475 3.967 -10.051 1.00 . A A . 28 LYS HZ1 1 1 7 3620 1 1 28 LYS HZ2 H 5.096 3.903 -11.026 1.00 . A A . 28 LYS HZ2 1 1 7 3621 1 1 28 LYS HZ3 H 6.421 2.933 -11.370 1.00 . A A . 28 LYS HZ3 1 1 7 3622 1 1 28 LYS N N 4.438 5.144 -4.292 1.00 . A A . 28 LYS N 1 1 7 3623 1 1 28 LYS NZ N 5.849 3.330 -10.597 1.00 . A A . 28 LYS NZ 1 1 7 3624 1 1 28 LYS O O 4.183 6.818 -6.901 1.00 . A A . 28 LYS O 1 1 7 3625 1 1 29 LEU C C 7.343 8.268 -7.686 1.00 . A A . 29 LEU C 1 1 7 3626 1 1 29 LEU CA C 6.414 8.413 -6.484 1.00 . A A . 29 LEU CA 1 1 7 3627 1 1 29 LEU CB C 7.058 9.304 -5.416 1.00 . A A . 29 LEU CB 1 1 7 3628 1 1 29 LEU CD1 C 5.950 11.488 -5.983 1.00 . A A . 29 LEU CD1 1 1 7 3629 1 1 29 LEU CD2 C 8.116 11.462 -4.736 1.00 . A A . 29 LEU CD2 1 1 7 3630 1 1 29 LEU CG C 7.277 10.770 -5.788 1.00 . A A . 29 LEU CG 1 1 7 3631 1 1 29 LEU H H 6.840 6.715 -5.318 1.00 . A A . 29 LEU H 1 1 7 3632 1 1 29 LEU HA H 5.471 8.839 -6.794 1.00 . A A . 29 LEU HA 1 1 7 3633 1 1 29 LEU HB2 H 6.434 9.272 -4.536 1.00 . A A . 29 LEU HB2 1 1 7 3634 1 1 29 LEU HB3 H 8.018 8.875 -5.163 1.00 . A A . 29 LEU HB3 1 1 7 3635 1 1 29 LEU HD11 H 6.136 12.520 -6.242 1.00 . A A . 29 LEU HD11 1 1 7 3636 1 1 29 LEU HD12 H 5.381 11.449 -5.067 1.00 . A A . 29 LEU HD12 1 1 7 3637 1 1 29 LEU HD13 H 5.391 11.014 -6.775 1.00 . A A . 29 LEU HD13 1 1 7 3638 1 1 29 LEU HD21 H 7.609 11.421 -3.783 1.00 . A A . 29 LEU HD21 1 1 7 3639 1 1 29 LEU HD22 H 8.264 12.492 -5.025 1.00 . A A . 29 LEU HD22 1 1 7 3640 1 1 29 LEU HD23 H 9.074 10.969 -4.658 1.00 . A A . 29 LEU HD23 1 1 7 3641 1 1 29 LEU HG H 7.810 10.813 -6.726 1.00 . A A . 29 LEU HG 1 1 7 3642 1 1 29 LEU N N 6.178 7.100 -5.933 1.00 . A A . 29 LEU N 1 1 7 3643 1 1 29 LEU O O 7.442 9.159 -8.543 1.00 . A A . 29 LEU O 1 1 7 3644 1 1 30 TRP C C 8.134 6.024 -9.820 1.00 . A A . 30 TRP C 1 1 7 3645 1 1 30 TRP CA C 8.921 6.791 -8.774 1.00 . A A . 30 TRP CA 1 1 7 3646 1 1 30 TRP CB C 10.057 5.926 -8.197 1.00 . A A . 30 TRP CB 1 1 7 3647 1 1 30 TRP CD1 C 11.139 4.499 -10.044 1.00 . A A . 30 TRP CD1 1 1 7 3648 1 1 30 TRP CD2 C 12.407 6.196 -9.331 1.00 . A A . 30 TRP CD2 1 1 7 3649 1 1 30 TRP CE2 C 13.111 5.497 -10.329 1.00 . A A . 30 TRP CE2 1 1 7 3650 1 1 30 TRP CE3 C 13.011 7.302 -8.732 1.00 . A A . 30 TRP CE3 1 1 7 3651 1 1 30 TRP CG C 11.141 5.549 -9.171 1.00 . A A . 30 TRP CG 1 1 7 3652 1 1 30 TRP CH2 C 14.951 6.954 -10.133 1.00 . A A . 30 TRP CH2 1 1 7 3653 1 1 30 TRP CZ2 C 14.386 5.869 -10.737 1.00 . A A . 30 TRP CZ2 1 1 7 3654 1 1 30 TRP CZ3 C 14.276 7.669 -9.138 1.00 . A A . 30 TRP CZ3 1 1 7 3655 1 1 30 TRP H H 7.889 6.499 -6.994 1.00 . A A . 30 TRP H 1 1 7 3656 1 1 30 TRP HA H 9.333 7.691 -9.205 1.00 . A A . 30 TRP HA 1 1 7 3657 1 1 30 TRP HB2 H 10.526 6.464 -7.388 1.00 . A A . 30 TRP HB2 1 1 7 3658 1 1 30 TRP HB3 H 9.629 5.016 -7.801 1.00 . A A . 30 TRP HB3 1 1 7 3659 1 1 30 TRP HD1 H 10.317 3.808 -10.160 1.00 . A A . 30 TRP HD1 1 1 7 3660 1 1 30 TRP HE1 H 12.548 3.811 -11.441 1.00 . A A . 30 TRP HE1 1 1 7 3661 1 1 30 TRP HE3 H 12.503 7.865 -7.963 1.00 . A A . 30 TRP HE3 1 1 7 3662 1 1 30 TRP HH2 H 15.941 7.276 -10.421 1.00 . A A . 30 TRP HH2 1 1 7 3663 1 1 30 TRP HZ2 H 14.923 5.331 -11.506 1.00 . A A . 30 TRP HZ2 1 1 7 3664 1 1 30 TRP HZ3 H 14.757 8.522 -8.683 1.00 . A A . 30 TRP HZ3 1 1 7 3665 1 1 30 TRP N N 8.016 7.143 -7.722 1.00 . A A . 30 TRP N 1 1 7 3666 1 1 30 TRP NE1 N 12.317 4.468 -10.745 1.00 . A A . 30 TRP NE1 1 1 7 3667 1 1 30 TRP O O 7.796 6.606 -10.879 1.00 . A A . 30 TRP O 1 1 7 3668 1 1 30 TRP OXT O 7.770 4.861 -9.566 1.00 . A A . 30 TRP OXT 1 1 8 3669 1 1 1 TYR C C -9.795 0.373 2.034 1.00 . A A . 1 TYR C 1 1 8 3670 1 1 1 TYR CA C -11.095 0.911 2.570 1.00 . A A . 1 TYR CA 1 1 8 3671 1 1 1 TYR CB C -10.903 2.351 3.074 1.00 . A A . 1 TYR CB 1 1 8 3672 1 1 1 TYR CD1 C -12.421 3.181 4.908 1.00 . A A . 1 TYR CD1 1 1 8 3673 1 1 1 TYR CD2 C -13.133 3.430 2.652 1.00 . A A . 1 TYR CD2 1 1 8 3674 1 1 1 TYR CE1 C -13.591 3.761 5.343 1.00 . A A . 1 TYR CE1 1 1 8 3675 1 1 1 TYR CE2 C -14.300 4.012 3.081 1.00 . A A . 1 TYR CE2 1 1 8 3676 1 1 1 TYR CG C -12.173 3.004 3.555 1.00 . A A . 1 TYR CG 1 1 8 3677 1 1 1 TYR CZ C -14.523 4.175 4.423 1.00 . A A . 1 TYR CZ 1 1 8 3678 1 1 1 TYR H1 H -11.673 -0.921 3.299 1.00 . A A . 1 TYR H1 1 1 8 3679 1 1 1 TYR H2 H -12.450 0.362 4.058 1.00 . A A . 1 TYR H2 1 1 8 3680 1 1 1 TYR H3 H -10.821 0.012 4.391 1.00 . A A . 1 TYR H3 1 1 8 3681 1 1 1 TYR HA H -11.841 0.897 1.790 1.00 . A A . 1 TYR HA 1 1 8 3682 1 1 1 TYR HB2 H -10.201 2.347 3.894 1.00 . A A . 1 TYR HB2 1 1 8 3683 1 1 1 TYR HB3 H -10.499 2.949 2.271 1.00 . A A . 1 TYR HB3 1 1 8 3684 1 1 1 TYR HD1 H -11.685 2.858 5.631 1.00 . A A . 1 TYR HD1 1 1 8 3685 1 1 1 TYR HD2 H -12.960 3.302 1.594 1.00 . A A . 1 TYR HD2 1 1 8 3686 1 1 1 TYR HE1 H -13.765 3.890 6.400 1.00 . A A . 1 TYR HE1 1 1 8 3687 1 1 1 TYR HE2 H -15.031 4.337 2.356 1.00 . A A . 1 TYR HE2 1 1 8 3688 1 1 1 TYR HH H -15.504 5.515 5.380 1.00 . A A . 1 TYR HH 1 1 8 3689 1 1 1 TYR N N -11.548 0.050 3.651 1.00 . A A . 1 TYR N 1 1 8 3690 1 1 1 TYR O O -9.402 -0.751 2.371 1.00 . A A . 1 TYR O 1 1 8 3691 1 1 1 TYR OH O -15.694 4.733 4.846 1.00 . A A . 1 TYR OH 1 1 8 3692 1 1 2 CYS C C -6.815 1.100 1.730 1.00 . A A . 2 CYS C 1 1 8 3693 1 1 2 CYS CA C -7.858 0.719 0.704 1.00 . A A . 2 CYS CA 1 1 8 3694 1 1 2 CYS CB C -7.547 1.324 -0.673 1.00 . A A . 2 CYS CB 1 1 8 3695 1 1 2 CYS H H -9.506 1.981 0.879 1.00 . A A . 2 CYS H 1 1 8 3696 1 1 2 CYS HA H -7.874 -0.359 0.626 1.00 . A A . 2 CYS HA 1 1 8 3697 1 1 2 CYS HB2 H -6.560 1.002 -0.971 1.00 . A A . 2 CYS HB2 1 1 8 3698 1 1 2 CYS HB3 H -8.264 0.952 -1.389 1.00 . A A . 2 CYS HB3 1 1 8 3699 1 1 2 CYS N N -9.138 1.126 1.184 1.00 . A A . 2 CYS N 1 1 8 3700 1 1 2 CYS O O -7.031 2.026 2.540 1.00 . A A . 2 CYS O 1 1 8 3701 1 1 2 CYS SG S -7.566 3.153 -0.751 1.00 . A A . 2 CYS SG 1 1 8 3702 1 1 3 GLN C C -3.836 1.796 2.256 1.00 . A A . 3 GLN C 1 1 8 3703 1 1 3 GLN CA C -4.692 0.650 2.683 1.00 . A A . 3 GLN CA 1 1 8 3704 1 1 3 GLN CB C -3.851 -0.593 2.903 1.00 . A A . 3 GLN CB 1 1 8 3705 1 1 3 GLN CD C -5.296 -1.531 4.729 1.00 . A A . 3 GLN CD 1 1 8 3706 1 1 3 GLN CG C -4.643 -1.783 3.387 1.00 . A A . 3 GLN CG 1 1 8 3707 1 1 3 GLN H H -5.613 -0.296 1.049 1.00 . A A . 3 GLN H 1 1 8 3708 1 1 3 GLN HA H -5.189 0.898 3.607 1.00 . A A . 3 GLN HA 1 1 8 3709 1 1 3 GLN HB2 H -3.338 -0.863 1.993 1.00 . A A . 3 GLN HB2 1 1 8 3710 1 1 3 GLN HB3 H -3.109 -0.365 3.654 1.00 . A A . 3 GLN HB3 1 1 8 3711 1 1 3 GLN HE21 H -3.646 -2.084 5.626 1.00 . A A . 3 GLN HE21 1 1 8 3712 1 1 3 GLN HE22 H -4.958 -1.613 6.660 1.00 . A A . 3 GLN HE22 1 1 8 3713 1 1 3 GLN HG2 H -5.415 -1.990 2.660 1.00 . A A . 3 GLN HG2 1 1 8 3714 1 1 3 GLN HG3 H -3.982 -2.635 3.458 1.00 . A A . 3 GLN HG3 1 1 8 3715 1 1 3 GLN N N -5.719 0.413 1.721 1.00 . A A . 3 GLN N 1 1 8 3716 1 1 3 GLN NE2 N -4.566 -1.765 5.772 1.00 . A A . 3 GLN NE2 1 1 8 3717 1 1 3 GLN O O -3.415 1.875 1.104 1.00 . A A . 3 GLN O 1 1 8 3718 1 1 3 GLN OE1 O -6.446 -1.088 4.815 1.00 . A A . 3 GLN OE1 1 1 8 3719 1 1 4 LYS C C -1.393 3.597 3.175 1.00 . A A . 4 LYS C 1 1 8 3720 1 1 4 LYS CA C -2.861 3.874 2.935 1.00 . A A . 4 LYS CA 1 1 8 3721 1 1 4 LYS CB C -3.359 4.974 3.854 1.00 . A A . 4 LYS CB 1 1 8 3722 1 1 4 LYS CD C -5.311 6.303 4.692 1.00 . A A . 4 LYS CD 1 1 8 3723 1 1 4 LYS CE C -6.778 6.618 4.500 1.00 . A A . 4 LYS CE 1 1 8 3724 1 1 4 LYS CG C -4.837 5.276 3.690 1.00 . A A . 4 LYS CG 1 1 8 3725 1 1 4 LYS H H -3.974 2.532 4.072 1.00 . A A . 4 LYS H 1 1 8 3726 1 1 4 LYS HA H -3.011 4.179 1.910 1.00 . A A . 4 LYS HA 1 1 8 3727 1 1 4 LYS HB2 H -3.183 4.680 4.879 1.00 . A A . 4 LYS HB2 1 1 8 3728 1 1 4 LYS HB3 H -2.805 5.877 3.642 1.00 . A A . 4 LYS HB3 1 1 8 3729 1 1 4 LYS HD2 H -5.164 5.916 5.690 1.00 . A A . 4 LYS HD2 1 1 8 3730 1 1 4 LYS HD3 H -4.736 7.209 4.568 1.00 . A A . 4 LYS HD3 1 1 8 3731 1 1 4 LYS HE2 H -6.931 6.981 3.495 1.00 . A A . 4 LYS HE2 1 1 8 3732 1 1 4 LYS HE3 H -7.352 5.714 4.646 1.00 . A A . 4 LYS HE3 1 1 8 3733 1 1 4 LYS HG2 H -5.007 5.655 2.692 1.00 . A A . 4 LYS HG2 1 1 8 3734 1 1 4 LYS HG3 H -5.397 4.362 3.827 1.00 . A A . 4 LYS HG3 1 1 8 3735 1 1 4 LYS HZ1 H -7.210 7.293 6.423 1.00 . A A . 4 LYS HZ1 1 1 8 3736 1 1 4 LYS HZ2 H -8.221 7.931 5.238 1.00 . A A . 4 LYS HZ2 1 1 8 3737 1 1 4 LYS HZ3 H -6.639 8.486 5.396 1.00 . A A . 4 LYS HZ3 1 1 8 3738 1 1 4 LYS N N -3.618 2.687 3.174 1.00 . A A . 4 LYS N 1 1 8 3739 1 1 4 LYS NZ N -7.245 7.640 5.444 1.00 . A A . 4 LYS NZ 1 1 8 3740 1 1 4 LYS O O -1.048 2.589 3.784 1.00 . A A . 4 LYS O 1 1 8 3741 1 1 5 TRP C C 1.443 4.125 4.217 1.00 . A A . 5 TRP C 1 1 8 3742 1 1 5 TRP CA C 0.910 4.375 2.799 1.00 . A A . 5 TRP CA 1 1 8 3743 1 1 5 TRP CB C 1.602 5.603 2.170 1.00 . A A . 5 TRP CB 1 1 8 3744 1 1 5 TRP CD1 C 0.320 7.510 3.322 1.00 . A A . 5 TRP CD1 1 1 8 3745 1 1 5 TRP CD2 C 2.532 7.672 3.478 1.00 . A A . 5 TRP CD2 1 1 8 3746 1 1 5 TRP CE2 C 1.953 8.764 4.149 1.00 . A A . 5 TRP CE2 1 1 8 3747 1 1 5 TRP CE3 C 3.916 7.565 3.444 1.00 . A A . 5 TRP CE3 1 1 8 3748 1 1 5 TRP CG C 1.468 6.875 2.966 1.00 . A A . 5 TRP CG 1 1 8 3749 1 1 5 TRP CH2 C 4.063 9.606 4.717 1.00 . A A . 5 TRP CH2 1 1 8 3750 1 1 5 TRP CZ2 C 2.712 9.737 4.773 1.00 . A A . 5 TRP CZ2 1 1 8 3751 1 1 5 TRP CZ3 C 4.667 8.534 4.062 1.00 . A A . 5 TRP CZ3 1 1 8 3752 1 1 5 TRP H H -0.924 5.323 2.340 1.00 . A A . 5 TRP H 1 1 8 3753 1 1 5 TRP HA H 1.162 3.512 2.201 1.00 . A A . 5 TRP HA 1 1 8 3754 1 1 5 TRP HB2 H 2.657 5.395 2.063 1.00 . A A . 5 TRP HB2 1 1 8 3755 1 1 5 TRP HB3 H 1.180 5.775 1.190 1.00 . A A . 5 TRP HB3 1 1 8 3756 1 1 5 TRP HD1 H -0.668 7.151 3.082 1.00 . A A . 5 TRP HD1 1 1 8 3757 1 1 5 TRP HE1 H -0.057 9.260 4.419 1.00 . A A . 5 TRP HE1 1 1 8 3758 1 1 5 TRP HE3 H 4.396 6.741 2.938 1.00 . A A . 5 TRP HE3 1 1 8 3759 1 1 5 TRP HH2 H 4.693 10.345 5.187 1.00 . A A . 5 TRP HH2 1 1 8 3760 1 1 5 TRP HZ2 H 2.268 10.576 5.288 1.00 . A A . 5 TRP HZ2 1 1 8 3761 1 1 5 TRP HZ3 H 5.745 8.475 4.042 1.00 . A A . 5 TRP HZ3 1 1 8 3762 1 1 5 TRP N N -0.550 4.514 2.744 1.00 . A A . 5 TRP N 1 1 8 3763 1 1 5 TRP NE1 N 0.604 8.638 4.043 1.00 . A A . 5 TRP NE1 1 1 8 3764 1 1 5 TRP O O 2.449 3.441 4.389 1.00 . A A . 5 TRP O 1 1 8 3765 1 1 6 MET C C 0.886 3.058 7.068 1.00 . A A . 6 MET C 1 1 8 3766 1 1 6 MET CA C 1.242 4.456 6.595 1.00 . A A . 6 MET CA 1 1 8 3767 1 1 6 MET CB C 0.679 5.495 7.567 1.00 . A A . 6 MET CB 1 1 8 3768 1 1 6 MET CE C -1.149 6.092 10.193 1.00 . A A . 6 MET CE 1 1 8 3769 1 1 6 MET CG C 1.220 5.323 8.982 1.00 . A A . 6 MET CG 1 1 8 3770 1 1 6 MET H H -0.024 5.204 5.066 1.00 . A A . 6 MET H 1 1 8 3771 1 1 6 MET HA H 2.315 4.553 6.556 1.00 . A A . 6 MET HA 1 1 8 3772 1 1 6 MET HB2 H 0.931 6.484 7.217 1.00 . A A . 6 MET HB2 1 1 8 3773 1 1 6 MET HB3 H -0.395 5.390 7.601 1.00 . A A . 6 MET HB3 1 1 8 3774 1 1 6 MET HE1 H -1.569 6.229 9.207 1.00 . A A . 6 MET HE1 1 1 8 3775 1 1 6 MET HE2 H -1.667 6.727 10.896 1.00 . A A . 6 MET HE2 1 1 8 3776 1 1 6 MET HE3 H -1.259 5.060 10.492 1.00 . A A . 6 MET HE3 1 1 8 3777 1 1 6 MET HG2 H 0.952 4.334 9.322 1.00 . A A . 6 MET HG2 1 1 8 3778 1 1 6 MET HG3 H 2.293 5.392 8.924 1.00 . A A . 6 MET HG3 1 1 8 3779 1 1 6 MET N N 0.776 4.662 5.233 1.00 . A A . 6 MET N 1 1 8 3780 1 1 6 MET O O 1.562 2.473 7.914 1.00 . A A . 6 MET O 1 1 8 3781 1 1 6 MET SD S 0.589 6.523 10.174 1.00 . A A . 6 MET SD 1 1 8 3782 1 1 7 TRP C C 0.083 0.144 6.066 1.00 . A A . 7 TRP C 1 1 8 3783 1 1 7 TRP CA C -0.642 1.224 6.862 1.00 . A A . 7 TRP CA 1 1 8 3784 1 1 7 TRP CB C -2.166 1.135 6.624 1.00 . A A . 7 TRP CB 1 1 8 3785 1 1 7 TRP CD1 C -2.617 2.906 8.455 1.00 . A A . 7 TRP CD1 1 1 8 3786 1 1 7 TRP CD2 C -4.349 2.517 7.095 1.00 . A A . 7 TRP CD2 1 1 8 3787 1 1 7 TRP CE2 C -4.725 3.506 8.021 1.00 . A A . 7 TRP CE2 1 1 8 3788 1 1 7 TRP CE3 C -5.277 2.106 6.146 1.00 . A A . 7 TRP CE3 1 1 8 3789 1 1 7 TRP CG C -2.991 2.158 7.372 1.00 . A A . 7 TRP CG 1 1 8 3790 1 1 7 TRP CH2 C -6.877 3.658 7.074 1.00 . A A . 7 TRP CH2 1 1 8 3791 1 1 7 TRP CZ2 C -5.988 4.085 8.021 1.00 . A A . 7 TRP CZ2 1 1 8 3792 1 1 7 TRP CZ3 C -6.532 2.676 6.144 1.00 . A A . 7 TRP CZ3 1 1 8 3793 1 1 7 TRP H H -0.544 2.999 5.737 1.00 . A A . 7 TRP H 1 1 8 3794 1 1 7 TRP HA H -0.440 1.079 7.912 1.00 . A A . 7 TRP HA 1 1 8 3795 1 1 7 TRP HB2 H -2.355 1.281 5.571 1.00 . A A . 7 TRP HB2 1 1 8 3796 1 1 7 TRP HB3 H -2.515 0.151 6.900 1.00 . A A . 7 TRP HB3 1 1 8 3797 1 1 7 TRP HD1 H -1.643 2.858 8.921 1.00 . A A . 7 TRP HD1 1 1 8 3798 1 1 7 TRP HE1 H -3.630 4.376 9.582 1.00 . A A . 7 TRP HE1 1 1 8 3799 1 1 7 TRP HE3 H -5.021 1.341 5.430 1.00 . A A . 7 TRP HE3 1 1 8 3800 1 1 7 TRP HH2 H -7.872 4.078 7.038 1.00 . A A . 7 TRP HH2 1 1 8 3801 1 1 7 TRP HZ2 H -6.271 4.846 8.733 1.00 . A A . 7 TRP HZ2 1 1 8 3802 1 1 7 TRP HZ3 H -7.263 2.364 5.411 1.00 . A A . 7 TRP HZ3 1 1 8 3803 1 1 7 TRP N N -0.137 2.522 6.491 1.00 . A A . 7 TRP N 1 1 8 3804 1 1 7 TRP NE1 N -3.652 3.729 8.839 1.00 . A A . 7 TRP NE1 1 1 8 3805 1 1 7 TRP O O 1.009 0.429 5.283 1.00 . A A . 7 TRP O 1 1 8 3806 1 1 8 THR C C -0.775 -2.860 4.742 1.00 . A A . 8 THR C 1 1 8 3807 1 1 8 THR CA C 0.298 -2.174 5.587 1.00 . A A . 8 THR CA 1 1 8 3808 1 1 8 THR CB C 0.868 -3.168 6.631 1.00 . A A . 8 THR CB 1 1 8 3809 1 1 8 THR CG2 C 1.953 -2.507 7.479 1.00 . A A . 8 THR CG2 1 1 8 3810 1 1 8 THR H H -1.022 -1.274 6.905 1.00 . A A . 8 THR H 1 1 8 3811 1 1 8 THR HA H 1.100 -1.789 4.975 1.00 . A A . 8 THR HA 1 1 8 3812 1 1 8 THR HB H 1.289 -4.016 6.113 1.00 . A A . 8 THR HB 1 1 8 3813 1 1 8 THR HG1 H 0.115 -3.515 8.412 1.00 . A A . 8 THR HG1 1 1 8 3814 1 1 8 THR HG21 H 2.747 -2.151 6.837 1.00 . A A . 8 THR HG21 1 1 8 3815 1 1 8 THR HG22 H 2.351 -3.225 8.181 1.00 . A A . 8 THR HG22 1 1 8 3816 1 1 8 THR HG23 H 1.527 -1.673 8.016 1.00 . A A . 8 THR HG23 1 1 8 3817 1 1 8 THR N N -0.302 -1.071 6.268 1.00 . A A . 8 THR N 1 1 8 3818 1 1 8 THR O O -1.975 -2.654 5.000 1.00 . A A . 8 THR O 1 1 8 3819 1 1 8 THR OG1 O -0.187 -3.608 7.496 1.00 . A A . 8 THR OG1 1 1 8 3820 1 1 9 CYS C C -1.163 -5.821 3.039 1.00 . A A . 9 CYS C 1 1 8 3821 1 1 9 CYS CA C -1.441 -4.345 3.021 1.00 . A A . 9 CYS CA 1 1 8 3822 1 1 9 CYS CB C -1.686 -3.793 1.613 1.00 . A A . 9 CYS CB 1 1 8 3823 1 1 9 CYS H H 0.523 -3.788 3.443 1.00 . A A . 9 CYS H 1 1 8 3824 1 1 9 CYS HA H -2.336 -4.203 3.613 1.00 . A A . 9 CYS HA 1 1 8 3825 1 1 9 CYS HB2 H -2.464 -4.373 1.140 1.00 . A A . 9 CYS HB2 1 1 8 3826 1 1 9 CYS HB3 H -2.020 -2.769 1.698 1.00 . A A . 9 CYS HB3 1 1 8 3827 1 1 9 CYS N N -0.410 -3.639 3.731 1.00 . A A . 9 CYS N 1 1 8 3828 1 1 9 CYS O O -0.094 -6.249 3.501 1.00 . A A . 9 CYS O 1 1 8 3829 1 1 9 CYS SG S -0.259 -3.819 0.509 1.00 . A A . 9 CYS SG 1 1 8 3830 1 1 10 ASP C C -2.847 -8.587 1.490 1.00 . A A . 10 ASP C 1 1 8 3831 1 1 10 ASP CA C -1.997 -8.042 2.630 1.00 . A A . 10 ASP CA 1 1 8 3832 1 1 10 ASP CB C -2.522 -8.527 4.016 1.00 . A A . 10 ASP CB 1 1 8 3833 1 1 10 ASP CG C -2.221 -9.987 4.312 1.00 . A A . 10 ASP CG 1 1 8 3834 1 1 10 ASP H H -2.882 -6.223 2.107 1.00 . A A . 10 ASP H 1 1 8 3835 1 1 10 ASP HA H -0.966 -8.334 2.499 1.00 . A A . 10 ASP HA 1 1 8 3836 1 1 10 ASP HB2 H -2.066 -7.928 4.789 1.00 . A A . 10 ASP HB2 1 1 8 3837 1 1 10 ASP HB3 H -3.592 -8.382 4.047 1.00 . A A . 10 ASP HB3 1 1 8 3838 1 1 10 ASP N N -2.098 -6.601 2.570 1.00 . A A . 10 ASP N 1 1 8 3839 1 1 10 ASP O O -3.216 -7.829 0.600 1.00 . A A . 10 ASP O 1 1 8 3840 1 1 10 ASP OD1 O -1.174 -10.288 4.908 1.00 . A A . 10 ASP OD1 1 1 8 3841 1 1 10 ASP OD2 O -3.025 -10.856 3.932 1.00 . A A . 10 ASP OD2 1 1 8 3842 1 1 11 SER C C -5.428 -10.002 0.669 1.00 . A A . 11 SER C 1 1 8 3843 1 1 11 SER CA C -3.973 -10.441 0.493 1.00 . A A . 11 SER CA 1 1 8 3844 1 1 11 SER CB C -3.834 -11.969 0.571 1.00 . A A . 11 SER CB 1 1 8 3845 1 1 11 SER H H -2.897 -10.400 2.278 1.00 . A A . 11 SER H 1 1 8 3846 1 1 11 SER HA H -3.613 -10.100 -0.465 1.00 . A A . 11 SER HA 1 1 8 3847 1 1 11 SER HB2 H -2.790 -12.232 0.490 1.00 . A A . 11 SER HB2 1 1 8 3848 1 1 11 SER HB3 H -4.218 -12.313 1.520 1.00 . A A . 11 SER HB3 1 1 8 3849 1 1 11 SER HG H -5.278 -13.080 -0.069 1.00 . A A . 11 SER HG 1 1 8 3850 1 1 11 SER N N -3.178 -9.841 1.515 1.00 . A A . 11 SER N 1 1 8 3851 1 1 11 SER O O -6.159 -9.817 -0.306 1.00 . A A . 11 SER O 1 1 8 3852 1 1 11 SER OG O -4.532 -12.617 -0.470 1.00 . A A . 11 SER OG 1 1 8 3853 1 1 12 GLU C C -7.283 -7.851 2.201 1.00 . A A . 12 GLU C 1 1 8 3854 1 1 12 GLU CA C -7.192 -9.371 2.221 1.00 . A A . 12 GLU CA 1 1 8 3855 1 1 12 GLU CB C -7.597 -9.840 3.600 1.00 . A A . 12 GLU CB 1 1 8 3856 1 1 12 GLU CD C -7.837 -11.677 5.240 1.00 . A A . 12 GLU CD 1 1 8 3857 1 1 12 GLU CG C -7.391 -11.310 3.860 1.00 . A A . 12 GLU CG 1 1 8 3858 1 1 12 GLU H H -5.197 -9.973 2.646 1.00 . A A . 12 GLU H 1 1 8 3859 1 1 12 GLU HA H -7.867 -9.792 1.492 1.00 . A A . 12 GLU HA 1 1 8 3860 1 1 12 GLU HB2 H -7.021 -9.290 4.329 1.00 . A A . 12 GLU HB2 1 1 8 3861 1 1 12 GLU HB3 H -8.642 -9.613 3.747 1.00 . A A . 12 GLU HB3 1 1 8 3862 1 1 12 GLU HG2 H -7.963 -11.879 3.143 1.00 . A A . 12 GLU HG2 1 1 8 3863 1 1 12 GLU HG3 H -6.342 -11.545 3.759 1.00 . A A . 12 GLU HG3 1 1 8 3864 1 1 12 GLU N N -5.830 -9.801 1.917 1.00 . A A . 12 GLU N 1 1 8 3865 1 1 12 GLU O O -8.321 -7.275 1.883 1.00 . A A . 12 GLU O 1 1 8 3866 1 1 12 GLU OE1 O -7.288 -11.126 6.216 1.00 . A A . 12 GLU OE1 1 1 8 3867 1 1 12 GLU OE2 O -8.749 -12.507 5.378 1.00 . A A . 12 GLU OE2 1 1 8 3868 1 1 13 ARG C C -5.532 -5.206 1.407 1.00 . A A . 13 ARG C 1 1 8 3869 1 1 13 ARG CA C -6.180 -5.773 2.650 1.00 . A A . 13 ARG CA 1 1 8 3870 1 1 13 ARG CB C -5.447 -5.315 3.919 1.00 . A A . 13 ARG CB 1 1 8 3871 1 1 13 ARG CD C -5.396 -5.272 6.455 1.00 . A A . 13 ARG CD 1 1 8 3872 1 1 13 ARG CG C -6.136 -5.749 5.206 1.00 . A A . 13 ARG CG 1 1 8 3873 1 1 13 ARG CZ C -2.972 -5.276 7.072 1.00 . A A . 13 ARG CZ 1 1 8 3874 1 1 13 ARG H H -5.396 -7.723 2.773 1.00 . A A . 13 ARG H 1 1 8 3875 1 1 13 ARG HA H -7.205 -5.438 2.699 1.00 . A A . 13 ARG HA 1 1 8 3876 1 1 13 ARG HB2 H -4.447 -5.723 3.912 1.00 . A A . 13 ARG HB2 1 1 8 3877 1 1 13 ARG HB3 H -5.389 -4.237 3.916 1.00 . A A . 13 ARG HB3 1 1 8 3878 1 1 13 ARG HD2 H -5.251 -4.207 6.367 1.00 . A A . 13 ARG HD2 1 1 8 3879 1 1 13 ARG HD3 H -6.004 -5.476 7.324 1.00 . A A . 13 ARG HD3 1 1 8 3880 1 1 13 ARG HE H -4.042 -6.871 6.416 1.00 . A A . 13 ARG HE 1 1 8 3881 1 1 13 ARG HG2 H -7.140 -5.353 5.219 1.00 . A A . 13 ARG HG2 1 1 8 3882 1 1 13 ARG HG3 H -6.183 -6.828 5.211 1.00 . A A . 13 ARG HG3 1 1 8 3883 1 1 13 ARG HH11 H -3.896 -3.486 7.459 1.00 . A A . 13 ARG HH11 1 1 8 3884 1 1 13 ARG HH12 H -2.226 -3.517 7.778 1.00 . A A . 13 ARG HH12 1 1 8 3885 1 1 13 ARG HH21 H -1.692 -6.893 6.967 1.00 . A A . 13 ARG HH21 1 1 8 3886 1 1 13 ARG HH22 H -0.999 -5.427 7.494 1.00 . A A . 13 ARG HH22 1 1 8 3887 1 1 13 ARG N N -6.205 -7.212 2.577 1.00 . A A . 13 ARG N 1 1 8 3888 1 1 13 ARG NE N -4.076 -5.911 6.628 1.00 . A A . 13 ARG NE 1 1 8 3889 1 1 13 ARG NH1 N -3.044 -4.014 7.462 1.00 . A A . 13 ARG NH1 1 1 8 3890 1 1 13 ARG NH2 N -1.820 -5.922 7.186 1.00 . A A . 13 ARG NH2 1 1 8 3891 1 1 13 ARG O O -4.331 -5.355 1.212 1.00 . A A . 13 ARG O 1 1 8 3892 1 1 14 LYS C C -5.367 -2.567 -0.479 1.00 . A A . 14 LYS C 1 1 8 3893 1 1 14 LYS CA C -5.827 -4.006 -0.661 1.00 . A A . 14 LYS CA 1 1 8 3894 1 1 14 LYS CB C -6.890 -4.154 -1.778 1.00 . A A . 14 LYS CB 1 1 8 3895 1 1 14 LYS CD C -9.283 -3.900 -2.534 1.00 . A A . 14 LYS CD 1 1 8 3896 1 1 14 LYS CE C -10.640 -3.286 -2.222 1.00 . A A . 14 LYS CE 1 1 8 3897 1 1 14 LYS CG C -8.252 -3.537 -1.468 1.00 . A A . 14 LYS CG 1 1 8 3898 1 1 14 LYS H H -7.244 -4.400 0.854 1.00 . A A . 14 LYS H 1 1 8 3899 1 1 14 LYS HA H -4.959 -4.592 -0.927 1.00 . A A . 14 LYS HA 1 1 8 3900 1 1 14 LYS HB2 H -6.511 -3.685 -2.673 1.00 . A A . 14 LYS HB2 1 1 8 3901 1 1 14 LYS HB3 H -7.029 -5.206 -1.977 1.00 . A A . 14 LYS HB3 1 1 8 3902 1 1 14 LYS HD2 H -8.942 -3.531 -3.489 1.00 . A A . 14 LYS HD2 1 1 8 3903 1 1 14 LYS HD3 H -9.383 -4.974 -2.578 1.00 . A A . 14 LYS HD3 1 1 8 3904 1 1 14 LYS HE2 H -10.926 -3.598 -1.230 1.00 . A A . 14 LYS HE2 1 1 8 3905 1 1 14 LYS HE3 H -10.553 -2.209 -2.251 1.00 . A A . 14 LYS HE3 1 1 8 3906 1 1 14 LYS HG2 H -8.590 -3.905 -0.511 1.00 . A A . 14 LYS HG2 1 1 8 3907 1 1 14 LYS HG3 H -8.149 -2.463 -1.425 1.00 . A A . 14 LYS HG3 1 1 8 3908 1 1 14 LYS HZ1 H -11.855 -4.745 -3.092 1.00 . A A . 14 LYS HZ1 1 1 8 3909 1 1 14 LYS HZ2 H -11.466 -3.498 -4.149 1.00 . A A . 14 LYS HZ2 1 1 8 3910 1 1 14 LYS HZ3 H -12.600 -3.247 -2.927 1.00 . A A . 14 LYS HZ3 1 1 8 3911 1 1 14 LYS N N -6.311 -4.551 0.592 1.00 . A A . 14 LYS N 1 1 8 3912 1 1 14 LYS NZ N -11.701 -3.718 -3.160 1.00 . A A . 14 LYS NZ 1 1 8 3913 1 1 14 LYS O O -6.060 -1.758 0.123 1.00 . A A . 14 LYS O 1 1 8 3914 1 1 15 CYS C C -4.140 -0.006 -1.854 1.00 . A A . 15 CYS C 1 1 8 3915 1 1 15 CYS CA C -3.585 -0.967 -0.809 1.00 . A A . 15 CYS CA 1 1 8 3916 1 1 15 CYS CB C -2.067 -1.098 -0.931 1.00 . A A . 15 CYS CB 1 1 8 3917 1 1 15 CYS H H -3.721 -2.963 -1.478 1.00 . A A . 15 CYS H 1 1 8 3918 1 1 15 CYS HA H -3.835 -0.584 0.167 1.00 . A A . 15 CYS HA 1 1 8 3919 1 1 15 CYS HB2 H -1.741 -1.976 -0.393 1.00 . A A . 15 CYS HB2 1 1 8 3920 1 1 15 CYS HB3 H -1.824 -1.223 -1.976 1.00 . A A . 15 CYS HB3 1 1 8 3921 1 1 15 CYS N N -4.195 -2.274 -0.969 1.00 . A A . 15 CYS N 1 1 8 3922 1 1 15 CYS O O -4.596 -0.440 -2.928 1.00 . A A . 15 CYS O 1 1 8 3923 1 1 15 CYS SG S -1.096 0.306 -0.307 1.00 . A A . 15 CYS SG 1 1 8 3924 1 1 16 CYS C C -3.912 2.384 -3.723 1.00 . A A . 16 CYS C 1 1 8 3925 1 1 16 CYS CA C -4.672 2.295 -2.406 1.00 . A A . 16 CYS CA 1 1 8 3926 1 1 16 CYS CB C -4.690 3.657 -1.703 1.00 . A A . 16 CYS CB 1 1 8 3927 1 1 16 CYS H H -3.749 1.555 -0.674 1.00 . A A . 16 CYS H 1 1 8 3928 1 1 16 CYS HA H -5.691 2.019 -2.628 1.00 . A A . 16 CYS HA 1 1 8 3929 1 1 16 CYS HB2 H -3.679 3.927 -1.434 1.00 . A A . 16 CYS HB2 1 1 8 3930 1 1 16 CYS HB3 H -5.079 4.399 -2.386 1.00 . A A . 16 CYS HB3 1 1 8 3931 1 1 16 CYS N N -4.136 1.270 -1.535 1.00 . A A . 16 CYS N 1 1 8 3932 1 1 16 CYS O O -2.698 2.129 -3.794 1.00 . A A . 16 CYS O 1 1 8 3933 1 1 16 CYS SG S -5.698 3.721 -0.176 1.00 . A A . 16 CYS SG 1 1 8 3934 1 1 17 LYS C C -3.291 4.152 -6.100 1.00 . A A . 17 LYS C 1 1 8 3935 1 1 17 LYS CA C -4.071 2.859 -6.070 1.00 . A A . 17 LYS CA 1 1 8 3936 1 1 17 LYS CB C -5.164 2.818 -7.129 1.00 . A A . 17 LYS CB 1 1 8 3937 1 1 17 LYS CD C -7.008 1.445 -8.160 1.00 . A A . 17 LYS CD 1 1 8 3938 1 1 17 LYS CE C -7.785 0.138 -8.063 1.00 . A A . 17 LYS CE 1 1 8 3939 1 1 17 LYS CG C -5.936 1.513 -7.096 1.00 . A A . 17 LYS CG 1 1 8 3940 1 1 17 LYS H H -5.605 2.796 -4.645 1.00 . A A . 17 LYS H 1 1 8 3941 1 1 17 LYS HA H -3.382 2.044 -6.237 1.00 . A A . 17 LYS HA 1 1 8 3942 1 1 17 LYS HB2 H -5.850 3.634 -6.962 1.00 . A A . 17 LYS HB2 1 1 8 3943 1 1 17 LYS HB3 H -4.715 2.921 -8.106 1.00 . A A . 17 LYS HB3 1 1 8 3944 1 1 17 LYS HD2 H -7.690 2.272 -8.027 1.00 . A A . 17 LYS HD2 1 1 8 3945 1 1 17 LYS HD3 H -6.544 1.507 -9.132 1.00 . A A . 17 LYS HD3 1 1 8 3946 1 1 17 LYS HE2 H -8.297 0.106 -7.112 1.00 . A A . 17 LYS HE2 1 1 8 3947 1 1 17 LYS HE3 H -8.511 0.106 -8.861 1.00 . A A . 17 LYS HE3 1 1 8 3948 1 1 17 LYS HG2 H -5.238 0.703 -7.257 1.00 . A A . 17 LYS HG2 1 1 8 3949 1 1 17 LYS HG3 H -6.389 1.404 -6.122 1.00 . A A . 17 LYS HG3 1 1 8 3950 1 1 17 LYS HZ1 H -6.312 -1.004 -9.024 1.00 . A A . 17 LYS HZ1 1 1 8 3951 1 1 17 LYS HZ2 H -7.446 -1.922 -8.246 1.00 . A A . 17 LYS HZ2 1 1 8 3952 1 1 17 LYS HZ3 H -6.267 -1.141 -7.345 1.00 . A A . 17 LYS HZ3 1 1 8 3953 1 1 17 LYS N N -4.637 2.685 -4.764 1.00 . A A . 17 LYS N 1 1 8 3954 1 1 17 LYS NZ N -6.896 -1.042 -8.166 1.00 . A A . 17 LYS NZ 1 1 8 3955 1 1 17 LYS O O -3.787 5.202 -5.666 1.00 . A A . 17 LYS O 1 1 8 3956 1 1 18 GLY C C -0.104 4.904 -5.484 1.00 . A A . 18 GLY C 1 1 8 3957 1 1 18 GLY CA C -1.165 5.175 -6.526 1.00 . A A . 18 GLY CA 1 1 8 3958 1 1 18 GLY H H -1.791 3.229 -7.012 1.00 . A A . 18 GLY H 1 1 8 3959 1 1 18 GLY HA2 H -0.704 5.300 -7.495 1.00 . A A . 18 GLY HA2 1 1 8 3960 1 1 18 GLY HA3 H -1.701 6.073 -6.258 1.00 . A A . 18 GLY HA3 1 1 8 3961 1 1 18 GLY N N -2.078 4.064 -6.579 1.00 . A A . 18 GLY N 1 1 8 3962 1 1 18 GLY O O 0.823 5.686 -5.282 1.00 . A A . 18 GLY O 1 1 8 3963 1 1 19 MET C C 1.165 1.952 -4.204 1.00 . A A . 19 MET C 1 1 8 3964 1 1 19 MET CA C 0.660 3.328 -3.801 1.00 . A A . 19 MET CA 1 1 8 3965 1 1 19 MET CB C -0.039 3.263 -2.431 1.00 . A A . 19 MET CB 1 1 8 3966 1 1 19 MET CE C -1.935 6.223 -0.191 1.00 . A A . 19 MET CE 1 1 8 3967 1 1 19 MET CG C -0.496 4.612 -1.913 1.00 . A A . 19 MET CG 1 1 8 3968 1 1 19 MET H H -1.056 3.240 -4.982 1.00 . A A . 19 MET H 1 1 8 3969 1 1 19 MET HA H 1.490 4.018 -3.750 1.00 . A A . 19 MET HA 1 1 8 3970 1 1 19 MET HB2 H -0.904 2.622 -2.514 1.00 . A A . 19 MET HB2 1 1 8 3971 1 1 19 MET HB3 H 0.645 2.836 -1.713 1.00 . A A . 19 MET HB3 1 1 8 3972 1 1 19 MET HE1 H -2.537 6.324 0.700 1.00 . A A . 19 MET HE1 1 1 8 3973 1 1 19 MET HE2 H -2.499 6.553 -1.050 1.00 . A A . 19 MET HE2 1 1 8 3974 1 1 19 MET HE3 H -1.042 6.824 -0.093 1.00 . A A . 19 MET HE3 1 1 8 3975 1 1 19 MET HG2 H 0.397 5.175 -1.690 1.00 . A A . 19 MET HG2 1 1 8 3976 1 1 19 MET HG3 H -1.070 5.113 -2.678 1.00 . A A . 19 MET HG3 1 1 8 3977 1 1 19 MET N N -0.264 3.792 -4.807 1.00 . A A . 19 MET N 1 1 8 3978 1 1 19 MET O O 0.663 1.369 -5.166 1.00 . A A . 19 MET O 1 1 8 3979 1 1 19 MET SD S -1.469 4.506 -0.404 1.00 . A A . 19 MET SD 1 1 8 3980 1 1 20 VAL C C 2.249 -0.771 -2.638 1.00 . A A . 20 VAL C 1 1 8 3981 1 1 20 VAL CA C 2.689 0.147 -3.762 1.00 . A A . 20 VAL CA 1 1 8 3982 1 1 20 VAL CB C 4.243 0.174 -3.835 1.00 . A A . 20 VAL CB 1 1 8 3983 1 1 20 VAL CG1 C 4.811 -1.221 -4.060 1.00 . A A . 20 VAL CG1 1 1 8 3984 1 1 20 VAL CG2 C 4.713 1.116 -4.932 1.00 . A A . 20 VAL CG2 1 1 8 3985 1 1 20 VAL H H 2.543 1.984 -2.773 1.00 . A A . 20 VAL H 1 1 8 3986 1 1 20 VAL HA H 2.292 -0.214 -4.699 1.00 . A A . 20 VAL HA 1 1 8 3987 1 1 20 VAL HB H 4.617 0.540 -2.891 1.00 . A A . 20 VAL HB 1 1 8 3988 1 1 20 VAL HG11 H 4.519 -1.862 -3.243 1.00 . A A . 20 VAL HG11 1 1 8 3989 1 1 20 VAL HG12 H 5.888 -1.170 -4.109 1.00 . A A . 20 VAL HG12 1 1 8 3990 1 1 20 VAL HG13 H 4.429 -1.623 -4.986 1.00 . A A . 20 VAL HG13 1 1 8 3991 1 1 20 VAL HG21 H 4.379 2.119 -4.713 1.00 . A A . 20 VAL HG21 1 1 8 3992 1 1 20 VAL HG22 H 4.297 0.800 -5.878 1.00 . A A . 20 VAL HG22 1 1 8 3993 1 1 20 VAL HG23 H 5.791 1.096 -4.990 1.00 . A A . 20 VAL HG23 1 1 8 3994 1 1 20 VAL N N 2.149 1.457 -3.513 1.00 . A A . 20 VAL N 1 1 8 3995 1 1 20 VAL O O 2.430 -0.443 -1.453 1.00 . A A . 20 VAL O 1 1 8 3996 1 1 21 CYS C C 2.281 -3.840 -1.752 1.00 . A A . 21 CYS C 1 1 8 3997 1 1 21 CYS CA C 1.182 -2.830 -2.032 1.00 . A A . 21 CYS CA 1 1 8 3998 1 1 21 CYS CB C -0.081 -3.531 -2.538 1.00 . A A . 21 CYS CB 1 1 8 3999 1 1 21 CYS H H 1.552 -2.085 -3.952 1.00 . A A . 21 CYS H 1 1 8 4000 1 1 21 CYS HA H 0.954 -2.296 -1.121 1.00 . A A . 21 CYS HA 1 1 8 4001 1 1 21 CYS HB2 H -0.766 -2.794 -2.930 1.00 . A A . 21 CYS HB2 1 1 8 4002 1 1 21 CYS HB3 H 0.195 -4.206 -3.335 1.00 . A A . 21 CYS HB3 1 1 8 4003 1 1 21 CYS N N 1.655 -1.881 -2.997 1.00 . A A . 21 CYS N 1 1 8 4004 1 1 21 CYS O O 2.868 -4.404 -2.683 1.00 . A A . 21 CYS O 1 1 8 4005 1 1 21 CYS SG S -0.979 -4.508 -1.264 1.00 . A A . 21 CYS SG 1 1 8 4006 1 1 22 ARG C C 3.319 -5.148 1.473 1.00 . A A . 22 ARG C 1 1 8 4007 1 1 22 ARG CA C 3.577 -4.920 -0.026 1.00 . A A . 22 ARG CA 1 1 8 4008 1 1 22 ARG CB C 4.907 -4.219 -0.260 1.00 . A A . 22 ARG CB 1 1 8 4009 1 1 22 ARG CD C 7.308 -4.445 -0.645 1.00 . A A . 22 ARG CD 1 1 8 4010 1 1 22 ARG CG C 6.076 -5.155 -0.277 1.00 . A A . 22 ARG CG 1 1 8 4011 1 1 22 ARG CZ C 7.902 -2.857 -2.472 1.00 . A A . 22 ARG CZ 1 1 8 4012 1 1 22 ARG H H 2.001 -3.630 0.210 1.00 . A A . 22 ARG H 1 1 8 4013 1 1 22 ARG HA H 3.587 -5.865 -0.548 1.00 . A A . 22 ARG HA 1 1 8 4014 1 1 22 ARG HB2 H 4.868 -3.704 -1.208 1.00 . A A . 22 ARG HB2 1 1 8 4015 1 1 22 ARG HB3 H 5.060 -3.496 0.528 1.00 . A A . 22 ARG HB3 1 1 8 4016 1 1 22 ARG HD2 H 7.325 -3.594 0.012 1.00 . A A . 22 ARG HD2 1 1 8 4017 1 1 22 ARG HD3 H 8.122 -5.122 -0.459 1.00 . A A . 22 ARG HD3 1 1 8 4018 1 1 22 ARG HE H 6.871 -4.594 -2.672 1.00 . A A . 22 ARG HE 1 1 8 4019 1 1 22 ARG HG2 H 6.218 -5.572 0.707 1.00 . A A . 22 ARG HG2 1 1 8 4020 1 1 22 ARG HG3 H 5.891 -5.943 -0.993 1.00 . A A . 22 ARG HG3 1 1 8 4021 1 1 22 ARG HH11 H 8.484 -2.176 -0.626 1.00 . A A . 22 ARG HH11 1 1 8 4022 1 1 22 ARG HH12 H 8.915 -1.167 -1.933 1.00 . A A . 22 ARG HH12 1 1 8 4023 1 1 22 ARG HH21 H 7.498 -3.183 -4.447 1.00 . A A . 22 ARG HH21 1 1 8 4024 1 1 22 ARG HH22 H 8.342 -1.739 -4.118 1.00 . A A . 22 ARG HH22 1 1 8 4025 1 1 22 ARG N N 2.548 -4.057 -0.487 1.00 . A A . 22 ARG N 1 1 8 4026 1 1 22 ARG NE N 7.313 -3.983 -2.036 1.00 . A A . 22 ARG NE 1 1 8 4027 1 1 22 ARG NH1 N 8.472 -2.009 -1.615 1.00 . A A . 22 ARG NH1 1 1 8 4028 1 1 22 ARG NH2 N 7.915 -2.577 -3.765 1.00 . A A . 22 ARG NH2 1 1 8 4029 1 1 22 ARG O O 2.214 -4.747 1.980 1.00 . A A . 22 ARG O 1 1 8 4030 1 1 23 LEU C C 3.729 -4.743 4.326 1.00 . A A . 23 LEU C 1 1 8 4031 1 1 23 LEU CA C 4.229 -6.000 3.640 1.00 . A A . 23 LEU CA 1 1 8 4032 1 1 23 LEU CB C 5.618 -6.379 4.182 1.00 . A A . 23 LEU CB 1 1 8 4033 1 1 23 LEU CD1 C 4.848 -7.842 6.093 1.00 . A A . 23 LEU CD1 1 1 8 4034 1 1 23 LEU CD2 C 7.149 -6.852 6.123 1.00 . A A . 23 LEU CD2 1 1 8 4035 1 1 23 LEU CG C 5.705 -6.646 5.695 1.00 . A A . 23 LEU CG 1 1 8 4036 1 1 23 LEU H H 5.039 -6.188 1.700 1.00 . A A . 23 LEU H 1 1 8 4037 1 1 23 LEU HA H 3.539 -6.807 3.832 1.00 . A A . 23 LEU HA 1 1 8 4038 1 1 23 LEU HB2 H 5.952 -7.265 3.664 1.00 . A A . 23 LEU HB2 1 1 8 4039 1 1 23 LEU HB3 H 6.298 -5.573 3.946 1.00 . A A . 23 LEU HB3 1 1 8 4040 1 1 23 LEU HD11 H 5.181 -8.720 5.559 1.00 . A A . 23 LEU HD11 1 1 8 4041 1 1 23 LEU HD12 H 3.813 -7.645 5.854 1.00 . A A . 23 LEU HD12 1 1 8 4042 1 1 23 LEU HD13 H 4.942 -8.013 7.156 1.00 . A A . 23 LEU HD13 1 1 8 4043 1 1 23 LEU HD21 H 7.564 -7.701 5.600 1.00 . A A . 23 LEU HD21 1 1 8 4044 1 1 23 LEU HD22 H 7.185 -7.033 7.187 1.00 . A A . 23 LEU HD22 1 1 8 4045 1 1 23 LEU HD23 H 7.723 -5.969 5.889 1.00 . A A . 23 LEU HD23 1 1 8 4046 1 1 23 LEU HG H 5.316 -5.785 6.218 1.00 . A A . 23 LEU HG 1 1 8 4047 1 1 23 LEU N N 4.284 -5.789 2.182 1.00 . A A . 23 LEU N 1 1 8 4048 1 1 23 LEU O O 2.885 -4.810 5.208 1.00 . A A . 23 LEU O 1 1 8 4049 1 1 24 TRP C C 3.512 -1.506 3.039 1.00 . A A . 24 TRP C 1 1 8 4050 1 1 24 TRP CA C 3.722 -2.342 4.300 1.00 . A A . 24 TRP CA 1 1 8 4051 1 1 24 TRP CB C 4.644 -1.635 5.325 1.00 . A A . 24 TRP CB 1 1 8 4052 1 1 24 TRP CD1 C 6.161 0.047 4.179 1.00 . A A . 24 TRP CD1 1 1 8 4053 1 1 24 TRP CD2 C 7.233 -1.782 4.876 1.00 . A A . 24 TRP CD2 1 1 8 4054 1 1 24 TRP CE2 C 8.167 -0.920 4.266 1.00 . A A . 24 TRP CE2 1 1 8 4055 1 1 24 TRP CE3 C 7.679 -2.998 5.396 1.00 . A A . 24 TRP CE3 1 1 8 4056 1 1 24 TRP CG C 5.954 -1.137 4.798 1.00 . A A . 24 TRP CG 1 1 8 4057 1 1 24 TRP CH2 C 9.924 -2.436 4.683 1.00 . A A . 24 TRP CH2 1 1 8 4058 1 1 24 TRP CZ2 C 9.515 -1.238 4.163 1.00 . A A . 24 TRP CZ2 1 1 8 4059 1 1 24 TRP CZ3 C 9.021 -3.313 5.294 1.00 . A A . 24 TRP CZ3 1 1 8 4060 1 1 24 TRP H H 4.952 -3.618 3.220 1.00 . A A . 24 TRP H 1 1 8 4061 1 1 24 TRP HA H 2.765 -2.560 4.747 1.00 . A A . 24 TRP HA 1 1 8 4062 1 1 24 TRP HB2 H 4.123 -0.780 5.729 1.00 . A A . 24 TRP HB2 1 1 8 4063 1 1 24 TRP HB3 H 4.850 -2.325 6.132 1.00 . A A . 24 TRP HB3 1 1 8 4064 1 1 24 TRP HD1 H 5.348 0.735 3.992 1.00 . A A . 24 TRP HD1 1 1 8 4065 1 1 24 TRP HE1 H 7.875 0.968 3.383 1.00 . A A . 24 TRP HE1 1 1 8 4066 1 1 24 TRP HE3 H 6.993 -3.685 5.872 1.00 . A A . 24 TRP HE3 1 1 8 4067 1 1 24 TRP HH2 H 10.964 -2.723 4.624 1.00 . A A . 24 TRP HH2 1 1 8 4068 1 1 24 TRP HZ2 H 10.230 -0.575 3.696 1.00 . A A . 24 TRP HZ2 1 1 8 4069 1 1 24 TRP HZ3 H 9.386 -4.249 5.690 1.00 . A A . 24 TRP HZ3 1 1 8 4070 1 1 24 TRP N N 4.233 -3.609 3.885 1.00 . A A . 24 TRP N 1 1 8 4071 1 1 24 TRP NE1 N 7.484 0.188 3.844 1.00 . A A . 24 TRP NE1 1 1 8 4072 1 1 24 TRP O O 4.209 -1.741 2.031 1.00 . A A . 24 TRP O 1 1 8 4073 1 1 25 CYS C C 3.350 1.307 1.702 1.00 . A A . 25 CYS C 1 1 8 4074 1 1 25 CYS CA C 2.305 0.232 1.883 1.00 . A A . 25 CYS CA 1 1 8 4075 1 1 25 CYS CB C 0.903 0.842 1.897 1.00 . A A . 25 CYS CB 1 1 8 4076 1 1 25 CYS H H 2.048 -0.397 3.869 1.00 . A A . 25 CYS H 1 1 8 4077 1 1 25 CYS HA H 2.378 -0.429 1.030 1.00 . A A . 25 CYS HA 1 1 8 4078 1 1 25 CYS HB2 H 0.710 1.257 2.876 1.00 . A A . 25 CYS HB2 1 1 8 4079 1 1 25 CYS HB3 H 0.864 1.635 1.164 1.00 . A A . 25 CYS HB3 1 1 8 4080 1 1 25 CYS N N 2.568 -0.586 3.057 1.00 . A A . 25 CYS N 1 1 8 4081 1 1 25 CYS O O 4.041 1.695 2.653 1.00 . A A . 25 CYS O 1 1 8 4082 1 1 25 CYS SG S -0.445 -0.322 1.526 1.00 . A A . 25 CYS SG 1 1 8 4083 1 1 26 LYS C C 3.851 3.559 -1.002 1.00 . A A . 26 LYS C 1 1 8 4084 1 1 26 LYS CA C 4.443 2.765 0.136 1.00 . A A . 26 LYS CA 1 1 8 4085 1 1 26 LYS CB C 5.711 2.023 -0.311 1.00 . A A . 26 LYS CB 1 1 8 4086 1 1 26 LYS CD C 8.132 2.066 -0.867 1.00 . A A . 26 LYS CD 1 1 8 4087 1 1 26 LYS CE C 9.380 2.924 -1.005 1.00 . A A . 26 LYS CE 1 1 8 4088 1 1 26 LYS CG C 6.885 2.901 -0.638 1.00 . A A . 26 LYS CG 1 1 8 4089 1 1 26 LYS H H 2.861 1.467 -0.213 1.00 . A A . 26 LYS H 1 1 8 4090 1 1 26 LYS HA H 4.663 3.397 0.982 1.00 . A A . 26 LYS HA 1 1 8 4091 1 1 26 LYS HB2 H 6.010 1.355 0.484 1.00 . A A . 26 LYS HB2 1 1 8 4092 1 1 26 LYS HB3 H 5.472 1.432 -1.182 1.00 . A A . 26 LYS HB3 1 1 8 4093 1 1 26 LYS HD2 H 8.263 1.396 -0.029 1.00 . A A . 26 LYS HD2 1 1 8 4094 1 1 26 LYS HD3 H 7.999 1.487 -1.767 1.00 . A A . 26 LYS HD3 1 1 8 4095 1 1 26 LYS HE2 H 9.505 3.498 -0.099 1.00 . A A . 26 LYS HE2 1 1 8 4096 1 1 26 LYS HE3 H 10.233 2.275 -1.134 1.00 . A A . 26 LYS HE3 1 1 8 4097 1 1 26 LYS HG2 H 6.652 3.455 -1.536 1.00 . A A . 26 LYS HG2 1 1 8 4098 1 1 26 LYS HG3 H 7.025 3.585 0.180 1.00 . A A . 26 LYS HG3 1 1 8 4099 1 1 26 LYS HZ1 H 9.201 3.351 -3.042 1.00 . A A . 26 LYS HZ1 1 1 8 4100 1 1 26 LYS HZ2 H 10.186 4.414 -2.181 1.00 . A A . 26 LYS HZ2 1 1 8 4101 1 1 26 LYS HZ3 H 8.524 4.530 -2.025 1.00 . A A . 26 LYS HZ3 1 1 8 4102 1 1 26 LYS N N 3.468 1.780 0.497 1.00 . A A . 26 LYS N 1 1 8 4103 1 1 26 LYS NZ N 9.308 3.859 -2.141 1.00 . A A . 26 LYS NZ 1 1 8 4104 1 1 26 LYS O O 2.961 3.075 -1.641 1.00 . A A . 26 LYS O 1 1 8 4105 1 1 27 LYS C C 4.469 5.090 -3.602 1.00 . A A . 27 LYS C 1 1 8 4106 1 1 27 LYS CA C 3.785 5.529 -2.312 1.00 . A A . 27 LYS CA 1 1 8 4107 1 1 27 LYS CB C 4.034 7.005 -2.031 1.00 . A A . 27 LYS CB 1 1 8 4108 1 1 27 LYS CD C 2.119 7.933 -3.376 1.00 . A A . 27 LYS CD 1 1 8 4109 1 1 27 LYS CE C 1.725 8.792 -4.579 1.00 . A A . 27 LYS CE 1 1 8 4110 1 1 27 LYS CG C 3.631 7.937 -3.134 1.00 . A A . 27 LYS CG 1 1 8 4111 1 1 27 LYS H H 4.965 5.222 -0.694 1.00 . A A . 27 LYS H 1 1 8 4112 1 1 27 LYS HA H 2.722 5.362 -2.385 1.00 . A A . 27 LYS HA 1 1 8 4113 1 1 27 LYS HB2 H 3.466 7.274 -1.155 1.00 . A A . 27 LYS HB2 1 1 8 4114 1 1 27 LYS HB3 H 5.087 7.135 -1.841 1.00 . A A . 27 LYS HB3 1 1 8 4115 1 1 27 LYS HD2 H 1.796 6.920 -3.559 1.00 . A A . 27 LYS HD2 1 1 8 4116 1 1 27 LYS HD3 H 1.624 8.313 -2.495 1.00 . A A . 27 LYS HD3 1 1 8 4117 1 1 27 LYS HE2 H 2.248 8.424 -5.449 1.00 . A A . 27 LYS HE2 1 1 8 4118 1 1 27 LYS HE3 H 0.662 8.694 -4.740 1.00 . A A . 27 LYS HE3 1 1 8 4119 1 1 27 LYS HG2 H 3.990 8.920 -2.876 1.00 . A A . 27 LYS HG2 1 1 8 4120 1 1 27 LYS HG3 H 4.150 7.547 -3.996 1.00 . A A . 27 LYS HG3 1 1 8 4121 1 1 27 LYS HZ1 H 3.082 10.352 -4.265 1.00 . A A . 27 LYS HZ1 1 1 8 4122 1 1 27 LYS HZ2 H 1.588 10.620 -3.564 1.00 . A A . 27 LYS HZ2 1 1 8 4123 1 1 27 LYS HZ3 H 1.773 10.783 -5.222 1.00 . A A . 27 LYS HZ3 1 1 8 4124 1 1 27 LYS N N 4.285 4.767 -1.232 1.00 . A A . 27 LYS N 1 1 8 4125 1 1 27 LYS NZ N 2.060 10.219 -4.398 1.00 . A A . 27 LYS NZ 1 1 8 4126 1 1 27 LYS O O 5.621 4.644 -3.594 1.00 . A A . 27 LYS O 1 1 8 4127 1 1 28 LYS C C 4.794 6.105 -6.625 1.00 . A A . 28 LYS C 1 1 8 4128 1 1 28 LYS CA C 4.272 4.841 -5.971 1.00 . A A . 28 LYS CA 1 1 8 4129 1 1 28 LYS CB C 3.173 4.200 -6.822 1.00 . A A . 28 LYS CB 1 1 8 4130 1 1 28 LYS CD C 2.396 3.299 -9.034 1.00 . A A . 28 LYS CD 1 1 8 4131 1 1 28 LYS CE C 2.031 1.900 -8.548 1.00 . A A . 28 LYS CE 1 1 8 4132 1 1 28 LYS CG C 3.562 3.899 -8.258 1.00 . A A . 28 LYS CG 1 1 8 4133 1 1 28 LYS H H 2.832 5.507 -4.600 1.00 . A A . 28 LYS H 1 1 8 4134 1 1 28 LYS HA H 5.083 4.139 -5.844 1.00 . A A . 28 LYS HA 1 1 8 4135 1 1 28 LYS HB2 H 2.883 3.273 -6.348 1.00 . A A . 28 LYS HB2 1 1 8 4136 1 1 28 LYS HB3 H 2.320 4.861 -6.829 1.00 . A A . 28 LYS HB3 1 1 8 4137 1 1 28 LYS HD2 H 1.536 3.940 -8.919 1.00 . A A . 28 LYS HD2 1 1 8 4138 1 1 28 LYS HD3 H 2.667 3.251 -10.079 1.00 . A A . 28 LYS HD3 1 1 8 4139 1 1 28 LYS HE2 H 1.863 1.923 -7.482 1.00 . A A . 28 LYS HE2 1 1 8 4140 1 1 28 LYS HE3 H 1.120 1.592 -9.038 1.00 . A A . 28 LYS HE3 1 1 8 4141 1 1 28 LYS HG2 H 3.871 4.818 -8.733 1.00 . A A . 28 LYS HG2 1 1 8 4142 1 1 28 LYS HG3 H 4.386 3.202 -8.260 1.00 . A A . 28 LYS HG3 1 1 8 4143 1 1 28 LYS HZ1 H 3.265 0.864 -9.869 1.00 . A A . 28 LYS HZ1 1 1 8 4144 1 1 28 LYS HZ2 H 2.779 -0.032 -8.541 1.00 . A A . 28 LYS HZ2 1 1 8 4145 1 1 28 LYS HZ3 H 3.986 1.129 -8.364 1.00 . A A . 28 LYS HZ3 1 1 8 4146 1 1 28 LYS N N 3.752 5.173 -4.675 1.00 . A A . 28 LYS N 1 1 8 4147 1 1 28 LYS NZ N 3.091 0.912 -8.844 1.00 . A A . 28 LYS NZ 1 1 8 4148 1 1 28 LYS O O 4.029 7.030 -6.901 1.00 . A A . 28 LYS O 1 1 8 4149 1 1 29 LEU C C 6.882 7.046 -8.913 1.00 . A A . 29 LEU C 1 1 8 4150 1 1 29 LEU CA C 6.698 7.325 -7.441 1.00 . A A . 29 LEU CA 1 1 8 4151 1 1 29 LEU CB C 8.064 7.697 -6.804 1.00 . A A . 29 LEU CB 1 1 8 4152 1 1 29 LEU CD1 C 7.060 9.229 -5.040 1.00 . A A . 29 LEU CD1 1 1 8 4153 1 1 29 LEU CD2 C 7.920 6.963 -4.366 1.00 . A A . 29 LEU CD2 1 1 8 4154 1 1 29 LEU CG C 8.083 8.139 -5.319 1.00 . A A . 29 LEU CG 1 1 8 4155 1 1 29 LEU H H 6.648 5.420 -6.522 1.00 . A A . 29 LEU H 1 1 8 4156 1 1 29 LEU HA H 6.018 8.157 -7.335 1.00 . A A . 29 LEU HA 1 1 8 4157 1 1 29 LEU HB2 H 8.712 6.838 -6.893 1.00 . A A . 29 LEU HB2 1 1 8 4158 1 1 29 LEU HB3 H 8.491 8.494 -7.395 1.00 . A A . 29 LEU HB3 1 1 8 4159 1 1 29 LEU HD11 H 7.262 10.084 -5.668 1.00 . A A . 29 LEU HD11 1 1 8 4160 1 1 29 LEU HD12 H 7.126 9.522 -4.002 1.00 . A A . 29 LEU HD12 1 1 8 4161 1 1 29 LEU HD13 H 6.067 8.855 -5.244 1.00 . A A . 29 LEU HD13 1 1 8 4162 1 1 29 LEU HD21 H 7.936 7.328 -3.350 1.00 . A A . 29 LEU HD21 1 1 8 4163 1 1 29 LEU HD22 H 8.732 6.264 -4.512 1.00 . A A . 29 LEU HD22 1 1 8 4164 1 1 29 LEU HD23 H 6.981 6.469 -4.559 1.00 . A A . 29 LEU HD23 1 1 8 4165 1 1 29 LEU HG H 9.048 8.588 -5.135 1.00 . A A . 29 LEU HG 1 1 8 4166 1 1 29 LEU N N 6.084 6.171 -6.809 1.00 . A A . 29 LEU N 1 1 8 4167 1 1 29 LEU O O 6.808 7.954 -9.756 1.00 . A A . 29 LEU O 1 1 8 4168 1 1 30 TRP C C 6.501 4.096 -10.750 1.00 . A A . 30 TRP C 1 1 8 4169 1 1 30 TRP CA C 7.306 5.346 -10.562 1.00 . A A . 30 TRP CA 1 1 8 4170 1 1 30 TRP CB C 8.797 5.092 -10.861 1.00 . A A . 30 TRP CB 1 1 8 4171 1 1 30 TRP CD1 C 10.455 6.645 -9.660 1.00 . A A . 30 TRP CD1 1 1 8 4172 1 1 30 TRP CD2 C 9.772 7.393 -11.655 1.00 . A A . 30 TRP CD2 1 1 8 4173 1 1 30 TRP CE2 C 10.667 8.330 -11.111 1.00 . A A . 30 TRP CE2 1 1 8 4174 1 1 30 TRP CE3 C 9.211 7.649 -12.903 1.00 . A A . 30 TRP CE3 1 1 8 4175 1 1 30 TRP CG C 9.655 6.317 -10.718 1.00 . A A . 30 TRP CG 1 1 8 4176 1 1 30 TRP CH2 C 10.437 9.727 -12.995 1.00 . A A . 30 TRP CH2 1 1 8 4177 1 1 30 TRP CZ2 C 11.008 9.504 -11.774 1.00 . A A . 30 TRP CZ2 1 1 8 4178 1 1 30 TRP CZ3 C 9.546 8.814 -13.559 1.00 . A A . 30 TRP CZ3 1 1 8 4179 1 1 30 TRP H H 7.125 5.109 -8.516 1.00 . A A . 30 TRP H 1 1 8 4180 1 1 30 TRP HA H 6.930 6.108 -11.229 1.00 . A A . 30 TRP HA 1 1 8 4181 1 1 30 TRP HB2 H 9.171 4.342 -10.180 1.00 . A A . 30 TRP HB2 1 1 8 4182 1 1 30 TRP HB3 H 8.896 4.727 -11.873 1.00 . A A . 30 TRP HB3 1 1 8 4183 1 1 30 TRP HD1 H 10.577 6.029 -8.781 1.00 . A A . 30 TRP HD1 1 1 8 4184 1 1 30 TRP HE1 H 11.700 8.317 -9.297 1.00 . A A . 30 TRP HE1 1 1 8 4185 1 1 30 TRP HE3 H 8.521 6.949 -13.349 1.00 . A A . 30 TRP HE3 1 1 8 4186 1 1 30 TRP HH2 H 10.671 10.629 -13.541 1.00 . A A . 30 TRP HH2 1 1 8 4187 1 1 30 TRP HZ2 H 11.696 10.222 -11.355 1.00 . A A . 30 TRP HZ2 1 1 8 4188 1 1 30 TRP HZ3 H 9.114 9.029 -14.526 1.00 . A A . 30 TRP HZ3 1 1 8 4189 1 1 30 TRP N N 7.107 5.792 -9.220 1.00 . A A . 30 TRP N 1 1 8 4190 1 1 30 TRP NE1 N 11.073 7.852 -9.897 1.00 . A A . 30 TRP NE1 1 1 8 4191 1 1 30 TRP O O 5.424 4.163 -11.346 1.00 . A A . 30 TRP O 1 1 8 4192 1 1 30 TRP OXT O 6.893 3.050 -10.217 1.00 . A A . 30 TRP OXT 1 1 9 4193 1 1 1 TYR C C -10.477 0.832 1.618 1.00 . A A . 1 TYR C 1 1 9 4194 1 1 1 TYR CA C -11.879 0.639 2.173 1.00 . A A . 1 TYR CA 1 1 9 4195 1 1 1 TYR CB C -12.887 1.635 1.559 1.00 . A A . 1 TYR CB 1 1 9 4196 1 1 1 TYR CD1 C -13.538 0.577 -0.655 1.00 . A A . 1 TYR CD1 1 1 9 4197 1 1 1 TYR CD2 C -12.529 2.732 -0.686 1.00 . A A . 1 TYR CD2 1 1 9 4198 1 1 1 TYR CE1 C -13.642 0.605 -2.034 1.00 . A A . 1 TYR CE1 1 1 9 4199 1 1 1 TYR CE2 C -12.624 2.763 -2.058 1.00 . A A . 1 TYR CE2 1 1 9 4200 1 1 1 TYR CG C -12.978 1.640 0.043 1.00 . A A . 1 TYR CG 1 1 9 4201 1 1 1 TYR CZ C -13.181 1.701 -2.729 1.00 . A A . 1 TYR CZ 1 1 9 4202 1 1 1 TYR H1 H -12.806 0.669 4.034 1.00 . A A . 1 TYR H1 1 1 9 4203 1 1 1 TYR H2 H -11.474 1.685 3.914 1.00 . A A . 1 TYR H2 1 1 9 4204 1 1 1 TYR H3 H -11.247 0.037 4.043 1.00 . A A . 1 TYR H3 1 1 9 4205 1 1 1 TYR HA H -12.189 -0.370 1.942 1.00 . A A . 1 TYR HA 1 1 9 4206 1 1 1 TYR HB2 H -13.874 1.404 1.929 1.00 . A A . 1 TYR HB2 1 1 9 4207 1 1 1 TYR HB3 H -12.627 2.633 1.876 1.00 . A A . 1 TYR HB3 1 1 9 4208 1 1 1 TYR HD1 H -13.897 -0.285 -0.112 1.00 . A A . 1 TYR HD1 1 1 9 4209 1 1 1 TYR HD2 H -12.090 3.570 -0.164 1.00 . A A . 1 TYR HD2 1 1 9 4210 1 1 1 TYR HE1 H -14.080 -0.234 -2.555 1.00 . A A . 1 TYR HE1 1 1 9 4211 1 1 1 TYR HE2 H -12.261 3.628 -2.595 1.00 . A A . 1 TYR HE2 1 1 9 4212 1 1 1 TYR HH H -12.490 2.133 -4.471 1.00 . A A . 1 TYR HH 1 1 9 4213 1 1 1 TYR N N -11.857 0.766 3.622 1.00 . A A . 1 TYR N 1 1 9 4214 1 1 1 TYR O O -9.835 -0.128 1.179 1.00 . A A . 1 TYR O 1 1 9 4215 1 1 1 TYR OH O -13.293 1.742 -4.101 1.00 . A A . 1 TYR OH 1 1 9 4216 1 1 2 CYS C C -7.638 2.243 2.296 1.00 . A A . 2 CYS C 1 1 9 4217 1 1 2 CYS CA C -8.661 2.315 1.170 1.00 . A A . 2 CYS CA 1 1 9 4218 1 1 2 CYS CB C -8.633 3.690 0.487 1.00 . A A . 2 CYS CB 1 1 9 4219 1 1 2 CYS H H -10.457 2.778 2.105 1.00 . A A . 2 CYS H 1 1 9 4220 1 1 2 CYS HA H -8.427 1.555 0.440 1.00 . A A . 2 CYS HA 1 1 9 4221 1 1 2 CYS HB2 H -9.447 3.745 -0.220 1.00 . A A . 2 CYS HB2 1 1 9 4222 1 1 2 CYS HB3 H -8.767 4.451 1.241 1.00 . A A . 2 CYS HB3 1 1 9 4223 1 1 2 CYS N N -9.970 2.036 1.688 1.00 . A A . 2 CYS N 1 1 9 4224 1 1 2 CYS O O -7.984 2.363 3.481 1.00 . A A . 2 CYS O 1 1 9 4225 1 1 2 CYS SG S -7.084 4.062 -0.416 1.00 . A A . 2 CYS SG 1 1 9 4226 1 1 3 GLN C C -4.658 3.276 3.018 1.00 . A A . 3 GLN C 1 1 9 4227 1 1 3 GLN CA C -5.333 1.937 2.883 1.00 . A A . 3 GLN CA 1 1 9 4228 1 1 3 GLN CB C -4.290 0.895 2.453 1.00 . A A . 3 GLN CB 1 1 9 4229 1 1 3 GLN CD C -5.322 -1.014 3.723 1.00 . A A . 3 GLN CD 1 1 9 4230 1 1 3 GLN CG C -4.795 -0.534 2.395 1.00 . A A . 3 GLN CG 1 1 9 4231 1 1 3 GLN H H -6.213 1.981 0.973 1.00 . A A . 3 GLN H 1 1 9 4232 1 1 3 GLN HA H -5.750 1.642 3.832 1.00 . A A . 3 GLN HA 1 1 9 4233 1 1 3 GLN HB2 H -3.929 1.158 1.469 1.00 . A A . 3 GLN HB2 1 1 9 4234 1 1 3 GLN HB3 H -3.463 0.935 3.145 1.00 . A A . 3 GLN HB3 1 1 9 4235 1 1 3 GLN HE21 H -3.532 -1.687 4.251 1.00 . A A . 3 GLN HE21 1 1 9 4236 1 1 3 GLN HE22 H -4.797 -1.878 5.409 1.00 . A A . 3 GLN HE22 1 1 9 4237 1 1 3 GLN HG2 H -5.591 -0.595 1.668 1.00 . A A . 3 GLN HG2 1 1 9 4238 1 1 3 GLN HG3 H -3.983 -1.179 2.093 1.00 . A A . 3 GLN HG3 1 1 9 4239 1 1 3 GLN N N -6.407 2.031 1.933 1.00 . A A . 3 GLN N 1 1 9 4240 1 1 3 GLN NE2 N -4.469 -1.584 4.530 1.00 . A A . 3 GLN NE2 1 1 9 4241 1 1 3 GLN O O -4.690 4.088 2.096 1.00 . A A . 3 GLN O 1 1 9 4242 1 1 3 GLN OE1 O -6.498 -0.875 4.014 1.00 . A A . 3 GLN OE1 1 1 9 4243 1 1 4 LYS C C -1.880 4.339 4.151 1.00 . A A . 4 LYS C 1 1 9 4244 1 1 4 LYS CA C -3.321 4.698 4.387 1.00 . A A . 4 LYS CA 1 1 9 4245 1 1 4 LYS CB C -3.503 5.210 5.818 1.00 . A A . 4 LYS CB 1 1 9 4246 1 1 4 LYS CD C -5.220 6.994 5.392 1.00 . A A . 4 LYS CD 1 1 9 4247 1 1 4 LYS CE C -6.593 7.551 5.758 1.00 . A A . 4 LYS CE 1 1 9 4248 1 1 4 LYS CG C -4.903 5.708 6.133 1.00 . A A . 4 LYS CG 1 1 9 4249 1 1 4 LYS H H -4.208 2.874 4.891 1.00 . A A . 4 LYS H 1 1 9 4250 1 1 4 LYS HA H -3.627 5.460 3.685 1.00 . A A . 4 LYS HA 1 1 9 4251 1 1 4 LYS HB2 H -3.269 4.409 6.504 1.00 . A A . 4 LYS HB2 1 1 9 4252 1 1 4 LYS HB3 H -2.810 6.022 5.981 1.00 . A A . 4 LYS HB3 1 1 9 4253 1 1 4 LYS HD2 H -4.475 7.728 5.654 1.00 . A A . 4 LYS HD2 1 1 9 4254 1 1 4 LYS HD3 H -5.183 6.810 4.329 1.00 . A A . 4 LYS HD3 1 1 9 4255 1 1 4 LYS HE2 H -6.618 7.736 6.820 1.00 . A A . 4 LYS HE2 1 1 9 4256 1 1 4 LYS HE3 H -6.732 8.485 5.235 1.00 . A A . 4 LYS HE3 1 1 9 4257 1 1 4 LYS HG2 H -5.570 4.944 5.767 1.00 . A A . 4 LYS HG2 1 1 9 4258 1 1 4 LYS HG3 H -5.024 5.846 7.197 1.00 . A A . 4 LYS HG3 1 1 9 4259 1 1 4 LYS HZ1 H -7.714 6.385 4.407 1.00 . A A . 4 LYS HZ1 1 1 9 4260 1 1 4 LYS HZ2 H -8.612 7.097 5.614 1.00 . A A . 4 LYS HZ2 1 1 9 4261 1 1 4 LYS HZ3 H -7.695 5.758 5.978 1.00 . A A . 4 LYS HZ3 1 1 9 4262 1 1 4 LYS N N -4.106 3.521 4.163 1.00 . A A . 4 LYS N 1 1 9 4263 1 1 4 LYS NZ N -7.703 6.632 5.418 1.00 . A A . 4 LYS NZ 1 1 9 4264 1 1 4 LYS O O -1.509 3.170 4.272 1.00 . A A . 4 LYS O 1 1 9 4265 1 1 5 TRP C C 1.080 4.536 4.814 1.00 . A A . 5 TRP C 1 1 9 4266 1 1 5 TRP CA C 0.375 5.123 3.591 1.00 . A A . 5 TRP CA 1 1 9 4267 1 1 5 TRP CB C 1.055 6.456 3.202 1.00 . A A . 5 TRP CB 1 1 9 4268 1 1 5 TRP CD1 C 0.188 8.142 4.952 1.00 . A A . 5 TRP CD1 1 1 9 4269 1 1 5 TRP CD2 C 2.402 7.858 4.991 1.00 . A A . 5 TRP CD2 1 1 9 4270 1 1 5 TRP CE2 C 2.054 8.802 5.975 1.00 . A A . 5 TRP CE2 1 1 9 4271 1 1 5 TRP CE3 C 3.744 7.518 4.834 1.00 . A A . 5 TRP CE3 1 1 9 4272 1 1 5 TRP CG C 1.188 7.451 4.340 1.00 . A A . 5 TRP CG 1 1 9 4273 1 1 5 TRP CH2 C 4.307 9.051 6.620 1.00 . A A . 5 TRP CH2 1 1 9 4274 1 1 5 TRP CZ2 C 3.000 9.407 6.796 1.00 . A A . 5 TRP CZ2 1 1 9 4275 1 1 5 TRP CZ3 C 4.683 8.117 5.651 1.00 . A A . 5 TRP CZ3 1 1 9 4276 1 1 5 TRP H H -1.476 6.215 3.776 1.00 . A A . 5 TRP H 1 1 9 4277 1 1 5 TRP HA H 0.473 4.425 2.774 1.00 . A A . 5 TRP HA 1 1 9 4278 1 1 5 TRP HB2 H 2.049 6.247 2.834 1.00 . A A . 5 TRP HB2 1 1 9 4279 1 1 5 TRP HB3 H 0.482 6.923 2.415 1.00 . A A . 5 TRP HB3 1 1 9 4280 1 1 5 TRP HD1 H -0.852 8.045 4.691 1.00 . A A . 5 TRP HD1 1 1 9 4281 1 1 5 TRP HE1 H 0.174 9.563 6.504 1.00 . A A . 5 TRP HE1 1 1 9 4282 1 1 5 TRP HE3 H 4.049 6.796 4.093 1.00 . A A . 5 TRP HE3 1 1 9 4283 1 1 5 TRP HH2 H 5.075 9.496 7.235 1.00 . A A . 5 TRP HH2 1 1 9 4284 1 1 5 TRP HZ2 H 2.732 10.134 7.551 1.00 . A A . 5 TRP HZ2 1 1 9 4285 1 1 5 TRP HZ3 H 5.728 7.864 5.543 1.00 . A A . 5 TRP HZ3 1 1 9 4286 1 1 5 TRP N N -1.071 5.323 3.858 1.00 . A A . 5 TRP N 1 1 9 4287 1 1 5 TRP NE1 N 0.700 8.959 5.929 1.00 . A A . 5 TRP NE1 1 1 9 4288 1 1 5 TRP O O 2.143 3.927 4.710 1.00 . A A . 5 TRP O 1 1 9 4289 1 1 6 MET C C 0.648 2.787 7.458 1.00 . A A . 6 MET C 1 1 9 4290 1 1 6 MET CA C 1.022 4.253 7.203 1.00 . A A . 6 MET CA 1 1 9 4291 1 1 6 MET CB C 0.562 5.138 8.370 1.00 . A A . 6 MET CB 1 1 9 4292 1 1 6 MET CE C -3.227 6.054 9.844 1.00 . A A . 6 MET CE 1 1 9 4293 1 1 6 MET CG C -0.940 5.161 8.584 1.00 . A A . 6 MET CG 1 1 9 4294 1 1 6 MET H H -0.379 5.205 5.946 1.00 . A A . 6 MET H 1 1 9 4295 1 1 6 MET HA H 2.090 4.360 7.094 1.00 . A A . 6 MET HA 1 1 9 4296 1 1 6 MET HB2 H 1.021 4.777 9.278 1.00 . A A . 6 MET HB2 1 1 9 4297 1 1 6 MET HB3 H 0.895 6.150 8.190 1.00 . A A . 6 MET HB3 1 1 9 4298 1 1 6 MET HE1 H -3.694 6.656 10.609 1.00 . A A . 6 MET HE1 1 1 9 4299 1 1 6 MET HE2 H -3.481 5.015 9.998 1.00 . A A . 6 MET HE2 1 1 9 4300 1 1 6 MET HE3 H -3.577 6.369 8.872 1.00 . A A . 6 MET HE3 1 1 9 4301 1 1 6 MET HG2 H -1.412 5.497 7.673 1.00 . A A . 6 MET HG2 1 1 9 4302 1 1 6 MET HG3 H -1.274 4.160 8.808 1.00 . A A . 6 MET HG3 1 1 9 4303 1 1 6 MET N N 0.472 4.722 5.961 1.00 . A A . 6 MET N 1 1 9 4304 1 1 6 MET O O 1.132 2.170 8.397 1.00 . A A . 6 MET O 1 1 9 4305 1 1 6 MET SD S -1.443 6.255 9.923 1.00 . A A . 6 MET SD 1 1 9 4306 1 1 7 TRP C C 0.122 -0.050 5.834 1.00 . A A . 7 TRP C 1 1 9 4307 1 1 7 TRP CA C -0.643 0.859 6.781 1.00 . A A . 7 TRP CA 1 1 9 4308 1 1 7 TRP CB C -2.166 0.706 6.583 1.00 . A A . 7 TRP CB 1 1 9 4309 1 1 7 TRP CD1 C -2.602 1.969 8.789 1.00 . A A . 7 TRP CD1 1 1 9 4310 1 1 7 TRP CD2 C -4.388 1.789 7.460 1.00 . A A . 7 TRP CD2 1 1 9 4311 1 1 7 TRP CE2 C -4.755 2.512 8.612 1.00 . A A . 7 TRP CE2 1 1 9 4312 1 1 7 TRP CE3 C -5.349 1.545 6.485 1.00 . A A . 7 TRP CE3 1 1 9 4313 1 1 7 TRP CG C -3.001 1.468 7.581 1.00 . A A . 7 TRP CG 1 1 9 4314 1 1 7 TRP CH2 C -6.966 2.734 7.827 1.00 . A A . 7 TRP CH2 1 1 9 4315 1 1 7 TRP CZ2 C -6.045 2.990 8.804 1.00 . A A . 7 TRP CZ2 1 1 9 4316 1 1 7 TRP CZ3 C -6.629 2.016 6.679 1.00 . A A . 7 TRP CZ3 1 1 9 4317 1 1 7 TRP H H -0.530 2.731 5.832 1.00 . A A . 7 TRP H 1 1 9 4318 1 1 7 TRP HA H -0.388 0.569 7.789 1.00 . A A . 7 TRP HA 1 1 9 4319 1 1 7 TRP HB2 H -2.426 1.067 5.600 1.00 . A A . 7 TRP HB2 1 1 9 4320 1 1 7 TRP HB3 H -2.431 -0.339 6.651 1.00 . A A . 7 TRP HB3 1 1 9 4321 1 1 7 TRP HD1 H -1.600 1.881 9.182 1.00 . A A . 7 TRP HD1 1 1 9 4322 1 1 7 TRP HE1 H -3.592 3.059 10.278 1.00 . A A . 7 TRP HE1 1 1 9 4323 1 1 7 TRP HE3 H -5.105 0.983 5.596 1.00 . A A . 7 TRP HE3 1 1 9 4324 1 1 7 TRP HH2 H -7.982 3.082 7.937 1.00 . A A . 7 TRP HH2 1 1 9 4325 1 1 7 TRP HZ2 H -6.328 3.549 9.684 1.00 . A A . 7 TRP HZ2 1 1 9 4326 1 1 7 TRP HZ3 H -7.388 1.834 5.931 1.00 . A A . 7 TRP HZ3 1 1 9 4327 1 1 7 TRP N N -0.208 2.233 6.615 1.00 . A A . 7 TRP N 1 1 9 4328 1 1 7 TRP NE1 N -3.647 2.611 9.403 1.00 . A A . 7 TRP NE1 1 1 9 4329 1 1 7 TRP O O 1.049 0.394 5.133 1.00 . A A . 7 TRP O 1 1 9 4330 1 1 8 THR C C -0.615 -3.095 4.250 1.00 . A A . 8 THR C 1 1 9 4331 1 1 8 THR CA C 0.445 -2.303 5.041 1.00 . A A . 8 THR CA 1 1 9 4332 1 1 8 THR CB C 1.209 -3.267 5.998 1.00 . A A . 8 THR CB 1 1 9 4333 1 1 8 THR CG2 C 2.176 -2.495 6.912 1.00 . A A . 8 THR CG2 1 1 9 4334 1 1 8 THR H H -0.985 -1.605 6.381 1.00 . A A . 8 THR H 1 1 9 4335 1 1 8 THR HA H 1.143 -1.812 4.381 1.00 . A A . 8 THR HA 1 1 9 4336 1 1 8 THR HB H 1.772 -3.975 5.409 1.00 . A A . 8 THR HB 1 1 9 4337 1 1 8 THR HG1 H 0.543 -4.902 6.789 1.00 . A A . 8 THR HG1 1 1 9 4338 1 1 8 THR HG21 H 1.609 -1.823 7.539 1.00 . A A . 8 THR HG21 1 1 9 4339 1 1 8 THR HG22 H 2.871 -1.912 6.324 1.00 . A A . 8 THR HG22 1 1 9 4340 1 1 8 THR HG23 H 2.721 -3.189 7.536 1.00 . A A . 8 THR HG23 1 1 9 4341 1 1 8 THR N N -0.232 -1.304 5.830 1.00 . A A . 8 THR N 1 1 9 4342 1 1 8 THR O O -1.827 -2.806 4.394 1.00 . A A . 8 THR O 1 1 9 4343 1 1 8 THR OG1 O 0.272 -3.975 6.835 1.00 . A A . 8 THR OG1 1 1 9 4344 1 1 9 CYS C C -0.886 -6.341 2.857 1.00 . A A . 9 CYS C 1 1 9 4345 1 1 9 CYS CA C -1.247 -4.874 2.796 1.00 . A A . 9 CYS CA 1 1 9 4346 1 1 9 CYS CB C -1.526 -4.443 1.364 1.00 . A A . 9 CYS CB 1 1 9 4347 1 1 9 CYS H H 0.716 -4.262 3.187 1.00 . A A . 9 CYS H 1 1 9 4348 1 1 9 CYS HA H -2.144 -4.737 3.380 1.00 . A A . 9 CYS HA 1 1 9 4349 1 1 9 CYS HB2 H -2.390 -4.979 1.004 1.00 . A A . 9 CYS HB2 1 1 9 4350 1 1 9 CYS HB3 H -1.743 -3.384 1.355 1.00 . A A . 9 CYS HB3 1 1 9 4351 1 1 9 CYS N N -0.225 -4.065 3.420 1.00 . A A . 9 CYS N 1 1 9 4352 1 1 9 CYS O O 0.234 -6.698 3.258 1.00 . A A . 9 CYS O 1 1 9 4353 1 1 9 CYS SG S -0.187 -4.744 0.196 1.00 . A A . 9 CYS SG 1 1 9 4354 1 1 10 ASP C C -2.717 -9.196 1.520 1.00 . A A . 10 ASP C 1 1 9 4355 1 1 10 ASP CA C -1.654 -8.619 2.485 1.00 . A A . 10 ASP CA 1 1 9 4356 1 1 10 ASP CB C -1.806 -9.167 3.927 1.00 . A A . 10 ASP CB 1 1 9 4357 1 1 10 ASP CG C -1.330 -10.600 4.085 1.00 . A A . 10 ASP CG 1 1 9 4358 1 1 10 ASP H H -2.697 -6.830 2.176 1.00 . A A . 10 ASP H 1 1 9 4359 1 1 10 ASP HA H -0.668 -8.837 2.099 1.00 . A A . 10 ASP HA 1 1 9 4360 1 1 10 ASP HB2 H -1.240 -8.546 4.608 1.00 . A A . 10 ASP HB2 1 1 9 4361 1 1 10 ASP HB3 H -2.850 -9.123 4.198 1.00 . A A . 10 ASP HB3 1 1 9 4362 1 1 10 ASP N N -1.829 -7.181 2.490 1.00 . A A . 10 ASP N 1 1 9 4363 1 1 10 ASP O O -2.931 -8.627 0.442 1.00 . A A . 10 ASP O 1 1 9 4364 1 1 10 ASP OD1 O -0.139 -10.819 4.330 1.00 . A A . 10 ASP OD1 1 1 9 4365 1 1 10 ASP OD2 O -2.147 -11.537 3.944 1.00 . A A . 10 ASP OD2 1 1 9 4366 1 1 11 SER C C -5.711 -10.172 1.086 1.00 . A A . 11 SER C 1 1 9 4367 1 1 11 SER CA C -4.351 -10.886 1.013 1.00 . A A . 11 SER CA 1 1 9 4368 1 1 11 SER CB C -4.469 -12.370 1.347 1.00 . A A . 11 SER CB 1 1 9 4369 1 1 11 SER H H -3.175 -10.726 2.732 1.00 . A A . 11 SER H 1 1 9 4370 1 1 11 SER HA H -3.984 -10.798 0.002 1.00 . A A . 11 SER HA 1 1 9 4371 1 1 11 SER HB2 H -5.344 -12.779 0.863 1.00 . A A . 11 SER HB2 1 1 9 4372 1 1 11 SER HB3 H -3.588 -12.891 1.002 1.00 . A A . 11 SER HB3 1 1 9 4373 1 1 11 SER HG H -3.804 -13.035 3.052 1.00 . A A . 11 SER HG 1 1 9 4374 1 1 11 SER N N -3.366 -10.282 1.872 1.00 . A A . 11 SER N 1 1 9 4375 1 1 11 SER O O -6.323 -9.883 0.047 1.00 . A A . 11 SER O 1 1 9 4376 1 1 11 SER OG O -4.591 -12.557 2.758 1.00 . A A . 11 SER OG 1 1 9 4377 1 1 12 GLU C C -7.303 -7.704 2.126 1.00 . A A . 12 GLU C 1 1 9 4378 1 1 12 GLU CA C -7.443 -9.182 2.456 1.00 . A A . 12 GLU CA 1 1 9 4379 1 1 12 GLU CB C -7.993 -9.365 3.878 1.00 . A A . 12 GLU CB 1 1 9 4380 1 1 12 GLU CD C -9.275 -11.455 3.337 1.00 . A A . 12 GLU CD 1 1 9 4381 1 1 12 GLU CG C -8.271 -10.810 4.259 1.00 . A A . 12 GLU CG 1 1 9 4382 1 1 12 GLU H H -5.634 -10.109 3.075 1.00 . A A . 12 GLU H 1 1 9 4383 1 1 12 GLU HA H -8.133 -9.624 1.752 1.00 . A A . 12 GLU HA 1 1 9 4384 1 1 12 GLU HB2 H -7.287 -8.959 4.587 1.00 . A A . 12 GLU HB2 1 1 9 4385 1 1 12 GLU HB3 H -8.917 -8.812 3.960 1.00 . A A . 12 GLU HB3 1 1 9 4386 1 1 12 GLU HG2 H -7.346 -11.364 4.213 1.00 . A A . 12 GLU HG2 1 1 9 4387 1 1 12 GLU HG3 H -8.657 -10.837 5.268 1.00 . A A . 12 GLU HG3 1 1 9 4388 1 1 12 GLU N N -6.163 -9.861 2.290 1.00 . A A . 12 GLU N 1 1 9 4389 1 1 12 GLU O O -8.054 -7.155 1.327 1.00 . A A . 12 GLU O 1 1 9 4390 1 1 12 GLU OE1 O -10.492 -11.223 3.509 1.00 . A A . 12 GLU OE1 1 1 9 4391 1 1 12 GLU OE2 O -8.873 -12.183 2.414 1.00 . A A . 12 GLU OE2 1 1 9 4392 1 1 13 ARG C C -5.143 -5.472 1.390 1.00 . A A . 13 ARG C 1 1 9 4393 1 1 13 ARG CA C -6.095 -5.681 2.514 1.00 . A A . 13 ARG CA 1 1 9 4394 1 1 13 ARG CB C -5.550 -5.035 3.779 1.00 . A A . 13 ARG CB 1 1 9 4395 1 1 13 ARG CD C -7.616 -3.895 4.662 1.00 . A A . 13 ARG CD 1 1 9 4396 1 1 13 ARG CG C -6.532 -4.932 4.925 1.00 . A A . 13 ARG CG 1 1 9 4397 1 1 13 ARG CZ C -8.968 -3.355 2.643 1.00 . A A . 13 ARG CZ 1 1 9 4398 1 1 13 ARG H H -5.742 -7.584 3.324 1.00 . A A . 13 ARG H 1 1 9 4399 1 1 13 ARG HA H -7.037 -5.210 2.275 1.00 . A A . 13 ARG HA 1 1 9 4400 1 1 13 ARG HB2 H -4.742 -5.658 4.123 1.00 . A A . 13 ARG HB2 1 1 9 4401 1 1 13 ARG HB3 H -5.175 -4.047 3.550 1.00 . A A . 13 ARG HB3 1 1 9 4402 1 1 13 ARG HD2 H -8.236 -3.810 5.540 1.00 . A A . 13 ARG HD2 1 1 9 4403 1 1 13 ARG HD3 H -7.134 -2.945 4.478 1.00 . A A . 13 ARG HD3 1 1 9 4404 1 1 13 ARG HE H -8.627 -5.199 3.412 1.00 . A A . 13 ARG HE 1 1 9 4405 1 1 13 ARG HG2 H -6.995 -5.903 5.022 1.00 . A A . 13 ARG HG2 1 1 9 4406 1 1 13 ARG HG3 H -5.990 -4.684 5.825 1.00 . A A . 13 ARG HG3 1 1 9 4407 1 1 13 ARG HH11 H -8.053 -1.693 3.438 1.00 . A A . 13 ARG HH11 1 1 9 4408 1 1 13 ARG HH12 H -9.061 -1.373 2.114 1.00 . A A . 13 ARG HH12 1 1 9 4409 1 1 13 ARG HH21 H -9.954 -4.757 1.556 1.00 . A A . 13 ARG HH21 1 1 9 4410 1 1 13 ARG HH22 H -10.174 -3.168 1.000 1.00 . A A . 13 ARG HH22 1 1 9 4411 1 1 13 ARG N N -6.335 -7.081 2.725 1.00 . A A . 13 ARG N 1 1 9 4412 1 1 13 ARG NE N -8.452 -4.235 3.508 1.00 . A A . 13 ARG NE 1 1 9 4413 1 1 13 ARG NH1 N -8.670 -2.063 2.734 1.00 . A A . 13 ARG NH1 1 1 9 4414 1 1 13 ARG NH2 N -9.742 -3.782 1.665 1.00 . A A . 13 ARG NH2 1 1 9 4415 1 1 13 ARG O O -4.042 -5.965 1.431 1.00 . A A . 13 ARG O 1 1 9 4416 1 1 14 LYS C C -4.482 -2.926 -0.650 1.00 . A A . 14 LYS C 1 1 9 4417 1 1 14 LYS CA C -4.745 -4.414 -0.735 1.00 . A A . 14 LYS CA 1 1 9 4418 1 1 14 LYS CB C -5.385 -4.755 -2.082 1.00 . A A . 14 LYS CB 1 1 9 4419 1 1 14 LYS CD C -6.080 -6.501 -3.736 1.00 . A A . 14 LYS CD 1 1 9 4420 1 1 14 LYS CE C -6.105 -7.982 -4.046 1.00 . A A . 14 LYS CE 1 1 9 4421 1 1 14 LYS CG C -5.502 -6.240 -2.356 1.00 . A A . 14 LYS CG 1 1 9 4422 1 1 14 LYS H H -6.535 -4.541 0.365 1.00 . A A . 14 LYS H 1 1 9 4423 1 1 14 LYS HA H -3.807 -4.940 -0.639 1.00 . A A . 14 LYS HA 1 1 9 4424 1 1 14 LYS HB2 H -6.378 -4.331 -2.106 1.00 . A A . 14 LYS HB2 1 1 9 4425 1 1 14 LYS HB3 H -4.797 -4.306 -2.868 1.00 . A A . 14 LYS HB3 1 1 9 4426 1 1 14 LYS HD2 H -7.091 -6.119 -3.773 1.00 . A A . 14 LYS HD2 1 1 9 4427 1 1 14 LYS HD3 H -5.475 -5.996 -4.474 1.00 . A A . 14 LYS HD3 1 1 9 4428 1 1 14 LYS HE2 H -5.093 -8.358 -4.003 1.00 . A A . 14 LYS HE2 1 1 9 4429 1 1 14 LYS HE3 H -6.705 -8.490 -3.305 1.00 . A A . 14 LYS HE3 1 1 9 4430 1 1 14 LYS HG2 H -4.519 -6.684 -2.299 1.00 . A A . 14 LYS HG2 1 1 9 4431 1 1 14 LYS HG3 H -6.144 -6.688 -1.612 1.00 . A A . 14 LYS HG3 1 1 9 4432 1 1 14 LYS HZ1 H -6.608 -9.291 -5.568 1.00 . A A . 14 LYS HZ1 1 1 9 4433 1 1 14 LYS HZ2 H -6.094 -7.792 -6.126 1.00 . A A . 14 LYS HZ2 1 1 9 4434 1 1 14 LYS HZ3 H -7.638 -7.970 -5.467 1.00 . A A . 14 LYS HZ3 1 1 9 4435 1 1 14 LYS N N -5.593 -4.807 0.372 1.00 . A A . 14 LYS N 1 1 9 4436 1 1 14 LYS NZ N -6.646 -8.267 -5.385 1.00 . A A . 14 LYS NZ 1 1 9 4437 1 1 14 LYS O O -5.381 -2.168 -0.274 1.00 . A A . 14 LYS O 1 1 9 4438 1 1 15 CYS C C -3.622 -0.444 -2.201 1.00 . A A . 15 CYS C 1 1 9 4439 1 1 15 CYS CA C -2.975 -1.072 -0.974 1.00 . A A . 15 CYS CA 1 1 9 4440 1 1 15 CYS CB C -1.458 -0.784 -0.965 1.00 . A A . 15 CYS CB 1 1 9 4441 1 1 15 CYS H H -2.585 -3.150 -1.211 1.00 . A A . 15 CYS H 1 1 9 4442 1 1 15 CYS HA H -3.432 -0.641 -0.095 1.00 . A A . 15 CYS HA 1 1 9 4443 1 1 15 CYS HB2 H -1.013 -1.226 -1.845 1.00 . A A . 15 CYS HB2 1 1 9 4444 1 1 15 CYS HB3 H -1.305 0.285 -0.996 1.00 . A A . 15 CYS HB3 1 1 9 4445 1 1 15 CYS N N -3.273 -2.499 -0.963 1.00 . A A . 15 CYS N 1 1 9 4446 1 1 15 CYS O O -3.761 -1.097 -3.244 1.00 . A A . 15 CYS O 1 1 9 4447 1 1 15 CYS SG S -0.551 -1.436 0.488 1.00 . A A . 15 CYS SG 1 1 9 4448 1 1 16 CYS C C -3.705 1.883 -4.246 1.00 . A A . 16 CYS C 1 1 9 4449 1 1 16 CYS CA C -4.702 1.476 -3.158 1.00 . A A . 16 CYS CA 1 1 9 4450 1 1 16 CYS CB C -5.430 2.695 -2.595 1.00 . A A . 16 CYS CB 1 1 9 4451 1 1 16 CYS H H -3.901 1.263 -1.237 1.00 . A A . 16 CYS H 1 1 9 4452 1 1 16 CYS HA H -5.431 0.801 -3.577 1.00 . A A . 16 CYS HA 1 1 9 4453 1 1 16 CYS HB2 H -4.702 3.398 -2.219 1.00 . A A . 16 CYS HB2 1 1 9 4454 1 1 16 CYS HB3 H -6.015 3.160 -3.375 1.00 . A A . 16 CYS HB3 1 1 9 4455 1 1 16 CYS N N -4.034 0.782 -2.079 1.00 . A A . 16 CYS N 1 1 9 4456 1 1 16 CYS O O -2.489 1.956 -3.996 1.00 . A A . 16 CYS O 1 1 9 4457 1 1 16 CYS SG S -6.559 2.273 -1.223 1.00 . A A . 16 CYS SG 1 1 9 4458 1 1 17 LYS C C -2.771 3.869 -6.257 1.00 . A A . 17 LYS C 1 1 9 4459 1 1 17 LYS CA C -3.429 2.529 -6.587 1.00 . A A . 17 LYS CA 1 1 9 4460 1 1 17 LYS CB C -4.339 2.647 -7.806 1.00 . A A . 17 LYS CB 1 1 9 4461 1 1 17 LYS CD C -4.624 3.119 -10.254 1.00 . A A . 17 LYS CD 1 1 9 4462 1 1 17 LYS CE C -5.337 1.801 -10.543 1.00 . A A . 17 LYS CE 1 1 9 4463 1 1 17 LYS CG C -3.632 2.987 -9.109 1.00 . A A . 17 LYS CG 1 1 9 4464 1 1 17 LYS H H -5.180 1.954 -5.575 1.00 . A A . 17 LYS H 1 1 9 4465 1 1 17 LYS HA H -2.664 1.789 -6.776 1.00 . A A . 17 LYS HA 1 1 9 4466 1 1 17 LYS HB2 H -4.839 1.699 -7.928 1.00 . A A . 17 LYS HB2 1 1 9 4467 1 1 17 LYS HB3 H -5.082 3.406 -7.609 1.00 . A A . 17 LYS HB3 1 1 9 4468 1 1 17 LYS HD2 H -5.360 3.861 -9.989 1.00 . A A . 17 LYS HD2 1 1 9 4469 1 1 17 LYS HD3 H -4.093 3.437 -11.139 1.00 . A A . 17 LYS HD3 1 1 9 4470 1 1 17 LYS HE2 H -4.611 1.099 -10.921 1.00 . A A . 17 LYS HE2 1 1 9 4471 1 1 17 LYS HE3 H -5.770 1.416 -9.633 1.00 . A A . 17 LYS HE3 1 1 9 4472 1 1 17 LYS HG2 H -3.101 3.919 -8.990 1.00 . A A . 17 LYS HG2 1 1 9 4473 1 1 17 LYS HG3 H -2.932 2.197 -9.339 1.00 . A A . 17 LYS HG3 1 1 9 4474 1 1 17 LYS HZ1 H -6.861 1.049 -11.747 1.00 . A A . 17 LYS HZ1 1 1 9 4475 1 1 17 LYS HZ2 H -6.020 2.331 -12.442 1.00 . A A . 17 LYS HZ2 1 1 9 4476 1 1 17 LYS HZ3 H -7.125 2.621 -11.211 1.00 . A A . 17 LYS HZ3 1 1 9 4477 1 1 17 LYS N N -4.217 2.098 -5.447 1.00 . A A . 17 LYS N 1 1 9 4478 1 1 17 LYS NZ N -6.398 1.958 -11.548 1.00 . A A . 17 LYS NZ 1 1 9 4479 1 1 17 LYS O O -3.404 4.747 -5.662 1.00 . A A . 17 LYS O 1 1 9 4480 1 1 18 GLY C C 0.214 4.780 -5.136 1.00 . A A . 18 GLY C 1 1 9 4481 1 1 18 GLY CA C -0.770 5.179 -6.207 1.00 . A A . 18 GLY CA 1 1 9 4482 1 1 18 GLY H H -1.087 3.328 -7.164 1.00 . A A . 18 GLY H 1 1 9 4483 1 1 18 GLY HA2 H -0.244 5.578 -7.062 1.00 . A A . 18 GLY HA2 1 1 9 4484 1 1 18 GLY HA3 H -1.441 5.925 -5.807 1.00 . A A . 18 GLY HA3 1 1 9 4485 1 1 18 GLY N N -1.523 4.010 -6.607 1.00 . A A . 18 GLY N 1 1 9 4486 1 1 18 GLY O O 1.159 5.515 -4.804 1.00 . A A . 18 GLY O 1 1 9 4487 1 1 19 MET C C 1.119 1.590 -4.167 1.00 . A A . 19 MET C 1 1 9 4488 1 1 19 MET CA C 0.813 2.969 -3.637 1.00 . A A . 19 MET CA 1 1 9 4489 1 1 19 MET CB C 0.157 2.860 -2.239 1.00 . A A . 19 MET CB 1 1 9 4490 1 1 19 MET CE C -2.338 3.467 -0.226 1.00 . A A . 19 MET CE 1 1 9 4491 1 1 19 MET CG C 0.048 4.177 -1.485 1.00 . A A . 19 MET CG 1 1 9 4492 1 1 19 MET H H -0.857 3.138 -4.838 1.00 . A A . 19 MET H 1 1 9 4493 1 1 19 MET HA H 1.731 3.532 -3.564 1.00 . A A . 19 MET HA 1 1 9 4494 1 1 19 MET HB2 H -0.838 2.462 -2.363 1.00 . A A . 19 MET HB2 1 1 9 4495 1 1 19 MET HB3 H 0.736 2.170 -1.641 1.00 . A A . 19 MET HB3 1 1 9 4496 1 1 19 MET HE1 H -2.300 2.535 -0.769 1.00 . A A . 19 MET HE1 1 1 9 4497 1 1 19 MET HE2 H -2.829 4.217 -0.827 1.00 . A A . 19 MET HE2 1 1 9 4498 1 1 19 MET HE3 H -2.892 3.325 0.690 1.00 . A A . 19 MET HE3 1 1 9 4499 1 1 19 MET HG2 H 1.051 4.552 -1.352 1.00 . A A . 19 MET HG2 1 1 9 4500 1 1 19 MET HG3 H -0.539 4.875 -2.061 1.00 . A A . 19 MET HG3 1 1 9 4501 1 1 19 MET N N -0.038 3.617 -4.585 1.00 . A A . 19 MET N 1 1 9 4502 1 1 19 MET O O 0.464 1.123 -5.106 1.00 . A A . 19 MET O 1 1 9 4503 1 1 19 MET SD S -0.677 4.007 0.167 1.00 . A A . 19 MET SD 1 1 9 4504 1 1 20 VAL C C 1.985 -1.299 -2.921 1.00 . A A . 20 VAL C 1 1 9 4505 1 1 20 VAL CA C 2.464 -0.373 -4.002 1.00 . A A . 20 VAL CA 1 1 9 4506 1 1 20 VAL CB C 4.005 -0.540 -4.095 1.00 . A A . 20 VAL CB 1 1 9 4507 1 1 20 VAL CG1 C 4.368 -1.836 -4.794 1.00 . A A . 20 VAL CG1 1 1 9 4508 1 1 20 VAL CG2 C 4.670 0.644 -4.767 1.00 . A A . 20 VAL CG2 1 1 9 4509 1 1 20 VAL H H 2.584 1.408 -2.881 1.00 . A A . 20 VAL H 1 1 9 4510 1 1 20 VAL HA H 2.010 -0.617 -4.950 1.00 . A A . 20 VAL HA 1 1 9 4511 1 1 20 VAL HB H 4.377 -0.616 -3.083 1.00 . A A . 20 VAL HB 1 1 9 4512 1 1 20 VAL HG11 H 4.004 -1.812 -5.811 1.00 . A A . 20 VAL HG11 1 1 9 4513 1 1 20 VAL HG12 H 3.908 -2.665 -4.276 1.00 . A A . 20 VAL HG12 1 1 9 4514 1 1 20 VAL HG13 H 5.441 -1.959 -4.797 1.00 . A A . 20 VAL HG13 1 1 9 4515 1 1 20 VAL HG21 H 5.740 0.493 -4.783 1.00 . A A . 20 VAL HG21 1 1 9 4516 1 1 20 VAL HG22 H 4.437 1.548 -4.225 1.00 . A A . 20 VAL HG22 1 1 9 4517 1 1 20 VAL HG23 H 4.305 0.723 -5.780 1.00 . A A . 20 VAL HG23 1 1 9 4518 1 1 20 VAL N N 2.089 0.958 -3.602 1.00 . A A . 20 VAL N 1 1 9 4519 1 1 20 VAL O O 2.144 -0.983 -1.730 1.00 . A A . 20 VAL O 1 1 9 4520 1 1 21 CYS C C 2.089 -4.256 -1.988 1.00 . A A . 21 CYS C 1 1 9 4521 1 1 21 CYS CA C 0.942 -3.323 -2.307 1.00 . A A . 21 CYS CA 1 1 9 4522 1 1 21 CYS CB C -0.294 -4.088 -2.799 1.00 . A A . 21 CYS CB 1 1 9 4523 1 1 21 CYS H H 1.273 -2.613 -4.242 1.00 . A A . 21 CYS H 1 1 9 4524 1 1 21 CYS HA H 0.693 -2.765 -1.417 1.00 . A A . 21 CYS HA 1 1 9 4525 1 1 21 CYS HB2 H -1.030 -3.366 -3.118 1.00 . A A . 21 CYS HB2 1 1 9 4526 1 1 21 CYS HB3 H -0.015 -4.704 -3.641 1.00 . A A . 21 CYS HB3 1 1 9 4527 1 1 21 CYS N N 1.393 -2.398 -3.290 1.00 . A A . 21 CYS N 1 1 9 4528 1 1 21 CYS O O 2.437 -5.144 -2.772 1.00 . A A . 21 CYS O 1 1 9 4529 1 1 21 CYS SG S -1.121 -5.161 -1.554 1.00 . A A . 21 CYS SG 1 1 9 4530 1 1 22 ARG C C 3.585 -5.090 1.092 1.00 . A A . 22 ARG C 1 1 9 4531 1 1 22 ARG CA C 3.797 -4.778 -0.365 1.00 . A A . 22 ARG CA 1 1 9 4532 1 1 22 ARG CB C 5.086 -3.961 -0.514 1.00 . A A . 22 ARG CB 1 1 9 4533 1 1 22 ARG CD C 6.923 -3.136 -1.948 1.00 . A A . 22 ARG CD 1 1 9 4534 1 1 22 ARG CG C 5.602 -3.863 -1.917 1.00 . A A . 22 ARG CG 1 1 9 4535 1 1 22 ARG CZ C 8.670 -2.498 -3.635 1.00 . A A . 22 ARG CZ 1 1 9 4536 1 1 22 ARG H H 2.344 -3.307 -0.276 1.00 . A A . 22 ARG H 1 1 9 4537 1 1 22 ARG HA H 3.905 -5.684 -0.940 1.00 . A A . 22 ARG HA 1 1 9 4538 1 1 22 ARG HB2 H 4.885 -2.956 -0.171 1.00 . A A . 22 ARG HB2 1 1 9 4539 1 1 22 ARG HB3 H 5.861 -4.378 0.109 1.00 . A A . 22 ARG HB3 1 1 9 4540 1 1 22 ARG HD2 H 6.790 -2.180 -1.464 1.00 . A A . 22 ARG HD2 1 1 9 4541 1 1 22 ARG HD3 H 7.619 -3.738 -1.385 1.00 . A A . 22 ARG HD3 1 1 9 4542 1 1 22 ARG HE H 6.789 -3.125 -4.037 1.00 . A A . 22 ARG HE 1 1 9 4543 1 1 22 ARG HG2 H 5.748 -4.879 -2.253 1.00 . A A . 22 ARG HG2 1 1 9 4544 1 1 22 ARG HG3 H 4.878 -3.356 -2.536 1.00 . A A . 22 ARG HG3 1 1 9 4545 1 1 22 ARG HH11 H 9.450 -2.607 -1.732 1.00 . A A . 22 ARG HH11 1 1 9 4546 1 1 22 ARG HH12 H 10.530 -2.053 -2.915 1.00 . A A . 22 ARG HH12 1 1 9 4547 1 1 22 ARG HH21 H 8.311 -2.348 -5.646 1.00 . A A . 22 ARG HH21 1 1 9 4548 1 1 22 ARG HH22 H 9.889 -1.924 -5.188 1.00 . A A . 22 ARG HH22 1 1 9 4549 1 1 22 ARG N N 2.682 -4.027 -0.852 1.00 . A A . 22 ARG N 1 1 9 4550 1 1 22 ARG NE N 7.434 -2.940 -3.318 1.00 . A A . 22 ARG NE 1 1 9 4551 1 1 22 ARG NH1 N 9.604 -2.375 -2.696 1.00 . A A . 22 ARG NH1 1 1 9 4552 1 1 22 ARG NH2 N 8.977 -2.234 -4.903 1.00 . A A . 22 ARG NH2 1 1 9 4553 1 1 22 ARG O O 2.438 -4.972 1.630 1.00 . A A . 22 ARG O 1 1 9 4554 1 1 23 LEU C C 4.158 -4.480 3.914 1.00 . A A . 23 LEU C 1 1 9 4555 1 1 23 LEU CA C 4.705 -5.707 3.183 1.00 . A A . 23 LEU CA 1 1 9 4556 1 1 23 LEU CB C 6.138 -6.006 3.641 1.00 . A A . 23 LEU CB 1 1 9 4557 1 1 23 LEU CD1 C 5.636 -7.601 5.516 1.00 . A A . 23 LEU CD1 1 1 9 4558 1 1 23 LEU CD2 C 7.807 -6.374 5.464 1.00 . A A . 23 LEU CD2 1 1 9 4559 1 1 23 LEU CG C 6.333 -6.308 5.129 1.00 . A A . 23 LEU CG 1 1 9 4560 1 1 23 LEU H H 5.500 -5.615 1.222 1.00 . A A . 23 LEU H 1 1 9 4561 1 1 23 LEU HA H 4.075 -6.556 3.399 1.00 . A A . 23 LEU HA 1 1 9 4562 1 1 23 LEU HB2 H 6.486 -6.864 3.086 1.00 . A A . 23 LEU HB2 1 1 9 4563 1 1 23 LEU HB3 H 6.761 -5.162 3.383 1.00 . A A . 23 LEU HB3 1 1 9 4564 1 1 23 LEU HD11 H 6.041 -8.417 4.937 1.00 . A A . 23 LEU HD11 1 1 9 4565 1 1 23 LEU HD12 H 4.577 -7.513 5.328 1.00 . A A . 23 LEU HD12 1 1 9 4566 1 1 23 LEU HD13 H 5.800 -7.791 6.567 1.00 . A A . 23 LEU HD13 1 1 9 4567 1 1 23 LEU HD21 H 7.926 -6.576 6.518 1.00 . A A . 23 LEU HD21 1 1 9 4568 1 1 23 LEU HD22 H 8.276 -5.432 5.222 1.00 . A A . 23 LEU HD22 1 1 9 4569 1 1 23 LEU HD23 H 8.270 -7.166 4.894 1.00 . A A . 23 LEU HD23 1 1 9 4570 1 1 23 LEU HG H 5.890 -5.511 5.706 1.00 . A A . 23 LEU HG 1 1 9 4571 1 1 23 LEU N N 4.679 -5.470 1.744 1.00 . A A . 23 LEU N 1 1 9 4572 1 1 23 LEU O O 3.624 -4.590 4.994 1.00 . A A . 23 LEU O 1 1 9 4573 1 1 24 TRP C C 3.181 -1.357 2.541 1.00 . A A . 24 TRP C 1 1 9 4574 1 1 24 TRP CA C 3.734 -2.100 3.767 1.00 . A A . 24 TRP CA 1 1 9 4575 1 1 24 TRP CB C 4.794 -1.251 4.509 1.00 . A A . 24 TRP CB 1 1 9 4576 1 1 24 TRP CD1 C 5.743 0.713 3.204 1.00 . A A . 24 TRP CD1 1 1 9 4577 1 1 24 TRP CD2 C 6.989 -1.130 3.048 1.00 . A A . 24 TRP CD2 1 1 9 4578 1 1 24 TRP CE2 C 7.600 -0.113 2.287 1.00 . A A . 24 TRP CE2 1 1 9 4579 1 1 24 TRP CE3 C 7.597 -2.383 3.104 1.00 . A A . 24 TRP CE3 1 1 9 4580 1 1 24 TRP CG C 5.798 -0.573 3.621 1.00 . A A . 24 TRP CG 1 1 9 4581 1 1 24 TRP CH2 C 9.356 -1.554 1.661 1.00 . A A . 24 TRP CH2 1 1 9 4582 1 1 24 TRP CZ2 C 8.784 -0.315 1.587 1.00 . A A . 24 TRP CZ2 1 1 9 4583 1 1 24 TRP CZ3 C 8.774 -2.584 2.411 1.00 . A A . 24 TRP CZ3 1 1 9 4584 1 1 24 TRP H H 4.776 -3.283 2.433 1.00 . A A . 24 TRP H 1 1 9 4585 1 1 24 TRP HA H 2.934 -2.370 4.435 1.00 . A A . 24 TRP HA 1 1 9 4586 1 1 24 TRP HB2 H 4.292 -0.484 5.079 1.00 . A A . 24 TRP HB2 1 1 9 4587 1 1 24 TRP HB3 H 5.331 -1.892 5.192 1.00 . A A . 24 TRP HB3 1 1 9 4588 1 1 24 TRP HD1 H 4.933 1.369 3.490 1.00 . A A . 24 TRP HD1 1 1 9 4589 1 1 24 TRP HE1 H 6.992 1.872 1.971 1.00 . A A . 24 TRP HE1 1 1 9 4590 1 1 24 TRP HE3 H 7.159 -3.184 3.681 1.00 . A A . 24 TRP HE3 1 1 9 4591 1 1 24 TRP HH2 H 10.278 -1.755 1.134 1.00 . A A . 24 TRP HH2 1 1 9 4592 1 1 24 TRP HZ2 H 9.250 0.466 1.004 1.00 . A A . 24 TRP HZ2 1 1 9 4593 1 1 24 TRP HZ3 H 9.257 -3.550 2.442 1.00 . A A . 24 TRP HZ3 1 1 9 4594 1 1 24 TRP N N 4.297 -3.321 3.287 1.00 . A A . 24 TRP N 1 1 9 4595 1 1 24 TRP NE1 N 6.816 1.002 2.396 1.00 . A A . 24 TRP NE1 1 1 9 4596 1 1 24 TRP O O 3.501 -1.745 1.407 1.00 . A A . 24 TRP O 1 1 9 4597 1 1 25 CYS C C 2.942 1.458 1.252 1.00 . A A . 25 CYS C 1 1 9 4598 1 1 25 CYS CA C 1.898 0.421 1.588 1.00 . A A . 25 CYS CA 1 1 9 4599 1 1 25 CYS CB C 0.531 1.077 1.838 1.00 . A A . 25 CYS CB 1 1 9 4600 1 1 25 CYS H H 2.040 -0.086 3.620 1.00 . A A . 25 CYS H 1 1 9 4601 1 1 25 CYS HA H 1.821 -0.263 0.754 1.00 . A A . 25 CYS HA 1 1 9 4602 1 1 25 CYS HB2 H 0.579 1.642 2.759 1.00 . A A . 25 CYS HB2 1 1 9 4603 1 1 25 CYS HB3 H 0.311 1.750 1.024 1.00 . A A . 25 CYS HB3 1 1 9 4604 1 1 25 CYS N N 2.352 -0.349 2.727 1.00 . A A . 25 CYS N 1 1 9 4605 1 1 25 CYS O O 3.191 2.394 2.026 1.00 . A A . 25 CYS O 1 1 9 4606 1 1 25 CYS SG S -0.867 -0.097 1.989 1.00 . A A . 25 CYS SG 1 1 9 4607 1 1 26 LYS C C 4.036 3.220 -1.210 1.00 . A A . 26 LYS C 1 1 9 4608 1 1 26 LYS CA C 4.608 2.182 -0.290 1.00 . A A . 26 LYS CA 1 1 9 4609 1 1 26 LYS CB C 5.740 1.424 -0.993 1.00 . A A . 26 LYS CB 1 1 9 4610 1 1 26 LYS CD C 7.943 1.561 -2.204 1.00 . A A . 26 LYS CD 1 1 9 4611 1 1 26 LYS CE C 9.050 2.494 -2.677 1.00 . A A . 26 LYS CE 1 1 9 4612 1 1 26 LYS CG C 6.876 2.326 -1.453 1.00 . A A . 26 LYS CG 1 1 9 4613 1 1 26 LYS H H 3.295 0.544 -0.454 1.00 . A A . 26 LYS H 1 1 9 4614 1 1 26 LYS HA H 4.998 2.654 0.598 1.00 . A A . 26 LYS HA 1 1 9 4615 1 1 26 LYS HB2 H 6.142 0.687 -0.313 1.00 . A A . 26 LYS HB2 1 1 9 4616 1 1 26 LYS HB3 H 5.336 0.921 -1.859 1.00 . A A . 26 LYS HB3 1 1 9 4617 1 1 26 LYS HD2 H 8.367 0.813 -1.549 1.00 . A A . 26 LYS HD2 1 1 9 4618 1 1 26 LYS HD3 H 7.493 1.082 -3.061 1.00 . A A . 26 LYS HD3 1 1 9 4619 1 1 26 LYS HE2 H 9.492 2.974 -1.817 1.00 . A A . 26 LYS HE2 1 1 9 4620 1 1 26 LYS HE3 H 9.802 1.907 -3.182 1.00 . A A . 26 LYS HE3 1 1 9 4621 1 1 26 LYS HG2 H 6.477 3.091 -2.101 1.00 . A A . 26 LYS HG2 1 1 9 4622 1 1 26 LYS HG3 H 7.322 2.790 -0.584 1.00 . A A . 26 LYS HG3 1 1 9 4623 1 1 26 LYS HZ1 H 9.338 4.160 -3.894 1.00 . A A . 26 LYS HZ1 1 1 9 4624 1 1 26 LYS HZ2 H 7.856 4.182 -3.168 1.00 . A A . 26 LYS HZ2 1 1 9 4625 1 1 26 LYS HZ3 H 8.152 3.139 -4.477 1.00 . A A . 26 LYS HZ3 1 1 9 4626 1 1 26 LYS N N 3.565 1.290 0.122 1.00 . A A . 26 LYS N 1 1 9 4627 1 1 26 LYS NZ N 8.552 3.545 -3.603 1.00 . A A . 26 LYS NZ 1 1 9 4628 1 1 26 LYS O O 3.494 2.882 -2.255 1.00 . A A . 26 LYS O 1 1 9 4629 1 1 27 LYS C C 4.591 5.852 -2.771 1.00 . A A . 27 LYS C 1 1 9 4630 1 1 27 LYS CA C 3.624 5.520 -1.661 1.00 . A A . 27 LYS CA 1 1 9 4631 1 1 27 LYS CB C 3.222 6.756 -0.840 1.00 . A A . 27 LYS CB 1 1 9 4632 1 1 27 LYS CD C 3.828 8.539 0.820 1.00 . A A . 27 LYS CD 1 1 9 4633 1 1 27 LYS CE C 4.891 9.090 1.772 1.00 . A A . 27 LYS CE 1 1 9 4634 1 1 27 LYS CG C 4.314 7.318 0.049 1.00 . A A . 27 LYS CG 1 1 9 4635 1 1 27 LYS H H 4.605 4.670 0.003 1.00 . A A . 27 LYS H 1 1 9 4636 1 1 27 LYS HA H 2.744 5.124 -2.145 1.00 . A A . 27 LYS HA 1 1 9 4637 1 1 27 LYS HB2 H 2.923 7.533 -1.528 1.00 . A A . 27 LYS HB2 1 1 9 4638 1 1 27 LYS HB3 H 2.373 6.493 -0.229 1.00 . A A . 27 LYS HB3 1 1 9 4639 1 1 27 LYS HD2 H 3.571 9.312 0.111 1.00 . A A . 27 LYS HD2 1 1 9 4640 1 1 27 LYS HD3 H 2.951 8.267 1.389 1.00 . A A . 27 LYS HD3 1 1 9 4641 1 1 27 LYS HE2 H 4.460 9.899 2.342 1.00 . A A . 27 LYS HE2 1 1 9 4642 1 1 27 LYS HE3 H 5.183 8.302 2.450 1.00 . A A . 27 LYS HE3 1 1 9 4643 1 1 27 LYS HG2 H 4.630 6.550 0.740 1.00 . A A . 27 LYS HG2 1 1 9 4644 1 1 27 LYS HG3 H 5.135 7.593 -0.594 1.00 . A A . 27 LYS HG3 1 1 9 4645 1 1 27 LYS HZ1 H 6.548 8.854 0.503 1.00 . A A . 27 LYS HZ1 1 1 9 4646 1 1 27 LYS HZ2 H 6.789 9.918 1.768 1.00 . A A . 27 LYS HZ2 1 1 9 4647 1 1 27 LYS HZ3 H 5.872 10.403 0.453 1.00 . A A . 27 LYS HZ3 1 1 9 4648 1 1 27 LYS N N 4.140 4.463 -0.837 1.00 . A A . 27 LYS N 1 1 9 4649 1 1 27 LYS NZ N 6.091 9.595 1.071 1.00 . A A . 27 LYS NZ 1 1 9 4650 1 1 27 LYS O O 5.805 5.954 -2.559 1.00 . A A . 27 LYS O 1 1 9 4651 1 1 28 LYS C C 4.800 7.724 -5.399 1.00 . A A . 28 LYS C 1 1 9 4652 1 1 28 LYS CA C 4.836 6.246 -5.129 1.00 . A A . 28 LYS CA 1 1 9 4653 1 1 28 LYS CB C 4.240 5.562 -6.358 1.00 . A A . 28 LYS CB 1 1 9 4654 1 1 28 LYS CD C 3.510 3.577 -7.617 1.00 . A A . 28 LYS CD 1 1 9 4655 1 1 28 LYS CE C 3.369 2.076 -7.703 1.00 . A A . 28 LYS CE 1 1 9 4656 1 1 28 LYS CG C 4.124 4.052 -6.316 1.00 . A A . 28 LYS CG 1 1 9 4657 1 1 28 LYS H H 3.085 5.852 -4.018 1.00 . A A . 28 LYS H 1 1 9 4658 1 1 28 LYS HA H 5.851 5.904 -4.993 1.00 . A A . 28 LYS HA 1 1 9 4659 1 1 28 LYS HB2 H 3.247 5.955 -6.512 1.00 . A A . 28 LYS HB2 1 1 9 4660 1 1 28 LYS HB3 H 4.842 5.832 -7.214 1.00 . A A . 28 LYS HB3 1 1 9 4661 1 1 28 LYS HD2 H 2.527 4.016 -7.716 1.00 . A A . 28 LYS HD2 1 1 9 4662 1 1 28 LYS HD3 H 4.133 3.921 -8.430 1.00 . A A . 28 LYS HD3 1 1 9 4663 1 1 28 LYS HE2 H 4.349 1.634 -7.622 1.00 . A A . 28 LYS HE2 1 1 9 4664 1 1 28 LYS HE3 H 2.740 1.734 -6.894 1.00 . A A . 28 LYS HE3 1 1 9 4665 1 1 28 LYS HG2 H 5.104 3.615 -6.194 1.00 . A A . 28 LYS HG2 1 1 9 4666 1 1 28 LYS HG3 H 3.482 3.764 -5.496 1.00 . A A . 28 LYS HG3 1 1 9 4667 1 1 28 LYS HZ1 H 1.839 2.104 -9.114 1.00 . A A . 28 LYS HZ1 1 1 9 4668 1 1 28 LYS HZ2 H 2.679 0.631 -9.023 1.00 . A A . 28 LYS HZ2 1 1 9 4669 1 1 28 LYS HZ3 H 3.382 1.956 -9.778 1.00 . A A . 28 LYS HZ3 1 1 9 4670 1 1 28 LYS N N 4.058 5.957 -3.949 1.00 . A A . 28 LYS N 1 1 9 4671 1 1 28 LYS NZ N 2.772 1.666 -8.988 1.00 . A A . 28 LYS NZ 1 1 9 4672 1 1 28 LYS O O 3.885 8.432 -4.932 1.00 . A A . 28 LYS O 1 1 9 4673 1 1 29 LEU C C 5.423 9.553 -8.092 1.00 . A A . 29 LEU C 1 1 9 4674 1 1 29 LEU CA C 5.747 9.556 -6.596 1.00 . A A . 29 LEU CA 1 1 9 4675 1 1 29 LEU CB C 7.049 10.322 -6.214 1.00 . A A . 29 LEU CB 1 1 9 4676 1 1 29 LEU CD1 C 8.747 9.850 -8.056 1.00 . A A . 29 LEU CD1 1 1 9 4677 1 1 29 LEU CD2 C 9.509 10.293 -5.711 1.00 . A A . 29 LEU CD2 1 1 9 4678 1 1 29 LEU CG C 8.413 9.698 -6.578 1.00 . A A . 29 LEU CG 1 1 9 4679 1 1 29 LEU H H 6.537 7.622 -6.322 1.00 . A A . 29 LEU H 1 1 9 4680 1 1 29 LEU HA H 4.902 10.016 -6.105 1.00 . A A . 29 LEU HA 1 1 9 4681 1 1 29 LEU HB2 H 7.006 11.294 -6.683 1.00 . A A . 29 LEU HB2 1 1 9 4682 1 1 29 LEU HB3 H 7.030 10.477 -5.145 1.00 . A A . 29 LEU HB3 1 1 9 4683 1 1 29 LEU HD11 H 7.978 9.377 -8.649 1.00 . A A . 29 LEU HD11 1 1 9 4684 1 1 29 LEU HD12 H 9.698 9.385 -8.262 1.00 . A A . 29 LEU HD12 1 1 9 4685 1 1 29 LEU HD13 H 8.801 10.900 -8.307 1.00 . A A . 29 LEU HD13 1 1 9 4686 1 1 29 LEU HD21 H 9.548 11.359 -5.867 1.00 . A A . 29 LEU HD21 1 1 9 4687 1 1 29 LEU HD22 H 10.460 9.853 -5.973 1.00 . A A . 29 LEU HD22 1 1 9 4688 1 1 29 LEU HD23 H 9.294 10.091 -4.672 1.00 . A A . 29 LEU HD23 1 1 9 4689 1 1 29 LEU HG H 8.367 8.640 -6.369 1.00 . A A . 29 LEU HG 1 1 9 4690 1 1 29 LEU N N 5.770 8.200 -6.118 1.00 . A A . 29 LEU N 1 1 9 4691 1 1 29 LEU O O 4.872 10.513 -8.636 1.00 . A A . 29 LEU O 1 1 9 4692 1 1 30 TRP C C 5.844 6.724 -10.360 1.00 . A A . 30 TRP C 1 1 9 4693 1 1 30 TRP CA C 5.445 8.154 -10.114 1.00 . A A . 30 TRP CA 1 1 9 4694 1 1 30 TRP CB C 6.194 9.100 -11.087 1.00 . A A . 30 TRP CB 1 1 9 4695 1 1 30 TRP CD1 C 6.803 8.263 -13.451 1.00 . A A . 30 TRP CD1 1 1 9 4696 1 1 30 TRP CD2 C 4.701 9.017 -13.262 1.00 . A A . 30 TRP CD2 1 1 9 4697 1 1 30 TRP CE2 C 4.906 8.592 -14.588 1.00 . A A . 30 TRP CE2 1 1 9 4698 1 1 30 TRP CE3 C 3.451 9.526 -12.906 1.00 . A A . 30 TRP CE3 1 1 9 4699 1 1 30 TRP CG C 5.929 8.805 -12.548 1.00 . A A . 30 TRP CG 1 1 9 4700 1 1 30 TRP CH2 C 2.700 9.166 -15.174 1.00 . A A . 30 TRP CH2 1 1 9 4701 1 1 30 TRP CZ2 C 3.910 8.665 -15.552 1.00 . A A . 30 TRP CZ2 1 1 9 4702 1 1 30 TRP CZ3 C 2.464 9.595 -13.868 1.00 . A A . 30 TRP CZ3 1 1 9 4703 1 1 30 TRP H H 6.206 7.728 -8.235 1.00 . A A . 30 TRP H 1 1 9 4704 1 1 30 TRP HA H 4.379 8.239 -10.257 1.00 . A A . 30 TRP HA 1 1 9 4705 1 1 30 TRP HB2 H 5.886 10.117 -10.894 1.00 . A A . 30 TRP HB2 1 1 9 4706 1 1 30 TRP HB3 H 7.257 9.015 -10.913 1.00 . A A . 30 TRP HB3 1 1 9 4707 1 1 30 TRP HD1 H 7.821 7.988 -13.218 1.00 . A A . 30 TRP HD1 1 1 9 4708 1 1 30 TRP HE1 H 6.626 7.782 -15.495 1.00 . A A . 30 TRP HE1 1 1 9 4709 1 1 30 TRP HE3 H 3.258 9.862 -11.899 1.00 . A A . 30 TRP HE3 1 1 9 4710 1 1 30 TRP HH2 H 1.898 9.238 -15.895 1.00 . A A . 30 TRP HH2 1 1 9 4711 1 1 30 TRP HZ2 H 4.065 8.339 -16.572 1.00 . A A . 30 TRP HZ2 1 1 9 4712 1 1 30 TRP HZ3 H 1.488 9.984 -13.614 1.00 . A A . 30 TRP HZ3 1 1 9 4713 1 1 30 TRP N N 5.734 8.437 -8.721 1.00 . A A . 30 TRP N 1 1 9 4714 1 1 30 TRP NE1 N 6.197 8.142 -14.683 1.00 . A A . 30 TRP NE1 1 1 9 4715 1 1 30 TRP O O 4.978 5.838 -10.329 1.00 . A A . 30 TRP O 1 1 9 4716 1 1 30 TRP OXT O 7.057 6.461 -10.478 1.00 . A A . 30 TRP OXT 1 1 10 4717 1 1 1 TYR C C -10.857 1.419 1.447 1.00 . A A . 1 TYR C 1 1 10 4718 1 1 1 TYR CA C -12.125 1.017 2.173 1.00 . A A . 1 TYR CA 1 1 10 4719 1 1 1 TYR CB C -12.471 2.000 3.320 1.00 . A A . 1 TYR CB 1 1 10 4720 1 1 1 TYR CD1 C -13.525 3.933 2.061 1.00 . A A . 1 TYR CD1 1 1 10 4721 1 1 1 TYR CD2 C -11.623 4.368 3.422 1.00 . A A . 1 TYR CD2 1 1 10 4722 1 1 1 TYR CE1 C -13.587 5.268 1.717 1.00 . A A . 1 TYR CE1 1 1 10 4723 1 1 1 TYR CE2 C -11.678 5.697 3.083 1.00 . A A . 1 TYR CE2 1 1 10 4724 1 1 1 TYR CG C -12.540 3.462 2.919 1.00 . A A . 1 TYR CG 1 1 10 4725 1 1 1 TYR CZ C -12.659 6.146 2.233 1.00 . A A . 1 TYR CZ 1 1 10 4726 1 1 1 TYR H1 H -11.868 -1.020 1.886 1.00 . A A . 1 TYR H1 1 1 10 4727 1 1 1 TYR H2 H -12.890 -0.626 3.154 1.00 . A A . 1 TYR H2 1 1 10 4728 1 1 1 TYR H3 H -11.227 -0.446 3.333 1.00 . A A . 1 TYR H3 1 1 10 4729 1 1 1 TYR HA H -12.922 1.033 1.446 1.00 . A A . 1 TYR HA 1 1 10 4730 1 1 1 TYR HB2 H -13.432 1.741 3.736 1.00 . A A . 1 TYR HB2 1 1 10 4731 1 1 1 TYR HB3 H -11.729 1.914 4.098 1.00 . A A . 1 TYR HB3 1 1 10 4732 1 1 1 TYR HD1 H -14.252 3.246 1.656 1.00 . A A . 1 TYR HD1 1 1 10 4733 1 1 1 TYR HD2 H -10.850 4.021 4.092 1.00 . A A . 1 TYR HD2 1 1 10 4734 1 1 1 TYR HE1 H -14.362 5.613 1.048 1.00 . A A . 1 TYR HE1 1 1 10 4735 1 1 1 TYR HE2 H -10.947 6.378 3.494 1.00 . A A . 1 TYR HE2 1 1 10 4736 1 1 1 TYR HH H -13.631 7.771 1.963 1.00 . A A . 1 TYR HH 1 1 10 4737 1 1 1 TYR N N -12.017 -0.347 2.665 1.00 . A A . 1 TYR N 1 1 10 4738 1 1 1 TYR O O -10.848 1.499 0.212 1.00 . A A . 1 TYR O 1 1 10 4739 1 1 1 TYR OH O -12.713 7.479 1.901 1.00 . A A . 1 TYR OH 1 1 10 4740 1 1 2 CYS C C -7.445 1.886 2.607 1.00 . A A . 2 CYS C 1 1 10 4741 1 1 2 CYS CA C -8.540 2.051 1.583 1.00 . A A . 2 CYS CA 1 1 10 4742 1 1 2 CYS CB C -8.616 3.527 1.123 1.00 . A A . 2 CYS CB 1 1 10 4743 1 1 2 CYS H H -9.782 1.517 3.158 1.00 . A A . 2 CYS H 1 1 10 4744 1 1 2 CYS HA H -8.338 1.420 0.731 1.00 . A A . 2 CYS HA 1 1 10 4745 1 1 2 CYS HB2 H -9.523 3.679 0.559 1.00 . A A . 2 CYS HB2 1 1 10 4746 1 1 2 CYS HB3 H -8.630 4.150 2.005 1.00 . A A . 2 CYS HB3 1 1 10 4747 1 1 2 CYS N N -9.785 1.640 2.181 1.00 . A A . 2 CYS N 1 1 10 4748 1 1 2 CYS O O -7.716 1.897 3.809 1.00 . A A . 2 CYS O 1 1 10 4749 1 1 2 CYS SG S -7.218 4.076 0.082 1.00 . A A . 2 CYS SG 1 1 10 4750 1 1 3 GLN C C -4.239 2.815 2.844 1.00 . A A . 3 GLN C 1 1 10 4751 1 1 3 GLN CA C -5.092 1.582 2.999 1.00 . A A . 3 GLN CA 1 1 10 4752 1 1 3 GLN CB C -4.247 0.355 2.640 1.00 . A A . 3 GLN CB 1 1 10 4753 1 1 3 GLN CD C -5.474 -1.294 4.131 1.00 . A A . 3 GLN CD 1 1 10 4754 1 1 3 GLN CG C -4.937 -1.000 2.747 1.00 . A A . 3 GLN CG 1 1 10 4755 1 1 3 GLN H H -6.114 1.767 1.171 1.00 . A A . 3 GLN H 1 1 10 4756 1 1 3 GLN HA H -5.447 1.497 4.014 1.00 . A A . 3 GLN HA 1 1 10 4757 1 1 3 GLN HB2 H -3.907 0.477 1.623 1.00 . A A . 3 GLN HB2 1 1 10 4758 1 1 3 GLN HB3 H -3.380 0.345 3.284 1.00 . A A . 3 GLN HB3 1 1 10 4759 1 1 3 GLN HE21 H -3.729 -2.066 4.715 1.00 . A A . 3 GLN HE21 1 1 10 4760 1 1 3 GLN HE22 H -4.993 -2.037 5.882 1.00 . A A . 3 GLN HE22 1 1 10 4761 1 1 3 GLN HG2 H -5.765 -1.022 2.052 1.00 . A A . 3 GLN HG2 1 1 10 4762 1 1 3 GLN HG3 H -4.231 -1.770 2.478 1.00 . A A . 3 GLN HG3 1 1 10 4763 1 1 3 GLN N N -6.241 1.723 2.143 1.00 . A A . 3 GLN N 1 1 10 4764 1 1 3 GLN NE2 N -4.653 -1.853 4.980 1.00 . A A . 3 GLN NE2 1 1 10 4765 1 1 3 GLN O O -4.114 3.340 1.746 1.00 . A A . 3 GLN O 1 1 10 4766 1 1 3 GLN OE1 O -6.627 -1.005 4.434 1.00 . A A . 3 GLN OE1 1 1 10 4767 1 1 4 LYS C C -1.369 4.005 3.773 1.00 . A A . 4 LYS C 1 1 10 4768 1 1 4 LYS CA C -2.829 4.452 3.875 1.00 . A A . 4 LYS CA 1 1 10 4769 1 1 4 LYS CB C -3.042 5.309 5.127 1.00 . A A . 4 LYS CB 1 1 10 4770 1 1 4 LYS CD C -4.632 6.613 6.577 1.00 . A A . 4 LYS CD 1 1 10 4771 1 1 4 LYS CE C -6.051 7.156 6.728 1.00 . A A . 4 LYS CE 1 1 10 4772 1 1 4 LYS CG C -4.470 5.813 5.294 1.00 . A A . 4 LYS CG 1 1 10 4773 1 1 4 LYS H H -3.851 2.842 4.775 1.00 . A A . 4 LYS H 1 1 10 4774 1 1 4 LYS HA H -3.089 5.029 3.002 1.00 . A A . 4 LYS HA 1 1 10 4775 1 1 4 LYS HB2 H -2.789 4.720 5.995 1.00 . A A . 4 LYS HB2 1 1 10 4776 1 1 4 LYS HB3 H -2.385 6.164 5.075 1.00 . A A . 4 LYS HB3 1 1 10 4777 1 1 4 LYS HD2 H -4.414 5.970 7.418 1.00 . A A . 4 LYS HD2 1 1 10 4778 1 1 4 LYS HD3 H -3.936 7.439 6.569 1.00 . A A . 4 LYS HD3 1 1 10 4779 1 1 4 LYS HE2 H -6.743 6.327 6.707 1.00 . A A . 4 LYS HE2 1 1 10 4780 1 1 4 LYS HE3 H -6.125 7.655 7.681 1.00 . A A . 4 LYS HE3 1 1 10 4781 1 1 4 LYS HG2 H -4.726 6.442 4.454 1.00 . A A . 4 LYS HG2 1 1 10 4782 1 1 4 LYS HG3 H -5.137 4.964 5.322 1.00 . A A . 4 LYS HG3 1 1 10 4783 1 1 4 LYS HZ1 H -5.743 8.909 5.635 1.00 . A A . 4 LYS HZ1 1 1 10 4784 1 1 4 LYS HZ2 H -7.362 8.499 5.786 1.00 . A A . 4 LYS HZ2 1 1 10 4785 1 1 4 LYS HZ3 H -6.388 7.663 4.710 1.00 . A A . 4 LYS HZ3 1 1 10 4786 1 1 4 LYS N N -3.689 3.293 3.922 1.00 . A A . 4 LYS N 1 1 10 4787 1 1 4 LYS NZ N -6.408 8.109 5.649 1.00 . A A . 4 LYS NZ 1 1 10 4788 1 1 4 LYS O O -1.052 2.863 4.074 1.00 . A A . 4 LYS O 1 1 10 4789 1 1 5 TRP C C 1.611 4.363 4.632 1.00 . A A . 5 TRP C 1 1 10 4790 1 1 5 TRP CA C 0.974 4.623 3.259 1.00 . A A . 5 TRP CA 1 1 10 4791 1 1 5 TRP CB C 1.700 5.800 2.571 1.00 . A A . 5 TRP CB 1 1 10 4792 1 1 5 TRP CD1 C 2.466 7.445 4.406 1.00 . A A . 5 TRP CD1 1 1 10 4793 1 1 5 TRP CD2 C 0.770 8.191 3.166 1.00 . A A . 5 TRP CD2 1 1 10 4794 1 1 5 TRP CE2 C 1.087 9.159 4.139 1.00 . A A . 5 TRP CE2 1 1 10 4795 1 1 5 TRP CE3 C -0.264 8.452 2.269 1.00 . A A . 5 TRP CE3 1 1 10 4796 1 1 5 TRP CG C 1.657 7.090 3.361 1.00 . A A . 5 TRP CG 1 1 10 4797 1 1 5 TRP CH2 C -0.598 10.588 3.349 1.00 . A A . 5 TRP CH2 1 1 10 4798 1 1 5 TRP CZ2 C 0.409 10.356 4.240 1.00 . A A . 5 TRP CZ2 1 1 10 4799 1 1 5 TRP CZ3 C -0.936 9.650 2.369 1.00 . A A . 5 TRP CZ3 1 1 10 4800 1 1 5 TRP H H -0.798 5.825 3.197 1.00 . A A . 5 TRP H 1 1 10 4801 1 1 5 TRP HA H 1.078 3.738 2.650 1.00 . A A . 5 TRP HA 1 1 10 4802 1 1 5 TRP HB2 H 2.735 5.541 2.410 1.00 . A A . 5 TRP HB2 1 1 10 4803 1 1 5 TRP HB3 H 1.232 5.983 1.615 1.00 . A A . 5 TRP HB3 1 1 10 4804 1 1 5 TRP HD1 H 3.251 6.823 4.811 1.00 . A A . 5 TRP HD1 1 1 10 4805 1 1 5 TRP HE1 H 2.544 9.132 5.642 1.00 . A A . 5 TRP HE1 1 1 10 4806 1 1 5 TRP HE3 H -0.544 7.746 1.501 1.00 . A A . 5 TRP HE3 1 1 10 4807 1 1 5 TRP HH2 H -1.151 11.514 3.389 1.00 . A A . 5 TRP HH2 1 1 10 4808 1 1 5 TRP HZ2 H 0.663 11.082 4.999 1.00 . A A . 5 TRP HZ2 1 1 10 4809 1 1 5 TRP HZ3 H -1.739 9.871 1.682 1.00 . A A . 5 TRP HZ3 1 1 10 4810 1 1 5 TRP N N -0.477 4.922 3.402 1.00 . A A . 5 TRP N 1 1 10 4811 1 1 5 TRP NE1 N 2.114 8.671 4.884 1.00 . A A . 5 TRP NE1 1 1 10 4812 1 1 5 TRP O O 2.745 3.882 4.759 1.00 . A A . 5 TRP O 1 1 10 4813 1 1 6 MET C C 0.761 3.254 7.559 1.00 . A A . 6 MET C 1 1 10 4814 1 1 6 MET CA C 1.294 4.582 7.018 1.00 . A A . 6 MET CA 1 1 10 4815 1 1 6 MET CB C 0.773 5.775 7.834 1.00 . A A . 6 MET CB 1 1 10 4816 1 1 6 MET CE C -0.668 8.651 7.536 1.00 . A A . 6 MET CE 1 1 10 4817 1 1 6 MET CG C -0.742 5.885 7.853 1.00 . A A . 6 MET CG 1 1 10 4818 1 1 6 MET H H 0.020 5.145 5.430 1.00 . A A . 6 MET H 1 1 10 4819 1 1 6 MET HA H 2.372 4.574 7.047 1.00 . A A . 6 MET HA 1 1 10 4820 1 1 6 MET HB2 H 1.125 5.693 8.850 1.00 . A A . 6 MET HB2 1 1 10 4821 1 1 6 MET HB3 H 1.167 6.682 7.396 1.00 . A A . 6 MET HB3 1 1 10 4822 1 1 6 MET HE1 H -1.011 8.480 6.525 1.00 . A A . 6 MET HE1 1 1 10 4823 1 1 6 MET HE2 H 0.410 8.620 7.564 1.00 . A A . 6 MET HE2 1 1 10 4824 1 1 6 MET HE3 H -1.005 9.623 7.865 1.00 . A A . 6 MET HE3 1 1 10 4825 1 1 6 MET HG2 H -1.098 5.861 6.833 1.00 . A A . 6 MET HG2 1 1 10 4826 1 1 6 MET HG3 H -1.145 5.036 8.386 1.00 . A A . 6 MET HG3 1 1 10 4827 1 1 6 MET N N 0.882 4.737 5.642 1.00 . A A . 6 MET N 1 1 10 4828 1 1 6 MET O O 0.963 2.903 8.729 1.00 . A A . 6 MET O 1 1 10 4829 1 1 6 MET SD S -1.352 7.393 8.621 1.00 . A A . 6 MET SD 1 1 10 4830 1 1 7 TRP C C 0.199 0.206 6.108 1.00 . A A . 7 TRP C 1 1 10 4831 1 1 7 TRP CA C -0.480 1.233 6.992 1.00 . A A . 7 TRP CA 1 1 10 4832 1 1 7 TRP CB C -2.002 1.198 6.755 1.00 . A A . 7 TRP CB 1 1 10 4833 1 1 7 TRP CD1 C -2.400 2.819 8.719 1.00 . A A . 7 TRP CD1 1 1 10 4834 1 1 7 TRP CD2 C -4.206 2.376 7.500 1.00 . A A . 7 TRP CD2 1 1 10 4835 1 1 7 TRP CE2 C -4.563 3.280 8.515 1.00 . A A . 7 TRP CE2 1 1 10 4836 1 1 7 TRP CE3 C -5.182 1.946 6.613 1.00 . A A . 7 TRP CE3 1 1 10 4837 1 1 7 TRP CG C -2.817 2.108 7.633 1.00 . A A . 7 TRP CG 1 1 10 4838 1 1 7 TRP CH2 C -6.789 3.318 7.771 1.00 . A A . 7 TRP CH2 1 1 10 4839 1 1 7 TRP CZ2 C -5.855 3.759 8.660 1.00 . A A . 7 TRP CZ2 1 1 10 4840 1 1 7 TRP CZ3 C -6.464 2.417 6.756 1.00 . A A . 7 TRP CZ3 1 1 10 4841 1 1 7 TRP H H -0.018 2.840 5.763 1.00 . A A . 7 TRP H 1 1 10 4842 1 1 7 TRP HA H -0.267 1.007 8.027 1.00 . A A . 7 TRP HA 1 1 10 4843 1 1 7 TRP HB2 H -2.197 1.486 5.732 1.00 . A A . 7 TRP HB2 1 1 10 4844 1 1 7 TRP HB3 H -2.354 0.187 6.900 1.00 . A A . 7 TRP HB3 1 1 10 4845 1 1 7 TRP HD1 H -1.383 2.820 9.089 1.00 . A A . 7 TRP HD1 1 1 10 4846 1 1 7 TRP HE1 H -3.393 4.136 10.022 1.00 . A A . 7 TRP HE1 1 1 10 4847 1 1 7 TRP HE3 H -4.942 1.241 5.833 1.00 . A A . 7 TRP HE3 1 1 10 4848 1 1 7 TRP HH2 H -7.809 3.661 7.848 1.00 . A A . 7 TRP HH2 1 1 10 4849 1 1 7 TRP HZ2 H -6.131 4.456 9.437 1.00 . A A . 7 TRP HZ2 1 1 10 4850 1 1 7 TRP HZ3 H -7.232 2.090 6.069 1.00 . A A . 7 TRP HZ3 1 1 10 4851 1 1 7 TRP N N 0.082 2.528 6.689 1.00 . A A . 7 TRP N 1 1 10 4852 1 1 7 TRP NE1 N -3.442 3.539 9.241 1.00 . A A . 7 TRP NE1 1 1 10 4853 1 1 7 TRP O O 1.143 0.533 5.364 1.00 . A A . 7 TRP O 1 1 10 4854 1 1 8 THR C C -0.708 -2.873 4.667 1.00 . A A . 8 THR C 1 1 10 4855 1 1 8 THR CA C 0.362 -2.082 5.451 1.00 . A A . 8 THR CA 1 1 10 4856 1 1 8 THR CB C 1.085 -2.978 6.481 1.00 . A A . 8 THR CB 1 1 10 4857 1 1 8 THR CG2 C 2.207 -2.218 7.192 1.00 . A A . 8 THR CG2 1 1 10 4858 1 1 8 THR H H -1.062 -1.233 6.683 1.00 . A A . 8 THR H 1 1 10 4859 1 1 8 THR HA H 1.083 -1.661 4.770 1.00 . A A . 8 THR HA 1 1 10 4860 1 1 8 THR HB H 1.504 -3.831 5.969 1.00 . A A . 8 THR HB 1 1 10 4861 1 1 8 THR HG1 H -0.263 -4.207 7.160 1.00 . A A . 8 THR HG1 1 1 10 4862 1 1 8 THR HG21 H 2.904 -1.812 6.472 1.00 . A A . 8 THR HG21 1 1 10 4863 1 1 8 THR HG22 H 2.734 -2.886 7.854 1.00 . A A . 8 THR HG22 1 1 10 4864 1 1 8 THR HG23 H 1.778 -1.407 7.764 1.00 . A A . 8 THR HG23 1 1 10 4865 1 1 8 THR N N -0.262 -1.006 6.162 1.00 . A A . 8 THR N 1 1 10 4866 1 1 8 THR O O -1.909 -2.580 4.822 1.00 . A A . 8 THR O 1 1 10 4867 1 1 8 THR OG1 O 0.147 -3.396 7.477 1.00 . A A . 8 THR OG1 1 1 10 4868 1 1 9 CYS C C -1.234 -6.075 3.315 1.00 . A A . 9 CYS C 1 1 10 4869 1 1 9 CYS CA C -1.405 -4.574 3.156 1.00 . A A . 9 CYS CA 1 1 10 4870 1 1 9 CYS CB C -1.564 -4.186 1.692 1.00 . A A . 9 CYS CB 1 1 10 4871 1 1 9 CYS H H 0.596 -4.072 3.578 1.00 . A A . 9 CYS H 1 1 10 4872 1 1 9 CYS HA H -2.311 -4.306 3.682 1.00 . A A . 9 CYS HA 1 1 10 4873 1 1 9 CYS HB2 H -2.485 -4.605 1.315 1.00 . A A . 9 CYS HB2 1 1 10 4874 1 1 9 CYS HB3 H -1.616 -3.109 1.620 1.00 . A A . 9 CYS HB3 1 1 10 4875 1 1 9 CYS N N -0.336 -3.840 3.806 1.00 . A A . 9 CYS N 1 1 10 4876 1 1 9 CYS O O -0.277 -6.541 3.949 1.00 . A A . 9 CYS O 1 1 10 4877 1 1 9 CYS SG S -0.236 -4.746 0.604 1.00 . A A . 9 CYS SG 1 1 10 4878 1 1 10 ASP C C -2.679 -8.768 1.492 1.00 . A A . 10 ASP C 1 1 10 4879 1 1 10 ASP CA C -2.197 -8.271 2.837 1.00 . A A . 10 ASP CA 1 1 10 4880 1 1 10 ASP CB C -3.221 -8.723 3.911 1.00 . A A . 10 ASP CB 1 1 10 4881 1 1 10 ASP CG C -2.936 -8.229 5.306 1.00 . A A . 10 ASP CG 1 1 10 4882 1 1 10 ASP H H -2.859 -6.398 2.205 1.00 . A A . 10 ASP H 1 1 10 4883 1 1 10 ASP HA H -1.218 -8.660 3.070 1.00 . A A . 10 ASP HA 1 1 10 4884 1 1 10 ASP HB2 H -4.204 -8.375 3.633 1.00 . A A . 10 ASP HB2 1 1 10 4885 1 1 10 ASP HB3 H -3.228 -9.802 3.930 1.00 . A A . 10 ASP HB3 1 1 10 4886 1 1 10 ASP N N -2.157 -6.823 2.752 1.00 . A A . 10 ASP N 1 1 10 4887 1 1 10 ASP O O -2.619 -8.037 0.505 1.00 . A A . 10 ASP O 1 1 10 4888 1 1 10 ASP OD1 O -2.324 -8.965 6.102 1.00 . A A . 10 ASP OD1 1 1 10 4889 1 1 10 ASP OD2 O -3.334 -7.096 5.639 1.00 . A A . 10 ASP OD2 1 1 10 4890 1 1 11 SER C C -5.214 -10.018 0.179 1.00 . A A . 11 SER C 1 1 10 4891 1 1 11 SER CA C -3.746 -10.478 0.221 1.00 . A A . 11 SER CA 1 1 10 4892 1 1 11 SER CB C -3.652 -11.997 0.168 1.00 . A A . 11 SER CB 1 1 10 4893 1 1 11 SER H H -3.052 -10.588 2.201 1.00 . A A . 11 SER H 1 1 10 4894 1 1 11 SER HA H -3.218 -10.050 -0.618 1.00 . A A . 11 SER HA 1 1 10 4895 1 1 11 SER HB2 H -4.283 -12.422 0.936 1.00 . A A . 11 SER HB2 1 1 10 4896 1 1 11 SER HB3 H -3.977 -12.345 -0.800 1.00 . A A . 11 SER HB3 1 1 10 4897 1 1 11 SER HG H -1.839 -12.386 -0.462 1.00 . A A . 11 SER HG 1 1 10 4898 1 1 11 SER N N -3.143 -9.986 1.433 1.00 . A A . 11 SER N 1 1 10 4899 1 1 11 SER O O -5.773 -9.749 -0.894 1.00 . A A . 11 SER O 1 1 10 4900 1 1 11 SER OG O -2.310 -12.425 0.383 1.00 . A A . 11 SER OG 1 1 10 4901 1 1 12 GLU C C -7.309 -7.940 1.368 1.00 . A A . 12 GLU C 1 1 10 4902 1 1 12 GLU CA C -7.208 -9.467 1.482 1.00 . A A . 12 GLU CA 1 1 10 4903 1 1 12 GLU CB C -7.842 -9.974 2.793 1.00 . A A . 12 GLU CB 1 1 10 4904 1 1 12 GLU CD C -7.813 -10.057 5.315 1.00 . A A . 12 GLU CD 1 1 10 4905 1 1 12 GLU CG C -7.100 -9.591 4.073 1.00 . A A . 12 GLU CG 1 1 10 4906 1 1 12 GLU H H -5.329 -10.169 2.171 1.00 . A A . 12 GLU H 1 1 10 4907 1 1 12 GLU HA H -7.745 -9.894 0.648 1.00 . A A . 12 GLU HA 1 1 10 4908 1 1 12 GLU HB2 H -8.844 -9.577 2.860 1.00 . A A . 12 GLU HB2 1 1 10 4909 1 1 12 GLU HB3 H -7.903 -11.050 2.749 1.00 . A A . 12 GLU HB3 1 1 10 4910 1 1 12 GLU HG2 H -6.114 -10.027 4.055 1.00 . A A . 12 GLU HG2 1 1 10 4911 1 1 12 GLU HG3 H -7.009 -8.515 4.107 1.00 . A A . 12 GLU HG3 1 1 10 4912 1 1 12 GLU N N -5.824 -9.915 1.362 1.00 . A A . 12 GLU N 1 1 10 4913 1 1 12 GLU O O -8.192 -7.411 0.704 1.00 . A A . 12 GLU O 1 1 10 4914 1 1 12 GLU OE1 O -7.658 -11.229 5.702 1.00 . A A . 12 GLU OE1 1 1 10 4915 1 1 12 GLU OE2 O -8.552 -9.254 5.927 1.00 . A A . 12 GLU OE2 1 1 10 4916 1 1 13 ARG C C -5.282 -5.390 1.035 1.00 . A A . 13 ARG C 1 1 10 4917 1 1 13 ARG CA C -6.358 -5.803 1.988 1.00 . A A . 13 ARG CA 1 1 10 4918 1 1 13 ARG CB C -6.051 -5.227 3.370 1.00 . A A . 13 ARG CB 1 1 10 4919 1 1 13 ARG CD C -6.760 -4.947 5.756 1.00 . A A . 13 ARG CD 1 1 10 4920 1 1 13 ARG CG C -7.142 -5.459 4.382 1.00 . A A . 13 ARG CG 1 1 10 4921 1 1 13 ARG CZ C -5.490 -5.940 7.652 1.00 . A A . 13 ARG CZ 1 1 10 4922 1 1 13 ARG H H -5.757 -7.731 2.576 1.00 . A A . 13 ARG H 1 1 10 4923 1 1 13 ARG HA H -7.312 -5.428 1.653 1.00 . A A . 13 ARG HA 1 1 10 4924 1 1 13 ARG HB2 H -5.144 -5.681 3.742 1.00 . A A . 13 ARG HB2 1 1 10 4925 1 1 13 ARG HB3 H -5.894 -4.162 3.276 1.00 . A A . 13 ARG HB3 1 1 10 4926 1 1 13 ARG HD2 H -6.496 -3.902 5.686 1.00 . A A . 13 ARG HD2 1 1 10 4927 1 1 13 ARG HD3 H -7.621 -5.061 6.397 1.00 . A A . 13 ARG HD3 1 1 10 4928 1 1 13 ARG HE H -4.940 -6.051 5.742 1.00 . A A . 13 ARG HE 1 1 10 4929 1 1 13 ARG HG2 H -8.032 -4.945 4.053 1.00 . A A . 13 ARG HG2 1 1 10 4930 1 1 13 ARG HG3 H -7.333 -6.519 4.439 1.00 . A A . 13 ARG HG3 1 1 10 4931 1 1 13 ARG HH11 H -7.127 -4.869 8.272 1.00 . A A . 13 ARG HH11 1 1 10 4932 1 1 13 ARG HH12 H -6.255 -5.634 9.520 1.00 . A A . 13 ARG HH12 1 1 10 4933 1 1 13 ARG HH21 H -3.832 -7.033 7.367 1.00 . A A . 13 ARG HH21 1 1 10 4934 1 1 13 ARG HH22 H -4.324 -6.944 9.010 1.00 . A A . 13 ARG HH22 1 1 10 4935 1 1 13 ARG N N -6.418 -7.250 2.038 1.00 . A A . 13 ARG N 1 1 10 4936 1 1 13 ARG NE N -5.634 -5.690 6.347 1.00 . A A . 13 ARG NE 1 1 10 4937 1 1 13 ARG NH1 N -6.347 -5.444 8.538 1.00 . A A . 13 ARG NH1 1 1 10 4938 1 1 13 ARG NH2 N -4.480 -6.680 8.055 1.00 . A A . 13 ARG NH2 1 1 10 4939 1 1 13 ARG O O -4.133 -5.706 1.264 1.00 . A A . 13 ARG O 1 1 10 4940 1 1 14 LYS C C -4.440 -2.767 -0.745 1.00 . A A . 14 LYS C 1 1 10 4941 1 1 14 LYS CA C -4.617 -4.255 -0.936 1.00 . A A . 14 LYS CA 1 1 10 4942 1 1 14 LYS CB C -4.984 -4.553 -2.404 1.00 . A A . 14 LYS CB 1 1 10 4943 1 1 14 LYS CD C -6.492 -4.072 -4.395 1.00 . A A . 14 LYS CD 1 1 10 4944 1 1 14 LYS CE C -5.365 -3.586 -5.310 1.00 . A A . 14 LYS CE 1 1 10 4945 1 1 14 LYS CG C -6.208 -3.791 -2.921 1.00 . A A . 14 LYS CG 1 1 10 4946 1 1 14 LYS H H -6.569 -4.517 -0.188 1.00 . A A . 14 LYS H 1 1 10 4947 1 1 14 LYS HA H -3.690 -4.751 -0.692 1.00 . A A . 14 LYS HA 1 1 10 4948 1 1 14 LYS HB2 H -4.136 -4.291 -3.019 1.00 . A A . 14 LYS HB2 1 1 10 4949 1 1 14 LYS HB3 H -5.173 -5.611 -2.506 1.00 . A A . 14 LYS HB3 1 1 10 4950 1 1 14 LYS HD2 H -6.615 -5.136 -4.527 1.00 . A A . 14 LYS HD2 1 1 10 4951 1 1 14 LYS HD3 H -7.409 -3.573 -4.671 1.00 . A A . 14 LYS HD3 1 1 10 4952 1 1 14 LYS HE2 H -4.440 -4.050 -5.005 1.00 . A A . 14 LYS HE2 1 1 10 4953 1 1 14 LYS HE3 H -5.587 -3.891 -6.321 1.00 . A A . 14 LYS HE3 1 1 10 4954 1 1 14 LYS HG2 H -7.071 -4.067 -2.335 1.00 . A A . 14 LYS HG2 1 1 10 4955 1 1 14 LYS HG3 H -6.020 -2.734 -2.794 1.00 . A A . 14 LYS HG3 1 1 10 4956 1 1 14 LYS HZ1 H -6.053 -1.624 -5.574 1.00 . A A . 14 LYS HZ1 1 1 10 4957 1 1 14 LYS HZ2 H -4.413 -1.837 -5.916 1.00 . A A . 14 LYS HZ2 1 1 10 4958 1 1 14 LYS HZ3 H -4.924 -1.767 -4.330 1.00 . A A . 14 LYS HZ3 1 1 10 4959 1 1 14 LYS N N -5.625 -4.725 -0.019 1.00 . A A . 14 LYS N 1 1 10 4960 1 1 14 LYS NZ N -5.184 -2.116 -5.278 1.00 . A A . 14 LYS NZ 1 1 10 4961 1 1 14 LYS O O -5.382 -2.077 -0.324 1.00 . A A . 14 LYS O 1 1 10 4962 1 1 15 CYS C C -3.788 -0.190 -2.108 1.00 . A A . 15 CYS C 1 1 10 4963 1 1 15 CYS CA C -3.022 -0.845 -0.967 1.00 . A A . 15 CYS CA 1 1 10 4964 1 1 15 CYS CB C -1.530 -0.544 -1.072 1.00 . A A . 15 CYS CB 1 1 10 4965 1 1 15 CYS H H -2.529 -2.876 -1.258 1.00 . A A . 15 CYS H 1 1 10 4966 1 1 15 CYS HA H -3.407 -0.480 -0.029 1.00 . A A . 15 CYS HA 1 1 10 4967 1 1 15 CYS HB2 H -1.173 -0.845 -2.046 1.00 . A A . 15 CYS HB2 1 1 10 4968 1 1 15 CYS HB3 H -1.376 0.517 -0.949 1.00 . A A . 15 CYS HB3 1 1 10 4969 1 1 15 CYS N N -3.262 -2.272 -1.020 1.00 . A A . 15 CYS N 1 1 10 4970 1 1 15 CYS O O -4.072 -0.849 -3.124 1.00 . A A . 15 CYS O 1 1 10 4971 1 1 15 CYS SG S -0.521 -1.401 0.179 1.00 . A A . 15 CYS SG 1 1 10 4972 1 1 16 CYS C C -4.117 2.130 -4.150 1.00 . A A . 16 CYS C 1 1 10 4973 1 1 16 CYS CA C -4.940 1.740 -2.934 1.00 . A A . 16 CYS CA 1 1 10 4974 1 1 16 CYS CB C -5.633 2.927 -2.282 1.00 . A A . 16 CYS CB 1 1 10 4975 1 1 16 CYS H H -3.853 1.545 -1.151 1.00 . A A . 16 CYS H 1 1 10 4976 1 1 16 CYS HA H -5.696 1.044 -3.260 1.00 . A A . 16 CYS HA 1 1 10 4977 1 1 16 CYS HB2 H -4.891 3.601 -1.876 1.00 . A A . 16 CYS HB2 1 1 10 4978 1 1 16 CYS HB3 H -6.235 3.445 -3.012 1.00 . A A . 16 CYS HB3 1 1 10 4979 1 1 16 CYS N N -4.141 1.050 -1.948 1.00 . A A . 16 CYS N 1 1 10 4980 1 1 16 CYS O O -2.887 2.124 -4.097 1.00 . A A . 16 CYS O 1 1 10 4981 1 1 16 CYS SG S -6.729 2.393 -0.928 1.00 . A A . 16 CYS SG 1 1 10 4982 1 1 17 LYS C C -3.287 4.023 -6.287 1.00 . A A . 17 LYS C 1 1 10 4983 1 1 17 LYS CA C -4.147 2.784 -6.500 1.00 . A A . 17 LYS CA 1 1 10 4984 1 1 17 LYS CB C -5.200 3.002 -7.595 1.00 . A A . 17 LYS CB 1 1 10 4985 1 1 17 LYS CD C -5.732 3.346 -10.046 1.00 . A A . 17 LYS CD 1 1 10 4986 1 1 17 LYS CE C -6.457 2.002 -10.211 1.00 . A A . 17 LYS CE 1 1 10 4987 1 1 17 LYS CG C -4.635 3.297 -8.978 1.00 . A A . 17 LYS CG 1 1 10 4988 1 1 17 LYS H H -5.779 2.396 -5.230 1.00 . A A . 17 LYS H 1 1 10 4989 1 1 17 LYS HA H -3.502 1.964 -6.785 1.00 . A A . 17 LYS HA 1 1 10 4990 1 1 17 LYS HB2 H -5.809 2.115 -7.657 1.00 . A A . 17 LYS HB2 1 1 10 4991 1 1 17 LYS HB3 H -5.826 3.833 -7.303 1.00 . A A . 17 LYS HB3 1 1 10 4992 1 1 17 LYS HD2 H -6.458 4.094 -9.764 1.00 . A A . 17 LYS HD2 1 1 10 4993 1 1 17 LYS HD3 H -5.286 3.622 -10.990 1.00 . A A . 17 LYS HD3 1 1 10 4994 1 1 17 LYS HE2 H -6.922 1.726 -9.277 1.00 . A A . 17 LYS HE2 1 1 10 4995 1 1 17 LYS HE3 H -7.223 2.121 -10.962 1.00 . A A . 17 LYS HE3 1 1 10 4996 1 1 17 LYS HG2 H -4.131 4.251 -8.949 1.00 . A A . 17 LYS HG2 1 1 10 4997 1 1 17 LYS HG3 H -3.926 2.525 -9.232 1.00 . A A . 17 LYS HG3 1 1 10 4998 1 1 17 LYS HZ1 H -5.112 1.119 -11.556 1.00 . A A . 17 LYS HZ1 1 1 10 4999 1 1 17 LYS HZ2 H -6.042 0.006 -10.716 1.00 . A A . 17 LYS HZ2 1 1 10 5000 1 1 17 LYS HZ3 H -4.768 0.778 -9.949 1.00 . A A . 17 LYS HZ3 1 1 10 5001 1 1 17 LYS N N -4.798 2.418 -5.253 1.00 . A A . 17 LYS N 1 1 10 5002 1 1 17 LYS NZ N -5.540 0.912 -10.632 1.00 . A A . 17 LYS NZ 1 1 10 5003 1 1 17 LYS O O -3.784 5.075 -5.860 1.00 . A A . 17 LYS O 1 1 10 5004 1 1 18 GLY C C -0.145 4.521 -5.169 1.00 . A A . 18 GLY C 1 1 10 5005 1 1 18 GLY CA C -1.076 4.938 -6.287 1.00 . A A . 18 GLY CA 1 1 10 5006 1 1 18 GLY H H -1.706 3.050 -6.971 1.00 . A A . 18 GLY H 1 1 10 5007 1 1 18 GLY HA2 H -0.503 5.145 -7.179 1.00 . A A . 18 GLY HA2 1 1 10 5008 1 1 18 GLY HA3 H -1.608 5.828 -5.986 1.00 . A A . 18 GLY HA3 1 1 10 5009 1 1 18 GLY N N -2.018 3.886 -6.562 1.00 . A A . 18 GLY N 1 1 10 5010 1 1 18 GLY O O 0.603 5.323 -4.637 1.00 . A A . 18 GLY O 1 1 10 5011 1 1 19 MET C C 0.925 1.257 -4.249 1.00 . A A . 19 MET C 1 1 10 5012 1 1 19 MET CA C 0.593 2.647 -3.779 1.00 . A A . 19 MET CA 1 1 10 5013 1 1 19 MET CB C -0.150 2.520 -2.439 1.00 . A A . 19 MET CB 1 1 10 5014 1 1 19 MET CE C -1.897 5.304 0.084 1.00 . A A . 19 MET CE 1 1 10 5015 1 1 19 MET CG C -0.509 3.822 -1.773 1.00 . A A . 19 MET CG 1 1 10 5016 1 1 19 MET H H -0.947 2.696 -5.177 1.00 . A A . 19 MET H 1 1 10 5017 1 1 19 MET HA H 1.492 3.229 -3.644 1.00 . A A . 19 MET HA 1 1 10 5018 1 1 19 MET HB2 H -1.070 1.981 -2.614 1.00 . A A . 19 MET HB2 1 1 10 5019 1 1 19 MET HB3 H 0.462 1.944 -1.761 1.00 . A A . 19 MET HB3 1 1 10 5020 1 1 19 MET HE1 H -2.554 5.344 0.939 1.00 . A A . 19 MET HE1 1 1 10 5021 1 1 19 MET HE2 H -2.363 5.809 -0.750 1.00 . A A . 19 MET HE2 1 1 10 5022 1 1 19 MET HE3 H -0.964 5.791 0.323 1.00 . A A . 19 MET HE3 1 1 10 5023 1 1 19 MET HG2 H 0.418 4.237 -1.404 1.00 . A A . 19 MET HG2 1 1 10 5024 1 1 19 MET HG3 H -0.977 4.488 -2.480 1.00 . A A . 19 MET HG3 1 1 10 5025 1 1 19 MET N N -0.249 3.267 -4.787 1.00 . A A . 19 MET N 1 1 10 5026 1 1 19 MET O O 0.207 0.706 -5.077 1.00 . A A . 19 MET O 1 1 10 5027 1 1 19 MET SD S -1.584 3.594 -0.351 1.00 . A A . 19 MET SD 1 1 10 5028 1 1 20 VAL C C 2.006 -1.521 -2.846 1.00 . A A . 20 VAL C 1 1 10 5029 1 1 20 VAL CA C 2.310 -0.659 -4.066 1.00 . A A . 20 VAL CA 1 1 10 5030 1 1 20 VAL CB C 3.789 -0.823 -4.562 1.00 . A A . 20 VAL CB 1 1 10 5031 1 1 20 VAL CG1 C 4.804 -0.364 -3.531 1.00 . A A . 20 VAL CG1 1 1 10 5032 1 1 20 VAL CG2 C 4.071 -2.249 -5.001 1.00 . A A . 20 VAL CG2 1 1 10 5033 1 1 20 VAL H H 2.553 1.221 -3.146 1.00 . A A . 20 VAL H 1 1 10 5034 1 1 20 VAL HA H 1.630 -0.962 -4.852 1.00 . A A . 20 VAL HA 1 1 10 5035 1 1 20 VAL HB H 3.907 -0.182 -5.426 1.00 . A A . 20 VAL HB 1 1 10 5036 1 1 20 VAL HG11 H 4.646 0.685 -3.327 1.00 . A A . 20 VAL HG11 1 1 10 5037 1 1 20 VAL HG12 H 5.804 -0.515 -3.911 1.00 . A A . 20 VAL HG12 1 1 10 5038 1 1 20 VAL HG13 H 4.672 -0.931 -2.621 1.00 . A A . 20 VAL HG13 1 1 10 5039 1 1 20 VAL HG21 H 3.426 -2.508 -5.827 1.00 . A A . 20 VAL HG21 1 1 10 5040 1 1 20 VAL HG22 H 3.879 -2.918 -4.175 1.00 . A A . 20 VAL HG22 1 1 10 5041 1 1 20 VAL HG23 H 5.104 -2.339 -5.303 1.00 . A A . 20 VAL HG23 1 1 10 5042 1 1 20 VAL N N 1.976 0.697 -3.750 1.00 . A A . 20 VAL N 1 1 10 5043 1 1 20 VAL O O 2.307 -1.134 -1.700 1.00 . A A . 20 VAL O 1 1 10 5044 1 1 21 CYS C C 2.013 -4.484 -1.644 1.00 . A A . 21 CYS C 1 1 10 5045 1 1 21 CYS CA C 0.925 -3.507 -2.019 1.00 . A A . 21 CYS CA 1 1 10 5046 1 1 21 CYS CB C -0.351 -4.243 -2.438 1.00 . A A . 21 CYS CB 1 1 10 5047 1 1 21 CYS H H 1.215 -2.922 -4.008 1.00 . A A . 21 CYS H 1 1 10 5048 1 1 21 CYS HA H 0.700 -2.890 -1.161 1.00 . A A . 21 CYS HA 1 1 10 5049 1 1 21 CYS HB2 H -1.074 -3.521 -2.789 1.00 . A A . 21 CYS HB2 1 1 10 5050 1 1 21 CYS HB3 H -0.102 -4.910 -3.250 1.00 . A A . 21 CYS HB3 1 1 10 5051 1 1 21 CYS N N 1.371 -2.642 -3.079 1.00 . A A . 21 CYS N 1 1 10 5052 1 1 21 CYS O O 2.330 -5.407 -2.397 1.00 . A A . 21 CYS O 1 1 10 5053 1 1 21 CYS SG S -1.175 -5.241 -1.128 1.00 . A A . 21 CYS SG 1 1 10 5054 1 1 22 ARG C C 3.512 -5.159 1.572 1.00 . A A . 22 ARG C 1 1 10 5055 1 1 22 ARG CA C 3.648 -5.068 0.057 1.00 . A A . 22 ARG CA 1 1 10 5056 1 1 22 ARG CB C 5.001 -4.478 -0.323 1.00 . A A . 22 ARG CB 1 1 10 5057 1 1 22 ARG CD C 6.607 -4.049 -2.146 1.00 . A A . 22 ARG CD 1 1 10 5058 1 1 22 ARG CG C 5.313 -4.670 -1.769 1.00 . A A . 22 ARG CG 1 1 10 5059 1 1 22 ARG CZ C 7.947 -3.751 -4.208 1.00 . A A . 22 ARG CZ 1 1 10 5060 1 1 22 ARG H H 2.307 -3.480 0.048 1.00 . A A . 22 ARG H 1 1 10 5061 1 1 22 ARG HA H 3.576 -6.051 -0.385 1.00 . A A . 22 ARG HA 1 1 10 5062 1 1 22 ARG HB2 H 4.998 -3.419 -0.112 1.00 . A A . 22 ARG HB2 1 1 10 5063 1 1 22 ARG HB3 H 5.784 -4.949 0.250 1.00 . A A . 22 ARG HB3 1 1 10 5064 1 1 22 ARG HD2 H 6.580 -3.011 -1.850 1.00 . A A . 22 ARG HD2 1 1 10 5065 1 1 22 ARG HD3 H 7.380 -4.574 -1.607 1.00 . A A . 22 ARG HD3 1 1 10 5066 1 1 22 ARG HE H 6.103 -4.561 -4.091 1.00 . A A . 22 ARG HE 1 1 10 5067 1 1 22 ARG HG2 H 5.388 -5.738 -1.907 1.00 . A A . 22 ARG HG2 1 1 10 5068 1 1 22 ARG HG3 H 4.509 -4.268 -2.365 1.00 . A A . 22 ARG HG3 1 1 10 5069 1 1 22 ARG HH11 H 8.972 -3.196 -2.511 1.00 . A A . 22 ARG HH11 1 1 10 5070 1 1 22 ARG HH12 H 9.813 -2.938 -3.958 1.00 . A A . 22 ARG HH12 1 1 10 5071 1 1 22 ARG HH21 H 7.277 -4.218 -6.081 1.00 . A A . 22 ARG HH21 1 1 10 5072 1 1 22 ARG HH22 H 8.841 -3.559 -6.036 1.00 . A A . 22 ARG HH22 1 1 10 5073 1 1 22 ARG N N 2.601 -4.250 -0.488 1.00 . A A . 22 ARG N 1 1 10 5074 1 1 22 ARG NE N 6.847 -4.164 -3.584 1.00 . A A . 22 ARG NE 1 1 10 5075 1 1 22 ARG NH1 N 8.975 -3.266 -3.513 1.00 . A A . 22 ARG NH1 1 1 10 5076 1 1 22 ARG NH2 N 8.026 -3.847 -5.527 1.00 . A A . 22 ARG NH2 1 1 10 5077 1 1 22 ARG O O 2.373 -4.986 2.147 1.00 . A A . 22 ARG O 1 1 10 5078 1 1 23 LEU C C 4.098 -4.309 4.280 1.00 . A A . 23 LEU C 1 1 10 5079 1 1 23 LEU CA C 4.756 -5.528 3.684 1.00 . A A . 23 LEU CA 1 1 10 5080 1 1 23 LEU CB C 6.224 -5.599 4.120 1.00 . A A . 23 LEU CB 1 1 10 5081 1 1 23 LEU CD1 C 5.843 -6.871 6.263 1.00 . A A . 23 LEU CD1 1 1 10 5082 1 1 23 LEU CD2 C 7.979 -5.630 5.910 1.00 . A A . 23 LEU CD2 1 1 10 5083 1 1 23 LEU CG C 6.488 -5.647 5.633 1.00 . A A . 23 LEU CG 1 1 10 5084 1 1 23 LEU H H 5.434 -5.696 1.679 1.00 . A A . 23 LEU H 1 1 10 5085 1 1 23 LEU HA H 4.237 -6.412 4.023 1.00 . A A . 23 LEU HA 1 1 10 5086 1 1 23 LEU HB2 H 6.669 -6.475 3.675 1.00 . A A . 23 LEU HB2 1 1 10 5087 1 1 23 LEU HB3 H 6.727 -4.728 3.725 1.00 . A A . 23 LEU HB3 1 1 10 5088 1 1 23 LEU HD11 H 6.071 -6.895 7.318 1.00 . A A . 23 LEU HD11 1 1 10 5089 1 1 23 LEU HD12 H 6.223 -7.762 5.788 1.00 . A A . 23 LEU HD12 1 1 10 5090 1 1 23 LEU HD13 H 4.773 -6.821 6.129 1.00 . A A . 23 LEU HD13 1 1 10 5091 1 1 23 LEU HD21 H 8.150 -5.670 6.975 1.00 . A A . 23 LEU HD21 1 1 10 5092 1 1 23 LEU HD22 H 8.408 -4.723 5.511 1.00 . A A . 23 LEU HD22 1 1 10 5093 1 1 23 LEU HD23 H 8.441 -6.484 5.437 1.00 . A A . 23 LEU HD23 1 1 10 5094 1 1 23 LEU HG H 6.050 -4.774 6.091 1.00 . A A . 23 LEU HG 1 1 10 5095 1 1 23 LEU N N 4.646 -5.472 2.224 1.00 . A A . 23 LEU N 1 1 10 5096 1 1 23 LEU O O 3.371 -4.412 5.256 1.00 . A A . 23 LEU O 1 1 10 5097 1 1 24 TRP C C 3.162 -1.320 2.731 1.00 . A A . 24 TRP C 1 1 10 5098 1 1 24 TRP CA C 3.656 -1.973 4.008 1.00 . A A . 24 TRP CA 1 1 10 5099 1 1 24 TRP CB C 4.519 -1.009 4.852 1.00 . A A . 24 TRP CB 1 1 10 5100 1 1 24 TRP CD1 C 5.671 0.764 3.428 1.00 . A A . 24 TRP CD1 1 1 10 5101 1 1 24 TRP CD2 C 7.043 -0.842 4.153 1.00 . A A . 24 TRP CD2 1 1 10 5102 1 1 24 TRP CE2 C 7.794 0.079 3.396 1.00 . A A . 24 TRP CE2 1 1 10 5103 1 1 24 TRP CE3 C 7.693 -1.941 4.713 1.00 . A A . 24 TRP CE3 1 1 10 5104 1 1 24 TRP CG C 5.687 -0.384 4.153 1.00 . A A . 24 TRP CG 1 1 10 5105 1 1 24 TRP CH2 C 9.767 -1.153 3.754 1.00 . A A . 24 TRP CH2 1 1 10 5106 1 1 24 TRP CZ2 C 9.158 -0.069 3.190 1.00 . A A . 24 TRP CZ2 1 1 10 5107 1 1 24 TRP CZ3 C 9.049 -2.084 4.509 1.00 . A A . 24 TRP CZ3 1 1 10 5108 1 1 24 TRP H H 4.971 -3.141 2.913 1.00 . A A . 24 TRP H 1 1 10 5109 1 1 24 TRP HA H 2.806 -2.300 4.584 1.00 . A A . 24 TRP HA 1 1 10 5110 1 1 24 TRP HB2 H 3.897 -0.201 5.204 1.00 . A A . 24 TRP HB2 1 1 10 5111 1 1 24 TRP HB3 H 4.896 -1.549 5.707 1.00 . A A . 24 TRP HB3 1 1 10 5112 1 1 24 TRP HD1 H 4.764 1.331 3.269 1.00 . A A . 24 TRP HD1 1 1 10 5113 1 1 24 TRP HE1 H 7.182 1.834 2.418 1.00 . A A . 24 TRP HE1 1 1 10 5114 1 1 24 TRP HE3 H 7.154 -2.671 5.300 1.00 . A A . 24 TRP HE3 1 1 10 5115 1 1 24 TRP HH2 H 10.828 -1.306 3.622 1.00 . A A . 24 TRP HH2 1 1 10 5116 1 1 24 TRP HZ2 H 9.737 0.638 2.612 1.00 . A A . 24 TRP HZ2 1 1 10 5117 1 1 24 TRP HZ3 H 9.575 -2.927 4.936 1.00 . A A . 24 TRP HZ3 1 1 10 5118 1 1 24 TRP N N 4.337 -3.171 3.660 1.00 . A A . 24 TRP N 1 1 10 5119 1 1 24 TRP NE1 N 6.935 1.053 2.968 1.00 . A A . 24 TRP NE1 1 1 10 5120 1 1 24 TRP O O 3.578 -1.727 1.633 1.00 . A A . 24 TRP O 1 1 10 5121 1 1 25 CYS C C 2.750 1.448 1.336 1.00 . A A . 25 CYS C 1 1 10 5122 1 1 25 CYS CA C 1.800 0.349 1.690 1.00 . A A . 25 CYS CA 1 1 10 5123 1 1 25 CYS CB C 0.388 0.888 1.896 1.00 . A A . 25 CYS CB 1 1 10 5124 1 1 25 CYS H H 1.948 -0.090 3.732 1.00 . A A . 25 CYS H 1 1 10 5125 1 1 25 CYS HA H 1.789 -0.357 0.872 1.00 . A A . 25 CYS HA 1 1 10 5126 1 1 25 CYS HB2 H 0.340 1.409 2.841 1.00 . A A . 25 CYS HB2 1 1 10 5127 1 1 25 CYS HB3 H 0.149 1.573 1.096 1.00 . A A . 25 CYS HB3 1 1 10 5128 1 1 25 CYS N N 2.280 -0.363 2.848 1.00 . A A . 25 CYS N 1 1 10 5129 1 1 25 CYS O O 2.927 2.407 2.088 1.00 . A A . 25 CYS O 1 1 10 5130 1 1 25 CYS SG S -0.879 -0.411 1.915 1.00 . A A . 25 CYS SG 1 1 10 5131 1 1 26 LYS C C 3.734 3.088 -1.302 1.00 . A A . 26 LYS C 1 1 10 5132 1 1 26 LYS CA C 4.336 2.259 -0.210 1.00 . A A . 26 LYS CA 1 1 10 5133 1 1 26 LYS CB C 5.632 1.569 -0.631 1.00 . A A . 26 LYS CB 1 1 10 5134 1 1 26 LYS CD C 8.049 1.768 -1.172 1.00 . A A . 26 LYS CD 1 1 10 5135 1 1 26 LYS CE C 9.203 2.701 -1.481 1.00 . A A . 26 LYS CE 1 1 10 5136 1 1 26 LYS CG C 6.738 2.510 -1.058 1.00 . A A . 26 LYS CG 1 1 10 5137 1 1 26 LYS H H 3.151 0.550 -0.370 1.00 . A A . 26 LYS H 1 1 10 5138 1 1 26 LYS HA H 4.532 2.898 0.637 1.00 . A A . 26 LYS HA 1 1 10 5139 1 1 26 LYS HB2 H 5.993 0.989 0.206 1.00 . A A . 26 LYS HB2 1 1 10 5140 1 1 26 LYS HB3 H 5.422 0.895 -1.447 1.00 . A A . 26 LYS HB3 1 1 10 5141 1 1 26 LYS HD2 H 8.250 1.275 -0.232 1.00 . A A . 26 LYS HD2 1 1 10 5142 1 1 26 LYS HD3 H 7.968 1.029 -1.956 1.00 . A A . 26 LYS HD3 1 1 10 5143 1 1 26 LYS HE2 H 9.050 3.154 -2.449 1.00 . A A . 26 LYS HE2 1 1 10 5144 1 1 26 LYS HE3 H 9.233 3.477 -0.731 1.00 . A A . 26 LYS HE3 1 1 10 5145 1 1 26 LYS HG2 H 6.483 2.933 -2.019 1.00 . A A . 26 LYS HG2 1 1 10 5146 1 1 26 LYS HG3 H 6.830 3.299 -0.329 1.00 . A A . 26 LYS HG3 1 1 10 5147 1 1 26 LYS HZ1 H 10.489 1.220 -2.192 1.00 . A A . 26 LYS HZ1 1 1 10 5148 1 1 26 LYS HZ2 H 10.643 1.533 -0.558 1.00 . A A . 26 LYS HZ2 1 1 10 5149 1 1 26 LYS HZ3 H 11.290 2.616 -1.667 1.00 . A A . 26 LYS HZ3 1 1 10 5150 1 1 26 LYS N N 3.376 1.307 0.212 1.00 . A A . 26 LYS N 1 1 10 5151 1 1 26 LYS NZ N 10.490 1.981 -1.485 1.00 . A A . 26 LYS NZ 1 1 10 5152 1 1 26 LYS O O 3.308 2.564 -2.321 1.00 . A A . 26 LYS O 1 1 10 5153 1 1 27 LYS C C 3.792 5.599 -3.212 1.00 . A A . 27 LYS C 1 1 10 5154 1 1 27 LYS CA C 3.000 5.294 -1.949 1.00 . A A . 27 LYS CA 1 1 10 5155 1 1 27 LYS CB C 2.648 6.579 -1.194 1.00 . A A . 27 LYS CB 1 1 10 5156 1 1 27 LYS CD C 3.437 8.439 0.300 1.00 . A A . 27 LYS CD 1 1 10 5157 1 1 27 LYS CE C 4.633 9.004 1.044 1.00 . A A . 27 LYS CE 1 1 10 5158 1 1 27 LYS CG C 3.839 7.242 -0.532 1.00 . A A . 27 LYS CG 1 1 10 5159 1 1 27 LYS H H 4.119 4.683 -0.254 1.00 . A A . 27 LYS H 1 1 10 5160 1 1 27 LYS HA H 2.076 4.834 -2.262 1.00 . A A . 27 LYS HA 1 1 10 5161 1 1 27 LYS HB2 H 2.220 7.279 -1.898 1.00 . A A . 27 LYS HB2 1 1 10 5162 1 1 27 LYS HB3 H 1.915 6.350 -0.434 1.00 . A A . 27 LYS HB3 1 1 10 5163 1 1 27 LYS HD2 H 3.032 9.200 -0.350 1.00 . A A . 27 LYS HD2 1 1 10 5164 1 1 27 LYS HD3 H 2.687 8.136 1.017 1.00 . A A . 27 LYS HD3 1 1 10 5165 1 1 27 LYS HE2 H 5.384 9.282 0.320 1.00 . A A . 27 LYS HE2 1 1 10 5166 1 1 27 LYS HE3 H 4.320 9.878 1.596 1.00 . A A . 27 LYS HE3 1 1 10 5167 1 1 27 LYS HG2 H 4.315 6.525 0.117 1.00 . A A . 27 LYS HG2 1 1 10 5168 1 1 27 LYS HG3 H 4.534 7.558 -1.295 1.00 . A A . 27 LYS HG3 1 1 10 5169 1 1 27 LYS HZ1 H 6.058 8.445 2.441 1.00 . A A . 27 LYS HZ1 1 1 10 5170 1 1 27 LYS HZ2 H 5.583 7.171 1.498 1.00 . A A . 27 LYS HZ2 1 1 10 5171 1 1 27 LYS HZ3 H 4.567 7.742 2.732 1.00 . A A . 27 LYS HZ3 1 1 10 5172 1 1 27 LYS N N 3.669 4.359 -1.063 1.00 . A A . 27 LYS N 1 1 10 5173 1 1 27 LYS NZ N 5.227 8.022 1.982 1.00 . A A . 27 LYS NZ 1 1 10 5174 1 1 27 LYS O O 4.934 5.162 -3.383 1.00 . A A . 27 LYS O 1 1 10 5175 1 1 28 LYS C C 4.797 7.798 -5.131 1.00 . A A . 28 LYS C 1 1 10 5176 1 1 28 LYS CA C 3.733 6.730 -5.329 1.00 . A A . 28 LYS CA 1 1 10 5177 1 1 28 LYS CB C 2.636 7.206 -6.299 1.00 . A A . 28 LYS CB 1 1 10 5178 1 1 28 LYS CD C 1.991 8.351 -8.446 1.00 . A A . 28 LYS CD 1 1 10 5179 1 1 28 LYS CE C 1.505 7.201 -9.310 1.00 . A A . 28 LYS CE 1 1 10 5180 1 1 28 LYS CG C 3.139 7.948 -7.536 1.00 . A A . 28 LYS CG 1 1 10 5181 1 1 28 LYS H H 2.221 6.545 -3.917 1.00 . A A . 28 LYS H 1 1 10 5182 1 1 28 LYS HA H 4.206 5.864 -5.768 1.00 . A A . 28 LYS HA 1 1 10 5183 1 1 28 LYS HB2 H 2.074 6.346 -6.630 1.00 . A A . 28 LYS HB2 1 1 10 5184 1 1 28 LYS HB3 H 1.968 7.861 -5.759 1.00 . A A . 28 LYS HB3 1 1 10 5185 1 1 28 LYS HD2 H 1.169 8.697 -7.836 1.00 . A A . 28 LYS HD2 1 1 10 5186 1 1 28 LYS HD3 H 2.330 9.156 -9.080 1.00 . A A . 28 LYS HD3 1 1 10 5187 1 1 28 LYS HE2 H 1.376 6.325 -8.691 1.00 . A A . 28 LYS HE2 1 1 10 5188 1 1 28 LYS HE3 H 0.554 7.475 -9.741 1.00 . A A . 28 LYS HE3 1 1 10 5189 1 1 28 LYS HG2 H 3.664 8.836 -7.219 1.00 . A A . 28 LYS HG2 1 1 10 5190 1 1 28 LYS HG3 H 3.815 7.306 -8.082 1.00 . A A . 28 LYS HG3 1 1 10 5191 1 1 28 LYS HZ1 H 2.485 7.660 -11.094 1.00 . A A . 28 LYS HZ1 1 1 10 5192 1 1 28 LYS HZ2 H 2.213 6.006 -10.902 1.00 . A A . 28 LYS HZ2 1 1 10 5193 1 1 28 LYS HZ3 H 3.436 6.775 -10.048 1.00 . A A . 28 LYS HZ3 1 1 10 5194 1 1 28 LYS N N 3.158 6.314 -4.095 1.00 . A A . 28 LYS N 1 1 10 5195 1 1 28 LYS NZ N 2.459 6.883 -10.402 1.00 . A A . 28 LYS NZ 1 1 10 5196 1 1 28 LYS O O 4.494 8.975 -4.877 1.00 . A A . 28 LYS O 1 1 10 5197 1 1 29 LEU C C 7.679 8.214 -6.665 1.00 . A A . 29 LEU C 1 1 10 5198 1 1 29 LEU CA C 7.164 8.252 -5.234 1.00 . A A . 29 LEU CA 1 1 10 5199 1 1 29 LEU CB C 8.310 7.872 -4.251 1.00 . A A . 29 LEU CB 1 1 10 5200 1 1 29 LEU CD1 C 7.467 9.381 -2.381 1.00 . A A . 29 LEU CD1 1 1 10 5201 1 1 29 LEU CD2 C 7.237 6.886 -2.159 1.00 . A A . 29 LEU CD2 1 1 10 5202 1 1 29 LEU CG C 8.061 8.024 -2.729 1.00 . A A . 29 LEU CG 1 1 10 5203 1 1 29 LEU H H 6.183 6.391 -5.088 1.00 . A A . 29 LEU H 1 1 10 5204 1 1 29 LEU HA H 6.810 9.251 -5.024 1.00 . A A . 29 LEU HA 1 1 10 5205 1 1 29 LEU HB2 H 8.566 6.839 -4.434 1.00 . A A . 29 LEU HB2 1 1 10 5206 1 1 29 LEU HB3 H 9.168 8.474 -4.509 1.00 . A A . 29 LEU HB3 1 1 10 5207 1 1 29 LEU HD11 H 7.332 9.449 -1.311 1.00 . A A . 29 LEU HD11 1 1 10 5208 1 1 29 LEU HD12 H 6.510 9.493 -2.868 1.00 . A A . 29 LEU HD12 1 1 10 5209 1 1 29 LEU HD13 H 8.132 10.167 -2.711 1.00 . A A . 29 LEU HD13 1 1 10 5210 1 1 29 LEU HD21 H 7.762 5.952 -2.302 1.00 . A A . 29 LEU HD21 1 1 10 5211 1 1 29 LEU HD22 H 6.286 6.842 -2.668 1.00 . A A . 29 LEU HD22 1 1 10 5212 1 1 29 LEU HD23 H 7.074 7.051 -1.104 1.00 . A A . 29 LEU HD23 1 1 10 5213 1 1 29 LEU HG H 9.032 8.007 -2.253 1.00 . A A . 29 LEU HG 1 1 10 5214 1 1 29 LEU N N 6.028 7.359 -5.160 1.00 . A A . 29 LEU N 1 1 10 5215 1 1 29 LEU O O 8.710 8.796 -6.996 1.00 . A A . 29 LEU O 1 1 10 5216 1 1 30 TRP C C 6.026 7.794 -9.690 1.00 . A A . 30 TRP C 1 1 10 5217 1 1 30 TRP CA C 7.236 7.331 -8.903 1.00 . A A . 30 TRP CA 1 1 10 5218 1 1 30 TRP CB C 7.472 5.849 -9.233 1.00 . A A . 30 TRP CB 1 1 10 5219 1 1 30 TRP CD1 C 9.768 4.983 -8.494 1.00 . A A . 30 TRP CD1 1 1 10 5220 1 1 30 TRP CD2 C 8.079 4.388 -7.156 1.00 . A A . 30 TRP CD2 1 1 10 5221 1 1 30 TRP CE2 C 9.265 3.839 -6.645 1.00 . A A . 30 TRP CE2 1 1 10 5222 1 1 30 TRP CE3 C 6.878 4.151 -6.480 1.00 . A A . 30 TRP CE3 1 1 10 5223 1 1 30 TRP CG C 8.423 5.119 -8.339 1.00 . A A . 30 TRP CG 1 1 10 5224 1 1 30 TRP CH2 C 8.094 2.849 -4.856 1.00 . A A . 30 TRP CH2 1 1 10 5225 1 1 30 TRP CZ2 C 9.286 3.064 -5.493 1.00 . A A . 30 TRP CZ2 1 1 10 5226 1 1 30 TRP CZ3 C 6.898 3.383 -5.338 1.00 . A A . 30 TRP CZ3 1 1 10 5227 1 1 30 TRP H H 6.099 7.119 -7.167 1.00 . A A . 30 TRP H 1 1 10 5228 1 1 30 TRP HA H 8.105 7.915 -9.166 1.00 . A A . 30 TRP HA 1 1 10 5229 1 1 30 TRP HB2 H 6.528 5.330 -9.182 1.00 . A A . 30 TRP HB2 1 1 10 5230 1 1 30 TRP HB3 H 7.844 5.780 -10.245 1.00 . A A . 30 TRP HB3 1 1 10 5231 1 1 30 TRP HD1 H 10.335 5.420 -9.305 1.00 . A A . 30 TRP HD1 1 1 10 5232 1 1 30 TRP HE1 H 11.231 3.969 -7.373 1.00 . A A . 30 TRP HE1 1 1 10 5233 1 1 30 TRP HE3 H 5.944 4.555 -6.844 1.00 . A A . 30 TRP HE3 1 1 10 5234 1 1 30 TRP HH2 H 8.056 2.248 -3.959 1.00 . A A . 30 TRP HH2 1 1 10 5235 1 1 30 TRP HZ2 H 10.201 2.640 -5.102 1.00 . A A . 30 TRP HZ2 1 1 10 5236 1 1 30 TRP HZ3 H 5.980 3.190 -4.802 1.00 . A A . 30 TRP HZ3 1 1 10 5237 1 1 30 TRP N N 6.928 7.514 -7.505 1.00 . A A . 30 TRP N 1 1 10 5238 1 1 30 TRP NE1 N 10.282 4.210 -7.481 1.00 . A A . 30 TRP NE1 1 1 10 5239 1 1 30 TRP O O 5.118 6.967 -9.948 1.00 . A A . 30 TRP O 1 1 10 5240 1 1 30 TRP OXT O 5.931 8.984 -10.007 1.00 . A A . 30 TRP OXT 1 1 11 5241 1 1 1 TYR C C -9.880 0.232 2.003 1.00 . A A . 1 TYR C 1 1 11 5242 1 1 1 TYR CA C -11.159 0.760 2.550 1.00 . A A . 1 TYR CA 1 1 11 5243 1 1 1 TYR CB C -10.835 1.708 3.722 1.00 . A A . 1 TYR CB 1 1 11 5244 1 1 1 TYR CD1 C -12.543 1.710 5.562 1.00 . A A . 1 TYR CD1 1 1 11 5245 1 1 1 TYR CD2 C -12.668 3.410 3.907 1.00 . A A . 1 TYR CD2 1 1 11 5246 1 1 1 TYR CE1 C -13.645 2.230 6.187 1.00 . A A . 1 TYR CE1 1 1 11 5247 1 1 1 TYR CE2 C -13.767 3.939 4.526 1.00 . A A . 1 TYR CE2 1 1 11 5248 1 1 1 TYR CG C -12.037 2.288 4.410 1.00 . A A . 1 TYR CG 1 1 11 5249 1 1 1 TYR CZ C -14.251 3.346 5.664 1.00 . A A . 1 TYR CZ 1 1 11 5250 1 1 1 TYR H1 H -12.195 -0.970 2.169 1.00 . A A . 1 TYR H1 1 1 11 5251 1 1 1 TYR H2 H -12.843 -0.082 3.471 1.00 . A A . 1 TYR H2 1 1 11 5252 1 1 1 TYR H3 H -11.392 -0.949 3.629 1.00 . A A . 1 TYR H3 1 1 11 5253 1 1 1 TYR HA H -11.679 1.305 1.777 1.00 . A A . 1 TYR HA 1 1 11 5254 1 1 1 TYR HB2 H -10.261 1.176 4.464 1.00 . A A . 1 TYR HB2 1 1 11 5255 1 1 1 TYR HB3 H -10.236 2.527 3.354 1.00 . A A . 1 TYR HB3 1 1 11 5256 1 1 1 TYR HD1 H -12.063 0.833 5.972 1.00 . A A . 1 TYR HD1 1 1 11 5257 1 1 1 TYR HD2 H -12.287 3.875 3.011 1.00 . A A . 1 TYR HD2 1 1 11 5258 1 1 1 TYR HE1 H -14.021 1.761 7.083 1.00 . A A . 1 TYR HE1 1 1 11 5259 1 1 1 TYR HE2 H -14.246 4.816 4.116 1.00 . A A . 1 TYR HE2 1 1 11 5260 1 1 1 TYR HH H -15.199 3.823 7.226 1.00 . A A . 1 TYR HH 1 1 11 5261 1 1 1 TYR N N -11.971 -0.371 2.988 1.00 . A A . 1 TYR N 1 1 11 5262 1 1 1 TYR O O -9.584 -0.961 2.155 1.00 . A A . 1 TYR O 1 1 11 5263 1 1 1 TYR OH O -15.343 3.863 6.274 1.00 . A A . 1 TYR OH 1 1 11 5264 1 1 2 CYS C C -6.820 1.121 1.947 1.00 . A A . 2 CYS C 1 1 11 5265 1 1 2 CYS CA C -7.840 0.694 0.908 1.00 . A A . 2 CYS CA 1 1 11 5266 1 1 2 CYS CB C -7.537 1.288 -0.478 1.00 . A A . 2 CYS CB 1 1 11 5267 1 1 2 CYS H H -9.435 1.996 1.216 1.00 . A A . 2 CYS H 1 1 11 5268 1 1 2 CYS HA H -7.829 -0.385 0.849 1.00 . A A . 2 CYS HA 1 1 11 5269 1 1 2 CYS HB2 H -6.542 0.986 -0.768 1.00 . A A . 2 CYS HB2 1 1 11 5270 1 1 2 CYS HB3 H -8.244 0.886 -1.190 1.00 . A A . 2 CYS HB3 1 1 11 5271 1 1 2 CYS N N -9.130 1.075 1.367 1.00 . A A . 2 CYS N 1 1 11 5272 1 1 2 CYS O O -7.069 2.050 2.734 1.00 . A A . 2 CYS O 1 1 11 5273 1 1 2 CYS SG S -7.603 3.117 -0.591 1.00 . A A . 2 CYS SG 1 1 11 5274 1 1 3 GLN C C -3.846 1.902 2.437 1.00 . A A . 3 GLN C 1 1 11 5275 1 1 3 GLN CA C -4.687 0.759 2.936 1.00 . A A . 3 GLN CA 1 1 11 5276 1 1 3 GLN CB C -3.829 -0.470 3.184 1.00 . A A . 3 GLN CB 1 1 11 5277 1 1 3 GLN CD C -5.134 -1.418 5.098 1.00 . A A . 3 GLN CD 1 1 11 5278 1 1 3 GLN CG C -4.621 -1.650 3.694 1.00 . A A . 3 GLN CG 1 1 11 5279 1 1 3 GLN H H -5.594 -0.294 1.360 1.00 . A A . 3 GLN H 1 1 11 5280 1 1 3 GLN HA H -5.176 1.035 3.857 1.00 . A A . 3 GLN HA 1 1 11 5281 1 1 3 GLN HB2 H -3.307 -0.754 2.283 1.00 . A A . 3 GLN HB2 1 1 11 5282 1 1 3 GLN HB3 H -3.094 -0.220 3.934 1.00 . A A . 3 GLN HB3 1 1 11 5283 1 1 3 GLN HE21 H -3.480 -2.187 5.825 1.00 . A A . 3 GLN HE21 1 1 11 5284 1 1 3 GLN HE22 H -4.647 -1.679 6.994 1.00 . A A . 3 GLN HE22 1 1 11 5285 1 1 3 GLN HG2 H -5.469 -1.776 3.037 1.00 . A A . 3 GLN HG2 1 1 11 5286 1 1 3 GLN HG3 H -4.009 -2.538 3.654 1.00 . A A . 3 GLN HG3 1 1 11 5287 1 1 3 GLN N N -5.712 0.457 1.981 1.00 . A A . 3 GLN N 1 1 11 5288 1 1 3 GLN NE2 N -4.348 -1.790 6.069 1.00 . A A . 3 GLN NE2 1 1 11 5289 1 1 3 GLN O O -3.390 1.900 1.306 1.00 . A A . 3 GLN O 1 1 11 5290 1 1 3 GLN OE1 O -6.229 -0.888 5.301 1.00 . A A . 3 GLN OE1 1 1 11 5291 1 1 4 LYS C C -1.458 3.785 3.138 1.00 . A A . 4 LYS C 1 1 11 5292 1 1 4 LYS CA C -2.935 4.058 2.910 1.00 . A A . 4 LYS CA 1 1 11 5293 1 1 4 LYS CB C -3.428 5.240 3.747 1.00 . A A . 4 LYS CB 1 1 11 5294 1 1 4 LYS CD C -5.456 6.576 4.493 1.00 . A A . 4 LYS CD 1 1 11 5295 1 1 4 LYS CE C -6.971 6.629 4.411 1.00 . A A . 4 LYS CE 1 1 11 5296 1 1 4 LYS CG C -4.931 5.452 3.618 1.00 . A A . 4 LYS CG 1 1 11 5297 1 1 4 LYS H H -4.088 2.823 4.154 1.00 . A A . 4 LYS H 1 1 11 5298 1 1 4 LYS HA H -3.104 4.265 1.864 1.00 . A A . 4 LYS HA 1 1 11 5299 1 1 4 LYS HB2 H -3.188 5.063 4.784 1.00 . A A . 4 LYS HB2 1 1 11 5300 1 1 4 LYS HB3 H -2.931 6.137 3.410 1.00 . A A . 4 LYS HB3 1 1 11 5301 1 1 4 LYS HD2 H -5.165 6.390 5.516 1.00 . A A . 4 LYS HD2 1 1 11 5302 1 1 4 LYS HD3 H -5.048 7.518 4.157 1.00 . A A . 4 LYS HD3 1 1 11 5303 1 1 4 LYS HE2 H -7.250 6.775 3.379 1.00 . A A . 4 LYS HE2 1 1 11 5304 1 1 4 LYS HE3 H -7.364 5.682 4.753 1.00 . A A . 4 LYS HE3 1 1 11 5305 1 1 4 LYS HG2 H -5.161 5.685 2.588 1.00 . A A . 4 LYS HG2 1 1 11 5306 1 1 4 LYS HG3 H -5.430 4.532 3.888 1.00 . A A . 4 LYS HG3 1 1 11 5307 1 1 4 LYS HZ1 H -8.603 7.622 5.172 1.00 . A A . 4 LYS HZ1 1 1 11 5308 1 1 4 LYS HZ2 H -7.341 8.646 4.804 1.00 . A A . 4 LYS HZ2 1 1 11 5309 1 1 4 LYS HZ3 H -7.274 7.692 6.206 1.00 . A A . 4 LYS HZ3 1 1 11 5310 1 1 4 LYS N N -3.688 2.887 3.263 1.00 . A A . 4 LYS N 1 1 11 5311 1 1 4 LYS NZ N -7.566 7.715 5.209 1.00 . A A . 4 LYS NZ 1 1 11 5312 1 1 4 LYS O O -1.110 2.802 3.788 1.00 . A A . 4 LYS O 1 1 11 5313 1 1 5 TRP C C 1.367 4.401 4.145 1.00 . A A . 5 TRP C 1 1 11 5314 1 1 5 TRP CA C 0.875 4.491 2.716 1.00 . A A . 5 TRP CA 1 1 11 5315 1 1 5 TRP CB C 1.618 5.631 2.010 1.00 . A A . 5 TRP CB 1 1 11 5316 1 1 5 TRP CD1 C 0.452 7.793 2.714 1.00 . A A . 5 TRP CD1 1 1 11 5317 1 1 5 TRP CD2 C 2.521 7.612 3.510 1.00 . A A . 5 TRP CD2 1 1 11 5318 1 1 5 TRP CE2 C 1.984 8.834 3.938 1.00 . A A . 5 TRP CE2 1 1 11 5319 1 1 5 TRP CE3 C 3.814 7.278 3.900 1.00 . A A . 5 TRP CE3 1 1 11 5320 1 1 5 TRP CG C 1.517 6.966 2.708 1.00 . A A . 5 TRP CG 1 1 11 5321 1 1 5 TRP CH2 C 3.953 9.367 5.104 1.00 . A A . 5 TRP CH2 1 1 11 5322 1 1 5 TRP CZ2 C 2.691 9.722 4.735 1.00 . A A . 5 TRP CZ2 1 1 11 5323 1 1 5 TRP CZ3 C 4.517 8.158 4.695 1.00 . A A . 5 TRP CZ3 1 1 11 5324 1 1 5 TRP H H -0.956 5.484 2.233 1.00 . A A . 5 TRP H 1 1 11 5325 1 1 5 TRP HA H 1.113 3.565 2.215 1.00 . A A . 5 TRP HA 1 1 11 5326 1 1 5 TRP HB2 H 2.664 5.371 1.950 1.00 . A A . 5 TRP HB2 1 1 11 5327 1 1 5 TRP HB3 H 1.225 5.743 1.010 1.00 . A A . 5 TRP HB3 1 1 11 5328 1 1 5 TRP HD1 H -0.471 7.569 2.209 1.00 . A A . 5 TRP HD1 1 1 11 5329 1 1 5 TRP HE1 H 0.115 9.675 3.576 1.00 . A A . 5 TRP HE1 1 1 11 5330 1 1 5 TRP HE3 H 4.269 6.349 3.595 1.00 . A A . 5 TRP HE3 1 1 11 5331 1 1 5 TRP HH2 H 4.540 10.027 5.727 1.00 . A A . 5 TRP HH2 1 1 11 5332 1 1 5 TRP HZ2 H 2.273 10.663 5.062 1.00 . A A . 5 TRP HZ2 1 1 11 5333 1 1 5 TRP HZ3 H 5.522 7.917 5.011 1.00 . A A . 5 TRP HZ3 1 1 11 5334 1 1 5 TRP N N -0.596 4.674 2.649 1.00 . A A . 5 TRP N 1 1 11 5335 1 1 5 TRP NE1 N 0.726 8.920 3.430 1.00 . A A . 5 TRP NE1 1 1 11 5336 1 1 5 TRP O O 2.431 3.865 4.410 1.00 . A A . 5 TRP O 1 1 11 5337 1 1 6 MET C C 0.827 3.529 7.013 1.00 . A A . 6 MET C 1 1 11 5338 1 1 6 MET CA C 0.949 4.948 6.439 1.00 . A A . 6 MET CA 1 1 11 5339 1 1 6 MET CB C 0.026 5.887 7.199 1.00 . A A . 6 MET CB 1 1 11 5340 1 1 6 MET CE C 1.860 6.763 10.836 1.00 . A A . 6 MET CE 1 1 11 5341 1 1 6 MET CG C 0.301 5.987 8.682 1.00 . A A . 6 MET CG 1 1 11 5342 1 1 6 MET H H -0.230 5.387 4.761 1.00 . A A . 6 MET H 1 1 11 5343 1 1 6 MET HA H 1.947 5.354 6.452 1.00 . A A . 6 MET HA 1 1 11 5344 1 1 6 MET HB2 H 0.130 6.876 6.779 1.00 . A A . 6 MET HB2 1 1 11 5345 1 1 6 MET HB3 H -0.992 5.553 7.062 1.00 . A A . 6 MET HB3 1 1 11 5346 1 1 6 MET HE1 H 1.706 5.767 11.225 1.00 . A A . 6 MET HE1 1 1 11 5347 1 1 6 MET HE2 H 1.049 7.403 11.148 1.00 . A A . 6 MET HE2 1 1 11 5348 1 1 6 MET HE3 H 2.792 7.156 11.214 1.00 . A A . 6 MET HE3 1 1 11 5349 1 1 6 MET HG2 H -0.482 6.586 9.116 1.00 . A A . 6 MET HG2 1 1 11 5350 1 1 6 MET HG3 H 0.256 4.993 9.101 1.00 . A A . 6 MET HG3 1 1 11 5351 1 1 6 MET N N 0.597 4.950 5.051 1.00 . A A . 6 MET N 1 1 11 5352 1 1 6 MET O O 1.528 3.138 7.949 1.00 . A A . 6 MET O 1 1 11 5353 1 1 6 MET SD S 1.922 6.706 9.046 1.00 . A A . 6 MET SD 1 1 11 5354 1 1 7 TRP C C 0.335 0.377 6.038 1.00 . A A . 7 TRP C 1 1 11 5355 1 1 7 TRP CA C -0.388 1.442 6.875 1.00 . A A . 7 TRP CA 1 1 11 5356 1 1 7 TRP CB C -1.916 1.244 6.818 1.00 . A A . 7 TRP CB 1 1 11 5357 1 1 7 TRP CD1 C -2.272 2.929 8.733 1.00 . A A . 7 TRP CD1 1 1 11 5358 1 1 7 TRP CD2 C -4.024 2.714 7.363 1.00 . A A . 7 TRP CD2 1 1 11 5359 1 1 7 TRP CE2 C -4.338 3.669 8.347 1.00 . A A . 7 TRP CE2 1 1 11 5360 1 1 7 TRP CE3 C -4.976 2.411 6.398 1.00 . A A . 7 TRP CE3 1 1 11 5361 1 1 7 TRP CG C -2.691 2.264 7.616 1.00 . A A . 7 TRP CG 1 1 11 5362 1 1 7 TRP CH2 C -6.480 3.999 7.423 1.00 . A A . 7 TRP CH2 1 1 11 5363 1 1 7 TRP CZ2 C -5.565 4.320 8.387 1.00 . A A . 7 TRP CZ2 1 1 11 5364 1 1 7 TRP CZ3 C -6.196 3.053 6.436 1.00 . A A . 7 TRP CZ3 1 1 11 5365 1 1 7 TRP H H -0.500 3.126 5.623 1.00 . A A . 7 TRP H 1 1 11 5366 1 1 7 TRP HA H -0.072 1.355 7.904 1.00 . A A . 7 TRP HA 1 1 11 5367 1 1 7 TRP HB2 H -2.235 1.328 5.790 1.00 . A A . 7 TRP HB2 1 1 11 5368 1 1 7 TRP HB3 H -2.176 0.264 7.181 1.00 . A A . 7 TRP HB3 1 1 11 5369 1 1 7 TRP HD1 H -1.299 2.804 9.186 1.00 . A A . 7 TRP HD1 1 1 11 5370 1 1 7 TRP HE1 H -3.183 4.385 9.945 1.00 . A A . 7 TRP HE1 1 1 11 5371 1 1 7 TRP HE3 H -4.767 1.675 5.637 1.00 . A A . 7 TRP HE3 1 1 11 5372 1 1 7 TRP HH2 H -7.449 4.478 7.417 1.00 . A A . 7 TRP HH2 1 1 11 5373 1 1 7 TRP HZ2 H -5.804 5.055 9.141 1.00 . A A . 7 TRP HZ2 1 1 11 5374 1 1 7 TRP HZ3 H -6.945 2.825 5.690 1.00 . A A . 7 TRP HZ3 1 1 11 5375 1 1 7 TRP N N -0.058 2.772 6.424 1.00 . A A . 7 TRP N 1 1 11 5376 1 1 7 TRP NE1 N -3.253 3.786 9.168 1.00 . A A . 7 TRP NE1 1 1 11 5377 1 1 7 TRP O O 1.271 0.678 5.277 1.00 . A A . 7 TRP O 1 1 11 5378 1 1 8 THR C C -0.614 -2.702 4.771 1.00 . A A . 8 THR C 1 1 11 5379 1 1 8 THR CA C 0.518 -1.976 5.497 1.00 . A A . 8 THR CA 1 1 11 5380 1 1 8 THR CB C 1.195 -2.939 6.513 1.00 . A A . 8 THR CB 1 1 11 5381 1 1 8 THR CG2 C 2.296 -2.230 7.295 1.00 . A A . 8 THR CG2 1 1 11 5382 1 1 8 THR H H -0.829 -1.041 6.796 1.00 . A A . 8 THR H 1 1 11 5383 1 1 8 THR HA H 1.250 -1.589 4.801 1.00 . A A . 8 THR HA 1 1 11 5384 1 1 8 THR HB H 1.621 -3.780 5.983 1.00 . A A . 8 THR HB 1 1 11 5385 1 1 8 THR HG1 H -0.156 -2.623 7.869 1.00 . A A . 8 THR HG1 1 1 11 5386 1 1 8 THR HG21 H 3.055 -1.855 6.623 1.00 . A A . 8 THR HG21 1 1 11 5387 1 1 8 THR HG22 H 2.743 -2.920 7.995 1.00 . A A . 8 THR HG22 1 1 11 5388 1 1 8 THR HG23 H 1.856 -1.405 7.835 1.00 . A A . 8 THR HG23 1 1 11 5389 1 1 8 THR N N -0.071 -0.855 6.200 1.00 . A A . 8 THR N 1 1 11 5390 1 1 8 THR O O -1.782 -2.442 5.086 1.00 . A A . 8 THR O 1 1 11 5391 1 1 8 THR OG1 O 0.220 -3.407 7.449 1.00 . A A . 8 THR OG1 1 1 11 5392 1 1 9 CYS C C -1.221 -5.739 3.059 1.00 . A A . 9 CYS C 1 1 11 5393 1 1 9 CYS CA C -1.456 -4.261 3.188 1.00 . A A . 9 CYS CA 1 1 11 5394 1 1 9 CYS CB C -1.765 -3.628 1.853 1.00 . A A . 9 CYS CB 1 1 11 5395 1 1 9 CYS H H 0.569 -3.858 3.537 1.00 . A A . 9 CYS H 1 1 11 5396 1 1 9 CYS HA H -2.309 -4.125 3.837 1.00 . A A . 9 CYS HA 1 1 11 5397 1 1 9 CYS HB2 H -2.585 -4.156 1.389 1.00 . A A . 9 CYS HB2 1 1 11 5398 1 1 9 CYS HB3 H -2.049 -2.598 2.011 1.00 . A A . 9 CYS HB3 1 1 11 5399 1 1 9 CYS N N -0.337 -3.599 3.833 1.00 . A A . 9 CYS N 1 1 11 5400 1 1 9 CYS O O -0.154 -6.235 3.429 1.00 . A A . 9 CYS O 1 1 11 5401 1 1 9 CYS SG S -0.381 -3.647 0.704 1.00 . A A . 9 CYS SG 1 1 11 5402 1 1 10 ASP C C -2.791 -8.292 1.136 1.00 . A A . 10 ASP C 1 1 11 5403 1 1 10 ASP CA C -2.140 -7.891 2.431 1.00 . A A . 10 ASP CA 1 1 11 5404 1 1 10 ASP CB C -2.908 -8.573 3.595 1.00 . A A . 10 ASP CB 1 1 11 5405 1 1 10 ASP CG C -2.373 -8.256 4.974 1.00 . A A . 10 ASP CG 1 1 11 5406 1 1 10 ASP H H -2.992 -6.002 2.158 1.00 . A A . 10 ASP H 1 1 11 5407 1 1 10 ASP HA H -1.107 -8.199 2.456 1.00 . A A . 10 ASP HA 1 1 11 5408 1 1 10 ASP HB2 H -3.938 -8.250 3.565 1.00 . A A . 10 ASP HB2 1 1 11 5409 1 1 10 ASP HB3 H -2.879 -9.642 3.453 1.00 . A A . 10 ASP HB3 1 1 11 5410 1 1 10 ASP N N -2.200 -6.448 2.540 1.00 . A A . 10 ASP N 1 1 11 5411 1 1 10 ASP O O -3.113 -7.436 0.314 1.00 . A A . 10 ASP O 1 1 11 5412 1 1 10 ASP OD1 O -1.333 -8.823 5.380 1.00 . A A . 10 ASP OD1 1 1 11 5413 1 1 10 ASP OD2 O -3.002 -7.470 5.695 1.00 . A A . 10 ASP OD2 1 1 11 5414 1 1 11 SER C C -5.223 -9.815 0.023 1.00 . A A . 11 SER C 1 1 11 5415 1 1 11 SER CA C -3.731 -10.043 -0.212 1.00 . A A . 11 SER CA 1 1 11 5416 1 1 11 SER CB C -3.431 -11.529 -0.433 1.00 . A A . 11 SER CB 1 1 11 5417 1 1 11 SER H H -2.641 -10.243 1.568 1.00 . A A . 11 SER H 1 1 11 5418 1 1 11 SER HA H -3.420 -9.477 -1.075 1.00 . A A . 11 SER HA 1 1 11 5419 1 1 11 SER HB2 H -4.065 -11.909 -1.219 1.00 . A A . 11 SER HB2 1 1 11 5420 1 1 11 SER HB3 H -2.395 -11.651 -0.712 1.00 . A A . 11 SER HB3 1 1 11 5421 1 1 11 SER HG H -4.628 -12.477 0.816 1.00 . A A . 11 SER HG 1 1 11 5422 1 1 11 SER N N -3.001 -9.573 0.945 1.00 . A A . 11 SER N 1 1 11 5423 1 1 11 SER O O -6.021 -9.673 -0.906 1.00 . A A . 11 SER O 1 1 11 5424 1 1 11 SER OG O -3.676 -12.278 0.762 1.00 . A A . 11 SER OG 1 1 11 5425 1 1 12 GLU C C -7.257 -8.114 1.824 1.00 . A A . 12 GLU C 1 1 11 5426 1 1 12 GLU CA C -6.942 -9.599 1.703 1.00 . A A . 12 GLU CA 1 1 11 5427 1 1 12 GLU CB C -7.151 -10.288 3.048 1.00 . A A . 12 GLU CB 1 1 11 5428 1 1 12 GLU CD C -7.021 -12.613 2.040 1.00 . A A . 12 GLU CD 1 1 11 5429 1 1 12 GLU CG C -6.547 -11.693 3.131 1.00 . A A . 12 GLU CG 1 1 11 5430 1 1 12 GLU H H -4.862 -9.848 1.955 1.00 . A A . 12 GLU H 1 1 11 5431 1 1 12 GLU HA H -7.586 -10.054 0.966 1.00 . A A . 12 GLU HA 1 1 11 5432 1 1 12 GLU HB2 H -6.699 -9.679 3.817 1.00 . A A . 12 GLU HB2 1 1 11 5433 1 1 12 GLU HB3 H -8.211 -10.363 3.241 1.00 . A A . 12 GLU HB3 1 1 11 5434 1 1 12 GLU HG2 H -5.473 -11.614 3.060 1.00 . A A . 12 GLU HG2 1 1 11 5435 1 1 12 GLU HG3 H -6.810 -12.125 4.085 1.00 . A A . 12 GLU HG3 1 1 11 5436 1 1 12 GLU N N -5.575 -9.760 1.291 1.00 . A A . 12 GLU N 1 1 11 5437 1 1 12 GLU O O -8.278 -7.634 1.338 1.00 . A A . 12 GLU O 1 1 11 5438 1 1 12 GLU OE1 O -8.129 -13.165 2.156 1.00 . A A . 12 GLU OE1 1 1 11 5439 1 1 12 GLU OE2 O -6.294 -12.811 1.042 1.00 . A A . 12 GLU OE2 1 1 11 5440 1 1 13 ARG C C -5.849 -5.270 1.482 1.00 . A A . 13 ARG C 1 1 11 5441 1 1 13 ARG CA C -6.520 -5.983 2.638 1.00 . A A . 13 ARG CA 1 1 11 5442 1 1 13 ARG CB C -5.871 -5.553 3.937 1.00 . A A . 13 ARG CB 1 1 11 5443 1 1 13 ARG CD C -6.144 -5.526 6.390 1.00 . A A . 13 ARG CD 1 1 11 5444 1 1 13 ARG CG C -6.340 -6.337 5.148 1.00 . A A . 13 ARG CG 1 1 11 5445 1 1 13 ARG CZ C -7.301 -3.516 7.264 1.00 . A A . 13 ARG CZ 1 1 11 5446 1 1 13 ARG H H -5.591 -7.798 2.898 1.00 . A A . 13 ARG H 1 1 11 5447 1 1 13 ARG HA H -7.569 -5.739 2.673 1.00 . A A . 13 ARG HA 1 1 11 5448 1 1 13 ARG HB2 H -4.804 -5.695 3.841 1.00 . A A . 13 ARG HB2 1 1 11 5449 1 1 13 ARG HB3 H -6.062 -4.505 4.106 1.00 . A A . 13 ARG HB3 1 1 11 5450 1 1 13 ARG HD2 H -6.445 -6.103 7.252 1.00 . A A . 13 ARG HD2 1 1 11 5451 1 1 13 ARG HD3 H -5.106 -5.243 6.475 1.00 . A A . 13 ARG HD3 1 1 11 5452 1 1 13 ARG HE H -7.257 -4.174 5.354 1.00 . A A . 13 ARG HE 1 1 11 5453 1 1 13 ARG HG2 H -7.389 -6.567 5.035 1.00 . A A . 13 ARG HG2 1 1 11 5454 1 1 13 ARG HG3 H -5.770 -7.251 5.223 1.00 . A A . 13 ARG HG3 1 1 11 5455 1 1 13 ARG HH11 H -6.217 -4.448 8.731 1.00 . A A . 13 ARG HH11 1 1 11 5456 1 1 13 ARG HH12 H -7.086 -3.082 9.253 1.00 . A A . 13 ARG HH12 1 1 11 5457 1 1 13 ARG HH21 H -8.450 -2.354 6.070 1.00 . A A . 13 ARG HH21 1 1 11 5458 1 1 13 ARG HH22 H -8.430 -1.887 7.718 1.00 . A A . 13 ARG HH22 1 1 11 5459 1 1 13 ARG N N -6.374 -7.393 2.477 1.00 . A A . 13 ARG N 1 1 11 5460 1 1 13 ARG NE N -6.950 -4.329 6.278 1.00 . A A . 13 ARG NE 1 1 11 5461 1 1 13 ARG NH1 N -6.838 -3.695 8.501 1.00 . A A . 13 ARG NH1 1 1 11 5462 1 1 13 ARG NH2 N -8.109 -2.512 7.002 1.00 . A A . 13 ARG NH2 1 1 11 5463 1 1 13 ARG O O -4.618 -5.295 1.374 1.00 . A A . 13 ARG O 1 1 11 5464 1 1 14 LYS C C -5.519 -2.607 -0.141 1.00 . A A . 14 LYS C 1 1 11 5465 1 1 14 LYS CA C -6.078 -3.963 -0.525 1.00 . A A . 14 LYS CA 1 1 11 5466 1 1 14 LYS CB C -7.108 -3.806 -1.665 1.00 . A A . 14 LYS CB 1 1 11 5467 1 1 14 LYS CD C -9.212 -2.674 -2.531 1.00 . A A . 14 LYS CD 1 1 11 5468 1 1 14 LYS CE C -9.712 -3.941 -3.208 1.00 . A A . 14 LYS CE 1 1 11 5469 1 1 14 LYS CG C -8.345 -2.975 -1.306 1.00 . A A . 14 LYS CG 1 1 11 5470 1 1 14 LYS H H -7.596 -4.612 0.804 1.00 . A A . 14 LYS H 1 1 11 5471 1 1 14 LYS HA H -5.259 -4.571 -0.882 1.00 . A A . 14 LYS HA 1 1 11 5472 1 1 14 LYS HB2 H -6.623 -3.334 -2.507 1.00 . A A . 14 LYS HB2 1 1 11 5473 1 1 14 LYS HB3 H -7.436 -4.790 -1.960 1.00 . A A . 14 LYS HB3 1 1 11 5474 1 1 14 LYS HD2 H -10.066 -2.089 -2.222 1.00 . A A . 14 LYS HD2 1 1 11 5475 1 1 14 LYS HD3 H -8.628 -2.105 -3.239 1.00 . A A . 14 LYS HD3 1 1 11 5476 1 1 14 LYS HE2 H -8.862 -4.509 -3.551 1.00 . A A . 14 LYS HE2 1 1 11 5477 1 1 14 LYS HE3 H -10.266 -4.526 -2.488 1.00 . A A . 14 LYS HE3 1 1 11 5478 1 1 14 LYS HG2 H -8.935 -3.521 -0.586 1.00 . A A . 14 LYS HG2 1 1 11 5479 1 1 14 LYS HG3 H -8.019 -2.042 -0.869 1.00 . A A . 14 LYS HG3 1 1 11 5480 1 1 14 LYS HZ1 H -11.410 -3.088 -4.082 1.00 . A A . 14 LYS HZ1 1 1 11 5481 1 1 14 LYS HZ2 H -10.942 -4.540 -4.769 1.00 . A A . 14 LYS HZ2 1 1 11 5482 1 1 14 LYS HZ3 H -10.081 -3.140 -5.119 1.00 . A A . 14 LYS HZ3 1 1 11 5483 1 1 14 LYS N N -6.630 -4.641 0.633 1.00 . A A . 14 LYS N 1 1 11 5484 1 1 14 LYS NZ N -10.583 -3.652 -4.367 1.00 . A A . 14 LYS NZ 1 1 11 5485 1 1 14 LYS O O -6.086 -1.900 0.680 1.00 . A A . 14 LYS O 1 1 11 5486 1 1 15 CYS C C -4.352 -0.007 -1.496 1.00 . A A . 15 CYS C 1 1 11 5487 1 1 15 CYS CA C -3.779 -1.001 -0.499 1.00 . A A . 15 CYS CA 1 1 11 5488 1 1 15 CYS CB C -2.272 -1.149 -0.696 1.00 . A A . 15 CYS CB 1 1 11 5489 1 1 15 CYS H H -3.989 -2.910 -1.320 1.00 . A A . 15 CYS H 1 1 11 5490 1 1 15 CYS HA H -3.986 -0.661 0.502 1.00 . A A . 15 CYS HA 1 1 11 5491 1 1 15 CYS HB2 H -1.922 -2.006 -0.141 1.00 . A A . 15 CYS HB2 1 1 11 5492 1 1 15 CYS HB3 H -2.089 -1.318 -1.747 1.00 . A A . 15 CYS HB3 1 1 11 5493 1 1 15 CYS N N -4.414 -2.272 -0.712 1.00 . A A . 15 CYS N 1 1 11 5494 1 1 15 CYS O O -4.968 -0.408 -2.494 1.00 . A A . 15 CYS O 1 1 11 5495 1 1 15 CYS SG S -1.261 0.275 -0.185 1.00 . A A . 15 CYS SG 1 1 11 5496 1 1 16 CYS C C -3.808 2.305 -3.347 1.00 . A A . 16 CYS C 1 1 11 5497 1 1 16 CYS CA C -4.667 2.284 -2.103 1.00 . A A . 16 CYS CA 1 1 11 5498 1 1 16 CYS CB C -4.677 3.646 -1.413 1.00 . A A . 16 CYS CB 1 1 11 5499 1 1 16 CYS H H -3.764 1.525 -0.372 1.00 . A A . 16 CYS H 1 1 11 5500 1 1 16 CYS HA H -5.676 2.033 -2.397 1.00 . A A . 16 CYS HA 1 1 11 5501 1 1 16 CYS HB2 H -3.675 3.886 -1.094 1.00 . A A . 16 CYS HB2 1 1 11 5502 1 1 16 CYS HB3 H -5.008 4.389 -2.123 1.00 . A A . 16 CYS HB3 1 1 11 5503 1 1 16 CYS N N -4.207 1.259 -1.212 1.00 . A A . 16 CYS N 1 1 11 5504 1 1 16 CYS O O -2.580 2.144 -3.288 1.00 . A A . 16 CYS O 1 1 11 5505 1 1 16 CYS SG S -5.772 3.751 0.057 1.00 . A A . 16 CYS SG 1 1 11 5506 1 1 17 LYS C C -3.078 3.788 -5.918 1.00 . A A . 17 LYS C 1 1 11 5507 1 1 17 LYS CA C -3.762 2.460 -5.711 1.00 . A A . 17 LYS CA 1 1 11 5508 1 1 17 LYS CB C -4.710 2.073 -6.831 1.00 . A A . 17 LYS CB 1 1 11 5509 1 1 17 LYS CD C -6.263 0.248 -7.676 1.00 . A A . 17 LYS CD 1 1 11 5510 1 1 17 LYS CE C -5.580 0.080 -9.021 1.00 . A A . 17 LYS CE 1 1 11 5511 1 1 17 LYS CG C -5.305 0.688 -6.593 1.00 . A A . 17 LYS CG 1 1 11 5512 1 1 17 LYS H H -5.413 2.626 -4.449 1.00 . A A . 17 LYS H 1 1 11 5513 1 1 17 LYS HA H -2.989 1.710 -5.628 1.00 . A A . 17 LYS HA 1 1 11 5514 1 1 17 LYS HB2 H -5.507 2.798 -6.878 1.00 . A A . 17 LYS HB2 1 1 11 5515 1 1 17 LYS HB3 H -4.176 2.060 -7.768 1.00 . A A . 17 LYS HB3 1 1 11 5516 1 1 17 LYS HD2 H -6.702 -0.695 -7.387 1.00 . A A . 17 LYS HD2 1 1 11 5517 1 1 17 LYS HD3 H -7.044 0.989 -7.768 1.00 . A A . 17 LYS HD3 1 1 11 5518 1 1 17 LYS HE2 H -5.251 1.047 -9.373 1.00 . A A . 17 LYS HE2 1 1 11 5519 1 1 17 LYS HE3 H -4.724 -0.568 -8.899 1.00 . A A . 17 LYS HE3 1 1 11 5520 1 1 17 LYS HG2 H -4.500 -0.030 -6.541 1.00 . A A . 17 LYS HG2 1 1 11 5521 1 1 17 LYS HG3 H -5.823 0.700 -5.644 1.00 . A A . 17 LYS HG3 1 1 11 5522 1 1 17 LYS HZ1 H -6.704 -1.494 -9.761 1.00 . A A . 17 LYS HZ1 1 1 11 5523 1 1 17 LYS HZ2 H -6.092 -0.466 -10.976 1.00 . A A . 17 LYS HZ2 1 1 11 5524 1 1 17 LYS HZ3 H -7.396 0.009 -10.018 1.00 . A A . 17 LYS HZ3 1 1 11 5525 1 1 17 LYS N N -4.444 2.467 -4.466 1.00 . A A . 17 LYS N 1 1 11 5526 1 1 17 LYS NZ N -6.494 -0.509 -10.020 1.00 . A A . 17 LYS NZ 1 1 11 5527 1 1 17 LYS O O -3.678 4.859 -5.731 1.00 . A A . 17 LYS O 1 1 11 5528 1 1 18 GLY C C 0.126 4.586 -5.343 1.00 . A A . 18 GLY C 1 1 11 5529 1 1 18 GLY CA C -0.980 4.846 -6.337 1.00 . A A . 18 GLY CA 1 1 11 5530 1 1 18 GLY H H -1.510 2.856 -6.670 1.00 . A A . 18 GLY H 1 1 11 5531 1 1 18 GLY HA2 H -0.569 4.985 -7.325 1.00 . A A . 18 GLY HA2 1 1 11 5532 1 1 18 GLY HA3 H -1.524 5.728 -6.032 1.00 . A A . 18 GLY HA3 1 1 11 5533 1 1 18 GLY N N -1.854 3.714 -6.336 1.00 . A A . 18 GLY N 1 1 11 5534 1 1 18 GLY O O 1.147 5.275 -5.328 1.00 . A A . 18 GLY O 1 1 11 5535 1 1 19 MET C C 1.263 1.683 -4.090 1.00 . A A . 19 MET C 1 1 11 5536 1 1 19 MET CA C 0.912 3.070 -3.614 1.00 . A A . 19 MET CA 1 1 11 5537 1 1 19 MET CB C 0.448 2.958 -2.143 1.00 . A A . 19 MET CB 1 1 11 5538 1 1 19 MET CE C -1.165 6.540 -0.697 1.00 . A A . 19 MET CE 1 1 11 5539 1 1 19 MET CG C 0.258 4.256 -1.385 1.00 . A A . 19 MET CG 1 1 11 5540 1 1 19 MET H H -0.992 3.184 -4.456 1.00 . A A . 19 MET H 1 1 11 5541 1 1 19 MET HA H 1.784 3.704 -3.676 1.00 . A A . 19 MET HA 1 1 11 5542 1 1 19 MET HB2 H -0.497 2.439 -2.127 1.00 . A A . 19 MET HB2 1 1 11 5543 1 1 19 MET HB3 H 1.172 2.357 -1.611 1.00 . A A . 19 MET HB3 1 1 11 5544 1 1 19 MET HE1 H -0.257 7.099 -0.872 1.00 . A A . 19 MET HE1 1 1 11 5545 1 1 19 MET HE2 H -1.169 6.173 0.320 1.00 . A A . 19 MET HE2 1 1 11 5546 1 1 19 MET HE3 H -2.018 7.184 -0.849 1.00 . A A . 19 MET HE3 1 1 11 5547 1 1 19 MET HG2 H 0.272 4.019 -0.331 1.00 . A A . 19 MET HG2 1 1 11 5548 1 1 19 MET HG3 H 1.112 4.882 -1.596 1.00 . A A . 19 MET HG3 1 1 11 5549 1 1 19 MET N N -0.102 3.594 -4.499 1.00 . A A . 19 MET N 1 1 11 5550 1 1 19 MET O O 0.585 1.135 -4.974 1.00 . A A . 19 MET O 1 1 11 5551 1 1 19 MET SD S -1.250 5.154 -1.833 1.00 . A A . 19 MET SD 1 1 11 5552 1 1 20 VAL C C 2.254 -1.122 -2.689 1.00 . A A . 20 VAL C 1 1 11 5553 1 1 20 VAL CA C 2.666 -0.246 -3.848 1.00 . A A . 20 VAL CA 1 1 11 5554 1 1 20 VAL CB C 4.204 -0.394 -4.042 1.00 . A A . 20 VAL CB 1 1 11 5555 1 1 20 VAL CG1 C 4.564 -1.782 -4.563 1.00 . A A . 20 VAL CG1 1 1 11 5556 1 1 20 VAL CG2 C 4.763 0.685 -4.943 1.00 . A A . 20 VAL CG2 1 1 11 5557 1 1 20 VAL H H 2.789 1.616 -2.845 1.00 . A A . 20 VAL H 1 1 11 5558 1 1 20 VAL HA H 2.152 -0.551 -4.746 1.00 . A A . 20 VAL HA 1 1 11 5559 1 1 20 VAL HB H 4.663 -0.307 -3.070 1.00 . A A . 20 VAL HB 1 1 11 5560 1 1 20 VAL HG11 H 4.223 -2.528 -3.863 1.00 . A A . 20 VAL HG11 1 1 11 5561 1 1 20 VAL HG12 H 5.635 -1.858 -4.677 1.00 . A A . 20 VAL HG12 1 1 11 5562 1 1 20 VAL HG13 H 4.090 -1.942 -5.521 1.00 . A A . 20 VAL HG13 1 1 11 5563 1 1 20 VAL HG21 H 5.833 0.561 -5.028 1.00 . A A . 20 VAL HG21 1 1 11 5564 1 1 20 VAL HG22 H 4.543 1.657 -4.527 1.00 . A A . 20 VAL HG22 1 1 11 5565 1 1 20 VAL HG23 H 4.317 0.600 -5.922 1.00 . A A . 20 VAL HG23 1 1 11 5566 1 1 20 VAL N N 2.281 1.108 -3.518 1.00 . A A . 20 VAL N 1 1 11 5567 1 1 20 VAL O O 2.635 -0.856 -1.541 1.00 . A A . 20 VAL O 1 1 11 5568 1 1 21 CYS C C 2.037 -4.080 -1.668 1.00 . A A . 21 CYS C 1 1 11 5569 1 1 21 CYS CA C 0.998 -3.008 -1.931 1.00 . A A . 21 CYS CA 1 1 11 5570 1 1 21 CYS CB C -0.344 -3.644 -2.302 1.00 . A A . 21 CYS CB 1 1 11 5571 1 1 21 CYS H H 1.172 -2.282 -3.890 1.00 . A A . 21 CYS H 1 1 11 5572 1 1 21 CYS HA H 0.872 -2.421 -1.033 1.00 . A A . 21 CYS HA 1 1 11 5573 1 1 21 CYS HB2 H -1.026 -2.878 -2.635 1.00 . A A . 21 CYS HB2 1 1 11 5574 1 1 21 CYS HB3 H -0.181 -4.347 -3.103 1.00 . A A . 21 CYS HB3 1 1 11 5575 1 1 21 CYS N N 1.460 -2.126 -2.966 1.00 . A A . 21 CYS N 1 1 11 5576 1 1 21 CYS O O 2.442 -4.816 -2.583 1.00 . A A . 21 CYS O 1 1 11 5577 1 1 21 CYS SG S -1.141 -4.546 -0.939 1.00 . A A . 21 CYS SG 1 1 11 5578 1 1 22 ARG C C 3.247 -5.285 1.509 1.00 . A A . 22 ARG C 1 1 11 5579 1 1 22 ARG CA C 3.466 -5.077 0.031 1.00 . A A . 22 ARG CA 1 1 11 5580 1 1 22 ARG CB C 4.906 -4.566 -0.195 1.00 . A A . 22 ARG CB 1 1 11 5581 1 1 22 ARG CD C 5.584 -6.162 -2.071 1.00 . A A . 22 ARG CD 1 1 11 5582 1 1 22 ARG CG C 5.466 -4.701 -1.591 1.00 . A A . 22 ARG CG 1 1 11 5583 1 1 22 ARG CZ C 4.111 -8.183 -2.169 1.00 . A A . 22 ARG CZ 1 1 11 5584 1 1 22 ARG H H 2.163 -3.477 0.213 1.00 . A A . 22 ARG H 1 1 11 5585 1 1 22 ARG HA H 3.334 -6.009 -0.497 1.00 . A A . 22 ARG HA 1 1 11 5586 1 1 22 ARG HB2 H 4.912 -3.510 0.034 1.00 . A A . 22 ARG HB2 1 1 11 5587 1 1 22 ARG HB3 H 5.600 -5.039 0.482 1.00 . A A . 22 ARG HB3 1 1 11 5588 1 1 22 ARG HD2 H 6.093 -6.175 -3.024 1.00 . A A . 22 ARG HD2 1 1 11 5589 1 1 22 ARG HD3 H 6.178 -6.702 -1.351 1.00 . A A . 22 ARG HD3 1 1 11 5590 1 1 22 ARG HE H 3.522 -6.247 -2.400 1.00 . A A . 22 ARG HE 1 1 11 5591 1 1 22 ARG HG2 H 4.872 -4.124 -2.279 1.00 . A A . 22 ARG HG2 1 1 11 5592 1 1 22 ARG HG3 H 6.459 -4.296 -1.481 1.00 . A A . 22 ARG HG3 1 1 11 5593 1 1 22 ARG HH11 H 6.074 -8.649 -1.792 1.00 . A A . 22 ARG HH11 1 1 11 5594 1 1 22 ARG HH12 H 5.011 -9.983 -1.858 1.00 . A A . 22 ARG HH12 1 1 11 5595 1 1 22 ARG HH21 H 2.097 -8.136 -2.513 1.00 . A A . 22 ARG HH21 1 1 11 5596 1 1 22 ARG HH22 H 2.750 -9.694 -2.319 1.00 . A A . 22 ARG HH22 1 1 11 5597 1 1 22 ARG N N 2.501 -4.123 -0.449 1.00 . A A . 22 ARG N 1 1 11 5598 1 1 22 ARG NE N 4.288 -6.850 -2.232 1.00 . A A . 22 ARG NE 1 1 11 5599 1 1 22 ARG NH1 N 5.139 -8.986 -1.928 1.00 . A A . 22 ARG NH1 1 1 11 5600 1 1 22 ARG NH2 N 2.908 -8.702 -2.341 1.00 . A A . 22 ARG NH2 1 1 11 5601 1 1 22 ARG O O 2.143 -4.975 2.058 1.00 . A A . 22 ARG O 1 1 11 5602 1 1 23 LEU C C 4.000 -4.630 4.335 1.00 . A A . 23 LEU C 1 1 11 5603 1 1 23 LEU CA C 4.321 -5.962 3.624 1.00 . A A . 23 LEU CA 1 1 11 5604 1 1 23 LEU CB C 5.693 -6.510 4.064 1.00 . A A . 23 LEU CB 1 1 11 5605 1 1 23 LEU CD1 C 4.913 -7.952 5.984 1.00 . A A . 23 LEU CD1 1 1 11 5606 1 1 23 LEU CD2 C 7.306 -7.246 5.835 1.00 . A A . 23 LEU CD2 1 1 11 5607 1 1 23 LEU CG C 5.871 -6.849 5.551 1.00 . A A . 23 LEU CG 1 1 11 5608 1 1 23 LEU H H 5.101 -5.978 1.629 1.00 . A A . 23 LEU H 1 1 11 5609 1 1 23 LEU HA H 3.550 -6.679 3.862 1.00 . A A . 23 LEU HA 1 1 11 5610 1 1 23 LEU HB2 H 5.881 -7.413 3.503 1.00 . A A . 23 LEU HB2 1 1 11 5611 1 1 23 LEU HB3 H 6.447 -5.785 3.794 1.00 . A A . 23 LEU HB3 1 1 11 5612 1 1 23 LEU HD11 H 5.093 -8.839 5.394 1.00 . A A . 23 LEU HD11 1 1 11 5613 1 1 23 LEU HD12 H 3.894 -7.623 5.844 1.00 . A A . 23 LEU HD12 1 1 11 5614 1 1 23 LEU HD13 H 5.076 -8.177 7.027 1.00 . A A . 23 LEU HD13 1 1 11 5615 1 1 23 LEU HD21 H 7.563 -8.118 5.251 1.00 . A A . 23 LEU HD21 1 1 11 5616 1 1 23 LEU HD22 H 7.416 -7.469 6.886 1.00 . A A . 23 LEU HD22 1 1 11 5617 1 1 23 LEU HD23 H 7.963 -6.432 5.570 1.00 . A A . 23 LEU HD23 1 1 11 5618 1 1 23 LEU HG H 5.642 -5.970 6.132 1.00 . A A . 23 LEU HG 1 1 11 5619 1 1 23 LEU N N 4.306 -5.759 2.168 1.00 . A A . 23 LEU N 1 1 11 5620 1 1 23 LEU O O 3.613 -4.601 5.499 1.00 . A A . 23 LEU O 1 1 11 5621 1 1 24 TRP C C 3.273 -1.539 2.769 1.00 . A A . 24 TRP C 1 1 11 5622 1 1 24 TRP CA C 3.776 -2.246 4.027 1.00 . A A . 24 TRP CA 1 1 11 5623 1 1 24 TRP CB C 4.951 -1.466 4.665 1.00 . A A . 24 TRP CB 1 1 11 5624 1 1 24 TRP CD1 C 6.012 0.404 3.301 1.00 . A A . 24 TRP CD1 1 1 11 5625 1 1 24 TRP CD2 C 6.977 -1.583 2.971 1.00 . A A . 24 TRP CD2 1 1 11 5626 1 1 24 TRP CE2 C 7.632 -0.626 2.168 1.00 . A A . 24 TRP CE2 1 1 11 5627 1 1 24 TRP CE3 C 7.411 -2.906 2.929 1.00 . A A . 24 TRP CE3 1 1 11 5628 1 1 24 TRP CG C 5.941 -0.893 3.687 1.00 . A A . 24 TRP CG 1 1 11 5629 1 1 24 TRP CH2 C 9.099 -2.258 1.319 1.00 . A A . 24 TRP CH2 1 1 11 5630 1 1 24 TRP CZ2 C 8.695 -0.954 1.339 1.00 . A A . 24 TRP CZ2 1 1 11 5631 1 1 24 TRP CZ3 C 8.468 -3.230 2.103 1.00 . A A . 24 TRP CZ3 1 1 11 5632 1 1 24 TRP H H 4.556 -3.613 2.709 1.00 . A A . 24 TRP H 1 1 11 5633 1 1 24 TRP HA H 2.972 -2.373 4.734 1.00 . A A . 24 TRP HA 1 1 11 5634 1 1 24 TRP HB2 H 4.550 -0.643 5.239 1.00 . A A . 24 TRP HB2 1 1 11 5635 1 1 24 TRP HB3 H 5.479 -2.129 5.333 1.00 . A A . 24 TRP HB3 1 1 11 5636 1 1 24 TRP HD1 H 5.335 1.156 3.682 1.00 . A A . 24 TRP HD1 1 1 11 5637 1 1 24 TRP HE1 H 7.273 1.428 1.963 1.00 . A A . 24 TRP HE1 1 1 11 5638 1 1 24 TRP HE3 H 6.936 -3.665 3.532 1.00 . A A . 24 TRP HE3 1 1 11 5639 1 1 24 TRP HH2 H 9.920 -2.557 0.685 1.00 . A A . 24 TRP HH2 1 1 11 5640 1 1 24 TRP HZ2 H 9.197 -0.220 0.726 1.00 . A A . 24 TRP HZ2 1 1 11 5641 1 1 24 TRP HZ3 H 8.821 -4.249 2.053 1.00 . A A . 24 TRP HZ3 1 1 11 5642 1 1 24 TRP N N 4.172 -3.545 3.610 1.00 . A A . 24 TRP N 1 1 11 5643 1 1 24 TRP NE1 N 7.025 0.577 2.390 1.00 . A A . 24 TRP NE1 1 1 11 5644 1 1 24 TRP O O 3.559 -2.010 1.659 1.00 . A A . 24 TRP O 1 1 11 5645 1 1 25 CYS C C 3.165 1.297 1.448 1.00 . A A . 25 CYS C 1 1 11 5646 1 1 25 CYS CA C 2.117 0.273 1.752 1.00 . A A . 25 CYS CA 1 1 11 5647 1 1 25 CYS CB C 0.760 0.929 1.929 1.00 . A A . 25 CYS CB 1 1 11 5648 1 1 25 CYS H H 2.224 -0.176 3.792 1.00 . A A . 25 CYS H 1 1 11 5649 1 1 25 CYS HA H 2.074 -0.417 0.921 1.00 . A A . 25 CYS HA 1 1 11 5650 1 1 25 CYS HB2 H 0.691 1.342 2.925 1.00 . A A . 25 CYS HB2 1 1 11 5651 1 1 25 CYS HB3 H 0.664 1.727 1.208 1.00 . A A . 25 CYS HB3 1 1 11 5652 1 1 25 CYS N N 2.516 -0.490 2.909 1.00 . A A . 25 CYS N 1 1 11 5653 1 1 25 CYS O O 3.450 2.174 2.267 1.00 . A A . 25 CYS O 1 1 11 5654 1 1 25 CYS SG S -0.647 -0.188 1.703 1.00 . A A . 25 CYS SG 1 1 11 5655 1 1 26 LYS C C 4.249 3.245 -0.817 1.00 . A A . 26 LYS C 1 1 11 5656 1 1 26 LYS CA C 4.813 2.066 -0.083 1.00 . A A . 26 LYS CA 1 1 11 5657 1 1 26 LYS CB C 5.828 1.354 -0.981 1.00 . A A . 26 LYS CB 1 1 11 5658 1 1 26 LYS CD C 7.848 1.603 -2.465 1.00 . A A . 26 LYS CD 1 1 11 5659 1 1 26 LYS CE C 8.912 2.577 -2.940 1.00 . A A . 26 LYS CE 1 1 11 5660 1 1 26 LYS CG C 6.966 2.259 -1.430 1.00 . A A . 26 LYS CG 1 1 11 5661 1 1 26 LYS H H 3.421 0.507 -0.333 1.00 . A A . 26 LYS H 1 1 11 5662 1 1 26 LYS HA H 5.314 2.400 0.812 1.00 . A A . 26 LYS HA 1 1 11 5663 1 1 26 LYS HB2 H 6.243 0.508 -0.454 1.00 . A A . 26 LYS HB2 1 1 11 5664 1 1 26 LYS HB3 H 5.310 1.009 -1.861 1.00 . A A . 26 LYS HB3 1 1 11 5665 1 1 26 LYS HD2 H 8.325 0.738 -2.029 1.00 . A A . 26 LYS HD2 1 1 11 5666 1 1 26 LYS HD3 H 7.245 1.302 -3.310 1.00 . A A . 26 LYS HD3 1 1 11 5667 1 1 26 LYS HE2 H 8.419 3.446 -3.348 1.00 . A A . 26 LYS HE2 1 1 11 5668 1 1 26 LYS HE3 H 9.511 2.876 -2.093 1.00 . A A . 26 LYS HE3 1 1 11 5669 1 1 26 LYS HG2 H 6.548 3.160 -1.853 1.00 . A A . 26 LYS HG2 1 1 11 5670 1 1 26 LYS HG3 H 7.565 2.513 -0.570 1.00 . A A . 26 LYS HG3 1 1 11 5671 1 1 26 LYS HZ1 H 9.234 1.802 -4.838 1.00 . A A . 26 LYS HZ1 1 1 11 5672 1 1 26 LYS HZ2 H 10.199 1.103 -3.652 1.00 . A A . 26 LYS HZ2 1 1 11 5673 1 1 26 LYS HZ3 H 10.553 2.645 -4.217 1.00 . A A . 26 LYS HZ3 1 1 11 5674 1 1 26 LYS N N 3.749 1.185 0.297 1.00 . A A . 26 LYS N 1 1 11 5675 1 1 26 LYS NZ N 9.779 1.997 -3.975 1.00 . A A . 26 LYS NZ 1 1 11 5676 1 1 26 LYS O O 3.558 3.073 -1.828 1.00 . A A . 26 LYS O 1 1 11 5677 1 1 27 LYS C C 4.921 5.786 -2.244 1.00 . A A . 27 LYS C 1 1 11 5678 1 1 27 LYS CA C 4.109 5.642 -0.970 1.00 . A A . 27 LYS CA 1 1 11 5679 1 1 27 LYS CB C 4.324 6.872 -0.068 1.00 . A A . 27 LYS CB 1 1 11 5680 1 1 27 LYS CD C 5.946 8.332 1.244 1.00 . A A . 27 LYS CD 1 1 11 5681 1 1 27 LYS CE C 5.457 9.647 0.636 1.00 . A A . 27 LYS CE 1 1 11 5682 1 1 27 LYS CG C 5.779 7.130 0.315 1.00 . A A . 27 LYS CG 1 1 11 5683 1 1 27 LYS H H 4.979 4.471 0.558 1.00 . A A . 27 LYS H 1 1 11 5684 1 1 27 LYS HA H 3.063 5.561 -1.222 1.00 . A A . 27 LYS HA 1 1 11 5685 1 1 27 LYS HB2 H 3.954 7.740 -0.590 1.00 . A A . 27 LYS HB2 1 1 11 5686 1 1 27 LYS HB3 H 3.744 6.744 0.831 1.00 . A A . 27 LYS HB3 1 1 11 5687 1 1 27 LYS HD2 H 5.390 8.151 2.152 1.00 . A A . 27 LYS HD2 1 1 11 5688 1 1 27 LYS HD3 H 6.993 8.428 1.485 1.00 . A A . 27 LYS HD3 1 1 11 5689 1 1 27 LYS HE2 H 4.404 9.563 0.412 1.00 . A A . 27 LYS HE2 1 1 11 5690 1 1 27 LYS HE3 H 5.595 10.429 1.369 1.00 . A A . 27 LYS HE3 1 1 11 5691 1 1 27 LYS HG2 H 6.163 6.252 0.814 1.00 . A A . 27 LYS HG2 1 1 11 5692 1 1 27 LYS HG3 H 6.342 7.298 -0.590 1.00 . A A . 27 LYS HG3 1 1 11 5693 1 1 27 LYS HZ1 H 5.982 9.360 -1.382 1.00 . A A . 27 LYS HZ1 1 1 11 5694 1 1 27 LYS HZ2 H 7.211 10.015 -0.448 1.00 . A A . 27 LYS HZ2 1 1 11 5695 1 1 27 LYS HZ3 H 5.916 10.975 -0.909 1.00 . A A . 27 LYS HZ3 1 1 11 5696 1 1 27 LYS N N 4.506 4.427 -0.302 1.00 . A A . 27 LYS N 1 1 11 5697 1 1 27 LYS NZ N 6.183 10.018 -0.602 1.00 . A A . 27 LYS NZ 1 1 11 5698 1 1 27 LYS O O 6.084 5.340 -2.294 1.00 . A A . 27 LYS O 1 1 11 5699 1 1 28 LYS C C 5.093 5.279 -5.294 1.00 . A A . 28 LYS C 1 1 11 5700 1 1 28 LYS CA C 4.915 6.615 -4.551 1.00 . A A . 28 LYS CA 1 1 11 5701 1 1 28 LYS CB C 6.226 7.428 -4.416 1.00 . A A . 28 LYS CB 1 1 11 5702 1 1 28 LYS CD C 8.017 8.833 -5.393 1.00 . A A . 28 LYS CD 1 1 11 5703 1 1 28 LYS CE C 8.687 9.367 -6.644 1.00 . A A . 28 LYS CE 1 1 11 5704 1 1 28 LYS CG C 6.874 7.879 -5.706 1.00 . A A . 28 LYS CG 1 1 11 5705 1 1 28 LYS H H 3.398 6.709 -3.079 1.00 . A A . 28 LYS H 1 1 11 5706 1 1 28 LYS HA H 4.196 7.192 -5.111 1.00 . A A . 28 LYS HA 1 1 11 5707 1 1 28 LYS HB2 H 6.021 8.311 -3.830 1.00 . A A . 28 LYS HB2 1 1 11 5708 1 1 28 LYS HB3 H 6.938 6.822 -3.874 1.00 . A A . 28 LYS HB3 1 1 11 5709 1 1 28 LYS HD2 H 7.626 9.670 -4.832 1.00 . A A . 28 LYS HD2 1 1 11 5710 1 1 28 LYS HD3 H 8.748 8.315 -4.792 1.00 . A A . 28 LYS HD3 1 1 11 5711 1 1 28 LYS HE2 H 7.927 9.758 -7.301 1.00 . A A . 28 LYS HE2 1 1 11 5712 1 1 28 LYS HE3 H 9.353 10.169 -6.362 1.00 . A A . 28 LYS HE3 1 1 11 5713 1 1 28 LYS HG2 H 7.251 7.019 -6.240 1.00 . A A . 28 LYS HG2 1 1 11 5714 1 1 28 LYS HG3 H 6.138 8.395 -6.305 1.00 . A A . 28 LYS HG3 1 1 11 5715 1 1 28 LYS HZ1 H 10.231 7.985 -6.780 1.00 . A A . 28 LYS HZ1 1 1 11 5716 1 1 28 LYS HZ2 H 9.836 8.741 -8.244 1.00 . A A . 28 LYS HZ2 1 1 11 5717 1 1 28 LYS HZ3 H 8.857 7.525 -7.644 1.00 . A A . 28 LYS HZ3 1 1 11 5718 1 1 28 LYS N N 4.312 6.392 -3.242 1.00 . A A . 28 LYS N 1 1 11 5719 1 1 28 LYS NZ N 9.448 8.339 -7.366 1.00 . A A . 28 LYS NZ 1 1 11 5720 1 1 28 LYS O O 6.056 4.530 -5.065 1.00 . A A . 28 LYS O 1 1 11 5721 1 1 29 LEU C C 5.306 3.402 -7.671 1.00 . A A . 29 LEU C 1 1 11 5722 1 1 29 LEU CA C 4.007 3.754 -6.936 1.00 . A A . 29 LEU CA 1 1 11 5723 1 1 29 LEU CB C 2.840 3.881 -7.934 1.00 . A A . 29 LEU CB 1 1 11 5724 1 1 29 LEU CD1 C 2.100 1.469 -7.946 1.00 . A A . 29 LEU CD1 1 1 11 5725 1 1 29 LEU CD2 C 1.425 2.994 -9.796 1.00 . A A . 29 LEU CD2 1 1 11 5726 1 1 29 LEU CG C 2.516 2.655 -8.802 1.00 . A A . 29 LEU CG 1 1 11 5727 1 1 29 LEU H H 3.414 5.668 -6.279 1.00 . A A . 29 LEU H 1 1 11 5728 1 1 29 LEU HA H 3.772 2.958 -6.246 1.00 . A A . 29 LEU HA 1 1 11 5729 1 1 29 LEU HB2 H 1.952 4.131 -7.374 1.00 . A A . 29 LEU HB2 1 1 11 5730 1 1 29 LEU HB3 H 3.062 4.709 -8.593 1.00 . A A . 29 LEU HB3 1 1 11 5731 1 1 29 LEU HD11 H 1.230 1.731 -7.362 1.00 . A A . 29 LEU HD11 1 1 11 5732 1 1 29 LEU HD12 H 2.909 1.195 -7.288 1.00 . A A . 29 LEU HD12 1 1 11 5733 1 1 29 LEU HD13 H 1.861 0.633 -8.588 1.00 . A A . 29 LEU HD13 1 1 11 5734 1 1 29 LEU HD21 H 0.536 3.301 -9.264 1.00 . A A . 29 LEU HD21 1 1 11 5735 1 1 29 LEU HD22 H 1.203 2.126 -10.398 1.00 . A A . 29 LEU HD22 1 1 11 5736 1 1 29 LEU HD23 H 1.757 3.800 -10.433 1.00 . A A . 29 LEU HD23 1 1 11 5737 1 1 29 LEU HG H 3.400 2.377 -9.355 1.00 . A A . 29 LEU HG 1 1 11 5738 1 1 29 LEU N N 4.117 4.996 -6.159 1.00 . A A . 29 LEU N 1 1 11 5739 1 1 29 LEU O O 5.721 2.229 -7.702 1.00 . A A . 29 LEU O 1 1 11 5740 1 1 30 TRP C C 7.848 5.548 -9.075 1.00 . A A . 30 TRP C 1 1 11 5741 1 1 30 TRP CA C 7.188 4.199 -8.929 1.00 . A A . 30 TRP CA 1 1 11 5742 1 1 30 TRP CB C 6.959 3.545 -10.300 1.00 . A A . 30 TRP CB 1 1 11 5743 1 1 30 TRP CD1 C 8.990 3.702 -11.870 1.00 . A A . 30 TRP CD1 1 1 11 5744 1 1 30 TRP CD2 C 8.786 1.739 -10.831 1.00 . A A . 30 TRP CD2 1 1 11 5745 1 1 30 TRP CE2 C 9.914 1.686 -11.668 1.00 . A A . 30 TRP CE2 1 1 11 5746 1 1 30 TRP CE3 C 8.461 0.615 -10.074 1.00 . A A . 30 TRP CE3 1 1 11 5747 1 1 30 TRP CG C 8.206 3.039 -10.977 1.00 . A A . 30 TRP CG 1 1 11 5748 1 1 30 TRP CH2 C 10.368 -0.528 -11.016 1.00 . A A . 30 TRP CH2 1 1 11 5749 1 1 30 TRP CZ2 C 10.712 0.552 -11.767 1.00 . A A . 30 TRP CZ2 1 1 11 5750 1 1 30 TRP CZ3 C 9.257 -0.505 -10.174 1.00 . A A . 30 TRP CZ3 1 1 11 5751 1 1 30 TRP H H 5.572 5.302 -8.201 1.00 . A A . 30 TRP H 1 1 11 5752 1 1 30 TRP HA H 7.814 3.561 -8.322 1.00 . A A . 30 TRP HA 1 1 11 5753 1 1 30 TRP HB2 H 6.290 2.706 -10.181 1.00 . A A . 30 TRP HB2 1 1 11 5754 1 1 30 TRP HB3 H 6.497 4.271 -10.952 1.00 . A A . 30 TRP HB3 1 1 11 5755 1 1 30 TRP HD1 H 8.817 4.717 -12.195 1.00 . A A . 30 TRP HD1 1 1 11 5756 1 1 30 TRP HE1 H 10.702 3.163 -12.946 1.00 . A A . 30 TRP HE1 1 1 11 5757 1 1 30 TRP HE3 H 7.605 0.619 -9.417 1.00 . A A . 30 TRP HE3 1 1 11 5758 1 1 30 TRP HH2 H 10.962 -1.429 -11.068 1.00 . A A . 30 TRP HH2 1 1 11 5759 1 1 30 TRP HZ2 H 11.579 0.508 -12.410 1.00 . A A . 30 TRP HZ2 1 1 11 5760 1 1 30 TRP HZ3 H 9.024 -1.386 -9.596 1.00 . A A . 30 TRP HZ3 1 1 11 5761 1 1 30 TRP N N 5.939 4.391 -8.243 1.00 . A A . 30 TRP N 1 1 11 5762 1 1 30 TRP NE1 N 10.015 2.895 -12.293 1.00 . A A . 30 TRP NE1 1 1 11 5763 1 1 30 TRP O O 7.605 6.245 -10.081 1.00 . A A . 30 TRP O 1 1 11 5764 1 1 30 TRP OXT O 8.579 5.955 -8.148 1.00 . A A . 30 TRP OXT 1 1 12 5765 1 1 1 TYR C C -10.050 1.195 2.306 1.00 . A A . 1 TYR C 1 1 12 5766 1 1 1 TYR CA C -11.224 1.925 2.899 1.00 . A A . 1 TYR CA 1 1 12 5767 1 1 1 TYR CB C -10.891 2.284 4.360 1.00 . A A . 1 TYR CB 1 1 12 5768 1 1 1 TYR CD1 C -12.994 2.419 5.759 1.00 . A A . 1 TYR CD1 1 1 12 5769 1 1 1 TYR CD2 C -11.910 4.452 5.165 1.00 . A A . 1 TYR CD2 1 1 12 5770 1 1 1 TYR CE1 C -13.954 3.128 6.446 1.00 . A A . 1 TYR CE1 1 1 12 5771 1 1 1 TYR CE2 C -12.869 5.168 5.849 1.00 . A A . 1 TYR CE2 1 1 12 5772 1 1 1 TYR CG C -11.955 3.065 5.105 1.00 . A A . 1 TYR CG 1 1 12 5773 1 1 1 TYR CZ C -13.888 4.501 6.487 1.00 . A A . 1 TYR CZ 1 1 12 5774 1 1 1 TYR H1 H -12.591 0.842 1.826 1.00 . A A . 1 TYR H1 1 1 12 5775 1 1 1 TYR H2 H -13.244 1.520 3.220 1.00 . A A . 1 TYR H2 1 1 12 5776 1 1 1 TYR H3 H -12.216 0.163 3.308 1.00 . A A . 1 TYR H3 1 1 12 5777 1 1 1 TYR HA H -11.412 2.826 2.337 1.00 . A A . 1 TYR HA 1 1 12 5778 1 1 1 TYR HB2 H -10.719 1.370 4.904 1.00 . A A . 1 TYR HB2 1 1 12 5779 1 1 1 TYR HB3 H -9.980 2.864 4.372 1.00 . A A . 1 TYR HB3 1 1 12 5780 1 1 1 TYR HD1 H -13.050 1.340 5.727 1.00 . A A . 1 TYR HD1 1 1 12 5781 1 1 1 TYR HD2 H -11.110 4.978 4.664 1.00 . A A . 1 TYR HD2 1 1 12 5782 1 1 1 TYR HE1 H -14.751 2.595 6.943 1.00 . A A . 1 TYR HE1 1 1 12 5783 1 1 1 TYR HE2 H -12.813 6.246 5.878 1.00 . A A . 1 TYR HE2 1 1 12 5784 1 1 1 TYR HH H -14.999 4.786 8.024 1.00 . A A . 1 TYR HH 1 1 12 5785 1 1 1 TYR N N -12.397 1.064 2.822 1.00 . A A . 1 TYR N 1 1 12 5786 1 1 1 TYR O O -9.979 -0.032 2.383 1.00 . A A . 1 TYR O 1 1 12 5787 1 1 1 TYR OH O -14.840 5.209 7.172 1.00 . A A . 1 TYR OH 1 1 12 5788 1 1 2 CYS C C -6.842 1.493 2.208 1.00 . A A . 2 CYS C 1 1 12 5789 1 1 2 CYS CA C -7.947 1.340 1.187 1.00 . A A . 2 CYS CA 1 1 12 5790 1 1 2 CYS CB C -7.577 2.026 -0.124 1.00 . A A . 2 CYS CB 1 1 12 5791 1 1 2 CYS H H -9.260 2.894 1.668 1.00 . A A . 2 CYS H 1 1 12 5792 1 1 2 CYS HA H -8.127 0.291 1.008 1.00 . A A . 2 CYS HA 1 1 12 5793 1 1 2 CYS HB2 H -6.614 1.659 -0.444 1.00 . A A . 2 CYS HB2 1 1 12 5794 1 1 2 CYS HB3 H -8.316 1.779 -0.870 1.00 . A A . 2 CYS HB3 1 1 12 5795 1 1 2 CYS N N -9.148 1.919 1.726 1.00 . A A . 2 CYS N 1 1 12 5796 1 1 2 CYS O O -6.999 2.240 3.188 1.00 . A A . 2 CYS O 1 1 12 5797 1 1 2 CYS SG S -7.467 3.849 -0.013 1.00 . A A . 2 CYS SG 1 1 12 5798 1 1 3 GLN C C -3.813 2.093 2.564 1.00 . A A . 3 GLN C 1 1 12 5799 1 1 3 GLN CA C -4.673 0.917 2.951 1.00 . A A . 3 GLN CA 1 1 12 5800 1 1 3 GLN CB C -3.845 -0.353 3.005 1.00 . A A . 3 GLN CB 1 1 12 5801 1 1 3 GLN CD C -5.270 -1.476 4.747 1.00 . A A . 3 GLN CD 1 1 12 5802 1 1 3 GLN CG C -4.632 -1.591 3.383 1.00 . A A . 3 GLN CG 1 1 12 5803 1 1 3 GLN H H -5.690 0.157 1.289 1.00 . A A . 3 GLN H 1 1 12 5804 1 1 3 GLN HA H -5.113 1.091 3.917 1.00 . A A . 3 GLN HA 1 1 12 5805 1 1 3 GLN HB2 H -3.377 -0.508 2.045 1.00 . A A . 3 GLN HB2 1 1 12 5806 1 1 3 GLN HB3 H -3.065 -0.214 3.739 1.00 . A A . 3 GLN HB3 1 1 12 5807 1 1 3 GLN HE21 H -3.652 -2.221 5.583 1.00 . A A . 3 GLN HE21 1 1 12 5808 1 1 3 GLN HE22 H -4.963 -1.826 6.649 1.00 . A A . 3 GLN HE22 1 1 12 5809 1 1 3 GLN HG2 H -5.412 -1.730 2.649 1.00 . A A . 3 GLN HG2 1 1 12 5810 1 1 3 GLN HG3 H -3.971 -2.445 3.363 1.00 . A A . 3 GLN HG3 1 1 12 5811 1 1 3 GLN N N -5.763 0.793 2.034 1.00 . A A . 3 GLN N 1 1 12 5812 1 1 3 GLN NE2 N -4.559 -1.873 5.757 1.00 . A A . 3 GLN NE2 1 1 12 5813 1 1 3 GLN O O -3.296 2.148 1.441 1.00 . A A . 3 GLN O 1 1 12 5814 1 1 3 GLN OE1 O -6.407 -1.019 4.883 1.00 . A A . 3 GLN OE1 1 1 12 5815 1 1 4 LYS C C -1.413 3.911 3.286 1.00 . A A . 4 LYS C 1 1 12 5816 1 1 4 LYS CA C -2.894 4.233 3.226 1.00 . A A . 4 LYS CA 1 1 12 5817 1 1 4 LYS CB C -3.199 5.361 4.226 1.00 . A A . 4 LYS CB 1 1 12 5818 1 1 4 LYS CD C -4.658 7.241 4.972 1.00 . A A . 4 LYS CD 1 1 12 5819 1 1 4 LYS CE C -5.979 7.978 4.805 1.00 . A A . 4 LYS CE 1 1 12 5820 1 1 4 LYS CG C -4.565 6.003 4.087 1.00 . A A . 4 LYS CG 1 1 12 5821 1 1 4 LYS H H -4.177 2.958 4.316 1.00 . A A . 4 LYS H 1 1 12 5822 1 1 4 LYS HA H -3.127 4.586 2.233 1.00 . A A . 4 LYS HA 1 1 12 5823 1 1 4 LYS HB2 H -3.130 4.960 5.226 1.00 . A A . 4 LYS HB2 1 1 12 5824 1 1 4 LYS HB3 H -2.450 6.130 4.112 1.00 . A A . 4 LYS HB3 1 1 12 5825 1 1 4 LYS HD2 H -4.564 6.941 6.003 1.00 . A A . 4 LYS HD2 1 1 12 5826 1 1 4 LYS HD3 H -3.849 7.911 4.720 1.00 . A A . 4 LYS HD3 1 1 12 5827 1 1 4 LYS HE2 H -5.947 8.893 5.373 1.00 . A A . 4 LYS HE2 1 1 12 5828 1 1 4 LYS HE3 H -6.099 8.219 3.759 1.00 . A A . 4 LYS HE3 1 1 12 5829 1 1 4 LYS HG2 H -4.718 6.287 3.058 1.00 . A A . 4 LYS HG2 1 1 12 5830 1 1 4 LYS HG3 H -5.320 5.293 4.395 1.00 . A A . 4 LYS HG3 1 1 12 5831 1 1 4 LYS HZ1 H -7.186 6.286 4.729 1.00 . A A . 4 LYS HZ1 1 1 12 5832 1 1 4 LYS HZ2 H -8.021 7.700 5.061 1.00 . A A . 4 LYS HZ2 1 1 12 5833 1 1 4 LYS HZ3 H -7.085 6.977 6.270 1.00 . A A . 4 LYS HZ3 1 1 12 5834 1 1 4 LYS N N -3.702 3.054 3.467 1.00 . A A . 4 LYS N 1 1 12 5835 1 1 4 LYS NZ N -7.140 7.180 5.252 1.00 . A A . 4 LYS NZ 1 1 12 5836 1 1 4 LYS O O -1.017 2.813 3.657 1.00 . A A . 4 LYS O 1 1 12 5837 1 1 5 TRP C C 1.395 4.529 4.368 1.00 . A A . 5 TRP C 1 1 12 5838 1 1 5 TRP CA C 0.847 4.833 2.976 1.00 . A A . 5 TRP CA 1 1 12 5839 1 1 5 TRP CB C 1.422 6.177 2.475 1.00 . A A . 5 TRP CB 1 1 12 5840 1 1 5 TRP CD1 C 1.882 7.820 4.415 1.00 . A A . 5 TRP CD1 1 1 12 5841 1 1 5 TRP CD2 C -0.035 8.227 3.331 1.00 . A A . 5 TRP CD2 1 1 12 5842 1 1 5 TRP CE2 C 0.111 9.172 4.369 1.00 . A A . 5 TRP CE2 1 1 12 5843 1 1 5 TRP CE3 C -1.170 8.296 2.516 1.00 . A A . 5 TRP CE3 1 1 12 5844 1 1 5 TRP CG C 1.116 7.363 3.379 1.00 . A A . 5 TRP CG 1 1 12 5845 1 1 5 TRP CH2 C -1.928 10.201 3.799 1.00 . A A . 5 TRP CH2 1 1 12 5846 1 1 5 TRP CZ2 C -0.833 10.163 4.610 1.00 . A A . 5 TRP CZ2 1 1 12 5847 1 1 5 TRP CZ3 C -2.103 9.282 2.761 1.00 . A A . 5 TRP CZ3 1 1 12 5848 1 1 5 TRP H H -1.023 5.781 2.787 1.00 . A A . 5 TRP H 1 1 12 5849 1 1 5 TRP HA H 1.141 4.054 2.288 1.00 . A A . 5 TRP HA 1 1 12 5850 1 1 5 TRP HB2 H 2.494 6.091 2.392 1.00 . A A . 5 TRP HB2 1 1 12 5851 1 1 5 TRP HB3 H 1.012 6.388 1.499 1.00 . A A . 5 TRP HB3 1 1 12 5852 1 1 5 TRP HD1 H 2.819 7.374 4.714 1.00 . A A . 5 TRP HD1 1 1 12 5853 1 1 5 TRP HE1 H 1.644 9.400 5.780 1.00 . A A . 5 TRP HE1 1 1 12 5854 1 1 5 TRP HE3 H -1.330 7.603 1.704 1.00 . A A . 5 TRP HE3 1 1 12 5855 1 1 5 TRP HH2 H -2.684 10.958 3.954 1.00 . A A . 5 TRP HH2 1 1 12 5856 1 1 5 TRP HZ2 H -0.722 10.887 5.404 1.00 . A A . 5 TRP HZ2 1 1 12 5857 1 1 5 TRP HZ3 H -2.986 9.353 2.144 1.00 . A A . 5 TRP HZ3 1 1 12 5858 1 1 5 TRP N N -0.613 4.919 3.001 1.00 . A A . 5 TRP N 1 1 12 5859 1 1 5 TRP NE1 N 1.284 8.899 5.012 1.00 . A A . 5 TRP NE1 1 1 12 5860 1 1 5 TRP O O 2.485 4.002 4.527 1.00 . A A . 5 TRP O 1 1 12 5861 1 1 6 MET C C 0.557 3.319 7.223 1.00 . A A . 6 MET C 1 1 12 5862 1 1 6 MET CA C 0.958 4.712 6.745 1.00 . A A . 6 MET CA 1 1 12 5863 1 1 6 MET CB C 0.260 5.804 7.555 1.00 . A A . 6 MET CB 1 1 12 5864 1 1 6 MET CE C 0.741 8.556 9.154 1.00 . A A . 6 MET CE 1 1 12 5865 1 1 6 MET CG C 0.542 5.771 9.038 1.00 . A A . 6 MET CG 1 1 12 5866 1 1 6 MET H H -0.239 5.305 5.123 1.00 . A A . 6 MET H 1 1 12 5867 1 1 6 MET HA H 2.027 4.832 6.846 1.00 . A A . 6 MET HA 1 1 12 5868 1 1 6 MET HB2 H 0.574 6.763 7.172 1.00 . A A . 6 MET HB2 1 1 12 5869 1 1 6 MET HB3 H -0.806 5.710 7.408 1.00 . A A . 6 MET HB3 1 1 12 5870 1 1 6 MET HE1 H 0.509 8.599 8.101 1.00 . A A . 6 MET HE1 1 1 12 5871 1 1 6 MET HE2 H 1.804 8.408 9.280 1.00 . A A . 6 MET HE2 1 1 12 5872 1 1 6 MET HE3 H 0.451 9.484 9.626 1.00 . A A . 6 MET HE3 1 1 12 5873 1 1 6 MET HG2 H 0.113 4.864 9.441 1.00 . A A . 6 MET HG2 1 1 12 5874 1 1 6 MET HG3 H 1.613 5.742 9.156 1.00 . A A . 6 MET HG3 1 1 12 5875 1 1 6 MET N N 0.612 4.884 5.357 1.00 . A A . 6 MET N 1 1 12 5876 1 1 6 MET O O 1.012 2.835 8.254 1.00 . A A . 6 MET O 1 1 12 5877 1 1 6 MET SD S -0.149 7.195 9.923 1.00 . A A . 6 MET SD 1 1 12 5878 1 1 7 TRP C C 0.001 0.296 5.984 1.00 . A A . 7 TRP C 1 1 12 5879 1 1 7 TRP CA C -0.742 1.355 6.784 1.00 . A A . 7 TRP CA 1 1 12 5880 1 1 7 TRP CB C -2.266 1.235 6.614 1.00 . A A . 7 TRP CB 1 1 12 5881 1 1 7 TRP CD1 C -2.625 2.513 8.821 1.00 . A A . 7 TRP CD1 1 1 12 5882 1 1 7 TRP CD2 C -4.415 2.482 7.481 1.00 . A A . 7 TRP CD2 1 1 12 5883 1 1 7 TRP CE2 C -4.735 3.203 8.644 1.00 . A A . 7 TRP CE2 1 1 12 5884 1 1 7 TRP CE3 C -5.391 2.329 6.504 1.00 . A A . 7 TRP CE3 1 1 12 5885 1 1 7 TRP CG C -3.052 2.055 7.605 1.00 . A A . 7 TRP CG 1 1 12 5886 1 1 7 TRP CH2 C -6.922 3.597 7.868 1.00 . A A . 7 TRP CH2 1 1 12 5887 1 1 7 TRP CZ2 C -5.984 3.764 8.847 1.00 . A A . 7 TRP CZ2 1 1 12 5888 1 1 7 TRP CZ3 C -6.635 2.885 6.705 1.00 . A A . 7 TRP CZ3 1 1 12 5889 1 1 7 TRP H H -0.527 3.090 5.606 1.00 . A A . 7 TRP H 1 1 12 5890 1 1 7 TRP HA H -0.496 1.194 7.823 1.00 . A A . 7 TRP HA 1 1 12 5891 1 1 7 TRP HB2 H -2.535 1.568 5.623 1.00 . A A . 7 TRP HB2 1 1 12 5892 1 1 7 TRP HB3 H -2.558 0.201 6.729 1.00 . A A . 7 TRP HB3 1 1 12 5893 1 1 7 TRP HD1 H -1.632 2.357 9.218 1.00 . A A . 7 TRP HD1 1 1 12 5894 1 1 7 TRP HE1 H -3.547 3.646 10.324 1.00 . A A . 7 TRP HE1 1 1 12 5895 1 1 7 TRP HE3 H -5.185 1.775 5.604 1.00 . A A . 7 TRP HE3 1 1 12 5896 1 1 7 TRP HH2 H -7.909 4.018 7.990 1.00 . A A . 7 TRP HH2 1 1 12 5897 1 1 7 TRP HZ2 H -6.219 4.319 9.743 1.00 . A A . 7 TRP HZ2 1 1 12 5898 1 1 7 TRP HZ3 H -7.403 2.771 5.954 1.00 . A A . 7 TRP HZ3 1 1 12 5899 1 1 7 TRP N N -0.268 2.677 6.454 1.00 . A A . 7 TRP N 1 1 12 5900 1 1 7 TRP NE1 N -3.626 3.217 9.440 1.00 . A A . 7 TRP NE1 1 1 12 5901 1 1 7 TRP O O 0.950 0.602 5.239 1.00 . A A . 7 TRP O 1 1 12 5902 1 1 8 THR C C -0.771 -2.902 4.783 1.00 . A A . 8 THR C 1 1 12 5903 1 1 8 THR CA C 0.271 -2.051 5.530 1.00 . A A . 8 THR CA 1 1 12 5904 1 1 8 THR CB C 0.960 -2.897 6.639 1.00 . A A . 8 THR CB 1 1 12 5905 1 1 8 THR CG2 C 2.029 -2.081 7.377 1.00 . A A . 8 THR CG2 1 1 12 5906 1 1 8 THR H H -1.178 -1.138 6.702 1.00 . A A . 8 THR H 1 1 12 5907 1 1 8 THR HA H 1.021 -1.655 4.859 1.00 . A A . 8 THR HA 1 1 12 5908 1 1 8 THR HB H 1.427 -3.759 6.186 1.00 . A A . 8 THR HB 1 1 12 5909 1 1 8 THR HG1 H 0.445 -3.946 8.192 1.00 . A A . 8 THR HG1 1 1 12 5910 1 1 8 THR HG21 H 2.502 -2.699 8.126 1.00 . A A . 8 THR HG21 1 1 12 5911 1 1 8 THR HG22 H 1.560 -1.234 7.858 1.00 . A A . 8 THR HG22 1 1 12 5912 1 1 8 THR HG23 H 2.772 -1.720 6.682 1.00 . A A . 8 THR HG23 1 1 12 5913 1 1 8 THR N N -0.395 -0.933 6.149 1.00 . A A . 8 THR N 1 1 12 5914 1 1 8 THR O O -1.981 -2.742 5.045 1.00 . A A . 8 THR O 1 1 12 5915 1 1 8 THR OG1 O -0.019 -3.333 7.606 1.00 . A A . 8 THR OG1 1 1 12 5916 1 1 9 CYS C C -0.983 -6.059 3.215 1.00 . A A . 9 CYS C 1 1 12 5917 1 1 9 CYS CA C -1.363 -4.597 3.189 1.00 . A A . 9 CYS CA 1 1 12 5918 1 1 9 CYS CB C -1.594 -4.129 1.761 1.00 . A A . 9 CYS CB 1 1 12 5919 1 1 9 CYS H H 0.577 -3.947 3.596 1.00 . A A . 9 CYS H 1 1 12 5920 1 1 9 CYS HA H -2.282 -4.482 3.745 1.00 . A A . 9 CYS HA 1 1 12 5921 1 1 9 CYS HB2 H -2.402 -4.700 1.327 1.00 . A A . 9 CYS HB2 1 1 12 5922 1 1 9 CYS HB3 H -1.864 -3.083 1.772 1.00 . A A . 9 CYS HB3 1 1 12 5923 1 1 9 CYS N N -0.361 -3.790 3.861 1.00 . A A . 9 CYS N 1 1 12 5924 1 1 9 CYS O O 0.112 -6.424 3.678 1.00 . A A . 9 CYS O 1 1 12 5925 1 1 9 CYS SG S -0.157 -4.314 0.691 1.00 . A A . 9 CYS SG 1 1 12 5926 1 1 10 ASP C C -2.342 -8.884 1.494 1.00 . A A . 10 ASP C 1 1 12 5927 1 1 10 ASP CA C -1.691 -8.339 2.736 1.00 . A A . 10 ASP CA 1 1 12 5928 1 1 10 ASP CB C -2.374 -8.967 3.969 1.00 . A A . 10 ASP CB 1 1 12 5929 1 1 10 ASP CG C -1.871 -8.458 5.294 1.00 . A A . 10 ASP CG 1 1 12 5930 1 1 10 ASP H H -2.674 -6.551 2.272 1.00 . A A . 10 ASP H 1 1 12 5931 1 1 10 ASP HA H -0.637 -8.567 2.740 1.00 . A A . 10 ASP HA 1 1 12 5932 1 1 10 ASP HB2 H -3.424 -8.736 3.909 1.00 . A A . 10 ASP HB2 1 1 12 5933 1 1 10 ASP HB3 H -2.247 -10.039 3.938 1.00 . A A . 10 ASP HB3 1 1 12 5934 1 1 10 ASP N N -1.872 -6.897 2.720 1.00 . A A . 10 ASP N 1 1 12 5935 1 1 10 ASP O O -2.529 -8.144 0.525 1.00 . A A . 10 ASP O 1 1 12 5936 1 1 10 ASP OD1 O -2.515 -7.577 5.881 1.00 . A A . 10 ASP OD1 1 1 12 5937 1 1 10 ASP OD2 O -0.822 -8.932 5.781 1.00 . A A . 10 ASP OD2 1 1 12 5938 1 1 11 SER C C -4.736 -10.164 0.151 1.00 . A A . 11 SER C 1 1 12 5939 1 1 11 SER CA C -3.341 -10.770 0.386 1.00 . A A . 11 SER CA 1 1 12 5940 1 1 11 SER CB C -3.424 -12.279 0.607 1.00 . A A . 11 SER CB 1 1 12 5941 1 1 11 SER H H -2.474 -10.714 2.276 1.00 . A A . 11 SER H 1 1 12 5942 1 1 11 SER HA H -2.737 -10.580 -0.486 1.00 . A A . 11 SER HA 1 1 12 5943 1 1 11 SER HB2 H -4.073 -12.490 1.443 1.00 . A A . 11 SER HB2 1 1 12 5944 1 1 11 SER HB3 H -3.821 -12.745 -0.281 1.00 . A A . 11 SER HB3 1 1 12 5945 1 1 11 SER HG H -2.237 -13.792 0.833 1.00 . A A . 11 SER HG 1 1 12 5946 1 1 11 SER N N -2.687 -10.149 1.506 1.00 . A A . 11 SER N 1 1 12 5947 1 1 11 SER O O -5.120 -9.885 -0.990 1.00 . A A . 11 SER O 1 1 12 5948 1 1 11 SER OG O -2.136 -12.832 0.870 1.00 . A A . 11 SER OG 1 1 12 5949 1 1 12 GLU C C -6.795 -7.847 1.097 1.00 . A A . 12 GLU C 1 1 12 5950 1 1 12 GLU CA C -6.809 -9.373 1.074 1.00 . A A . 12 GLU CA 1 1 12 5951 1 1 12 GLU CB C -7.784 -9.932 2.107 1.00 . A A . 12 GLU CB 1 1 12 5952 1 1 12 GLU CD C -8.532 -11.907 0.712 1.00 . A A . 12 GLU CD 1 1 12 5953 1 1 12 GLU CG C -7.969 -11.438 2.033 1.00 . A A . 12 GLU CG 1 1 12 5954 1 1 12 GLU H H -5.131 -10.156 2.109 1.00 . A A . 12 GLU H 1 1 12 5955 1 1 12 GLU HA H -7.153 -9.665 0.092 1.00 . A A . 12 GLU HA 1 1 12 5956 1 1 12 GLU HB2 H -7.446 -9.681 3.100 1.00 . A A . 12 GLU HB2 1 1 12 5957 1 1 12 GLU HB3 H -8.748 -9.471 1.950 1.00 . A A . 12 GLU HB3 1 1 12 5958 1 1 12 GLU HG2 H -7.006 -11.907 2.169 1.00 . A A . 12 GLU HG2 1 1 12 5959 1 1 12 GLU HG3 H -8.633 -11.745 2.826 1.00 . A A . 12 GLU HG3 1 1 12 5960 1 1 12 GLU N N -5.480 -9.933 1.219 1.00 . A A . 12 GLU N 1 1 12 5961 1 1 12 GLU O O -7.314 -7.216 0.174 1.00 . A A . 12 GLU O 1 1 12 5962 1 1 12 GLU OE1 O -9.724 -11.688 0.454 1.00 . A A . 12 GLU OE1 1 1 12 5963 1 1 12 GLU OE2 O -7.798 -12.534 -0.082 1.00 . A A . 12 GLU OE2 1 1 12 5964 1 1 13 ARG C C -5.371 -5.153 1.113 1.00 . A A . 13 ARG C 1 1 12 5965 1 1 13 ARG CA C -6.162 -5.784 2.259 1.00 . A A . 13 ARG CA 1 1 12 5966 1 1 13 ARG CB C -5.584 -5.332 3.612 1.00 . A A . 13 ARG CB 1 1 12 5967 1 1 13 ARG CD C -5.872 -5.121 6.109 1.00 . A A . 13 ARG CD 1 1 12 5968 1 1 13 ARG CG C -6.435 -5.707 4.819 1.00 . A A . 13 ARG CG 1 1 12 5969 1 1 13 ARG CZ C -3.700 -5.031 7.350 1.00 . A A . 13 ARG CZ 1 1 12 5970 1 1 13 ARG H H -5.814 -7.812 2.841 1.00 . A A . 13 ARG H 1 1 12 5971 1 1 13 ARG HA H -7.180 -5.432 2.183 1.00 . A A . 13 ARG HA 1 1 12 5972 1 1 13 ARG HB2 H -4.609 -5.781 3.737 1.00 . A A . 13 ARG HB2 1 1 12 5973 1 1 13 ARG HB3 H -5.471 -4.259 3.596 1.00 . A A . 13 ARG HB3 1 1 12 5974 1 1 13 ARG HD2 H -5.874 -4.046 6.022 1.00 . A A . 13 ARG HD2 1 1 12 5975 1 1 13 ARG HD3 H -6.512 -5.413 6.929 1.00 . A A . 13 ARG HD3 1 1 12 5976 1 1 13 ARG HE H -4.133 -6.293 5.845 1.00 . A A . 13 ARG HE 1 1 12 5977 1 1 13 ARG HG2 H -7.432 -5.319 4.672 1.00 . A A . 13 ARG HG2 1 1 12 5978 1 1 13 ARG HG3 H -6.484 -6.780 4.909 1.00 . A A . 13 ARG HG3 1 1 12 5979 1 1 13 ARG HH11 H -5.090 -3.745 8.109 1.00 . A A . 13 ARG HH11 1 1 12 5980 1 1 13 ARG HH12 H -3.563 -3.688 8.870 1.00 . A A . 13 ARG HH12 1 1 12 5981 1 1 13 ARG HH21 H -2.153 -6.224 6.896 1.00 . A A . 13 ARG HH21 1 1 12 5982 1 1 13 ARG HH22 H -1.846 -5.137 8.198 1.00 . A A . 13 ARG HH22 1 1 12 5983 1 1 13 ARG N N -6.214 -7.252 2.139 1.00 . A A . 13 ARG N 1 1 12 5984 1 1 13 ARG NE N -4.493 -5.559 6.397 1.00 . A A . 13 ARG NE 1 1 12 5985 1 1 13 ARG NH1 N -4.150 -4.091 8.163 1.00 . A A . 13 ARG NH1 1 1 12 5986 1 1 13 ARG NH2 N -2.477 -5.480 7.501 1.00 . A A . 13 ARG NH2 1 1 12 5987 1 1 13 ARG O O -4.208 -5.494 0.893 1.00 . A A . 13 ARG O 1 1 12 5988 1 1 14 LYS C C -5.039 -2.146 -0.400 1.00 . A A . 14 LYS C 1 1 12 5989 1 1 14 LYS CA C -5.409 -3.589 -0.754 1.00 . A A . 14 LYS CA 1 1 12 5990 1 1 14 LYS CB C -6.373 -3.599 -1.962 1.00 . A A . 14 LYS CB 1 1 12 5991 1 1 14 LYS CD C -8.624 -2.871 -2.927 1.00 . A A . 14 LYS CD 1 1 12 5992 1 1 14 LYS CE C -8.011 -2.098 -4.087 1.00 . A A . 14 LYS CE 1 1 12 5993 1 1 14 LYS CG C -7.709 -2.889 -1.703 1.00 . A A . 14 LYS CG 1 1 12 5994 1 1 14 LYS H H -6.935 -4.019 0.625 1.00 . A A . 14 LYS H 1 1 12 5995 1 1 14 LYS HA H -4.512 -4.128 -1.022 1.00 . A A . 14 LYS HA 1 1 12 5996 1 1 14 LYS HB2 H -5.884 -3.109 -2.791 1.00 . A A . 14 LYS HB2 1 1 12 5997 1 1 14 LYS HB3 H -6.580 -4.623 -2.234 1.00 . A A . 14 LYS HB3 1 1 12 5998 1 1 14 LYS HD2 H -8.801 -3.889 -3.245 1.00 . A A . 14 LYS HD2 1 1 12 5999 1 1 14 LYS HD3 H -9.563 -2.414 -2.655 1.00 . A A . 14 LYS HD3 1 1 12 6000 1 1 14 LYS HE2 H -7.749 -1.106 -3.749 1.00 . A A . 14 LYS HE2 1 1 12 6001 1 1 14 LYS HE3 H -7.118 -2.613 -4.410 1.00 . A A . 14 LYS HE3 1 1 12 6002 1 1 14 LYS HG2 H -8.222 -3.390 -0.897 1.00 . A A . 14 LYS HG2 1 1 12 6003 1 1 14 LYS HG3 H -7.501 -1.871 -1.407 1.00 . A A . 14 LYS HG3 1 1 12 6004 1 1 14 LYS HZ1 H -8.474 -1.510 -6.039 1.00 . A A . 14 LYS HZ1 1 1 12 6005 1 1 14 LYS HZ2 H -9.761 -1.401 -4.990 1.00 . A A . 14 LYS HZ2 1 1 12 6006 1 1 14 LYS HZ3 H -9.277 -2.908 -5.565 1.00 . A A . 14 LYS HZ3 1 1 12 6007 1 1 14 LYS N N -6.016 -4.260 0.387 1.00 . A A . 14 LYS N 1 1 12 6008 1 1 14 LYS NZ N -8.938 -1.982 -5.237 1.00 . A A . 14 LYS NZ 1 1 12 6009 1 1 14 LYS O O -5.753 -1.480 0.368 1.00 . A A . 14 LYS O 1 1 12 6010 1 1 15 CYS C C -4.276 0.630 -1.621 1.00 . A A . 15 CYS C 1 1 12 6011 1 1 15 CYS CA C -3.492 -0.314 -0.739 1.00 . A A . 15 CYS CA 1 1 12 6012 1 1 15 CYS CB C -1.997 -0.175 -1.045 1.00 . A A . 15 CYS CB 1 1 12 6013 1 1 15 CYS H H -3.417 -2.242 -1.548 1.00 . A A . 15 CYS H 1 1 12 6014 1 1 15 CYS HA H -3.674 -0.032 0.284 1.00 . A A . 15 CYS HA 1 1 12 6015 1 1 15 CYS HB2 H -1.838 -0.334 -2.100 1.00 . A A . 15 CYS HB2 1 1 12 6016 1 1 15 CYS HB3 H -1.686 0.829 -0.793 1.00 . A A . 15 CYS HB3 1 1 12 6017 1 1 15 CYS N N -3.950 -1.676 -0.952 1.00 . A A . 15 CYS N 1 1 12 6018 1 1 15 CYS O O -4.997 0.198 -2.535 1.00 . A A . 15 CYS O 1 1 12 6019 1 1 15 CYS SG S -0.919 -1.331 -0.152 1.00 . A A . 15 CYS SG 1 1 12 6020 1 1 16 CYS C C -4.222 2.982 -3.538 1.00 . A A . 16 CYS C 1 1 12 6021 1 1 16 CYS CA C -4.849 2.901 -2.131 1.00 . A A . 16 CYS CA 1 1 12 6022 1 1 16 CYS CB C -4.783 4.247 -1.425 1.00 . A A . 16 CYS CB 1 1 12 6023 1 1 16 CYS H H -3.691 2.151 -0.519 1.00 . A A . 16 CYS H 1 1 12 6024 1 1 16 CYS HA H -5.884 2.614 -2.241 1.00 . A A . 16 CYS HA 1 1 12 6025 1 1 16 CYS HB2 H -3.752 4.560 -1.350 1.00 . A A . 16 CYS HB2 1 1 12 6026 1 1 16 CYS HB3 H -5.336 4.972 -2.005 1.00 . A A . 16 CYS HB3 1 1 12 6027 1 1 16 CYS N N -4.195 1.888 -1.326 1.00 . A A . 16 CYS N 1 1 12 6028 1 1 16 CYS O O -3.050 2.600 -3.739 1.00 . A A . 16 CYS O 1 1 12 6029 1 1 16 CYS SG S -5.488 4.228 0.262 1.00 . A A . 16 CYS SG 1 1 12 6030 1 1 17 LYS C C -3.349 4.476 -5.969 1.00 . A A . 17 LYS C 1 1 12 6031 1 1 17 LYS CA C -4.580 3.579 -5.891 1.00 . A A . 17 LYS CA 1 1 12 6032 1 1 17 LYS CB C -5.725 4.160 -6.739 1.00 . A A . 17 LYS CB 1 1 12 6033 1 1 17 LYS CD C -4.967 3.241 -8.993 1.00 . A A . 17 LYS CD 1 1 12 6034 1 1 17 LYS CE C -4.640 3.621 -10.430 1.00 . A A . 17 LYS CE 1 1 12 6035 1 1 17 LYS CG C -5.372 4.473 -8.198 1.00 . A A . 17 LYS CG 1 1 12 6036 1 1 17 LYS H H -5.938 3.687 -4.278 1.00 . A A . 17 LYS H 1 1 12 6037 1 1 17 LYS HA H -4.329 2.599 -6.266 1.00 . A A . 17 LYS HA 1 1 12 6038 1 1 17 LYS HB2 H -6.543 3.454 -6.741 1.00 . A A . 17 LYS HB2 1 1 12 6039 1 1 17 LYS HB3 H -6.064 5.073 -6.271 1.00 . A A . 17 LYS HB3 1 1 12 6040 1 1 17 LYS HD2 H -4.097 2.795 -8.536 1.00 . A A . 17 LYS HD2 1 1 12 6041 1 1 17 LYS HD3 H -5.784 2.536 -8.991 1.00 . A A . 17 LYS HD3 1 1 12 6042 1 1 17 LYS HE2 H -5.508 4.084 -10.876 1.00 . A A . 17 LYS HE2 1 1 12 6043 1 1 17 LYS HE3 H -3.825 4.330 -10.420 1.00 . A A . 17 LYS HE3 1 1 12 6044 1 1 17 LYS HG2 H -6.227 4.924 -8.679 1.00 . A A . 17 LYS HG2 1 1 12 6045 1 1 17 LYS HG3 H -4.552 5.176 -8.204 1.00 . A A . 17 LYS HG3 1 1 12 6046 1 1 17 LYS HZ1 H -4.110 2.741 -12.233 1.00 . A A . 17 LYS HZ1 1 1 12 6047 1 1 17 LYS HZ2 H -5.001 1.734 -11.238 1.00 . A A . 17 LYS HZ2 1 1 12 6048 1 1 17 LYS HZ3 H -3.372 2.023 -10.907 1.00 . A A . 17 LYS HZ3 1 1 12 6049 1 1 17 LYS N N -5.016 3.432 -4.506 1.00 . A A . 17 LYS N 1 1 12 6050 1 1 17 LYS NZ N -4.255 2.459 -11.243 1.00 . A A . 17 LYS NZ 1 1 12 6051 1 1 17 LYS O O -3.390 5.650 -5.572 1.00 . A A . 17 LYS O 1 1 12 6052 1 1 18 GLY C C -0.051 4.216 -5.529 1.00 . A A . 18 GLY C 1 1 12 6053 1 1 18 GLY CA C -1.050 4.677 -6.556 1.00 . A A . 18 GLY CA 1 1 12 6054 1 1 18 GLY H H -2.298 3.000 -6.783 1.00 . A A . 18 GLY H 1 1 12 6055 1 1 18 GLY HA2 H -0.630 4.546 -7.541 1.00 . A A . 18 GLY HA2 1 1 12 6056 1 1 18 GLY HA3 H -1.261 5.724 -6.393 1.00 . A A . 18 GLY HA3 1 1 12 6057 1 1 18 GLY N N -2.273 3.930 -6.466 1.00 . A A . 18 GLY N 1 1 12 6058 1 1 18 GLY O O 0.920 4.915 -5.225 1.00 . A A . 18 GLY O 1 1 12 6059 1 1 19 MET C C 0.848 1.035 -4.396 1.00 . A A . 19 MET C 1 1 12 6060 1 1 19 MET CA C 0.591 2.464 -3.994 1.00 . A A . 19 MET CA 1 1 12 6061 1 1 19 MET CB C -0.012 2.504 -2.583 1.00 . A A . 19 MET CB 1 1 12 6062 1 1 19 MET CE C -1.330 5.717 -0.318 1.00 . A A . 19 MET CE 1 1 12 6063 1 1 19 MET CG C -0.217 3.902 -2.049 1.00 . A A . 19 MET CG 1 1 12 6064 1 1 19 MET H H -1.151 2.597 -5.133 1.00 . A A . 19 MET H 1 1 12 6065 1 1 19 MET HA H 1.520 3.013 -3.999 1.00 . A A . 19 MET HA 1 1 12 6066 1 1 19 MET HB2 H -0.972 2.009 -2.603 1.00 . A A . 19 MET HB2 1 1 12 6067 1 1 19 MET HB3 H 0.643 1.973 -1.907 1.00 . A A . 19 MET HB3 1 1 12 6068 1 1 19 MET HE1 H -0.369 6.208 -0.283 1.00 . A A . 19 MET HE1 1 1 12 6069 1 1 19 MET HE2 H -1.875 5.919 0.593 1.00 . A A . 19 MET HE2 1 1 12 6070 1 1 19 MET HE3 H -1.895 6.088 -1.161 1.00 . A A . 19 MET HE3 1 1 12 6071 1 1 19 MET HG2 H 0.769 4.307 -1.876 1.00 . A A . 19 MET HG2 1 1 12 6072 1 1 19 MET HG3 H -0.743 4.495 -2.781 1.00 . A A . 19 MET HG3 1 1 12 6073 1 1 19 MET N N -0.310 3.069 -4.949 1.00 . A A . 19 MET N 1 1 12 6074 1 1 19 MET O O 0.057 0.449 -5.140 1.00 . A A . 19 MET O 1 1 12 6075 1 1 19 MET SD S -1.101 3.951 -0.486 1.00 . A A . 19 MET SD 1 1 12 6076 1 1 20 VAL C C 1.999 -1.697 -2.938 1.00 . A A . 20 VAL C 1 1 12 6077 1 1 20 VAL CA C 2.238 -0.901 -4.196 1.00 . A A . 20 VAL CA 1 1 12 6078 1 1 20 VAL CB C 3.700 -1.132 -4.707 1.00 . A A . 20 VAL CB 1 1 12 6079 1 1 20 VAL CG1 C 3.952 -0.380 -5.996 1.00 . A A . 20 VAL CG1 1 1 12 6080 1 1 20 VAL CG2 C 4.731 -0.745 -3.663 1.00 . A A . 20 VAL CG2 1 1 12 6081 1 1 20 VAL H H 2.538 1.006 -3.353 1.00 . A A . 20 VAL H 1 1 12 6082 1 1 20 VAL HA H 1.540 -1.237 -4.948 1.00 . A A . 20 VAL HA 1 1 12 6083 1 1 20 VAL HB H 3.808 -2.186 -4.919 1.00 . A A . 20 VAL HB 1 1 12 6084 1 1 20 VAL HG11 H 3.246 -0.698 -6.747 1.00 . A A . 20 VAL HG11 1 1 12 6085 1 1 20 VAL HG12 H 4.957 -0.582 -6.336 1.00 . A A . 20 VAL HG12 1 1 12 6086 1 1 20 VAL HG13 H 3.840 0.678 -5.816 1.00 . A A . 20 VAL HG13 1 1 12 6087 1 1 20 VAL HG21 H 4.624 0.306 -3.433 1.00 . A A . 20 VAL HG21 1 1 12 6088 1 1 20 VAL HG22 H 5.724 -0.934 -4.046 1.00 . A A . 20 VAL HG22 1 1 12 6089 1 1 20 VAL HG23 H 4.571 -1.326 -2.767 1.00 . A A . 20 VAL HG23 1 1 12 6090 1 1 20 VAL N N 1.931 0.478 -3.927 1.00 . A A . 20 VAL N 1 1 12 6091 1 1 20 VAL O O 2.232 -1.203 -1.819 1.00 . A A . 20 VAL O 1 1 12 6092 1 1 21 CYS C C 2.408 -4.557 -1.613 1.00 . A A . 21 CYS C 1 1 12 6093 1 1 21 CYS CA C 1.187 -3.718 -1.992 1.00 . A A . 21 CYS CA 1 1 12 6094 1 1 21 CYS CB C -0.034 -4.600 -2.323 1.00 . A A . 21 CYS CB 1 1 12 6095 1 1 21 CYS H H 1.373 -3.217 -4.015 1.00 . A A . 21 CYS H 1 1 12 6096 1 1 21 CYS HA H 0.941 -3.074 -1.161 1.00 . A A . 21 CYS HA 1 1 12 6097 1 1 21 CYS HB2 H -0.794 -3.988 -2.786 1.00 . A A . 21 CYS HB2 1 1 12 6098 1 1 21 CYS HB3 H 0.271 -5.369 -3.018 1.00 . A A . 21 CYS HB3 1 1 12 6099 1 1 21 CYS N N 1.512 -2.883 -3.104 1.00 . A A . 21 CYS N 1 1 12 6100 1 1 21 CYS O O 3.155 -5.039 -2.497 1.00 . A A . 21 CYS O 1 1 12 6101 1 1 21 CYS SG S -0.801 -5.424 -0.878 1.00 . A A . 21 CYS SG 1 1 12 6102 1 1 22 ARG C C 3.400 -5.433 1.786 1.00 . A A . 22 ARG C 1 1 12 6103 1 1 22 ARG CA C 3.704 -5.392 0.274 1.00 . A A . 22 ARG CA 1 1 12 6104 1 1 22 ARG CB C 5.020 -4.636 -0.014 1.00 . A A . 22 ARG CB 1 1 12 6105 1 1 22 ARG CD C 7.488 -4.690 -0.241 1.00 . A A . 22 ARG CD 1 1 12 6106 1 1 22 ARG CG C 6.289 -5.417 0.278 1.00 . A A . 22 ARG CG 1 1 12 6107 1 1 22 ARG CZ C 9.966 -4.978 -0.306 1.00 . A A . 22 ARG CZ 1 1 12 6108 1 1 22 ARG H H 1.990 -4.264 0.307 1.00 . A A . 22 ARG H 1 1 12 6109 1 1 22 ARG HA H 3.758 -6.389 -0.137 1.00 . A A . 22 ARG HA 1 1 12 6110 1 1 22 ARG HB2 H 5.030 -4.351 -1.056 1.00 . A A . 22 ARG HB2 1 1 12 6111 1 1 22 ARG HB3 H 5.030 -3.737 0.585 1.00 . A A . 22 ARG HB3 1 1 12 6112 1 1 22 ARG HD2 H 7.374 -4.648 -1.314 1.00 . A A . 22 ARG HD2 1 1 12 6113 1 1 22 ARG HD3 H 7.475 -3.695 0.176 1.00 . A A . 22 ARG HD3 1 1 12 6114 1 1 22 ARG HE H 8.641 -6.163 0.664 1.00 . A A . 22 ARG HE 1 1 12 6115 1 1 22 ARG HG2 H 6.401 -5.531 1.347 1.00 . A A . 22 ARG HG2 1 1 12 6116 1 1 22 ARG HG3 H 6.229 -6.387 -0.193 1.00 . A A . 22 ARG HG3 1 1 12 6117 1 1 22 ARG HH11 H 9.322 -3.430 -1.488 1.00 . A A . 22 ARG HH11 1 1 12 6118 1 1 22 ARG HH12 H 11.011 -3.616 -1.441 1.00 . A A . 22 ARG HH12 1 1 12 6119 1 1 22 ARG HH21 H 10.981 -6.453 0.697 1.00 . A A . 22 ARG HH21 1 1 12 6120 1 1 22 ARG HH22 H 11.965 -5.380 -0.174 1.00 . A A . 22 ARG HH22 1 1 12 6121 1 1 22 ARG N N 2.623 -4.678 -0.322 1.00 . A A . 22 ARG N 1 1 12 6122 1 1 22 ARG NE N 8.746 -5.368 0.092 1.00 . A A . 22 ARG NE 1 1 12 6123 1 1 22 ARG NH1 N 10.110 -3.939 -1.134 1.00 . A A . 22 ARG NH1 1 1 12 6124 1 1 22 ARG NH2 N 11.038 -5.648 0.100 1.00 . A A . 22 ARG NH2 1 1 12 6125 1 1 22 ARG O O 2.270 -5.039 2.211 1.00 . A A . 22 ARG O 1 1 12 6126 1 1 23 LEU C C 3.808 -4.553 4.591 1.00 . A A . 23 LEU C 1 1 12 6127 1 1 23 LEU CA C 4.259 -5.904 4.058 1.00 . A A . 23 LEU CA 1 1 12 6128 1 1 23 LEU CB C 5.591 -6.301 4.703 1.00 . A A . 23 LEU CB 1 1 12 6129 1 1 23 LEU CD1 C 7.424 -7.953 5.102 1.00 . A A . 23 LEU CD1 1 1 12 6130 1 1 23 LEU CD2 C 5.060 -8.746 4.942 1.00 . A A . 23 LEU CD2 1 1 12 6131 1 1 23 LEU CG C 6.077 -7.727 4.440 1.00 . A A . 23 LEU CG 1 1 12 6132 1 1 23 LEU H H 5.147 -6.323 2.189 1.00 . A A . 23 LEU H 1 1 12 6133 1 1 23 LEU HA H 3.515 -6.637 4.329 1.00 . A A . 23 LEU HA 1 1 12 6134 1 1 23 LEU HB2 H 6.349 -5.623 4.338 1.00 . A A . 23 LEU HB2 1 1 12 6135 1 1 23 LEU HB3 H 5.505 -6.167 5.770 1.00 . A A . 23 LEU HB3 1 1 12 6136 1 1 23 LEU HD11 H 8.148 -7.263 4.692 1.00 . A A . 23 LEU HD11 1 1 12 6137 1 1 23 LEU HD12 H 7.750 -8.968 4.922 1.00 . A A . 23 LEU HD12 1 1 12 6138 1 1 23 LEU HD13 H 7.334 -7.789 6.165 1.00 . A A . 23 LEU HD13 1 1 12 6139 1 1 23 LEU HD21 H 5.434 -9.742 4.764 1.00 . A A . 23 LEU HD21 1 1 12 6140 1 1 23 LEU HD22 H 4.126 -8.621 4.413 1.00 . A A . 23 LEU HD22 1 1 12 6141 1 1 23 LEU HD23 H 4.899 -8.606 6.001 1.00 . A A . 23 LEU HD23 1 1 12 6142 1 1 23 LEU HG H 6.201 -7.865 3.376 1.00 . A A . 23 LEU HG 1 1 12 6143 1 1 23 LEU N N 4.362 -5.901 2.596 1.00 . A A . 23 LEU N 1 1 12 6144 1 1 23 LEU O O 3.237 -4.478 5.659 1.00 . A A . 23 LEU O 1 1 12 6145 1 1 24 TRP C C 3.161 -1.570 2.795 1.00 . A A . 24 TRP C 1 1 12 6146 1 1 24 TRP CA C 3.590 -2.198 4.131 1.00 . A A . 24 TRP CA 1 1 12 6147 1 1 24 TRP CB C 4.661 -1.345 4.836 1.00 . A A . 24 TRP CB 1 1 12 6148 1 1 24 TRP CD1 C 5.834 0.354 3.370 1.00 . A A . 24 TRP CD1 1 1 12 6149 1 1 24 TRP CD2 C 6.943 -1.576 3.537 1.00 . A A . 24 TRP CD2 1 1 12 6150 1 1 24 TRP CE2 C 7.678 -0.712 2.705 1.00 . A A . 24 TRP CE2 1 1 12 6151 1 1 24 TRP CE3 C 7.443 -2.854 3.793 1.00 . A A . 24 TRP CE3 1 1 12 6152 1 1 24 TRP CG C 5.766 -0.864 3.949 1.00 . A A . 24 TRP CG 1 1 12 6153 1 1 24 TRP CH2 C 9.352 -2.342 2.392 1.00 . A A . 24 TRP CH2 1 1 12 6154 1 1 24 TRP CZ2 C 8.886 -1.084 2.126 1.00 . A A . 24 TRP CZ2 1 1 12 6155 1 1 24 TRP CZ3 C 8.643 -3.225 3.218 1.00 . A A . 24 TRP CZ3 1 1 12 6156 1 1 24 TRP H H 4.598 -3.605 3.016 1.00 . A A . 24 TRP H 1 1 12 6157 1 1 24 TRP HA H 2.736 -2.335 4.774 1.00 . A A . 24 TRP HA 1 1 12 6158 1 1 24 TRP HB2 H 4.190 -0.476 5.268 1.00 . A A . 24 TRP HB2 1 1 12 6159 1 1 24 TRP HB3 H 5.100 -1.933 5.629 1.00 . A A . 24 TRP HB3 1 1 12 6160 1 1 24 TRP HD1 H 5.055 1.089 3.520 1.00 . A A . 24 TRP HD1 1 1 12 6161 1 1 24 TRP HE1 H 7.250 1.259 2.108 1.00 . A A . 24 TRP HE1 1 1 12 6162 1 1 24 TRP HE3 H 6.907 -3.541 4.430 1.00 . A A . 24 TRP HE3 1 1 12 6163 1 1 24 TRP HH2 H 10.285 -2.672 1.962 1.00 . A A . 24 TRP HH2 1 1 12 6164 1 1 24 TRP HZ2 H 9.448 -0.419 1.487 1.00 . A A . 24 TRP HZ2 1 1 12 6165 1 1 24 TRP HZ3 H 9.047 -4.210 3.401 1.00 . A A . 24 TRP HZ3 1 1 12 6166 1 1 24 TRP N N 4.077 -3.506 3.839 1.00 . A A . 24 TRP N 1 1 12 6167 1 1 24 TRP NE1 N 6.980 0.462 2.620 1.00 . A A . 24 TRP NE1 1 1 12 6168 1 1 24 TRP O O 3.593 -2.048 1.736 1.00 . A A . 24 TRP O 1 1 12 6169 1 1 25 CYS C C 2.889 1.197 1.243 1.00 . A A . 25 CYS C 1 1 12 6170 1 1 25 CYS CA C 1.915 0.101 1.591 1.00 . A A . 25 CYS CA 1 1 12 6171 1 1 25 CYS CB C 0.491 0.652 1.672 1.00 . A A . 25 CYS CB 1 1 12 6172 1 1 25 CYS H H 1.971 -0.211 3.671 1.00 . A A . 25 CYS H 1 1 12 6173 1 1 25 CYS HA H 1.960 -0.644 0.808 1.00 . A A . 25 CYS HA 1 1 12 6174 1 1 25 CYS HB2 H 0.400 1.265 2.558 1.00 . A A . 25 CYS HB2 1 1 12 6175 1 1 25 CYS HB3 H 0.298 1.260 0.801 1.00 . A A . 25 CYS HB3 1 1 12 6176 1 1 25 CYS N N 2.320 -0.559 2.822 1.00 . A A . 25 CYS N 1 1 12 6177 1 1 25 CYS O O 3.153 2.095 2.050 1.00 . A A . 25 CYS O 1 1 12 6178 1 1 25 CYS SG S -0.802 -0.625 1.756 1.00 . A A . 25 CYS SG 1 1 12 6179 1 1 26 LYS C C 3.871 2.828 -1.585 1.00 . A A . 26 LYS C 1 1 12 6180 1 1 26 LYS CA C 4.408 2.079 -0.392 1.00 . A A . 26 LYS CA 1 1 12 6181 1 1 26 LYS CB C 5.710 1.352 -0.749 1.00 . A A . 26 LYS CB 1 1 12 6182 1 1 26 LYS CD C 8.094 1.540 -1.592 1.00 . A A . 26 LYS CD 1 1 12 6183 1 1 26 LYS CE C 7.913 0.508 -2.687 1.00 . A A . 26 LYS CE 1 1 12 6184 1 1 26 LYS CG C 6.790 2.268 -1.303 1.00 . A A . 26 LYS CG 1 1 12 6185 1 1 26 LYS H H 3.102 0.443 -0.567 1.00 . A A . 26 LYS H 1 1 12 6186 1 1 26 LYS HA H 4.600 2.774 0.410 1.00 . A A . 26 LYS HA 1 1 12 6187 1 1 26 LYS HB2 H 6.094 0.872 0.139 1.00 . A A . 26 LYS HB2 1 1 12 6188 1 1 26 LYS HB3 H 5.490 0.596 -1.488 1.00 . A A . 26 LYS HB3 1 1 12 6189 1 1 26 LYS HD2 H 8.838 2.259 -1.904 1.00 . A A . 26 LYS HD2 1 1 12 6190 1 1 26 LYS HD3 H 8.427 1.045 -0.691 1.00 . A A . 26 LYS HD3 1 1 12 6191 1 1 26 LYS HE2 H 7.230 -0.251 -2.336 1.00 . A A . 26 LYS HE2 1 1 12 6192 1 1 26 LYS HE3 H 7.487 0.998 -3.550 1.00 . A A . 26 LYS HE3 1 1 12 6193 1 1 26 LYS HG2 H 6.420 2.688 -2.227 1.00 . A A . 26 LYS HG2 1 1 12 6194 1 1 26 LYS HG3 H 6.947 3.065 -0.597 1.00 . A A . 26 LYS HG3 1 1 12 6195 1 1 26 LYS HZ1 H 9.869 0.549 -3.407 1.00 . A A . 26 LYS HZ1 1 1 12 6196 1 1 26 LYS HZ2 H 8.989 -0.807 -3.850 1.00 . A A . 26 LYS HZ2 1 1 12 6197 1 1 26 LYS HZ3 H 9.591 -0.687 -2.292 1.00 . A A . 26 LYS HZ3 1 1 12 6198 1 1 26 LYS N N 3.419 1.134 0.055 1.00 . A A . 26 LYS N 1 1 12 6199 1 1 26 LYS NZ N 9.173 -0.142 -3.072 1.00 . A A . 26 LYS NZ 1 1 12 6200 1 1 26 LYS O O 3.213 2.243 -2.415 1.00 . A A . 26 LYS O 1 1 12 6201 1 1 27 LYS C C 4.382 4.569 -4.053 1.00 . A A . 27 LYS C 1 1 12 6202 1 1 27 LYS CA C 3.659 4.920 -2.766 1.00 . A A . 27 LYS CA 1 1 12 6203 1 1 27 LYS CB C 3.839 6.399 -2.463 1.00 . A A . 27 LYS CB 1 1 12 6204 1 1 27 LYS CD C 3.440 8.317 -0.900 1.00 . A A . 27 LYS CD 1 1 12 6205 1 1 27 LYS CE C 2.760 8.770 0.376 1.00 . A A . 27 LYS CE 1 1 12 6206 1 1 27 LYS CG C 3.149 6.859 -1.189 1.00 . A A . 27 LYS CG 1 1 12 6207 1 1 27 LYS H H 4.725 4.512 -0.988 1.00 . A A . 27 LYS H 1 1 12 6208 1 1 27 LYS HA H 2.606 4.716 -2.892 1.00 . A A . 27 LYS HA 1 1 12 6209 1 1 27 LYS HB2 H 4.898 6.600 -2.396 1.00 . A A . 27 LYS HB2 1 1 12 6210 1 1 27 LYS HB3 H 3.438 6.965 -3.290 1.00 . A A . 27 LYS HB3 1 1 12 6211 1 1 27 LYS HD2 H 4.507 8.452 -0.797 1.00 . A A . 27 LYS HD2 1 1 12 6212 1 1 27 LYS HD3 H 3.079 8.914 -1.725 1.00 . A A . 27 LYS HD3 1 1 12 6213 1 1 27 LYS HE2 H 1.692 8.665 0.255 1.00 . A A . 27 LYS HE2 1 1 12 6214 1 1 27 LYS HE3 H 3.087 8.135 1.187 1.00 . A A . 27 LYS HE3 1 1 12 6215 1 1 27 LYS HG2 H 2.083 6.729 -1.302 1.00 . A A . 27 LYS HG2 1 1 12 6216 1 1 27 LYS HG3 H 3.500 6.257 -0.364 1.00 . A A . 27 LYS HG3 1 1 12 6217 1 1 27 LYS HZ1 H 4.088 10.309 0.864 1.00 . A A . 27 LYS HZ1 1 1 12 6218 1 1 27 LYS HZ2 H 2.570 10.450 1.576 1.00 . A A . 27 LYS HZ2 1 1 12 6219 1 1 27 LYS HZ3 H 2.753 10.804 -0.057 1.00 . A A . 27 LYS HZ3 1 1 12 6220 1 1 27 LYS N N 4.147 4.107 -1.669 1.00 . A A . 27 LYS N 1 1 12 6221 1 1 27 LYS NZ N 3.069 10.174 0.707 1.00 . A A . 27 LYS NZ 1 1 12 6222 1 1 27 LYS O O 5.599 4.364 -4.068 1.00 . A A . 27 LYS O 1 1 12 6223 1 1 28 LYS C C 4.324 5.488 -7.149 1.00 . A A . 28 LYS C 1 1 12 6224 1 1 28 LYS CA C 4.178 4.186 -6.397 1.00 . A A . 28 LYS CA 1 1 12 6225 1 1 28 LYS CB C 3.246 3.222 -7.155 1.00 . A A . 28 LYS CB 1 1 12 6226 1 1 28 LYS CD C 2.815 1.771 -9.167 1.00 . A A . 28 LYS CD 1 1 12 6227 1 1 28 LYS CE C 3.404 1.176 -10.441 1.00 . A A . 28 LYS CE 1 1 12 6228 1 1 28 LYS CG C 3.815 2.682 -8.462 1.00 . A A . 28 LYS CG 1 1 12 6229 1 1 28 LYS H H 2.681 4.692 -5.027 1.00 . A A . 28 LYS H 1 1 12 6230 1 1 28 LYS HA H 5.149 3.731 -6.266 1.00 . A A . 28 LYS HA 1 1 12 6231 1 1 28 LYS HB2 H 3.007 2.386 -6.515 1.00 . A A . 28 LYS HB2 1 1 12 6232 1 1 28 LYS HB3 H 2.330 3.748 -7.379 1.00 . A A . 28 LYS HB3 1 1 12 6233 1 1 28 LYS HD2 H 2.540 0.971 -8.497 1.00 . A A . 28 LYS HD2 1 1 12 6234 1 1 28 LYS HD3 H 1.935 2.346 -9.419 1.00 . A A . 28 LYS HD3 1 1 12 6235 1 1 28 LYS HE2 H 3.687 1.979 -11.104 1.00 . A A . 28 LYS HE2 1 1 12 6236 1 1 28 LYS HE3 H 4.283 0.604 -10.178 1.00 . A A . 28 LYS HE3 1 1 12 6237 1 1 28 LYS HG2 H 4.062 3.510 -9.109 1.00 . A A . 28 LYS HG2 1 1 12 6238 1 1 28 LYS HG3 H 4.710 2.120 -8.243 1.00 . A A . 28 LYS HG3 1 1 12 6239 1 1 28 LYS HZ1 H 2.886 -0.100 -12.003 1.00 . A A . 28 LYS HZ1 1 1 12 6240 1 1 28 LYS HZ2 H 1.594 0.813 -11.422 1.00 . A A . 28 LYS HZ2 1 1 12 6241 1 1 28 LYS HZ3 H 2.162 -0.506 -10.539 1.00 . A A . 28 LYS HZ3 1 1 12 6242 1 1 28 LYS N N 3.641 4.496 -5.109 1.00 . A A . 28 LYS N 1 1 12 6243 1 1 28 LYS NZ N 2.449 0.291 -11.145 1.00 . A A . 28 LYS NZ 1 1 12 6244 1 1 28 LYS O O 3.390 5.951 -7.790 1.00 . A A . 28 LYS O 1 1 12 6245 1 1 29 LEU C C 6.715 7.241 -8.741 1.00 . A A . 29 LEU C 1 1 12 6246 1 1 29 LEU CA C 5.703 7.403 -7.622 1.00 . A A . 29 LEU CA 1 1 12 6247 1 1 29 LEU CB C 6.179 8.490 -6.610 1.00 . A A . 29 LEU CB 1 1 12 6248 1 1 29 LEU CD1 C 7.950 9.587 -5.201 1.00 . A A . 29 LEU CD1 1 1 12 6249 1 1 29 LEU CD2 C 7.550 7.167 -4.899 1.00 . A A . 29 LEU CD2 1 1 12 6250 1 1 29 LEU CG C 7.558 8.308 -5.913 1.00 . A A . 29 LEU CG 1 1 12 6251 1 1 29 LEU H H 6.124 5.730 -6.386 1.00 . A A . 29 LEU H 1 1 12 6252 1 1 29 LEU HA H 4.771 7.724 -8.062 1.00 . A A . 29 LEU HA 1 1 12 6253 1 1 29 LEU HB2 H 6.208 9.433 -7.137 1.00 . A A . 29 LEU HB2 1 1 12 6254 1 1 29 LEU HB3 H 5.424 8.568 -5.840 1.00 . A A . 29 LEU HB3 1 1 12 6255 1 1 29 LEU HD11 H 8.013 10.394 -5.916 1.00 . A A . 29 LEU HD11 1 1 12 6256 1 1 29 LEU HD12 H 8.911 9.455 -4.725 1.00 . A A . 29 LEU HD12 1 1 12 6257 1 1 29 LEU HD13 H 7.208 9.827 -4.454 1.00 . A A . 29 LEU HD13 1 1 12 6258 1 1 29 LEU HD21 H 7.386 6.226 -5.402 1.00 . A A . 29 LEU HD21 1 1 12 6259 1 1 29 LEU HD22 H 6.761 7.330 -4.180 1.00 . A A . 29 LEU HD22 1 1 12 6260 1 1 29 LEU HD23 H 8.500 7.139 -4.386 1.00 . A A . 29 LEU HD23 1 1 12 6261 1 1 29 LEU HG H 8.305 8.100 -6.665 1.00 . A A . 29 LEU HG 1 1 12 6262 1 1 29 LEU N N 5.450 6.123 -6.979 1.00 . A A . 29 LEU N 1 1 12 6263 1 1 29 LEU O O 7.119 8.213 -9.385 1.00 . A A . 29 LEU O 1 1 12 6264 1 1 30 TRP C C 7.371 5.433 -11.290 1.00 . A A . 30 TRP C 1 1 12 6265 1 1 30 TRP CA C 8.068 5.697 -9.985 1.00 . A A . 30 TRP CA 1 1 12 6266 1 1 30 TRP CB C 8.884 4.470 -9.561 1.00 . A A . 30 TRP CB 1 1 12 6267 1 1 30 TRP CD1 C 9.092 4.301 -7.025 1.00 . A A . 30 TRP CD1 1 1 12 6268 1 1 30 TRP CD2 C 10.880 5.170 -8.033 1.00 . A A . 30 TRP CD2 1 1 12 6269 1 1 30 TRP CE2 C 11.114 5.144 -6.648 1.00 . A A . 30 TRP CE2 1 1 12 6270 1 1 30 TRP CE3 C 11.869 5.672 -8.872 1.00 . A A . 30 TRP CE3 1 1 12 6271 1 1 30 TRP CG C 9.576 4.633 -8.252 1.00 . A A . 30 TRP CG 1 1 12 6272 1 1 30 TRP CH2 C 13.248 6.085 -6.931 1.00 . A A . 30 TRP CH2 1 1 12 6273 1 1 30 TRP CZ2 C 12.297 5.601 -6.085 1.00 . A A . 30 TRP CZ2 1 1 12 6274 1 1 30 TRP CZ3 C 13.042 6.124 -8.313 1.00 . A A . 30 TRP CZ3 1 1 12 6275 1 1 30 TRP H H 6.655 5.285 -8.503 1.00 . A A . 30 TRP H 1 1 12 6276 1 1 30 TRP HA H 8.731 6.543 -10.094 1.00 . A A . 30 TRP HA 1 1 12 6277 1 1 30 TRP HB2 H 8.225 3.618 -9.477 1.00 . A A . 30 TRP HB2 1 1 12 6278 1 1 30 TRP HB3 H 9.631 4.269 -10.314 1.00 . A A . 30 TRP HB3 1 1 12 6279 1 1 30 TRP HD1 H 8.118 3.864 -6.850 1.00 . A A . 30 TRP HD1 1 1 12 6280 1 1 30 TRP HE1 H 9.890 4.478 -5.093 1.00 . A A . 30 TRP HE1 1 1 12 6281 1 1 30 TRP HE3 H 11.730 5.710 -9.942 1.00 . A A . 30 TRP HE3 1 1 12 6282 1 1 30 TRP HH2 H 14.186 6.452 -6.541 1.00 . A A . 30 TRP HH2 1 1 12 6283 1 1 30 TRP HZ2 H 12.477 5.578 -5.020 1.00 . A A . 30 TRP HZ2 1 1 12 6284 1 1 30 TRP HZ3 H 13.820 6.516 -8.951 1.00 . A A . 30 TRP HZ3 1 1 12 6285 1 1 30 TRP N N 7.085 6.016 -8.989 1.00 . A A . 30 TRP N 1 1 12 6286 1 1 30 TRP NE1 N 10.008 4.617 -6.060 1.00 . A A . 30 TRP NE1 1 1 12 6287 1 1 30 TRP O O 6.911 4.299 -11.508 1.00 . A A . 30 TRP O 1 1 12 6288 1 1 30 TRP OXT O 7.254 6.367 -12.113 1.00 . A A . 30 TRP OXT 1 1 13 6289 1 1 1 TYR C C -10.174 0.381 3.026 1.00 . A A . 1 TYR C 1 1 13 6290 1 1 1 TYR CA C -11.349 0.735 3.894 1.00 . A A . 1 TYR CA 1 1 13 6291 1 1 1 TYR CB C -12.401 1.498 3.078 1.00 . A A . 1 TYR CB 1 1 13 6292 1 1 1 TYR CD1 C -13.743 2.993 4.609 1.00 . A A . 1 TYR CD1 1 1 13 6293 1 1 1 TYR CD2 C -14.761 1.015 3.784 1.00 . A A . 1 TYR CD2 1 1 13 6294 1 1 1 TYR CE1 C -14.890 3.303 5.295 1.00 . A A . 1 TYR CE1 1 1 13 6295 1 1 1 TYR CE2 C -15.911 1.319 4.466 1.00 . A A . 1 TYR CE2 1 1 13 6296 1 1 1 TYR CG C -13.658 1.840 3.840 1.00 . A A . 1 TYR CG 1 1 13 6297 1 1 1 TYR CZ C -15.973 2.460 5.220 1.00 . A A . 1 TYR CZ 1 1 13 6298 1 1 1 TYR H1 H -10.444 2.420 4.709 1.00 . A A . 1 TYR H1 1 1 13 6299 1 1 1 TYR H2 H -10.156 0.965 5.514 1.00 . A A . 1 TYR H2 1 1 13 6300 1 1 1 TYR H3 H -11.638 1.714 5.710 1.00 . A A . 1 TYR H3 1 1 13 6301 1 1 1 TYR HA H -11.779 -0.178 4.279 1.00 . A A . 1 TYR HA 1 1 13 6302 1 1 1 TYR HB2 H -11.974 2.423 2.726 1.00 . A A . 1 TYR HB2 1 1 13 6303 1 1 1 TYR HB3 H -12.681 0.898 2.225 1.00 . A A . 1 TYR HB3 1 1 13 6304 1 1 1 TYR HD1 H -12.894 3.657 4.666 1.00 . A A . 1 TYR HD1 1 1 13 6305 1 1 1 TYR HD2 H -14.715 0.115 3.190 1.00 . A A . 1 TYR HD2 1 1 13 6306 1 1 1 TYR HE1 H -14.930 4.206 5.886 1.00 . A A . 1 TYR HE1 1 1 13 6307 1 1 1 TYR HE2 H -16.760 0.657 4.404 1.00 . A A . 1 TYR HE2 1 1 13 6308 1 1 1 TYR HH H -17.300 3.701 5.798 1.00 . A A . 1 TYR HH 1 1 13 6309 1 1 1 TYR N N -10.876 1.530 5.026 1.00 . A A . 1 TYR N 1 1 13 6310 1 1 1 TYR O O -9.690 -0.748 3.053 1.00 . A A . 1 TYR O 1 1 13 6311 1 1 1 TYR OH O -17.121 2.758 5.902 1.00 . A A . 1 TYR OH 1 1 13 6312 1 1 2 CYS C C -7.328 1.371 2.387 1.00 . A A . 2 CYS C 1 1 13 6313 1 1 2 CYS CA C -8.524 1.177 1.475 1.00 . A A . 2 CYS CA 1 1 13 6314 1 1 2 CYS CB C -8.518 2.213 0.357 1.00 . A A . 2 CYS CB 1 1 13 6315 1 1 2 CYS H H -10.108 2.238 2.301 1.00 . A A . 2 CYS H 1 1 13 6316 1 1 2 CYS HA H -8.522 0.178 1.064 1.00 . A A . 2 CYS HA 1 1 13 6317 1 1 2 CYS HB2 H -9.456 2.178 -0.173 1.00 . A A . 2 CYS HB2 1 1 13 6318 1 1 2 CYS HB3 H -8.393 3.184 0.810 1.00 . A A . 2 CYS HB3 1 1 13 6319 1 1 2 CYS N N -9.692 1.349 2.291 1.00 . A A . 2 CYS N 1 1 13 6320 1 1 2 CYS O O -7.472 1.955 3.470 1.00 . A A . 2 CYS O 1 1 13 6321 1 1 2 CYS SG S -7.188 2.006 -0.863 1.00 . A A . 2 CYS SG 1 1 13 6322 1 1 3 GLN C C -4.150 2.147 2.541 1.00 . A A . 3 GLN C 1 1 13 6323 1 1 3 GLN CA C -5.061 1.000 2.896 1.00 . A A . 3 GLN CA 1 1 13 6324 1 1 3 GLN CB C -4.324 -0.315 3.075 1.00 . A A . 3 GLN CB 1 1 13 6325 1 1 3 GLN CD C -4.640 -2.491 4.283 1.00 . A A . 3 GLN CD 1 1 13 6326 1 1 3 GLN CG C -5.259 -1.466 3.396 1.00 . A A . 3 GLN CG 1 1 13 6327 1 1 3 GLN H H -6.072 0.515 1.107 1.00 . A A . 3 GLN H 1 1 13 6328 1 1 3 GLN HA H -5.508 1.265 3.844 1.00 . A A . 3 GLN HA 1 1 13 6329 1 1 3 GLN HB2 H -3.782 -0.538 2.170 1.00 . A A . 3 GLN HB2 1 1 13 6330 1 1 3 GLN HB3 H -3.619 -0.213 3.886 1.00 . A A . 3 GLN HB3 1 1 13 6331 1 1 3 GLN HE21 H -5.453 -1.640 5.857 1.00 . A A . 3 GLN HE21 1 1 13 6332 1 1 3 GLN HE22 H -4.468 -3.013 6.166 1.00 . A A . 3 GLN HE22 1 1 13 6333 1 1 3 GLN HG2 H -6.154 -1.088 3.866 1.00 . A A . 3 GLN HG2 1 1 13 6334 1 1 3 GLN HG3 H -5.518 -1.952 2.466 1.00 . A A . 3 GLN HG3 1 1 13 6335 1 1 3 GLN N N -6.177 0.897 2.003 1.00 . A A . 3 GLN N 1 1 13 6336 1 1 3 GLN NE2 N -4.877 -2.372 5.549 1.00 . A A . 3 GLN NE2 1 1 13 6337 1 1 3 GLN O O -3.659 2.262 1.405 1.00 . A A . 3 GLN O 1 1 13 6338 1 1 3 GLN OE1 O -4.015 -3.421 3.831 1.00 . A A . 3 GLN OE1 1 1 13 6339 1 1 4 LYS C C -1.709 3.914 3.474 1.00 . A A . 4 LYS C 1 1 13 6340 1 1 4 LYS CA C -3.195 4.215 3.409 1.00 . A A . 4 LYS CA 1 1 13 6341 1 1 4 LYS CB C -3.593 5.159 4.542 1.00 . A A . 4 LYS CB 1 1 13 6342 1 1 4 LYS CD C -5.446 6.326 5.779 1.00 . A A . 4 LYS CD 1 1 13 6343 1 1 4 LYS CE C -6.949 6.506 5.894 1.00 . A A . 4 LYS CE 1 1 13 6344 1 1 4 LYS CG C -5.091 5.430 4.610 1.00 . A A . 4 LYS CG 1 1 13 6345 1 1 4 LYS H H -4.356 2.777 4.392 1.00 . A A . 4 LYS H 1 1 13 6346 1 1 4 LYS HA H -3.426 4.688 2.467 1.00 . A A . 4 LYS HA 1 1 13 6347 1 1 4 LYS HB2 H -3.284 4.721 5.480 1.00 . A A . 4 LYS HB2 1 1 13 6348 1 1 4 LYS HB3 H -3.081 6.102 4.410 1.00 . A A . 4 LYS HB3 1 1 13 6349 1 1 4 LYS HD2 H -5.077 5.878 6.690 1.00 . A A . 4 LYS HD2 1 1 13 6350 1 1 4 LYS HD3 H -4.988 7.292 5.639 1.00 . A A . 4 LYS HD3 1 1 13 6351 1 1 4 LYS HE2 H -7.326 6.923 4.973 1.00 . A A . 4 LYS HE2 1 1 13 6352 1 1 4 LYS HE3 H -7.403 5.538 6.059 1.00 . A A . 4 LYS HE3 1 1 13 6353 1 1 4 LYS HG2 H -5.404 5.911 3.695 1.00 . A A . 4 LYS HG2 1 1 13 6354 1 1 4 LYS HG3 H -5.609 4.488 4.716 1.00 . A A . 4 LYS HG3 1 1 13 6355 1 1 4 LYS HZ1 H -8.342 7.461 7.112 1.00 . A A . 4 LYS HZ1 1 1 13 6356 1 1 4 LYS HZ2 H -6.954 8.359 6.816 1.00 . A A . 4 LYS HZ2 1 1 13 6357 1 1 4 LYS HZ3 H -6.903 7.072 7.907 1.00 . A A . 4 LYS HZ3 1 1 13 6358 1 1 4 LYS N N -3.961 2.998 3.524 1.00 . A A . 4 LYS N 1 1 13 6359 1 1 4 LYS NZ N -7.308 7.400 7.008 1.00 . A A . 4 LYS NZ 1 1 13 6360 1 1 4 LYS O O -1.318 2.858 3.951 1.00 . A A . 4 LYS O 1 1 13 6361 1 1 5 TRP C C 1.190 4.368 4.334 1.00 . A A . 5 TRP C 1 1 13 6362 1 1 5 TRP CA C 0.578 4.725 2.972 1.00 . A A . 5 TRP CA 1 1 13 6363 1 1 5 TRP CB C 1.231 6.027 2.445 1.00 . A A . 5 TRP CB 1 1 13 6364 1 1 5 TRP CD1 C 0.242 7.918 3.900 1.00 . A A . 5 TRP CD1 1 1 13 6365 1 1 5 TRP CD2 C 2.445 7.633 4.132 1.00 . A A . 5 TRP CD2 1 1 13 6366 1 1 5 TRP CE2 C 2.039 8.678 4.980 1.00 . A A . 5 TRP CE2 1 1 13 6367 1 1 5 TRP CE3 C 3.793 7.270 4.106 1.00 . A A . 5 TRP CE3 1 1 13 6368 1 1 5 TRP CG C 1.281 7.154 3.452 1.00 . A A . 5 TRP CG 1 1 13 6369 1 1 5 TRP CH2 C 4.242 8.986 5.742 1.00 . A A . 5 TRP CH2 1 1 13 6370 1 1 5 TRP CZ2 C 2.931 9.363 5.791 1.00 . A A . 5 TRP CZ2 1 1 13 6371 1 1 5 TRP CZ3 C 4.677 7.951 4.911 1.00 . A A . 5 TRP CZ3 1 1 13 6372 1 1 5 TRP H H -1.293 5.729 2.774 1.00 . A A . 5 TRP H 1 1 13 6373 1 1 5 TRP HA H 0.789 3.928 2.274 1.00 . A A . 5 TRP HA 1 1 13 6374 1 1 5 TRP HB2 H 2.247 5.814 2.143 1.00 . A A . 5 TRP HB2 1 1 13 6375 1 1 5 TRP HB3 H 0.676 6.372 1.586 1.00 . A A . 5 TRP HB3 1 1 13 6376 1 1 5 TRP HD1 H -0.781 7.807 3.579 1.00 . A A . 5 TRP HD1 1 1 13 6377 1 1 5 TRP HE1 H 0.124 9.488 5.292 1.00 . A A . 5 TRP HE1 1 1 13 6378 1 1 5 TRP HE3 H 4.144 6.472 3.469 1.00 . A A . 5 TRP HE3 1 1 13 6379 1 1 5 TRP HH2 H 4.973 9.492 6.354 1.00 . A A . 5 TRP HH2 1 1 13 6380 1 1 5 TRP HZ2 H 2.619 10.166 6.443 1.00 . A A . 5 TRP HZ2 1 1 13 6381 1 1 5 TRP HZ3 H 5.724 7.685 4.903 1.00 . A A . 5 TRP HZ3 1 1 13 6382 1 1 5 TRP N N -0.894 4.878 3.055 1.00 . A A . 5 TRP N 1 1 13 6383 1 1 5 TRP NE1 N 0.690 8.831 4.823 1.00 . A A . 5 TRP NE1 1 1 13 6384 1 1 5 TRP O O 2.218 3.719 4.416 1.00 . A A . 5 TRP O 1 1 13 6385 1 1 6 MET C C 0.705 3.170 7.216 1.00 . A A . 6 MET C 1 1 13 6386 1 1 6 MET CA C 1.004 4.588 6.736 1.00 . A A . 6 MET CA 1 1 13 6387 1 1 6 MET CB C 0.360 5.628 7.653 1.00 . A A . 6 MET CB 1 1 13 6388 1 1 6 MET CE C 0.979 8.259 9.392 1.00 . A A . 6 MET CE 1 1 13 6389 1 1 6 MET CG C 0.750 5.512 9.110 1.00 . A A . 6 MET CG 1 1 13 6390 1 1 6 MET H H -0.310 5.272 5.236 1.00 . A A . 6 MET H 1 1 13 6391 1 1 6 MET HA H 2.070 4.750 6.732 1.00 . A A . 6 MET HA 1 1 13 6392 1 1 6 MET HB2 H 0.640 6.609 7.302 1.00 . A A . 6 MET HB2 1 1 13 6393 1 1 6 MET HB3 H -0.713 5.527 7.579 1.00 . A A . 6 MET HB3 1 1 13 6394 1 1 6 MET HE1 H 2.045 8.094 9.449 1.00 . A A . 6 MET HE1 1 1 13 6395 1 1 6 MET HE2 H 0.730 9.153 9.943 1.00 . A A . 6 MET HE2 1 1 13 6396 1 1 6 MET HE3 H 0.685 8.384 8.360 1.00 . A A . 6 MET HE3 1 1 13 6397 1 1 6 MET HG2 H 0.363 4.576 9.489 1.00 . A A . 6 MET HG2 1 1 13 6398 1 1 6 MET HG3 H 1.827 5.496 9.150 1.00 . A A . 6 MET HG3 1 1 13 6399 1 1 6 MET N N 0.530 4.791 5.387 1.00 . A A . 6 MET N 1 1 13 6400 1 1 6 MET O O 1.258 2.696 8.215 1.00 . A A . 6 MET O 1 1 13 6401 1 1 6 MET SD S 0.115 6.860 10.119 1.00 . A A . 6 MET SD 1 1 13 6402 1 1 7 TRP C C 0.277 0.140 6.084 1.00 . A A . 7 TRP C 1 1 13 6403 1 1 7 TRP CA C -0.553 1.166 6.850 1.00 . A A . 7 TRP CA 1 1 13 6404 1 1 7 TRP CB C -2.059 0.965 6.571 1.00 . A A . 7 TRP CB 1 1 13 6405 1 1 7 TRP CD1 C -2.652 2.834 8.269 1.00 . A A . 7 TRP CD1 1 1 13 6406 1 1 7 TRP CD2 C -4.400 2.009 7.154 1.00 . A A . 7 TRP CD2 1 1 13 6407 1 1 7 TRP CE2 C -4.856 3.016 8.023 1.00 . A A . 7 TRP CE2 1 1 13 6408 1 1 7 TRP CE3 C -5.324 1.347 6.356 1.00 . A A . 7 TRP CE3 1 1 13 6409 1 1 7 TRP CG C -2.983 1.911 7.312 1.00 . A A . 7 TRP CG 1 1 13 6410 1 1 7 TRP CH2 C -7.077 2.703 7.314 1.00 . A A . 7 TRP CH2 1 1 13 6411 1 1 7 TRP CZ2 C -6.195 3.372 8.111 1.00 . A A . 7 TRP CZ2 1 1 13 6412 1 1 7 TRP CZ3 C -6.652 1.698 6.445 1.00 . A A . 7 TRP CZ3 1 1 13 6413 1 1 7 TRP H H -0.457 2.898 5.661 1.00 . A A . 7 TRP H 1 1 13 6414 1 1 7 TRP HA H -0.373 1.044 7.906 1.00 . A A . 7 TRP HA 1 1 13 6415 1 1 7 TRP HB2 H -2.236 1.103 5.514 1.00 . A A . 7 TRP HB2 1 1 13 6416 1 1 7 TRP HB3 H -2.332 -0.046 6.838 1.00 . A A . 7 TRP HB3 1 1 13 6417 1 1 7 TRP HD1 H -1.645 3.005 8.623 1.00 . A A . 7 TRP HD1 1 1 13 6418 1 1 7 TRP HE1 H -3.796 4.227 9.358 1.00 . A A . 7 TRP HE1 1 1 13 6419 1 1 7 TRP HE3 H -5.011 0.564 5.683 1.00 . A A . 7 TRP HE3 1 1 13 6420 1 1 7 TRP HH2 H -8.128 2.944 7.352 1.00 . A A . 7 TRP HH2 1 1 13 6421 1 1 7 TRP HZ2 H -6.542 4.148 8.779 1.00 . A A . 7 TRP HZ2 1 1 13 6422 1 1 7 TRP HZ3 H -7.381 1.191 5.828 1.00 . A A . 7 TRP HZ3 1 1 13 6423 1 1 7 TRP N N -0.134 2.498 6.495 1.00 . A A . 7 TRP N 1 1 13 6424 1 1 7 TRP NE1 N -3.772 3.508 8.685 1.00 . A A . 7 TRP NE1 1 1 13 6425 1 1 7 TRP O O 1.256 0.492 5.405 1.00 . A A . 7 TRP O 1 1 13 6426 1 1 8 THR C C -0.513 -3.048 4.928 1.00 . A A . 8 THR C 1 1 13 6427 1 1 8 THR CA C 0.578 -2.203 5.570 1.00 . A A . 8 THR CA 1 1 13 6428 1 1 8 THR CB C 1.319 -3.037 6.641 1.00 . A A . 8 THR CB 1 1 13 6429 1 1 8 THR CG2 C 2.473 -2.256 7.246 1.00 . A A . 8 THR CG2 1 1 13 6430 1 1 8 THR H H -0.838 -1.335 6.799 1.00 . A A . 8 THR H 1 1 13 6431 1 1 8 THR HA H 1.274 -1.814 4.844 1.00 . A A . 8 THR HA 1 1 13 6432 1 1 8 THR HB H 1.694 -3.945 6.189 1.00 . A A . 8 THR HB 1 1 13 6433 1 1 8 THR HG1 H 0.010 -4.232 7.504 1.00 . A A . 8 THR HG1 1 1 13 6434 1 1 8 THR HG21 H 3.171 -1.952 6.481 1.00 . A A . 8 THR HG21 1 1 13 6435 1 1 8 THR HG22 H 2.984 -2.876 7.964 1.00 . A A . 8 THR HG22 1 1 13 6436 1 1 8 THR HG23 H 2.080 -1.379 7.736 1.00 . A A . 8 THR HG23 1 1 13 6437 1 1 8 THR N N -0.080 -1.097 6.223 1.00 . A A . 8 THR N 1 1 13 6438 1 1 8 THR O O -1.648 -2.975 5.401 1.00 . A A . 8 THR O 1 1 13 6439 1 1 8 THR OG1 O 0.397 -3.371 7.702 1.00 . A A . 8 THR OG1 1 1 13 6440 1 1 9 CYS C C -1.099 -6.082 3.377 1.00 . A A . 9 CYS C 1 1 13 6441 1 1 9 CYS CA C -1.339 -4.598 3.321 1.00 . A A . 9 CYS CA 1 1 13 6442 1 1 9 CYS CB C -1.663 -4.158 1.898 1.00 . A A . 9 CYS CB 1 1 13 6443 1 1 9 CYS H H 0.664 -3.963 3.496 1.00 . A A . 9 CYS H 1 1 13 6444 1 1 9 CYS HA H -2.210 -4.393 3.933 1.00 . A A . 9 CYS HA 1 1 13 6445 1 1 9 CYS HB2 H -2.540 -4.692 1.566 1.00 . A A . 9 CYS HB2 1 1 13 6446 1 1 9 CYS HB3 H -1.881 -3.099 1.908 1.00 . A A . 9 CYS HB3 1 1 13 6447 1 1 9 CYS N N -0.234 -3.841 3.889 1.00 . A A . 9 CYS N 1 1 13 6448 1 1 9 CYS O O 0.012 -6.538 3.700 1.00 . A A . 9 CYS O 1 1 13 6449 1 1 9 CYS SG S -0.362 -4.460 0.690 1.00 . A A . 9 CYS SG 1 1 13 6450 1 1 10 ASP C C -2.753 -8.718 1.748 1.00 . A A . 10 ASP C 1 1 13 6451 1 1 10 ASP CA C -2.106 -8.266 3.052 1.00 . A A . 10 ASP CA 1 1 13 6452 1 1 10 ASP CB C -2.833 -8.860 4.292 1.00 . A A . 10 ASP CB 1 1 13 6453 1 1 10 ASP CG C -4.324 -8.558 4.372 1.00 . A A . 10 ASP CG 1 1 13 6454 1 1 10 ASP H H -2.969 -6.391 2.787 1.00 . A A . 10 ASP H 1 1 13 6455 1 1 10 ASP HA H -1.069 -8.575 3.048 1.00 . A A . 10 ASP HA 1 1 13 6456 1 1 10 ASP HB2 H -2.715 -9.933 4.285 1.00 . A A . 10 ASP HB2 1 1 13 6457 1 1 10 ASP HB3 H -2.359 -8.472 5.182 1.00 . A A . 10 ASP HB3 1 1 13 6458 1 1 10 ASP N N -2.131 -6.825 3.068 1.00 . A A . 10 ASP N 1 1 13 6459 1 1 10 ASP O O -2.812 -7.936 0.795 1.00 . A A . 10 ASP O 1 1 13 6460 1 1 10 ASP OD1 O -5.122 -9.321 3.818 1.00 . A A . 10 ASP OD1 1 1 13 6461 1 1 10 ASP OD2 O -4.718 -7.581 5.036 1.00 . A A . 10 ASP OD2 1 1 13 6462 1 1 11 SER C C -5.208 -9.874 0.254 1.00 . A A . 11 SER C 1 1 13 6463 1 1 11 SER CA C -3.801 -10.442 0.456 1.00 . A A . 11 SER CA 1 1 13 6464 1 1 11 SER CB C -3.833 -11.969 0.495 1.00 . A A . 11 SER CB 1 1 13 6465 1 1 11 SER H H -3.158 -10.544 2.444 1.00 . A A . 11 SER H 1 1 13 6466 1 1 11 SER HA H -3.182 -10.134 -0.373 1.00 . A A . 11 SER HA 1 1 13 6467 1 1 11 SER HB2 H -4.367 -12.338 -0.369 1.00 . A A . 11 SER HB2 1 1 13 6468 1 1 11 SER HB3 H -2.824 -12.352 0.486 1.00 . A A . 11 SER HB3 1 1 13 6469 1 1 11 SER HG H -5.443 -12.472 1.483 1.00 . A A . 11 SER HG 1 1 13 6470 1 1 11 SER N N -3.205 -9.943 1.670 1.00 . A A . 11 SER N 1 1 13 6471 1 1 11 SER O O -5.572 -9.449 -0.850 1.00 . A A . 11 SER O 1 1 13 6472 1 1 11 SER OG O -4.490 -12.436 1.676 1.00 . A A . 11 SER OG 1 1 13 6473 1 1 12 GLU C C -7.433 -7.904 1.255 1.00 . A A . 12 GLU C 1 1 13 6474 1 1 12 GLU CA C -7.333 -9.422 1.293 1.00 . A A . 12 GLU CA 1 1 13 6475 1 1 12 GLU CB C -8.060 -9.978 2.527 1.00 . A A . 12 GLU CB 1 1 13 6476 1 1 12 GLU CD C -8.085 -12.364 1.628 1.00 . A A . 12 GLU CD 1 1 13 6477 1 1 12 GLU CG C -7.793 -11.465 2.806 1.00 . A A . 12 GLU CG 1 1 13 6478 1 1 12 GLU H H -5.539 -9.962 2.215 1.00 . A A . 12 GLU H 1 1 13 6479 1 1 12 GLU HA H -7.778 -9.838 0.403 1.00 . A A . 12 GLU HA 1 1 13 6480 1 1 12 GLU HB2 H -7.752 -9.411 3.392 1.00 . A A . 12 GLU HB2 1 1 13 6481 1 1 12 GLU HB3 H -9.122 -9.847 2.386 1.00 . A A . 12 GLU HB3 1 1 13 6482 1 1 12 GLU HG2 H -6.752 -11.584 3.066 1.00 . A A . 12 GLU HG2 1 1 13 6483 1 1 12 GLU HG3 H -8.404 -11.774 3.641 1.00 . A A . 12 GLU HG3 1 1 13 6484 1 1 12 GLU N N -5.951 -9.801 1.333 1.00 . A A . 12 GLU N 1 1 13 6485 1 1 12 GLU O O -8.201 -7.325 0.476 1.00 . A A . 12 GLU O 1 1 13 6486 1 1 12 GLU OE1 O -7.133 -12.793 0.930 1.00 . A A . 12 GLU OE1 1 1 13 6487 1 1 12 GLU OE2 O -9.273 -12.658 1.366 1.00 . A A . 12 GLU OE2 1 1 13 6488 1 1 13 ARG C C -5.413 -5.335 1.346 1.00 . A A . 13 ARG C 1 1 13 6489 1 1 13 ARG CA C -6.594 -5.818 2.119 1.00 . A A . 13 ARG CA 1 1 13 6490 1 1 13 ARG CB C -6.495 -5.302 3.531 1.00 . A A . 13 ARG CB 1 1 13 6491 1 1 13 ARG CD C -8.902 -4.671 3.929 1.00 . A A . 13 ARG CD 1 1 13 6492 1 1 13 ARG CG C -7.706 -5.497 4.391 1.00 . A A . 13 ARG CG 1 1 13 6493 1 1 13 ARG CZ C -10.414 -4.473 1.959 1.00 . A A . 13 ARG CZ 1 1 13 6494 1 1 13 ARG H H -6.076 -7.786 2.690 1.00 . A A . 13 ARG H 1 1 13 6495 1 1 13 ARG HA H -7.497 -5.432 1.669 1.00 . A A . 13 ARG HA 1 1 13 6496 1 1 13 ARG HB2 H -5.678 -5.818 4.011 1.00 . A A . 13 ARG HB2 1 1 13 6497 1 1 13 ARG HB3 H -6.263 -4.247 3.498 1.00 . A A . 13 ARG HB3 1 1 13 6498 1 1 13 ARG HD2 H -9.651 -4.694 4.703 1.00 . A A . 13 ARG HD2 1 1 13 6499 1 1 13 ARG HD3 H -8.577 -3.650 3.787 1.00 . A A . 13 ARG HD3 1 1 13 6500 1 1 13 ARG HE H -9.228 -6.052 2.391 1.00 . A A . 13 ARG HE 1 1 13 6501 1 1 13 ARG HG2 H -7.962 -6.543 4.332 1.00 . A A . 13 ARG HG2 1 1 13 6502 1 1 13 ARG HG3 H -7.430 -5.223 5.399 1.00 . A A . 13 ARG HG3 1 1 13 6503 1 1 13 ARG HH11 H -10.499 -2.851 3.209 1.00 . A A . 13 ARG HH11 1 1 13 6504 1 1 13 ARG HH12 H -11.505 -2.746 1.846 1.00 . A A . 13 ARG HH12 1 1 13 6505 1 1 13 ARG HH21 H -10.639 -5.918 0.537 1.00 . A A . 13 ARG HH21 1 1 13 6506 1 1 13 ARG HH22 H -11.579 -4.520 0.279 1.00 . A A . 13 ARG HH22 1 1 13 6507 1 1 13 ARG N N -6.653 -7.264 2.087 1.00 . A A . 13 ARG N 1 1 13 6508 1 1 13 ARG NE N -9.510 -5.154 2.681 1.00 . A A . 13 ARG NE 1 1 13 6509 1 1 13 ARG NH1 N -10.834 -3.280 2.365 1.00 . A A . 13 ARG NH1 1 1 13 6510 1 1 13 ARG NH2 N -10.915 -5.006 0.852 1.00 . A A . 13 ARG NH2 1 1 13 6511 1 1 13 ARG O O -4.286 -5.629 1.697 1.00 . A A . 13 ARG O 1 1 13 6512 1 1 14 LYS C C -4.480 -2.589 -0.352 1.00 . A A . 14 LYS C 1 1 13 6513 1 1 14 LYS CA C -4.635 -4.094 -0.561 1.00 . A A . 14 LYS CA 1 1 13 6514 1 1 14 LYS CB C -4.959 -4.389 -2.015 1.00 . A A . 14 LYS CB 1 1 13 6515 1 1 14 LYS CD C -5.496 -6.080 -3.766 1.00 . A A . 14 LYS CD 1 1 13 6516 1 1 14 LYS CE C -5.541 -7.553 -4.123 1.00 . A A . 14 LYS CE 1 1 13 6517 1 1 14 LYS CG C -5.019 -5.866 -2.346 1.00 . A A . 14 LYS CG 1 1 13 6518 1 1 14 LYS H H -6.617 -4.424 0.105 1.00 . A A . 14 LYS H 1 1 13 6519 1 1 14 LYS HA H -3.706 -4.582 -0.304 1.00 . A A . 14 LYS HA 1 1 13 6520 1 1 14 LYS HB2 H -5.920 -3.955 -2.246 1.00 . A A . 14 LYS HB2 1 1 13 6521 1 1 14 LYS HB3 H -4.205 -3.931 -2.637 1.00 . A A . 14 LYS HB3 1 1 13 6522 1 1 14 LYS HD2 H -6.486 -5.666 -3.871 1.00 . A A . 14 LYS HD2 1 1 13 6523 1 1 14 LYS HD3 H -4.821 -5.574 -4.442 1.00 . A A . 14 LYS HD3 1 1 13 6524 1 1 14 LYS HE2 H -5.949 -7.654 -5.117 1.00 . A A . 14 LYS HE2 1 1 13 6525 1 1 14 LYS HE3 H -4.533 -7.936 -4.111 1.00 . A A . 14 LYS HE3 1 1 13 6526 1 1 14 LYS HG2 H -4.033 -6.293 -2.235 1.00 . A A . 14 LYS HG2 1 1 13 6527 1 1 14 LYS HG3 H -5.703 -6.352 -1.666 1.00 . A A . 14 LYS HG3 1 1 13 6528 1 1 14 LYS HZ1 H -5.971 -8.409 -2.234 1.00 . A A . 14 LYS HZ1 1 1 13 6529 1 1 14 LYS HZ2 H -6.503 -9.311 -3.530 1.00 . A A . 14 LYS HZ2 1 1 13 6530 1 1 14 LYS HZ3 H -7.332 -7.941 -3.096 1.00 . A A . 14 LYS HZ3 1 1 13 6531 1 1 14 LYS N N -5.675 -4.629 0.295 1.00 . A A . 14 LYS N 1 1 13 6532 1 1 14 LYS NZ N -6.377 -8.338 -3.191 1.00 . A A . 14 LYS NZ 1 1 13 6533 1 1 14 LYS O O -5.422 -1.918 0.099 1.00 . A A . 14 LYS O 1 1 13 6534 1 1 15 CYS C C -3.734 0.113 -1.720 1.00 . A A . 15 CYS C 1 1 13 6535 1 1 15 CYS CA C -3.064 -0.632 -0.576 1.00 . A A . 15 CYS CA 1 1 13 6536 1 1 15 CYS CB C -1.560 -0.339 -0.568 1.00 . A A . 15 CYS CB 1 1 13 6537 1 1 15 CYS H H -2.604 -2.647 -1.010 1.00 . A A . 15 CYS H 1 1 13 6538 1 1 15 CYS HA H -3.498 -0.277 0.344 1.00 . A A . 15 CYS HA 1 1 13 6539 1 1 15 CYS HB2 H -1.138 -0.627 -1.519 1.00 . A A . 15 CYS HB2 1 1 13 6540 1 1 15 CYS HB3 H -1.408 0.719 -0.421 1.00 . A A . 15 CYS HB3 1 1 13 6541 1 1 15 CYS N N -3.320 -2.064 -0.686 1.00 . A A . 15 CYS N 1 1 13 6542 1 1 15 CYS O O -4.075 -0.490 -2.758 1.00 . A A . 15 CYS O 1 1 13 6543 1 1 15 CYS SG S -0.633 -1.220 0.726 1.00 . A A . 15 CYS SG 1 1 13 6544 1 1 16 CYS C C -3.770 2.394 -3.830 1.00 . A A . 16 CYS C 1 1 13 6545 1 1 16 CYS CA C -4.580 2.246 -2.529 1.00 . A A . 16 CYS CA 1 1 13 6546 1 1 16 CYS CB C -4.859 3.617 -1.921 1.00 . A A . 16 CYS CB 1 1 13 6547 1 1 16 CYS H H -3.669 1.787 -0.674 1.00 . A A . 16 CYS H 1 1 13 6548 1 1 16 CYS HA H -5.530 1.793 -2.772 1.00 . A A . 16 CYS HA 1 1 13 6549 1 1 16 CYS HB2 H -3.924 4.066 -1.620 1.00 . A A . 16 CYS HB2 1 1 13 6550 1 1 16 CYS HB3 H -5.335 4.247 -2.659 1.00 . A A . 16 CYS HB3 1 1 13 6551 1 1 16 CYS N N -3.934 1.389 -1.534 1.00 . A A . 16 CYS N 1 1 13 6552 1 1 16 CYS O O -2.582 2.033 -3.904 1.00 . A A . 16 CYS O 1 1 13 6553 1 1 16 CYS SG S -5.940 3.553 -0.462 1.00 . A A . 16 CYS SG 1 1 13 6554 1 1 17 LYS C C -2.786 4.266 -5.987 1.00 . A A . 17 LYS C 1 1 13 6555 1 1 17 LYS CA C -3.841 3.181 -6.138 1.00 . A A . 17 LYS CA 1 1 13 6556 1 1 17 LYS CB C -4.929 3.611 -7.125 1.00 . A A . 17 LYS CB 1 1 13 6557 1 1 17 LYS CD C -5.561 4.414 -9.421 1.00 . A A . 17 LYS CD 1 1 13 6558 1 1 17 LYS CE C -6.476 3.251 -9.757 1.00 . A A . 17 LYS CE 1 1 13 6559 1 1 17 LYS CG C -4.421 3.994 -8.511 1.00 . A A . 17 LYS CG 1 1 13 6560 1 1 17 LYS H H -5.386 3.113 -4.728 1.00 . A A . 17 LYS H 1 1 13 6561 1 1 17 LYS HA H -3.370 2.278 -6.496 1.00 . A A . 17 LYS HA 1 1 13 6562 1 1 17 LYS HB2 H -5.623 2.792 -7.234 1.00 . A A . 17 LYS HB2 1 1 13 6563 1 1 17 LYS HB3 H -5.456 4.457 -6.711 1.00 . A A . 17 LYS HB3 1 1 13 6564 1 1 17 LYS HD2 H -6.139 5.180 -8.926 1.00 . A A . 17 LYS HD2 1 1 13 6565 1 1 17 LYS HD3 H -5.146 4.813 -10.335 1.00 . A A . 17 LYS HD3 1 1 13 6566 1 1 17 LYS HE2 H -5.913 2.508 -10.303 1.00 . A A . 17 LYS HE2 1 1 13 6567 1 1 17 LYS HE3 H -6.848 2.812 -8.843 1.00 . A A . 17 LYS HE3 1 1 13 6568 1 1 17 LYS HG2 H -3.727 4.815 -8.415 1.00 . A A . 17 LYS HG2 1 1 13 6569 1 1 17 LYS HG3 H -3.917 3.144 -8.946 1.00 . A A . 17 LYS HG3 1 1 13 6570 1 1 17 LYS HZ1 H -8.148 2.839 -10.893 1.00 . A A . 17 LYS HZ1 1 1 13 6571 1 1 17 LYS HZ2 H -7.292 4.185 -11.425 1.00 . A A . 17 LYS HZ2 1 1 13 6572 1 1 17 LYS HZ3 H -8.258 4.284 -10.029 1.00 . A A . 17 LYS HZ3 1 1 13 6573 1 1 17 LYS N N -4.436 2.907 -4.848 1.00 . A A . 17 LYS N 1 1 13 6574 1 1 17 LYS NZ N -7.617 3.677 -10.579 1.00 . A A . 17 LYS NZ 1 1 13 6575 1 1 17 LYS O O -2.957 5.206 -5.201 1.00 . A A . 17 LYS O 1 1 13 6576 1 1 18 GLY C C 0.371 4.497 -5.549 1.00 . A A . 18 GLY C 1 1 13 6577 1 1 18 GLY CA C -0.596 5.027 -6.569 1.00 . A A . 18 GLY CA 1 1 13 6578 1 1 18 GLY H H -1.612 3.374 -7.341 1.00 . A A . 18 GLY H 1 1 13 6579 1 1 18 GLY HA2 H -0.101 5.132 -7.524 1.00 . A A . 18 GLY HA2 1 1 13 6580 1 1 18 GLY HA3 H -0.960 5.989 -6.241 1.00 . A A . 18 GLY HA3 1 1 13 6581 1 1 18 GLY N N -1.696 4.115 -6.701 1.00 . A A . 18 GLY N 1 1 13 6582 1 1 18 GLY O O 1.423 5.088 -5.285 1.00 . A A . 18 GLY O 1 1 13 6583 1 1 19 MET C C 0.866 1.263 -4.370 1.00 . A A . 19 MET C 1 1 13 6584 1 1 19 MET CA C 0.774 2.706 -3.973 1.00 . A A . 19 MET CA 1 1 13 6585 1 1 19 MET CB C 0.120 2.825 -2.587 1.00 . A A . 19 MET CB 1 1 13 6586 1 1 19 MET CE C -0.994 6.215 -0.501 1.00 . A A . 19 MET CE 1 1 13 6587 1 1 19 MET CG C 0.030 4.242 -2.088 1.00 . A A . 19 MET CG 1 1 13 6588 1 1 19 MET H H -0.876 2.993 -5.180 1.00 . A A . 19 MET H 1 1 13 6589 1 1 19 MET HA H 1.761 3.143 -3.939 1.00 . A A . 19 MET HA 1 1 13 6590 1 1 19 MET HB2 H -0.881 2.421 -2.640 1.00 . A A . 19 MET HB2 1 1 13 6591 1 1 19 MET HB3 H 0.695 2.247 -1.879 1.00 . A A . 19 MET HB3 1 1 13 6592 1 1 19 MET HE1 H -1.464 6.628 -1.380 1.00 . A A . 19 MET HE1 1 1 13 6593 1 1 19 MET HE2 H 0.020 6.583 -0.435 1.00 . A A . 19 MET HE2 1 1 13 6594 1 1 19 MET HE3 H -1.545 6.509 0.377 1.00 . A A . 19 MET HE3 1 1 13 6595 1 1 19 MET HG2 H 1.038 4.522 -1.819 1.00 . A A . 19 MET HG2 1 1 13 6596 1 1 19 MET HG3 H -0.345 4.885 -2.871 1.00 . A A . 19 MET HG3 1 1 13 6597 1 1 19 MET N N -0.006 3.391 -4.953 1.00 . A A . 19 MET N 1 1 13 6598 1 1 19 MET O O -0.005 0.749 -5.090 1.00 . A A . 19 MET O 1 1 13 6599 1 1 19 MET SD S -0.975 4.431 -0.614 1.00 . A A . 19 MET SD 1 1 13 6600 1 1 20 VAL C C 1.790 -1.537 -2.941 1.00 . A A . 20 VAL C 1 1 13 6601 1 1 20 VAL CA C 2.076 -0.756 -4.206 1.00 . A A . 20 VAL CA 1 1 13 6602 1 1 20 VAL CB C 3.512 -1.053 -4.773 1.00 . A A . 20 VAL CB 1 1 13 6603 1 1 20 VAL CG1 C 4.609 -0.593 -3.832 1.00 . A A . 20 VAL CG1 1 1 13 6604 1 1 20 VAL CG2 C 3.683 -2.525 -5.113 1.00 . A A . 20 VAL CG2 1 1 13 6605 1 1 20 VAL H H 2.535 1.093 -3.359 1.00 . A A . 20 VAL H 1 1 13 6606 1 1 20 VAL HA H 1.340 -1.034 -4.946 1.00 . A A . 20 VAL HA 1 1 13 6607 1 1 20 VAL HB H 3.621 -0.486 -5.684 1.00 . A A . 20 VAL HB 1 1 13 6608 1 1 20 VAL HG11 H 4.518 0.470 -3.661 1.00 . A A . 20 VAL HG11 1 1 13 6609 1 1 20 VAL HG12 H 5.573 -0.805 -4.272 1.00 . A A . 20 VAL HG12 1 1 13 6610 1 1 20 VAL HG13 H 4.518 -1.120 -2.893 1.00 . A A . 20 VAL HG13 1 1 13 6611 1 1 20 VAL HG21 H 2.962 -2.809 -5.865 1.00 . A A . 20 VAL HG21 1 1 13 6612 1 1 20 VAL HG22 H 3.519 -3.119 -4.225 1.00 . A A . 20 VAL HG22 1 1 13 6613 1 1 20 VAL HG23 H 4.682 -2.699 -5.485 1.00 . A A . 20 VAL HG23 1 1 13 6614 1 1 20 VAL N N 1.884 0.621 -3.930 1.00 . A A . 20 VAL N 1 1 13 6615 1 1 20 VAL O O 2.214 -1.139 -1.829 1.00 . A A . 20 VAL O 1 1 13 6616 1 1 21 CYS C C 1.816 -4.297 -1.677 1.00 . A A . 21 CYS C 1 1 13 6617 1 1 21 CYS CA C 0.642 -3.410 -1.995 1.00 . A A . 21 CYS CA 1 1 13 6618 1 1 21 CYS CB C -0.599 -4.244 -2.347 1.00 . A A . 21 CYS CB 1 1 13 6619 1 1 21 CYS H H 0.655 -2.778 -3.980 1.00 . A A . 21 CYS H 1 1 13 6620 1 1 21 CYS HA H 0.424 -2.785 -1.141 1.00 . A A . 21 CYS HA 1 1 13 6621 1 1 21 CYS HB2 H -1.370 -3.588 -2.723 1.00 . A A . 21 CYS HB2 1 1 13 6622 1 1 21 CYS HB3 H -0.335 -4.954 -3.116 1.00 . A A . 21 CYS HB3 1 1 13 6623 1 1 21 CYS N N 1.005 -2.568 -3.088 1.00 . A A . 21 CYS N 1 1 13 6624 1 1 21 CYS O O 2.205 -5.146 -2.484 1.00 . A A . 21 CYS O 1 1 13 6625 1 1 21 CYS SG S -1.321 -5.179 -0.949 1.00 . A A . 21 CYS SG 1 1 13 6626 1 1 22 ARG C C 3.462 -5.030 1.382 1.00 . A A . 22 ARG C 1 1 13 6627 1 1 22 ARG CA C 3.556 -4.777 -0.098 1.00 . A A . 22 ARG CA 1 1 13 6628 1 1 22 ARG CB C 4.826 -3.976 -0.379 1.00 . A A . 22 ARG CB 1 1 13 6629 1 1 22 ARG CD C 5.556 -5.291 -2.373 1.00 . A A . 22 ARG CD 1 1 13 6630 1 1 22 ARG CG C 5.248 -3.914 -1.808 1.00 . A A . 22 ARG CG 1 1 13 6631 1 1 22 ARG CZ C 7.238 -7.084 -1.949 1.00 . A A . 22 ARG CZ 1 1 13 6632 1 1 22 ARG H H 2.065 -3.351 0.044 1.00 . A A . 22 ARG H 1 1 13 6633 1 1 22 ARG HA H 3.620 -5.715 -0.625 1.00 . A A . 22 ARG HA 1 1 13 6634 1 1 22 ARG HB2 H 4.658 -2.959 -0.056 1.00 . A A . 22 ARG HB2 1 1 13 6635 1 1 22 ARG HB3 H 5.654 -4.364 0.190 1.00 . A A . 22 ARG HB3 1 1 13 6636 1 1 22 ARG HD2 H 4.681 -5.919 -2.307 1.00 . A A . 22 ARG HD2 1 1 13 6637 1 1 22 ARG HD3 H 5.838 -5.185 -3.410 1.00 . A A . 22 ARG HD3 1 1 13 6638 1 1 22 ARG HE H 7.021 -5.397 -0.893 1.00 . A A . 22 ARG HE 1 1 13 6639 1 1 22 ARG HG2 H 4.491 -3.414 -2.388 1.00 . A A . 22 ARG HG2 1 1 13 6640 1 1 22 ARG HG3 H 6.164 -3.348 -1.760 1.00 . A A . 22 ARG HG3 1 1 13 6641 1 1 22 ARG HH11 H 5.967 -7.586 -3.485 1.00 . A A . 22 ARG HH11 1 1 13 6642 1 1 22 ARG HH12 H 7.197 -8.715 -3.195 1.00 . A A . 22 ARG HH12 1 1 13 6643 1 1 22 ARG HH21 H 8.631 -6.959 -0.466 1.00 . A A . 22 ARG HH21 1 1 13 6644 1 1 22 ARG HH22 H 8.746 -8.355 -1.428 1.00 . A A . 22 ARG HH22 1 1 13 6645 1 1 22 ARG N N 2.414 -4.054 -0.547 1.00 . A A . 22 ARG N 1 1 13 6646 1 1 22 ARG NE N 6.666 -5.920 -1.649 1.00 . A A . 22 ARG NE 1 1 13 6647 1 1 22 ARG NH1 N 6.767 -7.844 -2.939 1.00 . A A . 22 ARG NH1 1 1 13 6648 1 1 22 ARG NH2 N 8.265 -7.494 -1.235 1.00 . A A . 22 ARG NH2 1 1 13 6649 1 1 22 ARG O O 2.346 -4.911 2.011 1.00 . A A . 22 ARG O 1 1 13 6650 1 1 23 LEU C C 4.203 -4.413 4.115 1.00 . A A . 23 LEU C 1 1 13 6651 1 1 23 LEU CA C 4.794 -5.594 3.378 1.00 . A A . 23 LEU CA 1 1 13 6652 1 1 23 LEU CB C 6.276 -5.768 3.741 1.00 . A A . 23 LEU CB 1 1 13 6653 1 1 23 LEU CD1 C 5.997 -7.450 5.601 1.00 . A A . 23 LEU CD1 1 1 13 6654 1 1 23 LEU CD2 C 8.081 -6.070 5.464 1.00 . A A . 23 LEU CD2 1 1 13 6655 1 1 23 LEU CG C 6.584 -6.101 5.208 1.00 . A A . 23 LEU CG 1 1 13 6656 1 1 23 LEU H H 5.416 -5.397 1.348 1.00 . A A . 23 LEU H 1 1 13 6657 1 1 23 LEU HA H 4.244 -6.491 3.625 1.00 . A A . 23 LEU HA 1 1 13 6658 1 1 23 LEU HB2 H 6.682 -6.557 3.126 1.00 . A A . 23 LEU HB2 1 1 13 6659 1 1 23 LEU HB3 H 6.788 -4.849 3.493 1.00 . A A . 23 LEU HB3 1 1 13 6660 1 1 23 LEU HD11 H 4.924 -7.427 5.484 1.00 . A A . 23 LEU HD11 1 1 13 6661 1 1 23 LEU HD12 H 6.241 -7.663 6.631 1.00 . A A . 23 LEU HD12 1 1 13 6662 1 1 23 LEU HD13 H 6.412 -8.222 4.967 1.00 . A A . 23 LEU HD13 1 1 13 6663 1 1 23 LEU HD21 H 8.273 -6.305 6.502 1.00 . A A . 23 LEU HD21 1 1 13 6664 1 1 23 LEU HD22 H 8.467 -5.087 5.241 1.00 . A A . 23 LEU HD22 1 1 13 6665 1 1 23 LEU HD23 H 8.570 -6.800 4.836 1.00 . A A . 23 LEU HD23 1 1 13 6666 1 1 23 LEU HG H 6.119 -5.351 5.832 1.00 . A A . 23 LEU HG 1 1 13 6667 1 1 23 LEU N N 4.638 -5.351 1.950 1.00 . A A . 23 LEU N 1 1 13 6668 1 1 23 LEU O O 3.509 -4.570 5.115 1.00 . A A . 23 LEU O 1 1 13 6669 1 1 24 TRP C C 3.273 -1.337 2.781 1.00 . A A . 24 TRP C 1 1 13 6670 1 1 24 TRP CA C 3.828 -2.047 4.010 1.00 . A A . 24 TRP CA 1 1 13 6671 1 1 24 TRP CB C 4.796 -1.142 4.802 1.00 . A A . 24 TRP CB 1 1 13 6672 1 1 24 TRP CD1 C 5.868 0.643 3.333 1.00 . A A . 24 TRP CD1 1 1 13 6673 1 1 24 TRP CD2 C 7.238 -1.038 3.843 1.00 . A A . 24 TRP CD2 1 1 13 6674 1 1 24 TRP CE2 C 7.940 -0.120 3.035 1.00 . A A . 24 TRP CE2 1 1 13 6675 1 1 24 TRP CE3 C 7.895 -2.179 4.294 1.00 . A A . 24 TRP CE3 1 1 13 6676 1 1 24 TRP CG C 5.914 -0.530 4.010 1.00 . A A . 24 TRP CG 1 1 13 6677 1 1 24 TRP CH2 C 9.886 -1.443 3.134 1.00 . A A . 24 TRP CH2 1 1 13 6678 1 1 24 TRP CZ2 C 9.268 -0.313 2.672 1.00 . A A . 24 TRP CZ2 1 1 13 6679 1 1 24 TRP CZ3 C 9.211 -2.368 3.935 1.00 . A A . 24 TRP CZ3 1 1 13 6680 1 1 24 TRP H H 5.052 -3.181 2.800 1.00 . A A . 24 TRP H 1 1 13 6681 1 1 24 TRP HA H 3.016 -2.366 4.641 1.00 . A A . 24 TRP HA 1 1 13 6682 1 1 24 TRP HB2 H 4.230 -0.328 5.223 1.00 . A A . 24 TRP HB2 1 1 13 6683 1 1 24 TRP HB3 H 5.231 -1.718 5.607 1.00 . A A . 24 TRP HB3 1 1 13 6684 1 1 24 TRP HD1 H 4.967 1.241 3.298 1.00 . A A . 24 TRP HD1 1 1 13 6685 1 1 24 TRP HE1 H 7.299 1.685 2.182 1.00 . A A . 24 TRP HE1 1 1 13 6686 1 1 24 TRP HE3 H 7.391 -2.904 4.914 1.00 . A A . 24 TRP HE3 1 1 13 6687 1 1 24 TRP HH2 H 10.918 -1.639 2.886 1.00 . A A . 24 TRP HH2 1 1 13 6688 1 1 24 TRP HZ2 H 9.805 0.393 2.055 1.00 . A A . 24 TRP HZ2 1 1 13 6689 1 1 24 TRP HZ3 H 9.738 -3.248 4.276 1.00 . A A . 24 TRP HZ3 1 1 13 6690 1 1 24 TRP N N 4.446 -3.242 3.566 1.00 . A A . 24 TRP N 1 1 13 6691 1 1 24 TRP NE1 N 7.082 0.899 2.732 1.00 . A A . 24 TRP NE1 1 1 13 6692 1 1 24 TRP O O 3.616 -1.715 1.652 1.00 . A A . 24 TRP O 1 1 13 6693 1 1 25 CYS C C 2.952 1.376 1.404 1.00 . A A . 25 CYS C 1 1 13 6694 1 1 25 CYS CA C 1.910 0.399 1.857 1.00 . A A . 25 CYS CA 1 1 13 6695 1 1 25 CYS CB C 0.598 1.094 2.185 1.00 . A A . 25 CYS CB 1 1 13 6696 1 1 25 CYS H H 2.104 -0.126 3.874 1.00 . A A . 25 CYS H 1 1 13 6697 1 1 25 CYS HA H 1.747 -0.302 1.051 1.00 . A A . 25 CYS HA 1 1 13 6698 1 1 25 CYS HB2 H 0.706 1.639 3.111 1.00 . A A . 25 CYS HB2 1 1 13 6699 1 1 25 CYS HB3 H 0.350 1.781 1.390 1.00 . A A . 25 CYS HB3 1 1 13 6700 1 1 25 CYS N N 2.414 -0.366 2.972 1.00 . A A . 25 CYS N 1 1 13 6701 1 1 25 CYS O O 3.358 2.282 2.145 1.00 . A A . 25 CYS O 1 1 13 6702 1 1 25 CYS SG S -0.794 -0.058 2.377 1.00 . A A . 25 CYS SG 1 1 13 6703 1 1 26 LYS C C 3.963 2.780 -1.456 1.00 . A A . 26 LYS C 1 1 13 6704 1 1 26 LYS CA C 4.462 1.970 -0.301 1.00 . A A . 26 LYS CA 1 1 13 6705 1 1 26 LYS CB C 5.593 1.067 -0.767 1.00 . A A . 26 LYS CB 1 1 13 6706 1 1 26 LYS CD C 7.734 0.890 -2.031 1.00 . A A . 26 LYS CD 1 1 13 6707 1 1 26 LYS CE C 8.823 1.677 -2.718 1.00 . A A . 26 LYS CE 1 1 13 6708 1 1 26 LYS CG C 6.712 1.817 -1.437 1.00 . A A . 26 LYS CG 1 1 13 6709 1 1 26 LYS H H 2.999 0.496 -0.360 1.00 . A A . 26 LYS H 1 1 13 6710 1 1 26 LYS HA H 4.836 2.609 0.482 1.00 . A A . 26 LYS HA 1 1 13 6711 1 1 26 LYS HB2 H 5.997 0.544 0.088 1.00 . A A . 26 LYS HB2 1 1 13 6712 1 1 26 LYS HB3 H 5.199 0.345 -1.466 1.00 . A A . 26 LYS HB3 1 1 13 6713 1 1 26 LYS HD2 H 8.168 0.293 -1.243 1.00 . A A . 26 LYS HD2 1 1 13 6714 1 1 26 LYS HD3 H 7.252 0.248 -2.754 1.00 . A A . 26 LYS HD3 1 1 13 6715 1 1 26 LYS HE2 H 9.341 2.263 -1.975 1.00 . A A . 26 LYS HE2 1 1 13 6716 1 1 26 LYS HE3 H 9.520 0.983 -3.166 1.00 . A A . 26 LYS HE3 1 1 13 6717 1 1 26 LYS HG2 H 6.291 2.421 -2.227 1.00 . A A . 26 LYS HG2 1 1 13 6718 1 1 26 LYS HG3 H 7.181 2.459 -0.711 1.00 . A A . 26 LYS HG3 1 1 13 6719 1 1 26 LYS HZ1 H 7.777 2.075 -4.515 1.00 . A A . 26 LYS HZ1 1 1 13 6720 1 1 26 LYS HZ2 H 9.081 3.085 -4.231 1.00 . A A . 26 LYS HZ2 1 1 13 6721 1 1 26 LYS HZ3 H 7.659 3.315 -3.370 1.00 . A A . 26 LYS HZ3 1 1 13 6722 1 1 26 LYS N N 3.407 1.182 0.216 1.00 . A A . 26 LYS N 1 1 13 6723 1 1 26 LYS NZ N 8.291 2.589 -3.772 1.00 . A A . 26 LYS NZ 1 1 13 6724 1 1 26 LYS O O 3.330 2.232 -2.347 1.00 . A A . 26 LYS O 1 1 13 6725 1 1 27 LYS C C 4.685 4.455 -3.773 1.00 . A A . 27 LYS C 1 1 13 6726 1 1 27 LYS CA C 3.862 4.893 -2.572 1.00 . A A . 27 LYS CA 1 1 13 6727 1 1 27 LYS CB C 4.042 6.376 -2.279 1.00 . A A . 27 LYS CB 1 1 13 6728 1 1 27 LYS CD C 3.366 8.361 -0.763 1.00 . A A . 27 LYS CD 1 1 13 6729 1 1 27 LYS CE C 2.733 9.333 -1.786 1.00 . A A . 27 LYS CE 1 1 13 6730 1 1 27 LYS CG C 3.192 6.865 -1.103 1.00 . A A . 27 LYS CG 1 1 13 6731 1 1 27 LYS H H 4.644 4.467 -0.652 1.00 . A A . 27 LYS H 1 1 13 6732 1 1 27 LYS HA H 2.827 4.689 -2.799 1.00 . A A . 27 LYS HA 1 1 13 6733 1 1 27 LYS HB2 H 5.087 6.535 -2.085 1.00 . A A . 27 LYS HB2 1 1 13 6734 1 1 27 LYS HB3 H 3.767 6.931 -3.162 1.00 . A A . 27 LYS HB3 1 1 13 6735 1 1 27 LYS HD2 H 2.913 8.546 0.200 1.00 . A A . 27 LYS HD2 1 1 13 6736 1 1 27 LYS HD3 H 4.424 8.568 -0.692 1.00 . A A . 27 LYS HD3 1 1 13 6737 1 1 27 LYS HE2 H 1.736 8.984 -2.014 1.00 . A A . 27 LYS HE2 1 1 13 6738 1 1 27 LYS HE3 H 2.659 10.307 -1.324 1.00 . A A . 27 LYS HE3 1 1 13 6739 1 1 27 LYS HG2 H 2.153 6.696 -1.343 1.00 . A A . 27 LYS HG2 1 1 13 6740 1 1 27 LYS HG3 H 3.446 6.276 -0.234 1.00 . A A . 27 LYS HG3 1 1 13 6741 1 1 27 LYS HZ1 H 3.465 8.577 -3.619 1.00 . A A . 27 LYS HZ1 1 1 13 6742 1 1 27 LYS HZ2 H 4.475 9.682 -2.862 1.00 . A A . 27 LYS HZ2 1 1 13 6743 1 1 27 LYS HZ3 H 3.090 10.221 -3.645 1.00 . A A . 27 LYS HZ3 1 1 13 6744 1 1 27 LYS N N 4.216 4.072 -1.443 1.00 . A A . 27 LYS N 1 1 13 6745 1 1 27 LYS NZ N 3.481 9.454 -3.062 1.00 . A A . 27 LYS NZ 1 1 13 6746 1 1 27 LYS O O 5.913 4.263 -3.690 1.00 . A A . 27 LYS O 1 1 13 6747 1 1 28 LYS C C 4.763 4.808 -7.054 1.00 . A A . 28 LYS C 1 1 13 6748 1 1 28 LYS CA C 4.577 3.724 -6.031 1.00 . A A . 28 LYS CA 1 1 13 6749 1 1 28 LYS CB C 3.688 2.592 -6.577 1.00 . A A . 28 LYS CB 1 1 13 6750 1 1 28 LYS CD C 3.191 0.884 -8.343 1.00 . A A . 28 LYS CD 1 1 13 6751 1 1 28 LYS CE C 3.542 0.334 -9.716 1.00 . A A . 28 LYS CE 1 1 13 6752 1 1 28 LYS CG C 4.138 1.990 -7.903 1.00 . A A . 28 LYS CG 1 1 13 6753 1 1 28 LYS H H 3.062 4.527 -4.839 1.00 . A A . 28 LYS H 1 1 13 6754 1 1 28 LYS HA H 5.541 3.306 -5.780 1.00 . A A . 28 LYS HA 1 1 13 6755 1 1 28 LYS HB2 H 3.655 1.799 -5.845 1.00 . A A . 28 LYS HB2 1 1 13 6756 1 1 28 LYS HB3 H 2.688 2.981 -6.704 1.00 . A A . 28 LYS HB3 1 1 13 6757 1 1 28 LYS HD2 H 3.241 0.075 -7.629 1.00 . A A . 28 LYS HD2 1 1 13 6758 1 1 28 LYS HD3 H 2.186 1.278 -8.368 1.00 . A A . 28 LYS HD3 1 1 13 6759 1 1 28 LYS HE2 H 2.837 -0.443 -9.970 1.00 . A A . 28 LYS HE2 1 1 13 6760 1 1 28 LYS HE3 H 3.459 1.136 -10.434 1.00 . A A . 28 LYS HE3 1 1 13 6761 1 1 28 LYS HG2 H 4.149 2.764 -8.656 1.00 . A A . 28 LYS HG2 1 1 13 6762 1 1 28 LYS HG3 H 5.131 1.579 -7.792 1.00 . A A . 28 LYS HG3 1 1 13 6763 1 1 28 LYS HZ1 H 5.029 -0.731 -10.685 1.00 . A A . 28 LYS HZ1 1 1 13 6764 1 1 28 LYS HZ2 H 5.093 -0.896 -9.009 1.00 . A A . 28 LYS HZ2 1 1 13 6765 1 1 28 LYS HZ3 H 5.621 0.532 -9.762 1.00 . A A . 28 LYS HZ3 1 1 13 6766 1 1 28 LYS N N 4.008 4.258 -4.839 1.00 . A A . 28 LYS N 1 1 13 6767 1 1 28 LYS NZ N 4.903 -0.231 -9.783 1.00 . A A . 28 LYS NZ 1 1 13 6768 1 1 28 LYS O O 3.807 5.225 -7.726 1.00 . A A . 28 LYS O 1 1 13 6769 1 1 29 LEU C C 6.675 5.460 -9.347 1.00 . A A . 29 LEU C 1 1 13 6770 1 1 29 LEU CA C 6.290 6.266 -8.138 1.00 . A A . 29 LEU CA 1 1 13 6771 1 1 29 LEU CB C 7.452 7.170 -7.702 1.00 . A A . 29 LEU CB 1 1 13 6772 1 1 29 LEU CD1 C 8.464 8.831 -6.126 1.00 . A A . 29 LEU CD1 1 1 13 6773 1 1 29 LEU CD2 C 6.019 8.938 -6.626 1.00 . A A . 29 LEU CD2 1 1 13 6774 1 1 29 LEU CG C 7.222 8.019 -6.448 1.00 . A A . 29 LEU CG 1 1 13 6775 1 1 29 LEU H H 6.630 5.061 -6.451 1.00 . A A . 29 LEU H 1 1 13 6776 1 1 29 LEU HA H 5.417 6.859 -8.363 1.00 . A A . 29 LEU HA 1 1 13 6777 1 1 29 LEU HB2 H 8.315 6.544 -7.531 1.00 . A A . 29 LEU HB2 1 1 13 6778 1 1 29 LEU HB3 H 7.679 7.837 -8.520 1.00 . A A . 29 LEU HB3 1 1 13 6779 1 1 29 LEU HD11 H 8.695 9.482 -6.957 1.00 . A A . 29 LEU HD11 1 1 13 6780 1 1 29 LEU HD12 H 9.294 8.164 -5.951 1.00 . A A . 29 LEU HD12 1 1 13 6781 1 1 29 LEU HD13 H 8.286 9.425 -5.242 1.00 . A A . 29 LEU HD13 1 1 13 6782 1 1 29 LEU HD21 H 5.888 9.533 -5.735 1.00 . A A . 29 LEU HD21 1 1 13 6783 1 1 29 LEU HD22 H 5.131 8.346 -6.791 1.00 . A A . 29 LEU HD22 1 1 13 6784 1 1 29 LEU HD23 H 6.183 9.589 -7.472 1.00 . A A . 29 LEU HD23 1 1 13 6785 1 1 29 LEU HG H 7.030 7.363 -5.612 1.00 . A A . 29 LEU HG 1 1 13 6786 1 1 29 LEU N N 5.957 5.323 -7.114 1.00 . A A . 29 LEU N 1 1 13 6787 1 1 29 LEU O O 6.186 5.677 -10.456 1.00 . A A . 29 LEU O 1 1 13 6788 1 1 30 TRP C C 7.672 2.208 -9.711 1.00 . A A . 30 TRP C 1 1 13 6789 1 1 30 TRP CA C 7.960 3.608 -10.140 1.00 . A A . 30 TRP CA 1 1 13 6790 1 1 30 TRP CB C 9.442 3.800 -10.447 1.00 . A A . 30 TRP CB 1 1 13 6791 1 1 30 TRP CD1 C 9.487 5.676 -12.167 1.00 . A A . 30 TRP CD1 1 1 13 6792 1 1 30 TRP CD2 C 10.399 6.217 -10.205 1.00 . A A . 30 TRP CD2 1 1 13 6793 1 1 30 TRP CE2 C 10.485 7.331 -11.057 1.00 . A A . 30 TRP CE2 1 1 13 6794 1 1 30 TRP CE3 C 10.906 6.317 -8.914 1.00 . A A . 30 TRP CE3 1 1 13 6795 1 1 30 TRP CG C 9.759 5.171 -10.937 1.00 . A A . 30 TRP CG 1 1 13 6796 1 1 30 TRP CH2 C 11.548 8.595 -9.378 1.00 . A A . 30 TRP CH2 1 1 13 6797 1 1 30 TRP CZ2 C 11.060 8.530 -10.654 1.00 . A A . 30 TRP CZ2 1 1 13 6798 1 1 30 TRP CZ3 C 11.475 7.505 -8.514 1.00 . A A . 30 TRP CZ3 1 1 13 6799 1 1 30 TRP H H 7.849 4.348 -8.204 1.00 . A A . 30 TRP H 1 1 13 6800 1 1 30 TRP HA H 7.382 3.820 -11.027 1.00 . A A . 30 TRP HA 1 1 13 6801 1 1 30 TRP HB2 H 10.019 3.622 -9.552 1.00 . A A . 30 TRP HB2 1 1 13 6802 1 1 30 TRP HB3 H 9.739 3.096 -11.209 1.00 . A A . 30 TRP HB3 1 1 13 6803 1 1 30 TRP HD1 H 9.002 5.120 -12.956 1.00 . A A . 30 TRP HD1 1 1 13 6804 1 1 30 TRP HE1 H 9.834 7.550 -13.045 1.00 . A A . 30 TRP HE1 1 1 13 6805 1 1 30 TRP HE3 H 10.853 5.479 -8.234 1.00 . A A . 30 TRP HE3 1 1 13 6806 1 1 30 TRP HH2 H 12.004 9.503 -9.013 1.00 . A A . 30 TRP HH2 1 1 13 6807 1 1 30 TRP HZ2 H 11.125 9.389 -11.306 1.00 . A A . 30 TRP HZ2 1 1 13 6808 1 1 30 TRP HZ3 H 11.873 7.603 -7.514 1.00 . A A . 30 TRP HZ3 1 1 13 6809 1 1 30 TRP N N 7.518 4.495 -9.115 1.00 . A A . 30 TRP N 1 1 13 6810 1 1 30 TRP NE1 N 9.924 6.973 -12.251 1.00 . A A . 30 TRP NE1 1 1 13 6811 1 1 30 TRP O O 6.669 1.649 -10.159 1.00 . A A . 30 TRP O 1 1 13 6812 1 1 30 TRP OXT O 8.404 1.678 -8.849 1.00 . A A . 30 TRP OXT 1 1 14 6813 1 1 1 TYR C C -10.143 1.202 0.225 1.00 . A A . 1 TYR C 1 1 14 6814 1 1 1 TYR CA C -11.579 1.233 0.681 1.00 . A A . 1 TYR CA 1 1 14 6815 1 1 1 TYR CB C -11.944 -0.043 1.467 1.00 . A A . 1 TYR CB 1 1 14 6816 1 1 1 TYR CD1 C -13.169 -1.714 0.049 1.00 . A A . 1 TYR CD1 1 1 14 6817 1 1 1 TYR CD2 C -10.845 -2.048 0.416 1.00 . A A . 1 TYR CD2 1 1 14 6818 1 1 1 TYR CE1 C -13.211 -2.840 -0.725 1.00 . A A . 1 TYR CE1 1 1 14 6819 1 1 1 TYR CE2 C -10.878 -3.175 -0.354 1.00 . A A . 1 TYR CE2 1 1 14 6820 1 1 1 TYR CG C -11.988 -1.296 0.634 1.00 . A A . 1 TYR CG 1 1 14 6821 1 1 1 TYR CZ C -12.062 -3.572 -0.926 1.00 . A A . 1 TYR CZ 1 1 14 6822 1 1 1 TYR H1 H -13.454 1.459 -0.195 1.00 . A A . 1 TYR H1 1 1 14 6823 1 1 1 TYR H2 H -12.287 0.680 -1.163 1.00 . A A . 1 TYR H2 1 1 14 6824 1 1 1 TYR H3 H -12.207 2.324 -0.929 1.00 . A A . 1 TYR H3 1 1 14 6825 1 1 1 TYR HA H -11.715 2.089 1.318 1.00 . A A . 1 TYR HA 1 1 14 6826 1 1 1 TYR HB2 H -11.209 -0.196 2.242 1.00 . A A . 1 TYR HB2 1 1 14 6827 1 1 1 TYR HB3 H -12.910 0.096 1.927 1.00 . A A . 1 TYR HB3 1 1 14 6828 1 1 1 TYR HD1 H -14.074 -1.144 0.207 1.00 . A A . 1 TYR HD1 1 1 14 6829 1 1 1 TYR HD2 H -9.915 -1.735 0.866 1.00 . A A . 1 TYR HD2 1 1 14 6830 1 1 1 TYR HE1 H -14.154 -3.126 -1.162 1.00 . A A . 1 TYR HE1 1 1 14 6831 1 1 1 TYR HE2 H -9.965 -3.730 -0.499 1.00 . A A . 1 TYR HE2 1 1 14 6832 1 1 1 TYR HH H -11.532 -5.373 -1.312 1.00 . A A . 1 TYR HH 1 1 14 6833 1 1 1 TYR N N -12.450 1.429 -0.460 1.00 . A A . 1 TYR N 1 1 14 6834 1 1 1 TYR O O -9.851 0.754 -0.883 1.00 . A A . 1 TYR O 1 1 14 6835 1 1 1 TYR OH O -12.099 -4.698 -1.712 1.00 . A A . 1 TYR OH 1 1 14 6836 1 1 2 CYS C C -7.016 1.646 1.978 1.00 . A A . 2 CYS C 1 1 14 6837 1 1 2 CYS CA C -7.853 1.739 0.736 1.00 . A A . 2 CYS CA 1 1 14 6838 1 1 2 CYS CB C -7.515 3.071 0.055 1.00 . A A . 2 CYS CB 1 1 14 6839 1 1 2 CYS H H -9.546 2.000 1.937 1.00 . A A . 2 CYS H 1 1 14 6840 1 1 2 CYS HA H -7.603 0.940 0.054 1.00 . A A . 2 CYS HA 1 1 14 6841 1 1 2 CYS HB2 H -8.037 3.850 0.589 1.00 . A A . 2 CYS HB2 1 1 14 6842 1 1 2 CYS HB3 H -6.457 3.244 0.156 1.00 . A A . 2 CYS HB3 1 1 14 6843 1 1 2 CYS N N -9.261 1.671 1.056 1.00 . A A . 2 CYS N 1 1 14 6844 1 1 2 CYS O O -7.401 2.168 3.032 1.00 . A A . 2 CYS O 1 1 14 6845 1 1 2 CYS SG S -7.977 3.234 -1.703 1.00 . A A . 2 CYS SG 1 1 14 6846 1 1 3 GLN C C -4.098 2.251 2.747 1.00 . A A . 3 GLN C 1 1 14 6847 1 1 3 GLN CA C -4.923 1.001 2.936 1.00 . A A . 3 GLN CA 1 1 14 6848 1 1 3 GLN CB C -3.993 -0.210 2.914 1.00 . A A . 3 GLN CB 1 1 14 6849 1 1 3 GLN CD C -5.344 -1.701 4.390 1.00 . A A . 3 GLN CD 1 1 14 6850 1 1 3 GLN CG C -4.656 -1.559 3.073 1.00 . A A . 3 GLN CG 1 1 14 6851 1 1 3 GLN H H -5.701 0.451 1.066 1.00 . A A . 3 GLN H 1 1 14 6852 1 1 3 GLN HA H -5.458 1.052 3.871 1.00 . A A . 3 GLN HA 1 1 14 6853 1 1 3 GLN HB2 H -3.432 -0.212 1.994 1.00 . A A . 3 GLN HB2 1 1 14 6854 1 1 3 GLN HB3 H -3.288 -0.093 3.724 1.00 . A A . 3 GLN HB3 1 1 14 6855 1 1 3 GLN HE21 H -3.677 -2.379 5.199 1.00 . A A . 3 GLN HE21 1 1 14 6856 1 1 3 GLN HE22 H -5.039 -2.228 6.256 1.00 . A A . 3 GLN HE22 1 1 14 6857 1 1 3 GLN HG2 H -5.387 -1.682 2.288 1.00 . A A . 3 GLN HG2 1 1 14 6858 1 1 3 GLN HG3 H -3.905 -2.330 2.986 1.00 . A A . 3 GLN HG3 1 1 14 6859 1 1 3 GLN N N -5.889 0.978 1.871 1.00 . A A . 3 GLN N 1 1 14 6860 1 1 3 GLN NE2 N -4.620 -2.152 5.373 1.00 . A A . 3 GLN NE2 1 1 14 6861 1 1 3 GLN O O -3.852 2.662 1.608 1.00 . A A . 3 GLN O 1 1 14 6862 1 1 3 GLN OE1 O -6.523 -1.397 4.523 1.00 . A A . 3 GLN OE1 1 1 14 6863 1 1 4 LYS C C -1.461 3.803 3.745 1.00 . A A . 4 LYS C 1 1 14 6864 1 1 4 LYS CA C -2.947 4.086 3.748 1.00 . A A . 4 LYS CA 1 1 14 6865 1 1 4 LYS CB C -3.291 5.006 4.915 1.00 . A A . 4 LYS CB 1 1 14 6866 1 1 4 LYS CD C -5.006 6.340 6.133 1.00 . A A . 4 LYS CD 1 1 14 6867 1 1 4 LYS CE C -6.460 6.752 6.185 1.00 . A A . 4 LYS CE 1 1 14 6868 1 1 4 LYS CG C -4.743 5.422 4.962 1.00 . A A . 4 LYS CG 1 1 14 6869 1 1 4 LYS H H -3.924 2.477 4.697 1.00 . A A . 4 LYS H 1 1 14 6870 1 1 4 LYS HA H -3.213 4.587 2.830 1.00 . A A . 4 LYS HA 1 1 14 6871 1 1 4 LYS HB2 H -3.057 4.495 5.837 1.00 . A A . 4 LYS HB2 1 1 14 6872 1 1 4 LYS HB3 H -2.683 5.896 4.846 1.00 . A A . 4 LYS HB3 1 1 14 6873 1 1 4 LYS HD2 H -4.749 5.830 7.048 1.00 . A A . 4 LYS HD2 1 1 14 6874 1 1 4 LYS HD3 H -4.392 7.221 6.022 1.00 . A A . 4 LYS HD3 1 1 14 6875 1 1 4 LYS HE2 H -6.722 7.254 5.266 1.00 . A A . 4 LYS HE2 1 1 14 6876 1 1 4 LYS HE3 H -7.058 5.860 6.292 1.00 . A A . 4 LYS HE3 1 1 14 6877 1 1 4 LYS HG2 H -4.992 5.937 4.047 1.00 . A A . 4 LYS HG2 1 1 14 6878 1 1 4 LYS HG3 H -5.358 4.539 5.060 1.00 . A A . 4 LYS HG3 1 1 14 6879 1 1 4 LYS HZ1 H -7.736 7.943 7.325 1.00 . A A . 4 LYS HZ1 1 1 14 6880 1 1 4 LYS HZ2 H -6.161 8.515 7.261 1.00 . A A . 4 LYS HZ2 1 1 14 6881 1 1 4 LYS HZ3 H -6.529 7.193 8.225 1.00 . A A . 4 LYS HZ3 1 1 14 6882 1 1 4 LYS N N -3.706 2.865 3.824 1.00 . A A . 4 LYS N 1 1 14 6883 1 1 4 LYS NZ N -6.738 7.651 7.319 1.00 . A A . 4 LYS NZ 1 1 14 6884 1 1 4 LYS O O -1.037 2.686 3.994 1.00 . A A . 4 LYS O 1 1 14 6885 1 1 5 TRP C C 1.334 4.411 4.864 1.00 . A A . 5 TRP C 1 1 14 6886 1 1 5 TRP CA C 0.779 4.816 3.490 1.00 . A A . 5 TRP CA 1 1 14 6887 1 1 5 TRP CB C 1.303 6.223 3.094 1.00 . A A . 5 TRP CB 1 1 14 6888 1 1 5 TRP CD1 C 1.387 7.825 5.106 1.00 . A A . 5 TRP CD1 1 1 14 6889 1 1 5 TRP CD2 C -0.446 8.047 3.842 1.00 . A A . 5 TRP CD2 1 1 14 6890 1 1 5 TRP CE2 C -0.530 8.948 4.916 1.00 . A A . 5 TRP CE2 1 1 14 6891 1 1 5 TRP CE3 C -1.487 8.009 2.911 1.00 . A A . 5 TRP CE3 1 1 14 6892 1 1 5 TRP CG C 0.789 7.325 3.987 1.00 . A A . 5 TRP CG 1 1 14 6893 1 1 5 TRP CH2 C -2.612 9.742 4.157 1.00 . A A . 5 TRP CH2 1 1 14 6894 1 1 5 TRP CZ2 C -1.611 9.803 5.084 1.00 . A A . 5 TRP CZ2 1 1 14 6895 1 1 5 TRP CZ3 C -2.557 8.859 3.079 1.00 . A A . 5 TRP CZ3 1 1 14 6896 1 1 5 TRP H H -1.131 5.709 3.354 1.00 . A A . 5 TRP H 1 1 14 6897 1 1 5 TRP HA H 1.097 4.102 2.746 1.00 . A A . 5 TRP HA 1 1 14 6898 1 1 5 TRP HB2 H 2.380 6.233 3.164 1.00 . A A . 5 TRP HB2 1 1 14 6899 1 1 5 TRP HB3 H 1.005 6.444 2.081 1.00 . A A . 5 TRP HB3 1 1 14 6900 1 1 5 TRP HD1 H 2.342 7.488 5.487 1.00 . A A . 5 TRP HD1 1 1 14 6901 1 1 5 TRP HE1 H 0.813 9.280 6.502 1.00 . A A . 5 TRP HE1 1 1 14 6902 1 1 5 TRP HE3 H -1.468 7.338 2.064 1.00 . A A . 5 TRP HE3 1 1 14 6903 1 1 5 TRP HH2 H -3.473 10.387 4.248 1.00 . A A . 5 TRP HH2 1 1 14 6904 1 1 5 TRP HZ2 H -1.676 10.496 5.910 1.00 . A A . 5 TRP HZ2 1 1 14 6905 1 1 5 TRP HZ3 H -3.373 8.845 2.371 1.00 . A A . 5 TRP HZ3 1 1 14 6906 1 1 5 TRP N N -0.693 4.848 3.516 1.00 . A A . 5 TRP N 1 1 14 6907 1 1 5 TRP NE1 N 0.596 8.792 5.673 1.00 . A A . 5 TRP NE1 1 1 14 6908 1 1 5 TRP O O 2.429 3.870 4.987 1.00 . A A . 5 TRP O 1 1 14 6909 1 1 6 MET C C 0.651 2.917 7.531 1.00 . A A . 6 MET C 1 1 14 6910 1 1 6 MET CA C 0.882 4.392 7.256 1.00 . A A . 6 MET CA 1 1 14 6911 1 1 6 MET CB C -0.021 5.222 8.164 1.00 . A A . 6 MET CB 1 1 14 6912 1 1 6 MET CE C -0.420 5.436 12.297 1.00 . A A . 6 MET CE 1 1 14 6913 1 1 6 MET CG C 0.172 4.975 9.643 1.00 . A A . 6 MET CG 1 1 14 6914 1 1 6 MET H H -0.290 5.152 5.684 1.00 . A A . 6 MET H 1 1 14 6915 1 1 6 MET HA H 1.909 4.659 7.448 1.00 . A A . 6 MET HA 1 1 14 6916 1 1 6 MET HB2 H 0.170 6.268 7.972 1.00 . A A . 6 MET HB2 1 1 14 6917 1 1 6 MET HB3 H -1.051 5.008 7.915 1.00 . A A . 6 MET HB3 1 1 14 6918 1 1 6 MET HE1 H 0.621 5.691 12.433 1.00 . A A . 6 MET HE1 1 1 14 6919 1 1 6 MET HE2 H -0.547 4.369 12.399 1.00 . A A . 6 MET HE2 1 1 14 6920 1 1 6 MET HE3 H -1.015 5.940 13.044 1.00 . A A . 6 MET HE3 1 1 14 6921 1 1 6 MET HG2 H 0.004 3.926 9.838 1.00 . A A . 6 MET HG2 1 1 14 6922 1 1 6 MET HG3 H 1.191 5.224 9.890 1.00 . A A . 6 MET HG3 1 1 14 6923 1 1 6 MET N N 0.553 4.694 5.880 1.00 . A A . 6 MET N 1 1 14 6924 1 1 6 MET O O 1.277 2.313 8.402 1.00 . A A . 6 MET O 1 1 14 6925 1 1 6 MET SD S -0.954 5.946 10.663 1.00 . A A . 6 MET SD 1 1 14 6926 1 1 7 TRP C C 0.190 0.055 6.102 1.00 . A A . 7 TRP C 1 1 14 6927 1 1 7 TRP CA C -0.643 0.996 6.965 1.00 . A A . 7 TRP CA 1 1 14 6928 1 1 7 TRP CB C -2.148 0.835 6.636 1.00 . A A . 7 TRP CB 1 1 14 6929 1 1 7 TRP CD1 C -2.767 2.676 8.361 1.00 . A A . 7 TRP CD1 1 1 14 6930 1 1 7 TRP CD2 C -4.498 1.889 7.195 1.00 . A A . 7 TRP CD2 1 1 14 6931 1 1 7 TRP CE2 C -4.961 2.885 8.074 1.00 . A A . 7 TRP CE2 1 1 14 6932 1 1 7 TRP CE3 C -5.411 1.253 6.367 1.00 . A A . 7 TRP CE3 1 1 14 6933 1 1 7 TRP CG C -3.085 1.772 7.383 1.00 . A A . 7 TRP CG 1 1 14 6934 1 1 7 TRP CH2 C -7.168 2.610 7.308 1.00 . A A . 7 TRP CH2 1 1 14 6935 1 1 7 TRP CZ2 C -6.299 3.252 8.138 1.00 . A A . 7 TRP CZ2 1 1 14 6936 1 1 7 TRP CZ3 C -6.737 1.616 6.431 1.00 . A A . 7 TRP CZ3 1 1 14 6937 1 1 7 TRP H H -0.547 2.841 5.983 1.00 . A A . 7 TRP H 1 1 14 6938 1 1 7 TRP HA H -0.487 0.756 8.006 1.00 . A A . 7 TRP HA 1 1 14 6939 1 1 7 TRP HB2 H -2.292 1.015 5.581 1.00 . A A . 7 TRP HB2 1 1 14 6940 1 1 7 TRP HB3 H -2.445 -0.180 6.857 1.00 . A A . 7 TRP HB3 1 1 14 6941 1 1 7 TRP HD1 H -1.766 2.828 8.736 1.00 . A A . 7 TRP HD1 1 1 14 6942 1 1 7 TRP HE1 H -3.915 4.051 9.456 1.00 . A A . 7 TRP HE1 1 1 14 6943 1 1 7 TRP HE3 H -5.094 0.473 5.690 1.00 . A A . 7 TRP HE3 1 1 14 6944 1 1 7 TRP HH2 H -8.218 2.863 7.326 1.00 . A A . 7 TRP HH2 1 1 14 6945 1 1 7 TRP HZ2 H -6.656 4.018 8.812 1.00 . A A . 7 TRP HZ2 1 1 14 6946 1 1 7 TRP HZ3 H -7.460 1.131 5.790 1.00 . A A . 7 TRP HZ3 1 1 14 6947 1 1 7 TRP N N -0.216 2.347 6.761 1.00 . A A . 7 TRP N 1 1 14 6948 1 1 7 TRP NE1 N -3.886 3.351 8.767 1.00 . A A . 7 TRP NE1 1 1 14 6949 1 1 7 TRP O O 1.139 0.472 5.416 1.00 . A A . 7 TRP O 1 1 14 6950 1 1 8 THR C C -0.536 -2.977 4.628 1.00 . A A . 8 THR C 1 1 14 6951 1 1 8 THR CA C 0.539 -2.206 5.406 1.00 . A A . 8 THR CA 1 1 14 6952 1 1 8 THR CB C 1.281 -3.142 6.400 1.00 . A A . 8 THR CB 1 1 14 6953 1 1 8 THR CG2 C 2.350 -2.373 7.186 1.00 . A A . 8 THR CG2 1 1 14 6954 1 1 8 THR H H -0.900 -1.485 6.699 1.00 . A A . 8 THR H 1 1 14 6955 1 1 8 THR HA H 1.241 -1.720 4.746 1.00 . A A . 8 THR HA 1 1 14 6956 1 1 8 THR HB H 1.746 -3.955 5.860 1.00 . A A . 8 THR HB 1 1 14 6957 1 1 8 THR HG1 H 0.278 -3.006 8.060 1.00 . A A . 8 THR HG1 1 1 14 6958 1 1 8 THR HG21 H 3.076 -1.915 6.530 1.00 . A A . 8 THR HG21 1 1 14 6959 1 1 8 THR HG22 H 2.860 -3.049 7.854 1.00 . A A . 8 THR HG22 1 1 14 6960 1 1 8 THR HG23 H 1.867 -1.602 7.766 1.00 . A A . 8 THR HG23 1 1 14 6961 1 1 8 THR N N -0.142 -1.191 6.150 1.00 . A A . 8 THR N 1 1 14 6962 1 1 8 THR O O -1.745 -2.714 4.857 1.00 . A A . 8 THR O 1 1 14 6963 1 1 8 THR OG1 O 0.334 -3.654 7.348 1.00 . A A . 8 THR OG1 1 1 14 6964 1 1 9 CYS C C -1.196 -6.089 3.335 1.00 . A A . 9 CYS C 1 1 14 6965 1 1 9 CYS CA C -1.275 -4.601 3.082 1.00 . A A . 9 CYS CA 1 1 14 6966 1 1 9 CYS CB C -1.394 -4.294 1.587 1.00 . A A . 9 CYS CB 1 1 14 6967 1 1 9 CYS H H 0.742 -4.102 3.463 1.00 . A A . 9 CYS H 1 1 14 6968 1 1 9 CYS HA H -2.174 -4.254 3.572 1.00 . A A . 9 CYS HA 1 1 14 6969 1 1 9 CYS HB2 H -2.332 -4.686 1.223 1.00 . A A . 9 CYS HB2 1 1 14 6970 1 1 9 CYS HB3 H -1.391 -3.223 1.451 1.00 . A A . 9 CYS HB3 1 1 14 6971 1 1 9 CYS N N -0.186 -3.892 3.721 1.00 . A A . 9 CYS N 1 1 14 6972 1 1 9 CYS O O -0.286 -6.566 4.009 1.00 . A A . 9 CYS O 1 1 14 6973 1 1 9 CYS SG S -0.088 -4.988 0.544 1.00 . A A . 9 CYS SG 1 1 14 6974 1 1 10 ASP C C -2.832 -8.723 1.624 1.00 . A A . 10 ASP C 1 1 14 6975 1 1 10 ASP CA C -2.330 -8.207 2.971 1.00 . A A . 10 ASP CA 1 1 14 6976 1 1 10 ASP CB C -3.389 -8.419 4.091 1.00 . A A . 10 ASP CB 1 1 14 6977 1 1 10 ASP CG C -3.741 -9.854 4.397 1.00 . A A . 10 ASP CG 1 1 14 6978 1 1 10 ASP H H -2.806 -6.346 2.218 1.00 . A A . 10 ASP H 1 1 14 6979 1 1 10 ASP HA H -1.394 -8.671 3.244 1.00 . A A . 10 ASP HA 1 1 14 6980 1 1 10 ASP HB2 H -3.057 -7.958 5.005 1.00 . A A . 10 ASP HB2 1 1 14 6981 1 1 10 ASP HB3 H -4.291 -7.931 3.752 1.00 . A A . 10 ASP HB3 1 1 14 6982 1 1 10 ASP N N -2.152 -6.791 2.804 1.00 . A A . 10 ASP N 1 1 14 6983 1 1 10 ASP O O -2.751 -7.998 0.622 1.00 . A A . 10 ASP O 1 1 14 6984 1 1 10 ASP OD1 O -2.937 -10.566 5.014 1.00 . A A . 10 ASP OD1 1 1 14 6985 1 1 10 ASP OD2 O -4.844 -10.290 4.002 1.00 . A A . 10 ASP OD2 1 1 14 6986 1 1 11 SER C C -5.293 -9.846 0.211 1.00 . A A . 11 SER C 1 1 14 6987 1 1 11 SER CA C -3.894 -10.433 0.374 1.00 . A A . 11 SER CA 1 1 14 6988 1 1 11 SER CB C -3.905 -11.962 0.430 1.00 . A A . 11 SER CB 1 1 14 6989 1 1 11 SER H H -3.371 -10.469 2.380 1.00 . A A . 11 SER H 1 1 14 6990 1 1 11 SER HA H -3.279 -10.105 -0.451 1.00 . A A . 11 SER HA 1 1 14 6991 1 1 11 SER HB2 H -4.505 -12.345 -0.380 1.00 . A A . 11 SER HB2 1 1 14 6992 1 1 11 SER HB3 H -2.894 -12.333 0.337 1.00 . A A . 11 SER HB3 1 1 14 6993 1 1 11 SER HG H -5.137 -13.067 1.444 1.00 . A A . 11 SER HG 1 1 14 6994 1 1 11 SER N N -3.332 -9.914 1.572 1.00 . A A . 11 SER N 1 1 14 6995 1 1 11 SER O O -5.699 -9.464 -0.890 1.00 . A A . 11 SER O 1 1 14 6996 1 1 11 SER OG O -4.451 -12.424 1.667 1.00 . A A . 11 SER OG 1 1 14 6997 1 1 12 GLU C C -7.255 -7.617 1.435 1.00 . A A . 12 GLU C 1 1 14 6998 1 1 12 GLU CA C -7.312 -9.136 1.330 1.00 . A A . 12 GLU CA 1 1 14 6999 1 1 12 GLU CB C -8.150 -9.719 2.451 1.00 . A A . 12 GLU CB 1 1 14 7000 1 1 12 GLU CD C -9.088 -11.541 1.027 1.00 . A A . 12 GLU CD 1 1 14 7001 1 1 12 GLU CG C -8.403 -11.202 2.317 1.00 . A A . 12 GLU CG 1 1 14 7002 1 1 12 GLU H H -5.589 -10.020 2.172 1.00 . A A . 12 GLU H 1 1 14 7003 1 1 12 GLU HA H -7.772 -9.392 0.386 1.00 . A A . 12 GLU HA 1 1 14 7004 1 1 12 GLU HB2 H -7.651 -9.543 3.391 1.00 . A A . 12 GLU HB2 1 1 14 7005 1 1 12 GLU HB3 H -9.103 -9.217 2.454 1.00 . A A . 12 GLU HB3 1 1 14 7006 1 1 12 GLU HG2 H -7.459 -11.727 2.356 1.00 . A A . 12 GLU HG2 1 1 14 7007 1 1 12 GLU HG3 H -9.032 -11.524 3.134 1.00 . A A . 12 GLU HG3 1 1 14 7008 1 1 12 GLU N N -5.991 -9.706 1.327 1.00 . A A . 12 GLU N 1 1 14 7009 1 1 12 GLU O O -7.898 -6.908 0.662 1.00 . A A . 12 GLU O 1 1 14 7010 1 1 12 GLU OE1 O -10.328 -11.371 0.923 1.00 . A A . 12 GLU OE1 1 1 14 7011 1 1 12 GLU OE2 O -8.423 -12.001 0.101 1.00 . A A . 12 GLU OE2 1 1 14 7012 1 1 13 ARG C C -5.356 -5.212 1.476 1.00 . A A . 13 ARG C 1 1 14 7013 1 1 13 ARG CA C -6.332 -5.668 2.524 1.00 . A A . 13 ARG CA 1 1 14 7014 1 1 13 ARG CB C -5.768 -5.302 3.891 1.00 . A A . 13 ARG CB 1 1 14 7015 1 1 13 ARG CD C -7.865 -4.729 5.185 1.00 . A A . 13 ARG CD 1 1 14 7016 1 1 13 ARG CG C -6.642 -5.614 5.084 1.00 . A A . 13 ARG CG 1 1 14 7017 1 1 13 ARG CZ C -10.087 -4.468 4.120 1.00 . A A . 13 ARG CZ 1 1 14 7018 1 1 13 ARG H H -6.042 -7.720 3.010 1.00 . A A . 13 ARG H 1 1 14 7019 1 1 13 ARG HA H -7.287 -5.186 2.381 1.00 . A A . 13 ARG HA 1 1 14 7020 1 1 13 ARG HB2 H -4.853 -5.855 4.023 1.00 . A A . 13 ARG HB2 1 1 14 7021 1 1 13 ARG HB3 H -5.540 -4.246 3.898 1.00 . A A . 13 ARG HB3 1 1 14 7022 1 1 13 ARG HD2 H -8.236 -4.754 6.198 1.00 . A A . 13 ARG HD2 1 1 14 7023 1 1 13 ARG HD3 H -7.573 -3.720 4.940 1.00 . A A . 13 ARG HD3 1 1 14 7024 1 1 13 ARG HE H -8.777 -5.995 3.825 1.00 . A A . 13 ARG HE 1 1 14 7025 1 1 13 ARG HG2 H -7.002 -6.612 4.906 1.00 . A A . 13 ARG HG2 1 1 14 7026 1 1 13 ARG HG3 H -6.064 -5.563 5.993 1.00 . A A . 13 ARG HG3 1 1 14 7027 1 1 13 ARG HH11 H -9.584 -2.879 5.333 1.00 . A A . 13 ARG HH11 1 1 14 7028 1 1 13 ARG HH12 H -11.138 -2.787 4.643 1.00 . A A . 13 ARG HH12 1 1 14 7029 1 1 13 ARG HH21 H -10.964 -5.866 2.900 1.00 . A A . 13 ARG HH21 1 1 14 7030 1 1 13 ARG HH22 H -11.929 -4.509 3.240 1.00 . A A . 13 ARG HH22 1 1 14 7031 1 1 13 ARG N N -6.502 -7.112 2.395 1.00 . A A . 13 ARG N 1 1 14 7032 1 1 13 ARG NE N -8.938 -5.138 4.280 1.00 . A A . 13 ARG NE 1 1 14 7033 1 1 13 ARG NH1 N -10.279 -3.295 4.737 1.00 . A A . 13 ARG NH1 1 1 14 7034 1 1 13 ARG NH2 N -11.051 -4.979 3.363 1.00 . A A . 13 ARG NH2 1 1 14 7035 1 1 13 ARG O O -4.194 -5.545 1.531 1.00 . A A . 13 ARG O 1 1 14 7036 1 1 14 LYS C C -4.668 -2.538 -0.412 1.00 . A A . 14 LYS C 1 1 14 7037 1 1 14 LYS CA C -4.955 -4.022 -0.532 1.00 . A A . 14 LYS CA 1 1 14 7038 1 1 14 LYS CB C -5.495 -4.379 -1.914 1.00 . A A . 14 LYS CB 1 1 14 7039 1 1 14 LYS CD C -7.254 -4.201 -3.637 1.00 . A A . 14 LYS CD 1 1 14 7040 1 1 14 LYS CE C -8.591 -3.627 -4.026 1.00 . A A . 14 LYS CE 1 1 14 7041 1 1 14 LYS CG C -6.861 -3.817 -2.235 1.00 . A A . 14 LYS CG 1 1 14 7042 1 1 14 LYS H H -6.775 -4.273 0.560 1.00 . A A . 14 LYS H 1 1 14 7043 1 1 14 LYS HA H -4.013 -4.535 -0.396 1.00 . A A . 14 LYS HA 1 1 14 7044 1 1 14 LYS HB2 H -4.804 -4.013 -2.658 1.00 . A A . 14 LYS HB2 1 1 14 7045 1 1 14 LYS HB3 H -5.547 -5.455 -1.992 1.00 . A A . 14 LYS HB3 1 1 14 7046 1 1 14 LYS HD2 H -6.505 -3.824 -4.316 1.00 . A A . 14 LYS HD2 1 1 14 7047 1 1 14 LYS HD3 H -7.295 -5.279 -3.708 1.00 . A A . 14 LYS HD3 1 1 14 7048 1 1 14 LYS HE2 H -9.350 -4.019 -3.366 1.00 . A A . 14 LYS HE2 1 1 14 7049 1 1 14 LYS HE3 H -8.543 -2.553 -3.929 1.00 . A A . 14 LYS HE3 1 1 14 7050 1 1 14 LYS HG2 H -7.583 -4.215 -1.538 1.00 . A A . 14 LYS HG2 1 1 14 7051 1 1 14 LYS HG3 H -6.832 -2.739 -2.158 1.00 . A A . 14 LYS HG3 1 1 14 7052 1 1 14 LYS HZ1 H -8.185 -3.630 -6.052 1.00 . A A . 14 LYS HZ1 1 1 14 7053 1 1 14 LYS HZ2 H -9.824 -3.516 -5.697 1.00 . A A . 14 LYS HZ2 1 1 14 7054 1 1 14 LYS HZ3 H -9.034 -4.995 -5.539 1.00 . A A . 14 LYS HZ3 1 1 14 7055 1 1 14 LYS N N -5.822 -4.497 0.526 1.00 . A A . 14 LYS N 1 1 14 7056 1 1 14 LYS NZ N -8.932 -3.968 -5.413 1.00 . A A . 14 LYS NZ 1 1 14 7057 1 1 14 LYS O O -5.507 -1.769 0.087 1.00 . A A . 14 LYS O 1 1 14 7058 1 1 15 CYS C C -3.906 0.034 -1.885 1.00 . A A . 15 CYS C 1 1 14 7059 1 1 15 CYS CA C -3.101 -0.736 -0.849 1.00 . A A . 15 CYS CA 1 1 14 7060 1 1 15 CYS CB C -1.607 -0.588 -1.114 1.00 . A A . 15 CYS CB 1 1 14 7061 1 1 15 CYS H H -2.866 -2.796 -1.218 1.00 . A A . 15 CYS H 1 1 14 7062 1 1 15 CYS HA H -3.335 -0.330 0.121 1.00 . A A . 15 CYS HA 1 1 14 7063 1 1 15 CYS HB2 H -1.388 -0.941 -2.111 1.00 . A A . 15 CYS HB2 1 1 14 7064 1 1 15 CYS HB3 H -1.341 0.456 -1.041 1.00 . A A . 15 CYS HB3 1 1 14 7065 1 1 15 CYS N N -3.493 -2.137 -0.862 1.00 . A A . 15 CYS N 1 1 14 7066 1 1 15 CYS O O -4.460 -0.565 -2.821 1.00 . A A . 15 CYS O 1 1 14 7067 1 1 15 CYS SG S -0.542 -1.513 0.042 1.00 . A A . 15 CYS SG 1 1 14 7068 1 1 16 CYS C C -4.131 2.324 -3.978 1.00 . A A . 16 CYS C 1 1 14 7069 1 1 16 CYS CA C -4.776 2.172 -2.593 1.00 . A A . 16 CYS CA 1 1 14 7070 1 1 16 CYS CB C -4.963 3.548 -1.958 1.00 . A A . 16 CYS CB 1 1 14 7071 1 1 16 CYS H H -3.443 1.777 -1.023 1.00 . A A . 16 CYS H 1 1 14 7072 1 1 16 CYS HA H -5.744 1.707 -2.701 1.00 . A A . 16 CYS HA 1 1 14 7073 1 1 16 CYS HB2 H -4.931 3.467 -0.884 1.00 . A A . 16 CYS HB2 1 1 14 7074 1 1 16 CYS HB3 H -4.132 4.165 -2.265 1.00 . A A . 16 CYS HB3 1 1 14 7075 1 1 16 CYS N N -3.963 1.338 -1.730 1.00 . A A . 16 CYS N 1 1 14 7076 1 1 16 CYS O O -3.009 1.846 -4.220 1.00 . A A . 16 CYS O 1 1 14 7077 1 1 16 CYS SG S -6.498 4.403 -2.475 1.00 . A A . 16 CYS SG 1 1 14 7078 1 1 17 LYS C C -3.203 4.199 -6.169 1.00 . A A . 17 LYS C 1 1 14 7079 1 1 17 LYS CA C -4.372 3.221 -6.212 1.00 . A A . 17 LYS CA 1 1 14 7080 1 1 17 LYS CB C -5.514 3.775 -7.064 1.00 . A A . 17 LYS CB 1 1 14 7081 1 1 17 LYS CD C -6.372 4.444 -9.310 1.00 . A A . 17 LYS CD 1 1 14 7082 1 1 17 LYS CE C -6.044 4.593 -10.779 1.00 . A A . 17 LYS CE 1 1 14 7083 1 1 17 LYS CG C -5.165 3.977 -8.523 1.00 . A A . 17 LYS CG 1 1 14 7084 1 1 17 LYS H H -5.728 3.312 -4.618 1.00 . A A . 17 LYS H 1 1 14 7085 1 1 17 LYS HA H -4.040 2.283 -6.632 1.00 . A A . 17 LYS HA 1 1 14 7086 1 1 17 LYS HB2 H -6.352 3.096 -7.007 1.00 . A A . 17 LYS HB2 1 1 14 7087 1 1 17 LYS HB3 H -5.815 4.727 -6.653 1.00 . A A . 17 LYS HB3 1 1 14 7088 1 1 17 LYS HD2 H -7.166 3.721 -9.202 1.00 . A A . 17 LYS HD2 1 1 14 7089 1 1 17 LYS HD3 H -6.697 5.399 -8.922 1.00 . A A . 17 LYS HD3 1 1 14 7090 1 1 17 LYS HE2 H -5.647 3.656 -11.137 1.00 . A A . 17 LYS HE2 1 1 14 7091 1 1 17 LYS HE3 H -6.952 4.822 -11.315 1.00 . A A . 17 LYS HE3 1 1 14 7092 1 1 17 LYS HG2 H -4.385 4.720 -8.598 1.00 . A A . 17 LYS HG2 1 1 14 7093 1 1 17 LYS HG3 H -4.815 3.042 -8.933 1.00 . A A . 17 LYS HG3 1 1 14 7094 1 1 17 LYS HZ1 H -5.443 6.585 -10.773 1.00 . A A . 17 LYS HZ1 1 1 14 7095 1 1 17 LYS HZ2 H -4.801 5.673 -12.043 1.00 . A A . 17 LYS HZ2 1 1 14 7096 1 1 17 LYS HZ3 H -4.177 5.503 -10.487 1.00 . A A . 17 LYS HZ3 1 1 14 7097 1 1 17 LYS N N -4.843 2.976 -4.873 1.00 . A A . 17 LYS N 1 1 14 7098 1 1 17 LYS NZ N -5.048 5.658 -11.034 1.00 . A A . 17 LYS NZ 1 1 14 7099 1 1 17 LYS O O -3.305 5.277 -5.577 1.00 . A A . 17 LYS O 1 1 14 7100 1 1 18 GLY C C 0.013 4.185 -5.644 1.00 . A A . 18 GLY C 1 1 14 7101 1 1 18 GLY CA C -0.910 4.624 -6.751 1.00 . A A . 18 GLY CA 1 1 14 7102 1 1 18 GLY H H -2.089 2.942 -7.226 1.00 . A A . 18 GLY H 1 1 14 7103 1 1 18 GLY HA2 H -0.405 4.522 -7.702 1.00 . A A . 18 GLY HA2 1 1 14 7104 1 1 18 GLY HA3 H -1.177 5.658 -6.600 1.00 . A A . 18 GLY HA3 1 1 14 7105 1 1 18 GLY N N -2.105 3.809 -6.766 1.00 . A A . 18 GLY N 1 1 14 7106 1 1 18 GLY O O 0.978 4.870 -5.292 1.00 . A A . 18 GLY O 1 1 14 7107 1 1 19 MET C C 0.880 1.081 -4.446 1.00 . A A . 19 MET C 1 1 14 7108 1 1 19 MET CA C 0.477 2.461 -4.030 1.00 . A A . 19 MET CA 1 1 14 7109 1 1 19 MET CB C -0.292 2.371 -2.707 1.00 . A A . 19 MET CB 1 1 14 7110 1 1 19 MET CE C -1.812 5.207 -0.084 1.00 . A A . 19 MET CE 1 1 14 7111 1 1 19 MET CG C -0.624 3.693 -2.065 1.00 . A A . 19 MET CG 1 1 14 7112 1 1 19 MET H H -1.141 2.606 -5.345 1.00 . A A . 19 MET H 1 1 14 7113 1 1 19 MET HA H 1.362 3.059 -3.880 1.00 . A A . 19 MET HA 1 1 14 7114 1 1 19 MET HB2 H -1.220 1.851 -2.887 1.00 . A A . 19 MET HB2 1 1 14 7115 1 1 19 MET HB3 H 0.298 1.793 -2.011 1.00 . A A . 19 MET HB3 1 1 14 7116 1 1 19 MET HE1 H -2.315 5.750 -0.871 1.00 . A A . 19 MET HE1 1 1 14 7117 1 1 19 MET HE2 H -0.842 5.648 0.094 1.00 . A A . 19 MET HE2 1 1 14 7118 1 1 19 MET HE3 H -2.401 5.257 0.819 1.00 . A A . 19 MET HE3 1 1 14 7119 1 1 19 MET HG2 H 0.312 4.155 -1.787 1.00 . A A . 19 MET HG2 1 1 14 7120 1 1 19 MET HG3 H -1.156 4.317 -2.769 1.00 . A A . 19 MET HG3 1 1 14 7121 1 1 19 MET N N -0.316 3.059 -5.063 1.00 . A A . 19 MET N 1 1 14 7122 1 1 19 MET O O 0.230 0.462 -5.305 1.00 . A A . 19 MET O 1 1 14 7123 1 1 19 MET SD S -1.612 3.495 -0.574 1.00 . A A . 19 MET SD 1 1 14 7124 1 1 20 VAL C C 2.021 -1.572 -2.871 1.00 . A A . 20 VAL C 1 1 14 7125 1 1 20 VAL CA C 2.406 -0.728 -4.067 1.00 . A A . 20 VAL CA 1 1 14 7126 1 1 20 VAL CB C 3.959 -0.722 -4.205 1.00 . A A . 20 VAL CB 1 1 14 7127 1 1 20 VAL CG1 C 4.506 -2.126 -4.438 1.00 . A A . 20 VAL CG1 1 1 14 7128 1 1 20 VAL CG2 C 4.404 0.214 -5.323 1.00 . A A . 20 VAL CG2 1 1 14 7129 1 1 20 VAL H H 2.387 1.170 -3.191 1.00 . A A . 20 VAL H 1 1 14 7130 1 1 20 VAL HA H 1.965 -1.124 -4.970 1.00 . A A . 20 VAL HA 1 1 14 7131 1 1 20 VAL HB H 4.372 -0.357 -3.276 1.00 . A A . 20 VAL HB 1 1 14 7132 1 1 20 VAL HG11 H 4.104 -2.523 -5.357 1.00 . A A . 20 VAL HG11 1 1 14 7133 1 1 20 VAL HG12 H 4.217 -2.764 -3.617 1.00 . A A . 20 VAL HG12 1 1 14 7134 1 1 20 VAL HG13 H 5.584 -2.088 -4.502 1.00 . A A . 20 VAL HG13 1 1 14 7135 1 1 20 VAL HG21 H 5.483 0.202 -5.398 1.00 . A A . 20 VAL HG21 1 1 14 7136 1 1 20 VAL HG22 H 4.068 1.217 -5.109 1.00 . A A . 20 VAL HG22 1 1 14 7137 1 1 20 VAL HG23 H 3.976 -0.117 -6.258 1.00 . A A . 20 VAL HG23 1 1 14 7138 1 1 20 VAL N N 1.909 0.595 -3.834 1.00 . A A . 20 VAL N 1 1 14 7139 1 1 20 VAL O O 2.315 -1.191 -1.718 1.00 . A A . 20 VAL O 1 1 14 7140 1 1 21 CYS C C 2.116 -4.385 -1.693 1.00 . A A . 21 CYS C 1 1 14 7141 1 1 21 CYS CA C 0.912 -3.573 -2.073 1.00 . A A . 21 CYS CA 1 1 14 7142 1 1 21 CYS CB C -0.256 -4.474 -2.517 1.00 . A A . 21 CYS CB 1 1 14 7143 1 1 21 CYS H H 1.069 -2.879 -4.052 1.00 . A A . 21 CYS H 1 1 14 7144 1 1 21 CYS HA H 0.615 -2.977 -1.223 1.00 . A A . 21 CYS HA 1 1 14 7145 1 1 21 CYS HB2 H -1.034 -3.856 -2.941 1.00 . A A . 21 CYS HB2 1 1 14 7146 1 1 21 CYS HB3 H 0.107 -5.149 -3.277 1.00 . A A . 21 CYS HB3 1 1 14 7147 1 1 21 CYS N N 1.313 -2.665 -3.125 1.00 . A A . 21 CYS N 1 1 14 7148 1 1 21 CYS O O 2.580 -5.257 -2.449 1.00 . A A . 21 CYS O 1 1 14 7149 1 1 21 CYS SG S -1.036 -5.496 -1.189 1.00 . A A . 21 CYS SG 1 1 14 7150 1 1 22 ARG C C 3.722 -4.884 1.420 1.00 . A A . 22 ARG C 1 1 14 7151 1 1 22 ARG CA C 3.840 -4.645 -0.100 1.00 . A A . 22 ARG CA 1 1 14 7152 1 1 22 ARG CB C 4.931 -3.620 -0.454 1.00 . A A . 22 ARG CB 1 1 14 7153 1 1 22 ARG CD C 7.242 -3.097 -1.097 1.00 . A A . 22 ARG CD 1 1 14 7154 1 1 22 ARG CG C 6.349 -4.120 -0.449 1.00 . A A . 22 ARG CG 1 1 14 7155 1 1 22 ARG CZ C 9.592 -2.947 -1.892 1.00 . A A . 22 ARG CZ 1 1 14 7156 1 1 22 ARG H H 2.174 -3.454 0.049 1.00 . A A . 22 ARG H 1 1 14 7157 1 1 22 ARG HA H 4.042 -5.557 -0.637 1.00 . A A . 22 ARG HA 1 1 14 7158 1 1 22 ARG HB2 H 4.724 -3.238 -1.442 1.00 . A A . 22 ARG HB2 1 1 14 7159 1 1 22 ARG HB3 H 4.855 -2.800 0.245 1.00 . A A . 22 ARG HB3 1 1 14 7160 1 1 22 ARG HD2 H 6.876 -2.936 -2.101 1.00 . A A . 22 ARG HD2 1 1 14 7161 1 1 22 ARG HD3 H 7.159 -2.182 -0.531 1.00 . A A . 22 ARG HD3 1 1 14 7162 1 1 22 ARG HE H 8.876 -4.286 -0.579 1.00 . A A . 22 ARG HE 1 1 14 7163 1 1 22 ARG HG2 H 6.672 -4.276 0.570 1.00 . A A . 22 ARG HG2 1 1 14 7164 1 1 22 ARG HG3 H 6.400 -5.044 -1.003 1.00 . A A . 22 ARG HG3 1 1 14 7165 1 1 22 ARG HH11 H 8.365 -1.632 -2.892 1.00 . A A . 22 ARG HH11 1 1 14 7166 1 1 22 ARG HH12 H 10.011 -1.527 -3.297 1.00 . A A . 22 ARG HH12 1 1 14 7167 1 1 22 ARG HH21 H 11.079 -4.146 -1.189 1.00 . A A . 22 ARG HH21 1 1 14 7168 1 1 22 ARG HH22 H 11.591 -2.985 -2.326 1.00 . A A . 22 ARG HH22 1 1 14 7169 1 1 22 ARG N N 2.637 -4.084 -0.547 1.00 . A A . 22 ARG N 1 1 14 7170 1 1 22 ARG NE N 8.637 -3.522 -1.153 1.00 . A A . 22 ARG NE 1 1 14 7171 1 1 22 ARG NH1 N 9.296 -1.971 -2.751 1.00 . A A . 22 ARG NH1 1 1 14 7172 1 1 22 ARG NH2 N 10.835 -3.386 -1.800 1.00 . A A . 22 ARG NH2 1 1 14 7173 1 1 22 ARG O O 2.594 -4.738 2.015 1.00 . A A . 22 ARG O 1 1 14 7174 1 1 23 LEU C C 4.466 -4.220 4.272 1.00 . A A . 23 LEU C 1 1 14 7175 1 1 23 LEU CA C 4.962 -5.446 3.507 1.00 . A A . 23 LEU CA 1 1 14 7176 1 1 23 LEU CB C 6.415 -5.795 3.942 1.00 . A A . 23 LEU CB 1 1 14 7177 1 1 23 LEU CD1 C 6.134 -8.312 3.720 1.00 . A A . 23 LEU CD1 1 1 14 7178 1 1 23 LEU CD2 C 7.426 -7.067 1.963 1.00 . A A . 23 LEU CD2 1 1 14 7179 1 1 23 LEU CG C 7.037 -7.126 3.436 1.00 . A A . 23 LEU CG 1 1 14 7180 1 1 23 LEU H H 5.661 -5.371 1.514 1.00 . A A . 23 LEU H 1 1 14 7181 1 1 23 LEU HA H 4.316 -6.277 3.745 1.00 . A A . 23 LEU HA 1 1 14 7182 1 1 23 LEU HB2 H 7.057 -4.997 3.601 1.00 . A A . 23 LEU HB2 1 1 14 7183 1 1 23 LEU HB3 H 6.439 -5.802 5.022 1.00 . A A . 23 LEU HB3 1 1 14 7184 1 1 23 LEU HD11 H 5.948 -8.386 4.781 1.00 . A A . 23 LEU HD11 1 1 14 7185 1 1 23 LEU HD12 H 6.616 -9.217 3.378 1.00 . A A . 23 LEU HD12 1 1 14 7186 1 1 23 LEU HD13 H 5.197 -8.188 3.198 1.00 . A A . 23 LEU HD13 1 1 14 7187 1 1 23 LEU HD21 H 8.123 -6.258 1.810 1.00 . A A . 23 LEU HD21 1 1 14 7188 1 1 23 LEU HD22 H 6.546 -6.914 1.358 1.00 . A A . 23 LEU HD22 1 1 14 7189 1 1 23 LEU HD23 H 7.893 -7.999 1.682 1.00 . A A . 23 LEU HD23 1 1 14 7190 1 1 23 LEU HG H 7.935 -7.295 4.015 1.00 . A A . 23 LEU HG 1 1 14 7191 1 1 23 LEU N N 4.859 -5.229 2.055 1.00 . A A . 23 LEU N 1 1 14 7192 1 1 23 LEU O O 4.200 -4.284 5.469 1.00 . A A . 23 LEU O 1 1 14 7193 1 1 24 TRP C C 3.218 -1.244 2.778 1.00 . A A . 24 TRP C 1 1 14 7194 1 1 24 TRP CA C 3.805 -1.909 4.021 1.00 . A A . 24 TRP CA 1 1 14 7195 1 1 24 TRP CB C 4.816 -0.993 4.738 1.00 . A A . 24 TRP CB 1 1 14 7196 1 1 24 TRP CD1 C 5.739 0.966 3.432 1.00 . A A . 24 TRP CD1 1 1 14 7197 1 1 24 TRP CD2 C 6.978 -0.880 3.241 1.00 . A A . 24 TRP CD2 1 1 14 7198 1 1 24 TRP CE2 C 7.584 0.136 2.481 1.00 . A A . 24 TRP CE2 1 1 14 7199 1 1 24 TRP CE3 C 7.574 -2.140 3.276 1.00 . A A . 24 TRP CE3 1 1 14 7200 1 1 24 TRP CG C 5.804 -0.316 3.841 1.00 . A A . 24 TRP CG 1 1 14 7201 1 1 24 TRP CH2 C 9.311 -1.321 1.814 1.00 . A A . 24 TRP CH2 1 1 14 7202 1 1 24 TRP CZ2 C 8.755 -0.074 1.760 1.00 . A A . 24 TRP CZ2 1 1 14 7203 1 1 24 TRP CZ3 C 8.734 -2.348 2.561 1.00 . A A . 24 TRP CZ3 1 1 14 7204 1 1 24 TRP H H 4.754 -3.093 2.653 1.00 . A A . 24 TRP H 1 1 14 7205 1 1 24 TRP HA H 3.015 -2.208 4.689 1.00 . A A . 24 TRP HA 1 1 14 7206 1 1 24 TRP HB2 H 4.271 -0.219 5.254 1.00 . A A . 24 TRP HB2 1 1 14 7207 1 1 24 TRP HB3 H 5.365 -1.579 5.462 1.00 . A A . 24 TRP HB3 1 1 14 7208 1 1 24 TRP HD1 H 4.927 1.607 3.751 1.00 . A A . 24 TRP HD1 1 1 14 7209 1 1 24 TRP HE1 H 6.996 2.135 2.198 1.00 . A A . 24 TRP HE1 1 1 14 7210 1 1 24 TRP HE3 H 7.136 -2.938 3.854 1.00 . A A . 24 TRP HE3 1 1 14 7211 1 1 24 TRP HH2 H 10.220 -1.531 1.268 1.00 . A A . 24 TRP HH2 1 1 14 7212 1 1 24 TRP HZ2 H 9.221 0.705 1.176 1.00 . A A . 24 TRP HZ2 1 1 14 7213 1 1 24 TRP HZ3 H 9.207 -3.318 2.575 1.00 . A A . 24 TRP HZ3 1 1 14 7214 1 1 24 TRP N N 4.404 -3.110 3.568 1.00 . A A . 24 TRP N 1 1 14 7215 1 1 24 TRP NE1 N 6.814 1.263 2.618 1.00 . A A . 24 TRP NE1 1 1 14 7216 1 1 24 TRP O O 3.648 -1.577 1.664 1.00 . A A . 24 TRP O 1 1 14 7217 1 1 25 CYS C C 2.545 1.454 1.371 1.00 . A A . 25 CYS C 1 1 14 7218 1 1 25 CYS CA C 1.701 0.287 1.761 1.00 . A A . 25 CYS CA 1 1 14 7219 1 1 25 CYS CB C 0.248 0.690 1.945 1.00 . A A . 25 CYS CB 1 1 14 7220 1 1 25 CYS H H 1.905 -0.130 3.809 1.00 . A A . 25 CYS H 1 1 14 7221 1 1 25 CYS HA H 1.761 -0.430 0.954 1.00 . A A . 25 CYS HA 1 1 14 7222 1 1 25 CYS HB2 H 0.131 1.165 2.907 1.00 . A A . 25 CYS HB2 1 1 14 7223 1 1 25 CYS HB3 H -0.030 1.387 1.168 1.00 . A A . 25 CYS HB3 1 1 14 7224 1 1 25 CYS N N 2.251 -0.376 2.922 1.00 . A A . 25 CYS N 1 1 14 7225 1 1 25 CYS O O 2.669 2.441 2.114 1.00 . A A . 25 CYS O 1 1 14 7226 1 1 25 CYS SG S -0.903 -0.710 1.874 1.00 . A A . 25 CYS SG 1 1 14 7227 1 1 26 LYS C C 3.421 3.119 -1.366 1.00 . A A . 26 LYS C 1 1 14 7228 1 1 26 LYS CA C 4.015 2.373 -0.214 1.00 . A A . 26 LYS CA 1 1 14 7229 1 1 26 LYS CB C 5.390 1.811 -0.573 1.00 . A A . 26 LYS CB 1 1 14 7230 1 1 26 LYS CD C 7.768 2.356 -1.173 1.00 . A A . 26 LYS CD 1 1 14 7231 1 1 26 LYS CE C 8.717 3.483 -1.527 1.00 . A A . 26 LYS CE 1 1 14 7232 1 1 26 LYS CG C 6.366 2.886 -1.001 1.00 . A A . 26 LYS CG 1 1 14 7233 1 1 26 LYS H H 2.970 0.576 -0.351 1.00 . A A . 26 LYS H 1 1 14 7234 1 1 26 LYS HA H 4.139 3.054 0.613 1.00 . A A . 26 LYS HA 1 1 14 7235 1 1 26 LYS HB2 H 5.797 1.300 0.286 1.00 . A A . 26 LYS HB2 1 1 14 7236 1 1 26 LYS HB3 H 5.281 1.109 -1.387 1.00 . A A . 26 LYS HB3 1 1 14 7237 1 1 26 LYS HD2 H 8.088 1.900 -0.247 1.00 . A A . 26 LYS HD2 1 1 14 7238 1 1 26 LYS HD3 H 7.778 1.623 -1.965 1.00 . A A . 26 LYS HD3 1 1 14 7239 1 1 26 LYS HE2 H 8.435 3.888 -2.488 1.00 . A A . 26 LYS HE2 1 1 14 7240 1 1 26 LYS HE3 H 8.627 4.252 -0.777 1.00 . A A . 26 LYS HE3 1 1 14 7241 1 1 26 LYS HG2 H 6.033 3.298 -1.943 1.00 . A A . 26 LYS HG2 1 1 14 7242 1 1 26 LYS HG3 H 6.360 3.664 -0.254 1.00 . A A . 26 LYS HG3 1 1 14 7243 1 1 26 LYS HZ1 H 10.426 2.646 -0.681 1.00 . A A . 26 LYS HZ1 1 1 14 7244 1 1 26 LYS HZ2 H 10.749 3.805 -1.854 1.00 . A A . 26 LYS HZ2 1 1 14 7245 1 1 26 LYS HZ3 H 10.212 2.273 -2.298 1.00 . A A . 26 LYS HZ3 1 1 14 7246 1 1 26 LYS N N 3.143 1.353 0.224 1.00 . A A . 26 LYS N 1 1 14 7247 1 1 26 LYS NZ N 10.109 3.032 -1.593 1.00 . A A . 26 LYS NZ 1 1 14 7248 1 1 26 LYS O O 3.129 2.529 -2.397 1.00 . A A . 26 LYS O 1 1 14 7249 1 1 27 LYS C C 3.908 5.632 -3.106 1.00 . A A . 27 LYS C 1 1 14 7250 1 1 27 LYS CA C 2.727 5.231 -2.253 1.00 . A A . 27 LYS CA 1 1 14 7251 1 1 27 LYS CB C 1.945 6.457 -1.738 1.00 . A A . 27 LYS CB 1 1 14 7252 1 1 27 LYS CD C 1.856 8.505 -0.294 1.00 . A A . 27 LYS CD 1 1 14 7253 1 1 27 LYS CE C 2.543 9.302 0.814 1.00 . A A . 27 LYS CE 1 1 14 7254 1 1 27 LYS CG C 2.680 7.302 -0.720 1.00 . A A . 27 LYS CG 1 1 14 7255 1 1 27 LYS H H 3.381 4.779 -0.295 1.00 . A A . 27 LYS H 1 1 14 7256 1 1 27 LYS HA H 2.080 4.622 -2.866 1.00 . A A . 27 LYS HA 1 1 14 7257 1 1 27 LYS HB2 H 1.707 7.089 -2.580 1.00 . A A . 27 LYS HB2 1 1 14 7258 1 1 27 LYS HB3 H 1.020 6.119 -1.293 1.00 . A A . 27 LYS HB3 1 1 14 7259 1 1 27 LYS HD2 H 1.711 9.147 -1.149 1.00 . A A . 27 LYS HD2 1 1 14 7260 1 1 27 LYS HD3 H 0.898 8.160 0.063 1.00 . A A . 27 LYS HD3 1 1 14 7261 1 1 27 LYS HE2 H 1.919 10.144 1.077 1.00 . A A . 27 LYS HE2 1 1 14 7262 1 1 27 LYS HE3 H 2.654 8.661 1.677 1.00 . A A . 27 LYS HE3 1 1 14 7263 1 1 27 LYS HG2 H 2.884 6.695 0.150 1.00 . A A . 27 LYS HG2 1 1 14 7264 1 1 27 LYS HG3 H 3.609 7.643 -1.153 1.00 . A A . 27 LYS HG3 1 1 14 7265 1 1 27 LYS HZ1 H 3.835 10.464 -0.392 1.00 . A A . 27 LYS HZ1 1 1 14 7266 1 1 27 LYS HZ2 H 4.501 9.027 0.132 1.00 . A A . 27 LYS HZ2 1 1 14 7267 1 1 27 LYS HZ3 H 4.342 10.296 1.205 1.00 . A A . 27 LYS HZ3 1 1 14 7268 1 1 27 LYS N N 3.197 4.394 -1.177 1.00 . A A . 27 LYS N 1 1 14 7269 1 1 27 LYS NZ N 3.877 9.809 0.415 1.00 . A A . 27 LYS NZ 1 1 14 7270 1 1 27 LYS O O 5.048 5.657 -2.615 1.00 . A A . 27 LYS O 1 1 14 7271 1 1 28 LYS C C 5.560 7.425 -4.881 1.00 . A A . 28 LYS C 1 1 14 7272 1 1 28 LYS CA C 4.693 6.236 -5.325 1.00 . A A . 28 LYS CA 1 1 14 7273 1 1 28 LYS CB C 4.121 6.493 -6.735 1.00 . A A . 28 LYS CB 1 1 14 7274 1 1 28 LYS CD C 1.971 7.802 -6.209 1.00 . A A . 28 LYS CD 1 1 14 7275 1 1 28 LYS CE C 1.161 9.037 -6.587 1.00 . A A . 28 LYS CE 1 1 14 7276 1 1 28 LYS CG C 3.307 7.786 -6.929 1.00 . A A . 28 LYS CG 1 1 14 7277 1 1 28 LYS H H 2.718 5.851 -4.670 1.00 . A A . 28 LYS H 1 1 14 7278 1 1 28 LYS HA H 5.335 5.371 -5.379 1.00 . A A . 28 LYS HA 1 1 14 7279 1 1 28 LYS HB2 H 4.945 6.524 -7.433 1.00 . A A . 28 LYS HB2 1 1 14 7280 1 1 28 LYS HB3 H 3.488 5.657 -6.996 1.00 . A A . 28 LYS HB3 1 1 14 7281 1 1 28 LYS HD2 H 1.415 6.916 -6.479 1.00 . A A . 28 LYS HD2 1 1 14 7282 1 1 28 LYS HD3 H 2.149 7.809 -5.144 1.00 . A A . 28 LYS HD3 1 1 14 7283 1 1 28 LYS HE2 H 1.028 9.037 -7.659 1.00 . A A . 28 LYS HE2 1 1 14 7284 1 1 28 LYS HE3 H 0.197 8.974 -6.107 1.00 . A A . 28 LYS HE3 1 1 14 7285 1 1 28 LYS HG2 H 3.894 8.608 -6.547 1.00 . A A . 28 LYS HG2 1 1 14 7286 1 1 28 LYS HG3 H 3.145 7.948 -7.984 1.00 . A A . 28 LYS HG3 1 1 14 7287 1 1 28 LYS HZ1 H 1.220 11.101 -6.496 1.00 . A A . 28 LYS HZ1 1 1 14 7288 1 1 28 LYS HZ2 H 2.759 10.434 -6.641 1.00 . A A . 28 LYS HZ2 1 1 14 7289 1 1 28 LYS HZ3 H 1.921 10.359 -5.160 1.00 . A A . 28 LYS HZ3 1 1 14 7290 1 1 28 LYS N N 3.650 5.903 -4.364 1.00 . A A . 28 LYS N 1 1 14 7291 1 1 28 LYS NZ N 1.821 10.308 -6.195 1.00 . A A . 28 LYS NZ 1 1 14 7292 1 1 28 LYS O O 5.103 8.328 -4.162 1.00 . A A . 28 LYS O 1 1 14 7293 1 1 29 LEU C C 7.571 9.648 -5.955 1.00 . A A . 29 LEU C 1 1 14 7294 1 1 29 LEU CA C 7.754 8.468 -5.008 1.00 . A A . 29 LEU CA 1 1 14 7295 1 1 29 LEU CB C 9.183 7.922 -5.124 1.00 . A A . 29 LEU CB 1 1 14 7296 1 1 29 LEU CD1 C 10.930 6.232 -4.503 1.00 . A A . 29 LEU CD1 1 1 14 7297 1 1 29 LEU CD2 C 9.522 7.257 -2.729 1.00 . A A . 29 LEU CD2 1 1 14 7298 1 1 29 LEU CG C 9.553 6.778 -4.170 1.00 . A A . 29 LEU CG 1 1 14 7299 1 1 29 LEU H H 7.103 6.662 -5.864 1.00 . A A . 29 LEU H 1 1 14 7300 1 1 29 LEU HA H 7.586 8.798 -3.994 1.00 . A A . 29 LEU HA 1 1 14 7301 1 1 29 LEU HB2 H 9.326 7.574 -6.136 1.00 . A A . 29 LEU HB2 1 1 14 7302 1 1 29 LEU HB3 H 9.867 8.740 -4.948 1.00 . A A . 29 LEU HB3 1 1 14 7303 1 1 29 LEU HD11 H 11.169 5.428 -3.824 1.00 . A A . 29 LEU HD11 1 1 14 7304 1 1 29 LEU HD12 H 11.663 7.018 -4.405 1.00 . A A . 29 LEU HD12 1 1 14 7305 1 1 29 LEU HD13 H 10.933 5.858 -5.516 1.00 . A A . 29 LEU HD13 1 1 14 7306 1 1 29 LEU HD21 H 8.533 7.619 -2.489 1.00 . A A . 29 LEU HD21 1 1 14 7307 1 1 29 LEU HD22 H 10.237 8.054 -2.596 1.00 . A A . 29 LEU HD22 1 1 14 7308 1 1 29 LEU HD23 H 9.774 6.436 -2.073 1.00 . A A . 29 LEU HD23 1 1 14 7309 1 1 29 LEU HG H 8.836 5.978 -4.278 1.00 . A A . 29 LEU HG 1 1 14 7310 1 1 29 LEU N N 6.796 7.416 -5.315 1.00 . A A . 29 LEU N 1 1 14 7311 1 1 29 LEU O O 8.219 10.695 -5.808 1.00 . A A . 29 LEU O 1 1 14 7312 1 1 30 TRP C C 4.931 10.508 -8.151 1.00 . A A . 30 TRP C 1 1 14 7313 1 1 30 TRP CA C 6.434 10.507 -7.875 1.00 . A A . 30 TRP CA 1 1 14 7314 1 1 30 TRP CB C 7.220 10.209 -9.151 1.00 . A A . 30 TRP CB 1 1 14 7315 1 1 30 TRP CD1 C 6.476 11.955 -10.861 1.00 . A A . 30 TRP CD1 1 1 14 7316 1 1 30 TRP CD2 C 8.622 12.097 -10.268 1.00 . A A . 30 TRP CD2 1 1 14 7317 1 1 30 TRP CE2 C 8.357 13.100 -11.210 1.00 . A A . 30 TRP CE2 1 1 14 7318 1 1 30 TRP CE3 C 9.912 11.986 -9.747 1.00 . A A . 30 TRP CE3 1 1 14 7319 1 1 30 TRP CG C 7.404 11.378 -10.057 1.00 . A A . 30 TRP CG 1 1 14 7320 1 1 30 TRP CH2 C 10.584 13.858 -11.118 1.00 . A A . 30 TRP CH2 1 1 14 7321 1 1 30 TRP CZ2 C 9.329 13.987 -11.644 1.00 . A A . 30 TRP CZ2 1 1 14 7322 1 1 30 TRP CZ3 C 10.882 12.868 -10.178 1.00 . A A . 30 TRP CZ3 1 1 14 7323 1 1 30 TRP H H 6.206 8.641 -6.986 1.00 . A A . 30 TRP H 1 1 14 7324 1 1 30 TRP HA H 6.739 11.460 -7.470 1.00 . A A . 30 TRP HA 1 1 14 7325 1 1 30 TRP HB2 H 8.202 9.853 -8.878 1.00 . A A . 30 TRP HB2 1 1 14 7326 1 1 30 TRP HB3 H 6.708 9.434 -9.702 1.00 . A A . 30 TRP HB3 1 1 14 7327 1 1 30 TRP HD1 H 5.449 11.631 -10.929 1.00 . A A . 30 TRP HD1 1 1 14 7328 1 1 30 TRP HE1 H 6.562 13.558 -12.203 1.00 . A A . 30 TRP HE1 1 1 14 7329 1 1 30 TRP HE3 H 10.155 11.224 -9.021 1.00 . A A . 30 TRP HE3 1 1 14 7330 1 1 30 TRP HH2 H 11.371 14.529 -11.431 1.00 . A A . 30 TRP HH2 1 1 14 7331 1 1 30 TRP HZ2 H 9.118 14.755 -12.370 1.00 . A A . 30 TRP HZ2 1 1 14 7332 1 1 30 TRP HZ3 H 11.886 12.799 -9.787 1.00 . A A . 30 TRP HZ3 1 1 14 7333 1 1 30 TRP N N 6.700 9.482 -6.916 1.00 . A A . 30 TRP N 1 1 14 7334 1 1 30 TRP NE1 N 7.043 12.993 -11.559 1.00 . A A . 30 TRP NE1 1 1 14 7335 1 1 30 TRP O O 4.480 9.857 -9.105 1.00 . A A . 30 TRP O 1 1 14 7336 1 1 30 TRP OXT O 4.175 11.091 -7.347 1.00 . A A . 30 TRP OXT 1 1 15 7337 1 1 1 TYR C C -9.981 1.126 3.556 1.00 . A A . 1 TYR C 1 1 15 7338 1 1 1 TYR CA C -11.022 1.810 4.402 1.00 . A A . 1 TYR CA 1 1 15 7339 1 1 1 TYR CB C -10.340 2.877 5.271 1.00 . A A . 1 TYR CB 1 1 15 7340 1 1 1 TYR CD1 C -11.432 3.467 7.468 1.00 . A A . 1 TYR CD1 1 1 15 7341 1 1 1 TYR CD2 C -12.033 4.715 5.532 1.00 . A A . 1 TYR CD2 1 1 15 7342 1 1 1 TYR CE1 C -12.298 4.219 8.224 1.00 . A A . 1 TYR CE1 1 1 15 7343 1 1 1 TYR CE2 C -12.898 5.470 6.283 1.00 . A A . 1 TYR CE2 1 1 15 7344 1 1 1 TYR CG C -11.283 3.701 6.106 1.00 . A A . 1 TYR CG 1 1 15 7345 1 1 1 TYR CZ C -13.028 5.218 7.627 1.00 . A A . 1 TYR CZ 1 1 15 7346 1 1 1 TYR H1 H -12.472 1.292 5.777 1.00 . A A . 1 TYR H1 1 1 15 7347 1 1 1 TYR H2 H -11.048 0.361 5.864 1.00 . A A . 1 TYR H2 1 1 15 7348 1 1 1 TYR H3 H -12.139 0.100 4.626 1.00 . A A . 1 TYR H3 1 1 15 7349 1 1 1 TYR HA H -11.741 2.292 3.757 1.00 . A A . 1 TYR HA 1 1 15 7350 1 1 1 TYR HB2 H -9.647 2.392 5.942 1.00 . A A . 1 TYR HB2 1 1 15 7351 1 1 1 TYR HB3 H -9.788 3.549 4.630 1.00 . A A . 1 TYR HB3 1 1 15 7352 1 1 1 TYR HD1 H -10.857 2.683 7.941 1.00 . A A . 1 TYR HD1 1 1 15 7353 1 1 1 TYR HD2 H -11.932 4.912 4.476 1.00 . A A . 1 TYR HD2 1 1 15 7354 1 1 1 TYR HE1 H -12.399 4.020 9.281 1.00 . A A . 1 TYR HE1 1 1 15 7355 1 1 1 TYR HE2 H -13.473 6.255 5.816 1.00 . A A . 1 TYR HE2 1 1 15 7356 1 1 1 TYR HH H -13.451 6.248 9.177 1.00 . A A . 1 TYR HH 1 1 15 7357 1 1 1 TYR N N -11.720 0.836 5.229 1.00 . A A . 1 TYR N 1 1 15 7358 1 1 1 TYR O O -9.736 -0.077 3.708 1.00 . A A . 1 TYR O 1 1 15 7359 1 1 1 TYR OH O -13.899 5.966 8.369 1.00 . A A . 1 TYR OH 1 1 15 7360 1 1 2 CYS C C -7.034 1.623 2.621 1.00 . A A . 2 CYS C 1 1 15 7361 1 1 2 CYS CA C -8.315 1.441 1.819 1.00 . A A . 2 CYS CA 1 1 15 7362 1 1 2 CYS CB C -8.297 2.306 0.545 1.00 . A A . 2 CYS CB 1 1 15 7363 1 1 2 CYS H H -9.708 2.812 2.553 1.00 . A A . 2 CYS H 1 1 15 7364 1 1 2 CYS HA H -8.459 0.402 1.565 1.00 . A A . 2 CYS HA 1 1 15 7365 1 1 2 CYS HB2 H -9.251 2.226 0.049 1.00 . A A . 2 CYS HB2 1 1 15 7366 1 1 2 CYS HB3 H -8.143 3.329 0.852 1.00 . A A . 2 CYS HB3 1 1 15 7367 1 1 2 CYS N N -9.400 1.886 2.660 1.00 . A A . 2 CYS N 1 1 15 7368 1 1 2 CYS O O -7.024 2.393 3.605 1.00 . A A . 2 CYS O 1 1 15 7369 1 1 2 CYS SG S -7.014 1.912 -0.698 1.00 . A A . 2 CYS SG 1 1 15 7370 1 1 3 GLN C C -3.988 2.298 2.633 1.00 . A A . 3 GLN C 1 1 15 7371 1 1 3 GLN CA C -4.751 1.051 3.004 1.00 . A A . 3 GLN CA 1 1 15 7372 1 1 3 GLN CB C -3.856 -0.172 2.813 1.00 . A A . 3 GLN CB 1 1 15 7373 1 1 3 GLN CD C -5.211 -1.621 4.391 1.00 . A A . 3 GLN CD 1 1 15 7374 1 1 3 GLN CG C -4.516 -1.522 3.055 1.00 . A A . 3 GLN CG 1 1 15 7375 1 1 3 GLN H H -5.998 0.481 1.383 1.00 . A A . 3 GLN H 1 1 15 7376 1 1 3 GLN HA H -5.036 1.124 4.042 1.00 . A A . 3 GLN HA 1 1 15 7377 1 1 3 GLN HB2 H -3.448 -0.161 1.815 1.00 . A A . 3 GLN HB2 1 1 15 7378 1 1 3 GLN HB3 H -3.030 -0.080 3.503 1.00 . A A . 3 GLN HB3 1 1 15 7379 1 1 3 GLN HE21 H -3.526 -2.165 5.250 1.00 . A A . 3 GLN HE21 1 1 15 7380 1 1 3 GLN HE22 H -4.905 -2.042 6.281 1.00 . A A . 3 GLN HE22 1 1 15 7381 1 1 3 GLN HG2 H -5.247 -1.692 2.279 1.00 . A A . 3 GLN HG2 1 1 15 7382 1 1 3 GLN HG3 H -3.759 -2.290 3.000 1.00 . A A . 3 GLN HG3 1 1 15 7383 1 1 3 GLN N N -5.970 0.976 2.228 1.00 . A A . 3 GLN N 1 1 15 7384 1 1 3 GLN NE2 N -4.482 -1.977 5.400 1.00 . A A . 3 GLN NE2 1 1 15 7385 1 1 3 GLN O O -3.838 2.617 1.458 1.00 . A A . 3 GLN O 1 1 15 7386 1 1 3 GLN OE1 O -6.404 -1.352 4.509 1.00 . A A . 3 GLN OE1 1 1 15 7387 1 1 4 LYS C C -1.327 3.990 3.481 1.00 . A A . 4 LYS C 1 1 15 7388 1 1 4 LYS CA C -2.828 4.242 3.448 1.00 . A A . 4 LYS CA 1 1 15 7389 1 1 4 LYS CB C -3.189 5.242 4.549 1.00 . A A . 4 LYS CB 1 1 15 7390 1 1 4 LYS CD C -4.944 6.557 5.740 1.00 . A A . 4 LYS CD 1 1 15 7391 1 1 4 LYS CE C -6.422 6.864 5.831 1.00 . A A . 4 LYS CE 1 1 15 7392 1 1 4 LYS CG C -4.661 5.578 4.624 1.00 . A A . 4 LYS CG 1 1 15 7393 1 1 4 LYS H H -3.744 2.692 4.542 1.00 . A A . 4 LYS H 1 1 15 7394 1 1 4 LYS HA H -3.110 4.666 2.497 1.00 . A A . 4 LYS HA 1 1 15 7395 1 1 4 LYS HB2 H -2.891 4.826 5.501 1.00 . A A . 4 LYS HB2 1 1 15 7396 1 1 4 LYS HB3 H -2.637 6.155 4.381 1.00 . A A . 4 LYS HB3 1 1 15 7397 1 1 4 LYS HD2 H -4.618 6.124 6.674 1.00 . A A . 4 LYS HD2 1 1 15 7398 1 1 4 LYS HD3 H -4.402 7.474 5.556 1.00 . A A . 4 LYS HD3 1 1 15 7399 1 1 4 LYS HE2 H -6.754 7.268 4.886 1.00 . A A . 4 LYS HE2 1 1 15 7400 1 1 4 LYS HE3 H -6.957 5.948 6.035 1.00 . A A . 4 LYS HE3 1 1 15 7401 1 1 4 LYS HG2 H -4.963 6.027 3.689 1.00 . A A . 4 LYS HG2 1 1 15 7402 1 1 4 LYS HG3 H -5.224 4.673 4.793 1.00 . A A . 4 LYS HG3 1 1 15 7403 1 1 4 LYS HZ1 H -6.225 8.735 6.704 1.00 . A A . 4 LYS HZ1 1 1 15 7404 1 1 4 LYS HZ2 H -6.435 7.479 7.827 1.00 . A A . 4 LYS HZ2 1 1 15 7405 1 1 4 LYS HZ3 H -7.738 8.028 6.905 1.00 . A A . 4 LYS HZ3 1 1 15 7406 1 1 4 LYS N N -3.558 3.014 3.637 1.00 . A A . 4 LYS N 1 1 15 7407 1 1 4 LYS NZ N -6.716 7.839 6.893 1.00 . A A . 4 LYS NZ 1 1 15 7408 1 1 4 LYS O O -0.879 2.893 3.785 1.00 . A A . 4 LYS O 1 1 15 7409 1 1 5 TRP C C 1.440 4.694 4.667 1.00 . A A . 5 TRP C 1 1 15 7410 1 1 5 TRP CA C 0.910 5.041 3.262 1.00 . A A . 5 TRP CA 1 1 15 7411 1 1 5 TRP CB C 1.427 6.435 2.829 1.00 . A A . 5 TRP CB 1 1 15 7412 1 1 5 TRP CD1 C 1.532 8.140 4.765 1.00 . A A . 5 TRP CD1 1 1 15 7413 1 1 5 TRP CD2 C -0.346 8.257 3.549 1.00 . A A . 5 TRP CD2 1 1 15 7414 1 1 5 TRP CE2 C -0.416 9.216 4.578 1.00 . A A . 5 TRP CE2 1 1 15 7415 1 1 5 TRP CE3 C -1.417 8.151 2.656 1.00 . A A . 5 TRP CE3 1 1 15 7416 1 1 5 TRP CG C 0.910 7.572 3.688 1.00 . A A . 5 TRP CG 1 1 15 7417 1 1 5 TRP CH2 C -2.539 9.922 3.847 1.00 . A A . 5 TRP CH2 1 1 15 7418 1 1 5 TRP CZ2 C -1.510 10.054 4.736 1.00 . A A . 5 TRP CZ2 1 1 15 7419 1 1 5 TRP CZ3 C -2.499 8.985 2.817 1.00 . A A . 5 TRP CZ3 1 1 15 7420 1 1 5 TRP H H -1.023 5.888 3.034 1.00 . A A . 5 TRP H 1 1 15 7421 1 1 5 TRP HA H 1.258 4.303 2.556 1.00 . A A . 5 TRP HA 1 1 15 7422 1 1 5 TRP HB2 H 2.505 6.446 2.892 1.00 . A A . 5 TRP HB2 1 1 15 7423 1 1 5 TRP HB3 H 1.124 6.622 1.809 1.00 . A A . 5 TRP HB3 1 1 15 7424 1 1 5 TRP HD1 H 2.504 7.840 5.129 1.00 . A A . 5 TRP HD1 1 1 15 7425 1 1 5 TRP HE1 H 0.969 9.678 6.087 1.00 . A A . 5 TRP HE1 1 1 15 7426 1 1 5 TRP HE3 H -1.410 7.439 1.845 1.00 . A A . 5 TRP HE3 1 1 15 7427 1 1 5 TRP HH2 H -3.412 10.552 3.931 1.00 . A A . 5 TRP HH2 1 1 15 7428 1 1 5 TRP HZ2 H -1.563 10.789 5.527 1.00 . A A . 5 TRP HZ2 1 1 15 7429 1 1 5 TRP HZ3 H -3.337 8.919 2.139 1.00 . A A . 5 TRP HZ3 1 1 15 7430 1 1 5 TRP N N -0.568 5.047 3.246 1.00 . A A . 5 TRP N 1 1 15 7431 1 1 5 TRP NE1 N 0.738 9.126 5.303 1.00 . A A . 5 TRP NE1 1 1 15 7432 1 1 5 TRP O O 2.559 4.232 4.840 1.00 . A A . 5 TRP O 1 1 15 7433 1 1 6 MET C C 0.623 3.191 7.356 1.00 . A A . 6 MET C 1 1 15 7434 1 1 6 MET CA C 0.893 4.667 7.043 1.00 . A A . 6 MET CA 1 1 15 7435 1 1 6 MET CB C -0.033 5.548 7.896 1.00 . A A . 6 MET CB 1 1 15 7436 1 1 6 MET CE C -0.681 7.820 10.060 1.00 . A A . 6 MET CE 1 1 15 7437 1 1 6 MET CG C -0.049 5.212 9.377 1.00 . A A . 6 MET CG 1 1 15 7438 1 1 6 MET H H -0.241 5.367 5.408 1.00 . A A . 6 MET H 1 1 15 7439 1 1 6 MET HA H 1.917 4.925 7.262 1.00 . A A . 6 MET HA 1 1 15 7440 1 1 6 MET HB2 H 0.294 6.571 7.793 1.00 . A A . 6 MET HB2 1 1 15 7441 1 1 6 MET HB3 H -1.041 5.472 7.513 1.00 . A A . 6 MET HB3 1 1 15 7442 1 1 6 MET HE1 H -1.329 8.504 10.585 1.00 . A A . 6 MET HE1 1 1 15 7443 1 1 6 MET HE2 H -0.690 8.058 9.007 1.00 . A A . 6 MET HE2 1 1 15 7444 1 1 6 MET HE3 H 0.324 7.906 10.444 1.00 . A A . 6 MET HE3 1 1 15 7445 1 1 6 MET HG2 H -0.263 4.158 9.486 1.00 . A A . 6 MET HG2 1 1 15 7446 1 1 6 MET HG3 H 0.933 5.416 9.766 1.00 . A A . 6 MET HG3 1 1 15 7447 1 1 6 MET N N 0.610 4.948 5.646 1.00 . A A . 6 MET N 1 1 15 7448 1 1 6 MET O O 1.169 2.616 8.298 1.00 . A A . 6 MET O 1 1 15 7449 1 1 6 MET SD S -1.278 6.155 10.304 1.00 . A A . 6 MET SD 1 1 15 7450 1 1 7 TRP C C 0.131 0.236 6.011 1.00 . A A . 7 TRP C 1 1 15 7451 1 1 7 TRP CA C -0.701 1.265 6.757 1.00 . A A . 7 TRP CA 1 1 15 7452 1 1 7 TRP CB C -2.182 1.189 6.297 1.00 . A A . 7 TRP CB 1 1 15 7453 1 1 7 TRP CD1 C -2.825 3.241 7.741 1.00 . A A . 7 TRP CD1 1 1 15 7454 1 1 7 TRP CD2 C -4.562 2.012 7.086 1.00 . A A . 7 TRP CD2 1 1 15 7455 1 1 7 TRP CE2 C -5.033 3.092 7.857 1.00 . A A . 7 TRP CE2 1 1 15 7456 1 1 7 TRP CE3 C -5.483 1.114 6.568 1.00 . A A . 7 TRP CE3 1 1 15 7457 1 1 7 TRP CG C -3.136 2.118 7.029 1.00 . A A . 7 TRP CG 1 1 15 7458 1 1 7 TRP CH2 C -7.257 2.393 7.592 1.00 . A A . 7 TRP CH2 1 1 15 7459 1 1 7 TRP CZ2 C -6.380 3.291 8.118 1.00 . A A . 7 TRP CZ2 1 1 15 7460 1 1 7 TRP CZ3 C -6.818 1.312 6.822 1.00 . A A . 7 TRP CZ3 1 1 15 7461 1 1 7 TRP H H -0.401 3.050 5.693 1.00 . A A . 7 TRP H 1 1 15 7462 1 1 7 TRP HA H -0.661 1.060 7.816 1.00 . A A . 7 TRP HA 1 1 15 7463 1 1 7 TRP HB2 H -2.228 1.446 5.249 1.00 . A A . 7 TRP HB2 1 1 15 7464 1 1 7 TRP HB3 H -2.537 0.177 6.421 1.00 . A A . 7 TRP HB3 1 1 15 7465 1 1 7 TRP HD1 H -1.814 3.593 7.886 1.00 . A A . 7 TRP HD1 1 1 15 7466 1 1 7 TRP HE1 H -3.992 4.633 8.796 1.00 . A A . 7 TRP HE1 1 1 15 7467 1 1 7 TRP HE3 H -5.171 0.267 5.972 1.00 . A A . 7 TRP HE3 1 1 15 7468 1 1 7 TRP HH2 H -8.316 2.508 7.768 1.00 . A A . 7 TRP HH2 1 1 15 7469 1 1 7 TRP HZ2 H -6.739 4.120 8.708 1.00 . A A . 7 TRP HZ2 1 1 15 7470 1 1 7 TRP HZ3 H -7.540 0.618 6.417 1.00 . A A . 7 TRP HZ3 1 1 15 7471 1 1 7 TRP N N -0.181 2.597 6.533 1.00 . A A . 7 TRP N 1 1 15 7472 1 1 7 TRP NE1 N -3.952 3.818 8.246 1.00 . A A . 7 TRP NE1 1 1 15 7473 1 1 7 TRP O O 1.168 0.566 5.401 1.00 . A A . 7 TRP O 1 1 15 7474 1 1 8 THR C C -0.681 -2.842 4.607 1.00 . A A . 8 THR C 1 1 15 7475 1 1 8 THR CA C 0.373 -2.085 5.416 1.00 . A A . 8 THR CA 1 1 15 7476 1 1 8 THR CB C 1.007 -3.039 6.461 1.00 . A A . 8 THR CB 1 1 15 7477 1 1 8 THR CG2 C 2.007 -2.300 7.352 1.00 . A A . 8 THR CG2 1 1 15 7478 1 1 8 THR H H -1.079 -1.215 6.620 1.00 . A A . 8 THR H 1 1 15 7479 1 1 8 THR HA H 1.135 -1.686 4.768 1.00 . A A . 8 THR HA 1 1 15 7480 1 1 8 THR HB H 1.521 -3.828 5.933 1.00 . A A . 8 THR HB 1 1 15 7481 1 1 8 THR HG1 H -0.306 -4.433 6.893 1.00 . A A . 8 THR HG1 1 1 15 7482 1 1 8 THR HG21 H 1.493 -1.518 7.891 1.00 . A A . 8 THR HG21 1 1 15 7483 1 1 8 THR HG22 H 2.784 -1.857 6.746 1.00 . A A . 8 THR HG22 1 1 15 7484 1 1 8 THR HG23 H 2.446 -2.995 8.052 1.00 . A A . 8 THR HG23 1 1 15 7485 1 1 8 THR N N -0.287 -0.995 6.083 1.00 . A A . 8 THR N 1 1 15 7486 1 1 8 THR O O -1.878 -2.593 4.799 1.00 . A A . 8 THR O 1 1 15 7487 1 1 8 THR OG1 O -0.021 -3.601 7.295 1.00 . A A . 8 THR OG1 1 1 15 7488 1 1 9 CYS C C -1.029 -5.956 2.969 1.00 . A A . 9 CYS C 1 1 15 7489 1 1 9 CYS CA C -1.329 -4.478 3.017 1.00 . A A . 9 CYS CA 1 1 15 7490 1 1 9 CYS CB C -1.605 -3.903 1.632 1.00 . A A . 9 CYS CB 1 1 15 7491 1 1 9 CYS H H 0.639 -3.950 3.467 1.00 . A A . 9 CYS H 1 1 15 7492 1 1 9 CYS HA H -2.221 -4.360 3.615 1.00 . A A . 9 CYS HA 1 1 15 7493 1 1 9 CYS HB2 H -2.371 -4.490 1.148 1.00 . A A . 9 CYS HB2 1 1 15 7494 1 1 9 CYS HB3 H -1.953 -2.887 1.741 1.00 . A A . 9 CYS HB3 1 1 15 7495 1 1 9 CYS N N -0.297 -3.743 3.708 1.00 . A A . 9 CYS N 1 1 15 7496 1 1 9 CYS O O -0.008 -6.422 3.527 1.00 . A A . 9 CYS O 1 1 15 7497 1 1 9 CYS SG S -0.173 -3.880 0.545 1.00 . A A . 9 CYS SG 1 1 15 7498 1 1 10 ASP C C -2.662 -8.500 1.016 1.00 . A A . 10 ASP C 1 1 15 7499 1 1 10 ASP CA C -1.843 -8.126 2.249 1.00 . A A . 10 ASP CA 1 1 15 7500 1 1 10 ASP CB C -2.462 -8.710 3.541 1.00 . A A . 10 ASP CB 1 1 15 7501 1 1 10 ASP CG C -2.297 -10.199 3.687 1.00 . A A . 10 ASP CG 1 1 15 7502 1 1 10 ASP H H -2.647 -6.273 1.833 1.00 . A A . 10 ASP H 1 1 15 7503 1 1 10 ASP HA H -0.816 -8.441 2.140 1.00 . A A . 10 ASP HA 1 1 15 7504 1 1 10 ASP HB2 H -1.996 -8.241 4.394 1.00 . A A . 10 ASP HB2 1 1 15 7505 1 1 10 ASP HB3 H -3.518 -8.477 3.550 1.00 . A A . 10 ASP HB3 1 1 15 7506 1 1 10 ASP N N -1.906 -6.689 2.330 1.00 . A A . 10 ASP N 1 1 15 7507 1 1 10 ASP O O -2.968 -7.620 0.224 1.00 . A A . 10 ASP O 1 1 15 7508 1 1 10 ASP OD1 O -3.165 -10.942 3.215 1.00 . A A . 10 ASP OD1 1 1 15 7509 1 1 10 ASP OD2 O -1.294 -10.648 4.284 1.00 . A A . 10 ASP OD2 1 1 15 7510 1 1 11 SER C C -5.299 -9.823 0.059 1.00 . A A . 11 SER C 1 1 15 7511 1 1 11 SER CA C -3.842 -10.148 -0.266 1.00 . A A . 11 SER CA 1 1 15 7512 1 1 11 SER CB C -3.676 -11.639 -0.505 1.00 . A A . 11 SER CB 1 1 15 7513 1 1 11 SER H H -2.770 -10.424 1.514 1.00 . A A . 11 SER H 1 1 15 7514 1 1 11 SER HA H -3.532 -9.600 -1.143 1.00 . A A . 11 SER HA 1 1 15 7515 1 1 11 SER HB2 H -4.073 -12.178 0.342 1.00 . A A . 11 SER HB2 1 1 15 7516 1 1 11 SER HB3 H -4.204 -11.925 -1.402 1.00 . A A . 11 SER HB3 1 1 15 7517 1 1 11 SER HG H -1.801 -11.154 -0.770 1.00 . A A . 11 SER HG 1 1 15 7518 1 1 11 SER N N -3.027 -9.743 0.847 1.00 . A A . 11 SER N 1 1 15 7519 1 1 11 SER O O -6.124 -9.611 -0.830 1.00 . A A . 11 SER O 1 1 15 7520 1 1 11 SER OG O -2.305 -11.972 -0.649 1.00 . A A . 11 SER OG 1 1 15 7521 1 1 12 GLU C C -7.042 -7.921 1.885 1.00 . A A . 12 GLU C 1 1 15 7522 1 1 12 GLU CA C -6.912 -9.441 1.823 1.00 . A A . 12 GLU CA 1 1 15 7523 1 1 12 GLU CB C -7.174 -10.060 3.190 1.00 . A A . 12 GLU CB 1 1 15 7524 1 1 12 GLU CD C -7.362 -12.157 4.549 1.00 . A A . 12 GLU CD 1 1 15 7525 1 1 12 GLU CG C -7.073 -11.569 3.201 1.00 . A A . 12 GLU CG 1 1 15 7526 1 1 12 GLU H H -4.891 -10.039 1.991 1.00 . A A . 12 GLU H 1 1 15 7527 1 1 12 GLU HA H -7.629 -9.824 1.112 1.00 . A A . 12 GLU HA 1 1 15 7528 1 1 12 GLU HB2 H -6.461 -9.667 3.898 1.00 . A A . 12 GLU HB2 1 1 15 7529 1 1 12 GLU HB3 H -8.171 -9.790 3.505 1.00 . A A . 12 GLU HB3 1 1 15 7530 1 1 12 GLU HG2 H -7.786 -11.972 2.498 1.00 . A A . 12 GLU HG2 1 1 15 7531 1 1 12 GLU HG3 H -6.074 -11.855 2.902 1.00 . A A . 12 GLU HG3 1 1 15 7532 1 1 12 GLU N N -5.595 -9.793 1.352 1.00 . A A . 12 GLU N 1 1 15 7533 1 1 12 GLU O O -7.915 -7.336 1.240 1.00 . A A . 12 GLU O 1 1 15 7534 1 1 12 GLU OE1 O -6.454 -12.213 5.390 1.00 . A A . 12 GLU OE1 1 1 15 7535 1 1 12 GLU OE2 O -8.497 -12.610 4.788 1.00 . A A . 12 GLU OE2 1 1 15 7536 1 1 13 ARG C C -5.630 -5.233 1.457 1.00 . A A . 13 ARG C 1 1 15 7537 1 1 13 ARG CA C -6.142 -5.829 2.745 1.00 . A A . 13 ARG CA 1 1 15 7538 1 1 13 ARG CB C -5.252 -5.372 3.902 1.00 . A A . 13 ARG CB 1 1 15 7539 1 1 13 ARG CD C -6.955 -4.735 5.674 1.00 . A A . 13 ARG CD 1 1 15 7540 1 1 13 ARG CG C -5.781 -5.640 5.301 1.00 . A A . 13 ARG CG 1 1 15 7541 1 1 13 ARG CZ C -9.276 -4.286 4.901 1.00 . A A . 13 ARG CZ 1 1 15 7542 1 1 13 ARG H H -5.493 -7.813 3.129 1.00 . A A . 13 ARG H 1 1 15 7543 1 1 13 ARG HA H -7.152 -5.488 2.919 1.00 . A A . 13 ARG HA 1 1 15 7544 1 1 13 ARG HB2 H -4.315 -5.899 3.816 1.00 . A A . 13 ARG HB2 1 1 15 7545 1 1 13 ARG HB3 H -5.068 -4.311 3.801 1.00 . A A . 13 ARG HB3 1 1 15 7546 1 1 13 ARG HD2 H -7.143 -4.822 6.734 1.00 . A A . 13 ARG HD2 1 1 15 7547 1 1 13 ARG HD3 H -6.682 -3.715 5.450 1.00 . A A . 13 ARG HD3 1 1 15 7548 1 1 13 ARG HE H -8.184 -5.943 4.513 1.00 . A A . 13 ARG HE 1 1 15 7549 1 1 13 ARG HG2 H -6.134 -6.660 5.313 1.00 . A A . 13 ARG HG2 1 1 15 7550 1 1 13 ARG HG3 H -4.981 -5.512 6.013 1.00 . A A . 13 ARG HG3 1 1 15 7551 1 1 13 ARG HH11 H -8.498 -2.722 5.981 1.00 . A A . 13 ARG HH11 1 1 15 7552 1 1 13 ARG HH12 H -10.101 -2.502 5.459 1.00 . A A . 13 ARG HH12 1 1 15 7553 1 1 13 ARG HH21 H -10.398 -5.619 3.832 1.00 . A A . 13 ARG HH21 1 1 15 7554 1 1 13 ARG HH22 H -11.184 -4.149 4.198 1.00 . A A . 13 ARG HH22 1 1 15 7555 1 1 13 ARG N N -6.160 -7.285 2.642 1.00 . A A . 13 ARG N 1 1 15 7556 1 1 13 ARG NE N -8.184 -5.063 4.954 1.00 . A A . 13 ARG NE 1 1 15 7557 1 1 13 ARG NH1 N -9.288 -3.089 5.485 1.00 . A A . 13 ARG NH1 1 1 15 7558 1 1 13 ARG NH2 N -10.358 -4.717 4.274 1.00 . A A . 13 ARG NH2 1 1 15 7559 1 1 13 ARG O O -4.452 -5.379 1.127 1.00 . A A . 13 ARG O 1 1 15 7560 1 1 14 LYS C C -5.578 -2.596 -0.362 1.00 . A A . 14 LYS C 1 1 15 7561 1 1 14 LYS CA C -6.133 -3.992 -0.527 1.00 . A A . 14 LYS CA 1 1 15 7562 1 1 14 LYS CB C -7.273 -4.019 -1.585 1.00 . A A . 14 LYS CB 1 1 15 7563 1 1 14 LYS CD C -9.474 -4.051 -0.290 1.00 . A A . 14 LYS CD 1 1 15 7564 1 1 14 LYS CE C -10.785 -3.318 -0.073 1.00 . A A . 14 LYS CE 1 1 15 7565 1 1 14 LYS CG C -8.580 -3.285 -1.251 1.00 . A A . 14 LYS CG 1 1 15 7566 1 1 14 LYS H H -7.381 -4.428 1.141 1.00 . A A . 14 LYS H 1 1 15 7567 1 1 14 LYS HA H -5.317 -4.600 -0.889 1.00 . A A . 14 LYS HA 1 1 15 7568 1 1 14 LYS HB2 H -6.890 -3.571 -2.488 1.00 . A A . 14 LYS HB2 1 1 15 7569 1 1 14 LYS HB3 H -7.510 -5.051 -1.797 1.00 . A A . 14 LYS HB3 1 1 15 7570 1 1 14 LYS HD2 H -9.685 -5.026 -0.705 1.00 . A A . 14 LYS HD2 1 1 15 7571 1 1 14 LYS HD3 H -8.978 -4.164 0.661 1.00 . A A . 14 LYS HD3 1 1 15 7572 1 1 14 LYS HE2 H -10.572 -2.352 0.360 1.00 . A A . 14 LYS HE2 1 1 15 7573 1 1 14 LYS HE3 H -11.268 -3.180 -1.030 1.00 . A A . 14 LYS HE3 1 1 15 7574 1 1 14 LYS HG2 H -8.336 -2.333 -0.803 1.00 . A A . 14 LYS HG2 1 1 15 7575 1 1 14 LYS HG3 H -9.120 -3.115 -2.171 1.00 . A A . 14 LYS HG3 1 1 15 7576 1 1 14 LYS HZ1 H -11.892 -5.008 0.466 1.00 . A A . 14 LYS HZ1 1 1 15 7577 1 1 14 LYS HZ2 H -12.598 -3.547 0.922 1.00 . A A . 14 LYS HZ2 1 1 15 7578 1 1 14 LYS HZ3 H -11.285 -4.143 1.778 1.00 . A A . 14 LYS HZ3 1 1 15 7579 1 1 14 LYS N N -6.493 -4.565 0.750 1.00 . A A . 14 LYS N 1 1 15 7580 1 1 14 LYS NZ N -11.695 -4.053 0.826 1.00 . A A . 14 LYS NZ 1 1 15 7581 1 1 14 LYS O O -6.150 -1.762 0.356 1.00 . A A . 14 LYS O 1 1 15 7582 1 1 15 CYS C C -4.313 -0.188 -2.022 1.00 . A A . 15 CYS C 1 1 15 7583 1 1 15 CYS CA C -3.817 -1.085 -0.894 1.00 . A A . 15 CYS CA 1 1 15 7584 1 1 15 CYS CB C -2.299 -1.290 -0.951 1.00 . A A . 15 CYS CB 1 1 15 7585 1 1 15 CYS H H -4.102 -3.036 -1.592 1.00 . A A . 15 CYS H 1 1 15 7586 1 1 15 CYS HA H -4.090 -0.640 0.050 1.00 . A A . 15 CYS HA 1 1 15 7587 1 1 15 CYS HB2 H -2.037 -2.155 -0.360 1.00 . A A . 15 CYS HB2 1 1 15 7588 1 1 15 CYS HB3 H -2.009 -1.468 -1.975 1.00 . A A . 15 CYS HB3 1 1 15 7589 1 1 15 CYS N N -4.478 -2.350 -1.000 1.00 . A A . 15 CYS N 1 1 15 7590 1 1 15 CYS O O -4.831 -0.688 -3.042 1.00 . A A . 15 CYS O 1 1 15 7591 1 1 15 CYS SG S -1.316 0.105 -0.334 1.00 . A A . 15 CYS SG 1 1 15 7592 1 1 16 CYS C C -3.869 2.058 -4.109 1.00 . A A . 16 CYS C 1 1 15 7593 1 1 16 CYS CA C -4.709 2.038 -2.836 1.00 . A A . 16 CYS CA 1 1 15 7594 1 1 16 CYS CB C -4.794 3.444 -2.243 1.00 . A A . 16 CYS CB 1 1 15 7595 1 1 16 CYS H H -3.739 1.457 -1.062 1.00 . A A . 16 CYS H 1 1 15 7596 1 1 16 CYS HA H -5.708 1.720 -3.091 1.00 . A A . 16 CYS HA 1 1 15 7597 1 1 16 CYS HB2 H -3.814 3.729 -1.891 1.00 . A A . 16 CYS HB2 1 1 15 7598 1 1 16 CYS HB3 H -5.097 4.132 -3.021 1.00 . A A . 16 CYS HB3 1 1 15 7599 1 1 16 CYS N N -4.194 1.102 -1.857 1.00 . A A . 16 CYS N 1 1 15 7600 1 1 16 CYS O O -2.658 1.789 -4.087 1.00 . A A . 16 CYS O 1 1 15 7601 1 1 16 CYS SG S -5.953 3.647 -0.833 1.00 . A A . 16 CYS SG 1 1 15 7602 1 1 17 LYS C C -3.043 3.786 -6.404 1.00 . A A . 17 LYS C 1 1 15 7603 1 1 17 LYS CA C -3.821 2.492 -6.469 1.00 . A A . 17 LYS CA 1 1 15 7604 1 1 17 LYS CB C -4.784 2.470 -7.657 1.00 . A A . 17 LYS CB 1 1 15 7605 1 1 17 LYS CD C -6.437 1.150 -9.019 1.00 . A A . 17 LYS CD 1 1 15 7606 1 1 17 LYS CE C -7.133 -0.189 -9.182 1.00 . A A . 17 LYS CE 1 1 15 7607 1 1 17 LYS CG C -5.510 1.142 -7.819 1.00 . A A . 17 LYS CG 1 1 15 7608 1 1 17 LYS H H -5.489 2.468 -5.197 1.00 . A A . 17 LYS H 1 1 15 7609 1 1 17 LYS HA H -3.122 1.672 -6.544 1.00 . A A . 17 LYS HA 1 1 15 7610 1 1 17 LYS HB2 H -5.520 3.246 -7.519 1.00 . A A . 17 LYS HB2 1 1 15 7611 1 1 17 LYS HB3 H -4.228 2.666 -8.562 1.00 . A A . 17 LYS HB3 1 1 15 7612 1 1 17 LYS HD2 H -7.183 1.920 -8.885 1.00 . A A . 17 LYS HD2 1 1 15 7613 1 1 17 LYS HD3 H -5.854 1.357 -9.903 1.00 . A A . 17 LYS HD3 1 1 15 7614 1 1 17 LYS HE2 H -6.384 -0.957 -9.308 1.00 . A A . 17 LYS HE2 1 1 15 7615 1 1 17 LYS HE3 H -7.702 -0.391 -8.288 1.00 . A A . 17 LYS HE3 1 1 15 7616 1 1 17 LYS HG2 H -4.781 0.355 -7.947 1.00 . A A . 17 LYS HG2 1 1 15 7617 1 1 17 LYS HG3 H -6.089 0.954 -6.926 1.00 . A A . 17 LYS HG3 1 1 15 7618 1 1 17 LYS HZ1 H -8.792 0.500 -10.286 1.00 . A A . 17 LYS HZ1 1 1 15 7619 1 1 17 LYS HZ2 H -8.487 -1.154 -10.410 1.00 . A A . 17 LYS HZ2 1 1 15 7620 1 1 17 LYS HZ3 H -7.511 -0.074 -11.232 1.00 . A A . 17 LYS HZ3 1 1 15 7621 1 1 17 LYS N N -4.516 2.340 -5.224 1.00 . A A . 17 LYS N 1 1 15 7622 1 1 17 LYS NZ N -8.041 -0.216 -10.349 1.00 . A A . 17 LYS NZ 1 1 15 7623 1 1 17 LYS O O -3.579 4.833 -6.002 1.00 . A A . 17 LYS O 1 1 15 7624 1 1 18 GLY C C 0.012 4.520 -5.446 1.00 . A A . 18 GLY C 1 1 15 7625 1 1 18 GLY CA C -0.929 4.833 -6.576 1.00 . A A . 18 GLY CA 1 1 15 7626 1 1 18 GLY H H -1.464 2.898 -7.171 1.00 . A A . 18 GLY H 1 1 15 7627 1 1 18 GLY HA2 H -0.374 5.016 -7.485 1.00 . A A . 18 GLY HA2 1 1 15 7628 1 1 18 GLY HA3 H -1.507 5.708 -6.318 1.00 . A A . 18 GLY HA3 1 1 15 7629 1 1 18 GLY N N -1.808 3.720 -6.761 1.00 . A A . 18 GLY N 1 1 15 7630 1 1 18 GLY O O 0.804 5.349 -5.023 1.00 . A A . 18 GLY O 1 1 15 7631 1 1 19 MET C C 1.143 1.419 -4.319 1.00 . A A . 19 MET C 1 1 15 7632 1 1 19 MET CA C 0.724 2.792 -3.891 1.00 . A A . 19 MET CA 1 1 15 7633 1 1 19 MET CB C -0.010 2.682 -2.548 1.00 . A A . 19 MET CB 1 1 15 7634 1 1 19 MET CE C -1.913 5.476 -0.163 1.00 . A A . 19 MET CE 1 1 15 7635 1 1 19 MET CG C -0.493 3.991 -1.976 1.00 . A A . 19 MET CG 1 1 15 7636 1 1 19 MET H H -0.860 2.738 -5.223 1.00 . A A . 19 MET H 1 1 15 7637 1 1 19 MET HA H 1.592 3.422 -3.786 1.00 . A A . 19 MET HA 1 1 15 7638 1 1 19 MET HB2 H -0.871 2.043 -2.679 1.00 . A A . 19 MET HB2 1 1 15 7639 1 1 19 MET HB3 H 0.653 2.222 -1.830 1.00 . A A . 19 MET HB3 1 1 15 7640 1 1 19 MET HE1 H -2.513 5.534 0.733 1.00 . A A . 19 MET HE1 1 1 15 7641 1 1 19 MET HE2 H -2.483 5.850 -1.000 1.00 . A A . 19 MET HE2 1 1 15 7642 1 1 19 MET HE3 H -1.021 6.073 -0.038 1.00 . A A . 19 MET HE3 1 1 15 7643 1 1 19 MET HG2 H 0.383 4.564 -1.711 1.00 . A A . 19 MET HG2 1 1 15 7644 1 1 19 MET HG3 H -1.084 4.518 -2.709 1.00 . A A . 19 MET HG3 1 1 15 7645 1 1 19 MET N N -0.131 3.322 -4.920 1.00 . A A . 19 MET N 1 1 15 7646 1 1 19 MET O O 0.480 0.803 -5.157 1.00 . A A . 19 MET O 1 1 15 7647 1 1 19 MET SD S -1.451 3.785 -0.475 1.00 . A A . 19 MET SD 1 1 15 7648 1 1 20 VAL C C 2.343 -1.241 -2.873 1.00 . A A . 20 VAL C 1 1 15 7649 1 1 20 VAL CA C 2.653 -0.384 -4.071 1.00 . A A . 20 VAL CA 1 1 15 7650 1 1 20 VAL CB C 4.177 -0.425 -4.386 1.00 . A A . 20 VAL CB 1 1 15 7651 1 1 20 VAL CG1 C 4.637 -1.845 -4.695 1.00 . A A . 20 VAL CG1 1 1 15 7652 1 1 20 VAL CG2 C 4.503 0.493 -5.558 1.00 . A A . 20 VAL CG2 1 1 15 7653 1 1 20 VAL H H 2.713 1.484 -3.126 1.00 . A A . 20 VAL H 1 1 15 7654 1 1 20 VAL HA H 2.096 -0.746 -4.923 1.00 . A A . 20 VAL HA 1 1 15 7655 1 1 20 VAL HB H 4.716 -0.071 -3.519 1.00 . A A . 20 VAL HB 1 1 15 7656 1 1 20 VAL HG11 H 4.444 -2.480 -3.841 1.00 . A A . 20 VAL HG11 1 1 15 7657 1 1 20 VAL HG12 H 5.693 -1.842 -4.914 1.00 . A A . 20 VAL HG12 1 1 15 7658 1 1 20 VAL HG13 H 4.094 -2.220 -5.550 1.00 . A A . 20 VAL HG13 1 1 15 7659 1 1 20 VAL HG21 H 5.565 0.470 -5.749 1.00 . A A . 20 VAL HG21 1 1 15 7660 1 1 20 VAL HG22 H 4.197 1.502 -5.324 1.00 . A A . 20 VAL HG22 1 1 15 7661 1 1 20 VAL HG23 H 3.973 0.154 -6.436 1.00 . A A . 20 VAL HG23 1 1 15 7662 1 1 20 VAL N N 2.204 0.938 -3.773 1.00 . A A . 20 VAL N 1 1 15 7663 1 1 20 VAL O O 2.704 -0.888 -1.738 1.00 . A A . 20 VAL O 1 1 15 7664 1 1 21 CYS C C 2.409 -4.099 -1.718 1.00 . A A . 21 CYS C 1 1 15 7665 1 1 21 CYS CA C 1.240 -3.196 -2.056 1.00 . A A . 21 CYS CA 1 1 15 7666 1 1 21 CYS CB C 0.009 -4.018 -2.461 1.00 . A A . 21 CYS CB 1 1 15 7667 1 1 21 CYS H H 1.395 -2.534 -4.033 1.00 . A A . 21 CYS H 1 1 15 7668 1 1 21 CYS HA H 1.002 -2.596 -1.190 1.00 . A A . 21 CYS HA 1 1 15 7669 1 1 21 CYS HB2 H -0.745 -3.354 -2.855 1.00 . A A . 21 CYS HB2 1 1 15 7670 1 1 21 CYS HB3 H 0.294 -4.728 -3.223 1.00 . A A . 21 CYS HB3 1 1 15 7671 1 1 21 CYS N N 1.635 -2.313 -3.108 1.00 . A A . 21 CYS N 1 1 15 7672 1 1 21 CYS O O 3.098 -4.597 -2.621 1.00 . A A . 21 CYS O 1 1 15 7673 1 1 21 CYS SG S -0.740 -4.952 -1.081 1.00 . A A . 21 CYS SG 1 1 15 7674 1 1 22 ARG C C 3.472 -5.261 1.552 1.00 . A A . 22 ARG C 1 1 15 7675 1 1 22 ARG CA C 3.746 -5.018 0.061 1.00 . A A . 22 ARG CA 1 1 15 7676 1 1 22 ARG CB C 4.986 -4.139 -0.152 1.00 . A A . 22 ARG CB 1 1 15 7677 1 1 22 ARG CD C 7.369 -3.924 -0.660 1.00 . A A . 22 ARG CD 1 1 15 7678 1 1 22 ARG CG C 6.316 -4.847 -0.126 1.00 . A A . 22 ARG CG 1 1 15 7679 1 1 22 ARG CZ C 9.775 -3.975 -1.226 1.00 . A A . 22 ARG CZ 1 1 15 7680 1 1 22 ARG H H 2.018 -3.919 0.231 1.00 . A A . 22 ARG H 1 1 15 7681 1 1 22 ARG HA H 3.865 -5.946 -0.477 1.00 . A A . 22 ARG HA 1 1 15 7682 1 1 22 ARG HB2 H 4.893 -3.649 -1.108 1.00 . A A . 22 ARG HB2 1 1 15 7683 1 1 22 ARG HB3 H 4.992 -3.380 0.616 1.00 . A A . 22 ARG HB3 1 1 15 7684 1 1 22 ARG HD2 H 7.076 -3.630 -1.657 1.00 . A A . 22 ARG HD2 1 1 15 7685 1 1 22 ARG HD3 H 7.403 -3.055 -0.021 1.00 . A A . 22 ARG HD3 1 1 15 7686 1 1 22 ARG HE H 8.736 -5.454 -0.338 1.00 . A A . 22 ARG HE 1 1 15 7687 1 1 22 ARG HG2 H 6.563 -5.115 0.891 1.00 . A A . 22 ARG HG2 1 1 15 7688 1 1 22 ARG HG3 H 6.272 -5.733 -0.743 1.00 . A A . 22 ARG HG3 1 1 15 7689 1 1 22 ARG HH11 H 8.862 -2.227 -1.786 1.00 . A A . 22 ARG HH11 1 1 15 7690 1 1 22 ARG HH12 H 10.516 -2.331 -2.170 1.00 . A A . 22 ARG HH12 1 1 15 7691 1 1 22 ARG HH21 H 11.022 -5.552 -0.850 1.00 . A A . 22 ARG HH21 1 1 15 7692 1 1 22 ARG HH22 H 11.760 -4.221 -1.596 1.00 . A A . 22 ARG HH22 1 1 15 7693 1 1 22 ARG N N 2.640 -4.285 -0.438 1.00 . A A . 22 ARG N 1 1 15 7694 1 1 22 ARG NE N 8.685 -4.546 -0.712 1.00 . A A . 22 ARG NE 1 1 15 7695 1 1 22 ARG NH1 N 9.712 -2.761 -1.754 1.00 . A A . 22 ARG NH1 1 1 15 7696 1 1 22 ARG NH2 N 10.918 -4.625 -1.223 1.00 . A A . 22 ARG NH2 1 1 15 7697 1 1 22 ARG O O 2.315 -5.010 2.035 1.00 . A A . 22 ARG O 1 1 15 7698 1 1 23 LEU C C 3.933 -4.621 4.426 1.00 . A A . 23 LEU C 1 1 15 7699 1 1 23 LEU CA C 4.399 -5.903 3.760 1.00 . A A . 23 LEU CA 1 1 15 7700 1 1 23 LEU CB C 5.729 -6.367 4.410 1.00 . A A . 23 LEU CB 1 1 15 7701 1 1 23 LEU CD1 C 6.774 -7.869 2.660 1.00 . A A . 23 LEU CD1 1 1 15 7702 1 1 23 LEU CD2 C 7.308 -8.223 5.069 1.00 . A A . 23 LEU CD2 1 1 15 7703 1 1 23 LEU CG C 6.249 -7.780 4.073 1.00 . A A . 23 LEU CG 1 1 15 7704 1 1 23 LEU H H 5.343 -5.937 1.859 1.00 . A A . 23 LEU H 1 1 15 7705 1 1 23 LEU HA H 3.642 -6.655 3.924 1.00 . A A . 23 LEU HA 1 1 15 7706 1 1 23 LEU HB2 H 6.496 -5.666 4.120 1.00 . A A . 23 LEU HB2 1 1 15 7707 1 1 23 LEU HB3 H 5.608 -6.302 5.482 1.00 . A A . 23 LEU HB3 1 1 15 7708 1 1 23 LEU HD11 H 7.576 -7.158 2.532 1.00 . A A . 23 LEU HD11 1 1 15 7709 1 1 23 LEU HD12 H 5.977 -7.648 1.965 1.00 . A A . 23 LEU HD12 1 1 15 7710 1 1 23 LEU HD13 H 7.146 -8.866 2.476 1.00 . A A . 23 LEU HD13 1 1 15 7711 1 1 23 LEU HD21 H 8.142 -7.539 5.044 1.00 . A A . 23 LEU HD21 1 1 15 7712 1 1 23 LEU HD22 H 7.649 -9.214 4.809 1.00 . A A . 23 LEU HD22 1 1 15 7713 1 1 23 LEU HD23 H 6.885 -8.240 6.062 1.00 . A A . 23 LEU HD23 1 1 15 7714 1 1 23 LEU HG H 5.421 -8.466 4.148 1.00 . A A . 23 LEU HG 1 1 15 7715 1 1 23 LEU N N 4.501 -5.710 2.302 1.00 . A A . 23 LEU N 1 1 15 7716 1 1 23 LEU O O 3.370 -4.651 5.514 1.00 . A A . 23 LEU O 1 1 15 7717 1 1 24 TRP C C 3.193 -1.525 2.895 1.00 . A A . 24 TRP C 1 1 15 7718 1 1 24 TRP CA C 3.691 -2.231 4.164 1.00 . A A . 24 TRP CA 1 1 15 7719 1 1 24 TRP CB C 4.810 -1.420 4.848 1.00 . A A . 24 TRP CB 1 1 15 7720 1 1 24 TRP CD1 C 5.846 0.499 3.541 1.00 . A A . 24 TRP CD1 1 1 15 7721 1 1 24 TRP CD2 C 6.947 -1.419 3.275 1.00 . A A . 24 TRP CD2 1 1 15 7722 1 1 24 TRP CE2 C 7.591 -0.419 2.520 1.00 . A A . 24 TRP CE2 1 1 15 7723 1 1 24 TRP CE3 C 7.469 -2.707 3.258 1.00 . A A . 24 TRP CE3 1 1 15 7724 1 1 24 TRP CG C 5.824 -0.796 3.923 1.00 . A A . 24 TRP CG 1 1 15 7725 1 1 24 TRP CH2 C 9.213 -1.941 1.765 1.00 . A A . 24 TRP CH2 1 1 15 7726 1 1 24 TRP CZ2 C 8.724 -0.671 1.761 1.00 . A A . 24 TRP CZ2 1 1 15 7727 1 1 24 TRP CZ3 C 8.598 -2.956 2.503 1.00 . A A . 24 TRP CZ3 1 1 15 7728 1 1 24 TRP H H 4.653 -3.543 2.907 1.00 . A A . 24 TRP H 1 1 15 7729 1 1 24 TRP HA H 2.876 -2.402 4.848 1.00 . A A . 24 TRP HA 1 1 15 7730 1 1 24 TRP HB2 H 4.356 -0.617 5.407 1.00 . A A . 24 TRP HB2 1 1 15 7731 1 1 24 TRP HB3 H 5.335 -2.067 5.535 1.00 . A A . 24 TRP HB3 1 1 15 7732 1 1 24 TRP HD1 H 5.108 1.214 3.878 1.00 . A A . 24 TRP HD1 1 1 15 7733 1 1 24 TRP HE1 H 7.127 1.602 2.296 1.00 . A A . 24 TRP HE1 1 1 15 7734 1 1 24 TRP HE3 H 7.005 -3.500 3.825 1.00 . A A . 24 TRP HE3 1 1 15 7735 1 1 24 TRP HH2 H 10.094 -2.181 1.187 1.00 . A A . 24 TRP HH2 1 1 15 7736 1 1 24 TRP HZ2 H 9.212 0.101 1.183 1.00 . A A . 24 TRP HZ2 1 1 15 7737 1 1 24 TRP HZ3 H 9.021 -3.948 2.476 1.00 . A A . 24 TRP HZ3 1 1 15 7738 1 1 24 TRP N N 4.164 -3.509 3.755 1.00 . A A . 24 TRP N 1 1 15 7739 1 1 24 TRP NE1 N 6.900 0.736 2.700 1.00 . A A . 24 TRP NE1 1 1 15 7740 1 1 24 TRP O O 3.531 -1.964 1.798 1.00 . A A . 24 TRP O 1 1 15 7741 1 1 25 CYS C C 2.887 1.396 1.594 1.00 . A A . 25 CYS C 1 1 15 7742 1 1 25 CYS CA C 1.966 0.248 1.848 1.00 . A A . 25 CYS CA 1 1 15 7743 1 1 25 CYS CB C 0.531 0.744 1.955 1.00 . A A . 25 CYS CB 1 1 15 7744 1 1 25 CYS H H 2.091 -0.182 3.901 1.00 . A A . 25 CYS H 1 1 15 7745 1 1 25 CYS HA H 2.040 -0.427 1.009 1.00 . A A . 25 CYS HA 1 1 15 7746 1 1 25 CYS HB2 H 0.341 1.058 2.972 1.00 . A A . 25 CYS HB2 1 1 15 7747 1 1 25 CYS HB3 H 0.401 1.590 1.296 1.00 . A A . 25 CYS HB3 1 1 15 7748 1 1 25 CYS N N 2.395 -0.497 3.021 1.00 . A A . 25 CYS N 1 1 15 7749 1 1 25 CYS O O 3.232 2.148 2.512 1.00 . A A . 25 CYS O 1 1 15 7750 1 1 25 CYS SG S -0.723 -0.490 1.526 1.00 . A A . 25 CYS SG 1 1 15 7751 1 1 26 LYS C C 3.684 3.315 -1.178 1.00 . A A . 26 LYS C 1 1 15 7752 1 1 26 LYS CA C 4.199 2.586 0.026 1.00 . A A . 26 LYS CA 1 1 15 7753 1 1 26 LYS CB C 5.597 2.050 -0.226 1.00 . A A . 26 LYS CB 1 1 15 7754 1 1 26 LYS CD C 7.988 2.629 -0.618 1.00 . A A . 26 LYS CD 1 1 15 7755 1 1 26 LYS CE C 8.943 3.764 -0.883 1.00 . A A . 26 LYS CE 1 1 15 7756 1 1 26 LYS CG C 6.577 3.139 -0.556 1.00 . A A . 26 LYS CG 1 1 15 7757 1 1 26 LYS H H 3.001 0.916 -0.326 1.00 . A A . 26 LYS H 1 1 15 7758 1 1 26 LYS HA H 4.236 3.266 0.863 1.00 . A A . 26 LYS HA 1 1 15 7759 1 1 26 LYS HB2 H 5.940 1.532 0.657 1.00 . A A . 26 LYS HB2 1 1 15 7760 1 1 26 LYS HB3 H 5.565 1.358 -1.055 1.00 . A A . 26 LYS HB3 1 1 15 7761 1 1 26 LYS HD2 H 8.238 2.162 0.323 1.00 . A A . 26 LYS HD2 1 1 15 7762 1 1 26 LYS HD3 H 8.069 1.906 -1.415 1.00 . A A . 26 LYS HD3 1 1 15 7763 1 1 26 LYS HE2 H 8.726 4.189 -1.851 1.00 . A A . 26 LYS HE2 1 1 15 7764 1 1 26 LYS HE3 H 8.796 4.516 -0.123 1.00 . A A . 26 LYS HE3 1 1 15 7765 1 1 26 LYS HG2 H 6.311 3.563 -1.512 1.00 . A A . 26 LYS HG2 1 1 15 7766 1 1 26 LYS HG3 H 6.488 3.903 0.199 1.00 . A A . 26 LYS HG3 1 1 15 7767 1 1 26 LYS HZ1 H 10.569 2.941 0.089 1.00 . A A . 26 LYS HZ1 1 1 15 7768 1 1 26 LYS HZ2 H 10.982 4.103 -1.062 1.00 . A A . 26 LYS HZ2 1 1 15 7769 1 1 26 LYS HZ3 H 10.504 2.559 -1.547 1.00 . A A . 26 LYS HZ3 1 1 15 7770 1 1 26 LYS N N 3.310 1.534 0.373 1.00 . A A . 26 LYS N 1 1 15 7771 1 1 26 LYS NZ N 10.338 3.317 -0.853 1.00 . A A . 26 LYS NZ 1 1 15 7772 1 1 26 LYS O O 3.496 2.712 -2.234 1.00 . A A . 26 LYS O 1 1 15 7773 1 1 27 LYS C C 3.916 5.599 -3.224 1.00 . A A . 27 LYS C 1 1 15 7774 1 1 27 LYS CA C 2.914 5.391 -2.102 1.00 . A A . 27 LYS CA 1 1 15 7775 1 1 27 LYS CB C 2.340 6.705 -1.563 1.00 . A A . 27 LYS CB 1 1 15 7776 1 1 27 LYS CD C 2.690 8.738 -0.089 1.00 . A A . 27 LYS CD 1 1 15 7777 1 1 27 LYS CE C 1.655 9.573 -0.847 1.00 . A A . 27 LYS CE 1 1 15 7778 1 1 27 LYS CG C 3.359 7.662 -0.952 1.00 . A A . 27 LYS CG 1 1 15 7779 1 1 27 LYS H H 3.731 5.028 -0.191 1.00 . A A . 27 LYS H 1 1 15 7780 1 1 27 LYS HA H 2.107 4.811 -2.521 1.00 . A A . 27 LYS HA 1 1 15 7781 1 1 27 LYS HB2 H 1.845 7.212 -2.377 1.00 . A A . 27 LYS HB2 1 1 15 7782 1 1 27 LYS HB3 H 1.599 6.461 -0.818 1.00 . A A . 27 LYS HB3 1 1 15 7783 1 1 27 LYS HD2 H 2.195 8.256 0.741 1.00 . A A . 27 LYS HD2 1 1 15 7784 1 1 27 LYS HD3 H 3.459 9.392 0.293 1.00 . A A . 27 LYS HD3 1 1 15 7785 1 1 27 LYS HE2 H 0.895 8.911 -1.233 1.00 . A A . 27 LYS HE2 1 1 15 7786 1 1 27 LYS HE3 H 1.200 10.264 -0.153 1.00 . A A . 27 LYS HE3 1 1 15 7787 1 1 27 LYS HG2 H 4.051 7.101 -0.344 1.00 . A A . 27 LYS HG2 1 1 15 7788 1 1 27 LYS HG3 H 3.900 8.144 -1.754 1.00 . A A . 27 LYS HG3 1 1 15 7789 1 1 27 LYS HZ1 H 2.573 9.699 -2.730 1.00 . A A . 27 LYS HZ1 1 1 15 7790 1 1 27 LYS HZ2 H 3.019 10.941 -1.674 1.00 . A A . 27 LYS HZ2 1 1 15 7791 1 1 27 LYS HZ3 H 1.498 10.936 -2.381 1.00 . A A . 27 LYS HZ3 1 1 15 7792 1 1 27 LYS N N 3.474 4.598 -1.036 1.00 . A A . 27 LYS N 1 1 15 7793 1 1 27 LYS NZ N 2.237 10.329 -1.976 1.00 . A A . 27 LYS NZ 1 1 15 7794 1 1 27 LYS O O 5.129 5.702 -2.995 1.00 . A A . 27 LYS O 1 1 15 7795 1 1 28 LYS C C 4.344 7.224 -5.837 1.00 . A A . 28 LYS C 1 1 15 7796 1 1 28 LYS CA C 4.232 5.740 -5.599 1.00 . A A . 28 LYS CA 1 1 15 7797 1 1 28 LYS CB C 3.544 5.070 -6.808 1.00 . A A . 28 LYS CB 1 1 15 7798 1 1 28 LYS CD C 5.413 3.707 -7.811 1.00 . A A . 28 LYS CD 1 1 15 7799 1 1 28 LYS CE C 6.286 3.426 -9.035 1.00 . A A . 28 LYS CE 1 1 15 7800 1 1 28 LYS CG C 4.432 4.853 -8.038 1.00 . A A . 28 LYS CG 1 1 15 7801 1 1 28 LYS H H 2.443 5.502 -4.533 1.00 . A A . 28 LYS H 1 1 15 7802 1 1 28 LYS HA H 5.205 5.306 -5.434 1.00 . A A . 28 LYS HA 1 1 15 7803 1 1 28 LYS HB2 H 3.168 4.107 -6.496 1.00 . A A . 28 LYS HB2 1 1 15 7804 1 1 28 LYS HB3 H 2.705 5.683 -7.102 1.00 . A A . 28 LYS HB3 1 1 15 7805 1 1 28 LYS HD2 H 6.054 3.958 -6.980 1.00 . A A . 28 LYS HD2 1 1 15 7806 1 1 28 LYS HD3 H 4.852 2.817 -7.569 1.00 . A A . 28 LYS HD3 1 1 15 7807 1 1 28 LYS HE2 H 6.837 2.514 -8.868 1.00 . A A . 28 LYS HE2 1 1 15 7808 1 1 28 LYS HE3 H 5.640 3.294 -9.892 1.00 . A A . 28 LYS HE3 1 1 15 7809 1 1 28 LYS HG2 H 3.809 4.617 -8.887 1.00 . A A . 28 LYS HG2 1 1 15 7810 1 1 28 LYS HG3 H 4.987 5.758 -8.235 1.00 . A A . 28 LYS HG3 1 1 15 7811 1 1 28 LYS HZ1 H 6.817 5.428 -9.563 1.00 . A A . 28 LYS HZ1 1 1 15 7812 1 1 28 LYS HZ2 H 7.837 4.244 -10.144 1.00 . A A . 28 LYS HZ2 1 1 15 7813 1 1 28 LYS HZ3 H 7.896 4.645 -8.518 1.00 . A A . 28 LYS HZ3 1 1 15 7814 1 1 28 LYS N N 3.419 5.583 -4.422 1.00 . A A . 28 LYS N 1 1 15 7815 1 1 28 LYS NZ N 7.254 4.511 -9.325 1.00 . A A . 28 LYS NZ 1 1 15 7816 1 1 28 LYS O O 3.332 7.897 -6.023 1.00 . A A . 28 LYS O 1 1 15 7817 1 1 29 LEU C C 5.468 9.542 -7.384 1.00 . A A . 29 LEU C 1 1 15 7818 1 1 29 LEU CA C 5.754 9.161 -5.944 1.00 . A A . 29 LEU CA 1 1 15 7819 1 1 29 LEU CB C 7.192 9.518 -5.558 1.00 . A A . 29 LEU CB 1 1 15 7820 1 1 29 LEU CD1 C 9.063 9.483 -3.878 1.00 . A A . 29 LEU CD1 1 1 15 7821 1 1 29 LEU CD2 C 6.702 9.652 -3.087 1.00 . A A . 29 LEU CD2 1 1 15 7822 1 1 29 LEU CG C 7.627 9.081 -4.150 1.00 . A A . 29 LEU CG 1 1 15 7823 1 1 29 LEU H H 6.303 7.142 -5.623 1.00 . A A . 29 LEU H 1 1 15 7824 1 1 29 LEU HA H 5.068 9.687 -5.298 1.00 . A A . 29 LEU HA 1 1 15 7825 1 1 29 LEU HB2 H 7.855 9.062 -6.277 1.00 . A A . 29 LEU HB2 1 1 15 7826 1 1 29 LEU HB3 H 7.301 10.590 -5.624 1.00 . A A . 29 LEU HB3 1 1 15 7827 1 1 29 LEU HD11 H 9.712 9.015 -4.604 1.00 . A A . 29 LEU HD11 1 1 15 7828 1 1 29 LEU HD12 H 9.344 9.162 -2.885 1.00 . A A . 29 LEU HD12 1 1 15 7829 1 1 29 LEU HD13 H 9.158 10.556 -3.949 1.00 . A A . 29 LEU HD13 1 1 15 7830 1 1 29 LEU HD21 H 7.049 9.356 -2.109 1.00 . A A . 29 LEU HD21 1 1 15 7831 1 1 29 LEU HD22 H 5.703 9.270 -3.239 1.00 . A A . 29 LEU HD22 1 1 15 7832 1 1 29 LEU HD23 H 6.690 10.729 -3.158 1.00 . A A . 29 LEU HD23 1 1 15 7833 1 1 29 LEU HG H 7.580 8.003 -4.095 1.00 . A A . 29 LEU HG 1 1 15 7834 1 1 29 LEU N N 5.537 7.738 -5.778 1.00 . A A . 29 LEU N 1 1 15 7835 1 1 29 LEU O O 4.713 10.482 -7.671 1.00 . A A . 29 LEU O 1 1 15 7836 1 1 30 TRP C C 5.986 7.589 -10.277 1.00 . A A . 30 TRP C 1 1 15 7837 1 1 30 TRP CA C 5.847 8.948 -9.672 1.00 . A A . 30 TRP CA 1 1 15 7838 1 1 30 TRP CB C 6.879 9.925 -10.248 1.00 . A A . 30 TRP CB 1 1 15 7839 1 1 30 TRP CD1 C 5.886 11.290 -12.163 1.00 . A A . 30 TRP CD1 1 1 15 7840 1 1 30 TRP CD2 C 7.253 9.657 -12.841 1.00 . A A . 30 TRP CD2 1 1 15 7841 1 1 30 TRP CE2 C 6.776 10.337 -13.975 1.00 . A A . 30 TRP CE2 1 1 15 7842 1 1 30 TRP CE3 C 8.134 8.589 -13.022 1.00 . A A . 30 TRP CE3 1 1 15 7843 1 1 30 TRP CG C 6.666 10.284 -11.688 1.00 . A A . 30 TRP CG 1 1 15 7844 1 1 30 TRP CH2 C 8.009 8.938 -15.412 1.00 . A A . 30 TRP CH2 1 1 15 7845 1 1 30 TRP CZ2 C 7.147 9.986 -15.267 1.00 . A A . 30 TRP CZ2 1 1 15 7846 1 1 30 TRP CZ3 C 8.502 8.240 -14.305 1.00 . A A . 30 TRP CZ3 1 1 15 7847 1 1 30 TRP H H 6.595 8.033 -7.973 1.00 . A A . 30 TRP H 1 1 15 7848 1 1 30 TRP HA H 4.847 9.315 -9.847 1.00 . A A . 30 TRP HA 1 1 15 7849 1 1 30 TRP HB2 H 6.854 10.840 -9.677 1.00 . A A . 30 TRP HB2 1 1 15 7850 1 1 30 TRP HB3 H 7.859 9.486 -10.160 1.00 . A A . 30 TRP HB3 1 1 15 7851 1 1 30 TRP HD1 H 5.307 11.953 -11.537 1.00 . A A . 30 TRP HD1 1 1 15 7852 1 1 30 TRP HE1 H 5.474 11.968 -14.112 1.00 . A A . 30 TRP HE1 1 1 15 7853 1 1 30 TRP HE3 H 8.520 8.043 -12.175 1.00 . A A . 30 TRP HE3 1 1 15 7854 1 1 30 TRP HH2 H 8.322 8.631 -16.400 1.00 . A A . 30 TRP HH2 1 1 15 7855 1 1 30 TRP HZ2 H 6.777 10.513 -16.135 1.00 . A A . 30 TRP HZ2 1 1 15 7856 1 1 30 TRP HZ3 H 9.183 7.416 -14.463 1.00 . A A . 30 TRP HZ3 1 1 15 7857 1 1 30 TRP N N 6.030 8.777 -8.270 1.00 . A A . 30 TRP N 1 1 15 7858 1 1 30 TRP NE1 N 5.944 11.324 -13.535 1.00 . A A . 30 TRP NE1 1 1 15 7859 1 1 30 TRP O O 7.114 7.057 -10.276 1.00 . A A . 30 TRP O 1 1 15 7860 1 1 30 TRP OXT O 4.977 7.006 -10.688 1.00 . A A . 30 TRP OXT 1 1 16 7861 1 1 1 TYR C C -10.555 3.015 1.487 1.00 . A A . 1 TYR C 1 1 16 7862 1 1 1 TYR CA C -11.764 3.569 2.214 1.00 . A A . 1 TYR CA 1 1 16 7863 1 1 1 TYR CB C -11.487 5.017 2.664 1.00 . A A . 1 TYR CB 1 1 16 7864 1 1 1 TYR CD1 C -12.562 5.530 4.885 1.00 . A A . 1 TYR CD1 1 1 16 7865 1 1 1 TYR CD2 C -13.637 6.323 2.917 1.00 . A A . 1 TYR CD2 1 1 16 7866 1 1 1 TYR CE1 C -13.544 6.085 5.655 1.00 . A A . 1 TYR CE1 1 1 16 7867 1 1 1 TYR CE2 C -14.630 6.886 3.690 1.00 . A A . 1 TYR CE2 1 1 16 7868 1 1 1 TYR CG C -12.586 5.634 3.501 1.00 . A A . 1 TYR CG 1 1 16 7869 1 1 1 TYR CZ C -14.574 6.762 5.062 1.00 . A A . 1 TYR CZ 1 1 16 7870 1 1 1 TYR H1 H -12.892 3.067 3.873 1.00 . A A . 1 TYR H1 1 1 16 7871 1 1 1 TYR H2 H -11.256 2.594 3.976 1.00 . A A . 1 TYR H2 1 1 16 7872 1 1 1 TYR H3 H -12.317 1.773 2.974 1.00 . A A . 1 TYR H3 1 1 16 7873 1 1 1 TYR HA H -12.608 3.556 1.539 1.00 . A A . 1 TYR HA 1 1 16 7874 1 1 1 TYR HB2 H -10.577 5.043 3.242 1.00 . A A . 1 TYR HB2 1 1 16 7875 1 1 1 TYR HB3 H -11.355 5.631 1.785 1.00 . A A . 1 TYR HB3 1 1 16 7876 1 1 1 TYR HD1 H -11.755 5.003 5.370 1.00 . A A . 1 TYR HD1 1 1 16 7877 1 1 1 TYR HD2 H -13.678 6.418 1.841 1.00 . A A . 1 TYR HD2 1 1 16 7878 1 1 1 TYR HE1 H -13.501 5.988 6.731 1.00 . A A . 1 TYR HE1 1 1 16 7879 1 1 1 TYR HE2 H -15.442 7.420 3.218 1.00 . A A . 1 TYR HE2 1 1 16 7880 1 1 1 TYR HH H -16.413 7.034 5.506 1.00 . A A . 1 TYR HH 1 1 16 7881 1 1 1 TYR N N -12.073 2.713 3.345 1.00 . A A . 1 TYR N 1 1 16 7882 1 1 1 TYR O O -10.685 2.399 0.438 1.00 . A A . 1 TYR O 1 1 16 7883 1 1 1 TYR OH O -15.554 7.316 5.845 1.00 . A A . 1 TYR OH 1 1 16 7884 1 1 2 CYS C C -7.116 2.412 2.495 1.00 . A A . 2 CYS C 1 1 16 7885 1 1 2 CYS CA C -8.149 2.741 1.463 1.00 . A A . 2 CYS CA 1 1 16 7886 1 1 2 CYS CB C -7.580 3.817 0.524 1.00 . A A . 2 CYS CB 1 1 16 7887 1 1 2 CYS H H -9.303 3.576 2.972 1.00 . A A . 2 CYS H 1 1 16 7888 1 1 2 CYS HA H -8.370 1.866 0.873 1.00 . A A . 2 CYS HA 1 1 16 7889 1 1 2 CYS HB2 H -7.652 4.772 1.022 1.00 . A A . 2 CYS HB2 1 1 16 7890 1 1 2 CYS HB3 H -6.540 3.599 0.327 1.00 . A A . 2 CYS HB3 1 1 16 7891 1 1 2 CYS N N -9.384 3.176 2.078 1.00 . A A . 2 CYS N 1 1 16 7892 1 1 2 CYS O O -7.094 3.014 3.566 1.00 . A A . 2 CYS O 1 1 16 7893 1 1 2 CYS SG S -8.435 3.975 -1.071 1.00 . A A . 2 CYS SG 1 1 16 7894 1 1 3 GLN C C -4.053 2.110 2.616 1.00 . A A . 3 GLN C 1 1 16 7895 1 1 3 GLN CA C -5.146 1.145 3.010 1.00 . A A . 3 GLN CA 1 1 16 7896 1 1 3 GLN CB C -4.676 -0.304 2.813 1.00 . A A . 3 GLN CB 1 1 16 7897 1 1 3 GLN CD C -6.182 -1.363 4.577 1.00 . A A . 3 GLN CD 1 1 16 7898 1 1 3 GLN CG C -5.722 -1.367 3.132 1.00 . A A . 3 GLN CG 1 1 16 7899 1 1 3 GLN H H -6.435 0.926 1.370 1.00 . A A . 3 GLN H 1 1 16 7900 1 1 3 GLN HA H -5.431 1.310 4.038 1.00 . A A . 3 GLN HA 1 1 16 7901 1 1 3 GLN HB2 H -4.382 -0.431 1.783 1.00 . A A . 3 GLN HB2 1 1 16 7902 1 1 3 GLN HB3 H -3.814 -0.478 3.441 1.00 . A A . 3 GLN HB3 1 1 16 7903 1 1 3 GLN HE21 H -4.382 -0.857 5.196 1.00 . A A . 3 GLN HE21 1 1 16 7904 1 1 3 GLN HE22 H -5.581 -1.003 6.420 1.00 . A A . 3 GLN HE22 1 1 16 7905 1 1 3 GLN HG2 H -6.587 -1.201 2.505 1.00 . A A . 3 GLN HG2 1 1 16 7906 1 1 3 GLN HG3 H -5.297 -2.332 2.901 1.00 . A A . 3 GLN HG3 1 1 16 7907 1 1 3 GLN N N -6.276 1.451 2.184 1.00 . A A . 3 GLN N 1 1 16 7908 1 1 3 GLN NE2 N -5.297 -1.053 5.481 1.00 . A A . 3 GLN NE2 1 1 16 7909 1 1 3 GLN O O -3.547 2.064 1.489 1.00 . A A . 3 GLN O 1 1 16 7910 1 1 3 GLN OE1 O -7.330 -1.703 4.877 1.00 . A A . 3 GLN OE1 1 1 16 7911 1 1 4 LYS C C -1.397 3.613 3.456 1.00 . A A . 4 LYS C 1 1 16 7912 1 1 4 LYS CA C -2.820 4.093 3.262 1.00 . A A . 4 LYS CA 1 1 16 7913 1 1 4 LYS CB C -3.076 5.230 4.249 1.00 . A A . 4 LYS CB 1 1 16 7914 1 1 4 LYS CD C -4.643 6.821 5.334 1.00 . A A . 4 LYS CD 1 1 16 7915 1 1 4 LYS CE C -6.064 7.341 5.433 1.00 . A A . 4 LYS CE 1 1 16 7916 1 1 4 LYS CG C -4.493 5.768 4.259 1.00 . A A . 4 LYS CG 1 1 16 7917 1 1 4 LYS H H -4.214 2.982 4.376 1.00 . A A . 4 LYS H 1 1 16 7918 1 1 4 LYS HA H -2.957 4.474 2.263 1.00 . A A . 4 LYS HA 1 1 16 7919 1 1 4 LYS HB2 H -2.847 4.877 5.243 1.00 . A A . 4 LYS HB2 1 1 16 7920 1 1 4 LYS HB3 H -2.406 6.045 4.011 1.00 . A A . 4 LYS HB3 1 1 16 7921 1 1 4 LYS HD2 H -4.365 6.392 6.284 1.00 . A A . 4 LYS HD2 1 1 16 7922 1 1 4 LYS HD3 H -3.980 7.642 5.103 1.00 . A A . 4 LYS HD3 1 1 16 7923 1 1 4 LYS HE2 H -6.346 7.772 4.484 1.00 . A A . 4 LYS HE2 1 1 16 7924 1 1 4 LYS HE3 H -6.722 6.516 5.663 1.00 . A A . 4 LYS HE3 1 1 16 7925 1 1 4 LYS HG2 H -4.716 6.205 3.296 1.00 . A A . 4 LYS HG2 1 1 16 7926 1 1 4 LYS HG3 H -5.178 4.957 4.460 1.00 . A A . 4 LYS HG3 1 1 16 7927 1 1 4 LYS HZ1 H -7.177 8.678 6.579 1.00 . A A . 4 LYS HZ1 1 1 16 7928 1 1 4 LYS HZ2 H -5.619 9.210 6.265 1.00 . A A . 4 LYS HZ2 1 1 16 7929 1 1 4 LYS HZ3 H -5.881 7.995 7.405 1.00 . A A . 4 LYS HZ3 1 1 16 7930 1 1 4 LYS N N -3.766 3.026 3.505 1.00 . A A . 4 LYS N 1 1 16 7931 1 1 4 LYS NZ N -6.190 8.368 6.486 1.00 . A A . 4 LYS NZ 1 1 16 7932 1 1 4 LYS O O -1.168 2.581 4.078 1.00 . A A . 4 LYS O 1 1 16 7933 1 1 5 TRP C C 1.410 4.070 4.561 1.00 . A A . 5 TRP C 1 1 16 7934 1 1 5 TRP CA C 1.001 4.214 3.094 1.00 . A A . 5 TRP CA 1 1 16 7935 1 1 5 TRP CB C 1.731 5.427 2.462 1.00 . A A . 5 TRP CB 1 1 16 7936 1 1 5 TRP CD1 C 1.759 7.410 4.108 1.00 . A A . 5 TRP CD1 1 1 16 7937 1 1 5 TRP CD2 C 0.165 7.536 2.546 1.00 . A A . 5 TRP CD2 1 1 16 7938 1 1 5 TRP CE2 C 0.051 8.648 3.390 1.00 . A A . 5 TRP CE2 1 1 16 7939 1 1 5 TRP CE3 C -0.731 7.404 1.482 1.00 . A A . 5 TRP CE3 1 1 16 7940 1 1 5 TRP CG C 1.259 6.745 3.025 1.00 . A A . 5 TRP CG 1 1 16 7941 1 1 5 TRP CH2 C -1.780 9.463 2.162 1.00 . A A . 5 TRP CH2 1 1 16 7942 1 1 5 TRP CZ2 C -0.919 9.616 3.212 1.00 . A A . 5 TRP CZ2 1 1 16 7943 1 1 5 TRP CZ3 C -1.692 8.371 1.300 1.00 . A A . 5 TRP CZ3 1 1 16 7944 1 1 5 TRP H H -0.754 5.206 2.470 1.00 . A A . 5 TRP H 1 1 16 7945 1 1 5 TRP HA H 1.275 3.322 2.551 1.00 . A A . 5 TRP HA 1 1 16 7946 1 1 5 TRP HB2 H 2.791 5.345 2.649 1.00 . A A . 5 TRP HB2 1 1 16 7947 1 1 5 TRP HB3 H 1.554 5.435 1.396 1.00 . A A . 5 TRP HB3 1 1 16 7948 1 1 5 TRP HD1 H 2.596 7.067 4.698 1.00 . A A . 5 TRP HD1 1 1 16 7949 1 1 5 TRP HE1 H 1.171 9.194 5.066 1.00 . A A . 5 TRP HE1 1 1 16 7950 1 1 5 TRP HE3 H -0.677 6.565 0.801 1.00 . A A . 5 TRP HE3 1 1 16 7951 1 1 5 TRP HH2 H -2.547 10.199 1.980 1.00 . A A . 5 TRP HH2 1 1 16 7952 1 1 5 TRP HZ2 H -1.001 10.468 3.871 1.00 . A A . 5 TRP HZ2 1 1 16 7953 1 1 5 TRP HZ3 H -2.391 8.285 0.481 1.00 . A A . 5 TRP HZ3 1 1 16 7954 1 1 5 TRP N N -0.459 4.418 2.972 1.00 . A A . 5 TRP N 1 1 16 7955 1 1 5 TRP NE1 N 1.022 8.544 4.342 1.00 . A A . 5 TRP NE1 1 1 16 7956 1 1 5 TRP O O 2.406 3.438 4.897 1.00 . A A . 5 TRP O 1 1 16 7957 1 1 6 MET C C 0.587 3.244 7.408 1.00 . A A . 6 MET C 1 1 16 7958 1 1 6 MET CA C 0.781 4.658 6.848 1.00 . A A . 6 MET CA 1 1 16 7959 1 1 6 MET CB C -0.255 5.613 7.461 1.00 . A A . 6 MET CB 1 1 16 7960 1 1 6 MET CE C -1.294 6.526 11.385 1.00 . A A . 6 MET CE 1 1 16 7961 1 1 6 MET CG C -0.268 5.652 8.975 1.00 . A A . 6 MET CG 1 1 16 7962 1 1 6 MET H H -0.141 5.166 5.024 1.00 . A A . 6 MET H 1 1 16 7963 1 1 6 MET HA H 1.767 5.022 7.092 1.00 . A A . 6 MET HA 1 1 16 7964 1 1 6 MET HB2 H -0.058 6.614 7.102 1.00 . A A . 6 MET HB2 1 1 16 7965 1 1 6 MET HB3 H -1.236 5.317 7.121 1.00 . A A . 6 MET HB3 1 1 16 7966 1 1 6 MET HE1 H -1.441 5.485 11.631 1.00 . A A . 6 MET HE1 1 1 16 7967 1 1 6 MET HE2 H -2.006 7.129 11.929 1.00 . A A . 6 MET HE2 1 1 16 7968 1 1 6 MET HE3 H -0.291 6.821 11.656 1.00 . A A . 6 MET HE3 1 1 16 7969 1 1 6 MET HG2 H -0.456 4.651 9.337 1.00 . A A . 6 MET HG2 1 1 16 7970 1 1 6 MET HG3 H 0.704 5.976 9.312 1.00 . A A . 6 MET HG3 1 1 16 7971 1 1 6 MET N N 0.609 4.673 5.413 1.00 . A A . 6 MET N 1 1 16 7972 1 1 6 MET O O 1.160 2.879 8.432 1.00 . A A . 6 MET O 1 1 16 7973 1 1 6 MET SD S -1.534 6.757 9.625 1.00 . A A . 6 MET SD 1 1 16 7974 1 1 7 TRP C C 0.174 0.089 6.300 1.00 . A A . 7 TRP C 1 1 16 7975 1 1 7 TRP CA C -0.541 1.129 7.155 1.00 . A A . 7 TRP CA 1 1 16 7976 1 1 7 TRP CB C -2.066 0.937 7.097 1.00 . A A . 7 TRP CB 1 1 16 7977 1 1 7 TRP CD1 C -2.443 2.596 9.026 1.00 . A A . 7 TRP CD1 1 1 16 7978 1 1 7 TRP CD2 C -4.105 2.507 7.549 1.00 . A A . 7 TRP CD2 1 1 16 7979 1 1 7 TRP CE2 C -4.428 3.461 8.526 1.00 . A A . 7 TRP CE2 1 1 16 7980 1 1 7 TRP CE3 C -4.998 2.270 6.526 1.00 . A A . 7 TRP CE3 1 1 16 7981 1 1 7 TRP CG C -2.825 1.979 7.872 1.00 . A A . 7 TRP CG 1 1 16 7982 1 1 7 TRP CH2 C -6.478 3.918 7.473 1.00 . A A . 7 TRP CH2 1 1 16 7983 1 1 7 TRP CZ2 C -5.615 4.176 8.497 1.00 . A A . 7 TRP CZ2 1 1 16 7984 1 1 7 TRP CZ3 C -6.179 2.974 6.494 1.00 . A A . 7 TRP CZ3 1 1 16 7985 1 1 7 TRP H H -0.517 2.762 5.839 1.00 . A A . 7 TRP H 1 1 16 7986 1 1 7 TRP HA H -0.213 1.025 8.178 1.00 . A A . 7 TRP HA 1 1 16 7987 1 1 7 TRP HB2 H -2.379 1.012 6.066 1.00 . A A . 7 TRP HB2 1 1 16 7988 1 1 7 TRP HB3 H -2.345 -0.036 7.471 1.00 . A A . 7 TRP HB3 1 1 16 7989 1 1 7 TRP HD1 H -1.508 2.405 9.535 1.00 . A A . 7 TRP HD1 1 1 16 7990 1 1 7 TRP HE1 H -3.342 4.084 10.204 1.00 . A A . 7 TRP HE1 1 1 16 7991 1 1 7 TRP HE3 H -4.765 1.533 5.774 1.00 . A A . 7 TRP HE3 1 1 16 7992 1 1 7 TRP HH2 H -7.416 4.447 7.412 1.00 . A A . 7 TRP HH2 1 1 16 7993 1 1 7 TRP HZ2 H -5.860 4.912 9.247 1.00 . A A . 7 TRP HZ2 1 1 16 7994 1 1 7 TRP HZ3 H -6.889 2.799 5.698 1.00 . A A . 7 TRP HZ3 1 1 16 7995 1 1 7 TRP N N -0.190 2.459 6.714 1.00 . A A . 7 TRP N 1 1 16 7996 1 1 7 TRP NE1 N -3.393 3.507 9.410 1.00 . A A . 7 TRP NE1 1 1 16 7997 1 1 7 TRP O O 1.100 0.420 5.538 1.00 . A A . 7 TRP O 1 1 16 7998 1 1 8 THR C C -0.664 -3.011 4.952 1.00 . A A . 8 THR C 1 1 16 7999 1 1 8 THR CA C 0.413 -2.227 5.724 1.00 . A A . 8 THR CA 1 1 16 8000 1 1 8 THR CB C 1.136 -3.149 6.745 1.00 . A A . 8 THR CB 1 1 16 8001 1 1 8 THR CG2 C 2.273 -2.408 7.445 1.00 . A A . 8 THR CG2 1 1 16 8002 1 1 8 THR H H -0.961 -1.392 7.024 1.00 . A A . 8 THR H 1 1 16 8003 1 1 8 THR HA H 1.133 -1.790 5.053 1.00 . A A . 8 THR HA 1 1 16 8004 1 1 8 THR HB H 1.538 -4.006 6.225 1.00 . A A . 8 THR HB 1 1 16 8005 1 1 8 THR HG1 H 0.157 -4.552 7.675 1.00 . A A . 8 THR HG1 1 1 16 8006 1 1 8 THR HG21 H 3.005 -2.066 6.728 1.00 . A A . 8 THR HG21 1 1 16 8007 1 1 8 THR HG22 H 2.756 -3.060 8.156 1.00 . A A . 8 THR HG22 1 1 16 8008 1 1 8 THR HG23 H 1.865 -1.554 7.964 1.00 . A A . 8 THR HG23 1 1 16 8009 1 1 8 THR N N -0.215 -1.148 6.435 1.00 . A A . 8 THR N 1 1 16 8010 1 1 8 THR O O -1.861 -2.846 5.250 1.00 . A A . 8 THR O 1 1 16 8011 1 1 8 THR OG1 O 0.202 -3.591 7.755 1.00 . A A . 8 THR OG1 1 1 16 8012 1 1 9 CYS C C -0.994 -6.058 3.265 1.00 . A A . 9 CYS C 1 1 16 8013 1 1 9 CYS CA C -1.342 -4.589 3.297 1.00 . A A . 9 CYS CA 1 1 16 8014 1 1 9 CYS CB C -1.599 -4.071 1.888 1.00 . A A . 9 CYS CB 1 1 16 8015 1 1 9 CYS H H 0.625 -3.972 3.627 1.00 . A A . 9 CYS H 1 1 16 8016 1 1 9 CYS HA H -2.242 -4.467 3.882 1.00 . A A . 9 CYS HA 1 1 16 8017 1 1 9 CYS HB2 H -2.499 -4.525 1.502 1.00 . A A . 9 CYS HB2 1 1 16 8018 1 1 9 CYS HB3 H -1.734 -3.000 1.927 1.00 . A A . 9 CYS HB3 1 1 16 8019 1 1 9 CYS N N -0.296 -3.837 3.958 1.00 . A A . 9 CYS N 1 1 16 8020 1 1 9 CYS O O 0.085 -6.459 3.748 1.00 . A A . 9 CYS O 1 1 16 8021 1 1 9 CYS SG S -0.274 -4.416 0.717 1.00 . A A . 9 CYS SG 1 1 16 8022 1 1 10 ASP C C -2.428 -8.656 1.310 1.00 . A A . 10 ASP C 1 1 16 8023 1 1 10 ASP CA C -1.695 -8.278 2.589 1.00 . A A . 10 ASP CA 1 1 16 8024 1 1 10 ASP CB C -2.307 -8.974 3.801 1.00 . A A . 10 ASP CB 1 1 16 8025 1 1 10 ASP CG C -1.781 -10.360 4.024 1.00 . A A . 10 ASP CG 1 1 16 8026 1 1 10 ASP H H -2.725 -6.478 2.362 1.00 . A A . 10 ASP H 1 1 16 8027 1 1 10 ASP HA H -0.641 -8.496 2.501 1.00 . A A . 10 ASP HA 1 1 16 8028 1 1 10 ASP HB2 H -2.105 -8.388 4.685 1.00 . A A . 10 ASP HB2 1 1 16 8029 1 1 10 ASP HB3 H -3.373 -9.037 3.647 1.00 . A A . 10 ASP HB3 1 1 16 8030 1 1 10 ASP N N -1.886 -6.851 2.726 1.00 . A A . 10 ASP N 1 1 16 8031 1 1 10 ASP O O -2.707 -7.772 0.514 1.00 . A A . 10 ASP O 1 1 16 8032 1 1 10 ASP OD1 O -2.384 -11.329 3.530 1.00 . A A . 10 ASP OD1 1 1 16 8033 1 1 10 ASP OD2 O -0.747 -10.506 4.707 1.00 . A A . 10 ASP OD2 1 1 16 8034 1 1 11 SER C C -4.971 -9.878 0.055 1.00 . A A . 11 SER C 1 1 16 8035 1 1 11 SER CA C -3.496 -10.217 -0.134 1.00 . A A . 11 SER CA 1 1 16 8036 1 1 11 SER CB C -3.298 -11.673 -0.570 1.00 . A A . 11 SER CB 1 1 16 8037 1 1 11 SER H H -2.535 -10.627 1.713 1.00 . A A . 11 SER H 1 1 16 8038 1 1 11 SER HA H -3.111 -9.557 -0.900 1.00 . A A . 11 SER HA 1 1 16 8039 1 1 11 SER HB2 H -3.882 -11.852 -1.459 1.00 . A A . 11 SER HB2 1 1 16 8040 1 1 11 SER HB3 H -2.257 -11.841 -0.798 1.00 . A A . 11 SER HB3 1 1 16 8041 1 1 11 SER HG H -4.265 -13.232 -0.031 1.00 . A A . 11 SER HG 1 1 16 8042 1 1 11 SER N N -2.762 -9.907 1.082 1.00 . A A . 11 SER N 1 1 16 8043 1 1 11 SER O O -5.719 -9.686 -0.906 1.00 . A A . 11 SER O 1 1 16 8044 1 1 11 SER OG O -3.704 -12.596 0.434 1.00 . A A . 11 SER OG 1 1 16 8045 1 1 12 GLU C C -6.924 -7.935 1.639 1.00 . A A . 12 GLU C 1 1 16 8046 1 1 12 GLU CA C -6.722 -9.448 1.687 1.00 . A A . 12 GLU CA 1 1 16 8047 1 1 12 GLU CB C -7.046 -10.016 3.063 1.00 . A A . 12 GLU CB 1 1 16 8048 1 1 12 GLU CD C -7.254 -12.094 4.462 1.00 . A A . 12 GLU CD 1 1 16 8049 1 1 12 GLU CG C -6.956 -11.528 3.107 1.00 . A A . 12 GLU CG 1 1 16 8050 1 1 12 GLU H H -4.696 -9.957 2.008 1.00 . A A . 12 GLU H 1 1 16 8051 1 1 12 GLU HA H -7.377 -9.901 0.957 1.00 . A A . 12 GLU HA 1 1 16 8052 1 1 12 GLU HB2 H -6.346 -9.613 3.778 1.00 . A A . 12 GLU HB2 1 1 16 8053 1 1 12 GLU HB3 H -8.047 -9.726 3.342 1.00 . A A . 12 GLU HB3 1 1 16 8054 1 1 12 GLU HG2 H -7.659 -11.940 2.399 1.00 . A A . 12 GLU HG2 1 1 16 8055 1 1 12 GLU HG3 H -5.956 -11.819 2.821 1.00 . A A . 12 GLU HG3 1 1 16 8056 1 1 12 GLU N N -5.368 -9.784 1.318 1.00 . A A . 12 GLU N 1 1 16 8057 1 1 12 GLU O O -7.707 -7.433 0.825 1.00 . A A . 12 GLU O 1 1 16 8058 1 1 12 GLU OE1 O -8.438 -12.081 4.884 1.00 . A A . 12 GLU OE1 1 1 16 8059 1 1 12 GLU OE2 O -6.326 -12.600 5.124 1.00 . A A . 12 GLU OE2 1 1 16 8060 1 1 13 ARG C C -5.286 -5.276 1.440 1.00 . A A . 13 ARG C 1 1 16 8061 1 1 13 ARG CA C -6.281 -5.758 2.455 1.00 . A A . 13 ARG CA 1 1 16 8062 1 1 13 ARG CB C -5.932 -5.147 3.814 1.00 . A A . 13 ARG CB 1 1 16 8063 1 1 13 ARG CD C -6.499 -4.790 6.228 1.00 . A A . 13 ARG CD 1 1 16 8064 1 1 13 ARG CG C -6.933 -5.421 4.908 1.00 . A A . 13 ARG CG 1 1 16 8065 1 1 13 ARG CZ C -4.391 -4.797 7.581 1.00 . A A . 13 ARG CZ 1 1 16 8066 1 1 13 ARG H H -5.659 -7.652 3.155 1.00 . A A . 13 ARG H 1 1 16 8067 1 1 13 ARG HA H -7.277 -5.455 2.165 1.00 . A A . 13 ARG HA 1 1 16 8068 1 1 13 ARG HB2 H -4.975 -5.533 4.132 1.00 . A A . 13 ARG HB2 1 1 16 8069 1 1 13 ARG HB3 H -5.846 -4.076 3.698 1.00 . A A . 13 ARG HB3 1 1 16 8070 1 1 13 ARG HD2 H -6.339 -3.733 6.071 1.00 . A A . 13 ARG HD2 1 1 16 8071 1 1 13 ARG HD3 H -7.284 -4.929 6.955 1.00 . A A . 13 ARG HD3 1 1 16 8072 1 1 13 ARG HE H -5.108 -6.312 6.449 1.00 . A A . 13 ARG HE 1 1 16 8073 1 1 13 ARG HG2 H -7.891 -5.025 4.613 1.00 . A A . 13 ARG HG2 1 1 16 8074 1 1 13 ARG HG3 H -6.988 -6.494 5.025 1.00 . A A . 13 ARG HG3 1 1 16 8075 1 1 13 ARG HH11 H -5.359 -2.979 7.701 1.00 . A A . 13 ARG HH11 1 1 16 8076 1 1 13 ARG HH12 H -3.923 -3.085 8.590 1.00 . A A . 13 ARG HH12 1 1 16 8077 1 1 13 ARG HH21 H -3.179 -6.433 7.748 1.00 . A A . 13 ARG HH21 1 1 16 8078 1 1 13 ARG HH22 H -2.666 -5.093 8.653 1.00 . A A . 13 ARG HH22 1 1 16 8079 1 1 13 ARG N N -6.232 -7.212 2.492 1.00 . A A . 13 ARG N 1 1 16 8080 1 1 13 ARG NE N -5.262 -5.386 6.745 1.00 . A A . 13 ARG NE 1 1 16 8081 1 1 13 ARG NH1 N -4.579 -3.542 7.982 1.00 . A A . 13 ARG NH1 1 1 16 8082 1 1 13 ARG NH2 N -3.341 -5.481 8.021 1.00 . A A . 13 ARG NH2 1 1 16 8083 1 1 13 ARG O O -4.115 -5.514 1.603 1.00 . A A . 13 ARG O 1 1 16 8084 1 1 14 LYS C C -4.728 -2.635 -0.514 1.00 . A A . 14 LYS C 1 1 16 8085 1 1 14 LYS CA C -4.857 -4.140 -0.647 1.00 . A A . 14 LYS CA 1 1 16 8086 1 1 14 LYS CB C -5.410 -4.469 -2.041 1.00 . A A . 14 LYS CB 1 1 16 8087 1 1 14 LYS CD C -6.175 -6.214 -3.717 1.00 . A A . 14 LYS CD 1 1 16 8088 1 1 14 LYS CE C -7.480 -5.477 -4.022 1.00 . A A . 14 LYS CE 1 1 16 8089 1 1 14 LYS CG C -5.666 -5.948 -2.293 1.00 . A A . 14 LYS CG 1 1 16 8090 1 1 14 LYS H H -6.713 -4.474 0.313 1.00 . A A . 14 LYS H 1 1 16 8091 1 1 14 LYS HA H -3.890 -4.602 -0.527 1.00 . A A . 14 LYS HA 1 1 16 8092 1 1 14 LYS HB2 H -6.343 -3.941 -2.166 1.00 . A A . 14 LYS HB2 1 1 16 8093 1 1 14 LYS HB3 H -4.709 -4.113 -2.782 1.00 . A A . 14 LYS HB3 1 1 16 8094 1 1 14 LYS HD2 H -5.424 -5.888 -4.422 1.00 . A A . 14 LYS HD2 1 1 16 8095 1 1 14 LYS HD3 H -6.336 -7.275 -3.832 1.00 . A A . 14 LYS HD3 1 1 16 8096 1 1 14 LYS HE2 H -8.213 -5.734 -3.274 1.00 . A A . 14 LYS HE2 1 1 16 8097 1 1 14 LYS HE3 H -7.298 -4.413 -3.989 1.00 . A A . 14 LYS HE3 1 1 16 8098 1 1 14 LYS HG2 H -4.745 -6.494 -2.146 1.00 . A A . 14 LYS HG2 1 1 16 8099 1 1 14 LYS HG3 H -6.403 -6.298 -1.585 1.00 . A A . 14 LYS HG3 1 1 16 8100 1 1 14 LYS HZ1 H -7.338 -5.606 -6.121 1.00 . A A . 14 LYS HZ1 1 1 16 8101 1 1 14 LYS HZ2 H -8.898 -5.311 -5.549 1.00 . A A . 14 LYS HZ2 1 1 16 8102 1 1 14 LYS HZ3 H -8.243 -6.844 -5.402 1.00 . A A . 14 LYS HZ3 1 1 16 8103 1 1 14 LYS N N -5.748 -4.640 0.393 1.00 . A A . 14 LYS N 1 1 16 8104 1 1 14 LYS NZ N -8.016 -5.828 -5.362 1.00 . A A . 14 LYS NZ 1 1 16 8105 1 1 14 LYS O O -5.651 -1.981 -0.042 1.00 . A A . 14 LYS O 1 1 16 8106 1 1 15 CYS C C -4.096 -0.070 -2.130 1.00 . A A . 15 CYS C 1 1 16 8107 1 1 15 CYS CA C -3.417 -0.642 -0.888 1.00 . A A . 15 CYS CA 1 1 16 8108 1 1 15 CYS CB C -1.922 -0.290 -0.921 1.00 . A A . 15 CYS CB 1 1 16 8109 1 1 15 CYS H H -2.861 -2.659 -1.194 1.00 . A A . 15 CYS H 1 1 16 8110 1 1 15 CYS HA H -3.879 -0.218 -0.011 1.00 . A A . 15 CYS HA 1 1 16 8111 1 1 15 CYS HB2 H -1.540 -0.469 -1.915 1.00 . A A . 15 CYS HB2 1 1 16 8112 1 1 15 CYS HB3 H -1.802 0.757 -0.684 1.00 . A A . 15 CYS HB3 1 1 16 8113 1 1 15 CYS N N -3.601 -2.089 -0.901 1.00 . A A . 15 CYS N 1 1 16 8114 1 1 15 CYS O O -4.158 -0.752 -3.166 1.00 . A A . 15 CYS O 1 1 16 8115 1 1 15 CYS SG S -0.890 -1.247 0.240 1.00 . A A . 15 CYS SG 1 1 16 8116 1 1 16 CYS C C -4.199 2.190 -4.239 1.00 . A A . 16 CYS C 1 1 16 8117 1 1 16 CYS CA C -5.246 1.743 -3.218 1.00 . A A . 16 CYS CA 1 1 16 8118 1 1 16 CYS CB C -6.199 2.892 -2.845 1.00 . A A . 16 CYS CB 1 1 16 8119 1 1 16 CYS H H -4.599 1.615 -1.195 1.00 . A A . 16 CYS H 1 1 16 8120 1 1 16 CYS HA H -5.820 0.956 -3.685 1.00 . A A . 16 CYS HA 1 1 16 8121 1 1 16 CYS HB2 H -5.702 3.547 -2.144 1.00 . A A . 16 CYS HB2 1 1 16 8122 1 1 16 CYS HB3 H -6.442 3.445 -3.738 1.00 . A A . 16 CYS HB3 1 1 16 8123 1 1 16 CYS N N -4.627 1.128 -2.045 1.00 . A A . 16 CYS N 1 1 16 8124 1 1 16 CYS O O -3.000 2.280 -3.913 1.00 . A A . 16 CYS O 1 1 16 8125 1 1 16 CYS SG S -7.768 2.346 -2.074 1.00 . A A . 16 CYS SG 1 1 16 8126 1 1 17 LYS C C -2.985 4.041 -6.247 1.00 . A A . 17 LYS C 1 1 16 8127 1 1 17 LYS CA C -3.818 2.812 -6.588 1.00 . A A . 17 LYS CA 1 1 16 8128 1 1 17 LYS CB C -4.687 3.060 -7.824 1.00 . A A . 17 LYS CB 1 1 16 8129 1 1 17 LYS CD C -4.828 3.614 -10.258 1.00 . A A . 17 LYS CD 1 1 16 8130 1 1 17 LYS CE C -4.065 4.055 -11.497 1.00 . A A . 17 LYS CE 1 1 16 8131 1 1 17 LYS CG C -3.910 3.433 -9.071 1.00 . A A . 17 LYS CG 1 1 16 8132 1 1 17 LYS H H -5.613 2.307 -5.633 1.00 . A A . 17 LYS H 1 1 16 8133 1 1 17 LYS HA H -3.149 1.991 -6.796 1.00 . A A . 17 LYS HA 1 1 16 8134 1 1 17 LYS HB2 H -5.250 2.163 -8.035 1.00 . A A . 17 LYS HB2 1 1 16 8135 1 1 17 LYS HB3 H -5.379 3.859 -7.604 1.00 . A A . 17 LYS HB3 1 1 16 8136 1 1 17 LYS HD2 H -5.306 2.668 -10.467 1.00 . A A . 17 LYS HD2 1 1 16 8137 1 1 17 LYS HD3 H -5.580 4.351 -10.018 1.00 . A A . 17 LYS HD3 1 1 16 8138 1 1 17 LYS HE2 H -3.346 3.288 -11.741 1.00 . A A . 17 LYS HE2 1 1 16 8139 1 1 17 LYS HE3 H -4.761 4.171 -12.314 1.00 . A A . 17 LYS HE3 1 1 16 8140 1 1 17 LYS HG2 H -3.377 4.356 -8.891 1.00 . A A . 17 LYS HG2 1 1 16 8141 1 1 17 LYS HG3 H -3.203 2.645 -9.288 1.00 . A A . 17 LYS HG3 1 1 16 8142 1 1 17 LYS HZ1 H -3.992 6.104 -11.017 1.00 . A A . 17 LYS HZ1 1 1 16 8143 1 1 17 LYS HZ2 H -2.836 5.627 -12.144 1.00 . A A . 17 LYS HZ2 1 1 16 8144 1 1 17 LYS HZ3 H -2.631 5.234 -10.533 1.00 . A A . 17 LYS HZ3 1 1 16 8145 1 1 17 LYS N N -4.653 2.417 -5.467 1.00 . A A . 17 LYS N 1 1 16 8146 1 1 17 LYS NZ N -3.344 5.334 -11.283 1.00 . A A . 17 LYS NZ 1 1 16 8147 1 1 17 LYS O O -3.480 5.005 -5.667 1.00 . A A . 17 LYS O 1 1 16 8148 1 1 18 GLY C C 0.163 4.507 -5.216 1.00 . A A . 18 GLY C 1 1 16 8149 1 1 18 GLY CA C -0.795 5.024 -6.245 1.00 . A A . 18 GLY CA 1 1 16 8150 1 1 18 GLY H H -1.402 3.184 -7.073 1.00 . A A . 18 GLY H 1 1 16 8151 1 1 18 GLY HA2 H -0.258 5.321 -7.132 1.00 . A A . 18 GLY HA2 1 1 16 8152 1 1 18 GLY HA3 H -1.329 5.869 -5.837 1.00 . A A . 18 GLY HA3 1 1 16 8153 1 1 18 GLY N N -1.724 3.973 -6.582 1.00 . A A . 18 GLY N 1 1 16 8154 1 1 18 GLY O O 1.254 5.056 -4.991 1.00 . A A . 18 GLY O 1 1 16 8155 1 1 19 MET C C 0.602 1.290 -4.092 1.00 . A A . 19 MET C 1 1 16 8156 1 1 19 MET CA C 0.522 2.720 -3.636 1.00 . A A . 19 MET CA 1 1 16 8157 1 1 19 MET CB C -0.125 2.814 -2.250 1.00 . A A . 19 MET CB 1 1 16 8158 1 1 19 MET CE C -2.668 4.326 -0.861 1.00 . A A . 19 MET CE 1 1 16 8159 1 1 19 MET CG C 0.007 4.184 -1.603 1.00 . A A . 19 MET CG 1 1 16 8160 1 1 19 MET H H -1.150 3.092 -4.792 1.00 . A A . 19 MET H 1 1 16 8161 1 1 19 MET HA H 1.513 3.145 -3.603 1.00 . A A . 19 MET HA 1 1 16 8162 1 1 19 MET HB2 H -1.174 2.580 -2.348 1.00 . A A . 19 MET HB2 1 1 16 8163 1 1 19 MET HB3 H 0.336 2.084 -1.602 1.00 . A A . 19 MET HB3 1 1 16 8164 1 1 19 MET HE1 H -3.407 4.466 -0.085 1.00 . A A . 19 MET HE1 1 1 16 8165 1 1 19 MET HE2 H -2.826 3.366 -1.329 1.00 . A A . 19 MET HE2 1 1 16 8166 1 1 19 MET HE3 H -2.767 5.109 -1.597 1.00 . A A . 19 MET HE3 1 1 16 8167 1 1 19 MET HG2 H 1.039 4.294 -1.302 1.00 . A A . 19 MET HG2 1 1 16 8168 1 1 19 MET HG3 H -0.247 4.943 -2.328 1.00 . A A . 19 MET HG3 1 1 16 8169 1 1 19 MET N N -0.251 3.439 -4.596 1.00 . A A . 19 MET N 1 1 16 8170 1 1 19 MET O O -0.327 0.788 -4.742 1.00 . A A . 19 MET O 1 1 16 8171 1 1 19 MET SD S -1.025 4.386 -0.139 1.00 . A A . 19 MET SD 1 1 16 8172 1 1 20 VAL C C 1.736 -1.578 -2.952 1.00 . A A . 20 VAL C 1 1 16 8173 1 1 20 VAL CA C 1.879 -0.706 -4.186 1.00 . A A . 20 VAL CA 1 1 16 8174 1 1 20 VAL CB C 3.261 -0.919 -4.905 1.00 . A A . 20 VAL CB 1 1 16 8175 1 1 20 VAL CG1 C 4.449 -0.552 -4.017 1.00 . A A . 20 VAL CG1 1 1 16 8176 1 1 20 VAL CG2 C 3.397 -2.340 -5.439 1.00 . A A . 20 VAL CG2 1 1 16 8177 1 1 20 VAL H H 2.379 1.086 -3.245 1.00 . A A . 20 VAL H 1 1 16 8178 1 1 20 VAL HA H 1.080 -0.955 -4.870 1.00 . A A . 20 VAL HA 1 1 16 8179 1 1 20 VAL HB H 3.284 -0.244 -5.748 1.00 . A A . 20 VAL HB 1 1 16 8180 1 1 20 VAL HG11 H 5.369 -0.717 -4.557 1.00 . A A . 20 VAL HG11 1 1 16 8181 1 1 20 VAL HG12 H 4.438 -1.170 -3.131 1.00 . A A . 20 VAL HG12 1 1 16 8182 1 1 20 VAL HG13 H 4.378 0.487 -3.732 1.00 . A A . 20 VAL HG13 1 1 16 8183 1 1 20 VAL HG21 H 4.355 -2.454 -5.924 1.00 . A A . 20 VAL HG21 1 1 16 8184 1 1 20 VAL HG22 H 2.606 -2.536 -6.148 1.00 . A A . 20 VAL HG22 1 1 16 8185 1 1 20 VAL HG23 H 3.325 -3.038 -4.617 1.00 . A A . 20 VAL HG23 1 1 16 8186 1 1 20 VAL N N 1.683 0.649 -3.796 1.00 . A A . 20 VAL N 1 1 16 8187 1 1 20 VAL O O 2.250 -1.237 -1.867 1.00 . A A . 20 VAL O 1 1 16 8188 1 1 21 CYS C C 1.979 -4.313 -1.677 1.00 . A A . 21 CYS C 1 1 16 8189 1 1 21 CYS CA C 0.717 -3.520 -1.998 1.00 . A A . 21 CYS CA 1 1 16 8190 1 1 21 CYS CB C -0.468 -4.443 -2.323 1.00 . A A . 21 CYS CB 1 1 16 8191 1 1 21 CYS H H 0.579 -2.825 -3.965 1.00 . A A . 21 CYS H 1 1 16 8192 1 1 21 CYS HA H 0.467 -2.914 -1.140 1.00 . A A . 21 CYS HA 1 1 16 8193 1 1 21 CYS HB2 H -1.257 -3.858 -2.770 1.00 . A A . 21 CYS HB2 1 1 16 8194 1 1 21 CYS HB3 H -0.142 -5.194 -3.028 1.00 . A A . 21 CYS HB3 1 1 16 8195 1 1 21 CYS N N 0.981 -2.634 -3.090 1.00 . A A . 21 CYS N 1 1 16 8196 1 1 21 CYS O O 2.528 -5.017 -2.527 1.00 . A A . 21 CYS O 1 1 16 8197 1 1 21 CYS SG S -1.175 -5.304 -0.875 1.00 . A A . 21 CYS SG 1 1 16 8198 1 1 22 ARG C C 3.472 -5.021 1.508 1.00 . A A . 22 ARG C 1 1 16 8199 1 1 22 ARG CA C 3.645 -4.754 -0.011 1.00 . A A . 22 ARG CA 1 1 16 8200 1 1 22 ARG CB C 4.799 -3.737 -0.307 1.00 . A A . 22 ARG CB 1 1 16 8201 1 1 22 ARG CD C 6.613 -5.372 -0.928 1.00 . A A . 22 ARG CD 1 1 16 8202 1 1 22 ARG CG C 6.229 -4.200 -0.051 1.00 . A A . 22 ARG CG 1 1 16 8203 1 1 22 ARG CZ C 8.700 -6.608 -1.448 1.00 . A A . 22 ARG CZ 1 1 16 8204 1 1 22 ARG H H 1.911 -3.642 0.175 1.00 . A A . 22 ARG H 1 1 16 8205 1 1 22 ARG HA H 3.821 -5.673 -0.547 1.00 . A A . 22 ARG HA 1 1 16 8206 1 1 22 ARG HB2 H 4.747 -3.460 -1.350 1.00 . A A . 22 ARG HB2 1 1 16 8207 1 1 22 ARG HB3 H 4.622 -2.851 0.286 1.00 . A A . 22 ARG HB3 1 1 16 8208 1 1 22 ARG HD2 H 5.951 -6.199 -0.719 1.00 . A A . 22 ARG HD2 1 1 16 8209 1 1 22 ARG HD3 H 6.520 -5.084 -1.964 1.00 . A A . 22 ARG HD3 1 1 16 8210 1 1 22 ARG HE H 8.403 -5.406 0.133 1.00 . A A . 22 ARG HE 1 1 16 8211 1 1 22 ARG HG2 H 6.898 -3.380 -0.269 1.00 . A A . 22 ARG HG2 1 1 16 8212 1 1 22 ARG HG3 H 6.340 -4.476 0.986 1.00 . A A . 22 ARG HG3 1 1 16 8213 1 1 22 ARG HH11 H 7.208 -6.980 -2.798 1.00 . A A . 22 ARG HH11 1 1 16 8214 1 1 22 ARG HH12 H 8.680 -7.771 -3.125 1.00 . A A . 22 ARG HH12 1 1 16 8215 1 1 22 ARG HH21 H 10.381 -6.488 -0.312 1.00 . A A . 22 ARG HH21 1 1 16 8216 1 1 22 ARG HH22 H 10.536 -7.486 -1.686 1.00 . A A . 22 ARG HH22 1 1 16 8217 1 1 22 ARG N N 2.436 -4.165 -0.471 1.00 . A A . 22 ARG N 1 1 16 8218 1 1 22 ARG NE N 7.987 -5.789 -0.674 1.00 . A A . 22 ARG NE 1 1 16 8219 1 1 22 ARG NH1 N 8.159 -7.154 -2.526 1.00 . A A . 22 ARG NH1 1 1 16 8220 1 1 22 ARG NH2 N 9.954 -6.883 -1.129 1.00 . A A . 22 ARG NH2 1 1 16 8221 1 1 22 ARG O O 2.338 -4.823 2.082 1.00 . A A . 22 ARG O 1 1 16 8222 1 1 23 LEU C C 4.073 -4.478 4.357 1.00 . A A . 23 LEU C 1 1 16 8223 1 1 23 LEU CA C 4.601 -5.700 3.612 1.00 . A A . 23 LEU CA 1 1 16 8224 1 1 23 LEU CB C 6.031 -6.011 4.057 1.00 . A A . 23 LEU CB 1 1 16 8225 1 1 23 LEU CD1 C 8.093 -7.427 3.938 1.00 . A A . 23 LEU CD1 1 1 16 8226 1 1 23 LEU CD2 C 5.855 -8.456 3.512 1.00 . A A . 23 LEU CD2 1 1 16 8227 1 1 23 LEU CG C 6.704 -7.203 3.374 1.00 . A A . 23 LEU CG 1 1 16 8228 1 1 23 LEU H H 5.343 -5.717 1.633 1.00 . A A . 23 LEU H 1 1 16 8229 1 1 23 LEU HA H 3.970 -6.546 3.833 1.00 . A A . 23 LEU HA 1 1 16 8230 1 1 23 LEU HB2 H 6.640 -5.139 3.869 1.00 . A A . 23 LEU HB2 1 1 16 8231 1 1 23 LEU HB3 H 6.022 -6.198 5.122 1.00 . A A . 23 LEU HB3 1 1 16 8232 1 1 23 LEU HD11 H 8.553 -8.271 3.442 1.00 . A A . 23 LEU HD11 1 1 16 8233 1 1 23 LEU HD12 H 8.024 -7.625 4.997 1.00 . A A . 23 LEU HD12 1 1 16 8234 1 1 23 LEU HD13 H 8.696 -6.545 3.781 1.00 . A A . 23 LEU HD13 1 1 16 8235 1 1 23 LEU HD21 H 6.375 -9.293 3.069 1.00 . A A . 23 LEU HD21 1 1 16 8236 1 1 23 LEU HD22 H 4.914 -8.312 3.001 1.00 . A A . 23 LEU HD22 1 1 16 8237 1 1 23 LEU HD23 H 5.669 -8.655 4.555 1.00 . A A . 23 LEU HD23 1 1 16 8238 1 1 23 LEU HG H 6.814 -6.981 2.322 1.00 . A A . 23 LEU HG 1 1 16 8239 1 1 23 LEU N N 4.554 -5.475 2.160 1.00 . A A . 23 LEU N 1 1 16 8240 1 1 23 LEU O O 3.540 -4.590 5.457 1.00 . A A . 23 LEU O 1 1 16 8241 1 1 24 TRP C C 3.137 -1.431 2.906 1.00 . A A . 24 TRP C 1 1 16 8242 1 1 24 TRP CA C 3.647 -2.111 4.171 1.00 . A A . 24 TRP CA 1 1 16 8243 1 1 24 TRP CB C 4.667 -1.220 4.905 1.00 . A A . 24 TRP CB 1 1 16 8244 1 1 24 TRP CD1 C 5.653 0.749 3.645 1.00 . A A . 24 TRP CD1 1 1 16 8245 1 1 24 TRP CD2 C 6.852 -1.119 3.439 1.00 . A A . 24 TRP CD2 1 1 16 8246 1 1 24 TRP CE2 C 7.484 -0.102 2.702 1.00 . A A . 24 TRP CE2 1 1 16 8247 1 1 24 TRP CE3 C 7.423 -2.386 3.462 1.00 . A A . 24 TRP CE3 1 1 16 8248 1 1 24 TRP CG C 5.681 -0.545 4.032 1.00 . A A . 24 TRP CG 1 1 16 8249 1 1 24 TRP CH2 C 9.194 -1.576 2.031 1.00 . A A . 24 TRP CH2 1 1 16 8250 1 1 24 TRP CZ2 C 8.660 -0.321 1.993 1.00 . A A . 24 TRP CZ2 1 1 16 8251 1 1 24 TRP CZ3 C 8.585 -2.604 2.757 1.00 . A A . 24 TRP CZ3 1 1 16 8252 1 1 24 TRP H H 4.728 -3.295 2.894 1.00 . A A . 24 TRP H 1 1 16 8253 1 1 24 TRP HA H 2.833 -2.383 4.819 1.00 . A A . 24 TRP HA 1 1 16 8254 1 1 24 TRP HB2 H 4.130 -0.441 5.422 1.00 . A A . 24 TRP HB2 1 1 16 8255 1 1 24 TRP HB3 H 5.196 -1.821 5.629 1.00 . A A . 24 TRP HB3 1 1 16 8256 1 1 24 TRP HD1 H 4.861 1.421 3.950 1.00 . A A . 24 TRP HD1 1 1 16 8257 1 1 24 TRP HE1 H 6.931 1.905 2.433 1.00 . A A . 24 TRP HE1 1 1 16 8258 1 1 24 TRP HE3 H 6.963 -3.184 4.023 1.00 . A A . 24 TRP HE3 1 1 16 8259 1 1 24 TRP HH2 H 10.105 -1.791 1.494 1.00 . A A . 24 TRP HH2 1 1 16 8260 1 1 24 TRP HZ2 H 9.150 0.458 1.427 1.00 . A A . 24 TRP HZ2 1 1 16 8261 1 1 24 TRP HZ3 H 9.040 -3.583 2.765 1.00 . A A . 24 TRP HZ3 1 1 16 8262 1 1 24 TRP N N 4.227 -3.334 3.735 1.00 . A A . 24 TRP N 1 1 16 8263 1 1 24 TRP NE1 N 6.732 1.032 2.843 1.00 . A A . 24 TRP NE1 1 1 16 8264 1 1 24 TRP O O 3.594 -1.791 1.817 1.00 . A A . 24 TRP O 1 1 16 8265 1 1 25 CYS C C 2.808 1.194 1.409 1.00 . A A . 25 CYS C 1 1 16 8266 1 1 25 CYS CA C 1.763 0.186 1.817 1.00 . A A . 25 CYS CA 1 1 16 8267 1 1 25 CYS CB C 0.397 0.852 1.994 1.00 . A A . 25 CYS CB 1 1 16 8268 1 1 25 CYS H H 1.811 -0.271 3.873 1.00 . A A . 25 CYS H 1 1 16 8269 1 1 25 CYS HA H 1.701 -0.552 1.031 1.00 . A A . 25 CYS HA 1 1 16 8270 1 1 25 CYS HB2 H 0.390 1.394 2.927 1.00 . A A . 25 CYS HB2 1 1 16 8271 1 1 25 CYS HB3 H 0.233 1.544 1.180 1.00 . A A . 25 CYS HB3 1 1 16 8272 1 1 25 CYS N N 2.203 -0.518 3.008 1.00 . A A . 25 CYS N 1 1 16 8273 1 1 25 CYS O O 3.099 2.144 2.139 1.00 . A A . 25 CYS O 1 1 16 8274 1 1 25 CYS SG S -1.016 -0.301 2.036 1.00 . A A . 25 CYS SG 1 1 16 8275 1 1 26 LYS C C 3.941 2.567 -1.405 1.00 . A A . 26 LYS C 1 1 16 8276 1 1 26 LYS CA C 4.441 1.808 -0.211 1.00 . A A . 26 LYS CA 1 1 16 8277 1 1 26 LYS CB C 5.663 0.961 -0.593 1.00 . A A . 26 LYS CB 1 1 16 8278 1 1 26 LYS CD C 8.027 0.947 -1.453 1.00 . A A . 26 LYS CD 1 1 16 8279 1 1 26 LYS CE C 9.168 1.818 -1.966 1.00 . A A . 26 LYS CE 1 1 16 8280 1 1 26 LYS CG C 6.799 1.778 -1.159 1.00 . A A . 26 LYS CG 1 1 16 8281 1 1 26 LYS H H 3.098 0.214 -0.279 1.00 . A A . 26 LYS H 1 1 16 8282 1 1 26 LYS HA H 4.724 2.499 0.568 1.00 . A A . 26 LYS HA 1 1 16 8283 1 1 26 LYS HB2 H 6.018 0.446 0.286 1.00 . A A . 26 LYS HB2 1 1 16 8284 1 1 26 LYS HB3 H 5.364 0.231 -1.332 1.00 . A A . 26 LYS HB3 1 1 16 8285 1 1 26 LYS HD2 H 8.339 0.449 -0.548 1.00 . A A . 26 LYS HD2 1 1 16 8286 1 1 26 LYS HD3 H 7.779 0.211 -2.204 1.00 . A A . 26 LYS HD3 1 1 16 8287 1 1 26 LYS HE2 H 9.976 1.193 -2.309 1.00 . A A . 26 LYS HE2 1 1 16 8288 1 1 26 LYS HE3 H 8.802 2.405 -2.795 1.00 . A A . 26 LYS HE3 1 1 16 8289 1 1 26 LYS HG2 H 6.452 2.219 -2.083 1.00 . A A . 26 LYS HG2 1 1 16 8290 1 1 26 LYS HG3 H 7.020 2.565 -0.461 1.00 . A A . 26 LYS HG3 1 1 16 8291 1 1 26 LYS HZ1 H 10.111 2.209 -0.139 1.00 . A A . 26 LYS HZ1 1 1 16 8292 1 1 26 LYS HZ2 H 8.947 3.363 -0.574 1.00 . A A . 26 LYS HZ2 1 1 16 8293 1 1 26 LYS HZ3 H 10.430 3.336 -1.350 1.00 . A A . 26 LYS HZ3 1 1 16 8294 1 1 26 LYS N N 3.397 0.967 0.275 1.00 . A A . 26 LYS N 1 1 16 8295 1 1 26 LYS NZ N 9.691 2.734 -0.932 1.00 . A A . 26 LYS NZ 1 1 16 8296 1 1 26 LYS O O 3.127 2.063 -2.134 1.00 . A A . 26 LYS O 1 1 16 8297 1 1 27 LYS C C 4.586 3.916 -3.998 1.00 . A A . 27 LYS C 1 1 16 8298 1 1 27 LYS CA C 4.026 4.566 -2.737 1.00 . A A . 27 LYS CA 1 1 16 8299 1 1 27 LYS CB C 4.570 5.976 -2.592 1.00 . A A . 27 LYS CB 1 1 16 8300 1 1 27 LYS CD C 4.836 7.973 -1.091 1.00 . A A . 27 LYS CD 1 1 16 8301 1 1 27 LYS CE C 4.433 8.599 0.234 1.00 . A A . 27 LYS CE 1 1 16 8302 1 1 27 LYS CG C 4.089 6.677 -1.333 1.00 . A A . 27 LYS CG 1 1 16 8303 1 1 27 LYS H H 5.019 4.153 -0.924 1.00 . A A . 27 LYS H 1 1 16 8304 1 1 27 LYS HA H 2.948 4.602 -2.795 1.00 . A A . 27 LYS HA 1 1 16 8305 1 1 27 LYS HB2 H 5.646 5.923 -2.592 1.00 . A A . 27 LYS HB2 1 1 16 8306 1 1 27 LYS HB3 H 4.258 6.556 -3.447 1.00 . A A . 27 LYS HB3 1 1 16 8307 1 1 27 LYS HD2 H 5.897 7.770 -1.072 1.00 . A A . 27 LYS HD2 1 1 16 8308 1 1 27 LYS HD3 H 4.616 8.665 -1.890 1.00 . A A . 27 LYS HD3 1 1 16 8309 1 1 27 LYS HE2 H 3.379 8.836 0.198 1.00 . A A . 27 LYS HE2 1 1 16 8310 1 1 27 LYS HE3 H 4.609 7.883 1.023 1.00 . A A . 27 LYS HE3 1 1 16 8311 1 1 27 LYS HG2 H 3.039 6.895 -1.453 1.00 . A A . 27 LYS HG2 1 1 16 8312 1 1 27 LYS HG3 H 4.219 6.020 -0.488 1.00 . A A . 27 LYS HG3 1 1 16 8313 1 1 27 LYS HZ1 H 6.212 9.654 0.573 1.00 . A A . 27 LYS HZ1 1 1 16 8314 1 1 27 LYS HZ2 H 4.881 10.243 1.427 1.00 . A A . 27 LYS HZ2 1 1 16 8315 1 1 27 LYS HZ3 H 5.029 10.545 -0.222 1.00 . A A . 27 LYS HZ3 1 1 16 8316 1 1 27 LYS N N 4.399 3.775 -1.584 1.00 . A A . 27 LYS N 1 1 16 8317 1 1 27 LYS NZ N 5.189 9.834 0.522 1.00 . A A . 27 LYS NZ 1 1 16 8318 1 1 27 LYS O O 5.710 3.387 -4.004 1.00 . A A . 27 LYS O 1 1 16 8319 1 1 28 LYS C C 5.003 4.391 -7.059 1.00 . A A . 28 LYS C 1 1 16 8320 1 1 28 LYS CA C 4.242 3.343 -6.285 1.00 . A A . 28 LYS CA 1 1 16 8321 1 1 28 LYS CB C 3.057 2.787 -7.100 1.00 . A A . 28 LYS CB 1 1 16 8322 1 1 28 LYS CD C 2.253 1.480 -9.101 1.00 . A A . 28 LYS CD 1 1 16 8323 1 1 28 LYS CE C 2.642 0.638 -10.319 1.00 . A A . 28 LYS CE 1 1 16 8324 1 1 28 LYS CG C 3.467 2.023 -8.362 1.00 . A A . 28 LYS CG 1 1 16 8325 1 1 28 LYS H H 2.938 4.364 -4.973 1.00 . A A . 28 LYS H 1 1 16 8326 1 1 28 LYS HA H 4.923 2.539 -6.042 1.00 . A A . 28 LYS HA 1 1 16 8327 1 1 28 LYS HB2 H 2.488 2.119 -6.471 1.00 . A A . 28 LYS HB2 1 1 16 8328 1 1 28 LYS HB3 H 2.424 3.612 -7.394 1.00 . A A . 28 LYS HB3 1 1 16 8329 1 1 28 LYS HD2 H 1.687 0.860 -8.422 1.00 . A A . 28 LYS HD2 1 1 16 8330 1 1 28 LYS HD3 H 1.644 2.309 -9.425 1.00 . A A . 28 LYS HD3 1 1 16 8331 1 1 28 LYS HE2 H 3.266 -0.179 -9.991 1.00 . A A . 28 LYS HE2 1 1 16 8332 1 1 28 LYS HE3 H 1.740 0.237 -10.760 1.00 . A A . 28 LYS HE3 1 1 16 8333 1 1 28 LYS HG2 H 4.011 2.686 -9.019 1.00 . A A . 28 LYS HG2 1 1 16 8334 1 1 28 LYS HG3 H 4.101 1.197 -8.077 1.00 . A A . 28 LYS HG3 1 1 16 8335 1 1 28 LYS HZ1 H 4.306 1.754 -11.002 1.00 . A A . 28 LYS HZ1 1 1 16 8336 1 1 28 LYS HZ2 H 2.834 2.232 -11.665 1.00 . A A . 28 LYS HZ2 1 1 16 8337 1 1 28 LYS HZ3 H 3.559 0.811 -12.175 1.00 . A A . 28 LYS HZ3 1 1 16 8338 1 1 28 LYS N N 3.814 3.923 -5.042 1.00 . A A . 28 LYS N 1 1 16 8339 1 1 28 LYS NZ N 3.378 1.409 -11.344 1.00 . A A . 28 LYS NZ 1 1 16 8340 1 1 28 LYS O O 4.416 5.215 -7.777 1.00 . A A . 28 LYS O 1 1 16 8341 1 1 29 LEU C C 7.412 4.869 -8.883 1.00 . A A . 29 LEU C 1 1 16 8342 1 1 29 LEU CA C 7.151 5.367 -7.478 1.00 . A A . 29 LEU CA 1 1 16 8343 1 1 29 LEU CB C 8.469 5.491 -6.698 1.00 . A A . 29 LEU CB 1 1 16 8344 1 1 29 LEU CD1 C 9.717 5.887 -4.551 1.00 . A A . 29 LEU CD1 1 1 16 8345 1 1 29 LEU CD2 C 7.604 7.133 -4.987 1.00 . A A . 29 LEU CD2 1 1 16 8346 1 1 29 LEU CG C 8.347 5.826 -5.200 1.00 . A A . 29 LEU CG 1 1 16 8347 1 1 29 LEU H H 6.667 3.800 -6.178 1.00 . A A . 29 LEU H 1 1 16 8348 1 1 29 LEU HA H 6.660 6.328 -7.515 1.00 . A A . 29 LEU HA 1 1 16 8349 1 1 29 LEU HB2 H 9.001 4.556 -6.792 1.00 . A A . 29 LEU HB2 1 1 16 8350 1 1 29 LEU HB3 H 9.062 6.263 -7.165 1.00 . A A . 29 LEU HB3 1 1 16 8351 1 1 29 LEU HD11 H 10.311 6.652 -5.030 1.00 . A A . 29 LEU HD11 1 1 16 8352 1 1 29 LEU HD12 H 10.209 4.930 -4.658 1.00 . A A . 29 LEU HD12 1 1 16 8353 1 1 29 LEU HD13 H 9.608 6.120 -3.502 1.00 . A A . 29 LEU HD13 1 1 16 8354 1 1 29 LEU HD21 H 6.603 7.044 -5.383 1.00 . A A . 29 LEU HD21 1 1 16 8355 1 1 29 LEU HD22 H 8.125 7.928 -5.501 1.00 . A A . 29 LEU HD22 1 1 16 8356 1 1 29 LEU HD23 H 7.557 7.355 -3.931 1.00 . A A . 29 LEU HD23 1 1 16 8357 1 1 29 LEU HG H 7.792 5.036 -4.714 1.00 . A A . 29 LEU HG 1 1 16 8358 1 1 29 LEU N N 6.285 4.428 -6.827 1.00 . A A . 29 LEU N 1 1 16 8359 1 1 29 LEU O O 7.288 5.609 -9.868 1.00 . A A . 29 LEU O 1 1 16 8360 1 1 30 TRP C C 6.864 1.957 -10.429 1.00 . A A . 30 TRP C 1 1 16 8361 1 1 30 TRP CA C 7.966 2.959 -10.214 1.00 . A A . 30 TRP CA 1 1 16 8362 1 1 30 TRP CB C 9.327 2.261 -10.206 1.00 . A A . 30 TRP CB 1 1 16 8363 1 1 30 TRP CD1 C 11.147 3.979 -10.701 1.00 . A A . 30 TRP CD1 1 1 16 8364 1 1 30 TRP CD2 C 11.048 3.332 -8.567 1.00 . A A . 30 TRP CD2 1 1 16 8365 1 1 30 TRP CE2 C 12.081 4.271 -8.696 1.00 . A A . 30 TRP CE2 1 1 16 8366 1 1 30 TRP CE3 C 10.792 2.781 -7.314 1.00 . A A . 30 TRP CE3 1 1 16 8367 1 1 30 TRP CG C 10.464 3.161 -9.861 1.00 . A A . 30 TRP CG 1 1 16 8368 1 1 30 TRP CH2 C 12.584 4.117 -6.407 1.00 . A A . 30 TRP CH2 1 1 16 8369 1 1 30 TRP CZ2 C 12.859 4.672 -7.620 1.00 . A A . 30 TRP CZ2 1 1 16 8370 1 1 30 TRP CZ3 C 11.562 3.180 -6.249 1.00 . A A . 30 TRP CZ3 1 1 16 8371 1 1 30 TRP H H 7.767 3.070 -8.149 1.00 . A A . 30 TRP H 1 1 16 8372 1 1 30 TRP HA H 7.942 3.702 -10.999 1.00 . A A . 30 TRP HA 1 1 16 8373 1 1 30 TRP HB2 H 9.307 1.475 -9.466 1.00 . A A . 30 TRP HB2 1 1 16 8374 1 1 30 TRP HB3 H 9.515 1.835 -11.180 1.00 . A A . 30 TRP HB3 1 1 16 8375 1 1 30 TRP HD1 H 10.940 4.074 -11.758 1.00 . A A . 30 TRP HD1 1 1 16 8376 1 1 30 TRP HE1 H 12.760 5.301 -10.382 1.00 . A A . 30 TRP HE1 1 1 16 8377 1 1 30 TRP HE3 H 10.006 2.054 -7.172 1.00 . A A . 30 TRP HE3 1 1 16 8378 1 1 30 TRP HH2 H 13.162 4.397 -5.539 1.00 . A A . 30 TRP HH2 1 1 16 8379 1 1 30 TRP HZ2 H 13.654 5.396 -7.722 1.00 . A A . 30 TRP HZ2 1 1 16 8380 1 1 30 TRP HZ3 H 11.375 2.763 -5.269 1.00 . A A . 30 TRP HZ3 1 1 16 8381 1 1 30 TRP N N 7.718 3.607 -8.968 1.00 . A A . 30 TRP N 1 1 16 8382 1 1 30 TRP NE1 N 12.123 4.652 -10.004 1.00 . A A . 30 TRP NE1 1 1 16 8383 1 1 30 TRP O O 6.981 0.807 -9.949 1.00 . A A . 30 TRP O 1 1 16 8384 1 1 30 TRP OXT O 5.835 2.334 -11.021 1.00 . A A . 30 TRP OXT 1 1 17 8385 1 1 1 TYR C C -10.115 0.621 1.691 1.00 . A A . 1 TYR C 1 1 17 8386 1 1 1 TYR CA C -11.380 0.170 2.370 1.00 . A A . 1 TYR CA 1 1 17 8387 1 1 1 TYR CB C -11.085 -0.535 3.710 1.00 . A A . 1 TYR CB 1 1 17 8388 1 1 1 TYR CD1 C -11.446 -3.006 3.552 1.00 . A A . 1 TYR CD1 1 1 17 8389 1 1 1 TYR CD2 C -9.213 -2.203 3.464 1.00 . A A . 1 TYR CD2 1 1 17 8390 1 1 1 TYR CE1 C -11.002 -4.287 3.421 1.00 . A A . 1 TYR CE1 1 1 17 8391 1 1 1 TYR CE2 C -8.759 -3.490 3.332 1.00 . A A . 1 TYR CE2 1 1 17 8392 1 1 1 TYR CG C -10.566 -1.940 3.575 1.00 . A A . 1 TYR CG 1 1 17 8393 1 1 1 TYR CZ C -9.660 -4.533 3.309 1.00 . A A . 1 TYR CZ 1 1 17 8394 1 1 1 TYR H1 H -11.620 -1.521 1.202 1.00 . A A . 1 TYR H1 1 1 17 8395 1 1 1 TYR H2 H -12.327 -0.127 0.597 1.00 . A A . 1 TYR H2 1 1 17 8396 1 1 1 TYR H3 H -13.080 -0.935 1.869 1.00 . A A . 1 TYR H3 1 1 17 8397 1 1 1 TYR HA H -11.983 1.043 2.559 1.00 . A A . 1 TYR HA 1 1 17 8398 1 1 1 TYR HB2 H -10.336 0.034 4.240 1.00 . A A . 1 TYR HB2 1 1 17 8399 1 1 1 TYR HB3 H -11.984 -0.563 4.309 1.00 . A A . 1 TYR HB3 1 1 17 8400 1 1 1 TYR HD1 H -12.506 -2.819 3.638 1.00 . A A . 1 TYR HD1 1 1 17 8401 1 1 1 TYR HD2 H -8.509 -1.384 3.484 1.00 . A A . 1 TYR HD2 1 1 17 8402 1 1 1 TYR HE1 H -11.728 -5.083 3.406 1.00 . A A . 1 TYR HE1 1 1 17 8403 1 1 1 TYR HE2 H -7.696 -3.659 3.244 1.00 . A A . 1 TYR HE2 1 1 17 8404 1 1 1 TYR HH H -9.702 -6.249 2.463 1.00 . A A . 1 TYR HH 1 1 17 8405 1 1 1 TYR N N -12.159 -0.673 1.467 1.00 . A A . 1 TYR N 1 1 17 8406 1 1 1 TYR O O -9.607 -0.067 0.794 1.00 . A A . 1 TYR O 1 1 17 8407 1 1 1 TYR OH O -9.216 -5.822 3.182 1.00 . A A . 1 TYR OH 1 1 17 8408 1 1 2 CYS C C -7.318 2.228 2.464 1.00 . A A . 2 CYS C 1 1 17 8409 1 1 2 CYS CA C -8.440 2.278 1.465 1.00 . A A . 2 CYS CA 1 1 17 8410 1 1 2 CYS CB C -8.637 3.709 0.974 1.00 . A A . 2 CYS CB 1 1 17 8411 1 1 2 CYS H H -10.045 2.297 2.777 1.00 . A A . 2 CYS H 1 1 17 8412 1 1 2 CYS HA H -8.192 1.649 0.622 1.00 . A A . 2 CYS HA 1 1 17 8413 1 1 2 CYS HB2 H -9.588 3.797 0.472 1.00 . A A . 2 CYS HB2 1 1 17 8414 1 1 2 CYS HB3 H -8.611 4.362 1.831 1.00 . A A . 2 CYS HB3 1 1 17 8415 1 1 2 CYS N N -9.624 1.768 2.067 1.00 . A A . 2 CYS N 1 1 17 8416 1 1 2 CYS O O -7.545 2.348 3.672 1.00 . A A . 2 CYS O 1 1 17 8417 1 1 2 CYS SG S -7.330 4.254 -0.169 1.00 . A A . 2 CYS SG 1 1 17 8418 1 1 3 GLN C C -4.059 3.146 2.559 1.00 . A A . 3 GLN C 1 1 17 8419 1 1 3 GLN CA C -4.970 1.964 2.808 1.00 . A A . 3 GLN CA 1 1 17 8420 1 1 3 GLN CB C -4.209 0.652 2.574 1.00 . A A . 3 GLN CB 1 1 17 8421 1 1 3 GLN CD C -5.400 -0.726 4.357 1.00 . A A . 3 GLN CD 1 1 17 8422 1 1 3 GLN CG C -4.992 -0.620 2.898 1.00 . A A . 3 GLN CG 1 1 17 8423 1 1 3 GLN H H -6.030 2.053 0.997 1.00 . A A . 3 GLN H 1 1 17 8424 1 1 3 GLN HA H -5.322 1.990 3.826 1.00 . A A . 3 GLN HA 1 1 17 8425 1 1 3 GLN HB2 H -3.913 0.609 1.538 1.00 . A A . 3 GLN HB2 1 1 17 8426 1 1 3 GLN HB3 H -3.318 0.664 3.185 1.00 . A A . 3 GLN HB3 1 1 17 8427 1 1 3 GLN HE21 H -3.724 -1.694 4.811 1.00 . A A . 3 GLN HE21 1 1 17 8428 1 1 3 GLN HE22 H -4.830 -1.406 6.103 1.00 . A A . 3 GLN HE22 1 1 17 8429 1 1 3 GLN HG2 H -5.887 -0.635 2.295 1.00 . A A . 3 GLN HG2 1 1 17 8430 1 1 3 GLN HG3 H -4.381 -1.473 2.646 1.00 . A A . 3 GLN HG3 1 1 17 8431 1 1 3 GLN N N -6.129 2.060 1.972 1.00 . A A . 3 GLN N 1 1 17 8432 1 1 3 GLN NE2 N -4.571 -1.330 5.162 1.00 . A A . 3 GLN NE2 1 1 17 8433 1 1 3 GLN O O -3.899 3.589 1.415 1.00 . A A . 3 GLN O 1 1 17 8434 1 1 3 GLN OE1 O -6.470 -0.278 4.757 1.00 . A A . 3 GLN OE1 1 1 17 8435 1 1 4 LYS C C -1.182 4.208 3.612 1.00 . A A . 4 LYS C 1 1 17 8436 1 1 4 LYS CA C -2.594 4.781 3.560 1.00 . A A . 4 LYS CA 1 1 17 8437 1 1 4 LYS CB C -2.830 5.742 4.724 1.00 . A A . 4 LYS CB 1 1 17 8438 1 1 4 LYS CD C -4.414 7.301 5.895 1.00 . A A . 4 LYS CD 1 1 17 8439 1 1 4 LYS CE C -5.822 7.865 5.895 1.00 . A A . 4 LYS CE 1 1 17 8440 1 1 4 LYS CG C -4.214 6.364 4.721 1.00 . A A . 4 LYS CG 1 1 17 8441 1 1 4 LYS H H -3.780 3.327 4.501 1.00 . A A . 4 LYS H 1 1 17 8442 1 1 4 LYS HA H -2.746 5.299 2.626 1.00 . A A . 4 LYS HA 1 1 17 8443 1 1 4 LYS HB2 H -2.716 5.192 5.646 1.00 . A A . 4 LYS HB2 1 1 17 8444 1 1 4 LYS HB3 H -2.097 6.534 4.693 1.00 . A A . 4 LYS HB3 1 1 17 8445 1 1 4 LYS HD2 H -4.253 6.752 6.811 1.00 . A A . 4 LYS HD2 1 1 17 8446 1 1 4 LYS HD3 H -3.706 8.112 5.828 1.00 . A A . 4 LYS HD3 1 1 17 8447 1 1 4 LYS HE2 H -5.985 8.396 4.969 1.00 . A A . 4 LYS HE2 1 1 17 8448 1 1 4 LYS HE3 H -6.516 7.042 5.958 1.00 . A A . 4 LYS HE3 1 1 17 8449 1 1 4 LYS HG2 H -4.347 6.920 3.805 1.00 . A A . 4 LYS HG2 1 1 17 8450 1 1 4 LYS HG3 H -4.950 5.573 4.771 1.00 . A A . 4 LYS HG3 1 1 17 8451 1 1 4 LYS HZ1 H -5.933 8.315 7.936 1.00 . A A . 4 LYS HZ1 1 1 17 8452 1 1 4 LYS HZ2 H -7.041 9.147 6.984 1.00 . A A . 4 LYS HZ2 1 1 17 8453 1 1 4 LYS HZ3 H -5.424 9.608 6.981 1.00 . A A . 4 LYS HZ3 1 1 17 8454 1 1 4 LYS N N -3.536 3.692 3.625 1.00 . A A . 4 LYS N 1 1 17 8455 1 1 4 LYS NZ N -6.065 8.789 7.021 1.00 . A A . 4 LYS NZ 1 1 17 8456 1 1 4 LYS O O -1.010 3.055 4.011 1.00 . A A . 4 LYS O 1 1 17 8457 1 1 5 TRP C C 1.723 4.210 4.653 1.00 . A A . 5 TRP C 1 1 17 8458 1 1 5 TRP CA C 1.237 4.531 3.242 1.00 . A A . 5 TRP CA 1 1 17 8459 1 1 5 TRP CB C 2.179 5.574 2.597 1.00 . A A . 5 TRP CB 1 1 17 8460 1 1 5 TRP CD1 C 1.762 7.810 3.796 1.00 . A A . 5 TRP CD1 1 1 17 8461 1 1 5 TRP CD2 C 3.765 6.910 4.210 1.00 . A A . 5 TRP CD2 1 1 17 8462 1 1 5 TRP CE2 C 3.661 8.113 4.928 1.00 . A A . 5 TRP CE2 1 1 17 8463 1 1 5 TRP CE3 C 4.941 6.164 4.313 1.00 . A A . 5 TRP CE3 1 1 17 8464 1 1 5 TRP CG C 2.533 6.730 3.496 1.00 . A A . 5 TRP CG 1 1 17 8465 1 1 5 TRP CH2 C 5.822 7.837 5.819 1.00 . A A . 5 TRP CH2 1 1 17 8466 1 1 5 TRP CZ2 C 4.684 8.587 5.736 1.00 . A A . 5 TRP CZ2 1 1 17 8467 1 1 5 TRP CZ3 C 5.959 6.636 5.117 1.00 . A A . 5 TRP CZ3 1 1 17 8468 1 1 5 TRP H H -0.375 5.947 3.039 1.00 . A A . 5 TRP H 1 1 17 8469 1 1 5 TRP HA H 1.253 3.622 2.658 1.00 . A A . 5 TRP HA 1 1 17 8470 1 1 5 TRP HB2 H 3.100 5.088 2.312 1.00 . A A . 5 TRP HB2 1 1 17 8471 1 1 5 TRP HB3 H 1.705 5.971 1.713 1.00 . A A . 5 TRP HB3 1 1 17 8472 1 1 5 TRP HD1 H 0.768 7.974 3.410 1.00 . A A . 5 TRP HD1 1 1 17 8473 1 1 5 TRP HE1 H 2.081 9.485 5.024 1.00 . A A . 5 TRP HE1 1 1 17 8474 1 1 5 TRP HE3 H 5.058 5.233 3.778 1.00 . A A . 5 TRP HE3 1 1 17 8475 1 1 5 TRP HH2 H 6.643 8.171 6.435 1.00 . A A . 5 TRP HH2 1 1 17 8476 1 1 5 TRP HZ2 H 4.600 9.512 6.289 1.00 . A A . 5 TRP HZ2 1 1 17 8477 1 1 5 TRP HZ3 H 6.877 6.074 5.209 1.00 . A A . 5 TRP HZ3 1 1 17 8478 1 1 5 TRP N N -0.168 5.016 3.282 1.00 . A A . 5 TRP N 1 1 17 8479 1 1 5 TRP NE1 N 2.431 8.644 4.656 1.00 . A A . 5 TRP NE1 1 1 17 8480 1 1 5 TRP O O 2.686 3.477 4.864 1.00 . A A . 5 TRP O 1 1 17 8481 1 1 6 MET C C 0.801 3.254 7.495 1.00 . A A . 6 MET C 1 1 17 8482 1 1 6 MET CA C 1.334 4.598 7.004 1.00 . A A . 6 MET CA 1 1 17 8483 1 1 6 MET CB C 0.731 5.743 7.826 1.00 . A A . 6 MET CB 1 1 17 8484 1 1 6 MET CE C -0.710 8.625 7.871 1.00 . A A . 6 MET CE 1 1 17 8485 1 1 6 MET CG C -0.781 5.848 7.710 1.00 . A A . 6 MET CG 1 1 17 8486 1 1 6 MET H H 0.285 5.341 5.331 1.00 . A A . 6 MET H 1 1 17 8487 1 1 6 MET HA H 2.408 4.626 7.103 1.00 . A A . 6 MET HA 1 1 17 8488 1 1 6 MET HB2 H 0.979 5.586 8.865 1.00 . A A . 6 MET HB2 1 1 17 8489 1 1 6 MET HB3 H 1.167 6.673 7.494 1.00 . A A . 6 MET HB3 1 1 17 8490 1 1 6 MET HE1 H -1.080 9.533 8.324 1.00 . A A . 6 MET HE1 1 1 17 8491 1 1 6 MET HE2 H -0.936 8.631 6.815 1.00 . A A . 6 MET HE2 1 1 17 8492 1 1 6 MET HE3 H 0.359 8.569 8.010 1.00 . A A . 6 MET HE3 1 1 17 8493 1 1 6 MET HG2 H -1.029 5.994 6.670 1.00 . A A . 6 MET HG2 1 1 17 8494 1 1 6 MET HG3 H -1.217 4.920 8.051 1.00 . A A . 6 MET HG3 1 1 17 8495 1 1 6 MET N N 1.031 4.775 5.610 1.00 . A A . 6 MET N 1 1 17 8496 1 1 6 MET O O 1.075 2.839 8.618 1.00 . A A . 6 MET O 1 1 17 8497 1 1 6 MET SD S -1.497 7.207 8.649 1.00 . A A . 6 MET SD 1 1 17 8498 1 1 7 TRP C C 0.099 0.231 6.109 1.00 . A A . 7 TRP C 1 1 17 8499 1 1 7 TRP CA C -0.534 1.300 6.983 1.00 . A A . 7 TRP CA 1 1 17 8500 1 1 7 TRP CB C -2.070 1.289 6.830 1.00 . A A . 7 TRP CB 1 1 17 8501 1 1 7 TRP CD1 C -2.374 2.909 8.824 1.00 . A A . 7 TRP CD1 1 1 17 8502 1 1 7 TRP CD2 C -4.110 2.826 7.422 1.00 . A A . 7 TRP CD2 1 1 17 8503 1 1 7 TRP CE2 C -4.400 3.756 8.437 1.00 . A A . 7 TRP CE2 1 1 17 8504 1 1 7 TRP CE3 C -5.056 2.596 6.434 1.00 . A A . 7 TRP CE3 1 1 17 8505 1 1 7 TRP CG C -2.801 2.312 7.668 1.00 . A A . 7 TRP CG 1 1 17 8506 1 1 7 TRP CH2 C -6.512 4.205 7.495 1.00 . A A . 7 TRP CH2 1 1 17 8507 1 1 7 TRP CZ2 C -5.600 4.454 8.481 1.00 . A A . 7 TRP CZ2 1 1 17 8508 1 1 7 TRP CZ3 C -6.249 3.284 6.479 1.00 . A A . 7 TRP CZ3 1 1 17 8509 1 1 7 TRP H H -0.113 2.921 5.738 1.00 . A A . 7 TRP H 1 1 17 8510 1 1 7 TRP HA H -0.275 1.094 8.011 1.00 . A A . 7 TRP HA 1 1 17 8511 1 1 7 TRP HB2 H -2.318 1.481 5.796 1.00 . A A . 7 TRP HB2 1 1 17 8512 1 1 7 TRP HB3 H -2.440 0.310 7.099 1.00 . A A . 7 TRP HB3 1 1 17 8513 1 1 7 TRP HD1 H -1.412 2.721 9.282 1.00 . A A . 7 TRP HD1 1 1 17 8514 1 1 7 TRP HE1 H -3.234 4.363 10.073 1.00 . A A . 7 TRP HE1 1 1 17 8515 1 1 7 TRP HE3 H -4.864 1.878 5.653 1.00 . A A . 7 TRP HE3 1 1 17 8516 1 1 7 TRP HH2 H -7.462 4.721 7.493 1.00 . A A . 7 TRP HH2 1 1 17 8517 1 1 7 TRP HZ2 H -5.824 5.169 9.257 1.00 . A A . 7 TRP HZ2 1 1 17 8518 1 1 7 TRP HZ3 H -6.995 3.112 5.714 1.00 . A A . 7 TRP HZ3 1 1 17 8519 1 1 7 TRP N N 0.038 2.582 6.648 1.00 . A A . 7 TRP N 1 1 17 8520 1 1 7 TRP NE1 N -3.319 3.800 9.273 1.00 . A A . 7 TRP NE1 1 1 17 8521 1 1 7 TRP O O 1.029 0.509 5.333 1.00 . A A . 7 TRP O 1 1 17 8522 1 1 8 THR C C -0.888 -2.801 4.686 1.00 . A A . 8 THR C 1 1 17 8523 1 1 8 THR CA C 0.191 -2.082 5.511 1.00 . A A . 8 THR CA 1 1 17 8524 1 1 8 THR CB C 0.834 -3.035 6.545 1.00 . A A . 8 THR CB 1 1 17 8525 1 1 8 THR CG2 C 2.043 -2.375 7.203 1.00 . A A . 8 THR CG2 1 1 17 8526 1 1 8 THR H H -1.146 -1.167 6.799 1.00 . A A . 8 THR H 1 1 17 8527 1 1 8 THR HA H 0.956 -1.689 4.867 1.00 . A A . 8 THR HA 1 1 17 8528 1 1 8 THR HB H 1.142 -3.947 6.055 1.00 . A A . 8 THR HB 1 1 17 8529 1 1 8 THR HG1 H 0.195 -2.949 8.403 1.00 . A A . 8 THR HG1 1 1 17 8530 1 1 8 THR HG21 H 2.773 -2.101 6.456 1.00 . A A . 8 THR HG21 1 1 17 8531 1 1 8 THR HG22 H 2.494 -3.056 7.911 1.00 . A A . 8 THR HG22 1 1 17 8532 1 1 8 THR HG23 H 1.719 -1.484 7.718 1.00 . A A . 8 THR HG23 1 1 17 8533 1 1 8 THR N N -0.379 -0.971 6.223 1.00 . A A . 8 THR N 1 1 17 8534 1 1 8 THR O O -2.081 -2.505 4.865 1.00 . A A . 8 THR O 1 1 17 8535 1 1 8 THR OG1 O -0.138 -3.336 7.582 1.00 . A A . 8 THR OG1 1 1 17 8536 1 1 9 CYS C C -1.201 -5.923 3.049 1.00 . A A . 9 CYS C 1 1 17 8537 1 1 9 CYS CA C -1.558 -4.452 3.090 1.00 . A A . 9 CYS CA 1 1 17 8538 1 1 9 CYS CB C -1.889 -3.881 1.710 1.00 . A A . 9 CYS CB 1 1 17 8539 1 1 9 CYS H H 0.408 -3.911 3.482 1.00 . A A . 9 CYS H 1 1 17 8540 1 1 9 CYS HA H -2.430 -4.364 3.724 1.00 . A A . 9 CYS HA 1 1 17 8541 1 1 9 CYS HB2 H -2.693 -4.456 1.275 1.00 . A A . 9 CYS HB2 1 1 17 8542 1 1 9 CYS HB3 H -2.215 -2.859 1.829 1.00 . A A . 9 CYS HB3 1 1 17 8543 1 1 9 CYS N N -0.520 -3.705 3.759 1.00 . A A . 9 CYS N 1 1 17 8544 1 1 9 CYS O O -0.118 -6.311 3.526 1.00 . A A . 9 CYS O 1 1 17 8545 1 1 9 CYS SG S -0.526 -3.894 0.535 1.00 . A A . 9 CYS SG 1 1 17 8546 1 1 10 ASP C C -2.555 -8.758 1.304 1.00 . A A . 10 ASP C 1 1 17 8547 1 1 10 ASP CA C -1.920 -8.194 2.537 1.00 . A A . 10 ASP CA 1 1 17 8548 1 1 10 ASP CB C -2.636 -8.814 3.765 1.00 . A A . 10 ASP CB 1 1 17 8549 1 1 10 ASP CG C -2.105 -8.348 5.094 1.00 . A A . 10 ASP CG 1 1 17 8550 1 1 10 ASP H H -2.864 -6.382 2.030 1.00 . A A . 10 ASP H 1 1 17 8551 1 1 10 ASP HA H -0.872 -8.443 2.571 1.00 . A A . 10 ASP HA 1 1 17 8552 1 1 10 ASP HB2 H -3.682 -8.554 3.723 1.00 . A A . 10 ASP HB2 1 1 17 8553 1 1 10 ASP HB3 H -2.547 -9.888 3.714 1.00 . A A . 10 ASP HB3 1 1 17 8554 1 1 10 ASP N N -2.086 -6.743 2.514 1.00 . A A . 10 ASP N 1 1 17 8555 1 1 10 ASP O O -2.956 -8.009 0.423 1.00 . A A . 10 ASP O 1 1 17 8556 1 1 10 ASP OD1 O -2.648 -7.399 5.651 1.00 . A A . 10 ASP OD1 1 1 17 8557 1 1 10 ASP OD2 O -1.140 -8.946 5.617 1.00 . A A . 10 ASP OD2 1 1 17 8558 1 1 11 SER C C -4.889 -10.441 0.324 1.00 . A A . 11 SER C 1 1 17 8559 1 1 11 SER CA C -3.377 -10.696 0.142 1.00 . A A . 11 SER CA 1 1 17 8560 1 1 11 SER CB C -3.084 -12.195 0.156 1.00 . A A . 11 SER CB 1 1 17 8561 1 1 11 SER H H -2.262 -10.636 1.922 1.00 . A A . 11 SER H 1 1 17 8562 1 1 11 SER HA H -3.043 -10.261 -0.788 1.00 . A A . 11 SER HA 1 1 17 8563 1 1 11 SER HB2 H -3.596 -12.644 0.992 1.00 . A A . 11 SER HB2 1 1 17 8564 1 1 11 SER HB3 H -3.426 -12.642 -0.765 1.00 . A A . 11 SER HB3 1 1 17 8565 1 1 11 SER HG H -1.552 -12.683 1.218 1.00 . A A . 11 SER HG 1 1 17 8566 1 1 11 SER N N -2.677 -10.063 1.239 1.00 . A A . 11 SER N 1 1 17 8567 1 1 11 SER O O -5.668 -10.411 -0.635 1.00 . A A . 11 SER O 1 1 17 8568 1 1 11 SER OG O -1.683 -12.432 0.294 1.00 . A A . 11 SER OG 1 1 17 8569 1 1 12 GLU C C -6.919 -8.463 1.838 1.00 . A A . 12 GLU C 1 1 17 8570 1 1 12 GLU CA C -6.646 -9.956 1.937 1.00 . A A . 12 GLU CA 1 1 17 8571 1 1 12 GLU CB C -6.912 -10.426 3.361 1.00 . A A . 12 GLU CB 1 1 17 8572 1 1 12 GLU CD C -7.533 -12.763 2.718 1.00 . A A . 12 GLU CD 1 1 17 8573 1 1 12 GLU CG C -6.661 -11.900 3.575 1.00 . A A . 12 GLU CG 1 1 17 8574 1 1 12 GLU H H -4.588 -10.300 2.272 1.00 . A A . 12 GLU H 1 1 17 8575 1 1 12 GLU HA H -7.299 -10.494 1.263 1.00 . A A . 12 GLU HA 1 1 17 8576 1 1 12 GLU HB2 H -6.273 -9.873 4.032 1.00 . A A . 12 GLU HB2 1 1 17 8577 1 1 12 GLU HB3 H -7.942 -10.216 3.609 1.00 . A A . 12 GLU HB3 1 1 17 8578 1 1 12 GLU HG2 H -5.631 -12.113 3.336 1.00 . A A . 12 GLU HG2 1 1 17 8579 1 1 12 GLU HG3 H -6.846 -12.139 4.610 1.00 . A A . 12 GLU HG3 1 1 17 8580 1 1 12 GLU N N -5.274 -10.238 1.574 1.00 . A A . 12 GLU N 1 1 17 8581 1 1 12 GLU O O -7.883 -8.032 1.207 1.00 . A A . 12 GLU O 1 1 17 8582 1 1 12 GLU OE1 O -8.695 -12.999 3.086 1.00 . A A . 12 GLU OE1 1 1 17 8583 1 1 12 GLU OE2 O -7.069 -13.232 1.669 1.00 . A A . 12 GLU OE2 1 1 17 8584 1 1 13 ARG C C -5.570 -5.641 1.269 1.00 . A A . 13 ARG C 1 1 17 8585 1 1 13 ARG CA C -6.240 -6.249 2.467 1.00 . A A . 13 ARG CA 1 1 17 8586 1 1 13 ARG CB C -5.677 -5.627 3.746 1.00 . A A . 13 ARG CB 1 1 17 8587 1 1 13 ARG CD C -5.813 -5.357 6.226 1.00 . A A . 13 ARG CD 1 1 17 8588 1 1 13 ARG CG C -6.352 -6.097 5.022 1.00 . A A . 13 ARG CG 1 1 17 8589 1 1 13 ARG CZ C -3.546 -4.695 6.988 1.00 . A A . 13 ARG CZ 1 1 17 8590 1 1 13 ARG H H -5.298 -8.070 2.920 1.00 . A A . 13 ARG H 1 1 17 8591 1 1 13 ARG HA H -7.300 -6.041 2.419 1.00 . A A . 13 ARG HA 1 1 17 8592 1 1 13 ARG HB2 H -4.628 -5.876 3.814 1.00 . A A . 13 ARG HB2 1 1 17 8593 1 1 13 ARG HB3 H -5.772 -4.553 3.685 1.00 . A A . 13 ARG HB3 1 1 17 8594 1 1 13 ARG HD2 H -6.010 -4.305 6.090 1.00 . A A . 13 ARG HD2 1 1 17 8595 1 1 13 ARG HD3 H -6.315 -5.709 7.116 1.00 . A A . 13 ARG HD3 1 1 17 8596 1 1 13 ARG HE H -3.971 -6.371 6.021 1.00 . A A . 13 ARG HE 1 1 17 8597 1 1 13 ARG HG2 H -7.412 -5.903 4.942 1.00 . A A . 13 ARG HG2 1 1 17 8598 1 1 13 ARG HG3 H -6.178 -7.155 5.146 1.00 . A A . 13 ARG HG3 1 1 17 8599 1 1 13 ARG HH11 H -4.976 -3.305 7.475 1.00 . A A . 13 ARG HH11 1 1 17 8600 1 1 13 ARG HH12 H -3.389 -2.918 7.988 1.00 . A A . 13 ARG HH12 1 1 17 8601 1 1 13 ARG HH21 H -1.967 -5.877 6.639 1.00 . A A . 13 ARG HH21 1 1 17 8602 1 1 13 ARG HH22 H -1.541 -4.415 7.445 1.00 . A A . 13 ARG HH22 1 1 17 8603 1 1 13 ARG N N -6.071 -7.682 2.463 1.00 . A A . 13 ARG N 1 1 17 8604 1 1 13 ARG NE N -4.374 -5.539 6.388 1.00 . A A . 13 ARG NE 1 1 17 8605 1 1 13 ARG NH1 N -4.003 -3.556 7.517 1.00 . A A . 13 ARG NH1 1 1 17 8606 1 1 13 ARG NH2 N -2.259 -5.002 7.049 1.00 . A A . 13 ARG NH2 1 1 17 8607 1 1 13 ARG O O -4.350 -5.671 1.167 1.00 . A A . 13 ARG O 1 1 17 8608 1 1 14 LYS C C -5.361 -3.066 -0.467 1.00 . A A . 14 LYS C 1 1 17 8609 1 1 14 LYS CA C -5.828 -4.472 -0.814 1.00 . A A . 14 LYS CA 1 1 17 8610 1 1 14 LYS CB C -6.901 -4.392 -1.913 1.00 . A A . 14 LYS CB 1 1 17 8611 1 1 14 LYS CD C -9.121 -3.382 -2.629 1.00 . A A . 14 LYS CD 1 1 17 8612 1 1 14 LYS CE C -8.524 -2.516 -3.734 1.00 . A A . 14 LYS CE 1 1 17 8613 1 1 14 LYS CG C -8.142 -3.607 -1.490 1.00 . A A . 14 LYS CG 1 1 17 8614 1 1 14 LYS H H -7.324 -5.142 0.504 1.00 . A A . 14 LYS H 1 1 17 8615 1 1 14 LYS HA H -4.992 -5.051 -1.180 1.00 . A A . 14 LYS HA 1 1 17 8616 1 1 14 LYS HB2 H -6.469 -3.909 -2.779 1.00 . A A . 14 LYS HB2 1 1 17 8617 1 1 14 LYS HB3 H -7.204 -5.392 -2.183 1.00 . A A . 14 LYS HB3 1 1 17 8618 1 1 14 LYS HD2 H -9.392 -4.342 -3.046 1.00 . A A . 14 LYS HD2 1 1 17 8619 1 1 14 LYS HD3 H -10.006 -2.901 -2.240 1.00 . A A . 14 LYS HD3 1 1 17 8620 1 1 14 LYS HE2 H -8.077 -1.639 -3.291 1.00 . A A . 14 LYS HE2 1 1 17 8621 1 1 14 LYS HE3 H -7.761 -3.084 -4.249 1.00 . A A . 14 LYS HE3 1 1 17 8622 1 1 14 LYS HG2 H -8.647 -4.148 -0.704 1.00 . A A . 14 LYS HG2 1 1 17 8623 1 1 14 LYS HG3 H -7.823 -2.651 -1.105 1.00 . A A . 14 LYS HG3 1 1 17 8624 1 1 14 LYS HZ1 H -9.110 -1.657 -5.547 1.00 . A A . 14 LYS HZ1 1 1 17 8625 1 1 14 LYS HZ2 H -10.162 -1.379 -4.276 1.00 . A A . 14 LYS HZ2 1 1 17 8626 1 1 14 LYS HZ3 H -10.153 -2.883 -5.014 1.00 . A A . 14 LYS HZ3 1 1 17 8627 1 1 14 LYS N N -6.352 -5.116 0.369 1.00 . A A . 14 LYS N 1 1 17 8628 1 1 14 LYS NZ N -9.546 -2.095 -4.712 1.00 . A A . 14 LYS NZ 1 1 17 8629 1 1 14 LYS O O -5.945 -2.403 0.395 1.00 . A A . 14 LYS O 1 1 17 8630 1 1 15 CYS C C -4.418 -0.453 -2.026 1.00 . A A . 15 CYS C 1 1 17 8631 1 1 15 CYS CA C -3.836 -1.299 -0.903 1.00 . A A . 15 CYS CA 1 1 17 8632 1 1 15 CYS CB C -2.314 -1.243 -0.891 1.00 . A A . 15 CYS CB 1 1 17 8633 1 1 15 CYS H H -3.845 -3.223 -1.720 1.00 . A A . 15 CYS H 1 1 17 8634 1 1 15 CYS HA H -4.230 -0.941 0.037 1.00 . A A . 15 CYS HA 1 1 17 8635 1 1 15 CYS HB2 H -1.930 -2.038 -0.267 1.00 . A A . 15 CYS HB2 1 1 17 8636 1 1 15 CYS HB3 H -1.960 -1.386 -1.901 1.00 . A A . 15 CYS HB3 1 1 17 8637 1 1 15 CYS N N -4.310 -2.640 -1.086 1.00 . A A . 15 CYS N 1 1 17 8638 1 1 15 CYS O O -4.961 -1.004 -2.992 1.00 . A A . 15 CYS O 1 1 17 8639 1 1 15 CYS SG S -1.620 0.323 -0.284 1.00 . A A . 15 CYS SG 1 1 17 8640 1 1 16 CYS C C -3.911 2.062 -3.992 1.00 . A A . 16 CYS C 1 1 17 8641 1 1 16 CYS CA C -4.924 1.702 -2.912 1.00 . A A . 16 CYS CA 1 1 17 8642 1 1 16 CYS CB C -5.514 2.941 -2.257 1.00 . A A . 16 CYS CB 1 1 17 8643 1 1 16 CYS H H -3.891 1.239 -1.142 1.00 . A A . 16 CYS H 1 1 17 8644 1 1 16 CYS HA H -5.728 1.153 -3.380 1.00 . A A . 16 CYS HA 1 1 17 8645 1 1 16 CYS HB2 H -4.751 3.428 -1.666 1.00 . A A . 16 CYS HB2 1 1 17 8646 1 1 16 CYS HB3 H -5.872 3.619 -3.016 1.00 . A A . 16 CYS HB3 1 1 17 8647 1 1 16 CYS N N -4.358 0.836 -1.906 1.00 . A A . 16 CYS N 1 1 17 8648 1 1 16 CYS O O -2.689 2.080 -3.746 1.00 . A A . 16 CYS O 1 1 17 8649 1 1 16 CYS SG S -6.907 2.539 -1.161 1.00 . A A . 16 CYS SG 1 1 17 8650 1 1 17 LYS C C -2.868 3.985 -6.023 1.00 . A A . 17 LYS C 1 1 17 8651 1 1 17 LYS CA C -3.577 2.683 -6.324 1.00 . A A . 17 LYS CA 1 1 17 8652 1 1 17 LYS CB C -4.361 2.763 -7.642 1.00 . A A . 17 LYS CB 1 1 17 8653 1 1 17 LYS CD C -6.281 3.789 -8.995 1.00 . A A . 17 LYS CD 1 1 17 8654 1 1 17 LYS CE C -6.740 2.443 -9.597 1.00 . A A . 17 LYS CE 1 1 17 8655 1 1 17 LYS CG C -5.586 3.659 -7.620 1.00 . A A . 17 LYS CG 1 1 17 8656 1 1 17 LYS H H -5.379 2.165 -5.344 1.00 . A A . 17 LYS H 1 1 17 8657 1 1 17 LYS HA H -2.818 1.919 -6.416 1.00 . A A . 17 LYS HA 1 1 17 8658 1 1 17 LYS HB2 H -3.698 3.139 -8.405 1.00 . A A . 17 LYS HB2 1 1 17 8659 1 1 17 LYS HB3 H -4.676 1.765 -7.905 1.00 . A A . 17 LYS HB3 1 1 17 8660 1 1 17 LYS HD2 H -7.149 4.420 -8.883 1.00 . A A . 17 LYS HD2 1 1 17 8661 1 1 17 LYS HD3 H -5.592 4.261 -9.679 1.00 . A A . 17 LYS HD3 1 1 17 8662 1 1 17 LYS HE2 H -7.103 1.816 -8.798 1.00 . A A . 17 LYS HE2 1 1 17 8663 1 1 17 LYS HE3 H -7.541 2.631 -10.294 1.00 . A A . 17 LYS HE3 1 1 17 8664 1 1 17 LYS HG2 H -6.296 3.256 -6.913 1.00 . A A . 17 LYS HG2 1 1 17 8665 1 1 17 LYS HG3 H -5.278 4.641 -7.291 1.00 . A A . 17 LYS HG3 1 1 17 8666 1 1 17 LYS HZ1 H -4.838 1.498 -9.674 1.00 . A A . 17 LYS HZ1 1 1 17 8667 1 1 17 LYS HZ2 H -5.308 2.217 -11.124 1.00 . A A . 17 LYS HZ2 1 1 17 8668 1 1 17 LYS HZ3 H -6.007 0.789 -10.632 1.00 . A A . 17 LYS HZ3 1 1 17 8669 1 1 17 LYS N N -4.414 2.288 -5.207 1.00 . A A . 17 LYS N 1 1 17 8670 1 1 17 LYS NZ N -5.652 1.702 -10.289 1.00 . A A . 17 LYS NZ 1 1 17 8671 1 1 17 LYS O O -3.450 4.912 -5.437 1.00 . A A . 17 LYS O 1 1 17 8672 1 1 18 GLY C C 0.276 4.656 -5.114 1.00 . A A . 18 GLY C 1 1 17 8673 1 1 18 GLY CA C -0.773 5.146 -6.063 1.00 . A A . 18 GLY CA 1 1 17 8674 1 1 18 GLY H H -1.246 3.314 -6.951 1.00 . A A . 18 GLY H 1 1 17 8675 1 1 18 GLY HA2 H -0.311 5.540 -6.955 1.00 . A A . 18 GLY HA2 1 1 17 8676 1 1 18 GLY HA3 H -1.354 5.916 -5.579 1.00 . A A . 18 GLY HA3 1 1 17 8677 1 1 18 GLY N N -1.624 4.040 -6.408 1.00 . A A . 18 GLY N 1 1 17 8678 1 1 18 GLY O O 1.300 5.310 -4.864 1.00 . A A . 18 GLY O 1 1 17 8679 1 1 19 MET C C 1.141 1.454 -4.214 1.00 . A A . 19 MET C 1 1 17 8680 1 1 19 MET CA C 0.877 2.815 -3.684 1.00 . A A . 19 MET CA 1 1 17 8681 1 1 19 MET CB C 0.254 2.701 -2.303 1.00 . A A . 19 MET CB 1 1 17 8682 1 1 19 MET CE C -0.966 5.678 0.179 1.00 . A A . 19 MET CE 1 1 17 8683 1 1 19 MET CG C 0.039 4.023 -1.657 1.00 . A A . 19 MET CG 1 1 17 8684 1 1 19 MET H H -0.854 3.061 -4.778 1.00 . A A . 19 MET H 1 1 17 8685 1 1 19 MET HA H 1.803 3.364 -3.607 1.00 . A A . 19 MET HA 1 1 17 8686 1 1 19 MET HB2 H -0.700 2.204 -2.388 1.00 . A A . 19 MET HB2 1 1 17 8687 1 1 19 MET HB3 H 0.904 2.112 -1.671 1.00 . A A . 19 MET HB3 1 1 17 8688 1 1 19 MET HE1 H -1.484 6.152 -0.642 1.00 . A A . 19 MET HE1 1 1 17 8689 1 1 19 MET HE2 H 0.023 6.103 0.276 1.00 . A A . 19 MET HE2 1 1 17 8690 1 1 19 MET HE3 H -1.521 5.834 1.090 1.00 . A A . 19 MET HE3 1 1 17 8691 1 1 19 MET HG2 H 1.016 4.422 -1.431 1.00 . A A . 19 MET HG2 1 1 17 8692 1 1 19 MET HG3 H -0.484 4.676 -2.339 1.00 . A A . 19 MET HG3 1 1 17 8693 1 1 19 MET N N 0.002 3.495 -4.574 1.00 . A A . 19 MET N 1 1 17 8694 1 1 19 MET O O 0.410 0.961 -5.084 1.00 . A A . 19 MET O 1 1 17 8695 1 1 19 MET SD S -0.845 3.939 -0.124 1.00 . A A . 19 MET SD 1 1 17 8696 1 1 20 VAL C C 2.167 -1.330 -2.883 1.00 . A A . 20 VAL C 1 1 17 8697 1 1 20 VAL CA C 2.514 -0.463 -4.066 1.00 . A A . 20 VAL CA 1 1 17 8698 1 1 20 VAL CB C 4.020 -0.560 -4.392 1.00 . A A . 20 VAL CB 1 1 17 8699 1 1 20 VAL CG1 C 4.396 -1.975 -4.804 1.00 . A A . 20 VAL CG1 1 1 17 8700 1 1 20 VAL CG2 C 4.378 0.433 -5.493 1.00 . A A . 20 VAL CG2 1 1 17 8701 1 1 20 VAL H H 2.720 1.352 -3.076 1.00 . A A . 20 VAL H 1 1 17 8702 1 1 20 VAL HA H 1.934 -0.763 -4.926 1.00 . A A . 20 VAL HA 1 1 17 8703 1 1 20 VAL HB H 4.582 -0.301 -3.507 1.00 . A A . 20 VAL HB 1 1 17 8704 1 1 20 VAL HG11 H 4.160 -2.658 -4.002 1.00 . A A . 20 VAL HG11 1 1 17 8705 1 1 20 VAL HG12 H 5.453 -2.023 -5.021 1.00 . A A . 20 VAL HG12 1 1 17 8706 1 1 20 VAL HG13 H 3.832 -2.248 -5.683 1.00 . A A . 20 VAL HG13 1 1 17 8707 1 1 20 VAL HG21 H 3.805 0.205 -6.380 1.00 . A A . 20 VAL HG21 1 1 17 8708 1 1 20 VAL HG22 H 5.431 0.372 -5.722 1.00 . A A . 20 VAL HG22 1 1 17 8709 1 1 20 VAL HG23 H 4.140 1.433 -5.164 1.00 . A A . 20 VAL HG23 1 1 17 8710 1 1 20 VAL N N 2.157 0.861 -3.722 1.00 . A A . 20 VAL N 1 1 17 8711 1 1 20 VAL O O 2.650 -1.098 -1.763 1.00 . A A . 20 VAL O 1 1 17 8712 1 1 21 CYS C C 1.818 -4.174 -1.734 1.00 . A A . 21 CYS C 1 1 17 8713 1 1 21 CYS CA C 0.802 -3.122 -2.078 1.00 . A A . 21 CYS CA 1 1 17 8714 1 1 21 CYS CB C -0.507 -3.790 -2.495 1.00 . A A . 21 CYS CB 1 1 17 8715 1 1 21 CYS H H 0.977 -2.405 -4.031 1.00 . A A . 21 CYS H 1 1 17 8716 1 1 21 CYS HA H 0.611 -2.516 -1.204 1.00 . A A . 21 CYS HA 1 1 17 8717 1 1 21 CYS HB2 H -1.198 -3.041 -2.852 1.00 . A A . 21 CYS HB2 1 1 17 8718 1 1 21 CYS HB3 H -0.302 -4.485 -3.295 1.00 . A A . 21 CYS HB3 1 1 17 8719 1 1 21 CYS N N 1.297 -2.269 -3.115 1.00 . A A . 21 CYS N 1 1 17 8720 1 1 21 CYS O O 2.052 -5.094 -2.507 1.00 . A A . 21 CYS O 1 1 17 8721 1 1 21 CYS SG S -1.321 -4.719 -1.147 1.00 . A A . 21 CYS SG 1 1 17 8722 1 1 22 ARG C C 3.150 -5.165 1.387 1.00 . A A . 22 ARG C 1 1 17 8723 1 1 22 ARG CA C 3.408 -4.950 -0.100 1.00 . A A . 22 ARG CA 1 1 17 8724 1 1 22 ARG CB C 4.824 -4.376 -0.248 1.00 . A A . 22 ARG CB 1 1 17 8725 1 1 22 ARG CD C 5.639 -5.354 -2.449 1.00 . A A . 22 ARG CD 1 1 17 8726 1 1 22 ARG CG C 5.330 -4.090 -1.630 1.00 . A A . 22 ARG CG 1 1 17 8727 1 1 22 ARG CZ C 4.458 -7.446 -3.083 1.00 . A A . 22 ARG CZ 1 1 17 8728 1 1 22 ARG H H 2.236 -3.235 -0.040 1.00 . A A . 22 ARG H 1 1 17 8729 1 1 22 ARG HA H 3.340 -5.881 -0.644 1.00 . A A . 22 ARG HA 1 1 17 8730 1 1 22 ARG HB2 H 4.906 -3.461 0.318 1.00 . A A . 22 ARG HB2 1 1 17 8731 1 1 22 ARG HB3 H 5.509 -5.092 0.176 1.00 . A A . 22 ARG HB3 1 1 17 8732 1 1 22 ARG HD2 H 6.091 -5.052 -3.381 1.00 . A A . 22 ARG HD2 1 1 17 8733 1 1 22 ARG HD3 H 6.344 -5.959 -1.900 1.00 . A A . 22 ARG HD3 1 1 17 8734 1 1 22 ARG HE H 3.598 -5.664 -2.735 1.00 . A A . 22 ARG HE 1 1 17 8735 1 1 22 ARG HG2 H 4.614 -3.465 -2.136 1.00 . A A . 22 ARG HG2 1 1 17 8736 1 1 22 ARG HG3 H 6.248 -3.563 -1.428 1.00 . A A . 22 ARG HG3 1 1 17 8737 1 1 22 ARG HH11 H 6.466 -7.724 -2.788 1.00 . A A . 22 ARG HH11 1 1 17 8738 1 1 22 ARG HH12 H 5.651 -9.111 -3.301 1.00 . A A . 22 ARG HH12 1 1 17 8739 1 1 22 ARG HH21 H 2.438 -7.537 -3.430 1.00 . A A . 22 ARG HH21 1 1 17 8740 1 1 22 ARG HH22 H 3.249 -9.011 -3.675 1.00 . A A . 22 ARG HH22 1 1 17 8741 1 1 22 ARG N N 2.440 -4.018 -0.599 1.00 . A A . 22 ARG N 1 1 17 8742 1 1 22 ARG NE N 4.455 -6.158 -2.754 1.00 . A A . 22 ARG NE 1 1 17 8743 1 1 22 ARG NH1 N 5.593 -8.139 -3.057 1.00 . A A . 22 ARG NH1 1 1 17 8744 1 1 22 ARG NH2 N 3.310 -8.042 -3.419 1.00 . A A . 22 ARG NH2 1 1 17 8745 1 1 22 ARG O O 1.997 -4.965 1.909 1.00 . A A . 22 ARG O 1 1 17 8746 1 1 23 LEU C C 3.743 -4.455 4.199 1.00 . A A . 23 LEU C 1 1 17 8747 1 1 23 LEU CA C 4.220 -5.712 3.527 1.00 . A A . 23 LEU CA 1 1 17 8748 1 1 23 LEU CB C 5.601 -6.102 4.045 1.00 . A A . 23 LEU CB 1 1 17 8749 1 1 23 LEU CD1 C 7.579 -7.622 4.029 1.00 . A A . 23 LEU CD1 1 1 17 8750 1 1 23 LEU CD2 C 5.288 -8.593 3.863 1.00 . A A . 23 LEU CD2 1 1 17 8751 1 1 23 LEU CG C 6.179 -7.409 3.500 1.00 . A A . 23 LEU CG 1 1 17 8752 1 1 23 LEU H H 5.084 -5.561 1.591 1.00 . A A . 23 LEU H 1 1 17 8753 1 1 23 LEU HA H 3.516 -6.504 3.739 1.00 . A A . 23 LEU HA 1 1 17 8754 1 1 23 LEU HB2 H 6.287 -5.304 3.808 1.00 . A A . 23 LEU HB2 1 1 17 8755 1 1 23 LEU HB3 H 5.538 -6.188 5.118 1.00 . A A . 23 LEU HB3 1 1 17 8756 1 1 23 LEU HD11 H 8.214 -6.807 3.712 1.00 . A A . 23 LEU HD11 1 1 17 8757 1 1 23 LEU HD12 H 7.971 -8.554 3.647 1.00 . A A . 23 LEU HD12 1 1 17 8758 1 1 23 LEU HD13 H 7.556 -7.659 5.107 1.00 . A A . 23 LEU HD13 1 1 17 8759 1 1 23 LEU HD21 H 5.187 -8.651 4.937 1.00 . A A . 23 LEU HD21 1 1 17 8760 1 1 23 LEU HD22 H 5.738 -9.503 3.495 1.00 . A A . 23 LEU HD22 1 1 17 8761 1 1 23 LEU HD23 H 4.314 -8.469 3.414 1.00 . A A . 23 LEU HD23 1 1 17 8762 1 1 23 LEU HG H 6.232 -7.343 2.425 1.00 . A A . 23 LEU HG 1 1 17 8763 1 1 23 LEU N N 4.239 -5.500 2.087 1.00 . A A . 23 LEU N 1 1 17 8764 1 1 23 LEU O O 3.183 -4.495 5.280 1.00 . A A . 23 LEU O 1 1 17 8765 1 1 24 TRP C C 2.990 -1.393 2.663 1.00 . A A . 24 TRP C 1 1 17 8766 1 1 24 TRP CA C 3.423 -2.100 3.935 1.00 . A A . 24 TRP CA 1 1 17 8767 1 1 24 TRP CB C 4.385 -1.232 4.776 1.00 . A A . 24 TRP CB 1 1 17 8768 1 1 24 TRP CD1 C 5.584 0.577 3.460 1.00 . A A . 24 TRP CD1 1 1 17 8769 1 1 24 TRP CD2 C 6.825 -1.237 3.824 1.00 . A A . 24 TRP CD2 1 1 17 8770 1 1 24 TRP CE2 C 7.590 -0.313 3.094 1.00 . A A . 24 TRP CE2 1 1 17 8771 1 1 24 TRP CE3 C 7.398 -2.458 4.175 1.00 . A A . 24 TRP CE3 1 1 17 8772 1 1 24 TRP CG C 5.543 -0.646 4.039 1.00 . A A . 24 TRP CG 1 1 17 8773 1 1 24 TRP CH2 C 9.433 -1.773 3.068 1.00 . A A . 24 TRP CH2 1 1 17 8774 1 1 24 TRP CZ2 C 8.896 -0.571 2.713 1.00 . A A . 24 TRP CZ2 1 1 17 8775 1 1 24 TRP CZ3 C 8.697 -2.713 3.793 1.00 . A A . 24 TRP CZ3 1 1 17 8776 1 1 24 TRP H H 4.547 -3.355 2.746 1.00 . A A . 24 TRP H 1 1 17 8777 1 1 24 TRP HA H 2.562 -2.376 4.518 1.00 . A A . 24 TRP HA 1 1 17 8778 1 1 24 TRP HB2 H 3.830 -0.407 5.197 1.00 . A A . 24 TRP HB2 1 1 17 8779 1 1 24 TRP HB3 H 4.774 -1.831 5.586 1.00 . A A . 24 TRP HB3 1 1 17 8780 1 1 24 TRP HD1 H 4.739 1.253 3.475 1.00 . A A . 24 TRP HD1 1 1 17 8781 1 1 24 TRP HE1 H 7.071 1.606 2.400 1.00 . A A . 24 TRP HE1 1 1 17 8782 1 1 24 TRP HE3 H 6.842 -3.195 4.736 1.00 . A A . 24 TRP HE3 1 1 17 8783 1 1 24 TRP HH2 H 10.449 -2.017 2.791 1.00 . A A . 24 TRP HH2 1 1 17 8784 1 1 24 TRP HZ2 H 9.479 0.145 2.153 1.00 . A A . 24 TRP HZ2 1 1 17 8785 1 1 24 TRP HZ3 H 9.158 -3.653 4.053 1.00 . A A . 24 TRP HZ3 1 1 17 8786 1 1 24 TRP N N 3.986 -3.340 3.551 1.00 . A A . 24 TRP N 1 1 17 8787 1 1 24 TRP NE1 N 6.809 0.791 2.883 1.00 . A A . 24 TRP NE1 1 1 17 8788 1 1 24 TRP O O 3.343 -1.848 1.559 1.00 . A A . 24 TRP O 1 1 17 8789 1 1 25 CYS C C 2.905 1.417 1.294 1.00 . A A . 25 CYS C 1 1 17 8790 1 1 25 CYS CA C 1.848 0.399 1.610 1.00 . A A . 25 CYS CA 1 1 17 8791 1 1 25 CYS CB C 0.476 1.047 1.756 1.00 . A A . 25 CYS CB 1 1 17 8792 1 1 25 CYS H H 1.908 -0.038 3.655 1.00 . A A . 25 CYS H 1 1 17 8793 1 1 25 CYS HA H 1.816 -0.304 0.791 1.00 . A A . 25 CYS HA 1 1 17 8794 1 1 25 CYS HB2 H 0.400 1.495 2.736 1.00 . A A . 25 CYS HB2 1 1 17 8795 1 1 25 CYS HB3 H 0.363 1.813 1.003 1.00 . A A . 25 CYS HB3 1 1 17 8796 1 1 25 CYS N N 2.221 -0.351 2.777 1.00 . A A . 25 CYS N 1 1 17 8797 1 1 25 CYS O O 3.142 2.344 2.060 1.00 . A A . 25 CYS O 1 1 17 8798 1 1 25 CYS SG S -0.912 -0.119 1.578 1.00 . A A . 25 CYS SG 1 1 17 8799 1 1 26 LYS C C 4.044 3.036 -1.245 1.00 . A A . 26 LYS C 1 1 17 8800 1 1 26 LYS CA C 4.599 2.113 -0.208 1.00 . A A . 26 LYS CA 1 1 17 8801 1 1 26 LYS CB C 5.780 1.327 -0.781 1.00 . A A . 26 LYS CB 1 1 17 8802 1 1 26 LYS CD C 8.085 1.381 -1.830 1.00 . A A . 26 LYS CD 1 1 17 8803 1 1 26 LYS CE C 8.648 0.368 -0.843 1.00 . A A . 26 LYS CE 1 1 17 8804 1 1 26 LYS CG C 6.951 2.200 -1.224 1.00 . A A . 26 LYS CG 1 1 17 8805 1 1 26 LYS H H 3.314 0.469 -0.382 1.00 . A A . 26 LYS H 1 1 17 8806 1 1 26 LYS HA H 4.930 2.673 0.654 1.00 . A A . 26 LYS HA 1 1 17 8807 1 1 26 LYS HB2 H 6.131 0.644 -0.021 1.00 . A A . 26 LYS HB2 1 1 17 8808 1 1 26 LYS HB3 H 5.438 0.756 -1.632 1.00 . A A . 26 LYS HB3 1 1 17 8809 1 1 26 LYS HD2 H 7.708 0.851 -2.691 1.00 . A A . 26 LYS HD2 1 1 17 8810 1 1 26 LYS HD3 H 8.874 2.051 -2.139 1.00 . A A . 26 LYS HD3 1 1 17 8811 1 1 26 LYS HE2 H 8.993 0.891 0.036 1.00 . A A . 26 LYS HE2 1 1 17 8812 1 1 26 LYS HE3 H 7.867 -0.322 -0.565 1.00 . A A . 26 LYS HE3 1 1 17 8813 1 1 26 LYS HG2 H 6.595 2.903 -1.964 1.00 . A A . 26 LYS HG2 1 1 17 8814 1 1 26 LYS HG3 H 7.318 2.742 -0.366 1.00 . A A . 26 LYS HG3 1 1 17 8815 1 1 26 LYS HZ1 H 9.488 -0.838 -2.317 1.00 . A A . 26 LYS HZ1 1 1 17 8816 1 1 26 LYS HZ2 H 10.069 -1.151 -0.775 1.00 . A A . 26 LYS HZ2 1 1 17 8817 1 1 26 LYS HZ3 H 10.594 0.221 -1.603 1.00 . A A . 26 LYS HZ3 1 1 17 8818 1 1 26 LYS N N 3.562 1.224 0.194 1.00 . A A . 26 LYS N 1 1 17 8819 1 1 26 LYS NZ N 9.775 -0.394 -1.422 1.00 . A A . 26 LYS NZ 1 1 17 8820 1 1 26 LYS O O 3.615 2.589 -2.293 1.00 . A A . 26 LYS O 1 1 17 8821 1 1 27 LYS C C 4.516 5.551 -2.944 1.00 . A A . 27 LYS C 1 1 17 8822 1 1 27 LYS CA C 3.500 5.241 -1.903 1.00 . A A . 27 LYS CA 1 1 17 8823 1 1 27 LYS CB C 2.989 6.517 -1.224 1.00 . A A . 27 LYS CB 1 1 17 8824 1 1 27 LYS CD C 3.418 8.456 0.314 1.00 . A A . 27 LYS CD 1 1 17 8825 1 1 27 LYS CE C 4.439 9.161 1.192 1.00 . A A . 27 LYS CE 1 1 17 8826 1 1 27 LYS CG C 4.019 7.248 -0.374 1.00 . A A . 27 LYS CG 1 1 17 8827 1 1 27 LYS H H 4.423 4.597 -0.116 1.00 . A A . 27 LYS H 1 1 17 8828 1 1 27 LYS HA H 2.675 4.764 -2.405 1.00 . A A . 27 LYS HA 1 1 17 8829 1 1 27 LYS HB2 H 2.658 7.191 -2.000 1.00 . A A . 27 LYS HB2 1 1 17 8830 1 1 27 LYS HB3 H 2.143 6.249 -0.614 1.00 . A A . 27 LYS HB3 1 1 17 8831 1 1 27 LYS HD2 H 3.069 9.147 -0.437 1.00 . A A . 27 LYS HD2 1 1 17 8832 1 1 27 LYS HD3 H 2.587 8.137 0.925 1.00 . A A . 27 LYS HD3 1 1 17 8833 1 1 27 LYS HE2 H 4.857 8.448 1.887 1.00 . A A . 27 LYS HE2 1 1 17 8834 1 1 27 LYS HE3 H 5.224 9.554 0.564 1.00 . A A . 27 LYS HE3 1 1 17 8835 1 1 27 LYS HG2 H 4.390 6.568 0.378 1.00 . A A . 27 LYS HG2 1 1 17 8836 1 1 27 LYS HG3 H 4.829 7.563 -1.016 1.00 . A A . 27 LYS HG3 1 1 17 8837 1 1 27 LYS HZ1 H 3.414 10.974 1.316 1.00 . A A . 27 LYS HZ1 1 1 17 8838 1 1 27 LYS HZ2 H 4.517 10.747 2.563 1.00 . A A . 27 LYS HZ2 1 1 17 8839 1 1 27 LYS HZ3 H 3.059 9.915 2.558 1.00 . A A . 27 LYS HZ3 1 1 17 8840 1 1 27 LYS N N 4.029 4.298 -0.964 1.00 . A A . 27 LYS N 1 1 17 8841 1 1 27 LYS NZ N 3.829 10.266 1.952 1.00 . A A . 27 LYS NZ 1 1 17 8842 1 1 27 LYS O O 5.692 5.792 -2.641 1.00 . A A . 27 LYS O 1 1 17 8843 1 1 28 LYS C C 4.916 7.309 -5.485 1.00 . A A . 28 LYS C 1 1 17 8844 1 1 28 LYS CA C 4.981 5.838 -5.223 1.00 . A A . 28 LYS CA 1 1 17 8845 1 1 28 LYS CB C 4.734 4.990 -6.486 1.00 . A A . 28 LYS CB 1 1 17 8846 1 1 28 LYS CD C 5.579 4.322 -8.775 1.00 . A A . 28 LYS CD 1 1 17 8847 1 1 28 LYS CE C 6.409 4.741 -9.992 1.00 . A A . 28 LYS CE 1 1 17 8848 1 1 28 LYS CG C 5.655 5.347 -7.655 1.00 . A A . 28 LYS CG 1 1 17 8849 1 1 28 LYS H H 3.147 5.340 -4.324 1.00 . A A . 28 LYS H 1 1 17 8850 1 1 28 LYS HA H 5.974 5.633 -4.847 1.00 . A A . 28 LYS HA 1 1 17 8851 1 1 28 LYS HB2 H 4.882 3.950 -6.241 1.00 . A A . 28 LYS HB2 1 1 17 8852 1 1 28 LYS HB3 H 3.712 5.133 -6.803 1.00 . A A . 28 LYS HB3 1 1 17 8853 1 1 28 LYS HD2 H 5.955 3.378 -8.408 1.00 . A A . 28 LYS HD2 1 1 17 8854 1 1 28 LYS HD3 H 4.547 4.207 -9.073 1.00 . A A . 28 LYS HD3 1 1 17 8855 1 1 28 LYS HE2 H 6.446 3.913 -10.685 1.00 . A A . 28 LYS HE2 1 1 17 8856 1 1 28 LYS HE3 H 5.921 5.577 -10.471 1.00 . A A . 28 LYS HE3 1 1 17 8857 1 1 28 LYS HG2 H 5.366 6.310 -8.048 1.00 . A A . 28 LYS HG2 1 1 17 8858 1 1 28 LYS HG3 H 6.672 5.402 -7.293 1.00 . A A . 28 LYS HG3 1 1 17 8859 1 1 28 LYS HZ1 H 7.801 6.054 -9.159 1.00 . A A . 28 LYS HZ1 1 1 17 8860 1 1 28 LYS HZ2 H 8.390 5.237 -10.489 1.00 . A A . 28 LYS HZ2 1 1 17 8861 1 1 28 LYS HZ3 H 8.276 4.442 -9.017 1.00 . A A . 28 LYS HZ3 1 1 17 8862 1 1 28 LYS N N 4.098 5.529 -4.158 1.00 . A A . 28 LYS N 1 1 17 8863 1 1 28 LYS NZ N 7.800 5.124 -9.639 1.00 . A A . 28 LYS NZ 1 1 17 8864 1 1 28 LYS O O 4.103 7.794 -6.259 1.00 . A A . 28 LYS O 1 1 17 8865 1 1 29 LEU C C 7.009 9.768 -5.744 1.00 . A A . 29 LEU C 1 1 17 8866 1 1 29 LEU CA C 5.810 9.448 -4.847 1.00 . A A . 29 LEU CA 1 1 17 8867 1 1 29 LEU CB C 5.974 10.039 -3.433 1.00 . A A . 29 LEU CB 1 1 17 8868 1 1 29 LEU CD1 C 4.576 12.113 -3.710 1.00 . A A . 29 LEU CD1 1 1 17 8869 1 1 29 LEU CD2 C 6.282 11.980 -1.884 1.00 . A A . 29 LEU CD2 1 1 17 8870 1 1 29 LEU CG C 5.932 11.561 -3.298 1.00 . A A . 29 LEU CG 1 1 17 8871 1 1 29 LEU H H 6.260 7.553 -4.071 1.00 . A A . 29 LEU H 1 1 17 8872 1 1 29 LEU HA H 4.903 9.823 -5.300 1.00 . A A . 29 LEU HA 1 1 17 8873 1 1 29 LEU HB2 H 5.188 9.634 -2.814 1.00 . A A . 29 LEU HB2 1 1 17 8874 1 1 29 LEU HB3 H 6.918 9.692 -3.037 1.00 . A A . 29 LEU HB3 1 1 17 8875 1 1 29 LEU HD11 H 4.575 13.186 -3.589 1.00 . A A . 29 LEU HD11 1 1 17 8876 1 1 29 LEU HD12 H 3.806 11.681 -3.087 1.00 . A A . 29 LEU HD12 1 1 17 8877 1 1 29 LEU HD13 H 4.382 11.868 -4.744 1.00 . A A . 29 LEU HD13 1 1 17 8878 1 1 29 LEU HD21 H 5.575 11.546 -1.192 1.00 . A A . 29 LEU HD21 1 1 17 8879 1 1 29 LEU HD22 H 6.245 13.058 -1.810 1.00 . A A . 29 LEU HD22 1 1 17 8880 1 1 29 LEU HD23 H 7.277 11.637 -1.643 1.00 . A A . 29 LEU HD23 1 1 17 8881 1 1 29 LEU HG H 6.665 11.980 -3.967 1.00 . A A . 29 LEU HG 1 1 17 8882 1 1 29 LEU N N 5.713 8.018 -4.741 1.00 . A A . 29 LEU N 1 1 17 8883 1 1 29 LEU O O 7.331 10.927 -6.023 1.00 . A A . 29 LEU O 1 1 17 8884 1 1 30 TRP C C 8.256 8.735 -8.485 1.00 . A A . 30 TRP C 1 1 17 8885 1 1 30 TRP CA C 8.777 8.760 -7.063 1.00 . A A . 30 TRP CA 1 1 17 8886 1 1 30 TRP CB C 9.678 7.541 -6.808 1.00 . A A . 30 TRP CB 1 1 17 8887 1 1 30 TRP CD1 C 11.224 7.347 -8.857 1.00 . A A . 30 TRP CD1 1 1 17 8888 1 1 30 TRP CD2 C 12.284 7.786 -6.939 1.00 . A A . 30 TRP CD2 1 1 17 8889 1 1 30 TRP CE2 C 13.239 7.709 -7.972 1.00 . A A . 30 TRP CE2 1 1 17 8890 1 1 30 TRP CE3 C 12.719 8.051 -5.639 1.00 . A A . 30 TRP CE3 1 1 17 8891 1 1 30 TRP CG C 10.999 7.567 -7.528 1.00 . A A . 30 TRP CG 1 1 17 8892 1 1 30 TRP CH2 C 14.992 8.145 -6.459 1.00 . A A . 30 TRP CH2 1 1 17 8893 1 1 30 TRP CZ2 C 14.597 7.887 -7.741 1.00 . A A . 30 TRP CZ2 1 1 17 8894 1 1 30 TRP CZ3 C 14.069 8.227 -5.412 1.00 . A A . 30 TRP CZ3 1 1 17 8895 1 1 30 TRP H H 7.299 7.836 -5.924 1.00 . A A . 30 TRP H 1 1 17 8896 1 1 30 TRP HA H 9.330 9.670 -6.881 1.00 . A A . 30 TRP HA 1 1 17 8897 1 1 30 TRP HB2 H 9.886 7.470 -5.751 1.00 . A A . 30 TRP HB2 1 1 17 8898 1 1 30 TRP HB3 H 9.146 6.654 -7.119 1.00 . A A . 30 TRP HB3 1 1 17 8899 1 1 30 TRP HD1 H 10.446 7.142 -9.579 1.00 . A A . 30 TRP HD1 1 1 17 8900 1 1 30 TRP HE1 H 12.970 7.335 -10.022 1.00 . A A . 30 TRP HE1 1 1 17 8901 1 1 30 TRP HE3 H 12.017 8.118 -4.820 1.00 . A A . 30 TRP HE3 1 1 17 8902 1 1 30 TRP HH2 H 16.039 8.290 -6.236 1.00 . A A . 30 TRP HH2 1 1 17 8903 1 1 30 TRP HZ2 H 15.330 7.830 -8.533 1.00 . A A . 30 TRP HZ2 1 1 17 8904 1 1 30 TRP HZ3 H 14.422 8.432 -4.413 1.00 . A A . 30 TRP HZ3 1 1 17 8905 1 1 30 TRP N N 7.641 8.709 -6.192 1.00 . A A . 30 TRP N 1 1 17 8906 1 1 30 TRP NE1 N 12.566 7.440 -9.130 1.00 . A A . 30 TRP NE1 1 1 17 8907 1 1 30 TRP O O 7.803 7.668 -8.936 1.00 . A A . 30 TRP O 1 1 17 8908 1 1 30 TRP OXT O 8.267 9.780 -9.149 1.00 . A A . 30 TRP OXT 1 1 18 8909 1 1 1 TYR C C -10.678 0.447 1.862 1.00 . A A . 1 TYR C 1 1 18 8910 1 1 1 TYR CA C -12.045 0.713 2.475 1.00 . A A . 1 TYR CA 1 1 18 8911 1 1 1 TYR CB C -11.957 0.825 4.009 1.00 . A A . 1 TYR CB 1 1 18 8912 1 1 1 TYR CD1 C -10.119 2.132 5.157 1.00 . A A . 1 TYR CD1 1 1 18 8913 1 1 1 TYR CD2 C -11.970 3.323 4.276 1.00 . A A . 1 TYR CD2 1 1 18 8914 1 1 1 TYR CE1 C -9.558 3.318 5.576 1.00 . A A . 1 TYR CE1 1 1 18 8915 1 1 1 TYR CE2 C -11.420 4.507 4.692 1.00 . A A . 1 TYR CE2 1 1 18 8916 1 1 1 TYR CG C -11.337 2.116 4.500 1.00 . A A . 1 TYR CG 1 1 18 8917 1 1 1 TYR CZ C -10.215 4.503 5.337 1.00 . A A . 1 TYR CZ 1 1 18 8918 1 1 1 TYR H1 H -12.988 -0.398 1.061 1.00 . A A . 1 TYR H1 1 1 18 8919 1 1 1 TYR H2 H -13.870 -0.288 2.509 1.00 . A A . 1 TYR H2 1 1 18 8920 1 1 1 TYR H3 H -12.493 -1.281 2.398 1.00 . A A . 1 TYR H3 1 1 18 8921 1 1 1 TYR HA H -12.442 1.627 2.057 1.00 . A A . 1 TYR HA 1 1 18 8922 1 1 1 TYR HB2 H -12.954 0.772 4.412 1.00 . A A . 1 TYR HB2 1 1 18 8923 1 1 1 TYR HB3 H -11.372 0.002 4.394 1.00 . A A . 1 TYR HB3 1 1 18 8924 1 1 1 TYR HD1 H -9.602 1.202 5.345 1.00 . A A . 1 TYR HD1 1 1 18 8925 1 1 1 TYR HD2 H -12.924 3.336 3.768 1.00 . A A . 1 TYR HD2 1 1 18 8926 1 1 1 TYR HE1 H -8.606 3.311 6.087 1.00 . A A . 1 TYR HE1 1 1 18 8927 1 1 1 TYR HE2 H -11.940 5.434 4.500 1.00 . A A . 1 TYR HE2 1 1 18 8928 1 1 1 TYR HH H -8.772 5.724 5.380 1.00 . A A . 1 TYR HH 1 1 18 8929 1 1 1 TYR N N -12.922 -0.383 2.100 1.00 . A A . 1 TYR N 1 1 18 8930 1 1 1 TYR O O -10.420 -0.669 1.375 1.00 . A A . 1 TYR O 1 1 18 8931 1 1 1 TYR OH O -9.666 5.683 5.746 1.00 . A A . 1 TYR OH 1 1 18 8932 1 1 2 CYS C C -7.445 1.628 2.283 1.00 . A A . 2 CYS C 1 1 18 8933 1 1 2 CYS CA C -8.521 1.287 1.266 1.00 . A A . 2 CYS CA 1 1 18 8934 1 1 2 CYS CB C -8.442 2.212 0.061 1.00 . A A . 2 CYS CB 1 1 18 8935 1 1 2 CYS H H -10.031 2.267 2.333 1.00 . A A . 2 CYS H 1 1 18 8936 1 1 2 CYS HA H -8.394 0.266 0.942 1.00 . A A . 2 CYS HA 1 1 18 8937 1 1 2 CYS HB2 H -9.333 2.111 -0.538 1.00 . A A . 2 CYS HB2 1 1 18 8938 1 1 2 CYS HB3 H -8.367 3.218 0.440 1.00 . A A . 2 CYS HB3 1 1 18 8939 1 1 2 CYS N N -9.815 1.420 1.880 1.00 . A A . 2 CYS N 1 1 18 8940 1 1 2 CYS O O -7.687 2.416 3.204 1.00 . A A . 2 CYS O 1 1 18 8941 1 1 2 CYS SG S -7.020 1.934 -1.012 1.00 . A A . 2 CYS SG 1 1 18 8942 1 1 3 GLN C C -4.456 2.554 2.823 1.00 . A A . 3 GLN C 1 1 18 8943 1 1 3 GLN CA C -5.197 1.254 3.075 1.00 . A A . 3 GLN CA 1 1 18 8944 1 1 3 GLN CB C -4.200 0.086 3.033 1.00 . A A . 3 GLN CB 1 1 18 8945 1 1 3 GLN CD C -5.500 -1.422 4.584 1.00 . A A . 3 GLN CD 1 1 18 8946 1 1 3 GLN CG C -4.812 -1.292 3.249 1.00 . A A . 3 GLN CG 1 1 18 8947 1 1 3 GLN H H -6.128 0.558 1.287 1.00 . A A . 3 GLN H 1 1 18 8948 1 1 3 GLN HA H -5.645 1.292 4.056 1.00 . A A . 3 GLN HA 1 1 18 8949 1 1 3 GLN HB2 H -3.676 0.096 2.092 1.00 . A A . 3 GLN HB2 1 1 18 8950 1 1 3 GLN HB3 H -3.474 0.251 3.816 1.00 . A A . 3 GLN HB3 1 1 18 8951 1 1 3 GLN HE21 H -3.804 -1.999 5.428 1.00 . A A . 3 GLN HE21 1 1 18 8952 1 1 3 GLN HE22 H -5.190 -1.872 6.462 1.00 . A A . 3 GLN HE22 1 1 18 8953 1 1 3 GLN HG2 H -5.538 -1.477 2.470 1.00 . A A . 3 GLN HG2 1 1 18 8954 1 1 3 GLN HG3 H -4.029 -2.034 3.188 1.00 . A A . 3 GLN HG3 1 1 18 8955 1 1 3 GLN N N -6.272 1.074 2.108 1.00 . A A . 3 GLN N 1 1 18 8956 1 1 3 GLN NE2 N -4.760 -1.807 5.583 1.00 . A A . 3 GLN NE2 1 1 18 8957 1 1 3 GLN O O -4.410 3.051 1.695 1.00 . A A . 3 GLN O 1 1 18 8958 1 1 3 GLN OE1 O -6.697 -1.170 4.713 1.00 . A A . 3 GLN OE1 1 1 18 8959 1 1 4 LYS C C -1.676 3.983 3.597 1.00 . A A . 4 LYS C 1 1 18 8960 1 1 4 LYS CA C -3.148 4.334 3.806 1.00 . A A . 4 LYS CA 1 1 18 8961 1 1 4 LYS CB C -3.358 5.123 5.106 1.00 . A A . 4 LYS CB 1 1 18 8962 1 1 4 LYS CD C -5.078 6.228 6.682 1.00 . A A . 4 LYS CD 1 1 18 8963 1 1 4 LYS CE C -4.737 7.728 6.589 1.00 . A A . 4 LYS CE 1 1 18 8964 1 1 4 LYS CG C -4.829 5.437 5.385 1.00 . A A . 4 LYS CG 1 1 18 8965 1 1 4 LYS H H -3.999 2.658 4.740 1.00 . A A . 4 LYS H 1 1 18 8966 1 1 4 LYS HA H -3.502 4.913 2.966 1.00 . A A . 4 LYS HA 1 1 18 8967 1 1 4 LYS HB2 H -2.967 4.550 5.934 1.00 . A A . 4 LYS HB2 1 1 18 8968 1 1 4 LYS HB3 H -2.823 6.055 5.035 1.00 . A A . 4 LYS HB3 1 1 18 8969 1 1 4 LYS HD2 H -6.124 6.138 6.940 1.00 . A A . 4 LYS HD2 1 1 18 8970 1 1 4 LYS HD3 H -4.489 5.780 7.468 1.00 . A A . 4 LYS HD3 1 1 18 8971 1 1 4 LYS HE2 H -5.258 8.145 5.740 1.00 . A A . 4 LYS HE2 1 1 18 8972 1 1 4 LYS HE3 H -5.092 8.214 7.485 1.00 . A A . 4 LYS HE3 1 1 18 8973 1 1 4 LYS HG2 H -5.209 6.023 4.562 1.00 . A A . 4 LYS HG2 1 1 18 8974 1 1 4 LYS HG3 H -5.370 4.503 5.431 1.00 . A A . 4 LYS HG3 1 1 18 8975 1 1 4 LYS HZ1 H -2.736 7.584 7.188 1.00 . A A . 4 LYS HZ1 1 1 18 8976 1 1 4 LYS HZ2 H -3.148 9.039 6.471 1.00 . A A . 4 LYS HZ2 1 1 18 8977 1 1 4 LYS HZ3 H -2.936 7.691 5.505 1.00 . A A . 4 LYS HZ3 1 1 18 8978 1 1 4 LYS N N -3.905 3.104 3.873 1.00 . A A . 4 LYS N 1 1 18 8979 1 1 4 LYS NZ N -3.297 8.011 6.424 1.00 . A A . 4 LYS NZ 1 1 18 8980 1 1 4 LYS O O -1.269 2.879 3.934 1.00 . A A . 4 LYS O 1 1 18 8981 1 1 5 TRP C C 1.366 4.322 4.015 1.00 . A A . 5 TRP C 1 1 18 8982 1 1 5 TRP CA C 0.544 4.612 2.759 1.00 . A A . 5 TRP CA 1 1 18 8983 1 1 5 TRP CB C 1.228 5.726 1.907 1.00 . A A . 5 TRP CB 1 1 18 8984 1 1 5 TRP CD1 C 2.526 7.274 3.491 1.00 . A A . 5 TRP CD1 1 1 18 8985 1 1 5 TRP CD2 C 0.724 8.223 2.585 1.00 . A A . 5 TRP CD2 1 1 18 8986 1 1 5 TRP CE2 C 1.339 9.144 3.453 1.00 . A A . 5 TRP CE2 1 1 18 8987 1 1 5 TRP CE3 C -0.422 8.612 1.901 1.00 . A A . 5 TRP CE3 1 1 18 8988 1 1 5 TRP CG C 1.489 7.015 2.645 1.00 . A A . 5 TRP CG 1 1 18 8989 1 1 5 TRP CH2 C -0.271 10.774 2.969 1.00 . A A . 5 TRP CH2 1 1 18 8990 1 1 5 TRP CZ2 C 0.849 10.416 3.653 1.00 . A A . 5 TRP CZ2 1 1 18 8991 1 1 5 TRP CZ3 C -0.905 9.888 2.096 1.00 . A A . 5 TRP CZ3 1 1 18 8992 1 1 5 TRP H H -1.223 5.824 2.951 1.00 . A A . 5 TRP H 1 1 18 8993 1 1 5 TRP HA H 0.518 3.701 2.179 1.00 . A A . 5 TRP HA 1 1 18 8994 1 1 5 TRP HB2 H 2.181 5.361 1.553 1.00 . A A . 5 TRP HB2 1 1 18 8995 1 1 5 TRP HB3 H 0.603 5.947 1.055 1.00 . A A . 5 TRP HB3 1 1 18 8996 1 1 5 TRP HD1 H 3.295 6.558 3.746 1.00 . A A . 5 TRP HD1 1 1 18 8997 1 1 5 TRP HE1 H 3.041 8.938 4.643 1.00 . A A . 5 TRP HE1 1 1 18 8998 1 1 5 TRP HE3 H -0.931 7.945 1.222 1.00 . A A . 5 TRP HE3 1 1 18 8999 1 1 5 TRP HH2 H -0.685 11.764 3.093 1.00 . A A . 5 TRP HH2 1 1 18 9000 1 1 5 TRP HZ2 H 1.335 11.099 4.334 1.00 . A A . 5 TRP HZ2 1 1 18 9001 1 1 5 TRP HZ3 H -1.792 10.208 1.572 1.00 . A A . 5 TRP HZ3 1 1 18 9002 1 1 5 TRP N N -0.868 4.922 3.091 1.00 . A A . 5 TRP N 1 1 18 9003 1 1 5 TRP NE1 N 2.422 8.534 3.996 1.00 . A A . 5 TRP NE1 1 1 18 9004 1 1 5 TRP O O 2.403 3.683 3.955 1.00 . A A . 5 TRP O 1 1 18 9005 1 1 6 MET C C 1.178 3.249 6.993 1.00 . A A . 6 MET C 1 1 18 9006 1 1 6 MET CA C 1.552 4.613 6.413 1.00 . A A . 6 MET CA 1 1 18 9007 1 1 6 MET CB C 1.171 5.751 7.366 1.00 . A A . 6 MET CB 1 1 18 9008 1 1 6 MET CE C 2.181 6.536 11.324 1.00 . A A . 6 MET CE 1 1 18 9009 1 1 6 MET CG C 1.758 5.631 8.754 1.00 . A A . 6 MET CG 1 1 18 9010 1 1 6 MET H H 0.076 5.353 5.092 1.00 . A A . 6 MET H 1 1 18 9011 1 1 6 MET HA H 2.619 4.640 6.243 1.00 . A A . 6 MET HA 1 1 18 9012 1 1 6 MET HB2 H 1.498 6.689 6.936 1.00 . A A . 6 MET HB2 1 1 18 9013 1 1 6 MET HB3 H 0.094 5.776 7.454 1.00 . A A . 6 MET HB3 1 1 18 9014 1 1 6 MET HE1 H 1.737 5.616 11.674 1.00 . A A . 6 MET HE1 1 1 18 9015 1 1 6 MET HE2 H 2.060 7.304 12.075 1.00 . A A . 6 MET HE2 1 1 18 9016 1 1 6 MET HE3 H 3.233 6.379 11.139 1.00 . A A . 6 MET HE3 1 1 18 9017 1 1 6 MET HG2 H 1.357 4.738 9.213 1.00 . A A . 6 MET HG2 1 1 18 9018 1 1 6 MET HG3 H 2.826 5.526 8.647 1.00 . A A . 6 MET HG3 1 1 18 9019 1 1 6 MET N N 0.894 4.812 5.137 1.00 . A A . 6 MET N 1 1 18 9020 1 1 6 MET O O 1.847 2.717 7.874 1.00 . A A . 6 MET O 1 1 18 9021 1 1 6 MET SD S 1.381 7.046 9.804 1.00 . A A . 6 MET SD 1 1 18 9022 1 1 7 TRP C C 0.380 0.274 6.128 1.00 . A A . 7 TRP C 1 1 18 9023 1 1 7 TRP CA C -0.345 1.377 6.889 1.00 . A A . 7 TRP CA 1 1 18 9024 1 1 7 TRP CB C -1.861 1.246 6.665 1.00 . A A . 7 TRP CB 1 1 18 9025 1 1 7 TRP CD1 C -2.327 2.937 8.561 1.00 . A A . 7 TRP CD1 1 1 18 9026 1 1 7 TRP CD2 C -4.151 2.149 7.535 1.00 . A A . 7 TRP CD2 1 1 18 9027 1 1 7 TRP CE2 C -4.554 3.052 8.532 1.00 . A A . 7 TRP CE2 1 1 18 9028 1 1 7 TRP CE3 C -5.126 1.524 6.757 1.00 . A A . 7 TRP CE3 1 1 18 9029 1 1 7 TRP CG C -2.724 2.091 7.560 1.00 . A A . 7 TRP CG 1 1 18 9030 1 1 7 TRP CH2 C -6.822 2.717 7.991 1.00 . A A . 7 TRP CH2 1 1 18 9031 1 1 7 TRP CZ2 C -5.892 3.343 8.769 1.00 . A A . 7 TRP CZ2 1 1 18 9032 1 1 7 TRP CZ3 C -6.449 1.814 6.992 1.00 . A A . 7 TRP CZ3 1 1 18 9033 1 1 7 TRP H H -0.306 3.140 5.721 1.00 . A A . 7 TRP H 1 1 18 9034 1 1 7 TRP HA H -0.135 1.273 7.943 1.00 . A A . 7 TRP HA 1 1 18 9035 1 1 7 TRP HB2 H -2.081 1.540 5.650 1.00 . A A . 7 TRP HB2 1 1 18 9036 1 1 7 TRP HB3 H -2.154 0.215 6.792 1.00 . A A . 7 TRP HB3 1 1 18 9037 1 1 7 TRP HD1 H -1.298 3.114 8.839 1.00 . A A . 7 TRP HD1 1 1 18 9038 1 1 7 TRP HE1 H -3.410 4.168 9.885 1.00 . A A . 7 TRP HE1 1 1 18 9039 1 1 7 TRP HE3 H -4.855 0.821 5.984 1.00 . A A . 7 TRP HE3 1 1 18 9040 1 1 7 TRP HH2 H -7.872 2.916 8.144 1.00 . A A . 7 TRP HH2 1 1 18 9041 1 1 7 TRP HZ2 H -6.201 4.039 9.534 1.00 . A A . 7 TRP HZ2 1 1 18 9042 1 1 7 TRP HZ3 H -7.215 1.338 6.397 1.00 . A A . 7 TRP HZ3 1 1 18 9043 1 1 7 TRP N N 0.137 2.680 6.463 1.00 . A A . 7 TRP N 1 1 18 9044 1 1 7 TRP NE1 N -3.427 3.519 9.145 1.00 . A A . 7 TRP NE1 1 1 18 9045 1 1 7 TRP O O 1.380 0.523 5.434 1.00 . A A . 7 TRP O 1 1 18 9046 1 1 8 THR C C -0.668 -2.768 4.853 1.00 . A A . 8 THR C 1 1 18 9047 1 1 8 THR CA C 0.470 -2.056 5.602 1.00 . A A . 8 THR CA 1 1 18 9048 1 1 8 THR CB C 1.128 -3.016 6.640 1.00 . A A . 8 THR CB 1 1 18 9049 1 1 8 THR CG2 C 2.313 -2.352 7.344 1.00 . A A . 8 THR CG2 1 1 18 9050 1 1 8 THR H H -0.862 -1.099 6.854 1.00 . A A . 8 THR H 1 1 18 9051 1 1 8 THR HA H 1.222 -1.688 4.915 1.00 . A A . 8 THR HA 1 1 18 9052 1 1 8 THR HB H 1.481 -3.896 6.120 1.00 . A A . 8 THR HB 1 1 18 9053 1 1 8 THR HG1 H 0.688 -3.645 8.422 1.00 . A A . 8 THR HG1 1 1 18 9054 1 1 8 THR HG21 H 1.977 -1.440 7.811 1.00 . A A . 8 THR HG21 1 1 18 9055 1 1 8 THR HG22 H 3.098 -2.118 6.642 1.00 . A A . 8 THR HG22 1 1 18 9056 1 1 8 THR HG23 H 2.701 -3.013 8.104 1.00 . A A . 8 THR HG23 1 1 18 9057 1 1 8 THR N N -0.089 -0.926 6.274 1.00 . A A . 8 THR N 1 1 18 9058 1 1 8 THR O O -1.854 -2.439 5.086 1.00 . A A . 8 THR O 1 1 18 9059 1 1 8 THR OG1 O 0.172 -3.421 7.637 1.00 . A A . 8 THR OG1 1 1 18 9060 1 1 9 CYS C C -1.127 -5.884 3.206 1.00 . A A . 9 CYS C 1 1 18 9061 1 1 9 CYS CA C -1.445 -4.405 3.320 1.00 . A A . 9 CYS CA 1 1 18 9062 1 1 9 CYS CB C -1.854 -3.765 1.982 1.00 . A A . 9 CYS CB 1 1 18 9063 1 1 9 CYS H H 0.538 -3.944 3.654 1.00 . A A . 9 CYS H 1 1 18 9064 1 1 9 CYS HA H -2.277 -4.327 4.005 1.00 . A A . 9 CYS HA 1 1 18 9065 1 1 9 CYS HB2 H -2.662 -4.338 1.551 1.00 . A A . 9 CYS HB2 1 1 18 9066 1 1 9 CYS HB3 H -2.209 -2.765 2.178 1.00 . A A . 9 CYS HB3 1 1 18 9067 1 1 9 CYS N N -0.371 -3.695 3.951 1.00 . A A . 9 CYS N 1 1 18 9068 1 1 9 CYS O O -0.096 -6.345 3.719 1.00 . A A . 9 CYS O 1 1 18 9069 1 1 9 CYS SG S -0.553 -3.656 0.727 1.00 . A A . 9 CYS SG 1 1 18 9070 1 1 10 ASP C C -2.416 -8.405 1.096 1.00 . A A . 10 ASP C 1 1 18 9071 1 1 10 ASP CA C -1.895 -8.060 2.455 1.00 . A A . 10 ASP CA 1 1 18 9072 1 1 10 ASP CB C -2.791 -8.820 3.465 1.00 . A A . 10 ASP CB 1 1 18 9073 1 1 10 ASP CG C -2.447 -8.652 4.913 1.00 . A A . 10 ASP CG 1 1 18 9074 1 1 10 ASP H H -2.812 -6.204 2.194 1.00 . A A . 10 ASP H 1 1 18 9075 1 1 10 ASP HA H -0.868 -8.367 2.576 1.00 . A A . 10 ASP HA 1 1 18 9076 1 1 10 ASP HB2 H -3.809 -8.480 3.340 1.00 . A A . 10 ASP HB2 1 1 18 9077 1 1 10 ASP HB3 H -2.757 -9.870 3.220 1.00 . A A . 10 ASP HB3 1 1 18 9078 1 1 10 ASP N N -2.024 -6.624 2.610 1.00 . A A . 10 ASP N 1 1 18 9079 1 1 10 ASP O O -2.593 -7.528 0.251 1.00 . A A . 10 ASP O 1 1 18 9080 1 1 10 ASP OD1 O -1.528 -9.316 5.400 1.00 . A A . 10 ASP OD1 1 1 18 9081 1 1 10 ASP OD2 O -3.141 -7.910 5.604 1.00 . A A . 10 ASP OD2 1 1 18 9082 1 1 11 SER C C -4.859 -9.790 -0.047 1.00 . A A . 11 SER C 1 1 18 9083 1 1 11 SER CA C -3.367 -10.100 -0.286 1.00 . A A . 11 SER CA 1 1 18 9084 1 1 11 SER CB C -3.135 -11.593 -0.469 1.00 . A A . 11 SER CB 1 1 18 9085 1 1 11 SER H H -2.298 -10.351 1.484 1.00 . A A . 11 SER H 1 1 18 9086 1 1 11 SER HA H -3.006 -9.554 -1.145 1.00 . A A . 11 SER HA 1 1 18 9087 1 1 11 SER HB2 H -3.621 -12.127 0.334 1.00 . A A . 11 SER HB2 1 1 18 9088 1 1 11 SER HB3 H -3.532 -11.915 -1.420 1.00 . A A . 11 SER HB3 1 1 18 9089 1 1 11 SER HG H -1.588 -12.785 -0.709 1.00 . A A . 11 SER HG 1 1 18 9090 1 1 11 SER N N -2.654 -9.668 0.877 1.00 . A A . 11 SER N 1 1 18 9091 1 1 11 SER O O -5.606 -9.471 -0.971 1.00 . A A . 11 SER O 1 1 18 9092 1 1 11 SER OG O -1.738 -11.872 -0.431 1.00 . A A . 11 SER OG 1 1 18 9093 1 1 12 GLU C C -6.807 -8.017 1.678 1.00 . A A . 12 GLU C 1 1 18 9094 1 1 12 GLU CA C -6.594 -9.537 1.681 1.00 . A A . 12 GLU CA 1 1 18 9095 1 1 12 GLU CB C -6.783 -10.085 3.101 1.00 . A A . 12 GLU CB 1 1 18 9096 1 1 12 GLU CD C -6.464 -12.018 4.680 1.00 . A A . 12 GLU CD 1 1 18 9097 1 1 12 GLU CG C -6.445 -11.561 3.245 1.00 . A A . 12 GLU CG 1 1 18 9098 1 1 12 GLU H H -4.561 -10.063 1.897 1.00 . A A . 12 GLU H 1 1 18 9099 1 1 12 GLU HA H -7.296 -10.010 1.013 1.00 . A A . 12 GLU HA 1 1 18 9100 1 1 12 GLU HB2 H -6.149 -9.532 3.778 1.00 . A A . 12 GLU HB2 1 1 18 9101 1 1 12 GLU HB3 H -7.813 -9.944 3.396 1.00 . A A . 12 GLU HB3 1 1 18 9102 1 1 12 GLU HG2 H -7.169 -12.141 2.691 1.00 . A A . 12 GLU HG2 1 1 18 9103 1 1 12 GLU HG3 H -5.461 -11.734 2.836 1.00 . A A . 12 GLU HG3 1 1 18 9104 1 1 12 GLU N N -5.240 -9.827 1.234 1.00 . A A . 12 GLU N 1 1 18 9105 1 1 12 GLU O O -7.503 -7.476 0.805 1.00 . A A . 12 GLU O 1 1 18 9106 1 1 12 GLU OE1 O -7.357 -12.797 5.064 1.00 . A A . 12 GLU OE1 1 1 18 9107 1 1 12 GLU OE2 O -5.576 -11.595 5.457 1.00 . A A . 12 GLU OE2 1 1 18 9108 1 1 13 ARG C C -5.512 -5.297 1.548 1.00 . A A . 13 ARG C 1 1 18 9109 1 1 13 ARG CA C -6.212 -5.880 2.744 1.00 . A A . 13 ARG CA 1 1 18 9110 1 1 13 ARG CB C -5.512 -5.375 4.026 1.00 . A A . 13 ARG CB 1 1 18 9111 1 1 13 ARG CD C -5.379 -5.230 6.539 1.00 . A A . 13 ARG CD 1 1 18 9112 1 1 13 ARG CG C -6.123 -5.838 5.345 1.00 . A A . 13 ARG CG 1 1 18 9113 1 1 13 ARG CZ C -2.939 -4.930 7.095 1.00 . A A . 13 ARG CZ 1 1 18 9114 1 1 13 ARG H H -5.619 -7.829 3.290 1.00 . A A . 13 ARG H 1 1 18 9115 1 1 13 ARG HA H -7.244 -5.567 2.745 1.00 . A A . 13 ARG HA 1 1 18 9116 1 1 13 ARG HB2 H -4.485 -5.709 4.006 1.00 . A A . 13 ARG HB2 1 1 18 9117 1 1 13 ARG HB3 H -5.518 -4.295 4.011 1.00 . A A . 13 ARG HB3 1 1 18 9118 1 1 13 ARG HD2 H -5.420 -4.153 6.453 1.00 . A A . 13 ARG HD2 1 1 18 9119 1 1 13 ARG HD3 H -5.870 -5.534 7.452 1.00 . A A . 13 ARG HD3 1 1 18 9120 1 1 13 ARG HE H -3.768 -6.538 6.206 1.00 . A A . 13 ARG HE 1 1 18 9121 1 1 13 ARG HG2 H -7.156 -5.529 5.380 1.00 . A A . 13 ARG HG2 1 1 18 9122 1 1 13 ARG HG3 H -6.062 -6.915 5.402 1.00 . A A . 13 ARG HG3 1 1 18 9123 1 1 13 ARG HH11 H -4.062 -3.355 7.764 1.00 . A A . 13 ARG HH11 1 1 18 9124 1 1 13 ARG HH12 H -2.395 -3.191 8.039 1.00 . A A . 13 ARG HH12 1 1 18 9125 1 1 13 ARG HH21 H -1.524 -6.326 6.649 1.00 . A A . 13 ARG HH21 1 1 18 9126 1 1 13 ARG HH22 H -0.926 -4.898 7.397 1.00 . A A . 13 ARG HH22 1 1 18 9127 1 1 13 ARG N N -6.159 -7.336 2.640 1.00 . A A . 13 ARG N 1 1 18 9128 1 1 13 ARG NE N -3.964 -5.642 6.590 1.00 . A A . 13 ARG NE 1 1 18 9129 1 1 13 ARG NH1 N -3.147 -3.751 7.674 1.00 . A A . 13 ARG NH1 1 1 18 9130 1 1 13 ARG NH2 N -1.710 -5.423 7.047 1.00 . A A . 13 ARG NH2 1 1 18 9131 1 1 13 ARG O O -4.326 -5.535 1.358 1.00 . A A . 13 ARG O 1 1 18 9132 1 1 14 LYS C C -5.354 -2.540 -0.317 1.00 . A A . 14 LYS C 1 1 18 9133 1 1 14 LYS CA C -5.662 -4.016 -0.454 1.00 . A A . 14 LYS CA 1 1 18 9134 1 1 14 LYS CB C -6.570 -4.328 -1.648 1.00 . A A . 14 LYS CB 1 1 18 9135 1 1 14 LYS CD C -8.906 -4.375 -2.608 1.00 . A A . 14 LYS CD 1 1 18 9136 1 1 14 LYS CE C -8.952 -5.901 -2.727 1.00 . A A . 14 LYS CE 1 1 18 9137 1 1 14 LYS CG C -8.022 -3.916 -1.456 1.00 . A A . 14 LYS CG 1 1 18 9138 1 1 14 LYS H H -7.140 -4.315 1.001 1.00 . A A . 14 LYS H 1 1 18 9139 1 1 14 LYS HA H -4.720 -4.524 -0.604 1.00 . A A . 14 LYS HA 1 1 18 9140 1 1 14 LYS HB2 H -6.186 -3.820 -2.520 1.00 . A A . 14 LYS HB2 1 1 18 9141 1 1 14 LYS HB3 H -6.537 -5.393 -1.821 1.00 . A A . 14 LYS HB3 1 1 18 9142 1 1 14 LYS HD2 H -9.910 -4.008 -2.447 1.00 . A A . 14 LYS HD2 1 1 18 9143 1 1 14 LYS HD3 H -8.519 -3.964 -3.528 1.00 . A A . 14 LYS HD3 1 1 18 9144 1 1 14 LYS HE2 H -9.584 -6.159 -3.565 1.00 . A A . 14 LYS HE2 1 1 18 9145 1 1 14 LYS HE3 H -7.955 -6.270 -2.913 1.00 . A A . 14 LYS HE3 1 1 18 9146 1 1 14 LYS HG2 H -8.391 -4.350 -0.539 1.00 . A A . 14 LYS HG2 1 1 18 9147 1 1 14 LYS HG3 H -8.059 -2.840 -1.386 1.00 . A A . 14 LYS HG3 1 1 18 9148 1 1 14 LYS HZ1 H -9.530 -7.587 -1.652 1.00 . A A . 14 LYS HZ1 1 1 18 9149 1 1 14 LYS HZ2 H -10.462 -6.224 -1.319 1.00 . A A . 14 LYS HZ2 1 1 18 9150 1 1 14 LYS HZ3 H -8.917 -6.364 -0.666 1.00 . A A . 14 LYS HZ3 1 1 18 9151 1 1 14 LYS N N -6.218 -4.553 0.758 1.00 . A A . 14 LYS N 1 1 18 9152 1 1 14 LYS NZ N -9.496 -6.558 -1.510 1.00 . A A . 14 LYS NZ 1 1 18 9153 1 1 14 LYS O O -6.192 -1.746 0.137 1.00 . A A . 14 LYS O 1 1 18 9154 1 1 15 CYS C C -4.092 -0.055 -1.803 1.00 . A A . 15 CYS C 1 1 18 9155 1 1 15 CYS CA C -3.690 -0.827 -0.554 1.00 . A A . 15 CYS CA 1 1 18 9156 1 1 15 CYS CB C -2.181 -0.815 -0.352 1.00 . A A . 15 CYS CB 1 1 18 9157 1 1 15 CYS H H -3.548 -2.861 -1.046 1.00 . A A . 15 CYS H 1 1 18 9158 1 1 15 CYS HA H -4.177 -0.379 0.298 1.00 . A A . 15 CYS HA 1 1 18 9159 1 1 15 CYS HB2 H -1.901 -1.649 0.273 1.00 . A A . 15 CYS HB2 1 1 18 9160 1 1 15 CYS HB3 H -1.703 -0.926 -1.314 1.00 . A A . 15 CYS HB3 1 1 18 9161 1 1 15 CYS N N -4.152 -2.184 -0.675 1.00 . A A . 15 CYS N 1 1 18 9162 1 1 15 CYS O O -4.384 -0.661 -2.841 1.00 . A A . 15 CYS O 1 1 18 9163 1 1 15 CYS SG S -1.524 0.684 0.419 1.00 . A A . 15 CYS SG 1 1 18 9164 1 1 16 CYS C C -3.700 2.072 -4.017 1.00 . A A . 16 CYS C 1 1 18 9165 1 1 16 CYS CA C -4.592 2.092 -2.792 1.00 . A A . 16 CYS CA 1 1 18 9166 1 1 16 CYS CB C -4.792 3.530 -2.308 1.00 . A A . 16 CYS CB 1 1 18 9167 1 1 16 CYS H H -3.792 1.693 -0.894 1.00 . A A . 16 CYS H 1 1 18 9168 1 1 16 CYS HA H -5.560 1.709 -3.076 1.00 . A A . 16 CYS HA 1 1 18 9169 1 1 16 CYS HB2 H -3.853 3.904 -1.925 1.00 . A A . 16 CYS HB2 1 1 18 9170 1 1 16 CYS HB3 H -5.102 4.142 -3.141 1.00 . A A . 16 CYS HB3 1 1 18 9171 1 1 16 CYS N N -4.107 1.249 -1.711 1.00 . A A . 16 CYS N 1 1 18 9172 1 1 16 CYS O O -2.486 1.831 -3.934 1.00 . A A . 16 CYS O 1 1 18 9173 1 1 16 CYS SG S -6.034 3.705 -0.989 1.00 . A A . 16 CYS SG 1 1 18 9174 1 1 17 LYS C C -2.931 3.751 -6.362 1.00 . A A . 17 LYS C 1 1 18 9175 1 1 17 LYS CA C -3.587 2.399 -6.380 1.00 . A A . 17 LYS CA 1 1 18 9176 1 1 17 LYS CB C -4.519 2.206 -7.558 1.00 . A A . 17 LYS CB 1 1 18 9177 1 1 17 LYS CD C -6.179 0.643 -8.601 1.00 . A A . 17 LYS CD 1 1 18 9178 1 1 17 LYS CE C -6.759 -0.758 -8.553 1.00 . A A . 17 LYS CE 1 1 18 9179 1 1 17 LYS CG C -5.075 0.797 -7.595 1.00 . A A . 17 LYS CG 1 1 18 9180 1 1 17 LYS H H -5.290 2.308 -5.175 1.00 . A A . 17 LYS H 1 1 18 9181 1 1 17 LYS HA H -2.815 1.643 -6.392 1.00 . A A . 17 LYS HA 1 1 18 9182 1 1 17 LYS HB2 H -5.338 2.905 -7.478 1.00 . A A . 17 LYS HB2 1 1 18 9183 1 1 17 LYS HB3 H -3.981 2.386 -8.477 1.00 . A A . 17 LYS HB3 1 1 18 9184 1 1 17 LYS HD2 H -6.958 1.356 -8.373 1.00 . A A . 17 LYS HD2 1 1 18 9185 1 1 17 LYS HD3 H -5.787 0.833 -9.589 1.00 . A A . 17 LYS HD3 1 1 18 9186 1 1 17 LYS HE2 H -7.555 -0.822 -9.278 1.00 . A A . 17 LYS HE2 1 1 18 9187 1 1 17 LYS HE3 H -5.981 -1.461 -8.810 1.00 . A A . 17 LYS HE3 1 1 18 9188 1 1 17 LYS HG2 H -4.276 0.120 -7.861 1.00 . A A . 17 LYS HG2 1 1 18 9189 1 1 17 LYS HG3 H -5.443 0.536 -6.614 1.00 . A A . 17 LYS HG3 1 1 18 9190 1 1 17 LYS HZ1 H -7.999 -0.391 -6.906 1.00 . A A . 17 LYS HZ1 1 1 18 9191 1 1 17 LYS HZ2 H -6.551 -1.137 -6.493 1.00 . A A . 17 LYS HZ2 1 1 18 9192 1 1 17 LYS HZ3 H -7.778 -2.020 -7.226 1.00 . A A . 17 LYS HZ3 1 1 18 9193 1 1 17 LYS N N -4.309 2.258 -5.155 1.00 . A A . 17 LYS N 1 1 18 9194 1 1 17 LYS NZ N -7.300 -1.097 -7.212 1.00 . A A . 17 LYS NZ 1 1 18 9195 1 1 17 LYS O O -3.542 4.750 -5.953 1.00 . A A . 17 LYS O 1 1 18 9196 1 1 18 GLY C C 0.013 4.689 -5.378 1.00 . A A . 18 GLY C 1 1 18 9197 1 1 18 GLY CA C -0.904 4.952 -6.546 1.00 . A A . 18 GLY CA 1 1 18 9198 1 1 18 GLY H H -1.309 3.014 -7.217 1.00 . A A . 18 GLY H 1 1 18 9199 1 1 18 GLY HA2 H -0.326 5.159 -7.435 1.00 . A A . 18 GLY HA2 1 1 18 9200 1 1 18 GLY HA3 H -1.538 5.794 -6.311 1.00 . A A . 18 GLY HA3 1 1 18 9201 1 1 18 GLY N N -1.704 3.783 -6.750 1.00 . A A . 18 GLY N 1 1 18 9202 1 1 18 GLY O O 0.740 5.557 -4.918 1.00 . A A . 18 GLY O 1 1 18 9203 1 1 19 MET C C 1.133 1.572 -4.196 1.00 . A A . 19 MET C 1 1 18 9204 1 1 19 MET CA C 0.744 2.981 -3.812 1.00 . A A . 19 MET CA 1 1 18 9205 1 1 19 MET CB C -0.012 2.952 -2.466 1.00 . A A . 19 MET CB 1 1 18 9206 1 1 19 MET CE C -1.984 5.941 -0.348 1.00 . A A . 19 MET CE 1 1 18 9207 1 1 19 MET CG C -0.447 4.312 -1.964 1.00 . A A . 19 MET CG 1 1 18 9208 1 1 19 MET H H -0.791 2.874 -5.184 1.00 . A A . 19 MET H 1 1 18 9209 1 1 19 MET HA H 1.624 3.600 -3.727 1.00 . A A . 19 MET HA 1 1 18 9210 1 1 19 MET HB2 H -0.895 2.343 -2.583 1.00 . A A . 19 MET HB2 1 1 18 9211 1 1 19 MET HB3 H 0.625 2.501 -1.722 1.00 . A A . 19 MET HB3 1 1 18 9212 1 1 19 MET HE1 H -2.614 6.063 0.520 1.00 . A A . 19 MET HE1 1 1 18 9213 1 1 19 MET HE2 H -2.520 6.266 -1.228 1.00 . A A . 19 MET HE2 1 1 18 9214 1 1 19 MET HE3 H -1.087 6.531 -0.237 1.00 . A A . 19 MET HE3 1 1 18 9215 1 1 19 MET HG2 H 0.454 4.826 -1.661 1.00 . A A . 19 MET HG2 1 1 18 9216 1 1 19 MET HG3 H -0.937 4.854 -2.759 1.00 . A A . 19 MET HG3 1 1 18 9217 1 1 19 MET N N -0.092 3.483 -4.860 1.00 . A A . 19 MET N 1 1 18 9218 1 1 19 MET O O 0.493 0.958 -5.076 1.00 . A A . 19 MET O 1 1 18 9219 1 1 19 MET SD S -1.538 4.219 -0.534 1.00 . A A . 19 MET SD 1 1 18 9220 1 1 20 VAL C C 2.128 -1.121 -2.661 1.00 . A A . 20 VAL C 1 1 18 9221 1 1 20 VAL CA C 2.564 -0.282 -3.829 1.00 . A A . 20 VAL CA 1 1 18 9222 1 1 20 VAL CB C 4.106 -0.367 -3.986 1.00 . A A . 20 VAL CB 1 1 18 9223 1 1 20 VAL CG1 C 4.544 -1.792 -4.282 1.00 . A A . 20 VAL CG1 1 1 18 9224 1 1 20 VAL CG2 C 4.593 0.577 -5.078 1.00 . A A . 20 VAL CG2 1 1 18 9225 1 1 20 VAL H H 2.595 1.597 -2.890 1.00 . A A . 20 VAL H 1 1 18 9226 1 1 20 VAL HA H 2.086 -0.633 -4.731 1.00 . A A . 20 VAL HA 1 1 18 9227 1 1 20 VAL HB H 4.555 -0.066 -3.052 1.00 . A A . 20 VAL HB 1 1 18 9228 1 1 20 VAL HG11 H 4.220 -2.439 -3.482 1.00 . A A . 20 VAL HG11 1 1 18 9229 1 1 20 VAL HG12 H 5.621 -1.824 -4.359 1.00 . A A . 20 VAL HG12 1 1 18 9230 1 1 20 VAL HG13 H 4.105 -2.119 -5.214 1.00 . A A . 20 VAL HG13 1 1 18 9231 1 1 20 VAL HG21 H 4.334 1.591 -4.816 1.00 . A A . 20 VAL HG21 1 1 18 9232 1 1 20 VAL HG22 H 4.123 0.315 -6.014 1.00 . A A . 20 VAL HG22 1 1 18 9233 1 1 20 VAL HG23 H 5.665 0.492 -5.177 1.00 . A A . 20 VAL HG23 1 1 18 9234 1 1 20 VAL N N 2.129 1.057 -3.571 1.00 . A A . 20 VAL N 1 1 18 9235 1 1 20 VAL O O 2.425 -0.791 -1.505 1.00 . A A . 20 VAL O 1 1 18 9236 1 1 21 CYS C C 1.823 -4.133 -1.673 1.00 . A A . 21 CYS C 1 1 18 9237 1 1 21 CYS CA C 0.858 -2.999 -1.930 1.00 . A A . 21 CYS CA 1 1 18 9238 1 1 21 CYS CB C -0.520 -3.533 -2.326 1.00 . A A . 21 CYS CB 1 1 18 9239 1 1 21 CYS H H 1.213 -2.392 -3.885 1.00 . A A . 21 CYS H 1 1 18 9240 1 1 21 CYS HA H 0.761 -2.413 -1.029 1.00 . A A . 21 CYS HA 1 1 18 9241 1 1 21 CYS HB2 H -1.125 -2.716 -2.687 1.00 . A A . 21 CYS HB2 1 1 18 9242 1 1 21 CYS HB3 H -0.392 -4.257 -3.116 1.00 . A A . 21 CYS HB3 1 1 18 9243 1 1 21 CYS N N 1.385 -2.153 -2.949 1.00 . A A . 21 CYS N 1 1 18 9244 1 1 21 CYS O O 2.109 -4.941 -2.564 1.00 . A A . 21 CYS O 1 1 18 9245 1 1 21 CYS SG S -1.445 -4.347 -0.969 1.00 . A A . 21 CYS SG 1 1 18 9246 1 1 22 ARG C C 2.984 -5.403 1.419 1.00 . A A . 22 ARG C 1 1 18 9247 1 1 22 ARG CA C 3.266 -5.158 -0.026 1.00 . A A . 22 ARG CA 1 1 18 9248 1 1 22 ARG CB C 4.727 -4.685 -0.163 1.00 . A A . 22 ARG CB 1 1 18 9249 1 1 22 ARG CD C 5.444 -6.083 -2.178 1.00 . A A . 22 ARG CD 1 1 18 9250 1 1 22 ARG CG C 5.318 -4.683 -1.548 1.00 . A A . 22 ARG CG 1 1 18 9251 1 1 22 ARG CZ C 3.937 -8.071 -2.217 1.00 . A A . 22 ARG CZ 1 1 18 9252 1 1 22 ARG H H 2.122 -3.445 0.152 1.00 . A A . 22 ARG H 1 1 18 9253 1 1 22 ARG HA H 3.130 -6.063 -0.601 1.00 . A A . 22 ARG HA 1 1 18 9254 1 1 22 ARG HB2 H 4.764 -3.662 0.184 1.00 . A A . 22 ARG HB2 1 1 18 9255 1 1 22 ARG HB3 H 5.378 -5.258 0.473 1.00 . A A . 22 ARG HB3 1 1 18 9256 1 1 22 ARG HD2 H 5.922 -5.976 -3.141 1.00 . A A . 22 ARG HD2 1 1 18 9257 1 1 22 ARG HD3 H 6.071 -6.694 -1.548 1.00 . A A . 22 ARG HD3 1 1 18 9258 1 1 22 ARG HE H 3.416 -6.158 -2.651 1.00 . A A . 22 ARG HE 1 1 18 9259 1 1 22 ARG HG2 H 4.748 -4.028 -2.185 1.00 . A A . 22 ARG HG2 1 1 18 9260 1 1 22 ARG HG3 H 6.307 -4.302 -1.357 1.00 . A A . 22 ARG HG3 1 1 18 9261 1 1 22 ARG HH11 H 5.879 -8.552 -1.730 1.00 . A A . 22 ARG HH11 1 1 18 9262 1 1 22 ARG HH12 H 4.800 -9.874 -1.737 1.00 . A A . 22 ARG HH12 1 1 18 9263 1 1 22 ARG HH21 H 1.941 -7.975 -2.655 1.00 . A A . 22 ARG HH21 1 1 18 9264 1 1 22 ARG HH22 H 2.510 -9.537 -2.268 1.00 . A A . 22 ARG HH22 1 1 18 9265 1 1 22 ARG N N 2.358 -4.148 -0.491 1.00 . A A . 22 ARG N 1 1 18 9266 1 1 22 ARG NE N 4.156 -6.758 -2.383 1.00 . A A . 22 ARG NE 1 1 18 9267 1 1 22 ARG NH1 N 4.943 -8.890 -1.874 1.00 . A A . 22 ARG NH1 1 1 18 9268 1 1 22 ARG NH2 N 2.716 -8.562 -2.395 1.00 . A A . 22 ARG NH2 1 1 18 9269 1 1 22 ARG O O 1.891 -5.038 1.935 1.00 . A A . 22 ARG O 1 1 18 9270 1 1 23 LEU C C 3.571 -4.870 4.243 1.00 . A A . 23 LEU C 1 1 18 9271 1 1 23 LEU CA C 3.888 -6.179 3.553 1.00 . A A . 23 LEU CA 1 1 18 9272 1 1 23 LEU CB C 5.169 -6.789 4.147 1.00 . A A . 23 LEU CB 1 1 18 9273 1 1 23 LEU CD1 C 6.752 -8.698 4.467 1.00 . A A . 23 LEU CD1 1 1 18 9274 1 1 23 LEU CD2 C 4.297 -9.116 4.511 1.00 . A A . 23 LEU CD2 1 1 18 9275 1 1 23 LEU CG C 5.409 -8.279 3.894 1.00 . A A . 23 LEU CG 1 1 18 9276 1 1 23 LEU H H 4.769 -6.229 1.575 1.00 . A A . 23 LEU H 1 1 18 9277 1 1 23 LEU HA H 3.059 -6.848 3.722 1.00 . A A . 23 LEU HA 1 1 18 9278 1 1 23 LEU HB2 H 6.011 -6.247 3.745 1.00 . A A . 23 LEU HB2 1 1 18 9279 1 1 23 LEU HB3 H 5.146 -6.630 5.215 1.00 . A A . 23 LEU HB3 1 1 18 9280 1 1 23 LEU HD11 H 6.906 -9.751 4.284 1.00 . A A . 23 LEU HD11 1 1 18 9281 1 1 23 LEU HD12 H 6.765 -8.510 5.529 1.00 . A A . 23 LEU HD12 1 1 18 9282 1 1 23 LEU HD13 H 7.538 -8.132 3.990 1.00 . A A . 23 LEU HD13 1 1 18 9283 1 1 23 LEU HD21 H 4.242 -8.918 5.572 1.00 . A A . 23 LEU HD21 1 1 18 9284 1 1 23 LEU HD22 H 4.515 -10.162 4.357 1.00 . A A . 23 LEU HD22 1 1 18 9285 1 1 23 LEU HD23 H 3.353 -8.876 4.047 1.00 . A A . 23 LEU HD23 1 1 18 9286 1 1 23 LEU HG H 5.422 -8.466 2.832 1.00 . A A . 23 LEU HG 1 1 18 9287 1 1 23 LEU N N 3.976 -5.969 2.103 1.00 . A A . 23 LEU N 1 1 18 9288 1 1 23 LEU O O 2.937 -4.853 5.284 1.00 . A A . 23 LEU O 1 1 18 9289 1 1 24 TRP C C 3.258 -1.668 2.859 1.00 . A A . 24 TRP C 1 1 18 9290 1 1 24 TRP CA C 3.691 -2.474 4.090 1.00 . A A . 24 TRP CA 1 1 18 9291 1 1 24 TRP CB C 4.900 -1.817 4.790 1.00 . A A . 24 TRP CB 1 1 18 9292 1 1 24 TRP CD1 C 6.189 -0.187 3.338 1.00 . A A . 24 TRP CD1 1 1 18 9293 1 1 24 TRP CD2 C 7.088 -2.224 3.381 1.00 . A A . 24 TRP CD2 1 1 18 9294 1 1 24 TRP CE2 C 7.876 -1.403 2.548 1.00 . A A . 24 TRP CE2 1 1 18 9295 1 1 24 TRP CE3 C 7.460 -3.554 3.562 1.00 . A A . 24 TRP CE3 1 1 18 9296 1 1 24 TRP CG C 6.014 -1.414 3.872 1.00 . A A . 24 TRP CG 1 1 18 9297 1 1 24 TRP CH2 C 9.348 -3.181 2.100 1.00 . A A . 24 TRP CH2 1 1 18 9298 1 1 24 TRP CZ2 C 9.009 -1.872 1.903 1.00 . A A . 24 TRP CZ2 1 1 18 9299 1 1 24 TRP CZ3 C 8.585 -4.019 2.921 1.00 . A A . 24 TRP CZ3 1 1 18 9300 1 1 24 TRP H H 4.541 -3.864 2.823 1.00 . A A . 24 TRP H 1 1 18 9301 1 1 24 TRP HA H 2.869 -2.573 4.777 1.00 . A A . 24 TRP HA 1 1 18 9302 1 1 24 TRP HB2 H 4.568 -0.929 5.306 1.00 . A A . 24 TRP HB2 1 1 18 9303 1 1 24 TRP HB3 H 5.300 -2.511 5.516 1.00 . A A . 24 TRP HB3 1 1 18 9304 1 1 24 TRP HD1 H 5.507 0.627 3.539 1.00 . A A . 24 TRP HD1 1 1 18 9305 1 1 24 TRP HE1 H 7.609 0.640 2.059 1.00 . A A . 24 TRP HE1 1 1 18 9306 1 1 24 TRP HE3 H 6.882 -4.211 4.195 1.00 . A A . 24 TRP HE3 1 1 18 9307 1 1 24 TRP HH2 H 10.223 -3.590 1.616 1.00 . A A . 24 TRP HH2 1 1 18 9308 1 1 24 TRP HZ2 H 9.612 -1.242 1.264 1.00 . A A . 24 TRP HZ2 1 1 18 9309 1 1 24 TRP HZ3 H 8.888 -5.049 3.047 1.00 . A A . 24 TRP HZ3 1 1 18 9310 1 1 24 TRP N N 4.007 -3.787 3.641 1.00 . A A . 24 TRP N 1 1 18 9311 1 1 24 TRP NE1 N 7.303 -0.160 2.543 1.00 . A A . 24 TRP NE1 1 1 18 9312 1 1 24 TRP O O 3.539 -2.085 1.728 1.00 . A A . 24 TRP O 1 1 18 9313 1 1 25 CYS C C 3.311 1.258 1.657 1.00 . A A . 25 CYS C 1 1 18 9314 1 1 25 CYS CA C 2.201 0.280 1.944 1.00 . A A . 25 CYS CA 1 1 18 9315 1 1 25 CYS CB C 0.890 1.020 2.185 1.00 . A A . 25 CYS CB 1 1 18 9316 1 1 25 CYS H H 2.293 -0.291 3.959 1.00 . A A . 25 CYS H 1 1 18 9317 1 1 25 CYS HA H 2.090 -0.361 1.081 1.00 . A A . 25 CYS HA 1 1 18 9318 1 1 25 CYS HB2 H 0.913 1.474 3.166 1.00 . A A . 25 CYS HB2 1 1 18 9319 1 1 25 CYS HB3 H 0.797 1.794 1.439 1.00 . A A . 25 CYS HB3 1 1 18 9320 1 1 25 CYS N N 2.566 -0.572 3.057 1.00 . A A . 25 CYS N 1 1 18 9321 1 1 25 CYS O O 3.962 1.764 2.576 1.00 . A A . 25 CYS O 1 1 18 9322 1 1 25 CYS SG S -0.598 -0.016 2.096 1.00 . A A . 25 CYS SG 1 1 18 9323 1 1 26 LYS C C 4.012 3.294 -1.104 1.00 . A A . 26 LYS C 1 1 18 9324 1 1 26 LYS CA C 4.580 2.389 -0.030 1.00 . A A . 26 LYS CA 1 1 18 9325 1 1 26 LYS CB C 5.741 1.540 -0.578 1.00 . A A . 26 LYS CB 1 1 18 9326 1 1 26 LYS CD C 8.066 1.435 -1.577 1.00 . A A . 26 LYS CD 1 1 18 9327 1 1 26 LYS CE C 7.629 0.557 -2.745 1.00 . A A . 26 LYS CE 1 1 18 9328 1 1 26 LYS CG C 6.931 2.335 -1.084 1.00 . A A . 26 LYS CG 1 1 18 9329 1 1 26 LYS H H 2.961 1.101 -0.283 1.00 . A A . 26 LYS H 1 1 18 9330 1 1 26 LYS HA H 4.925 2.972 0.810 1.00 . A A . 26 LYS HA 1 1 18 9331 1 1 26 LYS HB2 H 6.089 0.882 0.203 1.00 . A A . 26 LYS HB2 1 1 18 9332 1 1 26 LYS HB3 H 5.361 0.940 -1.393 1.00 . A A . 26 LYS HB3 1 1 18 9333 1 1 26 LYS HD2 H 8.890 2.055 -1.898 1.00 . A A . 26 LYS HD2 1 1 18 9334 1 1 26 LYS HD3 H 8.389 0.804 -0.762 1.00 . A A . 26 LYS HD3 1 1 18 9335 1 1 26 LYS HE2 H 6.876 -0.134 -2.395 1.00 . A A . 26 LYS HE2 1 1 18 9336 1 1 26 LYS HE3 H 7.206 1.184 -3.514 1.00 . A A . 26 LYS HE3 1 1 18 9337 1 1 26 LYS HG2 H 6.601 2.962 -1.900 1.00 . A A . 26 LYS HG2 1 1 18 9338 1 1 26 LYS HG3 H 7.285 2.958 -0.280 1.00 . A A . 26 LYS HG3 1 1 18 9339 1 1 26 LYS HZ1 H 8.421 -0.812 -4.104 1.00 . A A . 26 LYS HZ1 1 1 18 9340 1 1 26 LYS HZ2 H 9.158 -0.866 -2.601 1.00 . A A . 26 LYS HZ2 1 1 18 9341 1 1 26 LYS HZ3 H 9.497 0.403 -3.664 1.00 . A A . 26 LYS HZ3 1 1 18 9342 1 1 26 LYS N N 3.533 1.510 0.403 1.00 . A A . 26 LYS N 1 1 18 9343 1 1 26 LYS NZ N 8.748 -0.227 -3.309 1.00 . A A . 26 LYS NZ 1 1 18 9344 1 1 26 LYS O O 3.170 2.857 -1.870 1.00 . A A . 26 LYS O 1 1 18 9345 1 1 27 LYS C C 4.447 5.145 -3.537 1.00 . A A . 27 LYS C 1 1 18 9346 1 1 27 LYS CA C 3.942 5.491 -2.135 1.00 . A A . 27 LYS CA 1 1 18 9347 1 1 27 LYS CB C 4.386 6.914 -1.790 1.00 . A A . 27 LYS CB 1 1 18 9348 1 1 27 LYS CD C 6.285 8.536 -1.517 1.00 . A A . 27 LYS CD 1 1 18 9349 1 1 27 LYS CE C 7.790 8.695 -1.417 1.00 . A A . 27 LYS CE 1 1 18 9350 1 1 27 LYS CG C 5.899 7.108 -1.820 1.00 . A A . 27 LYS CG 1 1 18 9351 1 1 27 LYS H H 5.097 4.843 -0.481 1.00 . A A . 27 LYS H 1 1 18 9352 1 1 27 LYS HA H 2.864 5.455 -2.128 1.00 . A A . 27 LYS HA 1 1 18 9353 1 1 27 LYS HB2 H 3.943 7.596 -2.502 1.00 . A A . 27 LYS HB2 1 1 18 9354 1 1 27 LYS HB3 H 4.031 7.163 -0.800 1.00 . A A . 27 LYS HB3 1 1 18 9355 1 1 27 LYS HD2 H 5.921 9.167 -2.313 1.00 . A A . 27 LYS HD2 1 1 18 9356 1 1 27 LYS HD3 H 5.831 8.837 -0.585 1.00 . A A . 27 LYS HD3 1 1 18 9357 1 1 27 LYS HE2 H 8.232 8.410 -2.360 1.00 . A A . 27 LYS HE2 1 1 18 9358 1 1 27 LYS HE3 H 8.016 9.731 -1.215 1.00 . A A . 27 LYS HE3 1 1 18 9359 1 1 27 LYS HG2 H 6.362 6.455 -1.097 1.00 . A A . 27 LYS HG2 1 1 18 9360 1 1 27 LYS HG3 H 6.255 6.852 -2.806 1.00 . A A . 27 LYS HG3 1 1 18 9361 1 1 27 LYS HZ1 H 7.908 8.028 0.574 1.00 . A A . 27 LYS HZ1 1 1 18 9362 1 1 27 LYS HZ2 H 9.371 8.077 -0.216 1.00 . A A . 27 LYS HZ2 1 1 18 9363 1 1 27 LYS HZ3 H 8.296 6.837 -0.564 1.00 . A A . 27 LYS HZ3 1 1 18 9364 1 1 27 LYS N N 4.438 4.540 -1.141 1.00 . A A . 27 LYS N 1 1 18 9365 1 1 27 LYS NZ N 8.365 7.850 -0.344 1.00 . A A . 27 LYS NZ 1 1 18 9366 1 1 27 LYS O O 5.408 4.371 -3.705 1.00 . A A . 27 LYS O 1 1 18 9367 1 1 28 LYS C C 3.586 6.781 -6.591 1.00 . A A . 28 LYS C 1 1 18 9368 1 1 28 LYS CA C 4.180 5.576 -5.887 1.00 . A A . 28 LYS CA 1 1 18 9369 1 1 28 LYS CB C 3.577 4.282 -6.468 1.00 . A A . 28 LYS CB 1 1 18 9370 1 1 28 LYS CD C 5.628 3.371 -7.603 1.00 . A A . 28 LYS CD 1 1 18 9371 1 1 28 LYS CE C 6.215 2.713 -8.852 1.00 . A A . 28 LYS CE 1 1 18 9372 1 1 28 LYS CG C 4.178 3.814 -7.790 1.00 . A A . 28 LYS CG 1 1 18 9373 1 1 28 LYS H H 3.008 6.265 -4.363 1.00 . A A . 28 LYS H 1 1 18 9374 1 1 28 LYS HA H 5.255 5.568 -5.974 1.00 . A A . 28 LYS HA 1 1 18 9375 1 1 28 LYS HB2 H 3.708 3.490 -5.745 1.00 . A A . 28 LYS HB2 1 1 18 9376 1 1 28 LYS HB3 H 2.518 4.439 -6.613 1.00 . A A . 28 LYS HB3 1 1 18 9377 1 1 28 LYS HD2 H 6.231 4.234 -7.362 1.00 . A A . 28 LYS HD2 1 1 18 9378 1 1 28 LYS HD3 H 5.670 2.669 -6.784 1.00 . A A . 28 LYS HD3 1 1 18 9379 1 1 28 LYS HE2 H 7.198 2.335 -8.617 1.00 . A A . 28 LYS HE2 1 1 18 9380 1 1 28 LYS HE3 H 5.577 1.884 -9.126 1.00 . A A . 28 LYS HE3 1 1 18 9381 1 1 28 LYS HG2 H 3.594 2.991 -8.173 1.00 . A A . 28 LYS HG2 1 1 18 9382 1 1 28 LYS HG3 H 4.147 4.644 -8.482 1.00 . A A . 28 LYS HG3 1 1 18 9383 1 1 28 LYS HZ1 H 6.874 4.481 -9.753 1.00 . A A . 28 LYS HZ1 1 1 18 9384 1 1 28 LYS HZ2 H 5.410 3.914 -10.411 1.00 . A A . 28 LYS HZ2 1 1 18 9385 1 1 28 LYS HZ3 H 6.854 3.158 -10.761 1.00 . A A . 28 LYS HZ3 1 1 18 9386 1 1 28 LYS N N 3.804 5.713 -4.519 1.00 . A A . 28 LYS N 1 1 18 9387 1 1 28 LYS NZ N 6.328 3.632 -10.000 1.00 . A A . 28 LYS NZ 1 1 18 9388 1 1 28 LYS O O 2.614 7.359 -6.101 1.00 . A A . 28 LYS O 1 1 18 9389 1 1 29 LEU C C 3.013 7.675 -9.670 1.00 . A A . 29 LEU C 1 1 18 9390 1 1 29 LEU CA C 3.615 8.280 -8.434 1.00 . A A . 29 LEU CA 1 1 18 9391 1 1 29 LEU CB C 4.662 9.370 -8.785 1.00 . A A . 29 LEU CB 1 1 18 9392 1 1 29 LEU CD1 C 4.088 10.902 -6.845 1.00 . A A . 29 LEU CD1 1 1 18 9393 1 1 29 LEU CD2 C 6.129 9.453 -6.696 1.00 . A A . 29 LEU CD2 1 1 18 9394 1 1 29 LEU CG C 5.214 10.241 -7.623 1.00 . A A . 29 LEU CG 1 1 18 9395 1 1 29 LEU H H 5.011 6.786 -7.960 1.00 . A A . 29 LEU H 1 1 18 9396 1 1 29 LEU HA H 2.815 8.713 -7.850 1.00 . A A . 29 LEU HA 1 1 18 9397 1 1 29 LEU HB2 H 5.503 8.881 -9.253 1.00 . A A . 29 LEU HB2 1 1 18 9398 1 1 29 LEU HB3 H 4.218 10.029 -9.516 1.00 . A A . 29 LEU HB3 1 1 18 9399 1 1 29 LEU HD11 H 3.497 11.512 -7.512 1.00 . A A . 29 LEU HD11 1 1 18 9400 1 1 29 LEU HD12 H 4.508 11.527 -6.072 1.00 . A A . 29 LEU HD12 1 1 18 9401 1 1 29 LEU HD13 H 3.462 10.147 -6.394 1.00 . A A . 29 LEU HD13 1 1 18 9402 1 1 29 LEU HD21 H 5.575 8.641 -6.250 1.00 . A A . 29 LEU HD21 1 1 18 9403 1 1 29 LEU HD22 H 6.513 10.100 -5.922 1.00 . A A . 29 LEU HD22 1 1 18 9404 1 1 29 LEU HD23 H 6.951 9.049 -7.269 1.00 . A A . 29 LEU HD23 1 1 18 9405 1 1 29 LEU HG H 5.787 11.044 -8.066 1.00 . A A . 29 LEU HG 1 1 18 9406 1 1 29 LEU N N 4.177 7.204 -7.659 1.00 . A A . 29 LEU N 1 1 18 9407 1 1 29 LEU O O 1.789 7.565 -9.794 1.00 . A A . 29 LEU O 1 1 18 9408 1 1 30 TRP C C 4.488 5.402 -11.859 1.00 . A A . 30 TRP C 1 1 18 9409 1 1 30 TRP CA C 3.482 6.512 -11.718 1.00 . A A . 30 TRP CA 1 1 18 9410 1 1 30 TRP CB C 3.494 7.391 -12.994 1.00 . A A . 30 TRP CB 1 1 18 9411 1 1 30 TRP CD1 C 2.899 9.886 -12.994 1.00 . A A . 30 TRP CD1 1 1 18 9412 1 1 30 TRP CD2 C 1.114 8.540 -13.046 1.00 . A A . 30 TRP CD2 1 1 18 9413 1 1 30 TRP CE2 C 0.668 9.876 -13.066 1.00 . A A . 30 TRP CE2 1 1 18 9414 1 1 30 TRP CE3 C 0.165 7.520 -13.066 1.00 . A A . 30 TRP CE3 1 1 18 9415 1 1 30 TRP CG C 2.552 8.570 -13.008 1.00 . A A . 30 TRP CG 1 1 18 9416 1 1 30 TRP CH2 C -1.586 9.190 -13.127 1.00 . A A . 30 TRP CH2 1 1 18 9417 1 1 30 TRP CZ2 C -0.681 10.213 -13.108 1.00 . A A . 30 TRP CZ2 1 1 18 9418 1 1 30 TRP CZ3 C -1.174 7.853 -13.105 1.00 . A A . 30 TRP CZ3 1 1 18 9419 1 1 30 TRP H H 4.827 7.352 -10.397 1.00 . A A . 30 TRP H 1 1 18 9420 1 1 30 TRP HA H 2.502 6.088 -11.559 1.00 . A A . 30 TRP HA 1 1 18 9421 1 1 30 TRP HB2 H 4.488 7.785 -13.130 1.00 . A A . 30 TRP HB2 1 1 18 9422 1 1 30 TRP HB3 H 3.256 6.767 -13.842 1.00 . A A . 30 TRP HB3 1 1 18 9423 1 1 30 TRP HD1 H 3.919 10.241 -12.965 1.00 . A A . 30 TRP HD1 1 1 18 9424 1 1 30 TRP HE1 H 1.765 11.660 -13.047 1.00 . A A . 30 TRP HE1 1 1 18 9425 1 1 30 TRP HE3 H 0.468 6.484 -13.048 1.00 . A A . 30 TRP HE3 1 1 18 9426 1 1 30 TRP HH2 H -2.644 9.405 -13.156 1.00 . A A . 30 TRP HH2 1 1 18 9427 1 1 30 TRP HZ2 H -1.018 11.240 -13.126 1.00 . A A . 30 TRP HZ2 1 1 18 9428 1 1 30 TRP HZ3 H -1.921 7.071 -13.120 1.00 . A A . 30 TRP HZ3 1 1 18 9429 1 1 30 TRP N N 3.864 7.228 -10.539 1.00 . A A . 30 TRP N 1 1 18 9430 1 1 30 TRP NE1 N 1.770 10.674 -13.045 1.00 . A A . 30 TRP NE1 1 1 18 9431 1 1 30 TRP O O 4.195 4.253 -11.475 1.00 . A A . 30 TRP O 1 1 18 9432 1 1 30 TRP OXT O 5.637 5.692 -12.232 1.00 . A A . 30 TRP OXT 1 1 19 9433 1 1 1 TYR C C -10.604 -0.094 2.206 1.00 . A A . 1 TYR C 1 1 19 9434 1 1 1 TYR CA C -11.844 0.192 3.034 1.00 . A A . 1 TYR CA 1 1 19 9435 1 1 1 TYR CB C -12.508 1.498 2.546 1.00 . A A . 1 TYR CB 1 1 19 9436 1 1 1 TYR CD1 C -13.585 2.850 4.394 1.00 . A A . 1 TYR CD1 1 1 19 9437 1 1 1 TYR CD2 C -14.985 1.456 3.066 1.00 . A A . 1 TYR CD2 1 1 19 9438 1 1 1 TYR CE1 C -14.675 3.259 5.131 1.00 . A A . 1 TYR CE1 1 1 19 9439 1 1 1 TYR CE2 C -16.084 1.862 3.799 1.00 . A A . 1 TYR CE2 1 1 19 9440 1 1 1 TYR CG C -13.717 1.941 3.351 1.00 . A A . 1 TYR CG 1 1 19 9441 1 1 1 TYR CZ C -15.924 2.764 4.831 1.00 . A A . 1 TYR CZ 1 1 19 9442 1 1 1 TYR H1 H -12.287 0.514 5.029 1.00 . A A . 1 TYR H1 1 1 19 9443 1 1 1 TYR H2 H -10.713 0.987 4.591 1.00 . A A . 1 TYR H2 1 1 19 9444 1 1 1 TYR H3 H -11.093 -0.630 4.745 1.00 . A A . 1 TYR H3 1 1 19 9445 1 1 1 TYR HA H -12.536 -0.628 2.928 1.00 . A A . 1 TYR HA 1 1 19 9446 1 1 1 TYR HB2 H -11.784 2.298 2.573 1.00 . A A . 1 TYR HB2 1 1 19 9447 1 1 1 TYR HB3 H -12.825 1.359 1.522 1.00 . A A . 1 TYR HB3 1 1 19 9448 1 1 1 TYR HD1 H -12.608 3.244 4.635 1.00 . A A . 1 TYR HD1 1 1 19 9449 1 1 1 TYR HD2 H -15.113 0.750 2.259 1.00 . A A . 1 TYR HD2 1 1 19 9450 1 1 1 TYR HE1 H -14.537 3.967 5.936 1.00 . A A . 1 TYR HE1 1 1 19 9451 1 1 1 TYR HE2 H -17.060 1.468 3.555 1.00 . A A . 1 TYR HE2 1 1 19 9452 1 1 1 TYR HH H -17.549 2.406 5.824 1.00 . A A . 1 TYR HH 1 1 19 9453 1 1 1 TYR N N -11.467 0.289 4.435 1.00 . A A . 1 TYR N 1 1 19 9454 1 1 1 TYR O O -10.485 -1.143 1.577 1.00 . A A . 1 TYR O 1 1 19 9455 1 1 1 TYR OH O -17.018 3.174 5.568 1.00 . A A . 1 TYR OH 1 1 19 9456 1 1 2 CYS C C -7.276 1.036 2.384 1.00 . A A . 2 CYS C 1 1 19 9457 1 1 2 CYS CA C -8.457 0.721 1.488 1.00 . A A . 2 CYS CA 1 1 19 9458 1 1 2 CYS CB C -8.542 1.713 0.343 1.00 . A A . 2 CYS CB 1 1 19 9459 1 1 2 CYS H H -9.739 1.611 2.826 1.00 . A A . 2 CYS H 1 1 19 9460 1 1 2 CYS HA H -8.364 -0.278 1.090 1.00 . A A . 2 CYS HA 1 1 19 9461 1 1 2 CYS HB2 H -9.408 1.490 -0.258 1.00 . A A . 2 CYS HB2 1 1 19 9462 1 1 2 CYS HB3 H -8.634 2.693 0.782 1.00 . A A . 2 CYS HB3 1 1 19 9463 1 1 2 CYS N N -9.663 0.814 2.258 1.00 . A A . 2 CYS N 1 1 19 9464 1 1 2 CYS O O -7.437 1.694 3.418 1.00 . A A . 2 CYS O 1 1 19 9465 1 1 2 CYS SG S -7.120 1.745 -0.766 1.00 . A A . 2 CYS SG 1 1 19 9466 1 1 3 GLN C C -4.138 1.990 2.390 1.00 . A A . 3 GLN C 1 1 19 9467 1 1 3 GLN CA C -4.938 0.784 2.822 1.00 . A A . 3 GLN CA 1 1 19 9468 1 1 3 GLN CB C -4.069 -0.463 2.884 1.00 . A A . 3 GLN CB 1 1 19 9469 1 1 3 GLN CD C -5.146 -1.344 4.963 1.00 . A A . 3 GLN CD 1 1 19 9470 1 1 3 GLN CG C -4.744 -1.637 3.537 1.00 . A A . 3 GLN CG 1 1 19 9471 1 1 3 GLN H H -6.035 0.138 1.137 1.00 . A A . 3 GLN H 1 1 19 9472 1 1 3 GLN HA H -5.324 0.975 3.809 1.00 . A A . 3 GLN HA 1 1 19 9473 1 1 3 GLN HB2 H -3.806 -0.765 1.882 1.00 . A A . 3 GLN HB2 1 1 19 9474 1 1 3 GLN HB3 H -3.169 -0.241 3.436 1.00 . A A . 3 GLN HB3 1 1 19 9475 1 1 3 GLN HE21 H -3.410 -2.008 5.597 1.00 . A A . 3 GLN HE21 1 1 19 9476 1 1 3 GLN HE22 H -4.520 -1.450 6.815 1.00 . A A . 3 GLN HE22 1 1 19 9477 1 1 3 GLN HG2 H -5.629 -1.891 2.972 1.00 . A A . 3 GLN HG2 1 1 19 9478 1 1 3 GLN HG3 H -4.056 -2.471 3.535 1.00 . A A . 3 GLN HG3 1 1 19 9479 1 1 3 GLN N N -6.111 0.587 2.007 1.00 . A A . 3 GLN N 1 1 19 9480 1 1 3 GLN NE2 N -4.273 -1.625 5.882 1.00 . A A . 3 GLN NE2 1 1 19 9481 1 1 3 GLN O O -3.806 2.148 1.217 1.00 . A A . 3 GLN O 1 1 19 9482 1 1 3 GLN OE1 O -6.241 -0.868 5.228 1.00 . A A . 3 GLN OE1 1 1 19 9483 1 1 4 LYS C C -1.599 3.789 3.172 1.00 . A A . 4 LYS C 1 1 19 9484 1 1 4 LYS CA C -3.096 4.053 3.100 1.00 . A A . 4 LYS CA 1 1 19 9485 1 1 4 LYS CB C -3.462 5.111 4.140 1.00 . A A . 4 LYS CB 1 1 19 9486 1 1 4 LYS CD C -5.202 6.486 5.281 1.00 . A A . 4 LYS CD 1 1 19 9487 1 1 4 LYS CE C -6.690 6.719 5.508 1.00 . A A . 4 LYS CE 1 1 19 9488 1 1 4 LYS CG C -4.940 5.422 4.234 1.00 . A A . 4 LYS CG 1 1 19 9489 1 1 4 LYS H H -4.103 2.623 4.263 1.00 . A A . 4 LYS H 1 1 19 9490 1 1 4 LYS HA H -3.355 4.426 2.120 1.00 . A A . 4 LYS HA 1 1 19 9491 1 1 4 LYS HB2 H -3.133 4.765 5.109 1.00 . A A . 4 LYS HB2 1 1 19 9492 1 1 4 LYS HB3 H -2.935 6.024 3.905 1.00 . A A . 4 LYS HB3 1 1 19 9493 1 1 4 LYS HD2 H -4.754 6.172 6.213 1.00 . A A . 4 LYS HD2 1 1 19 9494 1 1 4 LYS HD3 H -4.745 7.410 4.957 1.00 . A A . 4 LYS HD3 1 1 19 9495 1 1 4 LYS HE2 H -7.132 5.792 5.842 1.00 . A A . 4 LYS HE2 1 1 19 9496 1 1 4 LYS HE3 H -6.807 7.465 6.280 1.00 . A A . 4 LYS HE3 1 1 19 9497 1 1 4 LYS HG2 H -5.286 5.778 3.274 1.00 . A A . 4 LYS HG2 1 1 19 9498 1 1 4 LYS HG3 H -5.472 4.521 4.503 1.00 . A A . 4 LYS HG3 1 1 19 9499 1 1 4 LYS HZ1 H -8.396 7.342 4.519 1.00 . A A . 4 LYS HZ1 1 1 19 9500 1 1 4 LYS HZ2 H -7.353 6.440 3.546 1.00 . A A . 4 LYS HZ2 1 1 19 9501 1 1 4 LYS HZ3 H -6.982 8.040 3.909 1.00 . A A . 4 LYS HZ3 1 1 19 9502 1 1 4 LYS N N -3.833 2.835 3.346 1.00 . A A . 4 LYS N 1 1 19 9503 1 1 4 LYS NZ N -7.396 7.166 4.289 1.00 . A A . 4 LYS NZ 1 1 19 9504 1 1 4 LYS O O -1.173 2.740 3.637 1.00 . A A . 4 LYS O 1 1 19 9505 1 1 5 TRP C C 1.228 4.443 4.149 1.00 . A A . 5 TRP C 1 1 19 9506 1 1 5 TRP CA C 0.653 4.762 2.760 1.00 . A A . 5 TRP CA 1 1 19 9507 1 1 5 TRP CB C 1.180 6.152 2.302 1.00 . A A . 5 TRP CB 1 1 19 9508 1 1 5 TRP CD1 C 1.706 7.723 4.273 1.00 . A A . 5 TRP CD1 1 1 19 9509 1 1 5 TRP CD2 C -0.350 8.003 3.435 1.00 . A A . 5 TRP CD2 1 1 19 9510 1 1 5 TRP CE2 C -0.180 8.879 4.522 1.00 . A A . 5 TRP CE2 1 1 19 9511 1 1 5 TRP CE3 C -1.569 8.012 2.753 1.00 . A A . 5 TRP CE3 1 1 19 9512 1 1 5 TRP CG C 0.876 7.259 3.295 1.00 . A A . 5 TRP CG 1 1 19 9513 1 1 5 TRP CH2 C -2.356 9.731 4.260 1.00 . A A . 5 TRP CH2 1 1 19 9514 1 1 5 TRP CZ2 C -1.179 9.746 4.944 1.00 . A A . 5 TRP CZ2 1 1 19 9515 1 1 5 TRP CZ3 C -2.556 8.875 3.173 1.00 . A A . 5 TRP CZ3 1 1 19 9516 1 1 5 TRP H H -1.262 5.624 2.513 1.00 . A A . 5 TRP H 1 1 19 9517 1 1 5 TRP HA H 0.974 4.018 2.045 1.00 . A A . 5 TRP HA 1 1 19 9518 1 1 5 TRP HB2 H 2.252 6.102 2.177 1.00 . A A . 5 TRP HB2 1 1 19 9519 1 1 5 TRP HB3 H 0.724 6.413 1.358 1.00 . A A . 5 TRP HB3 1 1 19 9520 1 1 5 TRP HD1 H 2.708 7.357 4.438 1.00 . A A . 5 TRP HD1 1 1 19 9521 1 1 5 TRP HE1 H 1.462 9.153 5.788 1.00 . A A . 5 TRP HE1 1 1 19 9522 1 1 5 TRP HE3 H -1.751 7.368 1.906 1.00 . A A . 5 TRP HE3 1 1 19 9523 1 1 5 TRP HH2 H -3.157 10.392 4.557 1.00 . A A . 5 TRP HH2 1 1 19 9524 1 1 5 TRP HZ2 H -1.043 10.414 5.783 1.00 . A A . 5 TRP HZ2 1 1 19 9525 1 1 5 TRP HZ3 H -3.505 8.891 2.657 1.00 . A A . 5 TRP HZ3 1 1 19 9526 1 1 5 TRP N N -0.823 4.797 2.793 1.00 . A A . 5 TRP N 1 1 19 9527 1 1 5 TRP NE1 N 1.072 8.680 5.017 1.00 . A A . 5 TRP NE1 1 1 19 9528 1 1 5 TRP O O 2.292 3.867 4.281 1.00 . A A . 5 TRP O 1 1 19 9529 1 1 6 MET C C 0.530 3.313 7.085 1.00 . A A . 6 MET C 1 1 19 9530 1 1 6 MET CA C 0.890 4.687 6.544 1.00 . A A . 6 MET CA 1 1 19 9531 1 1 6 MET CB C 0.229 5.778 7.394 1.00 . A A . 6 MET CB 1 1 19 9532 1 1 6 MET CE C -1.573 6.558 9.934 1.00 . A A . 6 MET CE 1 1 19 9533 1 1 6 MET CG C -1.292 5.786 7.297 1.00 . A A . 6 MET CG 1 1 19 9534 1 1 6 MET H H -0.345 5.292 4.942 1.00 . A A . 6 MET H 1 1 19 9535 1 1 6 MET HA H 1.959 4.821 6.596 1.00 . A A . 6 MET HA 1 1 19 9536 1 1 6 MET HB2 H 0.504 5.623 8.427 1.00 . A A . 6 MET HB2 1 1 19 9537 1 1 6 MET HB3 H 0.596 6.742 7.073 1.00 . A A . 6 MET HB3 1 1 19 9538 1 1 6 MET HE1 H -0.497 6.599 10.020 1.00 . A A . 6 MET HE1 1 1 19 9539 1 1 6 MET HE2 H -1.907 5.546 10.111 1.00 . A A . 6 MET HE2 1 1 19 9540 1 1 6 MET HE3 H -2.020 7.218 10.664 1.00 . A A . 6 MET HE3 1 1 19 9541 1 1 6 MET HG2 H -1.569 5.951 6.266 1.00 . A A . 6 MET HG2 1 1 19 9542 1 1 6 MET HG3 H -1.663 4.823 7.614 1.00 . A A . 6 MET HG3 1 1 19 9543 1 1 6 MET N N 0.494 4.840 5.159 1.00 . A A . 6 MET N 1 1 19 9544 1 1 6 MET O O 0.916 2.952 8.189 1.00 . A A . 6 MET O 1 1 19 9545 1 1 6 MET SD S -2.074 7.062 8.291 1.00 . A A . 6 MET SD 1 1 19 9546 1 1 7 TRP C C 0.101 0.174 5.955 1.00 . A A . 7 TRP C 1 1 19 9547 1 1 7 TRP CA C -0.627 1.240 6.756 1.00 . A A . 7 TRP CA 1 1 19 9548 1 1 7 TRP CB C -2.155 1.077 6.645 1.00 . A A . 7 TRP CB 1 1 19 9549 1 1 7 TRP CD1 C -2.546 2.703 8.624 1.00 . A A . 7 TRP CD1 1 1 19 9550 1 1 7 TRP CD2 C -4.313 2.428 7.287 1.00 . A A . 7 TRP CD2 1 1 19 9551 1 1 7 TRP CE2 C -4.658 3.340 8.298 1.00 . A A . 7 TRP CE2 1 1 19 9552 1 1 7 TRP CE3 C -5.261 2.094 6.340 1.00 . A A . 7 TRP CE3 1 1 19 9553 1 1 7 TRP CG C -2.954 2.044 7.493 1.00 . A A . 7 TRP CG 1 1 19 9554 1 1 7 TRP CH2 C -6.828 3.565 7.421 1.00 . A A . 7 TRP CH2 1 1 19 9555 1 1 7 TRP CZ2 C -5.917 3.919 8.372 1.00 . A A . 7 TRP CZ2 1 1 19 9556 1 1 7 TRP CZ3 C -6.512 2.660 6.413 1.00 . A A . 7 TRP CZ3 1 1 19 9557 1 1 7 TRP H H -0.443 2.834 5.409 1.00 . A A . 7 TRP H 1 1 19 9558 1 1 7 TRP HA H -0.335 1.139 7.790 1.00 . A A . 7 TRP HA 1 1 19 9559 1 1 7 TRP HB2 H -2.446 1.236 5.617 1.00 . A A . 7 TRP HB2 1 1 19 9560 1 1 7 TRP HB3 H -2.433 0.073 6.929 1.00 . A A . 7 TRP HB3 1 1 19 9561 1 1 7 TRP HD1 H -1.559 2.618 9.054 1.00 . A A . 7 TRP HD1 1 1 19 9562 1 1 7 TRP HE1 H -3.525 4.079 9.892 1.00 . A A . 7 TRP HE1 1 1 19 9563 1 1 7 TRP HE3 H -5.023 1.384 5.567 1.00 . A A . 7 TRP HE3 1 1 19 9564 1 1 7 TRP HH2 H -7.823 3.986 7.443 1.00 . A A . 7 TRP HH2 1 1 19 9565 1 1 7 TRP HZ2 H -6.185 4.626 9.142 1.00 . A A . 7 TRP HZ2 1 1 19 9566 1 1 7 TRP HZ3 H -7.259 2.402 5.676 1.00 . A A . 7 TRP HZ3 1 1 19 9567 1 1 7 TRP N N -0.205 2.548 6.317 1.00 . A A . 7 TRP N 1 1 19 9568 1 1 7 TRP NE1 N -3.565 3.498 9.098 1.00 . A A . 7 TRP NE1 1 1 19 9569 1 1 7 TRP O O 1.012 0.485 5.179 1.00 . A A . 7 TRP O 1 1 19 9570 1 1 8 THR C C -0.683 -2.916 4.696 1.00 . A A . 8 THR C 1 1 19 9571 1 1 8 THR CA C 0.390 -2.148 5.480 1.00 . A A . 8 THR CA 1 1 19 9572 1 1 8 THR CB C 1.060 -3.079 6.517 1.00 . A A . 8 THR CB 1 1 19 9573 1 1 8 THR CG2 C 2.097 -2.320 7.348 1.00 . A A . 8 THR CG2 1 1 19 9574 1 1 8 THR H H -0.957 -1.277 6.800 1.00 . A A . 8 THR H 1 1 19 9575 1 1 8 THR HA H 1.140 -1.726 4.825 1.00 . A A . 8 THR HA 1 1 19 9576 1 1 8 THR HB H 1.548 -3.893 6.002 1.00 . A A . 8 THR HB 1 1 19 9577 1 1 8 THR HG1 H 0.240 -3.270 8.298 1.00 . A A . 8 THR HG1 1 1 19 9578 1 1 8 THR HG21 H 2.871 -1.925 6.707 1.00 . A A . 8 THR HG21 1 1 19 9579 1 1 8 THR HG22 H 2.538 -2.983 8.077 1.00 . A A . 8 THR HG22 1 1 19 9580 1 1 8 THR HG23 H 1.609 -1.501 7.857 1.00 . A A . 8 THR HG23 1 1 19 9581 1 1 8 THR N N -0.245 -1.056 6.163 1.00 . A A . 8 THR N 1 1 19 9582 1 1 8 THR O O -1.882 -2.652 4.897 1.00 . A A . 8 THR O 1 1 19 9583 1 1 8 THR OG1 O 0.064 -3.603 7.409 1.00 . A A . 8 THR OG1 1 1 19 9584 1 1 9 CYS C C -1.050 -6.063 3.101 1.00 . A A . 9 CYS C 1 1 19 9585 1 1 9 CYS CA C -1.348 -4.572 3.130 1.00 . A A . 9 CYS CA 1 1 19 9586 1 1 9 CYS CB C -1.565 -4.037 1.717 1.00 . A A . 9 CYS CB 1 1 19 9587 1 1 9 CYS H H 0.616 -4.064 3.579 1.00 . A A . 9 CYS H 1 1 19 9588 1 1 9 CYS HA H -2.259 -4.426 3.692 1.00 . A A . 9 CYS HA 1 1 19 9589 1 1 9 CYS HB2 H -2.489 -4.440 1.329 1.00 . A A . 9 CYS HB2 1 1 19 9590 1 1 9 CYS HB3 H -1.646 -2.959 1.762 1.00 . A A . 9 CYS HB3 1 1 19 9591 1 1 9 CYS N N -0.315 -3.841 3.815 1.00 . A A . 9 CYS N 1 1 19 9592 1 1 9 CYS O O 0.051 -6.501 3.464 1.00 . A A . 9 CYS O 1 1 19 9593 1 1 9 CYS SG S -0.267 -4.446 0.532 1.00 . A A . 9 CYS SG 1 1 19 9594 1 1 10 ASP C C -2.716 -8.641 1.321 1.00 . A A . 10 ASP C 1 1 19 9595 1 1 10 ASP CA C -1.959 -8.278 2.579 1.00 . A A . 10 ASP CA 1 1 19 9596 1 1 10 ASP CB C -2.669 -8.981 3.772 1.00 . A A . 10 ASP CB 1 1 19 9597 1 1 10 ASP CG C -2.132 -8.651 5.150 1.00 . A A . 10 ASP CG 1 1 19 9598 1 1 10 ASP H H -2.855 -6.398 2.355 1.00 . A A . 10 ASP H 1 1 19 9599 1 1 10 ASP HA H -0.928 -8.590 2.512 1.00 . A A . 10 ASP HA 1 1 19 9600 1 1 10 ASP HB2 H -3.715 -8.713 3.761 1.00 . A A . 10 ASP HB2 1 1 19 9601 1 1 10 ASP HB3 H -2.592 -10.047 3.622 1.00 . A A . 10 ASP HB3 1 1 19 9602 1 1 10 ASP N N -2.032 -6.828 2.682 1.00 . A A . 10 ASP N 1 1 19 9603 1 1 10 ASP O O -3.034 -7.759 0.522 1.00 . A A . 10 ASP O 1 1 19 9604 1 1 10 ASP OD1 O -2.859 -8.016 5.940 1.00 . A A . 10 ASP OD1 1 1 19 9605 1 1 10 ASP OD2 O -1.006 -9.036 5.488 1.00 . A A . 10 ASP OD2 1 1 19 9606 1 1 11 SER C C -5.312 -9.807 0.230 1.00 . A A . 11 SER C 1 1 19 9607 1 1 11 SER CA C -3.866 -10.301 0.009 1.00 . A A . 11 SER CA 1 1 19 9608 1 1 11 SER CB C -3.830 -11.818 -0.153 1.00 . A A . 11 SER CB 1 1 19 9609 1 1 11 SER H H -2.683 -10.588 1.743 1.00 . A A . 11 SER H 1 1 19 9610 1 1 11 SER HA H -3.467 -9.832 -0.879 1.00 . A A . 11 SER HA 1 1 19 9611 1 1 11 SER HB2 H -4.243 -12.274 0.734 1.00 . A A . 11 SER HB2 1 1 19 9612 1 1 11 SER HB3 H -4.413 -12.106 -1.015 1.00 . A A . 11 SER HB3 1 1 19 9613 1 1 11 SER HG H -2.138 -12.486 0.544 1.00 . A A . 11 SER HG 1 1 19 9614 1 1 11 SER N N -3.036 -9.900 1.137 1.00 . A A . 11 SER N 1 1 19 9615 1 1 11 SER O O -6.072 -9.608 -0.709 1.00 . A A . 11 SER O 1 1 19 9616 1 1 11 SER OG O -2.491 -12.272 -0.326 1.00 . A A . 11 SER OG 1 1 19 9617 1 1 12 GLU C C -6.996 -7.576 1.797 1.00 . A A . 12 GLU C 1 1 19 9618 1 1 12 GLU CA C -6.949 -9.103 1.896 1.00 . A A . 12 GLU CA 1 1 19 9619 1 1 12 GLU CB C -7.176 -9.503 3.330 1.00 . A A . 12 GLU CB 1 1 19 9620 1 1 12 GLU CD C -6.929 -11.238 5.065 1.00 . A A . 12 GLU CD 1 1 19 9621 1 1 12 GLU CG C -6.999 -10.970 3.601 1.00 . A A . 12 GLU CG 1 1 19 9622 1 1 12 GLU H H -4.961 -9.756 2.167 1.00 . A A . 12 GLU H 1 1 19 9623 1 1 12 GLU HA H -7.710 -9.549 1.276 1.00 . A A . 12 GLU HA 1 1 19 9624 1 1 12 GLU HB2 H -6.473 -8.964 3.947 1.00 . A A . 12 GLU HB2 1 1 19 9625 1 1 12 GLU HB3 H -8.178 -9.221 3.616 1.00 . A A . 12 GLU HB3 1 1 19 9626 1 1 12 GLU HG2 H -7.841 -11.505 3.185 1.00 . A A . 12 GLU HG2 1 1 19 9627 1 1 12 GLU HG3 H -6.087 -11.308 3.131 1.00 . A A . 12 GLU HG3 1 1 19 9628 1 1 12 GLU N N -5.642 -9.581 1.487 1.00 . A A . 12 GLU N 1 1 19 9629 1 1 12 GLU O O -7.654 -7.015 0.927 1.00 . A A . 12 GLU O 1 1 19 9630 1 1 12 GLU OE1 O -5.821 -11.149 5.647 1.00 . A A . 12 GLU OE1 1 1 19 9631 1 1 12 GLU OE2 O -7.980 -11.490 5.678 1.00 . A A . 12 GLU OE2 1 1 19 9632 1 1 13 ARG C C -5.274 -5.030 1.590 1.00 . A A . 13 ARG C 1 1 19 9633 1 1 13 ARG CA C -6.183 -5.465 2.714 1.00 . A A . 13 ARG CA 1 1 19 9634 1 1 13 ARG CB C -5.534 -5.002 4.026 1.00 . A A . 13 ARG CB 1 1 19 9635 1 1 13 ARG CD C -5.434 -4.927 6.526 1.00 . A A . 13 ARG CD 1 1 19 9636 1 1 13 ARG CG C -6.250 -5.376 5.307 1.00 . A A . 13 ARG CG 1 1 19 9637 1 1 13 ARG CZ C -2.977 -5.025 7.080 1.00 . A A . 13 ARG CZ 1 1 19 9638 1 1 13 ARG H H -5.769 -7.429 3.355 1.00 . A A . 13 ARG H 1 1 19 9639 1 1 13 ARG HA H -7.164 -5.028 2.622 1.00 . A A . 13 ARG HA 1 1 19 9640 1 1 13 ARG HB2 H -4.537 -5.414 4.082 1.00 . A A . 13 ARG HB2 1 1 19 9641 1 1 13 ARG HB3 H -5.451 -3.925 3.994 1.00 . A A . 13 ARG HB3 1 1 19 9642 1 1 13 ARG HD2 H -5.296 -3.857 6.465 1.00 . A A . 13 ARG HD2 1 1 19 9643 1 1 13 ARG HD3 H -5.978 -5.166 7.427 1.00 . A A . 13 ARG HD3 1 1 19 9644 1 1 13 ARG HE H -4.042 -6.485 6.207 1.00 . A A . 13 ARG HE 1 1 19 9645 1 1 13 ARG HG2 H -7.211 -4.886 5.322 1.00 . A A . 13 ARG HG2 1 1 19 9646 1 1 13 ARG HG3 H -6.387 -6.446 5.341 1.00 . A A . 13 ARG HG3 1 1 19 9647 1 1 13 ARG HH11 H -3.850 -3.313 7.762 1.00 . A A . 13 ARG HH11 1 1 19 9648 1 1 13 ARG HH12 H -2.173 -3.403 8.037 1.00 . A A . 13 ARG HH12 1 1 19 9649 1 1 13 ARG HH21 H -1.833 -6.623 6.614 1.00 . A A . 13 ARG HH21 1 1 19 9650 1 1 13 ARG HH22 H -0.982 -5.309 7.357 1.00 . A A . 13 ARG HH22 1 1 19 9651 1 1 13 ARG N N -6.271 -6.917 2.689 1.00 . A A . 13 ARG N 1 1 19 9652 1 1 13 ARG NE N -4.099 -5.572 6.580 1.00 . A A . 13 ARG NE 1 1 19 9653 1 1 13 ARG NH1 N -3.000 -3.838 7.665 1.00 . A A . 13 ARG NH1 1 1 19 9654 1 1 13 ARG NH2 N -1.846 -5.700 7.023 1.00 . A A . 13 ARG NH2 1 1 19 9655 1 1 13 ARG O O -4.124 -5.378 1.608 1.00 . A A . 13 ARG O 1 1 19 9656 1 1 14 LYS C C -4.681 -2.351 -0.402 1.00 . A A . 14 LYS C 1 1 19 9657 1 1 14 LYS CA C -4.926 -3.864 -0.479 1.00 . A A . 14 LYS CA 1 1 19 9658 1 1 14 LYS CB C -5.433 -4.316 -1.864 1.00 . A A . 14 LYS CB 1 1 19 9659 1 1 14 LYS CD C -7.302 -4.454 -3.560 1.00 . A A . 14 LYS CD 1 1 19 9660 1 1 14 LYS CE C -6.533 -3.757 -4.679 1.00 . A A . 14 LYS CE 1 1 19 9661 1 1 14 LYS CG C -6.874 -3.959 -2.176 1.00 . A A . 14 LYS CG 1 1 19 9662 1 1 14 LYS H H -6.729 -4.106 0.603 1.00 . A A . 14 LYS H 1 1 19 9663 1 1 14 LYS HA H -3.966 -4.328 -0.301 1.00 . A A . 14 LYS HA 1 1 19 9664 1 1 14 LYS HB2 H -4.806 -3.863 -2.616 1.00 . A A . 14 LYS HB2 1 1 19 9665 1 1 14 LYS HB3 H -5.329 -5.388 -1.931 1.00 . A A . 14 LYS HB3 1 1 19 9666 1 1 14 LYS HD2 H -7.116 -5.516 -3.624 1.00 . A A . 14 LYS HD2 1 1 19 9667 1 1 14 LYS HD3 H -8.359 -4.267 -3.690 1.00 . A A . 14 LYS HD3 1 1 19 9668 1 1 14 LYS HE2 H -6.694 -2.694 -4.608 1.00 . A A . 14 LYS HE2 1 1 19 9669 1 1 14 LYS HE3 H -5.480 -3.967 -4.562 1.00 . A A . 14 LYS HE3 1 1 19 9670 1 1 14 LYS HG2 H -7.521 -4.394 -1.428 1.00 . A A . 14 LYS HG2 1 1 19 9671 1 1 14 LYS HG3 H -6.960 -2.883 -2.150 1.00 . A A . 14 LYS HG3 1 1 19 9672 1 1 14 LYS HZ1 H -6.798 -5.219 -6.159 1.00 . A A . 14 LYS HZ1 1 1 19 9673 1 1 14 LYS HZ2 H -6.462 -3.688 -6.765 1.00 . A A . 14 LYS HZ2 1 1 19 9674 1 1 14 LYS HZ3 H -7.980 -4.025 -6.153 1.00 . A A . 14 LYS HZ3 1 1 19 9675 1 1 14 LYS N N -5.777 -4.340 0.603 1.00 . A A . 14 LYS N 1 1 19 9676 1 1 14 LYS NZ N -6.963 -4.204 -6.015 1.00 . A A . 14 LYS NZ 1 1 19 9677 1 1 14 LYS O O -5.585 -1.586 -0.021 1.00 . A A . 14 LYS O 1 1 19 9678 1 1 15 CYS C C -3.824 0.250 -1.787 1.00 . A A . 15 CYS C 1 1 19 9679 1 1 15 CYS CA C -3.069 -0.513 -0.722 1.00 . A A . 15 CYS CA 1 1 19 9680 1 1 15 CYS CB C -1.566 -0.346 -0.963 1.00 . A A . 15 CYS CB 1 1 19 9681 1 1 15 CYS H H -2.779 -2.599 -0.974 1.00 . A A . 15 CYS H 1 1 19 9682 1 1 15 CYS HA H -3.319 -0.072 0.230 1.00 . A A . 15 CYS HA 1 1 19 9683 1 1 15 CYS HB2 H -1.332 -0.685 -1.961 1.00 . A A . 15 CYS HB2 1 1 19 9684 1 1 15 CYS HB3 H -1.316 0.701 -0.884 1.00 . A A . 15 CYS HB3 1 1 19 9685 1 1 15 CYS N N -3.457 -1.935 -0.727 1.00 . A A . 15 CYS N 1 1 19 9686 1 1 15 CYS O O -4.212 -0.321 -2.821 1.00 . A A . 15 CYS O 1 1 19 9687 1 1 15 CYS SG S -0.494 -1.262 0.187 1.00 . A A . 15 CYS SG 1 1 19 9688 1 1 16 CYS C C -4.025 2.591 -3.767 1.00 . A A . 16 CYS C 1 1 19 9689 1 1 16 CYS CA C -4.762 2.389 -2.449 1.00 . A A . 16 CYS CA 1 1 19 9690 1 1 16 CYS CB C -5.083 3.719 -1.772 1.00 . A A . 16 CYS CB 1 1 19 9691 1 1 16 CYS H H -3.745 1.888 -0.674 1.00 . A A . 16 CYS H 1 1 19 9692 1 1 16 CYS HA H -5.697 1.898 -2.674 1.00 . A A . 16 CYS HA 1 1 19 9693 1 1 16 CYS HB2 H -4.170 4.153 -1.389 1.00 . A A . 16 CYS HB2 1 1 19 9694 1 1 16 CYS HB3 H -5.528 4.393 -2.487 1.00 . A A . 16 CYS HB3 1 1 19 9695 1 1 16 CYS N N -4.048 1.515 -1.535 1.00 . A A . 16 CYS N 1 1 19 9696 1 1 16 CYS O O -2.846 2.219 -3.912 1.00 . A A . 16 CYS O 1 1 19 9697 1 1 16 CYS SG S -6.238 3.536 -0.380 1.00 . A A . 16 CYS SG 1 1 19 9698 1 1 17 LYS C C -3.084 4.408 -6.004 1.00 . A A . 17 LYS C 1 1 19 9699 1 1 17 LYS CA C -4.148 3.342 -6.035 1.00 . A A . 17 LYS CA 1 1 19 9700 1 1 17 LYS CB C -5.211 3.609 -7.113 1.00 . A A . 17 LYS CB 1 1 19 9701 1 1 17 LYS CD C -6.959 1.903 -6.376 1.00 . A A . 17 LYS CD 1 1 19 9702 1 1 17 LYS CE C -7.738 0.665 -6.768 1.00 . A A . 17 LYS CE 1 1 19 9703 1 1 17 LYS CG C -6.061 2.385 -7.502 1.00 . A A . 17 LYS CG 1 1 19 9704 1 1 17 LYS H H -5.634 3.459 -4.568 1.00 . A A . 17 LYS H 1 1 19 9705 1 1 17 LYS HA H -3.650 2.413 -6.269 1.00 . A A . 17 LYS HA 1 1 19 9706 1 1 17 LYS HB2 H -5.876 4.378 -6.751 1.00 . A A . 17 LYS HB2 1 1 19 9707 1 1 17 LYS HB3 H -4.715 3.969 -8.002 1.00 . A A . 17 LYS HB3 1 1 19 9708 1 1 17 LYS HD2 H -6.349 1.672 -5.515 1.00 . A A . 17 LYS HD2 1 1 19 9709 1 1 17 LYS HD3 H -7.654 2.689 -6.121 1.00 . A A . 17 LYS HD3 1 1 19 9710 1 1 17 LYS HE2 H -8.347 0.893 -7.630 1.00 . A A . 17 LYS HE2 1 1 19 9711 1 1 17 LYS HE3 H -7.043 -0.122 -7.019 1.00 . A A . 17 LYS HE3 1 1 19 9712 1 1 17 LYS HG2 H -6.683 2.638 -8.344 1.00 . A A . 17 LYS HG2 1 1 19 9713 1 1 17 LYS HG3 H -5.395 1.582 -7.783 1.00 . A A . 17 LYS HG3 1 1 19 9714 1 1 17 LYS HZ1 H -9.347 0.902 -5.441 1.00 . A A . 17 LYS HZ1 1 1 19 9715 1 1 17 LYS HZ2 H -8.059 0.090 -4.800 1.00 . A A . 17 LYS HZ2 1 1 19 9716 1 1 17 LYS HZ3 H -9.066 -0.709 -5.865 1.00 . A A . 17 LYS HZ3 1 1 19 9717 1 1 17 LYS N N -4.716 3.149 -4.731 1.00 . A A . 17 LYS N 1 1 19 9718 1 1 17 LYS NZ N -8.611 0.205 -5.673 1.00 . A A . 17 LYS NZ 1 1 19 9719 1 1 17 LYS O O -3.269 5.492 -5.418 1.00 . A A . 17 LYS O 1 1 19 9720 1 1 18 GLY C C 0.143 4.487 -5.508 1.00 . A A . 18 GLY C 1 1 19 9721 1 1 18 GLY CA C -0.823 4.943 -6.565 1.00 . A A . 18 GLY CA 1 1 19 9722 1 1 18 GLY H H -1.905 3.205 -7.030 1.00 . A A . 18 GLY H 1 1 19 9723 1 1 18 GLY HA2 H -0.343 4.912 -7.531 1.00 . A A . 18 GLY HA2 1 1 19 9724 1 1 18 GLY HA3 H -1.135 5.952 -6.345 1.00 . A A . 18 GLY HA3 1 1 19 9725 1 1 18 GLY N N -1.963 4.078 -6.581 1.00 . A A . 18 GLY N 1 1 19 9726 1 1 18 GLY O O 1.131 5.154 -5.204 1.00 . A A . 18 GLY O 1 1 19 9727 1 1 19 MET C C 1.043 1.368 -4.314 1.00 . A A . 19 MET C 1 1 19 9728 1 1 19 MET CA C 0.658 2.773 -3.907 1.00 . A A . 19 MET CA 1 1 19 9729 1 1 19 MET CB C -0.077 2.758 -2.556 1.00 . A A . 19 MET CB 1 1 19 9730 1 1 19 MET CE C -1.891 5.853 -0.450 1.00 . A A . 19 MET CE 1 1 19 9731 1 1 19 MET CG C -0.468 4.138 -2.067 1.00 . A A . 19 MET CG 1 1 19 9732 1 1 19 MET H H -0.994 2.884 -5.162 1.00 . A A . 19 MET H 1 1 19 9733 1 1 19 MET HA H 1.552 3.370 -3.811 1.00 . A A . 19 MET HA 1 1 19 9734 1 1 19 MET HB2 H -0.977 2.168 -2.658 1.00 . A A . 19 MET HB2 1 1 19 9735 1 1 19 MET HB3 H 0.562 2.301 -1.814 1.00 . A A . 19 MET HB3 1 1 19 9736 1 1 19 MET HE1 H -2.524 6.008 0.412 1.00 . A A . 19 MET HE1 1 1 19 9737 1 1 19 MET HE2 H -2.419 6.158 -1.342 1.00 . A A . 19 MET HE2 1 1 19 9738 1 1 19 MET HE3 H -0.989 6.438 -0.345 1.00 . A A . 19 MET HE3 1 1 19 9739 1 1 19 MET HG2 H 0.448 4.669 -1.846 1.00 . A A . 19 MET HG2 1 1 19 9740 1 1 19 MET HG3 H -1.009 4.651 -2.849 1.00 . A A . 19 MET HG3 1 1 19 9741 1 1 19 MET N N -0.165 3.356 -4.919 1.00 . A A . 19 MET N 1 1 19 9742 1 1 19 MET O O 0.380 0.748 -5.147 1.00 . A A . 19 MET O 1 1 19 9743 1 1 19 MET SD S -1.468 4.116 -0.570 1.00 . A A . 19 MET SD 1 1 19 9744 1 1 20 VAL C C 2.226 -1.293 -2.802 1.00 . A A . 20 VAL C 1 1 19 9745 1 1 20 VAL CA C 2.587 -0.434 -3.993 1.00 . A A . 20 VAL CA 1 1 19 9746 1 1 20 VAL CB C 4.134 -0.418 -4.171 1.00 . A A . 20 VAL CB 1 1 19 9747 1 1 20 VAL CG1 C 4.665 -1.808 -4.491 1.00 . A A . 20 VAL CG1 1 1 19 9748 1 1 20 VAL CG2 C 4.551 0.577 -5.250 1.00 . A A . 20 VAL CG2 1 1 19 9749 1 1 20 VAL H H 2.554 1.436 -3.066 1.00 . A A . 20 VAL H 1 1 19 9750 1 1 20 VAL HA H 2.121 -0.821 -4.887 1.00 . A A . 20 VAL HA 1 1 19 9751 1 1 20 VAL HB H 4.571 -0.104 -3.233 1.00 . A A . 20 VAL HB 1 1 19 9752 1 1 20 VAL HG11 H 4.232 -2.154 -5.417 1.00 . A A . 20 VAL HG11 1 1 19 9753 1 1 20 VAL HG12 H 4.399 -2.485 -3.693 1.00 . A A . 20 VAL HG12 1 1 19 9754 1 1 20 VAL HG13 H 5.739 -1.768 -4.586 1.00 . A A . 20 VAL HG13 1 1 19 9755 1 1 20 VAL HG21 H 4.099 0.298 -6.190 1.00 . A A . 20 VAL HG21 1 1 19 9756 1 1 20 VAL HG22 H 5.627 0.569 -5.353 1.00 . A A . 20 VAL HG22 1 1 19 9757 1 1 20 VAL HG23 H 4.224 1.568 -4.973 1.00 . A A . 20 VAL HG23 1 1 19 9758 1 1 20 VAL N N 2.084 0.879 -3.731 1.00 . A A . 20 VAL N 1 1 19 9759 1 1 20 VAL O O 2.499 -0.918 -1.652 1.00 . A A . 20 VAL O 1 1 19 9760 1 1 21 CYS C C 2.181 -4.317 -1.709 1.00 . A A . 21 CYS C 1 1 19 9761 1 1 21 CYS CA C 1.105 -3.275 -2.030 1.00 . A A . 21 CYS CA 1 1 19 9762 1 1 21 CYS CB C -0.202 -3.939 -2.504 1.00 . A A . 21 CYS CB 1 1 19 9763 1 1 21 CYS H H 1.445 -2.666 -4.002 1.00 . A A . 21 CYS H 1 1 19 9764 1 1 21 CYS HA H 0.904 -2.682 -1.150 1.00 . A A . 21 CYS HA 1 1 19 9765 1 1 21 CYS HB2 H -0.822 -3.193 -2.979 1.00 . A A . 21 CYS HB2 1 1 19 9766 1 1 21 CYS HB3 H 0.062 -4.687 -3.238 1.00 . A A . 21 CYS HB3 1 1 19 9767 1 1 21 CYS N N 1.586 -2.399 -3.069 1.00 . A A . 21 CYS N 1 1 19 9768 1 1 21 CYS O O 2.689 -5.002 -2.607 1.00 . A A . 21 CYS O 1 1 19 9769 1 1 21 CYS SG S -1.239 -4.757 -1.219 1.00 . A A . 21 CYS SG 1 1 19 9770 1 1 22 ARG C C 3.296 -5.403 1.566 1.00 . A A . 22 ARG C 1 1 19 9771 1 1 22 ARG CA C 3.512 -5.316 0.037 1.00 . A A . 22 ARG CA 1 1 19 9772 1 1 22 ARG CB C 4.919 -4.799 -0.314 1.00 . A A . 22 ARG CB 1 1 19 9773 1 1 22 ARG CD C 7.306 -5.348 -0.694 1.00 . A A . 22 ARG CD 1 1 19 9774 1 1 22 ARG CG C 5.991 -5.870 -0.267 1.00 . A A . 22 ARG CG 1 1 19 9775 1 1 22 ARG CZ C 9.626 -6.120 -0.266 1.00 . A A . 22 ARG CZ 1 1 19 9776 1 1 22 ARG H H 2.105 -3.822 0.218 1.00 . A A . 22 ARG H 1 1 19 9777 1 1 22 ARG HA H 3.349 -6.277 -0.428 1.00 . A A . 22 ARG HA 1 1 19 9778 1 1 22 ARG HB2 H 4.898 -4.382 -1.311 1.00 . A A . 22 ARG HB2 1 1 19 9779 1 1 22 ARG HB3 H 5.186 -4.020 0.386 1.00 . A A . 22 ARG HB3 1 1 19 9780 1 1 22 ARG HD2 H 7.199 -5.072 -1.732 1.00 . A A . 22 ARG HD2 1 1 19 9781 1 1 22 ARG HD3 H 7.537 -4.482 -0.091 1.00 . A A . 22 ARG HD3 1 1 19 9782 1 1 22 ARG HE H 8.030 -7.292 -0.620 1.00 . A A . 22 ARG HE 1 1 19 9783 1 1 22 ARG HG2 H 6.124 -6.241 0.735 1.00 . A A . 22 ARG HG2 1 1 19 9784 1 1 22 ARG HG3 H 5.713 -6.681 -0.923 1.00 . A A . 22 ARG HG3 1 1 19 9785 1 1 22 ARG HH11 H 9.512 -4.075 -0.451 1.00 . A A . 22 ARG HH11 1 1 19 9786 1 1 22 ARG HH12 H 11.047 -4.662 -0.027 1.00 . A A . 22 ARG HH12 1 1 19 9787 1 1 22 ARG HH21 H 10.108 -8.089 -0.081 1.00 . A A . 22 ARG HH21 1 1 19 9788 1 1 22 ARG HH22 H 11.418 -7.035 0.181 1.00 . A A . 22 ARG HH22 1 1 19 9789 1 1 22 ARG N N 2.540 -4.395 -0.451 1.00 . A A . 22 ARG N 1 1 19 9790 1 1 22 ARG NE N 8.344 -6.362 -0.540 1.00 . A A . 22 ARG NE 1 1 19 9791 1 1 22 ARG NH1 N 10.091 -4.869 -0.252 1.00 . A A . 22 ARG NH1 1 1 19 9792 1 1 22 ARG NH2 N 10.446 -7.141 -0.043 1.00 . A A . 22 ARG NH2 1 1 19 9793 1 1 22 ARG O O 2.233 -4.968 2.063 1.00 . A A . 22 ARG O 1 1 19 9794 1 1 23 LEU C C 3.872 -4.690 4.432 1.00 . A A . 23 LEU C 1 1 19 9795 1 1 23 LEU CA C 4.231 -6.029 3.787 1.00 . A A . 23 LEU CA 1 1 19 9796 1 1 23 LEU CB C 5.563 -6.543 4.393 1.00 . A A . 23 LEU CB 1 1 19 9797 1 1 23 LEU CD1 C 4.920 -9.005 4.366 1.00 . A A . 23 LEU CD1 1 1 19 9798 1 1 23 LEU CD2 C 6.544 -8.125 2.657 1.00 . A A . 23 LEU CD2 1 1 19 9799 1 1 23 LEU CG C 6.016 -7.988 4.075 1.00 . A A . 23 LEU CG 1 1 19 9800 1 1 23 LEU H H 5.052 -6.317 1.864 1.00 . A A . 23 LEU H 1 1 19 9801 1 1 23 LEU HA H 3.449 -6.732 4.031 1.00 . A A . 23 LEU HA 1 1 19 9802 1 1 23 LEU HB2 H 6.347 -5.883 4.054 1.00 . A A . 23 LEU HB2 1 1 19 9803 1 1 23 LEU HB3 H 5.489 -6.445 5.466 1.00 . A A . 23 LEU HB3 1 1 19 9804 1 1 23 LEU HD11 H 4.637 -8.943 5.407 1.00 . A A . 23 LEU HD11 1 1 19 9805 1 1 23 LEU HD12 H 5.288 -9.998 4.152 1.00 . A A . 23 LEU HD12 1 1 19 9806 1 1 23 LEU HD13 H 4.061 -8.800 3.744 1.00 . A A . 23 LEU HD13 1 1 19 9807 1 1 23 LEU HD21 H 7.360 -7.434 2.504 1.00 . A A . 23 LEU HD21 1 1 19 9808 1 1 23 LEU HD22 H 5.752 -7.923 1.954 1.00 . A A . 23 LEU HD22 1 1 19 9809 1 1 23 LEU HD23 H 6.899 -9.133 2.506 1.00 . A A . 23 LEU HD23 1 1 19 9810 1 1 23 LEU HG H 6.819 -8.224 4.757 1.00 . A A . 23 LEU HG 1 1 19 9811 1 1 23 LEU N N 4.280 -5.932 2.316 1.00 . A A . 23 LEU N 1 1 19 9812 1 1 23 LEU O O 3.425 -4.650 5.567 1.00 . A A . 23 LEU O 1 1 19 9813 1 1 24 TRP C C 3.272 -1.557 2.840 1.00 . A A . 24 TRP C 1 1 19 9814 1 1 24 TRP CA C 3.673 -2.313 4.110 1.00 . A A . 24 TRP CA 1 1 19 9815 1 1 24 TRP CB C 4.772 -1.564 4.892 1.00 . A A . 24 TRP CB 1 1 19 9816 1 1 24 TRP CD1 C 6.069 0.172 3.588 1.00 . A A . 24 TRP CD1 1 1 19 9817 1 1 24 TRP CD2 C 7.062 -1.823 3.629 1.00 . A A . 24 TRP CD2 1 1 19 9818 1 1 24 TRP CE2 C 7.870 -0.940 2.888 1.00 . A A . 24 TRP CE2 1 1 19 9819 1 1 24 TRP CE3 C 7.481 -3.142 3.793 1.00 . A A . 24 TRP CE3 1 1 19 9820 1 1 24 TRP CG C 5.919 -1.079 4.069 1.00 . A A . 24 TRP CG 1 1 19 9821 1 1 24 TRP CH2 C 9.452 -2.639 2.491 1.00 . A A . 24 TRP CH2 1 1 19 9822 1 1 24 TRP CZ2 C 9.069 -1.340 2.314 1.00 . A A . 24 TRP CZ2 1 1 19 9823 1 1 24 TRP CZ3 C 8.671 -3.536 3.219 1.00 . A A . 24 TRP CZ3 1 1 19 9824 1 1 24 TRP H H 4.531 -3.685 2.834 1.00 . A A . 24 TRP H 1 1 19 9825 1 1 24 TRP HA H 2.812 -2.470 4.737 1.00 . A A . 24 TRP HA 1 1 19 9826 1 1 24 TRP HB2 H 4.335 -0.700 5.372 1.00 . A A . 24 TRP HB2 1 1 19 9827 1 1 24 TRP HB3 H 5.163 -2.221 5.655 1.00 . A A . 24 TRP HB3 1 1 19 9828 1 1 24 TRP HD1 H 5.326 0.937 3.773 1.00 . A A . 24 TRP HD1 1 1 19 9829 1 1 24 TRP HE1 H 7.560 1.094 2.441 1.00 . A A . 24 TRP HE1 1 1 19 9830 1 1 24 TRP HE3 H 6.885 -3.846 4.356 1.00 . A A . 24 TRP HE3 1 1 19 9831 1 1 24 TRP HH2 H 10.379 -2.993 2.061 1.00 . A A . 24 TRP HH2 1 1 19 9832 1 1 24 TRP HZ2 H 9.693 -0.664 1.749 1.00 . A A . 24 TRP HZ2 1 1 19 9833 1 1 24 TRP HZ3 H 9.012 -4.553 3.333 1.00 . A A . 24 TRP HZ3 1 1 19 9834 1 1 24 TRP N N 4.097 -3.614 3.711 1.00 . A A . 24 TRP N 1 1 19 9835 1 1 24 TRP NE1 N 7.240 0.275 2.878 1.00 . A A . 24 TRP NE1 1 1 19 9836 1 1 24 TRP O O 3.686 -1.961 1.742 1.00 . A A . 24 TRP O 1 1 19 9837 1 1 25 CYS C C 3.092 1.336 1.521 1.00 . A A . 25 CYS C 1 1 19 9838 1 1 25 CYS CA C 2.076 0.256 1.798 1.00 . A A . 25 CYS CA 1 1 19 9839 1 1 25 CYS CB C 0.684 0.871 1.958 1.00 . A A . 25 CYS CB 1 1 19 9840 1 1 25 CYS H H 2.122 -0.243 3.833 1.00 . A A . 25 CYS H 1 1 19 9841 1 1 25 CYS HA H 2.063 -0.417 0.953 1.00 . A A . 25 CYS HA 1 1 19 9842 1 1 25 CYS HB2 H 0.646 1.416 2.891 1.00 . A A . 25 CYS HB2 1 1 19 9843 1 1 25 CYS HB3 H 0.508 1.557 1.143 1.00 . A A . 25 CYS HB3 1 1 19 9844 1 1 25 CYS N N 2.467 -0.524 2.959 1.00 . A A . 25 CYS N 1 1 19 9845 1 1 25 CYS O O 3.593 1.994 2.438 1.00 . A A . 25 CYS O 1 1 19 9846 1 1 25 CYS SG S -0.681 -0.332 1.979 1.00 . A A . 25 CYS SG 1 1 19 9847 1 1 26 LYS C C 3.783 3.255 -1.302 1.00 . A A . 26 LYS C 1 1 19 9848 1 1 26 LYS CA C 4.371 2.473 -0.157 1.00 . A A . 26 LYS CA 1 1 19 9849 1 1 26 LYS CB C 5.609 1.707 -0.630 1.00 . A A . 26 LYS CB 1 1 19 9850 1 1 26 LYS CD C 7.885 1.724 -1.697 1.00 . A A . 26 LYS CD 1 1 19 9851 1 1 26 LYS CE C 8.522 0.913 -0.580 1.00 . A A . 26 LYS CE 1 1 19 9852 1 1 26 LYS CG C 6.721 2.567 -1.198 1.00 . A A . 26 LYS CG 1 1 19 9853 1 1 26 LYS H H 2.938 0.978 -0.409 1.00 . A A . 26 LYS H 1 1 19 9854 1 1 26 LYS HA H 4.643 3.124 0.659 1.00 . A A . 26 LYS HA 1 1 19 9855 1 1 26 LYS HB2 H 6.002 1.167 0.218 1.00 . A A . 26 LYS HB2 1 1 19 9856 1 1 26 LYS HB3 H 5.305 0.995 -1.384 1.00 . A A . 26 LYS HB3 1 1 19 9857 1 1 26 LYS HD2 H 7.525 1.046 -2.457 1.00 . A A . 26 LYS HD2 1 1 19 9858 1 1 26 LYS HD3 H 8.631 2.378 -2.124 1.00 . A A . 26 LYS HD3 1 1 19 9859 1 1 26 LYS HE2 H 8.916 1.586 0.165 1.00 . A A . 26 LYS HE2 1 1 19 9860 1 1 26 LYS HE3 H 7.773 0.278 -0.130 1.00 . A A . 26 LYS HE3 1 1 19 9861 1 1 26 LYS HG2 H 6.327 3.149 -2.018 1.00 . A A . 26 LYS HG2 1 1 19 9862 1 1 26 LYS HG3 H 7.065 3.230 -0.420 1.00 . A A . 26 LYS HG3 1 1 19 9863 1 1 26 LYS HZ1 H 10.349 0.653 -1.522 1.00 . A A . 26 LYS HZ1 1 1 19 9864 1 1 26 LYS HZ2 H 9.271 -0.607 -1.788 1.00 . A A . 26 LYS HZ2 1 1 19 9865 1 1 26 LYS HZ3 H 10.066 -0.471 -0.313 1.00 . A A . 26 LYS HZ3 1 1 19 9866 1 1 26 LYS N N 3.395 1.514 0.276 1.00 . A A . 26 LYS N 1 1 19 9867 1 1 26 LYS NZ N 9.614 0.070 -1.077 1.00 . A A . 26 LYS NZ 1 1 19 9868 1 1 26 LYS O O 3.084 2.688 -2.095 1.00 . A A . 26 LYS O 1 1 19 9869 1 1 27 LYS C C 4.496 5.143 -3.659 1.00 . A A . 27 LYS C 1 1 19 9870 1 1 27 LYS CA C 3.543 5.317 -2.506 1.00 . A A . 27 LYS CA 1 1 19 9871 1 1 27 LYS CB C 3.496 6.807 -2.198 1.00 . A A . 27 LYS CB 1 1 19 9872 1 1 27 LYS CD C 2.663 8.752 -0.968 1.00 . A A . 27 LYS CD 1 1 19 9873 1 1 27 LYS CE C 1.812 9.301 0.151 1.00 . A A . 27 LYS CE 1 1 19 9874 1 1 27 LYS CG C 2.589 7.245 -1.078 1.00 . A A . 27 LYS CG 1 1 19 9875 1 1 27 LYS H H 4.564 4.974 -0.677 1.00 . A A . 27 LYS H 1 1 19 9876 1 1 27 LYS HA H 2.557 4.974 -2.781 1.00 . A A . 27 LYS HA 1 1 19 9877 1 1 27 LYS HB2 H 4.495 7.126 -1.950 1.00 . A A . 27 LYS HB2 1 1 19 9878 1 1 27 LYS HB3 H 3.195 7.322 -3.098 1.00 . A A . 27 LYS HB3 1 1 19 9879 1 1 27 LYS HD2 H 3.688 9.041 -0.799 1.00 . A A . 27 LYS HD2 1 1 19 9880 1 1 27 LYS HD3 H 2.329 9.175 -1.903 1.00 . A A . 27 LYS HD3 1 1 19 9881 1 1 27 LYS HE2 H 0.783 9.029 -0.030 1.00 . A A . 27 LYS HE2 1 1 19 9882 1 1 27 LYS HE3 H 2.139 8.869 1.085 1.00 . A A . 27 LYS HE3 1 1 19 9883 1 1 27 LYS HG2 H 1.577 6.940 -1.295 1.00 . A A . 27 LYS HG2 1 1 19 9884 1 1 27 LYS HG3 H 2.924 6.805 -0.150 1.00 . A A . 27 LYS HG3 1 1 19 9885 1 1 27 LYS HZ1 H 1.293 11.148 0.962 1.00 . A A . 27 LYS HZ1 1 1 19 9886 1 1 27 LYS HZ2 H 1.668 11.204 -0.680 1.00 . A A . 27 LYS HZ2 1 1 19 9887 1 1 27 LYS HZ3 H 2.901 11.055 0.455 1.00 . A A . 27 LYS HZ3 1 1 19 9888 1 1 27 LYS N N 4.027 4.539 -1.373 1.00 . A A . 27 LYS N 1 1 19 9889 1 1 27 LYS NZ N 1.925 10.770 0.228 1.00 . A A . 27 LYS NZ 1 1 19 9890 1 1 27 LYS O O 5.687 4.874 -3.447 1.00 . A A . 27 LYS O 1 1 19 9891 1 1 28 LYS C C 5.564 6.626 -6.093 1.00 . A A . 28 LYS C 1 1 19 9892 1 1 28 LYS CA C 4.869 5.273 -5.995 1.00 . A A . 28 LYS CA 1 1 19 9893 1 1 28 LYS CB C 4.103 4.953 -7.277 1.00 . A A . 28 LYS CB 1 1 19 9894 1 1 28 LYS CD C 2.387 5.586 -8.936 1.00 . A A . 28 LYS CD 1 1 19 9895 1 1 28 LYS CE C 1.338 6.590 -9.302 1.00 . A A . 28 LYS CE 1 1 19 9896 1 1 28 LYS CG C 3.041 5.950 -7.639 1.00 . A A . 28 LYS CG 1 1 19 9897 1 1 28 LYS H H 3.038 5.426 -4.975 1.00 . A A . 28 LYS H 1 1 19 9898 1 1 28 LYS HA H 5.610 4.511 -5.823 1.00 . A A . 28 LYS HA 1 1 19 9899 1 1 28 LYS HB2 H 4.803 4.903 -8.097 1.00 . A A . 28 LYS HB2 1 1 19 9900 1 1 28 LYS HB3 H 3.634 3.986 -7.163 1.00 . A A . 28 LYS HB3 1 1 19 9901 1 1 28 LYS HD2 H 3.133 5.560 -9.715 1.00 . A A . 28 LYS HD2 1 1 19 9902 1 1 28 LYS HD3 H 1.929 4.614 -8.838 1.00 . A A . 28 LYS HD3 1 1 19 9903 1 1 28 LYS HE2 H 0.857 6.282 -10.215 1.00 . A A . 28 LYS HE2 1 1 19 9904 1 1 28 LYS HE3 H 0.634 6.579 -8.484 1.00 . A A . 28 LYS HE3 1 1 19 9905 1 1 28 LYS HG2 H 2.293 5.966 -6.860 1.00 . A A . 28 LYS HG2 1 1 19 9906 1 1 28 LYS HG3 H 3.491 6.927 -7.732 1.00 . A A . 28 LYS HG3 1 1 19 9907 1 1 28 LYS HZ1 H 2.088 8.387 -8.515 1.00 . A A . 28 LYS HZ1 1 1 19 9908 1 1 28 LYS HZ2 H 1.246 8.585 -9.963 1.00 . A A . 28 LYS HZ2 1 1 19 9909 1 1 28 LYS HZ3 H 2.800 7.939 -9.962 1.00 . A A . 28 LYS HZ3 1 1 19 9910 1 1 28 LYS N N 4.005 5.293 -4.856 1.00 . A A . 28 LYS N 1 1 19 9911 1 1 28 LYS NZ N 1.893 7.958 -9.443 1.00 . A A . 28 LYS NZ 1 1 19 9912 1 1 28 LYS O O 4.935 7.676 -5.863 1.00 . A A . 28 LYS O 1 1 19 9913 1 1 29 LEU C C 7.157 8.651 -7.664 1.00 . A A . 29 LEU C 1 1 19 9914 1 1 29 LEU CA C 7.613 7.831 -6.465 1.00 . A A . 29 LEU CA 1 1 19 9915 1 1 29 LEU CB C 9.135 7.503 -6.509 1.00 . A A . 29 LEU CB 1 1 19 9916 1 1 29 LEU CD1 C 11.509 8.184 -6.073 1.00 . A A . 29 LEU CD1 1 1 19 9917 1 1 29 LEU CD2 C 10.286 9.321 -7.886 1.00 . A A . 29 LEU CD2 1 1 19 9918 1 1 29 LEU CG C 10.148 8.683 -6.503 1.00 . A A . 29 LEU CG 1 1 19 9919 1 1 29 LEU H H 7.294 5.750 -6.524 1.00 . A A . 29 LEU H 1 1 19 9920 1 1 29 LEU HA H 7.405 8.402 -5.573 1.00 . A A . 29 LEU HA 1 1 19 9921 1 1 29 LEU HB2 H 9.359 6.882 -5.654 1.00 . A A . 29 LEU HB2 1 1 19 9922 1 1 29 LEU HB3 H 9.316 6.915 -7.397 1.00 . A A . 29 LEU HB3 1 1 19 9923 1 1 29 LEU HD11 H 11.445 7.762 -5.081 1.00 . A A . 29 LEU HD11 1 1 19 9924 1 1 29 LEU HD12 H 12.210 9.006 -6.070 1.00 . A A . 29 LEU HD12 1 1 19 9925 1 1 29 LEU HD13 H 11.849 7.426 -6.764 1.00 . A A . 29 LEU HD13 1 1 19 9926 1 1 29 LEU HD21 H 10.987 10.141 -7.837 1.00 . A A . 29 LEU HD21 1 1 19 9927 1 1 29 LEU HD22 H 9.323 9.689 -8.209 1.00 . A A . 29 LEU HD22 1 1 19 9928 1 1 29 LEU HD23 H 10.640 8.584 -8.590 1.00 . A A . 29 LEU HD23 1 1 19 9929 1 1 29 LEU HG H 9.826 9.438 -5.802 1.00 . A A . 29 LEU HG 1 1 19 9930 1 1 29 LEU N N 6.843 6.611 -6.376 1.00 . A A . 29 LEU N 1 1 19 9931 1 1 29 LEU O O 7.001 9.880 -7.571 1.00 . A A . 29 LEU O 1 1 19 9932 1 1 30 TRP C C 5.004 8.499 -10.117 1.00 . A A . 30 TRP C 1 1 19 9933 1 1 30 TRP CA C 6.513 8.631 -9.960 1.00 . A A . 30 TRP CA 1 1 19 9934 1 1 30 TRP CB C 7.264 8.038 -11.157 1.00 . A A . 30 TRP CB 1 1 19 9935 1 1 30 TRP CD1 C 6.174 8.493 -13.423 1.00 . A A . 30 TRP CD1 1 1 19 9936 1 1 30 TRP CD2 C 7.753 9.968 -12.856 1.00 . A A . 30 TRP CD2 1 1 19 9937 1 1 30 TRP CE2 C 7.235 10.328 -14.109 1.00 . A A . 30 TRP CE2 1 1 19 9938 1 1 30 TRP CE3 C 8.763 10.754 -12.294 1.00 . A A . 30 TRP CE3 1 1 19 9939 1 1 30 TRP CG C 7.055 8.789 -12.433 1.00 . A A . 30 TRP CG 1 1 19 9940 1 1 30 TRP CH2 C 8.679 12.187 -14.242 1.00 . A A . 30 TRP CH2 1 1 19 9941 1 1 30 TRP CZ2 C 7.692 11.436 -14.813 1.00 . A A . 30 TRP CZ2 1 1 19 9942 1 1 30 TRP CZ3 C 9.215 11.855 -12.995 1.00 . A A . 30 TRP CZ3 1 1 19 9943 1 1 30 TRP H H 6.989 7.007 -8.736 1.00 . A A . 30 TRP H 1 1 19 9944 1 1 30 TRP HA H 6.757 9.679 -9.870 1.00 . A A . 30 TRP HA 1 1 19 9945 1 1 30 TRP HB2 H 8.322 8.041 -10.942 1.00 . A A . 30 TRP HB2 1 1 19 9946 1 1 30 TRP HB3 H 6.939 7.020 -11.309 1.00 . A A . 30 TRP HB3 1 1 19 9947 1 1 30 TRP HD1 H 5.499 7.651 -13.401 1.00 . A A . 30 TRP HD1 1 1 19 9948 1 1 30 TRP HE1 H 5.742 9.421 -15.256 1.00 . A A . 30 TRP HE1 1 1 19 9949 1 1 30 TRP HE3 H 9.188 10.509 -11.330 1.00 . A A . 30 TRP HE3 1 1 19 9950 1 1 30 TRP HH2 H 9.061 13.056 -14.757 1.00 . A A . 30 TRP HH2 1 1 19 9951 1 1 30 TRP HZ2 H 7.290 11.710 -15.779 1.00 . A A . 30 TRP HZ2 1 1 19 9952 1 1 30 TRP HZ3 H 9.997 12.475 -12.579 1.00 . A A . 30 TRP HZ3 1 1 19 9953 1 1 30 TRP N N 6.917 7.984 -8.753 1.00 . A A . 30 TRP N 1 1 19 9954 1 1 30 TRP NE1 N 6.277 9.415 -14.430 1.00 . A A . 30 TRP NE1 1 1 19 9955 1 1 30 TRP O O 4.515 7.429 -10.521 1.00 . A A . 30 TRP O 1 1 19 9956 1 1 30 TRP OXT O 4.286 9.456 -9.818 1.00 . A A . 30 TRP OXT 1 1 20 9957 1 1 1 TYR C C -9.728 -0.707 2.839 1.00 . A A . 1 TYR C 1 1 20 9958 1 1 1 TYR CA C -10.946 -0.665 3.750 1.00 . A A . 1 TYR CA 1 1 20 9959 1 1 1 TYR CB C -12.211 -0.281 2.955 1.00 . A A . 1 TYR CB 1 1 20 9960 1 1 1 TYR CD1 C -13.503 -2.360 2.385 1.00 . A A . 1 TYR CD1 1 1 20 9961 1 1 1 TYR CD2 C -12.278 -1.308 0.642 1.00 . A A . 1 TYR CD2 1 1 20 9962 1 1 1 TYR CE1 C -13.926 -3.328 1.511 1.00 . A A . 1 TYR CE1 1 1 20 9963 1 1 1 TYR CE2 C -12.701 -2.274 -0.242 1.00 . A A . 1 TYR CE2 1 1 20 9964 1 1 1 TYR CG C -12.672 -1.335 1.972 1.00 . A A . 1 TYR CG 1 1 20 9965 1 1 1 TYR CZ C -13.523 -3.283 0.199 1.00 . A A . 1 TYR CZ 1 1 20 9966 1 1 1 TYR H1 H -9.869 0.025 5.372 1.00 . A A . 1 TYR H1 1 1 20 9967 1 1 1 TYR H2 H -11.515 0.291 5.486 1.00 . A A . 1 TYR H2 1 1 20 9968 1 1 1 TYR H3 H -10.582 1.262 4.462 1.00 . A A . 1 TYR H3 1 1 20 9969 1 1 1 TYR HA H -11.078 -1.642 4.191 1.00 . A A . 1 TYR HA 1 1 20 9970 1 1 1 TYR HB2 H -13.023 -0.101 3.642 1.00 . A A . 1 TYR HB2 1 1 20 9971 1 1 1 TYR HB3 H -12.015 0.625 2.400 1.00 . A A . 1 TYR HB3 1 1 20 9972 1 1 1 TYR HD1 H -13.822 -2.395 3.417 1.00 . A A . 1 TYR HD1 1 1 20 9973 1 1 1 TYR HD2 H -11.632 -0.515 0.297 1.00 . A A . 1 TYR HD2 1 1 20 9974 1 1 1 TYR HE1 H -14.577 -4.116 1.864 1.00 . A A . 1 TYR HE1 1 1 20 9975 1 1 1 TYR HE2 H -12.382 -2.237 -1.273 1.00 . A A . 1 TYR HE2 1 1 20 9976 1 1 1 TYR HH H -14.864 -4.460 -0.483 1.00 . A A . 1 TYR HH 1 1 20 9977 1 1 1 TYR N N -10.713 0.299 4.828 1.00 . A A . 1 TYR N 1 1 20 9978 1 1 1 TYR O O -9.081 -1.746 2.697 1.00 . A A . 1 TYR O 1 1 20 9979 1 1 1 TYR OH O -13.939 -4.254 -0.675 1.00 . A A . 1 TYR OH 1 1 20 9980 1 1 2 CYS C C -7.124 0.933 2.312 1.00 . A A . 2 CYS C 1 1 20 9981 1 1 2 CYS CA C -8.248 0.523 1.399 1.00 . A A . 2 CYS CA 1 1 20 9982 1 1 2 CYS CB C -8.455 1.576 0.313 1.00 . A A . 2 CYS CB 1 1 20 9983 1 1 2 CYS H H -9.978 1.215 2.325 1.00 . A A . 2 CYS H 1 1 20 9984 1 1 2 CYS HA H -8.030 -0.438 0.958 1.00 . A A . 2 CYS HA 1 1 20 9985 1 1 2 CYS HB2 H -9.422 1.444 -0.145 1.00 . A A . 2 CYS HB2 1 1 20 9986 1 1 2 CYS HB3 H -8.408 2.539 0.796 1.00 . A A . 2 CYS HB3 1 1 20 9987 1 1 2 CYS N N -9.421 0.414 2.224 1.00 . A A . 2 CYS N 1 1 20 9988 1 1 2 CYS O O -7.365 1.617 3.319 1.00 . A A . 2 CYS O 1 1 20 9989 1 1 2 CYS SG S -7.195 1.576 -1.016 1.00 . A A . 2 CYS SG 1 1 20 9990 1 1 3 GLN C C -4.124 2.095 2.553 1.00 . A A . 3 GLN C 1 1 20 9991 1 1 3 GLN CA C -4.834 0.806 2.891 1.00 . A A . 3 GLN CA 1 1 20 9992 1 1 3 GLN CB C -3.850 -0.362 2.947 1.00 . A A . 3 GLN CB 1 1 20 9993 1 1 3 GLN CD C -5.244 -1.676 4.591 1.00 . A A . 3 GLN CD 1 1 20 9994 1 1 3 GLN CG C -4.482 -1.700 3.287 1.00 . A A . 3 GLN CG 1 1 20 9995 1 1 3 GLN H H -5.809 0.103 1.134 1.00 . A A . 3 GLN H 1 1 20 9996 1 1 3 GLN HA H -5.271 0.926 3.870 1.00 . A A . 3 GLN HA 1 1 20 9997 1 1 3 GLN HB2 H -3.329 -0.450 2.007 1.00 . A A . 3 GLN HB2 1 1 20 9998 1 1 3 GLN HB3 H -3.121 -0.140 3.711 1.00 . A A . 3 GLN HB3 1 1 20 9999 1 1 3 GLN HE21 H -3.620 -2.182 5.574 1.00 . A A . 3 GLN HE21 1 1 20 10000 1 1 3 GLN HE22 H -5.040 -1.942 6.531 1.00 . A A . 3 GLN HE22 1 1 20 10001 1 1 3 GLN HG2 H -5.168 -1.972 2.497 1.00 . A A . 3 GLN HG2 1 1 20 10002 1 1 3 GLN HG3 H -3.704 -2.444 3.356 1.00 . A A . 3 GLN HG3 1 1 20 10003 1 1 3 GLN N N -5.936 0.547 1.997 1.00 . A A . 3 GLN N 1 1 20 10004 1 1 3 GLN NE2 N -4.576 -1.964 5.666 1.00 . A A . 3 GLN NE2 1 1 20 10005 1 1 3 GLN O O -3.946 2.438 1.375 1.00 . A A . 3 GLN O 1 1 20 10006 1 1 3 GLN OE1 O -6.433 -1.404 4.618 1.00 . A A . 3 GLN OE1 1 1 20 10007 1 1 4 LYS C C -1.554 3.801 3.558 1.00 . A A . 4 LYS C 1 1 20 10008 1 1 4 LYS CA C -3.044 4.063 3.455 1.00 . A A . 4 LYS CA 1 1 20 10009 1 1 4 LYS CB C -3.463 5.040 4.554 1.00 . A A . 4 LYS CB 1 1 20 10010 1 1 4 LYS CD C -5.266 6.354 5.670 1.00 . A A . 4 LYS CD 1 1 20 10011 1 1 4 LYS CE C -6.754 6.617 5.779 1.00 . A A . 4 LYS CE 1 1 20 10012 1 1 4 LYS CG C -4.950 5.332 4.600 1.00 . A A . 4 LYS CG 1 1 20 10013 1 1 4 LYS H H -3.952 2.479 4.486 1.00 . A A . 4 LYS H 1 1 20 10014 1 1 4 LYS HA H -3.272 4.491 2.491 1.00 . A A . 4 LYS HA 1 1 20 10015 1 1 4 LYS HB2 H -3.174 4.627 5.510 1.00 . A A . 4 LYS HB2 1 1 20 10016 1 1 4 LYS HB3 H -2.937 5.972 4.406 1.00 . A A . 4 LYS HB3 1 1 20 10017 1 1 4 LYS HD2 H -4.913 5.975 6.616 1.00 . A A . 4 LYS HD2 1 1 20 10018 1 1 4 LYS HD3 H -4.758 7.276 5.433 1.00 . A A . 4 LYS HD3 1 1 20 10019 1 1 4 LYS HE2 H -7.148 6.881 4.809 1.00 . A A . 4 LYS HE2 1 1 20 10020 1 1 4 LYS HE3 H -7.232 5.711 6.120 1.00 . A A . 4 LYS HE3 1 1 20 10021 1 1 4 LYS HG2 H -5.261 5.718 3.641 1.00 . A A . 4 LYS HG2 1 1 20 10022 1 1 4 LYS HG3 H -5.483 4.417 4.815 1.00 . A A . 4 LYS HG3 1 1 20 10023 1 1 4 LYS HZ1 H -8.064 7.910 6.773 1.00 . A A . 4 LYS HZ1 1 1 20 10024 1 1 4 LYS HZ2 H -6.537 8.572 6.500 1.00 . A A . 4 LYS HZ2 1 1 20 10025 1 1 4 LYS HZ3 H -6.753 7.432 7.703 1.00 . A A . 4 LYS HZ3 1 1 20 10026 1 1 4 LYS N N -3.753 2.816 3.587 1.00 . A A . 4 LYS N 1 1 20 10027 1 1 4 LYS NZ N -7.047 7.699 6.743 1.00 . A A . 4 LYS NZ 1 1 20 10028 1 1 4 LYS O O -1.147 2.732 3.982 1.00 . A A . 4 LYS O 1 1 20 10029 1 1 5 TRP C C 1.321 4.359 4.568 1.00 . A A . 5 TRP C 1 1 20 10030 1 1 5 TRP CA C 0.711 4.712 3.200 1.00 . A A . 5 TRP CA 1 1 20 10031 1 1 5 TRP CB C 1.305 6.041 2.687 1.00 . A A . 5 TRP CB 1 1 20 10032 1 1 5 TRP CD1 C 1.826 7.703 4.575 1.00 . A A . 5 TRP CD1 1 1 20 10033 1 1 5 TRP CD2 C -0.133 8.084 3.569 1.00 . A A . 5 TRP CD2 1 1 20 10034 1 1 5 TRP CE2 C 0.047 9.043 4.581 1.00 . A A . 5 TRP CE2 1 1 20 10035 1 1 5 TRP CE3 C -1.302 8.131 2.806 1.00 . A A . 5 TRP CE3 1 1 20 10036 1 1 5 TRP CG C 1.027 7.230 3.580 1.00 . A A . 5 TRP CG 1 1 20 10037 1 1 5 TRP CH2 C -2.023 10.046 4.084 1.00 . A A . 5 TRP CH2 1 1 20 10038 1 1 5 TRP CZ2 C -0.893 10.029 4.846 1.00 . A A . 5 TRP CZ2 1 1 20 10039 1 1 5 TRP CZ3 C -2.232 9.111 3.072 1.00 . A A . 5 TRP CZ3 1 1 20 10040 1 1 5 TRP H H -1.173 5.662 3.016 1.00 . A A . 5 TRP H 1 1 20 10041 1 1 5 TRP HA H 0.971 3.934 2.498 1.00 . A A . 5 TRP HA 1 1 20 10042 1 1 5 TRP HB2 H 2.376 5.932 2.610 1.00 . A A . 5 TRP HB2 1 1 20 10043 1 1 5 TRP HB3 H 0.902 6.254 1.708 1.00 . A A . 5 TRP HB3 1 1 20 10044 1 1 5 TRP HD1 H 2.778 7.261 4.834 1.00 . A A . 5 TRP HD1 1 1 20 10045 1 1 5 TRP HE1 H 1.626 9.309 5.921 1.00 . A A . 5 TRP HE1 1 1 20 10046 1 1 5 TRP HE3 H -1.487 7.422 2.013 1.00 . A A . 5 TRP HE3 1 1 20 10047 1 1 5 TRP HH2 H -2.782 10.796 4.258 1.00 . A A . 5 TRP HH2 1 1 20 10048 1 1 5 TRP HZ2 H -0.751 10.763 5.625 1.00 . A A . 5 TRP HZ2 1 1 20 10049 1 1 5 TRP HZ3 H -3.144 9.160 2.495 1.00 . A A . 5 TRP HZ3 1 1 20 10050 1 1 5 TRP N N -0.762 4.805 3.242 1.00 . A A . 5 TRP N 1 1 20 10051 1 1 5 TRP NE1 N 1.247 8.789 5.177 1.00 . A A . 5 TRP NE1 1 1 20 10052 1 1 5 TRP O O 2.398 3.787 4.654 1.00 . A A . 5 TRP O 1 1 20 10053 1 1 6 MET C C 0.707 3.047 7.413 1.00 . A A . 6 MET C 1 1 20 10054 1 1 6 MET CA C 1.098 4.459 6.969 1.00 . A A . 6 MET CA 1 1 20 10055 1 1 6 MET CB C 0.508 5.514 7.901 1.00 . A A . 6 MET CB 1 1 20 10056 1 1 6 MET CE C 1.233 6.448 11.882 1.00 . A A . 6 MET CE 1 1 20 10057 1 1 6 MET CG C 0.996 5.434 9.322 1.00 . A A . 6 MET CG 1 1 20 10058 1 1 6 MET H H -0.225 5.174 5.486 1.00 . A A . 6 MET H 1 1 20 10059 1 1 6 MET HA H 2.174 4.549 6.972 1.00 . A A . 6 MET HA 1 1 20 10060 1 1 6 MET HB2 H 0.747 6.495 7.518 1.00 . A A . 6 MET HB2 1 1 20 10061 1 1 6 MET HB3 H -0.565 5.393 7.907 1.00 . A A . 6 MET HB3 1 1 20 10062 1 1 6 MET HE1 H 0.978 7.204 12.610 1.00 . A A . 6 MET HE1 1 1 20 10063 1 1 6 MET HE2 H 2.304 6.432 11.739 1.00 . A A . 6 MET HE2 1 1 20 10064 1 1 6 MET HE3 H 0.899 5.483 12.232 1.00 . A A . 6 MET HE3 1 1 20 10065 1 1 6 MET HG2 H 0.635 4.508 9.749 1.00 . A A . 6 MET HG2 1 1 20 10066 1 1 6 MET HG3 H 2.073 5.413 9.280 1.00 . A A . 6 MET HG3 1 1 20 10067 1 1 6 MET N N 0.626 4.710 5.621 1.00 . A A . 6 MET N 1 1 20 10068 1 1 6 MET O O 1.198 2.518 8.410 1.00 . A A . 6 MET O 1 1 20 10069 1 1 6 MET SD S 0.429 6.817 10.328 1.00 . A A . 6 MET SD 1 1 20 10070 1 1 7 TRP C C 0.096 0.089 6.104 1.00 . A A . 7 TRP C 1 1 20 10071 1 1 7 TRP CA C -0.671 1.125 6.920 1.00 . A A . 7 TRP CA 1 1 20 10072 1 1 7 TRP CB C -2.169 1.059 6.560 1.00 . A A . 7 TRP CB 1 1 20 10073 1 1 7 TRP CD1 C -2.708 2.943 8.255 1.00 . A A . 7 TRP CD1 1 1 20 10074 1 1 7 TRP CD2 C -4.490 2.077 7.227 1.00 . A A . 7 TRP CD2 1 1 20 10075 1 1 7 TRP CE2 C -4.923 3.083 8.106 1.00 . A A . 7 TRP CE2 1 1 20 10076 1 1 7 TRP CE3 C -5.435 1.395 6.472 1.00 . A A . 7 TRP CE3 1 1 20 10077 1 1 7 TRP CG C -3.068 1.999 7.332 1.00 . A A . 7 TRP CG 1 1 20 10078 1 1 7 TRP CH2 C -7.165 2.730 7.490 1.00 . A A . 7 TRP CH2 1 1 20 10079 1 1 7 TRP CZ2 C -6.261 3.418 8.246 1.00 . A A . 7 TRP CZ2 1 1 20 10080 1 1 7 TRP CZ3 C -6.763 1.727 6.612 1.00 . A A . 7 TRP CZ3 1 1 20 10081 1 1 7 TRP H H -0.396 2.908 5.818 1.00 . A A . 7 TRP H 1 1 20 10082 1 1 7 TRP HA H -0.550 0.920 7.973 1.00 . A A . 7 TRP HA 1 1 20 10083 1 1 7 TRP HB2 H -2.279 1.306 5.514 1.00 . A A . 7 TRP HB2 1 1 20 10084 1 1 7 TRP HB3 H -2.525 0.051 6.714 1.00 . A A . 7 TRP HB3 1 1 20 10085 1 1 7 TRP HD1 H -1.690 3.132 8.562 1.00 . A A . 7 TRP HD1 1 1 20 10086 1 1 7 TRP HE1 H -3.817 4.312 9.392 1.00 . A A . 7 TRP HE1 1 1 20 10087 1 1 7 TRP HE3 H -5.142 0.608 5.795 1.00 . A A . 7 TRP HE3 1 1 20 10088 1 1 7 TRP HH2 H -8.217 2.958 7.568 1.00 . A A . 7 TRP HH2 1 1 20 10089 1 1 7 TRP HZ2 H -6.591 4.190 8.924 1.00 . A A . 7 TRP HZ2 1 1 20 10090 1 1 7 TRP HZ3 H -7.506 1.203 6.027 1.00 . A A . 7 TRP HZ3 1 1 20 10091 1 1 7 TRP N N -0.142 2.448 6.644 1.00 . A A . 7 TRP N 1 1 20 10092 1 1 7 TRP NE1 N -3.819 3.594 8.721 1.00 . A A . 7 TRP NE1 1 1 20 10093 1 1 7 TRP O O 1.063 0.423 5.402 1.00 . A A . 7 TRP O 1 1 20 10094 1 1 8 THR C C -0.723 -2.949 4.644 1.00 . A A . 8 THR C 1 1 20 10095 1 1 8 THR CA C 0.343 -2.207 5.449 1.00 . A A . 8 THR CA 1 1 20 10096 1 1 8 THR CB C 1.057 -3.188 6.417 1.00 . A A . 8 THR CB 1 1 20 10097 1 1 8 THR CG2 C 2.117 -2.466 7.255 1.00 . A A . 8 THR CG2 1 1 20 10098 1 1 8 THR H H -1.059 -1.402 6.767 1.00 . A A . 8 THR H 1 1 20 10099 1 1 8 THR HA H 1.063 -1.744 4.791 1.00 . A A . 8 THR HA 1 1 20 10100 1 1 8 THR HB H 1.533 -3.965 5.839 1.00 . A A . 8 THR HB 1 1 20 10101 1 1 8 THR HG1 H 0.460 -4.624 7.604 1.00 . A A . 8 THR HG1 1 1 20 10102 1 1 8 THR HG21 H 2.610 -3.171 7.908 1.00 . A A . 8 THR HG21 1 1 20 10103 1 1 8 THR HG22 H 1.640 -1.700 7.848 1.00 . A A . 8 THR HG22 1 1 20 10104 1 1 8 THR HG23 H 2.847 -1.994 6.613 1.00 . A A . 8 THR HG23 1 1 20 10105 1 1 8 THR N N -0.304 -1.149 6.192 1.00 . A A . 8 THR N 1 1 20 10106 1 1 8 THR O O -1.920 -2.772 4.922 1.00 . A A . 8 THR O 1 1 20 10107 1 1 8 THR OG1 O 0.096 -3.782 7.304 1.00 . A A . 8 THR OG1 1 1 20 10108 1 1 9 CYS C C -0.969 -5.916 2.717 1.00 . A A . 9 CYS C 1 1 20 10109 1 1 9 CYS CA C -1.384 -4.487 2.955 1.00 . A A . 9 CYS CA 1 1 20 10110 1 1 9 CYS CB C -1.784 -3.798 1.655 1.00 . A A . 9 CYS CB 1 1 20 10111 1 1 9 CYS H H 0.578 -3.901 3.348 1.00 . A A . 9 CYS H 1 1 20 10112 1 1 9 CYS HA H -2.242 -4.506 3.611 1.00 . A A . 9 CYS HA 1 1 20 10113 1 1 9 CYS HB2 H -2.599 -4.343 1.203 1.00 . A A . 9 CYS HB2 1 1 20 10114 1 1 9 CYS HB3 H -2.116 -2.795 1.881 1.00 . A A . 9 CYS HB3 1 1 20 10115 1 1 9 CYS N N -0.351 -3.757 3.651 1.00 . A A . 9 CYS N 1 1 20 10116 1 1 9 CYS O O 0.215 -6.246 2.814 1.00 . A A . 9 CYS O 1 1 20 10117 1 1 9 CYS SG S -0.471 -3.677 0.419 1.00 . A A . 9 CYS SG 1 1 20 10118 1 1 10 ASP C C -2.833 -8.638 1.222 1.00 . A A . 10 ASP C 1 1 20 10119 1 1 10 ASP CA C -1.745 -8.181 2.183 1.00 . A A . 10 ASP CA 1 1 20 10120 1 1 10 ASP CB C -1.771 -9.019 3.493 1.00 . A A . 10 ASP CB 1 1 20 10121 1 1 10 ASP CG C -0.588 -8.767 4.412 1.00 . A A . 10 ASP CG 1 1 20 10122 1 1 10 ASP H H -2.861 -6.415 2.339 1.00 . A A . 10 ASP H 1 1 20 10123 1 1 10 ASP HA H -0.788 -8.287 1.694 1.00 . A A . 10 ASP HA 1 1 20 10124 1 1 10 ASP HB2 H -2.669 -8.790 4.045 1.00 . A A . 10 ASP HB2 1 1 20 10125 1 1 10 ASP HB3 H -1.776 -10.068 3.236 1.00 . A A . 10 ASP HB3 1 1 20 10126 1 1 10 ASP N N -1.943 -6.760 2.433 1.00 . A A . 10 ASP N 1 1 20 10127 1 1 10 ASP O O -3.230 -7.872 0.352 1.00 . A A . 10 ASP O 1 1 20 10128 1 1 10 ASP OD1 O 0.544 -9.241 4.103 1.00 . A A . 10 ASP OD1 1 1 20 10129 1 1 10 ASP OD2 O -0.762 -8.115 5.478 1.00 . A A . 10 ASP OD2 1 1 20 10130 1 1 11 SER C C -5.707 -9.761 0.664 1.00 . A A . 11 SER C 1 1 20 10131 1 1 11 SER CA C -4.307 -10.386 0.449 1.00 . A A . 11 SER CA 1 1 20 10132 1 1 11 SER CB C -4.354 -11.919 0.599 1.00 . A A . 11 SER CB 1 1 20 10133 1 1 11 SER H H -3.048 -10.398 2.135 1.00 . A A . 11 SER H 1 1 20 10134 1 1 11 SER HA H -3.975 -10.152 -0.552 1.00 . A A . 11 SER HA 1 1 20 10135 1 1 11 SER HB2 H -3.349 -12.311 0.570 1.00 . A A . 11 SER HB2 1 1 20 10136 1 1 11 SER HB3 H -4.795 -12.154 1.556 1.00 . A A . 11 SER HB3 1 1 20 10137 1 1 11 SER HG H -5.716 -13.174 0.022 1.00 . A A . 11 SER HG 1 1 20 10138 1 1 11 SER N N -3.331 -9.847 1.376 1.00 . A A . 11 SER N 1 1 20 10139 1 1 11 SER O O -6.363 -9.343 -0.299 1.00 . A A . 11 SER O 1 1 20 10140 1 1 11 SER OG O -5.124 -12.553 -0.427 1.00 . A A . 11 SER OG 1 1 20 10141 1 1 12 GLU C C -7.511 -7.635 2.242 1.00 . A A . 12 GLU C 1 1 20 10142 1 1 12 GLU CA C -7.470 -9.159 2.236 1.00 . A A . 12 GLU CA 1 1 20 10143 1 1 12 GLU CB C -7.921 -9.706 3.585 1.00 . A A . 12 GLU CB 1 1 20 10144 1 1 12 GLU CD C -9.127 -11.728 2.721 1.00 . A A . 12 GLU CD 1 1 20 10145 1 1 12 GLU CG C -8.047 -11.218 3.630 1.00 . A A . 12 GLU CG 1 1 20 10146 1 1 12 GLU H H -5.542 -9.942 2.644 1.00 . A A . 12 GLU H 1 1 20 10147 1 1 12 GLU HA H -8.147 -9.519 1.477 1.00 . A A . 12 GLU HA 1 1 20 10148 1 1 12 GLU HB2 H -7.215 -9.401 4.343 1.00 . A A . 12 GLU HB2 1 1 20 10149 1 1 12 GLU HB3 H -8.887 -9.282 3.817 1.00 . A A . 12 GLU HB3 1 1 20 10150 1 1 12 GLU HG2 H -7.107 -11.651 3.316 1.00 . A A . 12 GLU HG2 1 1 20 10151 1 1 12 GLU HG3 H -8.261 -11.531 4.640 1.00 . A A . 12 GLU HG3 1 1 20 10152 1 1 12 GLU N N -6.133 -9.661 1.912 1.00 . A A . 12 GLU N 1 1 20 10153 1 1 12 GLU O O -8.467 -7.015 1.765 1.00 . A A . 12 GLU O 1 1 20 10154 1 1 12 GLU OE1 O -8.818 -12.180 1.600 1.00 . A A . 12 GLU OE1 1 1 20 10155 1 1 12 GLU OE2 O -10.322 -11.679 3.107 1.00 . A A . 12 GLU OE2 1 1 20 10156 1 1 13 ARG C C -5.569 -5.194 1.636 1.00 . A A . 13 ARG C 1 1 20 10157 1 1 13 ARG CA C -6.399 -5.605 2.801 1.00 . A A . 13 ARG CA 1 1 20 10158 1 1 13 ARG CB C -5.773 -5.105 4.087 1.00 . A A . 13 ARG CB 1 1 20 10159 1 1 13 ARG CD C -7.875 -4.574 5.433 1.00 . A A . 13 ARG CD 1 1 20 10160 1 1 13 ARG CG C -6.579 -5.384 5.346 1.00 . A A . 13 ARG CG 1 1 20 10161 1 1 13 ARG CZ C -10.218 -4.629 4.558 1.00 . A A . 13 ARG CZ 1 1 20 10162 1 1 13 ARG H H -5.804 -7.568 3.231 1.00 . A A . 13 ARG H 1 1 20 10163 1 1 13 ARG HA H -7.386 -5.181 2.695 1.00 . A A . 13 ARG HA 1 1 20 10164 1 1 13 ARG HB2 H -4.805 -5.568 4.199 1.00 . A A . 13 ARG HB2 1 1 20 10165 1 1 13 ARG HB3 H -5.634 -4.037 4.006 1.00 . A A . 13 ARG HB3 1 1 20 10166 1 1 13 ARG HD2 H -8.247 -4.646 6.442 1.00 . A A . 13 ARG HD2 1 1 20 10167 1 1 13 ARG HD3 H -7.635 -3.542 5.222 1.00 . A A . 13 ARG HD3 1 1 20 10168 1 1 13 ARG HE H -8.648 -5.649 3.799 1.00 . A A . 13 ARG HE 1 1 20 10169 1 1 13 ARG HG2 H -6.858 -6.424 5.297 1.00 . A A . 13 ARG HG2 1 1 20 10170 1 1 13 ARG HG3 H -5.966 -5.194 6.213 1.00 . A A . 13 ARG HG3 1 1 20 10171 1 1 13 ARG HH11 H -9.994 -3.430 6.212 1.00 . A A . 13 ARG HH11 1 1 20 10172 1 1 13 ARG HH12 H -11.589 -3.517 5.596 1.00 . A A . 13 ARG HH12 1 1 20 10173 1 1 13 ARG HH21 H -10.856 -5.712 2.929 1.00 . A A . 13 ARG HH21 1 1 20 10174 1 1 13 ARG HH22 H -12.062 -4.812 3.732 1.00 . A A . 13 ARG HH22 1 1 20 10175 1 1 13 ARG N N -6.507 -7.035 2.802 1.00 . A A . 13 ARG N 1 1 20 10176 1 1 13 ARG NE N -8.932 -5.020 4.497 1.00 . A A . 13 ARG NE 1 1 20 10177 1 1 13 ARG NH1 N -10.625 -3.793 5.519 1.00 . A A . 13 ARG NH1 1 1 20 10178 1 1 13 ARG NH2 N -11.096 -5.080 3.670 1.00 . A A . 13 ARG NH2 1 1 20 10179 1 1 13 ARG O O -4.377 -5.478 1.586 1.00 . A A . 13 ARG O 1 1 20 10180 1 1 14 LYS C C -5.190 -2.661 -0.373 1.00 . A A . 14 LYS C 1 1 20 10181 1 1 14 LYS CA C -5.505 -4.129 -0.488 1.00 . A A . 14 LYS CA 1 1 20 10182 1 1 14 LYS CB C -6.340 -4.395 -1.741 1.00 . A A . 14 LYS CB 1 1 20 10183 1 1 14 LYS CD C -7.573 -6.054 -3.198 1.00 . A A . 14 LYS CD 1 1 20 10184 1 1 14 LYS CE C -6.702 -5.846 -4.436 1.00 . A A . 14 LYS CE 1 1 20 10185 1 1 14 LYS CG C -6.798 -5.840 -1.900 1.00 . A A . 14 LYS CG 1 1 20 10186 1 1 14 LYS H H -7.137 -4.355 0.844 1.00 . A A . 14 LYS H 1 1 20 10187 1 1 14 LYS HA H -4.577 -4.678 -0.554 1.00 . A A . 14 LYS HA 1 1 20 10188 1 1 14 LYS HB2 H -7.215 -3.767 -1.720 1.00 . A A . 14 LYS HB2 1 1 20 10189 1 1 14 LYS HB3 H -5.743 -4.132 -2.602 1.00 . A A . 14 LYS HB3 1 1 20 10190 1 1 14 LYS HD2 H -7.949 -7.066 -3.215 1.00 . A A . 14 LYS HD2 1 1 20 10191 1 1 14 LYS HD3 H -8.402 -5.365 -3.227 1.00 . A A . 14 LYS HD3 1 1 20 10192 1 1 14 LYS HE2 H -7.313 -5.994 -5.313 1.00 . A A . 14 LYS HE2 1 1 20 10193 1 1 14 LYS HE3 H -6.322 -4.836 -4.440 1.00 . A A . 14 LYS HE3 1 1 20 10194 1 1 14 LYS HG2 H -5.938 -6.493 -1.894 1.00 . A A . 14 LYS HG2 1 1 20 10195 1 1 14 LYS HG3 H -7.436 -6.093 -1.067 1.00 . A A . 14 LYS HG3 1 1 20 10196 1 1 14 LYS HZ1 H -5.901 -7.781 -4.451 1.00 . A A . 14 LYS HZ1 1 1 20 10197 1 1 14 LYS HZ2 H -4.904 -6.643 -3.697 1.00 . A A . 14 LYS HZ2 1 1 20 10198 1 1 14 LYS HZ3 H -5.022 -6.681 -5.361 1.00 . A A . 14 LYS HZ3 1 1 20 10199 1 1 14 LYS N N -6.187 -4.558 0.705 1.00 . A A . 14 LYS N 1 1 20 10200 1 1 14 LYS NZ N -5.567 -6.797 -4.483 1.00 . A A . 14 LYS NZ 1 1 20 10201 1 1 14 LYS O O -6.013 -1.873 0.134 1.00 . A A . 14 LYS O 1 1 20 10202 1 1 15 CYS C C -4.116 -0.127 -1.885 1.00 . A A . 15 CYS C 1 1 20 10203 1 1 15 CYS CA C -3.578 -0.936 -0.722 1.00 . A A . 15 CYS CA 1 1 20 10204 1 1 15 CYS CB C -2.057 -0.905 -0.689 1.00 . A A . 15 CYS CB 1 1 20 10205 1 1 15 CYS H H -3.457 -2.950 -1.268 1.00 . A A . 15 CYS H 1 1 20 10206 1 1 15 CYS HA H -3.963 -0.514 0.193 1.00 . A A . 15 CYS HA 1 1 20 10207 1 1 15 CYS HB2 H -1.703 -1.702 -0.054 1.00 . A A . 15 CYS HB2 1 1 20 10208 1 1 15 CYS HB3 H -1.685 -1.066 -1.690 1.00 . A A . 15 CYS HB3 1 1 20 10209 1 1 15 CYS N N -4.033 -2.292 -0.825 1.00 . A A . 15 CYS N 1 1 20 10210 1 1 15 CYS O O -4.564 -0.692 -2.895 1.00 . A A . 15 CYS O 1 1 20 10211 1 1 15 CYS SG S -1.343 0.633 -0.073 1.00 . A A . 15 CYS SG 1 1 20 10212 1 1 16 CYS C C -3.682 2.175 -3.950 1.00 . A A . 16 CYS C 1 1 20 10213 1 1 16 CYS CA C -4.636 2.029 -2.760 1.00 . A A . 16 CYS CA 1 1 20 10214 1 1 16 CYS CB C -4.979 3.390 -2.160 1.00 . A A . 16 CYS CB 1 1 20 10215 1 1 16 CYS H H -3.703 1.566 -0.945 1.00 . A A . 16 CYS H 1 1 20 10216 1 1 16 CYS HA H -5.548 1.568 -3.100 1.00 . A A . 16 CYS HA 1 1 20 10217 1 1 16 CYS HB2 H -4.076 3.844 -1.780 1.00 . A A . 16 CYS HB2 1 1 20 10218 1 1 16 CYS HB3 H -5.389 4.016 -2.940 1.00 . A A . 16 CYS HB3 1 1 20 10219 1 1 16 CYS N N -4.093 1.163 -1.752 1.00 . A A . 16 CYS N 1 1 20 10220 1 1 16 CYS O O -2.442 2.128 -3.797 1.00 . A A . 16 CYS O 1 1 20 10221 1 1 16 CYS SG S -6.199 3.339 -0.780 1.00 . A A . 16 CYS SG 1 1 20 10222 1 1 17 LYS C C -2.771 3.844 -6.305 1.00 . A A . 17 LYS C 1 1 20 10223 1 1 17 LYS CA C -3.474 2.500 -6.344 1.00 . A A . 17 LYS CA 1 1 20 10224 1 1 17 LYS CB C -4.331 2.318 -7.610 1.00 . A A . 17 LYS CB 1 1 20 10225 1 1 17 LYS CD C -4.383 -0.251 -7.392 1.00 . A A . 17 LYS CD 1 1 20 10226 1 1 17 LYS CE C -5.835 -0.389 -6.942 1.00 . A A . 17 LYS CE 1 1 20 10227 1 1 17 LYS CG C -4.144 0.958 -8.311 1.00 . A A . 17 LYS CG 1 1 20 10228 1 1 17 LYS H H -5.231 2.287 -5.193 1.00 . A A . 17 LYS H 1 1 20 10229 1 1 17 LYS HA H -2.703 1.744 -6.330 1.00 . A A . 17 LYS HA 1 1 20 10230 1 1 17 LYS HB2 H -5.372 2.420 -7.342 1.00 . A A . 17 LYS HB2 1 1 20 10231 1 1 17 LYS HB3 H -4.075 3.097 -8.312 1.00 . A A . 17 LYS HB3 1 1 20 10232 1 1 17 LYS HD2 H -4.106 -1.149 -7.925 1.00 . A A . 17 LYS HD2 1 1 20 10233 1 1 17 LYS HD3 H -3.753 -0.152 -6.519 1.00 . A A . 17 LYS HD3 1 1 20 10234 1 1 17 LYS HE2 H -5.903 -1.210 -6.245 1.00 . A A . 17 LYS HE2 1 1 20 10235 1 1 17 LYS HE3 H -6.127 0.526 -6.449 1.00 . A A . 17 LYS HE3 1 1 20 10236 1 1 17 LYS HG2 H -4.838 0.894 -9.135 1.00 . A A . 17 LYS HG2 1 1 20 10237 1 1 17 LYS HG3 H -3.136 0.909 -8.699 1.00 . A A . 17 LYS HG3 1 1 20 10238 1 1 17 LYS HZ1 H -6.454 -1.492 -8.597 1.00 . A A . 17 LYS HZ1 1 1 20 10239 1 1 17 LYS HZ2 H -6.835 0.155 -8.718 1.00 . A A . 17 LYS HZ2 1 1 20 10240 1 1 17 LYS HZ3 H -7.708 -0.856 -7.693 1.00 . A A . 17 LYS HZ3 1 1 20 10241 1 1 17 LYS N N -4.253 2.304 -5.137 1.00 . A A . 17 LYS N 1 1 20 10242 1 1 17 LYS NZ N -6.760 -0.651 -8.066 1.00 . A A . 17 LYS NZ 1 1 20 10243 1 1 17 LYS O O -3.331 4.841 -5.843 1.00 . A A . 17 LYS O 1 1 20 10244 1 1 18 GLY C C 0.429 4.662 -5.700 1.00 . A A . 18 GLY C 1 1 20 10245 1 1 18 GLY CA C -0.696 5.004 -6.648 1.00 . A A . 18 GLY CA 1 1 20 10246 1 1 18 GLY H H -1.198 3.059 -7.233 1.00 . A A . 18 GLY H 1 1 20 10247 1 1 18 GLY HA2 H -0.300 5.270 -7.618 1.00 . A A . 18 GLY HA2 1 1 20 10248 1 1 18 GLY HA3 H -1.261 5.827 -6.238 1.00 . A A . 18 GLY HA3 1 1 20 10249 1 1 18 GLY N N -1.552 3.850 -6.773 1.00 . A A . 18 GLY N 1 1 20 10250 1 1 18 GLY O O 1.498 5.288 -5.685 1.00 . A A . 18 GLY O 1 1 20 10251 1 1 19 MET C C 1.444 1.698 -4.435 1.00 . A A . 19 MET C 1 1 20 10252 1 1 19 MET CA C 1.128 3.098 -3.982 1.00 . A A . 19 MET CA 1 1 20 10253 1 1 19 MET CB C 0.531 3.029 -2.574 1.00 . A A . 19 MET CB 1 1 20 10254 1 1 19 MET CE C -1.213 5.896 -0.174 1.00 . A A . 19 MET CE 1 1 20 10255 1 1 19 MET CG C 0.100 4.358 -2.015 1.00 . A A . 19 MET CG 1 1 20 10256 1 1 19 MET H H -0.725 3.248 -4.931 1.00 . A A . 19 MET H 1 1 20 10257 1 1 19 MET HA H 2.020 3.706 -3.971 1.00 . A A . 19 MET HA 1 1 20 10258 1 1 19 MET HB2 H -0.334 2.382 -2.599 1.00 . A A . 19 MET HB2 1 1 20 10259 1 1 19 MET HB3 H 1.264 2.600 -1.907 1.00 . A A . 19 MET HB3 1 1 20 10260 1 1 19 MET HE1 H -1.777 5.957 0.745 1.00 . A A . 19 MET HE1 1 1 20 10261 1 1 19 MET HE2 H -1.826 6.226 -0.998 1.00 . A A . 19 MET HE2 1 1 20 10262 1 1 19 MET HE3 H -0.333 6.517 -0.101 1.00 . A A . 19 MET HE3 1 1 20 10263 1 1 19 MET HG2 H 0.993 4.946 -1.861 1.00 . A A . 19 MET HG2 1 1 20 10264 1 1 19 MET HG3 H -0.556 4.848 -2.718 1.00 . A A . 19 MET HG3 1 1 20 10265 1 1 19 MET N N 0.171 3.648 -4.904 1.00 . A A . 19 MET N 1 1 20 10266 1 1 19 MET O O 0.805 1.185 -5.365 1.00 . A A . 19 MET O 1 1 20 10267 1 1 19 MET SD S -0.734 4.204 -0.434 1.00 . A A . 19 MET SD 1 1 20 10268 1 1 20 VAL C C 2.194 -1.075 -2.904 1.00 . A A . 20 VAL C 1 1 20 10269 1 1 20 VAL CA C 2.708 -0.275 -4.070 1.00 . A A . 20 VAL CA 1 1 20 10270 1 1 20 VAL CB C 4.243 -0.489 -4.200 1.00 . A A . 20 VAL CB 1 1 20 10271 1 1 20 VAL CG1 C 4.572 -1.943 -4.510 1.00 . A A . 20 VAL CG1 1 1 20 10272 1 1 20 VAL CG2 C 4.827 0.419 -5.263 1.00 . A A . 20 VAL CG2 1 1 20 10273 1 1 20 VAL H H 2.905 1.562 -3.119 1.00 . A A . 20 VAL H 1 1 20 10274 1 1 20 VAL HA H 2.218 -0.587 -4.980 1.00 . A A . 20 VAL HA 1 1 20 10275 1 1 20 VAL HB H 4.697 -0.240 -3.250 1.00 . A A . 20 VAL HB 1 1 20 10276 1 1 20 VAL HG11 H 4.203 -2.575 -3.715 1.00 . A A . 20 VAL HG11 1 1 20 10277 1 1 20 VAL HG12 H 5.641 -2.061 -4.599 1.00 . A A . 20 VAL HG12 1 1 20 10278 1 1 20 VAL HG13 H 4.102 -2.224 -5.440 1.00 . A A . 20 VAL HG13 1 1 20 10279 1 1 20 VAL HG21 H 5.888 0.235 -5.352 1.00 . A A . 20 VAL HG21 1 1 20 10280 1 1 20 VAL HG22 H 4.665 1.448 -4.980 1.00 . A A . 20 VAL HG22 1 1 20 10281 1 1 20 VAL HG23 H 4.345 0.223 -6.208 1.00 . A A . 20 VAL HG23 1 1 20 10282 1 1 20 VAL N N 2.381 1.086 -3.809 1.00 . A A . 20 VAL N 1 1 20 10283 1 1 20 VAL O O 2.463 -0.729 -1.737 1.00 . A A . 20 VAL O 1 1 20 10284 1 1 21 CYS C C 1.961 -3.945 -1.834 1.00 . A A . 21 CYS C 1 1 20 10285 1 1 21 CYS CA C 0.897 -2.927 -2.174 1.00 . A A . 21 CYS CA 1 1 20 10286 1 1 21 CYS CB C -0.407 -3.598 -2.617 1.00 . A A . 21 CYS CB 1 1 20 10287 1 1 21 CYS H H 1.225 -2.297 -4.135 1.00 . A A . 21 CYS H 1 1 20 10288 1 1 21 CYS HA H 0.716 -2.312 -1.304 1.00 . A A . 21 CYS HA 1 1 20 10289 1 1 21 CYS HB2 H -1.068 -2.849 -3.023 1.00 . A A . 21 CYS HB2 1 1 20 10290 1 1 21 CYS HB3 H -0.186 -4.330 -3.380 1.00 . A A . 21 CYS HB3 1 1 20 10291 1 1 21 CYS N N 1.424 -2.087 -3.197 1.00 . A A . 21 CYS N 1 1 20 10292 1 1 21 CYS O O 2.276 -4.842 -2.634 1.00 . A A . 21 CYS O 1 1 20 10293 1 1 21 CYS SG S -1.304 -4.449 -1.268 1.00 . A A . 21 CYS SG 1 1 20 10294 1 1 22 ARG C C 3.422 -4.848 1.236 1.00 . A A . 22 ARG C 1 1 20 10295 1 1 22 ARG CA C 3.643 -4.546 -0.260 1.00 . A A . 22 ARG CA 1 1 20 10296 1 1 22 ARG CB C 4.924 -3.675 -0.509 1.00 . A A . 22 ARG CB 1 1 20 10297 1 1 22 ARG CD C 6.428 -5.494 -1.416 1.00 . A A . 22 ARG CD 1 1 20 10298 1 1 22 ARG CG C 6.286 -4.371 -0.405 1.00 . A A . 22 ARG CG 1 1 20 10299 1 1 22 ARG CZ C 5.836 -5.696 -3.827 1.00 . A A . 22 ARG CZ 1 1 20 10300 1 1 22 ARG H H 2.203 -3.078 -0.078 1.00 . A A . 22 ARG H 1 1 20 10301 1 1 22 ARG HA H 3.706 -5.458 -0.831 1.00 . A A . 22 ARG HA 1 1 20 10302 1 1 22 ARG HB2 H 4.858 -3.258 -1.503 1.00 . A A . 22 ARG HB2 1 1 20 10303 1 1 22 ARG HB3 H 4.909 -2.856 0.196 1.00 . A A . 22 ARG HB3 1 1 20 10304 1 1 22 ARG HD2 H 7.372 -5.989 -1.254 1.00 . A A . 22 ARG HD2 1 1 20 10305 1 1 22 ARG HD3 H 5.624 -6.196 -1.260 1.00 . A A . 22 ARG HD3 1 1 20 10306 1 1 22 ARG HE H 6.815 -4.144 -2.955 1.00 . A A . 22 ARG HE 1 1 20 10307 1 1 22 ARG HG2 H 7.049 -3.634 -0.613 1.00 . A A . 22 ARG HG2 1 1 20 10308 1 1 22 ARG HG3 H 6.441 -4.754 0.591 1.00 . A A . 22 ARG HG3 1 1 20 10309 1 1 22 ARG HH11 H 5.167 -7.286 -2.702 1.00 . A A . 22 ARG HH11 1 1 20 10310 1 1 22 ARG HH12 H 4.841 -7.401 -4.364 1.00 . A A . 22 ARG HH12 1 1 20 10311 1 1 22 ARG HH21 H 6.309 -4.321 -5.293 1.00 . A A . 22 ARG HH21 1 1 20 10312 1 1 22 ARG HH22 H 5.456 -5.679 -5.834 1.00 . A A . 22 ARG HH22 1 1 20 10313 1 1 22 ARG N N 2.541 -3.768 -0.693 1.00 . A A . 22 ARG N 1 1 20 10314 1 1 22 ARG NE N 6.381 -5.017 -2.804 1.00 . A A . 22 ARG NE 1 1 20 10315 1 1 22 ARG NH1 N 5.238 -6.868 -3.612 1.00 . A A . 22 ARG NH1 1 1 20 10316 1 1 22 ARG NH2 N 5.880 -5.196 -5.061 1.00 . A A . 22 ARG NH2 1 1 20 10317 1 1 22 ARG O O 2.299 -4.600 1.781 1.00 . A A . 22 ARG O 1 1 20 10318 1 1 23 LEU C C 3.983 -4.459 4.127 1.00 . A A . 23 LEU C 1 1 20 10319 1 1 23 LEU CA C 4.505 -5.647 3.335 1.00 . A A . 23 LEU CA 1 1 20 10320 1 1 23 LEU CB C 5.944 -5.925 3.750 1.00 . A A . 23 LEU CB 1 1 20 10321 1 1 23 LEU CD1 C 8.107 -7.092 3.411 1.00 . A A . 23 LEU CD1 1 1 20 10322 1 1 23 LEU CD2 C 5.991 -8.402 3.372 1.00 . A A . 23 LEU CD2 1 1 20 10323 1 1 23 LEU CG C 6.646 -7.070 3.031 1.00 . A A . 23 LEU CG 1 1 20 10324 1 1 23 LEU H H 5.269 -5.593 1.380 1.00 . A A . 23 LEU H 1 1 20 10325 1 1 23 LEU HA H 3.907 -6.524 3.527 1.00 . A A . 23 LEU HA 1 1 20 10326 1 1 23 LEU HB2 H 6.515 -5.028 3.567 1.00 . A A . 23 LEU HB2 1 1 20 10327 1 1 23 LEU HB3 H 5.960 -6.133 4.810 1.00 . A A . 23 LEU HB3 1 1 20 10328 1 1 23 LEU HD11 H 8.203 -7.265 4.473 1.00 . A A . 23 LEU HD11 1 1 20 10329 1 1 23 LEU HD12 H 8.556 -6.142 3.161 1.00 . A A . 23 LEU HD12 1 1 20 10330 1 1 23 LEU HD13 H 8.612 -7.877 2.868 1.00 . A A . 23 LEU HD13 1 1 20 10331 1 1 23 LEU HD21 H 4.949 -8.373 3.097 1.00 . A A . 23 LEU HD21 1 1 20 10332 1 1 23 LEU HD22 H 6.083 -8.585 4.433 1.00 . A A . 23 LEU HD22 1 1 20 10333 1 1 23 LEU HD23 H 6.482 -9.195 2.831 1.00 . A A . 23 LEU HD23 1 1 20 10334 1 1 23 LEU HG H 6.578 -6.920 1.962 1.00 . A A . 23 LEU HG 1 1 20 10335 1 1 23 LEU N N 4.471 -5.360 1.894 1.00 . A A . 23 LEU N 1 1 20 10336 1 1 23 LEU O O 3.448 -4.607 5.215 1.00 . A A . 23 LEU O 1 1 20 10337 1 1 24 TRP C C 3.204 -1.285 2.834 1.00 . A A . 24 TRP C 1 1 20 10338 1 1 24 TRP CA C 3.634 -2.082 4.066 1.00 . A A . 24 TRP CA 1 1 20 10339 1 1 24 TRP CB C 4.684 -1.312 4.891 1.00 . A A . 24 TRP CB 1 1 20 10340 1 1 24 TRP CD1 C 5.827 0.498 3.550 1.00 . A A . 24 TRP CD1 1 1 20 10341 1 1 24 TRP CD2 C 7.037 -1.361 3.714 1.00 . A A . 24 TRP CD2 1 1 20 10342 1 1 24 TRP CE2 C 7.757 -0.428 2.944 1.00 . A A . 24 TRP CE2 1 1 20 10343 1 1 24 TRP CE3 C 7.602 -2.612 3.955 1.00 . A A . 24 TRP CE3 1 1 20 10344 1 1 24 TRP CG C 5.802 -0.736 4.082 1.00 . A A . 24 TRP CG 1 1 20 10345 1 1 24 TRP CH2 C 9.536 -1.945 2.669 1.00 . A A . 24 TRP CH2 1 1 20 10346 1 1 24 TRP CZ2 C 9.008 -0.710 2.416 1.00 . A A . 24 TRP CZ2 1 1 20 10347 1 1 24 TRP CZ3 C 8.846 -2.891 3.431 1.00 . A A . 24 TRP CZ3 1 1 20 10348 1 1 24 TRP H H 4.658 -3.227 2.720 1.00 . A A . 24 TRP H 1 1 20 10349 1 1 24 TRP HA H 2.787 -2.347 4.675 1.00 . A A . 24 TRP HA 1 1 20 10350 1 1 24 TRP HB2 H 4.198 -0.495 5.401 1.00 . A A . 24 TRP HB2 1 1 20 10351 1 1 24 TRP HB3 H 5.110 -1.981 5.624 1.00 . A A . 24 TRP HB3 1 1 20 10352 1 1 24 TRP HD1 H 5.001 1.184 3.678 1.00 . A A . 24 TRP HD1 1 1 20 10353 1 1 24 TRP HE1 H 7.228 1.527 2.380 1.00 . A A . 24 TRP HE1 1 1 20 10354 1 1 24 TRP HE3 H 7.084 -3.350 4.547 1.00 . A A . 24 TRP HE3 1 1 20 10355 1 1 24 TRP HH2 H 10.507 -2.206 2.274 1.00 . A A . 24 TRP HH2 1 1 20 10356 1 1 24 TRP HZ2 H 9.561 0.005 1.824 1.00 . A A . 24 TRP HZ2 1 1 20 10357 1 1 24 TRP HZ3 H 9.301 -3.856 3.605 1.00 . A A . 24 TRP HZ3 1 1 20 10358 1 1 24 TRP N N 4.165 -3.294 3.564 1.00 . A A . 24 TRP N 1 1 20 10359 1 1 24 TRP NE1 N 6.993 0.700 2.858 1.00 . A A . 24 TRP NE1 1 1 20 10360 1 1 24 TRP O O 3.615 -1.640 1.720 1.00 . A A . 24 TRP O 1 1 20 10361 1 1 25 CYS C C 3.117 1.548 1.563 1.00 . A A . 25 CYS C 1 1 20 10362 1 1 25 CYS CA C 2.039 0.552 1.855 1.00 . A A . 25 CYS CA 1 1 20 10363 1 1 25 CYS CB C 0.706 1.232 2.030 1.00 . A A . 25 CYS CB 1 1 20 10364 1 1 25 CYS H H 2.027 -0.030 3.871 1.00 . A A . 25 CYS H 1 1 20 10365 1 1 25 CYS HA H 1.982 -0.115 1.008 1.00 . A A . 25 CYS HA 1 1 20 10366 1 1 25 CYS HB2 H 0.644 1.640 3.028 1.00 . A A . 25 CYS HB2 1 1 20 10367 1 1 25 CYS HB3 H 0.624 2.034 1.311 1.00 . A A . 25 CYS HB3 1 1 20 10368 1 1 25 CYS N N 2.398 -0.273 2.992 1.00 . A A . 25 CYS N 1 1 20 10369 1 1 25 CYS O O 3.579 2.271 2.447 1.00 . A A . 25 CYS O 1 1 20 10370 1 1 25 CYS SG S -0.710 0.134 1.795 1.00 . A A . 25 CYS SG 1 1 20 10371 1 1 26 LYS C C 4.220 3.186 -1.275 1.00 . A A . 26 LYS C 1 1 20 10372 1 1 26 LYS CA C 4.616 2.400 -0.058 1.00 . A A . 26 LYS CA 1 1 20 10373 1 1 26 LYS CB C 5.794 1.486 -0.367 1.00 . A A . 26 LYS CB 1 1 20 10374 1 1 26 LYS CD C 8.139 1.159 -1.062 1.00 . A A . 26 LYS CD 1 1 20 10375 1 1 26 LYS CE C 9.422 1.792 -1.555 1.00 . A A . 26 LYS CE 1 1 20 10376 1 1 26 LYS CG C 7.050 2.178 -0.823 1.00 . A A . 26 LYS CG 1 1 20 10377 1 1 26 LYS H H 3.073 1.033 -0.338 1.00 . A A . 26 LYS H 1 1 20 10378 1 1 26 LYS HA H 4.889 3.057 0.753 1.00 . A A . 26 LYS HA 1 1 20 10379 1 1 26 LYS HB2 H 6.033 0.923 0.523 1.00 . A A . 26 LYS HB2 1 1 20 10380 1 1 26 LYS HB3 H 5.491 0.791 -1.137 1.00 . A A . 26 LYS HB3 1 1 20 10381 1 1 26 LYS HD2 H 8.342 0.649 -0.132 1.00 . A A . 26 LYS HD2 1 1 20 10382 1 1 26 LYS HD3 H 7.793 0.443 -1.790 1.00 . A A . 26 LYS HD3 1 1 20 10383 1 1 26 LYS HE2 H 9.218 2.379 -2.436 1.00 . A A . 26 LYS HE2 1 1 20 10384 1 1 26 LYS HE3 H 9.820 2.429 -0.780 1.00 . A A . 26 LYS HE3 1 1 20 10385 1 1 26 LYS HG2 H 6.838 2.711 -1.739 1.00 . A A . 26 LYS HG2 1 1 20 10386 1 1 26 LYS HG3 H 7.355 2.874 -0.060 1.00 . A A . 26 LYS HG3 1 1 20 10387 1 1 26 LYS HZ1 H 11.328 1.160 -2.175 1.00 . A A . 26 LYS HZ1 1 1 20 10388 1 1 26 LYS HZ2 H 10.078 0.147 -2.648 1.00 . A A . 26 LYS HZ2 1 1 20 10389 1 1 26 LYS HZ3 H 10.585 0.151 -1.055 1.00 . A A . 26 LYS HZ3 1 1 20 10390 1 1 26 LYS N N 3.526 1.581 0.341 1.00 . A A . 26 LYS N 1 1 20 10391 1 1 26 LYS NZ N 10.418 0.761 -1.879 1.00 . A A . 26 LYS NZ 1 1 20 10392 1 1 26 LYS O O 3.839 2.607 -2.267 1.00 . A A . 26 LYS O 1 1 20 10393 1 1 27 LYS C C 4.888 5.108 -3.465 1.00 . A A . 27 LYS C 1 1 20 10394 1 1 27 LYS CA C 3.936 5.340 -2.321 1.00 . A A . 27 LYS CA 1 1 20 10395 1 1 27 LYS CB C 3.926 6.813 -1.940 1.00 . A A . 27 LYS CB 1 1 20 10396 1 1 27 LYS CD C 2.869 8.686 -0.603 1.00 . A A . 27 LYS CD 1 1 20 10397 1 1 27 LYS CE C 2.777 9.618 -1.817 1.00 . A A . 27 LYS CE 1 1 20 10398 1 1 27 LYS CG C 2.806 7.207 -0.984 1.00 . A A . 27 LYS CG 1 1 20 10399 1 1 27 LYS H H 4.608 4.894 -0.360 1.00 . A A . 27 LYS H 1 1 20 10400 1 1 27 LYS HA H 2.946 5.055 -2.643 1.00 . A A . 27 LYS HA 1 1 20 10401 1 1 27 LYS HB2 H 4.880 7.047 -1.499 1.00 . A A . 27 LYS HB2 1 1 20 10402 1 1 27 LYS HB3 H 3.824 7.393 -2.845 1.00 . A A . 27 LYS HB3 1 1 20 10403 1 1 27 LYS HD2 H 2.054 8.911 0.067 1.00 . A A . 27 LYS HD2 1 1 20 10404 1 1 27 LYS HD3 H 3.805 8.869 -0.093 1.00 . A A . 27 LYS HD3 1 1 20 10405 1 1 27 LYS HE2 H 2.806 10.640 -1.466 1.00 . A A . 27 LYS HE2 1 1 20 10406 1 1 27 LYS HE3 H 3.627 9.447 -2.459 1.00 . A A . 27 LYS HE3 1 1 20 10407 1 1 27 LYS HG2 H 1.858 7.016 -1.464 1.00 . A A . 27 LYS HG2 1 1 20 10408 1 1 27 LYS HG3 H 2.882 6.605 -0.091 1.00 . A A . 27 LYS HG3 1 1 20 10409 1 1 27 LYS HZ1 H 1.473 8.483 -3.030 1.00 . A A . 27 LYS HZ1 1 1 20 10410 1 1 27 LYS HZ2 H 1.471 10.127 -3.357 1.00 . A A . 27 LYS HZ2 1 1 20 10411 1 1 27 LYS HZ3 H 0.694 9.560 -1.992 1.00 . A A . 27 LYS HZ3 1 1 20 10412 1 1 27 LYS N N 4.285 4.494 -1.195 1.00 . A A . 27 LYS N 1 1 20 10413 1 1 27 LYS NZ N 1.532 9.425 -2.593 1.00 . A A . 27 LYS NZ 1 1 20 10414 1 1 27 LYS O O 6.093 4.892 -3.261 1.00 . A A . 27 LYS O 1 1 20 10415 1 1 28 LYS C C 5.424 6.182 -6.481 1.00 . A A . 28 LYS C 1 1 20 10416 1 1 28 LYS CA C 5.158 4.872 -5.793 1.00 . A A . 28 LYS CA 1 1 20 10417 1 1 28 LYS CB C 4.449 3.894 -6.731 1.00 . A A . 28 LYS CB 1 1 20 10418 1 1 28 LYS CD C 4.621 2.282 -8.667 1.00 . A A . 28 LYS CD 1 1 20 10419 1 1 28 LYS CE C 3.735 3.005 -9.666 1.00 . A A . 28 LYS CE 1 1 20 10420 1 1 28 LYS CG C 5.371 3.248 -7.757 1.00 . A A . 28 LYS CG 1 1 20 10421 1 1 28 LYS H H 3.417 5.357 -4.747 1.00 . A A . 28 LYS H 1 1 20 10422 1 1 28 LYS HA H 6.095 4.444 -5.471 1.00 . A A . 28 LYS HA 1 1 20 10423 1 1 28 LYS HB2 H 3.988 3.116 -6.142 1.00 . A A . 28 LYS HB2 1 1 20 10424 1 1 28 LYS HB3 H 3.678 4.435 -7.259 1.00 . A A . 28 LYS HB3 1 1 20 10425 1 1 28 LYS HD2 H 5.340 1.690 -9.212 1.00 . A A . 28 LYS HD2 1 1 20 10426 1 1 28 LYS HD3 H 4.010 1.634 -8.055 1.00 . A A . 28 LYS HD3 1 1 20 10427 1 1 28 LYS HE2 H 3.082 2.277 -10.126 1.00 . A A . 28 LYS HE2 1 1 20 10428 1 1 28 LYS HE3 H 3.137 3.740 -9.149 1.00 . A A . 28 LYS HE3 1 1 20 10429 1 1 28 LYS HG2 H 5.819 4.022 -8.364 1.00 . A A . 28 LYS HG2 1 1 20 10430 1 1 28 LYS HG3 H 6.148 2.710 -7.234 1.00 . A A . 28 LYS HG3 1 1 20 10431 1 1 28 LYS HZ1 H 5.354 4.181 -10.370 1.00 . A A . 28 LYS HZ1 1 1 20 10432 1 1 28 LYS HZ2 H 3.926 4.383 -11.208 1.00 . A A . 28 LYS HZ2 1 1 20 10433 1 1 28 LYS HZ3 H 4.842 3.000 -11.454 1.00 . A A . 28 LYS HZ3 1 1 20 10434 1 1 28 LYS N N 4.365 5.127 -4.643 1.00 . A A . 28 LYS N 1 1 20 10435 1 1 28 LYS NZ N 4.517 3.674 -10.731 1.00 . A A . 28 LYS NZ 1 1 20 10436 1 1 28 LYS O O 4.527 6.774 -7.088 1.00 . A A . 28 LYS O 1 1 20 10437 1 1 29 LEU C C 7.541 7.668 -8.334 1.00 . A A . 29 LEU C 1 1 20 10438 1 1 29 LEU CA C 7.000 7.920 -6.945 1.00 . A A . 29 LEU CA 1 1 20 10439 1 1 29 LEU CB C 8.012 8.703 -6.085 1.00 . A A . 29 LEU CB 1 1 20 10440 1 1 29 LEU CD1 C 6.268 10.118 -4.881 1.00 . A A . 29 LEU CD1 1 1 20 10441 1 1 29 LEU CD2 C 7.319 8.178 -3.673 1.00 . A A . 29 LEU CD2 1 1 20 10442 1 1 29 LEU CG C 7.519 9.267 -4.723 1.00 . A A . 29 LEU CG 1 1 20 10443 1 1 29 LEU H H 7.276 6.163 -5.809 1.00 . A A . 29 LEU H 1 1 20 10444 1 1 29 LEU HA H 6.098 8.503 -7.048 1.00 . A A . 29 LEU HA 1 1 20 10445 1 1 29 LEU HB2 H 8.842 8.043 -5.885 1.00 . A A . 29 LEU HB2 1 1 20 10446 1 1 29 LEU HB3 H 8.378 9.530 -6.677 1.00 . A A . 29 LEU HB3 1 1 20 10447 1 1 29 LEU HD11 H 6.472 10.939 -5.552 1.00 . A A . 29 LEU HD11 1 1 20 10448 1 1 29 LEU HD12 H 5.979 10.509 -3.917 1.00 . A A . 29 LEU HD12 1 1 20 10449 1 1 29 LEU HD13 H 5.463 9.516 -5.277 1.00 . A A . 29 LEU HD13 1 1 20 10450 1 1 29 LEU HD21 H 6.967 8.623 -2.755 1.00 . A A . 29 LEU HD21 1 1 20 10451 1 1 29 LEU HD22 H 8.260 7.678 -3.492 1.00 . A A . 29 LEU HD22 1 1 20 10452 1 1 29 LEU HD23 H 6.593 7.462 -4.030 1.00 . A A . 29 LEU HD23 1 1 20 10453 1 1 29 LEU HG H 8.289 9.938 -4.370 1.00 . A A . 29 LEU HG 1 1 20 10454 1 1 29 LEU N N 6.620 6.668 -6.337 1.00 . A A . 29 LEU N 1 1 20 10455 1 1 29 LEU O O 7.528 8.553 -9.199 1.00 . A A . 29 LEU O 1 1 20 10456 1 1 30 TRP C C 7.322 5.241 -10.423 1.00 . A A . 30 TRP C 1 1 20 10457 1 1 30 TRP CA C 8.453 6.052 -9.840 1.00 . A A . 30 TRP CA 1 1 20 10458 1 1 30 TRP CB C 9.732 5.203 -9.732 1.00 . A A . 30 TRP CB 1 1 20 10459 1 1 30 TRP CD1 C 11.498 5.657 -11.531 1.00 . A A . 30 TRP CD1 1 1 20 10460 1 1 30 TRP CD2 C 10.153 3.940 -12.038 1.00 . A A . 30 TRP CD2 1 1 20 10461 1 1 30 TRP CE2 C 11.082 4.107 -13.080 1.00 . A A . 30 TRP CE2 1 1 20 10462 1 1 30 TRP CE3 C 9.208 2.917 -12.144 1.00 . A A . 30 TRP CE3 1 1 20 10463 1 1 30 TRP CG C 10.439 4.955 -11.046 1.00 . A A . 30 TRP CG 1 1 20 10464 1 1 30 TRP CH2 C 10.159 2.298 -14.280 1.00 . A A . 30 TRP CH2 1 1 20 10465 1 1 30 TRP CZ2 C 11.096 3.291 -14.206 1.00 . A A . 30 TRP CZ2 1 1 20 10466 1 1 30 TRP CZ3 C 9.220 2.109 -13.262 1.00 . A A . 30 TRP CZ3 1 1 20 10467 1 1 30 TRP H H 8.044 5.819 -7.810 1.00 . A A . 30 TRP H 1 1 20 10468 1 1 30 TRP HA H 8.629 6.928 -10.448 1.00 . A A . 30 TRP HA 1 1 20 10469 1 1 30 TRP HB2 H 10.429 5.701 -9.075 1.00 . A A . 30 TRP HB2 1 1 20 10470 1 1 30 TRP HB3 H 9.474 4.247 -9.306 1.00 . A A . 30 TRP HB3 1 1 20 10471 1 1 30 TRP HD1 H 11.957 6.490 -11.015 1.00 . A A . 30 TRP HD1 1 1 20 10472 1 1 30 TRP HE1 H 12.630 5.496 -13.293 1.00 . A A . 30 TRP HE1 1 1 20 10473 1 1 30 TRP HE3 H 8.472 2.763 -11.370 1.00 . A A . 30 TRP HE3 1 1 20 10474 1 1 30 TRP HH2 H 10.132 1.642 -15.137 1.00 . A A . 30 TRP HH2 1 1 20 10475 1 1 30 TRP HZ2 H 11.816 3.424 -15.001 1.00 . A A . 30 TRP HZ2 1 1 20 10476 1 1 30 TRP HZ3 H 8.494 1.313 -13.357 1.00 . A A . 30 TRP HZ3 1 1 20 10477 1 1 30 TRP N N 8.006 6.467 -8.547 1.00 . A A . 30 TRP N 1 1 20 10478 1 1 30 TRP NE1 N 11.890 5.151 -12.744 1.00 . A A . 30 TRP NE1 1 1 20 10479 1 1 30 TRP O O 7.202 4.060 -10.098 1.00 . A A . 30 TRP O 1 1 20 10480 1 1 30 TRP OXT O 6.478 5.805 -11.142 1.00 . A A . 30 TRP OXT 1 1 stop_ save_
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