NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
588547 | 2mvj | 25270 | cing | 4-filtered-FRED | STAR | entry | full | 385 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mvj # This FRED archive file contains, for PDB entry <2mvj>: # # - 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_2mvj _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mvj _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2980.70 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 $Stage_V_sporulation_protein_M A . 1 1 stop_ save_ save_Stage_V_sporulation_protein_M _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Stage V sporulation protein M" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code MKFYTIKLAKFLGGIVRAMLGSFRKD _Entity.Number_of_monomers 26 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 MET . 1 1 2 LYS . 1 1 3 PHE . 1 1 4 TYR . 1 1 5 THR . 1 1 6 ILE . 1 1 7 LYS . 1 1 8 LEU . 1 1 9 ALA . 1 1 10 LYS . 1 1 11 PHE . 1 1 12 LEU . 1 1 13 GLY . 1 1 14 GLY . 1 1 15 ILE . 1 1 16 VAL . 1 1 17 ARG . 1 1 18 ALA . 1 1 19 MET . 1 1 20 LEU . 1 1 21 GLY . 1 1 22 SER . 1 1 23 PHE . 1 1 24 ARG . 1 1 25 LYS . 1 1 26 ASP . 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 MET 1 1 1 1 LYS 2 2 1 1 PHE 3 3 1 1 TYR 4 4 1 1 THR 5 5 1 1 ILE 6 6 1 1 LYS 7 7 1 1 LEU 8 8 1 1 ALA 9 9 1 1 LYS 10 10 1 1 PHE 11 11 1 1 LEU 12 12 1 1 GLY 13 13 1 1 GLY 14 14 1 1 ILE 15 15 1 1 VAL 16 16 1 1 ARG 17 17 1 1 ALA 18 18 1 1 MET 19 19 1 1 LEU 20 20 1 1 GLY 21 21 1 1 SER 22 22 1 1 PHE 23 23 1 1 ARG 24 24 1 1 LYS 25 25 1 1 ASP 26 26 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 1 352 1 . . . 1 1 353 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 MET HA . 1 . HA 1 1 1 1 2 1 1 1 MET ME . 1 . HE# 1 1 2 1 1 1 1 1 MET ME . 1 . HE# 1 1 2 1 2 1 1 5 THR HA . 5 . HA 1 1 3 1 1 1 1 1 MET ME . 1 . HE# 1 1 3 1 2 1 1 5 THR HB . 5 . HB 1 1 4 1 1 1 1 1 MET ME . 1 . HE# 1 1 4 1 2 1 1 5 THR MG . 5 . HG2# 1 1 5 1 1 1 1 1 MET QG . 1 . HG# 1 1 5 1 2 1 1 5 THR MG . 5 . HG2# 1 1 6 1 1 1 1 2 LYS QB . 2 . HB# 1 1 6 1 2 1 1 4 TYR QE . 4 . HE# 1 1 7 1 1 1 1 2 LYS QB . 2 . HB# 1 1 7 1 2 1 1 5 THR MG . 5 . HG2# 1 1 8 1 1 1 1 3 PHE H . 3 . HN 1 1 8 1 2 1 1 3 PHE QB . 3 . HB# 1 1 9 1 1 1 1 3 PHE H . 3 . HN 1 1 9 1 2 1 1 3 PHE QD . 3 . HD# 1 1 10 1 1 1 1 3 PHE H . 3 . HN 1 1 10 1 2 1 1 4 TYR H . 4 . HN 1 1 11 1 1 1 1 3 PHE H . 3 . HN 1 1 11 1 2 1 1 4 TYR QD . 4 . HD# 1 1 12 1 1 1 1 3 PHE HA . 3 . HA 1 1 12 1 2 1 1 3 PHE QD . 3 . HD# 1 1 13 1 1 1 1 3 PHE HA . 3 . HA 1 1 13 1 2 1 1 6 ILE H . 6 . HN 1 1 14 1 1 1 1 3 PHE HA . 3 . HA 1 1 14 1 2 1 1 6 ILE HB . 6 . HB 1 1 15 1 1 1 1 3 PHE HA . 3 . HA 1 1 15 1 2 1 1 6 ILE MD . 6 . HD1# 1 1 16 1 1 1 1 3 PHE HA . 3 . HA 1 1 16 1 2 1 1 6 ILE QG . 6 . HG1# 1 1 17 1 1 1 1 3 PHE QB . 3 . HB# 1 1 17 1 2 1 1 4 TYR H . 4 . HN 1 1 18 1 1 1 1 3 PHE QB . 3 . HB# 1 1 18 1 2 1 1 6 ILE HB . 6 . HB 1 1 19 1 1 1 1 3 PHE QB . 3 . HB# 1 1 19 1 2 1 1 6 ILE MD . 6 . HD1# 1 1 20 1 1 1 1 3 PHE QB . 3 . HB# 1 1 20 1 2 1 1 6 ILE MG . 6 . HG2# 1 1 21 1 1 1 1 4 TYR H . 4 . HN 1 1 21 1 2 1 1 4 TYR QB . 4 . HB# 1 1 22 1 1 1 1 4 TYR H . 4 . HN 1 1 22 1 2 1 1 4 TYR QD . 4 . HD# 1 1 23 1 1 1 1 4 TYR H . 4 . HN 1 1 23 1 2 1 1 5 THR H . 5 . HN 1 1 24 1 1 1 1 4 TYR HA . 4 . HA 1 1 24 1 2 1 1 4 TYR QD . 4 . HD# 1 1 25 1 1 1 1 4 TYR HA . 4 . HA 1 1 25 1 2 1 1 4 TYR QE . 4 . HE# 1 1 26 1 1 1 1 4 TYR HA . 4 . HA 1 1 26 1 2 1 1 5 THR MG . 5 . HG2# 1 1 27 1 1 1 1 4 TYR HA . 4 . HA 1 1 27 1 2 1 1 6 ILE H . 6 . HN 1 1 28 1 1 1 1 4 TYR HA . 4 . HA 1 1 28 1 2 1 1 7 LYS H . 7 . HN 1 1 29 1 1 1 1 4 TYR HA . 4 . HA 1 1 29 1 2 1 1 8 LEU H . 8 . HN 1 1 30 1 1 1 1 4 TYR QB . 4 . HB# 1 1 30 1 2 1 1 5 THR H . 5 . HN 1 1 31 1 1 1 1 4 TYR QB . 4 . HB# 1 1 31 1 2 1 1 5 THR HB . 5 . HB 1 1 32 1 1 1 1 4 TYR QD . 4 . HD# 1 1 32 1 2 1 1 5 THR H . 5 . HN 1 1 33 1 1 1 1 4 TYR QD . 4 . HD# 1 1 33 1 2 1 1 5 THR MG . 5 . HG2# 1 1 34 1 1 1 1 4 TYR QD . 4 . HD# 1 1 34 1 2 1 1 8 LEU MD1 . 8 . HD1# 1 1 35 1 1 1 1 4 TYR QD . 4 . HD# 1 1 35 1 2 1 1 8 LEU QD . 8 . HD# 1 1 36 1 1 1 1 4 TYR QD . 4 . HD# 1 1 36 1 2 1 1 8 LEU MD2 . 8 . HD2# 1 1 37 1 1 1 1 4 TYR QE . 4 . HE# 1 1 37 1 2 1 1 5 THR MG . 5 . HG2# 1 1 38 1 1 1 1 4 TYR QE . 4 . HE# 1 1 38 1 2 1 1 8 LEU MD1 . 8 . HD1# 1 1 39 1 1 1 1 4 TYR QE . 4 . HE# 1 1 39 1 2 1 1 8 LEU QD . 8 . HD# 1 1 40 1 1 1 1 4 TYR QE . 4 . HE# 1 1 40 1 2 1 1 8 LEU MD2 . 8 . HD2# 1 1 41 1 1 1 1 5 THR H . 5 . HN 1 1 41 1 2 1 1 5 THR HB . 5 . HB 1 1 42 1 1 1 1 5 THR H . 5 . HN 1 1 42 1 2 1 1 5 THR MG . 5 . HG2# 1 1 43 1 1 1 1 5 THR H . 5 . HN 1 1 43 1 2 1 1 6 ILE H . 6 . HN 1 1 44 1 1 1 1 5 THR H . 5 . HN 1 1 44 1 2 1 1 6 ILE MG . 6 . HG2# 1 1 45 1 1 1 1 5 THR H . 5 . HN 1 1 45 1 2 1 1 8 LEU HB2 . 8 . HB2 1 1 46 1 1 1 1 5 THR HA . 5 . HA 1 1 46 1 2 1 1 5 THR MG . 5 . HG2# 1 1 47 1 1 1 1 5 THR HA . 5 . HA 1 1 47 1 2 1 1 6 ILE MD . 6 . HD1# 1 1 48 1 1 1 1 5 THR HA . 5 . HA 1 1 48 1 2 1 1 8 LEU QD . 8 . HD# 1 1 49 1 1 1 1 5 THR HA . 5 . HA 1 1 49 1 2 1 1 8 LEU HG . 8 . HG 1 1 50 1 1 1 1 5 THR HB . 5 . HB 1 1 50 1 2 1 1 6 ILE H . 6 . HN 1 1 51 1 1 1 1 5 THR HB . 5 . HB 1 1 51 1 2 1 1 6 ILE HA . 6 . HA 1 1 52 1 1 1 1 5 THR HB . 5 . HB 1 1 52 1 2 1 1 6 ILE MD . 6 . HD1# 1 1 53 1 1 1 1 5 THR HB . 5 . HB 1 1 53 1 2 1 1 6 ILE QG . 6 . HG1# 1 1 54 1 1 1 1 5 THR HB . 5 . HB 1 1 54 1 2 1 1 7 LYS H . 7 . HN 1 1 55 1 1 1 1 5 THR MG . 5 . HG2# 1 1 55 1 2 1 1 8 LEU H . 8 . HN 1 1 56 1 1 1 1 5 THR MG . 5 . HG2# 1 1 56 1 2 1 1 8 LEU HB3 . 8 . HB1 1 1 57 1 1 1 1 5 THR MG . 5 . HG2# 1 1 57 1 2 1 1 9 ALA MB . 9 . HB# 1 1 58 1 1 1 1 6 ILE H . 6 . HN 1 1 58 1 2 1 1 6 ILE HB . 6 . HB 1 1 59 1 1 1 1 6 ILE H . 6 . HN 1 1 59 1 2 1 1 6 ILE MD . 6 . HD1# 1 1 60 1 1 1 1 6 ILE H . 6 . HN 1 1 60 1 2 1 1 6 ILE QG . 6 . HG1# 1 1 61 1 1 1 1 6 ILE H . 6 . HN 1 1 61 1 2 1 1 6 ILE MG . 6 . HG2# 1 1 62 1 1 1 1 6 ILE H . 6 . HN 1 1 62 1 2 1 1 7 LYS H . 7 . HN 1 1 63 1 1 1 1 6 ILE H . 6 . HN 1 1 63 1 2 1 1 8 LEU H . 8 . HN 1 1 64 1 1 1 1 6 ILE HA . 6 . HA 1 1 64 1 2 1 1 6 ILE HB . 6 . HB 1 1 65 1 1 1 1 6 ILE HA . 6 . HA 1 1 65 1 2 1 1 6 ILE MD . 6 . HD1# 1 1 66 1 1 1 1 6 ILE HA . 6 . HA 1 1 66 1 2 1 1 6 ILE QG . 6 . HG1# 1 1 67 1 1 1 1 6 ILE HA . 6 . HA 1 1 67 1 2 1 1 6 ILE MG . 6 . HG2# 1 1 68 1 1 1 1 6 ILE HA . 6 . HA 1 1 68 1 2 1 1 9 ALA MB . 9 . HB# 1 1 69 1 1 1 1 6 ILE HB . 6 . HB 1 1 69 1 2 1 1 6 ILE MD . 6 . HD1# 1 1 70 1 1 1 1 6 ILE MD . 6 . HD1# 1 1 70 1 2 1 1 10 LYS QE . 10 . HE# 1 1 71 1 1 1 1 6 ILE MG . 6 . HG2# 1 1 71 1 2 1 1 7 LYS H . 7 . HN 1 1 72 1 1 1 1 6 ILE MG . 6 . HG2# 1 1 72 1 2 1 1 7 LYS HA . 7 . HA 1 1 73 1 1 1 1 6 ILE MG . 6 . HG2# 1 1 73 1 2 1 1 7 LYS HB2 . 7 . HB2 1 1 74 1 1 1 1 6 ILE MG . 6 . HG2# 1 1 74 1 2 1 1 9 ALA H . 9 . HN 1 1 75 1 1 1 1 6 ILE MG . 6 . HG2# 1 1 75 1 2 1 1 10 LYS HB3 . 10 . HB1 1 1 76 1 1 1 1 7 LYS H . 7 . HN 1 1 76 1 2 1 1 7 LYS HB3 . 7 . HB1 1 1 77 1 1 1 1 7 LYS H . 7 . HN 1 1 77 1 2 1 1 7 LYS HG2 . 7 . HG2 1 1 78 1 1 1 1 7 LYS H . 7 . HN 1 1 78 1 2 1 1 9 ALA H . 9 . HN 1 1 79 1 1 1 1 7 LYS HA . 7 . HA 1 1 79 1 2 1 1 9 ALA H . 9 . HN 1 1 80 1 1 1 1 7 LYS QE . 7 . HE# 1 1 80 1 2 1 1 8 LEU MD1 . 8 . HD1# 1 1 81 1 1 1 1 7 LYS QE . 7 . HE# 1 1 81 1 2 1 1 8 LEU QD . 8 . HD# 1 1 82 1 1 1 1 7 LYS HG3 . 7 . HG1 1 1 82 1 2 1 1 8 LEU H . 8 . HN 1 1 83 1 1 1 1 8 LEU H . 8 . HN 1 1 83 1 2 1 1 8 LEU HB2 . 8 . HB2 1 1 84 1 1 1 1 8 LEU H . 8 . HN 1 1 84 1 2 1 1 8 LEU HB3 . 8 . HB1 1 1 85 1 1 1 1 8 LEU H . 8 . HN 1 1 85 1 2 1 1 8 LEU MD1 . 8 . HD1# 1 1 86 1 1 1 1 8 LEU H . 8 . HN 1 1 86 1 2 1 1 8 LEU QD . 8 . HD# 1 1 87 1 1 1 1 8 LEU H . 8 . HN 1 1 87 1 2 1 1 8 LEU MD2 . 8 . HD2# 1 1 88 1 1 1 1 8 LEU H . 8 . HN 1 1 88 1 2 1 1 9 ALA HA . 9 . HA 1 1 89 1 1 1 1 8 LEU H . 8 . HN 1 1 89 1 2 1 1 9 ALA MB . 9 . HB# 1 1 90 1 1 1 1 8 LEU H . 8 . HN 1 1 90 1 2 1 1 11 PHE HB2 . 11 . HB2 1 1 91 1 1 1 1 8 LEU H . 8 . HN 1 1 91 1 2 1 1 11 PHE HB3 . 11 . HB1 1 1 92 1 1 1 1 8 LEU HA . 8 . HA 1 1 92 1 2 1 1 8 LEU MD1 . 8 . HD1# 1 1 93 1 1 1 1 8 LEU HA . 8 . HA 1 1 93 1 2 1 1 8 LEU QD . 8 . HD# 1 1 94 1 1 1 1 8 LEU HA . 8 . HA 1 1 94 1 2 1 1 8 LEU MD2 . 8 . HD2# 1 1 95 1 1 1 1 8 LEU HA . 8 . HA 1 1 95 1 2 1 1 11 PHE H . 11 . HN 1 1 96 1 1 1 1 8 LEU HA . 8 . HA 1 1 96 1 2 1 1 11 PHE HB2 . 11 . HB2 1 1 97 1 1 1 1 8 LEU HA . 8 . HA 1 1 97 1 2 1 1 11 PHE HB3 . 11 . HB1 1 1 98 1 1 1 1 8 LEU HA . 8 . HA 1 1 98 1 2 1 1 11 PHE QD . 11 . HD# 1 1 99 1 1 1 1 8 LEU HA . 8 . HA 1 1 99 1 2 1 1 12 LEU H . 12 . HN 1 1 100 1 1 1 1 8 LEU HB2 . 8 . HB2 1 1 100 1 2 1 1 9 ALA H . 9 . HN 1 1 101 1 1 1 1 8 LEU HB2 . 8 . HB2 1 1 101 1 2 1 1 11 PHE QD . 11 . HD# 1 1 102 1 1 1 1 8 LEU HB3 . 8 . HB1 1 1 102 1 2 1 1 9 ALA H . 9 . HN 1 1 103 1 1 1 1 8 LEU HB3 . 8 . HB1 1 1 103 1 2 1 1 11 PHE QD . 11 . HD# 1 1 104 1 1 1 1 8 LEU QD . 8 . HD# 1 1 104 1 2 1 1 9 ALA HA . 9 . HA 1 1 105 1 1 1 1 8 LEU QD . 8 . HD# 1 1 105 1 2 1 1 11 PHE H . 11 . HN 1 1 106 1 1 1 1 8 LEU QD . 8 . HD# 1 1 106 1 2 1 1 11 PHE HA . 11 . HA 1 1 107 1 1 1 1 8 LEU QD . 8 . HD# 1 1 107 1 2 1 1 11 PHE HB3 . 11 . HB1 1 1 108 1 1 1 1 8 LEU QD . 8 . HD# 1 1 108 1 2 1 1 11 PHE QD . 11 . HD# 1 1 109 1 1 1 1 8 LEU MD1 . 8 . HD1# 1 1 109 1 2 1 1 11 PHE QD . 11 . HD# 1 1 110 1 1 1 1 8 LEU MD2 . 8 . HD2# 1 1 110 1 2 1 1 11 PHE QD . 11 . HD# 1 1 111 1 1 1 1 8 LEU HG . 8 . HG 1 1 111 1 2 1 1 9 ALA HA . 9 . HA 1 1 112 1 1 1 1 9 ALA H . 9 . HN 1 1 112 1 2 1 1 9 ALA MB . 9 . HB# 1 1 113 1 1 1 1 9 ALA H . 9 . HN 1 1 113 1 2 1 1 10 LYS H . 10 . HN 1 1 114 1 1 1 1 9 ALA H . 9 . HN 1 1 114 1 2 1 1 12 LEU H . 12 . HN 1 1 115 1 1 1 1 9 ALA H . 9 . HN 1 1 115 1 2 1 1 12 LEU MD1 . 12 . HD1# 1 1 116 1 1 1 1 9 ALA H . 9 . HN 1 1 116 1 2 1 1 12 LEU QD . 12 . HD# 1 1 117 1 1 1 1 9 ALA H . 9 . HN 1 1 117 1 2 1 1 12 LEU MD2 . 12 . HD2# 1 1 118 1 1 1 1 9 ALA HA . 9 . HA 1 1 118 1 2 1 1 11 PHE H . 11 . HN 1 1 119 1 1 1 1 9 ALA HA . 9 . HA 1 1 119 1 2 1 1 12 LEU H . 12 . HN 1 1 120 1 1 1 1 9 ALA HA . 9 . HA 1 1 120 1 2 1 1 12 LEU QD . 12 . HD# 1 1 121 1 1 1 1 9 ALA MB . 9 . HB# 1 1 121 1 2 1 1 10 LYS QE . 10 . HE# 1 1 122 1 1 1 1 9 ALA MB . 9 . HB# 1 1 122 1 2 1 1 11 PHE H . 11 . HN 1 1 123 1 1 1 1 10 LYS H . 10 . HN 1 1 123 1 2 1 1 10 LYS HB3 . 10 . HB1 1 1 124 1 1 1 1 10 LYS H . 10 . HN 1 1 124 1 2 1 1 11 PHE HB2 . 11 . HB2 1 1 125 1 1 1 1 10 LYS H . 10 . HN 1 1 125 1 2 1 1 11 PHE HB3 . 11 . HB1 1 1 126 1 1 1 1 10 LYS HA . 10 . HA 1 1 126 1 2 1 1 11 PHE HA . 11 . HA 1 1 127 1 1 1 1 10 LYS HA . 10 . HA 1 1 127 1 2 1 1 12 LEU H . 12 . HN 1 1 128 1 1 1 1 10 LYS HA . 10 . HA 1 1 128 1 2 1 1 13 GLY H . 13 . HN 1 1 129 1 1 1 1 10 LYS HA . 10 . HA 1 1 129 1 2 1 1 14 GLY H . 14 . HN 1 1 130 1 1 1 1 10 LYS HB2 . 10 . HB2 1 1 130 1 2 1 1 11 PHE HA . 11 . HA 1 1 131 1 1 1 1 10 LYS HB3 . 10 . HB1 1 1 131 1 2 1 1 11 PHE H . 11 . HN 1 1 132 1 1 1 1 10 LYS HB3 . 10 . HB1 1 1 132 1 2 1 1 11 PHE HA . 11 . HA 1 1 133 1 1 1 1 10 LYS QG . 10 . HG# 1 1 133 1 2 1 1 11 PHE H . 11 . HN 1 1 134 1 1 1 1 10 LYS HG3 . 10 . HG1 1 1 134 1 2 1 1 11 PHE H . 11 . HN 1 1 135 1 1 1 1 11 PHE H . 11 . HN 1 1 135 1 2 1 1 11 PHE HB2 . 11 . HB2 1 1 136 1 1 1 1 11 PHE H . 11 . HN 1 1 136 1 2 1 1 11 PHE HB3 . 11 . HB1 1 1 137 1 1 1 1 11 PHE H . 11 . HN 1 1 137 1 2 1 1 11 PHE QD . 11 . HD# 1 1 138 1 1 1 1 11 PHE H . 11 . HN 1 1 138 1 2 1 1 12 LEU H . 12 . HN 1 1 139 1 1 1 1 11 PHE H . 11 . HN 1 1 139 1 2 1 1 12 LEU HA . 12 . HA 1 1 140 1 1 1 1 11 PHE H . 11 . HN 1 1 140 1 2 1 1 12 LEU QB . 12 . HB# 1 1 141 1 1 1 1 11 PHE H . 11 . HN 1 1 141 1 2 1 1 12 LEU QD . 12 . HD# 1 1 142 1 1 1 1 11 PHE HA . 11 . HA 1 1 142 1 2 1 1 11 PHE QD . 11 . HD# 1 1 143 1 1 1 1 11 PHE HA . 11 . HA 1 1 143 1 2 1 1 12 LEU H . 12 . HN 1 1 144 1 1 1 1 11 PHE HA . 11 . HA 1 1 144 1 2 1 1 13 GLY H . 13 . HN 1 1 145 1 1 1 1 11 PHE HA . 11 . HA 1 1 145 1 2 1 1 14 GLY H . 14 . HN 1 1 146 1 1 1 1 11 PHE HB2 . 11 . HB2 1 1 146 1 2 1 1 12 LEU H . 12 . HN 1 1 147 1 1 1 1 11 PHE HB2 . 11 . HB2 1 1 147 1 2 1 1 12 LEU HG . 12 . HG 1 1 148 1 1 1 1 11 PHE HB2 . 11 . HB2 1 1 148 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 149 1 1 1 1 11 PHE HB3 . 11 . HB1 1 1 149 1 2 1 1 12 LEU H . 12 . HN 1 1 150 1 1 1 1 11 PHE HB3 . 11 . HB1 1 1 150 1 2 1 1 12 LEU QD . 12 . HD# 1 1 151 1 1 1 1 11 PHE QD . 11 . HD# 1 1 151 1 2 1 1 12 LEU H . 12 . HN 1 1 152 1 1 1 1 11 PHE QD . 11 . HD# 1 1 152 1 2 1 1 12 LEU HA . 12 . HA 1 1 153 1 1 1 1 11 PHE QD . 11 . HD# 1 1 153 1 2 1 1 12 LEU HB3 . 12 . HB1 1 1 154 1 1 1 1 11 PHE QD . 11 . HD# 1 1 154 1 2 1 1 12 LEU MD1 . 12 . HD1# 1 1 155 1 1 1 1 11 PHE QD . 11 . HD# 1 1 155 1 2 1 1 12 LEU QD . 12 . HD# 1 1 156 1 1 1 1 11 PHE QD . 11 . HD# 1 1 156 1 2 1 1 12 LEU MD2 . 12 . HD2# 1 1 157 1 1 1 1 11 PHE QD . 11 . HD# 1 1 157 1 2 1 1 12 LEU HG . 12 . HG 1 1 158 1 1 1 1 11 PHE QD . 11 . HD# 1 1 158 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 159 1 1 1 1 11 PHE QD . 11 . HD# 1 1 159 1 2 1 1 15 ILE QG . 15 . HG1# 1 1 160 1 1 1 1 11 PHE QD . 11 . HD# 1 1 160 1 2 1 1 15 ILE MG . 15 . HG2# 1 1 161 1 1 1 1 12 LEU H . 12 . HN 1 1 161 1 2 1 1 12 LEU HB2 . 12 . HB2 1 1 162 1 1 1 1 12 LEU H . 12 . HN 1 1 162 1 2 1 1 12 LEU QB . 12 . HB# 1 1 163 1 1 1 1 12 LEU H . 12 . HN 1 1 163 1 2 1 1 12 LEU HB3 . 12 . HB1 1 1 164 1 1 1 1 12 LEU H . 12 . HN 1 1 164 1 2 1 1 12 LEU QD . 12 . HD# 1 1 165 1 1 1 1 12 LEU H . 12 . HN 1 1 165 1 2 1 1 12 LEU HG . 12 . HG 1 1 166 1 1 1 1 12 LEU H . 12 . HN 1 1 166 1 2 1 1 13 GLY HA2 . 13 . HA1 1 1 167 1 1 1 1 12 LEU H . 12 . HN 1 1 167 1 2 1 1 15 ILE H . 15 . HN 1 1 168 1 1 1 1 12 LEU H . 12 . HN 1 1 168 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 169 1 1 1 1 12 LEU HA . 12 . HA 1 1 169 1 2 1 1 12 LEU QD . 12 . HD# 1 1 170 1 1 1 1 12 LEU HA . 12 . HA 1 1 170 1 2 1 1 12 LEU HG . 12 . HG 1 1 171 1 1 1 1 12 LEU HA . 12 . HA 1 1 171 1 2 1 1 15 ILE HB . 15 . HB 1 1 172 1 1 1 1 12 LEU HA . 12 . HA 1 1 172 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 173 1 1 1 1 12 LEU HA . 12 . HA 1 1 173 1 2 1 1 15 ILE MG . 15 . HG2# 1 1 174 1 1 1 1 12 LEU HA . 12 . HA 1 1 174 1 2 1 1 16 VAL H . 16 . HN 1 1 175 1 1 1 1 12 LEU HA . 12 . HA 1 1 175 1 2 1 1 16 VAL HA . 16 . HA 1 1 176 1 1 1 1 12 LEU QB . 12 . HB# 1 1 176 1 2 1 1 12 LEU QD . 12 . HD# 1 1 177 1 1 1 1 12 LEU QB . 12 . HB# 1 1 177 1 2 1 1 13 GLY H . 13 . HN 1 1 178 1 1 1 1 12 LEU QB . 12 . HB# 1 1 178 1 2 1 1 13 GLY HA2 . 13 . HA1 1 1 179 1 1 1 1 12 LEU QB . 12 . HB# 1 1 179 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 180 1 1 1 1 12 LEU HB2 . 12 . HB2 1 1 180 1 2 1 1 12 LEU MD1 . 12 . HD1# 1 1 181 1 1 1 1 12 LEU HB2 . 12 . HB2 1 1 181 1 2 1 1 12 LEU MD2 . 12 . HD2# 1 1 182 1 1 1 1 12 LEU HB2 . 12 . HB2 1 1 182 1 2 1 1 13 GLY H . 13 . HN 1 1 183 1 1 1 1 12 LEU HB3 . 12 . HB1 1 1 183 1 2 1 1 12 LEU MD1 . 12 . HD1# 1 1 184 1 1 1 1 12 LEU HB3 . 12 . HB1 1 1 184 1 2 1 1 12 LEU MD2 . 12 . HD2# 1 1 185 1 1 1 1 12 LEU HB3 . 12 . HB1 1 1 185 1 2 1 1 13 GLY H . 13 . HN 1 1 186 1 1 1 1 12 LEU HB3 . 12 . HB1 1 1 186 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 187 1 1 1 1 12 LEU QD . 12 . HD# 1 1 187 1 2 1 1 15 ILE H . 15 . HN 1 1 188 1 1 1 1 12 LEU QD . 12 . HD# 1 1 188 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 189 1 1 1 1 12 LEU HG . 12 . HG 1 1 189 1 2 1 1 13 GLY H . 13 . HN 1 1 190 1 1 1 1 13 GLY H . 13 . HN 1 1 190 1 2 1 1 14 GLY H . 14 . HN 1 1 191 1 1 1 1 13 GLY H . 13 . HN 1 1 191 1 2 1 1 15 ILE H . 15 . HN 1 1 192 1 1 1 1 13 GLY H . 13 . HN 1 1 192 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 193 1 1 1 1 13 GLY HA2 . 13 . HA1 1 1 193 1 2 1 1 15 ILE H . 15 . HN 1 1 194 1 1 1 1 13 GLY HA2 . 13 . HA1 1 1 194 1 2 1 1 16 VAL H . 16 . HN 1 1 195 1 1 1 1 13 GLY HA2 . 13 . HA1 1 1 195 1 2 1 1 16 VAL HB . 16 . HB 1 1 196 1 1 1 1 13 GLY HA2 . 13 . HA1 1 1 196 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 197 1 1 1 1 13 GLY HA2 . 13 . HA1 1 1 197 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 198 1 1 1 1 13 GLY HA2 . 13 . HA1 1 1 198 1 2 1 1 17 ARG H . 17 . HN 1 1 199 1 1 1 1 14 GLY H . 14 . HN 1 1 199 1 2 1 1 15 ILE H . 15 . HN 1 1 200 1 1 1 1 14 GLY H . 14 . HN 1 1 200 1 2 1 1 15 ILE HA . 15 . HA 1 1 201 1 1 1 1 14 GLY H . 14 . HN 1 1 201 1 2 1 1 15 ILE QG . 15 . HG1# 1 1 202 1 1 1 1 14 GLY QA . 14 . HA# 1 1 202 1 2 1 1 17 ARG HB3 . 17 . HB1 1 1 203 1 1 1 1 15 ILE H . 15 . HN 1 1 203 1 2 1 1 15 ILE HB . 15 . HB 1 1 204 1 1 1 1 15 ILE H . 15 . HN 1 1 204 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 205 1 1 1 1 15 ILE H . 15 . HN 1 1 205 1 2 1 1 15 ILE QG . 15 . HG1# 1 1 206 1 1 1 1 15 ILE H . 15 . HN 1 1 206 1 2 1 1 15 ILE MG . 15 . HG2# 1 1 207 1 1 1 1 15 ILE H . 15 . HN 1 1 207 1 2 1 1 16 VAL H . 16 . HN 1 1 208 1 1 1 1 15 ILE H . 15 . HN 1 1 208 1 2 1 1 16 VAL HA . 16 . HA 1 1 209 1 1 1 1 15 ILE H . 15 . HN 1 1 209 1 2 1 1 16 VAL HB . 16 . HB 1 1 210 1 1 1 1 15 ILE H . 15 . HN 1 1 210 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 211 1 1 1 1 15 ILE H . 15 . HN 1 1 211 1 2 1 1 17 ARG H . 17 . HN 1 1 212 1 1 1 1 15 ILE HA . 15 . HA 1 1 212 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 213 1 1 1 1 15 ILE HA . 15 . HA 1 1 213 1 2 1 1 15 ILE QG . 15 . HG1# 1 1 214 1 1 1 1 15 ILE HA . 15 . HA 1 1 214 1 2 1 1 15 ILE MG . 15 . HG2# 1 1 215 1 1 1 1 15 ILE HA . 15 . HA 1 1 215 1 2 1 1 17 ARG H . 17 . HN 1 1 216 1 1 1 1 15 ILE HA . 15 . HA 1 1 216 1 2 1 1 18 ALA H . 18 . HN 1 1 217 1 1 1 1 15 ILE HA . 15 . HA 1 1 217 1 2 1 1 18 ALA HA . 18 . HA 1 1 218 1 1 1 1 15 ILE HA . 15 . HA 1 1 218 1 2 1 1 18 ALA MB . 18 . HB# 1 1 219 1 1 1 1 15 ILE HA . 15 . HA 1 1 219 1 2 1 1 19 MET HG2 . 19 . HG2 1 1 220 1 1 1 1 15 ILE HB . 15 . HB 1 1 220 1 2 1 1 15 ILE MD . 15 . HD1# 1 1 221 1 1 1 1 15 ILE HB . 15 . HB 1 1 221 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 222 1 1 1 1 15 ILE MD . 15 . HD1# 1 1 222 1 2 1 1 15 ILE MG . 15 . HG2# 1 1 223 1 1 1 1 15 ILE MD . 15 . HD1# 1 1 223 1 2 1 1 16 VAL H . 16 . HN 1 1 224 1 1 1 1 15 ILE MD . 15 . HD1# 1 1 224 1 2 1 1 16 VAL HA . 16 . HA 1 1 225 1 1 1 1 15 ILE MD . 15 . HD1# 1 1 225 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 226 1 1 1 1 15 ILE MD . 15 . HD1# 1 1 226 1 2 1 1 18 ALA MB . 18 . HB# 1 1 227 1 1 1 1 15 ILE MD . 15 . HD1# 1 1 227 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 228 1 1 1 1 15 ILE QG . 15 . HG1# 1 1 228 1 2 1 1 15 ILE MG . 15 . HG2# 1 1 229 1 1 1 1 15 ILE QG . 15 . HG1# 1 1 229 1 2 1 1 16 VAL H . 16 . HN 1 1 230 1 1 1 1 15 ILE MG . 15 . HG2# 1 1 230 1 2 1 1 16 VAL H . 16 . HN 1 1 231 1 1 1 1 15 ILE MG . 15 . HG2# 1 1 231 1 2 1 1 16 VAL HA . 16 . HA 1 1 232 1 1 1 1 15 ILE MG . 15 . HG2# 1 1 232 1 2 1 1 19 MET HG2 . 19 . HG2 1 1 233 1 1 1 1 15 ILE MG . 15 . HG2# 1 1 233 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 234 1 1 1 1 16 VAL H . 16 . HN 1 1 234 1 2 1 1 16 VAL HB . 16 . HB 1 1 235 1 1 1 1 16 VAL H . 16 . HN 1 1 235 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 236 1 1 1 1 16 VAL H . 16 . HN 1 1 236 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 237 1 1 1 1 16 VAL H . 16 . HN 1 1 237 1 2 1 1 17 ARG H . 17 . HN 1 1 238 1 1 1 1 16 VAL H . 16 . HN 1 1 238 1 2 1 1 18 ALA H . 18 . HN 1 1 239 1 1 1 1 16 VAL HA . 16 . HA 1 1 239 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 240 1 1 1 1 16 VAL HA . 16 . HA 1 1 240 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 241 1 1 1 1 16 VAL HA . 16 . HA 1 1 241 1 2 1 1 18 ALA H . 18 . HN 1 1 242 1 1 1 1 16 VAL HA . 16 . HA 1 1 242 1 2 1 1 19 MET H . 19 . HN 1 1 243 1 1 1 1 16 VAL HA . 16 . HA 1 1 243 1 2 1 1 19 MET HA . 19 . HA 1 1 244 1 1 1 1 16 VAL HA . 16 . HA 1 1 244 1 2 1 1 19 MET HB3 . 19 . HB2 1 1 245 1 1 1 1 16 VAL HA . 16 . HA 1 1 245 1 2 1 1 19 MET HG2 . 19 . HG2 1 1 246 1 1 1 1 16 VAL HA . 16 . HA 1 1 246 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 247 1 1 1 1 16 VAL HA . 16 . HA 1 1 247 1 2 1 1 20 LEU H . 20 . HN 1 1 248 1 1 1 1 16 VAL HA . 16 . HA 1 1 248 1 2 1 1 20 LEU MD1 . 20 . HD1# 1 1 249 1 1 1 1 16 VAL HA . 16 . HA 1 1 249 1 2 1 1 20 LEU MD2 . 20 . HD2# 1 1 250 1 1 1 1 16 VAL HB . 16 . HB 1 1 250 1 2 1 1 17 ARG H . 17 . HN 1 1 251 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 251 1 2 1 1 17 ARG H . 17 . HN 1 1 252 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 252 1 2 1 1 17 ARG HA . 17 . HA 1 1 253 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 253 1 2 1 1 18 ALA H . 18 . HN 1 1 254 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 254 1 2 1 1 19 MET H . 19 . HN 1 1 255 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 255 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 256 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 256 1 2 1 1 20 LEU H . 20 . HN 1 1 257 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 257 1 2 1 1 17 ARG H . 17 . HN 1 1 258 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 258 1 2 1 1 17 ARG QD . 17 . HD# 1 1 259 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 259 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 260 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 260 1 2 1 1 20 LEU H . 20 . HN 1 1 261 1 1 1 1 17 ARG H . 17 . HN 1 1 261 1 2 1 1 17 ARG HB2 . 17 . HB2 1 1 262 1 1 1 1 17 ARG H . 17 . HN 1 1 262 1 2 1 1 17 ARG HB3 . 17 . HB1 1 1 263 1 1 1 1 17 ARG H . 17 . HN 1 1 263 1 2 1 1 17 ARG QD . 17 . HD# 1 1 264 1 1 1 1 17 ARG H . 17 . HN 1 1 264 1 2 1 1 17 ARG HG2 . 17 . HG2 1 1 265 1 1 1 1 17 ARG H . 17 . HN 1 1 265 1 2 1 1 17 ARG HG3 . 17 . HG1 1 1 266 1 1 1 1 17 ARG H . 17 . HN 1 1 266 1 2 1 1 18 ALA H . 18 . HN 1 1 267 1 1 1 1 17 ARG H . 17 . HN 1 1 267 1 2 1 1 18 ALA HA . 18 . HA 1 1 268 1 1 1 1 17 ARG H . 17 . HN 1 1 268 1 2 1 1 18 ALA MB . 18 . HB# 1 1 269 1 1 1 1 17 ARG HA . 17 . HA 1 1 269 1 2 1 1 17 ARG HG2 . 17 . HG2 1 1 270 1 1 1 1 17 ARG HA . 17 . HA 1 1 270 1 2 1 1 17 ARG QG . 17 . HG# 1 1 271 1 1 1 1 17 ARG HA . 17 . HA 1 1 271 1 2 1 1 17 ARG HG3 . 17 . HG1 1 1 272 1 1 1 1 17 ARG HA . 17 . HA 1 1 272 1 2 1 1 19 MET H . 19 . HN 1 1 273 1 1 1 1 17 ARG HA . 17 . HA 1 1 273 1 2 1 1 20 LEU H . 20 . HN 1 1 274 1 1 1 1 17 ARG HA . 17 . HA 1 1 274 1 2 1 1 20 LEU HB3 . 20 . HB2 1 1 275 1 1 1 1 17 ARG HA . 17 . HA 1 1 275 1 2 1 1 20 LEU HG . 20 . HG 1 1 276 1 1 1 1 17 ARG HB3 . 17 . HB1 1 1 276 1 2 1 1 18 ALA HA . 18 . HA 1 1 277 1 1 1 1 17 ARG HB3 . 17 . HB1 1 1 277 1 2 1 1 20 LEU QD . 20 . HD# 1 1 278 1 1 1 1 17 ARG QD . 17 . HD# 1 1 278 1 2 1 1 17 ARG QG . 17 . HG# 1 1 279 1 1 1 1 17 ARG QD . 17 . HD# 1 1 279 1 2 1 1 18 ALA MB . 18 . HB# 1 1 280 1 1 1 1 17 ARG QD . 17 . HD# 1 1 280 1 2 1 1 20 LEU MD1 . 20 . HD1# 1 1 281 1 1 1 1 17 ARG QD . 17 . HD# 1 1 281 1 2 1 1 20 LEU QD . 20 . HD# 1 1 282 1 1 1 1 17 ARG QG . 17 . HG# 1 1 282 1 2 1 1 18 ALA HA . 18 . HA 1 1 283 1 1 1 1 18 ALA H . 18 . HN 1 1 283 1 2 1 1 18 ALA MB . 18 . HB# 1 1 284 1 1 1 1 18 ALA H . 18 . HN 1 1 284 1 2 1 1 19 MET H . 19 . HN 1 1 285 1 1 1 1 18 ALA H . 18 . HN 1 1 285 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 286 1 1 1 1 18 ALA MB . 18 . HB# 1 1 286 1 2 1 1 19 MET H . 19 . HN 1 1 287 1 1 1 1 18 ALA MB . 18 . HB# 1 1 287 1 2 1 1 19 MET HA . 19 . HA 1 1 288 1 1 1 1 18 ALA MB . 18 . HB# 1 1 288 1 2 1 1 19 MET HG2 . 19 . HG2 1 1 289 1 1 1 1 18 ALA MB . 18 . HB# 1 1 289 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 290 1 1 1 1 18 ALA MB . 18 . HB# 1 1 290 1 2 1 1 21 GLY H . 21 . HN 1 1 291 1 1 1 1 19 MET H . 19 . HN 1 1 291 1 2 1 1 19 MET HB2 . 19 . HB1 1 1 292 1 1 1 1 19 MET H . 19 . HN 1 1 292 1 2 1 1 19 MET HB3 . 19 . HB2 1 1 293 1 1 1 1 19 MET H . 19 . HN 1 1 293 1 2 1 1 19 MET HG2 . 19 . HG2 1 1 294 1 1 1 1 19 MET H . 19 . HN 1 1 294 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 295 1 1 1 1 19 MET H . 19 . HN 1 1 295 1 2 1 1 20 LEU QD . 20 . HD# 1 1 296 1 1 1 1 19 MET H . 19 . HN 1 1 296 1 2 1 1 21 GLY H . 21 . HN 1 1 297 1 1 1 1 19 MET H . 19 . HN 1 1 297 1 2 1 1 22 SER QB . 22 . HB# 1 1 298 1 1 1 1 19 MET HA . 19 . HA 1 1 298 1 2 1 1 19 MET HG2 . 19 . HG2 1 1 299 1 1 1 1 19 MET HA . 19 . HA 1 1 299 1 2 1 1 19 MET HG3 . 19 . HG1 1 1 300 1 1 1 1 19 MET HA . 19 . HA 1 1 300 1 2 1 1 20 LEU H . 20 . HN 1 1 301 1 1 1 1 19 MET HA . 19 . HA 1 1 301 1 2 1 1 22 SER H . 22 . HN 1 1 302 1 1 1 1 19 MET HA . 19 . HA 1 1 302 1 2 1 1 22 SER QB . 22 . HB# 1 1 303 1 1 1 1 19 MET HA . 19 . HA 1 1 303 1 2 1 1 23 PHE H . 23 . HN 1 1 304 1 1 1 1 19 MET HB2 . 19 . HB1 1 1 304 1 2 1 1 20 LEU H . 20 . HN 1 1 305 1 1 1 1 19 MET HB2 . 19 . HB1 1 1 305 1 2 1 1 21 GLY H . 21 . HN 1 1 306 1 1 1 1 19 MET HB3 . 19 . HB2 1 1 306 1 2 1 1 20 LEU H . 20 . HN 1 1 307 1 1 1 1 19 MET HB3 . 19 . HB2 1 1 307 1 2 1 1 20 LEU QD . 20 . HD# 1 1 308 1 1 1 1 19 MET HB3 . 19 . HB2 1 1 308 1 2 1 1 21 GLY H . 21 . HN 1 1 309 1 1 1 1 19 MET HG2 . 19 . HG2 1 1 309 1 2 1 1 20 LEU H . 20 . HN 1 1 310 1 1 1 1 19 MET HG3 . 19 . HG1 1 1 310 1 2 1 1 20 LEU QD . 20 . HD# 1 1 311 1 1 1 1 20 LEU H . 20 . HN 1 1 311 1 2 1 1 21 GLY H . 21 . HN 1 1 312 1 1 1 1 20 LEU H . 20 . HN 1 1 312 1 2 1 1 22 SER H . 22 . HN 1 1 313 1 1 1 1 20 LEU HA . 20 . HA 1 1 313 1 2 1 1 20 LEU QD . 20 . HD# 1 1 314 1 1 1 1 20 LEU HA . 20 . HA 1 1 314 1 2 1 1 22 SER H . 22 . HN 1 1 315 1 1 1 1 20 LEU HA . 20 . HA 1 1 315 1 2 1 1 23 PHE H . 23 . HN 1 1 316 1 1 1 1 20 LEU HA . 20 . HA 1 1 316 1 2 1 1 23 PHE QB . 23 . HB# 1 1 317 1 1 1 1 20 LEU HA . 20 . HA 1 1 317 1 2 1 1 23 PHE QD . 23 . HD# 1 1 318 1 1 1 1 20 LEU HB2 . 20 . HB1 1 1 318 1 2 1 1 21 GLY H . 21 . HN 1 1 319 1 1 1 1 20 LEU HB2 . 20 . HB1 1 1 319 1 2 1 1 22 SER H . 22 . HN 1 1 320 1 1 1 1 20 LEU HB3 . 20 . HB2 1 1 320 1 2 1 1 20 LEU MD2 . 20 . HD2# 1 1 321 1 1 1 1 20 LEU HB3 . 20 . HB2 1 1 321 1 2 1 1 21 GLY H . 21 . HN 1 1 322 1 1 1 1 20 LEU HB3 . 20 . HB2 1 1 322 1 2 1 1 21 GLY QA . 21 . HA# 1 1 323 1 1 1 1 20 LEU HB3 . 20 . HB2 1 1 323 1 2 1 1 22 SER H . 22 . HN 1 1 324 1 1 1 1 20 LEU HB3 . 20 . HB2 1 1 324 1 2 1 1 23 PHE H . 23 . HN 1 1 325 1 1 1 1 20 LEU QD . 20 . HD# 1 1 325 1 2 1 1 21 GLY H . 21 . HN 1 1 326 1 1 1 1 20 LEU QD . 20 . HD# 1 1 326 1 2 1 1 22 SER H . 22 . HN 1 1 327 1 1 1 1 20 LEU QD . 20 . HD# 1 1 327 1 2 1 1 23 PHE H . 23 . HN 1 1 328 1 1 1 1 20 LEU QD . 20 . HD# 1 1 328 1 2 1 1 23 PHE QB . 23 . HB# 1 1 329 1 1 1 1 20 LEU QD . 20 . HD# 1 1 329 1 2 1 1 23 PHE QD . 23 . HD# 1 1 330 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 330 1 2 1 1 21 GLY H . 21 . HN 1 1 331 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 331 1 2 1 1 21 GLY QA . 21 . HA# 1 1 332 1 1 1 1 20 LEU MD2 . 20 . HD2# 1 1 332 1 2 1 1 21 GLY H . 21 . HN 1 1 333 1 1 1 1 20 LEU MD2 . 20 . HD2# 1 1 333 1 2 1 1 21 GLY QA . 21 . HA# 1 1 334 1 1 1 1 21 GLY H . 21 . HN 1 1 334 1 2 1 1 21 GLY QA . 21 . HA# 1 1 335 1 1 1 1 21 GLY H . 21 . HN 1 1 335 1 2 1 1 22 SER H . 22 . HN 1 1 336 1 1 1 1 21 GLY H . 21 . HN 1 1 336 1 2 1 1 22 SER HA . 22 . HA 1 1 337 1 1 1 1 21 GLY QA . 21 . HA# 1 1 337 1 2 1 1 23 PHE H . 23 . HN 1 1 338 1 1 1 1 21 GLY QA . 21 . HA# 1 1 338 1 2 1 1 24 ARG H . 24 . HN 1 1 339 1 1 1 1 22 SER H . 22 . HN 1 1 339 1 2 1 1 22 SER QB . 22 . HB# 1 1 340 1 1 1 1 22 SER HA . 22 . HA 1 1 340 1 2 1 1 23 PHE H . 23 . HN 1 1 341 1 1 1 1 22 SER QB . 22 . HB# 1 1 341 1 2 1 1 23 PHE H . 23 . HN 1 1 342 1 1 1 1 23 PHE H . 23 . HN 1 1 342 1 2 1 1 23 PHE HB2 . 23 . HB2 1 1 343 1 1 1 1 23 PHE H . 23 . HN 1 1 343 1 2 1 1 23 PHE QB . 23 . HB# 1 1 344 1 1 1 1 23 PHE H . 23 . HN 1 1 344 1 2 1 1 23 PHE HB3 . 23 . HB1 1 1 345 1 1 1 1 23 PHE H . 23 . HN 1 1 345 1 2 1 1 24 ARG QG . 24 . HG# 1 1 346 1 1 1 1 23 PHE HA . 23 . HA 1 1 346 1 2 1 1 23 PHE QD . 23 . HD# 1 1 347 1 1 1 1 23 PHE HB3 . 23 . HB1 1 1 347 1 2 1 1 24 ARG H . 24 . HN 1 1 348 1 1 1 1 23 PHE QD . 23 . HD# 1 1 348 1 2 1 1 24 ARG HG2 . 24 . HG2 1 1 349 1 1 1 1 23 PHE QD . 23 . HD# 1 1 349 1 2 1 1 24 ARG HG3 . 24 . HG1 1 1 350 1 1 1 1 24 ARG H . 24 . HN 1 1 350 1 2 1 1 24 ARG QB . 24 . HB# 1 1 351 1 1 1 1 24 ARG H . 24 . HN 1 1 351 1 2 1 1 24 ARG QD . 24 . HD# 1 1 352 1 1 1 1 24 ARG H . 24 . HN 1 1 352 1 2 1 1 24 ARG QG . 24 . HG# 1 1 353 1 1 1 1 24 ARG HA . 24 . HA 1 1 353 1 2 1 1 25 LYS H . 25 . 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 . . . . . 4.87 1.8 4.87 1 1 2 1 . . . . . 5.77 1.8 5.77 1 1 3 1 . . . . . 4.29 1.8 4.29 1 1 4 1 . . . . . 3.82 1.8 3.82 1 1 5 1 . . . . . 5.48 1.8 5.48 1 1 6 1 . . . . . 4.94 1.8 4.94 1 1 7 1 . . . . . 4.85 1.8 4.85 1 1 8 1 . . . . . 3.38 1.8 3.38 1 1 9 1 . . . . . 4.53 1.8 4.53 1 1 10 1 . . . . . 4.23 1.8 4.23 1 1 11 1 . . . . . 5.87 1.8 5.87 1 1 12 1 . . . . . 3.85 1.8 3.85 1 1 13 1 . . . . . 5.27 1.8 5.27 1 1 14 1 . . . . . 4.21 1.8 4.21 1 1 15 1 . . . . . 3.51 1.8 3.51 1 1 16 1 . . . . . 5.9 1.8 5.9 1 1 17 1 . . . . . 3.55 1.8 3.55 1 1 18 1 . . . . . 4.73 1.8 4.73 1 1 19 1 . . . . . 3.89 1.8 3.89 1 1 20 1 . . . . . 5.77 1.8 5.77 1 1 21 1 . . . . . 3.04 1.8 3.04 1 1 22 1 . . . . . 3.43 1.8 3.43 1 1 23 1 . . . . . 3.29 1.8 3.29 1 1 24 1 . . . . . 3.91 1.8 3.91 1 1 25 1 . . . . . 6.0 1.8 6.0 1 1 26 1 . . . . . 6.0 1.8 6.0 1 1 27 1 . . . . . 4.85 1.8 4.85 1 1 28 1 . . . . . 4.98 1.8 4.98 1 1 29 1 . . . . . 4.94 1.8 4.94 1 1 30 1 . . . . . 3.82 1.8 3.82 1 1 31 1 . . . . . 6.0 1.8 6.0 1 1 32 1 . . . . . 4.7 1.8 4.7 1 1 33 1 . . . . . 5.99 1.8 5.99 1 1 34 1 . . . . . 5.84 1.8 5.84 1 1 35 1 . . . . . 4.63 1.8 4.63 1 1 36 1 . . . . . 5.84 1.8 5.84 1 1 37 1 . . . . . 6.0 1.8 6.0 1 1 38 1 . . . . . 6.0 1.8 6.0 1 1 39 1 . . . . . 4.98 1.8 4.98 1 1 40 1 . . . . . 6.0 1.8 6.0 1 1 41 1 . . . . . 3.36 1.8 3.36 1 1 42 1 . . . . . 3.97 1.8 3.97 1 1 43 1 . . . . . 3.44 1.8 3.44 1 1 44 1 . . . . . 6.0 1.8 6.0 1 1 45 1 . . . . . 5.49 1.8 5.49 1 1 46 1 . . . . . 2.98 1.8 2.98 1 1 47 1 . . . . . 4.98 1.8 4.98 1 1 48 1 . . . . . 4.05 1.8 4.05 1 1 49 1 . . . . . 5.99 1.8 5.99 1 1 50 1 . . . . . 3.48 1.8 3.48 1 1 51 1 . . . . . 4.6 1.8 4.6 1 1 52 1 . . . . . 4.68 1.8 4.68 1 1 53 1 . . . . . 4.18 1.8 4.18 1 1 54 1 . . . . . 5.38 1.8 5.38 1 1 55 1 . . . . . 5.43 1.8 5.43 1 1 56 1 . . . . . 6.0 1.8 6.0 1 1 57 1 . . . . . 5.29 1.8 5.29 1 1 58 1 . . . . . 3.18 1.8 3.18 1 1 59 1 . . . . . 4.22 1.8 4.22 1 1 60 1 . . . . . 3.32 1.8 3.32 1 1 61 1 . . . . . 3.92 1.8 3.92 1 1 62 1 . . . . . 3.25 1.8 3.25 1 1 63 1 . . . . . 4.25 1.8 4.25 1 1 64 1 . . . . . 3.02 1.8 3.02 1 1 65 1 . . . . . 3.8 1.8 3.8 1 1 66 1 . . . . . 3.54 1.8 3.54 1 1 67 1 . . . . . 3.04 1.8 3.04 1 1 68 1 . . . . . 2.85 1.8 2.85 1 1 69 1 . . . . . 2.82 1.8 2.82 1 1 70 1 . . . . . 6.0 1.8 6.0 1 1 71 1 . . . . . 4.07 1.8 4.07 1 1 72 1 . . . . . 3.71 1.8 3.71 1 1 73 1 . . . . . 5.64 1.8 5.64 1 1 74 1 . . . . . 5.28 1.8 5.28 1 1 75 1 . . . . . 5.05 1.8 5.05 1 1 76 1 . . . . . 3.92 1.8 3.92 1 1 77 1 . . . . . 4.87 1.8 4.87 1 1 78 1 . . . . . 5.7 1.8 5.7 1 1 79 1 . . . . . 4.67 1.8 4.67 1 1 80 1 . . . . . 5.56 1.8 5.56 1 1 81 1 . . . . . 4.51 1.8 4.51 1 1 82 1 . . . . . 4.21 1.8 4.21 1 1 83 1 . . . . . 2.84 1.8 2.84 1 1 84 1 . . . . . 3.13 1.8 3.13 1 1 85 1 . . . . . 4.48 1.8 4.48 1 1 86 1 . . . . . 3.86 1.8 3.86 1 1 87 1 . . . . . 4.48 1.8 4.48 1 1 88 1 . . . . . 4.84 1.8 4.84 1 1 89 1 . . . . . 4.63 1.8 4.63 1 1 90 1 . . . . . 5.51 1.8 5.51 1 1 91 1 . . . . . 5.47 1.8 5.47 1 1 92 1 . . . . . 3.93 1.8 3.93 1 1 93 1 . . . . . 3.15 1.8 3.15 1 1 94 1 . . . . . 3.93 1.8 3.93 1 1 95 1 . . . . . 3.71 1.8 3.71 1 1 96 1 . . . . . 3.62 1.8 3.62 1 1 97 1 . . . . . 4.15 1.8 4.15 1 1 98 1 . . . . . 4.71 1.8 4.71 1 1 99 1 . . . . . 5.37 1.8 5.37 1 1 100 1 . . . . . 3.49 1.8 3.49 1 1 101 1 . . . . . 6.0 1.8 6.0 1 1 102 1 . . . . . 4.21 1.8 4.21 1 1 103 1 . . . . . 6.0 1.8 6.0 1 1 104 1 . . . . . 4.52 1.8 4.52 1 1 105 1 . . . . . 5.75 1.8 5.75 1 1 106 1 . . . . . 5.59 1.8 5.59 1 1 107 1 . . . . . 4.41 1.8 4.41 1 1 108 1 . . . . . 3.69 1.8 3.69 1 1 109 1 . . . . . 4.34 1.8 4.34 1 1 110 1 . . . . . 4.34 1.8 4.34 1 1 111 1 . . . . . 4.19 1.8 4.19 1 1 112 1 . . . . . 2.9 1.8 2.9 1 1 113 1 . . . . . 3.48 1.8 3.48 1 1 114 1 . . . . . 5.32 1.8 5.32 1 1 115 1 . . . . . 6.0 1.8 6.0 1 1 116 1 . . . . . 5.11 1.8 5.11 1 1 117 1 . . . . . 6.0 1.8 6.0 1 1 118 1 . . . . . 5.7 1.8 5.7 1 1 119 1 . . . . . 3.93 1.8 3.93 1 1 120 1 . . . . . 3.83 1.8 3.83 1 1 121 1 . . . . . 4.72 1.8 4.72 1 1 122 1 . . . . . 4.7 1.8 4.7 1 1 123 1 . . . . . 3.71 1.8 3.71 1 1 124 1 . . . . . 5.37 1.8 5.37 1 1 125 1 . . . . . 4.96 1.8 4.96 1 1 126 1 . . . . . 5.07 1.8 5.07 1 1 127 1 . . . . . 5.07 1.8 5.07 1 1 128 1 . . . . . 4.4 1.8 4.4 1 1 129 1 . . . . . 4.12 1.8 4.12 1 1 130 1 . . . . . 6.0 1.8 6.0 1 1 131 1 . . . . . 3.12 1.8 3.12 1 1 132 1 . . . . . 4.6 1.8 4.6 1 1 133 1 . . . . . 4.81 1.8 4.81 1 1 134 1 . . . . . 5.56 1.8 5.56 1 1 135 1 . . . . . 3.07 1.8 3.07 1 1 136 1 . . . . . 2.97 1.8 2.97 1 1 137 1 . . . . . 4.24 1.8 4.24 1 1 138 1 . . . . . 3.48 1.8 3.48 1 1 139 1 . . . . . 5.71 1.8 5.71 1 1 140 1 . . . . . 5.73 1.8 5.73 1 1 141 1 . . . . . 4.68 1.8 4.68 1 1 142 1 . . . . . 3.59 1.8 3.59 1 1 143 1 . . . . . 3.8 1.8 3.8 1 1 144 1 . . . . . 5.26 1.8 5.26 1 1 145 1 . . . . . 4.62 1.8 4.62 1 1 146 1 . . . . . 3.42 1.8 3.42 1 1 147 1 . . . . . 6.0 1.8 6.0 1 1 148 1 . . . . . 5.25 1.8 5.25 1 1 149 1 . . . . . 3.88 1.8 3.88 1 1 150 1 . . . . . 4.75 1.8 4.75 1 1 151 1 . . . . . 4.56 1.8 4.56 1 1 152 1 . . . . . 6.0 1.8 6.0 1 1 153 1 . . . . . 6.0 1.8 6.0 1 1 154 1 . . . . . 4.41 1.8 4.41 1 1 155 1 . . . . . 3.1 1.8 3.1 1 1 156 1 . . . . . 4.41 1.8 4.41 1 1 157 1 . . . . . 4.53 1.8 4.53 1 1 158 1 . . . . . 4.22 1.8 4.22 1 1 159 1 . . . . . . 1.8 5.38 1 1 160 1 . . . . . 5.42 1.8 5.42 1 1 161 1 . . . . . 3.71 1.8 3.71 1 1 162 1 . . . . . 3.24 1.8 3.24 1 1 163 1 . . . . . 3.71 1.8 3.71 1 1 164 1 . . . . . 3.64 1.8 3.64 1 1 165 1 . . . . . 4.23 1.8 4.23 1 1 166 1 . . . . . 5.7 1.8 5.7 1 1 167 1 . . . . . 5.79 1.8 5.79 1 1 168 1 . . . . . 6.0 1.8 6.0 1 1 169 1 . . . . . 2.62 1.8 2.62 1 1 170 1 . . . . . 4.04 1.8 4.04 1 1 171 1 . . . . . 3.98 1.8 3.98 1 1 172 1 . . . . . 3.11 1.8 3.11 1 1 173 1 . . . . . 4.4 1.8 4.4 1 1 174 1 . . . . . 3.65 1.8 3.65 1 1 175 1 . . . . . 6.0 1.8 6.0 1 1 176 1 . . . . . 1.56 1.8 1.56 1 1 177 1 . . . . . 3.71 1.8 3.71 1 1 178 1 . . . . . 5.81 1.8 5.81 1 1 179 1 . . . . . 5.81 1.8 5.81 1 1 180 1 . . . . . 3.52 1.8 3.52 1 1 181 1 . . . . . 3.52 1.8 3.52 1 1 182 1 . . . . . 4.26 1.8 4.26 1 1 183 1 . . . . . 3.52 1.8 3.52 1 1 184 1 . . . . . 3.52 1.8 3.52 1 1 185 1 . . . . . 4.26 1.8 4.26 1 1 186 1 . . . . . 4.8 1.8 4.8 1 1 187 1 . . . . . 4.75 1.8 4.75 1 1 188 1 . . . . . 2.83 1.8 2.83 1 1 189 1 . . . . . 5.92 1.8 5.92 1 1 190 1 . . . . . 3.46 1.8 3.46 1 1 191 1 . . . . . 4.86 1.8 4.86 1 1 192 1 . . . . . 4.45 1.8 4.45 1 1 193 1 . . . . . 5.53 1.8 5.53 1 1 194 1 . . . . . 4.56 1.8 4.56 1 1 195 1 . . . . . 4.41 1.8 4.41 1 1 196 1 . . . . . 4.33 1.8 4.33 1 1 197 1 . . . . . 5.46 1.8 5.46 1 1 198 1 . . . . . 5.88 1.8 5.88 1 1 199 1 . . . . . 3.21 1.8 3.21 1 1 200 1 . . . . . 4.88 1.8 4.88 1 1 201 1 . . . . . 4.82 1.8 4.82 1 1 202 1 . . . . . 4.07 1.8 4.07 1 1 203 1 . . . . . 3.1 1.8 3.1 1 1 204 1 . . . . . 4.15 1.8 4.15 1 1 205 1 . . . . . 3.38 1.8 3.38 1 1 206 1 . . . . . 3.82 1.8 3.82 1 1 207 1 . . . . . 3.17 1.8 3.17 1 1 208 1 . . . . . 4.99 1.8 4.99 1 1 209 1 . . . . . 5.23 1.8 5.23 1 1 210 1 . . . . . 4.64 1.8 4.64 1 1 211 1 . . . . . 4.97 1.8 4.97 1 1 212 1 . . . . . 3.94 1.8 3.94 1 1 213 1 . . . . . 3.46 1.8 3.46 1 1 214 1 . . . . . 2.77 1.8 2.77 1 1 215 1 . . . . . 4.67 1.8 4.67 1 1 216 1 . . . . . 3.83 1.8 3.83 1 1 217 1 . . . . . 4.56 1.8 4.56 1 1 218 1 . . . . . 3.25 1.8 3.25 1 1 219 1 . . . . . 6.0 1.8 6.0 1 1 220 1 . . . . . 2.86 1.8 2.86 1 1 221 1 . . . . . 5.07 1.8 5.07 1 1 222 1 . . . . . 3.02 1.8 3.02 1 1 223 1 . . . . . 5.1 1.8 5.1 1 1 224 1 . . . . . 5.59 1.8 5.59 1 1 225 1 . . . . . 5.74 1.8 5.74 1 1 226 1 . . . . . 5.66 1.8 5.66 1 1 227 1 . . . . . 6.0 1.8 6.0 1 1 228 1 . . . . . 3.26 1.8 3.26 1 1 229 1 . . . . . 5.58 1.8 5.58 1 1 230 1 . . . . . 3.72 1.8 3.72 1 1 231 1 . . . . . 3.76 1.8 3.76 1 1 232 1 . . . . . 3.71 1.8 3.71 1 1 233 1 . . . . . 3.58 1.8 3.58 1 1 234 1 . . . . . 3.1 1.8 3.1 1 1 235 1 . . . . . 3.04 1.8 3.04 1 1 236 1 . . . . . 3.79 1.8 3.79 1 1 237 1 . . . . . 3.34 1.8 3.34 1 1 238 1 . . . . . 4.12 1.8 4.12 1 1 239 1 . . . . . 3.25 1.8 3.25 1 1 240 1 . . . . . 2.94 1.8 2.94 1 1 241 1 . . . . . 4.6 1.8 4.6 1 1 242 1 . . . . . 3.85 1.8 3.85 1 1 243 1 . . . . . 6.0 1.8 6.0 1 1 244 1 . . . . . 4.89 1.8 4.89 1 1 245 1 . . . . . 5.1 1.8 5.1 1 1 246 1 . . . . . 4.64 1.8 4.64 1 1 247 1 . . . . . 4.75 1.8 4.75 1 1 248 1 . . . . . 5.82 1.8 5.82 1 1 249 1 . . . . . 5.82 1.8 5.82 1 1 250 1 . . . . . 4.06 1.8 4.06 1 1 251 1 . . . . . 3.91 1.8 3.91 1 1 252 1 . . . . . 3.85 1.8 3.85 1 1 253 1 . . . . . 5.92 1.8 5.92 1 1 254 1 . . . . . 6.0 1.8 6.0 1 1 255 1 . . . . . 6.0 1.8 6.0 1 1 256 1 . . . . . 6.0 1.8 6.0 1 1 257 1 . . . . . 3.77 1.8 3.77 1 1 258 1 . . . . . 5.47 1.8 5.47 1 1 259 1 . . . . . 6.0 1.8 6.0 1 1 260 1 . . . . . 4.6 1.8 4.6 1 1 261 1 . . . . . 3.96 1.8 3.96 1 1 262 1 . . . . . 2.81 1.8 2.81 1 1 263 1 . . . . . 4.72 1.8 4.72 1 1 264 1 . . . . . 4.42 1.8 4.42 1 1 265 1 . . . . . 4.42 1.8 4.42 1 1 266 1 . . . . . 3.3 1.8 3.3 1 1 267 1 . . . . . 5.36 1.8 5.36 1 1 268 1 . . . . . 5.17 1.8 5.17 1 1 269 1 . . . . . 4.0 1.8 4.0 1 1 270 1 . . . . . 3.35 1.8 3.35 1 1 271 1 . . . . . 4.0 1.8 4.0 1 1 272 1 . . . . . 4.36 1.8 4.36 1 1 273 1 . . . . . 4.08 1.8 4.08 1 1 274 1 . . . . . 5.3 1.8 5.3 1 1 275 1 . . . . . 6.0 1.8 6.0 1 1 276 1 . . . . . 5.0 1.8 5.0 1 1 277 1 . . . . . 5.6 1.8 5.6 1 1 278 1 . . . . . 2.41 1.8 2.41 1 1 279 1 . . . . . 5.8 1.8 5.8 1 1 280 1 . . . . . 5.84 1.8 5.84 1 1 281 1 . . . . . 4.49 1.8 4.49 1 1 282 1 . . . . . 5.81 1.8 5.81 1 1 283 1 . . . . . 2.61 1.8 2.61 1 1 284 1 . . . . . 3.22 1.8 3.22 1 1 285 1 . . . . . 4.58 1.8 4.58 1 1 286 1 . . . . . 3.48 1.8 3.48 1 1 287 1 . . . . . 4.41 1.8 4.41 1 1 288 1 . . . . . 4.75 1.8 4.75 1 1 289 1 . . . . . 4.45 1.8 4.45 1 1 290 1 . . . . . 5.0 1.8 5.0 1 1 291 1 . . . . . 3.13 1.8 3.13 1 1 292 1 . . . . . 3.71 1.8 3.71 1 1 293 1 . . . . . 3.84 1.8 3.84 1 1 294 1 . . . . . 3.34 1.8 3.34 1 1 295 1 . . . . . 4.9 1.8 4.9 1 1 296 1 . . . . . 4.12 1.8 4.12 1 1 297 1 . . . . . 4.43 1.8 4.43 1 1 298 1 . . . . . 3.86 1.8 3.86 1 1 299 1 . . . . . 3.36 1.8 3.36 1 1 300 1 . . . . . 3.57 1.8 3.57 1 1 301 1 . . . . . 3.83 1.8 3.83 1 1 302 1 . . . . . 4.41 1.8 4.41 1 1 303 1 . . . . . 5.42 1.8 5.42 1 1 304 1 . . . . . 2.87 1.8 2.87 1 1 305 1 . . . . . 4.91 1.8 4.91 1 1 306 1 . . . . . 3.5 1.8 3.5 1 1 307 1 . . . . . 4.96 1.8 4.96 1 1 308 1 . . . . . 5.61 1.8 5.61 1 1 309 1 . . . . . 4.79 1.8 4.79 1 1 310 1 . . . . . 5.83 1.8 5.83 1 1 311 1 . . . . . 3.03 1.8 3.03 1 1 312 1 . . . . . 4.04 1.8 4.04 1 1 313 1 . . . . . 2.51 1.8 2.51 1 1 314 1 . . . . . 4.14 1.8 4.14 1 1 315 1 . . . . . 4.29 1.8 4.29 1 1 316 1 . . . . . 5.24 1.8 5.24 1 1 317 1 . . . . . 5.76 1.8 5.76 1 1 318 1 . . . . . 3.38 1.8 3.38 1 1 319 1 . . . . . 4.99 1.8 4.99 1 1 320 1 . . . . . 2.77 1.8 2.77 1 1 321 1 . . . . . 4.06 1.8 4.06 1 1 322 1 . . . . . 6.0 1.8 6.0 1 1 323 1 . . . . . 5.43 1.8 5.43 1 1 324 1 . . . . . 5.86 1.8 5.86 1 1 325 1 . . . . . 5.23 1.8 5.23 1 1 326 1 . . . . . 5.65 1.8 5.65 1 1 327 1 . . . . . 5.44 1.8 5.44 1 1 328 1 . . . . . 3.74 1.8 3.74 1 1 329 1 . . . . . 5.56 1.8 5.56 1 1 330 1 . . . . . 6.0 1.8 6.0 1 1 331 1 . . . . . 6.0 1.8 6.0 1 1 332 1 . . . . . 6.0 1.8 6.0 1 1 333 1 . . . . . 6.0 1.8 6.0 1 1 334 1 . . . . . 2.6 1.8 2.6 1 1 335 1 . . . . . 3.04 1.8 3.04 1 1 336 1 . . . . . 5.51 1.8 5.51 1 1 337 1 . . . . . 4.31 1.8 4.31 1 1 338 1 . . . . . 6.0 1.8 6.0 1 1 339 1 . . . . . 2.93 1.8 2.93 1 1 340 1 . . . . . 3.56 1.8 3.56 1 1 341 1 . . . . . 3.53 1.8 3.53 1 1 342 1 . . . . . 3.53 1.8 3.53 1 1 343 1 . . . . . 2.86 1.8 2.86 1 1 344 1 . . . . . 3.53 1.8 3.53 1 1 345 1 . . . . . 5.81 1.8 5.81 1 1 346 1 . . . . . 3.79 1.8 3.79 1 1 347 1 . . . . . 4.03 1.8 4.03 1 1 348 1 . . . . . 6.0 1.8 6.0 1 1 349 1 . . . . . 6.0 1.8 6.0 1 1 350 1 . . . . . 3.16 1.8 3.16 1 1 351 1 . . . . . 4.51 1.8 4.51 1 1 352 1 . . . . . 3.57 1.8 3.57 1 1 353 1 . . . . . 3.17 1.8 3.17 1 1 stop_ save_ save_DYANA/DIANA_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 PHI 1 1 3 PHE C 1 1 4 TYR N 1 1 4 TYR CA 1 1 4 TYR C -92.19999 -42.1 . 4 TYR . . 4 TYR . . 4 TYR . . 4 TYR . 1 1 2 PSI 1 1 4 TYR N 1 1 4 TYR CA 1 1 4 TYR C 1 1 5 THR N -96.3 31.099998 . 4 TYR . . 4 TYR . . 4 TYR . . 4 TYR . 1 1 3 PHI 1 1 4 TYR C 1 1 5 THR N 1 1 5 THR CA 1 1 5 THR C -76.4 -53.0 . 5 THR . . 5 THR . . 5 THR . . 5 THR . 1 1 4 PSI 1 1 5 THR N 1 1 5 THR CA 1 1 5 THR C 1 1 6 ILE N -64.9 -11.2 . 5 THR . . 5 THR . . 5 THR . . 5 THR . 1 1 5 PHI 1 1 5 THR C 1 1 6 ILE N 1 1 6 ILE CA 1 1 6 ILE C -94.7 -45.9 . 6 ILE . . 6 ILE . . 6 ILE . . 6 ILE . 1 1 6 PSI 1 1 6 ILE N 1 1 6 ILE CA 1 1 6 ILE C 1 1 7 LYS N -52.3 -16.4 . 6 ILE . . 6 ILE . . 6 ILE . . 6 ILE . 1 1 7 PHI 1 1 6 ILE C 1 1 7 LYS N 1 1 7 LYS CA 1 1 7 LYS C -73.0 -53.0 . 7 LYS . . 7 LYS . . 7 LYS . . 7 LYS . 1 1 8 PSI 1 1 7 LYS N 1 1 7 LYS CA 1 1 7 LYS C 1 1 8 LEU N -50.2 -28.799997 . 7 LYS . . 7 LYS . . 7 LYS . . 7 LYS . 1 1 9 PHI 1 1 7 LYS C 1 1 8 LEU N 1 1 8 LEU CA 1 1 8 LEU C -74.0 -53.999996 . 8 LEU . . 8 LEU . . 8 LEU . . 8 LEU . 1 1 10 PSI 1 1 8 LEU N 1 1 8 LEU CA 1 1 8 LEU C 1 1 9 ALA N -57.500004 -17.4 . 8 LEU . . 8 LEU . . 8 LEU . . 8 LEU . 1 1 11 PHI 1 1 8 LEU C 1 1 9 ALA N 1 1 9 ALA CA 1 1 9 ALA C -76.2 -49.3 . 9 ALA . . 9 ALA . . 9 ALA . . 9 ALA . 1 1 12 PSI 1 1 9 ALA N 1 1 9 ALA CA 1 1 9 ALA C 1 1 10 LYS N -49.5 -28.9 . 9 ALA . . 9 ALA . . 9 ALA . . 9 ALA . 1 1 13 PHI 1 1 9 ALA C 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C -80.7 -51.299995 . 10 LYS . . 10 LYS . . 10 LYS . . 10 LYS . 1 1 14 PSI 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C 1 1 11 PHE N -56.1 -22.1 . 10 LYS . . 10 LYS . . 10 LYS . . 10 LYS . 1 1 15 PHI 1 1 10 LYS C 1 1 11 PHE N 1 1 11 PHE CA 1 1 11 PHE C -76.1 -56.1 . 11 PHE . . 11 PHE . . 11 PHE . . 11 PHE . 1 1 16 PSI 1 1 11 PHE N 1 1 11 PHE CA 1 1 11 PHE C 1 1 12 LEU N -54.5 -28.7 . 11 PHE . . 11 PHE . . 11 PHE . . 11 PHE . 1 1 17 PHI 1 1 11 PHE C 1 1 12 LEU N 1 1 12 LEU CA 1 1 12 LEU C -113.7 -33.499996 . 12 LEU . . 12 LEU . . 12 LEU . . 12 LEU . 1 1 18 PSI 1 1 12 LEU N 1 1 12 LEU CA 1 1 12 LEU C 1 1 13 GLY N -64.0 -0.6 . 12 LEU . . 12 LEU . . 12 LEU . . 12 LEU . 1 1 19 PHI 1 1 14 GLY C 1 1 15 ILE N 1 1 15 ILE CA 1 1 15 ILE C -71.5 -51.5 . 15 ILE . . 15 ILE . . 15 ILE . . 15 ILE . 1 1 20 PSI 1 1 15 ILE N 1 1 15 ILE CA 1 1 15 ILE C 1 1 16 VAL N -50.999996 -30.999998 . 15 ILE . . 15 ILE . . 15 ILE . . 15 ILE . 1 1 21 PHI 1 1 15 ILE C 1 1 16 VAL N 1 1 16 VAL CA 1 1 16 VAL C -79.59999 -53.1 . 16 VAL . . 16 VAL . . 16 VAL . . 16 VAL . 1 1 22 PSI 1 1 16 VAL N 1 1 16 VAL CA 1 1 16 VAL C 1 1 17 ARG N -58.699997 -26.5 . 16 VAL . . 16 VAL . . 16 VAL . . 16 VAL . 1 1 23 PHI 1 1 16 VAL C 1 1 17 ARG N 1 1 17 ARG CA 1 1 17 ARG C -70.8 -50.8 . 17 ARG . . 17 ARG . . 17 ARG . . 17 ARG . 1 1 24 PSI 1 1 17 ARG N 1 1 17 ARG CA 1 1 17 ARG C 1 1 18 ALA N -58.6 -27.4 . 17 ARG . . 17 ARG . . 17 ARG . . 17 ARG . 1 1 25 PHI 1 1 17 ARG C 1 1 18 ALA N 1 1 18 ALA CA 1 1 18 ALA C -90.8 -42.2 . 18 ALA . . 18 ALA . . 18 ALA . . 18 ALA . 1 1 26 PSI 1 1 18 ALA N 1 1 18 ALA CA 1 1 18 ALA C 1 1 19 MET N -48.3 -23.999998 . 18 ALA . . 18 ALA . . 18 ALA . . 18 ALA . 1 1 27 PHI 1 1 18 ALA C 1 1 19 MET N 1 1 19 MET CA 1 1 19 MET C -74.1 -54.1 . 19 MET . . 19 MET . . 19 MET . . 19 MET . 1 1 28 PSI 1 1 19 MET N 1 1 19 MET CA 1 1 19 MET C 1 1 20 LEU N -54.6 -23.3 . 19 MET . . 19 MET . . 19 MET . . 19 MET . 1 1 29 PHI 1 1 19 MET C 1 1 20 LEU N 1 1 20 LEU CA 1 1 20 LEU C -109.2 -37.5 . 20 LEU . . 20 LEU . . 20 LEU . . 20 LEU . 1 1 30 PSI 1 1 20 LEU N 1 1 20 LEU CA 1 1 20 LEU C 1 1 21 GLY N -64.5 -13.299999 . 20 LEU . . 20 LEU . . 20 LEU . . 20 LEU . 1 1 31 PHI 1 1 20 LEU C 1 1 21 GLY N 1 1 21 GLY CA 1 1 21 GLY C -80.2 -50.9 . 21 GLY . . 21 GLY . . 21 GLY . . 21 GLY . 1 1 32 PSI 1 1 21 GLY N 1 1 21 GLY CA 1 1 21 GLY C 1 1 22 SER N -58.499996 -5.8 . 21 GLY . . 21 GLY . . 21 GLY . . 21 GLY . 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 MET C C 11.448 5.325 2.036 1.00 . A A . 1 MET C 1 1 1 2 1 1 1 MET CA C 12.589 4.671 1.254 1.00 . A A . 1 MET CA 1 1 1 3 1 1 1 MET CB C 12.404 4.877 -0.270 1.00 . A A . 1 MET CB 1 1 1 4 1 1 1 MET CE C 12.400 4.086 -3.298 1.00 . A A . 1 MET CE 1 1 1 5 1 1 1 MET CG C 11.252 3.990 -0.793 1.00 . A A . 1 MET CG 1 1 1 6 1 1 1 MET H1 H 13.455 2.782 1.124 1.00 . A A . 1 MET H1 1 1 1 7 1 1 1 MET H2 H 11.757 2.765 1.151 1.00 . A A . 1 MET H2 1 1 1 8 1 1 1 MET H3 H 12.626 3.064 2.579 1.00 . A A . 1 MET H3 1 1 1 9 1 1 1 MET HA H 13.527 5.109 1.569 1.00 . A A . 1 MET HA 1 1 1 10 1 1 1 MET HB2 H 12.184 5.916 -0.482 1.00 . A A . 1 MET HB2 1 1 1 11 1 1 1 MET HB3 H 13.321 4.603 -0.778 1.00 . A A . 1 MET HB3 1 1 1 12 1 1 1 MET HE1 H 12.226 3.908 -4.351 1.00 . A A . 1 MET HE1 1 1 1 13 1 1 1 MET HE2 H 12.836 3.204 -2.857 1.00 . A A . 1 MET HE2 1 1 1 14 1 1 1 MET HE3 H 13.075 4.922 -3.180 1.00 . A A . 1 MET HE3 1 1 1 15 1 1 1 MET HG2 H 11.555 2.953 -0.779 1.00 . A A . 1 MET HG2 1 1 1 16 1 1 1 MET HG3 H 10.379 4.111 -0.162 1.00 . A A . 1 MET HG3 1 1 1 17 1 1 1 MET N N 12.609 3.211 1.550 1.00 . A A . 1 MET N 1 1 1 18 1 1 1 MET O O 10.851 4.711 2.919 1.00 . A A . 1 MET O 1 1 1 19 1 1 1 MET SD S 10.821 4.467 -2.494 1.00 . A A . 1 MET SD 1 1 1 20 1 1 2 LYS C C 8.730 6.742 2.022 1.00 . A A . 2 LYS C 1 1 1 21 1 1 2 LYS CA C 10.093 7.335 2.365 1.00 . A A . 2 LYS CA 1 1 1 22 1 1 2 LYS CB C 10.143 8.807 1.909 1.00 . A A . 2 LYS CB 1 1 1 23 1 1 2 LYS CD C 11.509 10.921 1.921 1.00 . A A . 2 LYS CD 1 1 1 24 1 1 2 LYS CE C 12.860 11.540 2.306 1.00 . A A . 2 LYS CE 1 1 1 25 1 1 2 LYS CG C 11.477 9.442 2.336 1.00 . A A . 2 LYS CG 1 1 1 26 1 1 2 LYS H H 11.674 7.013 0.989 1.00 . A A . 2 LYS H 1 1 1 27 1 1 2 LYS HA H 10.233 7.295 3.439 1.00 . A A . 2 LYS HA 1 1 1 28 1 1 2 LYS HB2 H 10.051 8.854 0.829 1.00 . A A . 2 LYS HB2 1 1 1 29 1 1 2 LYS HB3 H 9.327 9.355 2.361 1.00 . A A . 2 LYS HB3 1 1 1 30 1 1 2 LYS HD2 H 11.370 11.000 0.850 1.00 . A A . 2 LYS HD2 1 1 1 31 1 1 2 LYS HD3 H 10.715 11.453 2.425 1.00 . A A . 2 LYS HD3 1 1 1 32 1 1 2 LYS HE2 H 13.651 11.046 1.759 1.00 . A A . 2 LYS HE2 1 1 1 33 1 1 2 LYS HE3 H 12.856 12.593 2.062 1.00 . A A . 2 LYS HE3 1 1 1 34 1 1 2 LYS HG2 H 11.583 9.368 3.411 1.00 . A A . 2 LYS HG2 1 1 1 35 1 1 2 LYS HG3 H 12.292 8.918 1.858 1.00 . A A . 2 LYS HG3 1 1 1 36 1 1 2 LYS HZ1 H 12.215 11.611 4.284 1.00 . A A . 2 LYS HZ1 1 1 1 37 1 1 2 LYS HZ2 H 13.858 11.995 4.079 1.00 . A A . 2 LYS HZ2 1 1 1 38 1 1 2 LYS HZ3 H 13.337 10.381 3.968 1.00 . A A . 2 LYS HZ3 1 1 1 39 1 1 2 LYS N N 11.157 6.581 1.702 1.00 . A A . 2 LYS N 1 1 1 40 1 1 2 LYS NZ N 13.085 11.369 3.769 1.00 . A A . 2 LYS NZ 1 1 1 41 1 1 2 LYS O O 7.724 7.102 2.633 1.00 . A A . 2 LYS O 1 1 1 42 1 1 3 PHE C C 6.505 6.267 -0.036 1.00 . A A . 3 PHE C 1 1 1 43 1 1 3 PHE CA C 7.471 5.227 0.546 1.00 . A A . 3 PHE CA 1 1 1 44 1 1 3 PHE CB C 6.784 4.435 1.675 1.00 . A A . 3 PHE CB 1 1 1 45 1 1 3 PHE CD1 C 8.142 2.305 1.495 1.00 . A A . 3 PHE CD1 1 1 1 46 1 1 3 PHE CD2 C 8.330 3.611 3.540 1.00 . A A . 3 PHE CD2 1 1 1 47 1 1 3 PHE CE1 C 9.050 1.375 2.010 1.00 . A A . 3 PHE CE1 1 1 1 48 1 1 3 PHE CE2 C 9.239 2.673 4.048 1.00 . A A . 3 PHE CE2 1 1 1 49 1 1 3 PHE CG C 7.774 3.431 2.258 1.00 . A A . 3 PHE CG 1 1 1 50 1 1 3 PHE CZ C 9.598 1.557 3.283 1.00 . A A . 3 PHE CZ 1 1 1 51 1 1 3 PHE H H 9.549 5.651 0.562 1.00 . A A . 3 PHE H 1 1 1 52 1 1 3 PHE HA H 7.735 4.536 -0.245 1.00 . A A . 3 PHE HA 1 1 1 53 1 1 3 PHE HB2 H 6.430 5.111 2.439 1.00 . A A . 3 PHE HB2 1 1 1 54 1 1 3 PHE HB3 H 5.937 3.899 1.268 1.00 . A A . 3 PHE HB3 1 1 1 55 1 1 3 PHE HD1 H 7.723 2.157 0.509 1.00 . A A . 3 PHE HD1 1 1 1 56 1 1 3 PHE HD2 H 8.055 4.469 4.135 1.00 . A A . 3 PHE HD2 1 1 1 57 1 1 3 PHE HE1 H 9.332 0.514 1.422 1.00 . A A . 3 PHE HE1 1 1 1 58 1 1 3 PHE HE2 H 9.668 2.810 5.030 1.00 . A A . 3 PHE HE2 1 1 1 59 1 1 3 PHE HZ H 10.297 0.834 3.678 1.00 . A A . 3 PHE HZ 1 1 1 60 1 1 3 PHE N N 8.709 5.864 1.017 1.00 . A A . 3 PHE N 1 1 1 61 1 1 3 PHE O O 5.536 5.918 -0.712 1.00 . A A . 3 PHE O 1 1 1 62 1 1 4 TYR C C 6.357 8.864 -1.778 1.00 . A A . 4 TYR C 1 1 1 63 1 1 4 TYR CA C 5.998 8.659 -0.302 1.00 . A A . 4 TYR CA 1 1 1 64 1 1 4 TYR CB C 6.304 9.911 0.586 1.00 . A A . 4 TYR CB 1 1 1 65 1 1 4 TYR CD1 C 7.286 11.657 -0.956 1.00 . A A . 4 TYR CD1 1 1 1 66 1 1 4 TYR CD2 C 5.026 11.997 -0.144 1.00 . A A . 4 TYR CD2 1 1 1 67 1 1 4 TYR CE1 C 7.219 12.853 -1.668 1.00 . A A . 4 TYR CE1 1 1 1 68 1 1 4 TYR CE2 C 4.959 13.201 -0.862 1.00 . A A . 4 TYR CE2 1 1 1 69 1 1 4 TYR CG C 6.191 11.223 -0.192 1.00 . A A . 4 TYR CG 1 1 1 70 1 1 4 TYR CZ C 6.057 13.628 -1.622 1.00 . A A . 4 TYR CZ 1 1 1 71 1 1 4 TYR H H 7.593 7.765 0.721 1.00 . A A . 4 TYR H 1 1 1 72 1 1 4 TYR HA H 4.943 8.415 -0.233 1.00 . A A . 4 TYR HA 1 1 1 73 1 1 4 TYR HB2 H 5.625 9.932 1.432 1.00 . A A . 4 TYR HB2 1 1 1 74 1 1 4 TYR HB3 H 7.315 9.821 0.975 1.00 . A A . 4 TYR HB3 1 1 1 75 1 1 4 TYR HD1 H 8.188 11.056 -0.993 1.00 . A A . 4 TYR HD1 1 1 1 76 1 1 4 TYR HD2 H 4.182 11.668 0.443 1.00 . A A . 4 TYR HD2 1 1 1 77 1 1 4 TYR HE1 H 8.066 13.177 -2.252 1.00 . A A . 4 TYR HE1 1 1 1 78 1 1 4 TYR HE2 H 4.061 13.800 -0.829 1.00 . A A . 4 TYR HE2 1 1 1 79 1 1 4 TYR HH H 5.479 15.438 -1.804 1.00 . A A . 4 TYR HH 1 1 1 80 1 1 4 TYR N N 6.797 7.548 0.207 1.00 . A A . 4 TYR N 1 1 1 81 1 1 4 TYR O O 5.656 9.554 -2.518 1.00 . A A . 4 TYR O 1 1 1 82 1 1 4 TYR OH O 5.993 14.815 -2.322 1.00 . A A . 4 TYR OH 1 1 1 83 1 1 5 THR C C 6.865 7.676 -4.503 1.00 . A A . 5 THR C 1 1 1 84 1 1 5 THR CA C 7.911 8.292 -3.566 1.00 . A A . 5 THR CA 1 1 1 85 1 1 5 THR CB C 9.256 7.549 -3.672 1.00 . A A . 5 THR CB 1 1 1 86 1 1 5 THR CG2 C 9.901 7.790 -5.038 1.00 . A A . 5 THR CG2 1 1 1 87 1 1 5 THR H H 7.943 7.678 -1.547 1.00 . A A . 5 THR H 1 1 1 88 1 1 5 THR HA H 8.060 9.328 -3.838 1.00 . A A . 5 THR HA 1 1 1 89 1 1 5 THR HB H 9.101 6.493 -3.531 1.00 . A A . 5 THR HB 1 1 1 90 1 1 5 THR HG1 H 10.811 8.550 -3.072 1.00 . A A . 5 THR HG1 1 1 1 91 1 1 5 THR HG21 H 10.844 7.267 -5.086 1.00 . A A . 5 THR HG21 1 1 1 92 1 1 5 THR HG22 H 10.071 8.848 -5.171 1.00 . A A . 5 THR HG22 1 1 1 93 1 1 5 THR HG23 H 9.248 7.428 -5.817 1.00 . A A . 5 THR HG23 1 1 1 94 1 1 5 THR N N 7.448 8.226 -2.188 1.00 . A A . 5 THR N 1 1 1 95 1 1 5 THR O O 6.521 8.259 -5.531 1.00 . A A . 5 THR O 1 1 1 96 1 1 5 THR OG1 O 10.126 8.023 -2.654 1.00 . A A . 5 THR OG1 1 1 1 97 1 1 6 ILE C C 4.046 6.712 -4.937 1.00 . A A . 6 ILE C 1 1 1 98 1 1 6 ILE CA C 5.301 5.835 -4.921 1.00 . A A . 6 ILE CA 1 1 1 99 1 1 6 ILE CB C 4.967 4.432 -4.321 1.00 . A A . 6 ILE CB 1 1 1 100 1 1 6 ILE CD1 C 7.424 3.903 -3.776 1.00 . A A . 6 ILE CD1 1 1 1 101 1 1 6 ILE CG1 C 6.162 3.454 -4.532 1.00 . A A . 6 ILE CG1 1 1 1 102 1 1 6 ILE CG2 C 3.697 3.821 -4.991 1.00 . A A . 6 ILE CG2 1 1 1 103 1 1 6 ILE H H 6.629 6.101 -3.281 1.00 . A A . 6 ILE H 1 1 1 104 1 1 6 ILE HA H 5.655 5.715 -5.937 1.00 . A A . 6 ILE HA 1 1 1 105 1 1 6 ILE HB H 4.784 4.544 -3.261 1.00 . A A . 6 ILE HB 1 1 1 106 1 1 6 ILE HD11 H 7.169 4.376 -2.836 1.00 . A A . 6 ILE HD11 1 1 1 107 1 1 6 ILE HD12 H 7.968 4.594 -4.393 1.00 . A A . 6 ILE HD12 1 1 1 108 1 1 6 ILE HD13 H 8.044 3.040 -3.582 1.00 . A A . 6 ILE HD13 1 1 1 109 1 1 6 ILE HG12 H 5.885 2.470 -4.186 1.00 . A A . 6 ILE HG12 1 1 1 110 1 1 6 ILE HG13 H 6.390 3.404 -5.587 1.00 . A A . 6 ILE HG13 1 1 1 111 1 1 6 ILE HG21 H 2.814 4.365 -4.684 1.00 . A A . 6 ILE HG21 1 1 1 112 1 1 6 ILE HG22 H 3.586 2.785 -4.697 1.00 . A A . 6 ILE HG22 1 1 1 113 1 1 6 ILE HG23 H 3.796 3.876 -6.067 1.00 . A A . 6 ILE HG23 1 1 1 114 1 1 6 ILE N N 6.336 6.504 -4.122 1.00 . A A . 6 ILE N 1 1 1 115 1 1 6 ILE O O 3.403 6.881 -5.973 1.00 . A A . 6 ILE O 1 1 1 116 1 1 7 LYS C C 2.563 9.283 -4.561 1.00 . A A . 7 LYS C 1 1 1 117 1 1 7 LYS CA C 2.514 8.083 -3.623 1.00 . A A . 7 LYS CA 1 1 1 118 1 1 7 LYS CB C 2.422 8.572 -2.158 1.00 . A A . 7 LYS CB 1 1 1 119 1 1 7 LYS CD C 1.068 9.883 -0.478 1.00 . A A . 7 LYS CD 1 1 1 120 1 1 7 LYS CE C -0.142 10.809 -0.297 1.00 . A A . 7 LYS CE 1 1 1 121 1 1 7 LYS CG C 1.188 9.475 -1.953 1.00 . A A . 7 LYS CG 1 1 1 122 1 1 7 LYS H H 4.249 7.055 -2.977 1.00 . A A . 7 LYS H 1 1 1 123 1 1 7 LYS HA H 1.638 7.493 -3.846 1.00 . A A . 7 LYS HA 1 1 1 124 1 1 7 LYS HB2 H 2.351 7.714 -1.504 1.00 . A A . 7 LYS HB2 1 1 1 125 1 1 7 LYS HB3 H 3.312 9.130 -1.916 1.00 . A A . 7 LYS HB3 1 1 1 126 1 1 7 LYS HD2 H 0.942 9.001 0.134 1.00 . A A . 7 LYS HD2 1 1 1 127 1 1 7 LYS HD3 H 1.965 10.404 -0.177 1.00 . A A . 7 LYS HD3 1 1 1 128 1 1 7 LYS HE2 H 0.005 11.710 -0.880 1.00 . A A . 7 LYS HE2 1 1 1 129 1 1 7 LYS HE3 H -1.039 10.307 -0.631 1.00 . A A . 7 LYS HE3 1 1 1 130 1 1 7 LYS HG2 H 1.287 10.371 -2.551 1.00 . A A . 7 LYS HG2 1 1 1 131 1 1 7 LYS HG3 H 0.306 8.943 -2.254 1.00 . A A . 7 LYS HG3 1 1 1 132 1 1 7 LYS HZ1 H -0.115 12.185 1.268 1.00 . A A . 7 LYS HZ1 1 1 1 133 1 1 7 LYS HZ2 H 0.410 10.628 1.703 1.00 . A A . 7 LYS HZ2 1 1 1 134 1 1 7 LYS HZ3 H -1.243 10.935 1.466 1.00 . A A . 7 LYS HZ3 1 1 1 135 1 1 7 LYS N N 3.702 7.246 -3.767 1.00 . A A . 7 LYS N 1 1 1 136 1 1 7 LYS NZ N -0.282 11.167 1.144 1.00 . A A . 7 LYS NZ 1 1 1 137 1 1 7 LYS O O 1.592 9.573 -5.261 1.00 . A A . 7 LYS O 1 1 1 138 1 1 8 LEU C C 3.748 10.806 -6.851 1.00 . A A . 8 LEU C 1 1 1 139 1 1 8 LEU CA C 3.829 11.182 -5.380 1.00 . A A . 8 LEU CA 1 1 1 140 1 1 8 LEU CB C 5.165 11.899 -5.069 1.00 . A A . 8 LEU CB 1 1 1 141 1 1 8 LEU CD1 C 4.153 14.280 -4.862 1.00 . A A . 8 LEU CD1 1 1 1 142 1 1 8 LEU CD2 C 6.582 13.953 -5.523 1.00 . A A . 8 LEU CD2 1 1 1 143 1 1 8 LEU CG C 5.162 13.363 -5.629 1.00 . A A . 8 LEU CG 1 1 1 144 1 1 8 LEU H H 4.411 9.728 -3.966 1.00 . A A . 8 LEU H 1 1 1 145 1 1 8 LEU HA H 3.011 11.842 -5.152 1.00 . A A . 8 LEU HA 1 1 1 146 1 1 8 LEU HB2 H 5.308 11.918 -4.002 1.00 . A A . 8 LEU HB2 1 1 1 147 1 1 8 LEU HB3 H 5.982 11.341 -5.514 1.00 . A A . 8 LEU HB3 1 1 1 148 1 1 8 LEU HD11 H 3.174 14.183 -5.304 1.00 . A A . 8 LEU HD11 1 1 1 149 1 1 8 LEU HD12 H 4.455 15.319 -4.933 1.00 . A A . 8 LEU HD12 1 1 1 150 1 1 8 LEU HD13 H 4.101 14.001 -3.816 1.00 . A A . 8 LEU HD13 1 1 1 151 1 1 8 LEU HD21 H 6.878 13.989 -4.486 1.00 . A A . 8 LEU HD21 1 1 1 152 1 1 8 LEU HD22 H 6.581 14.952 -5.933 1.00 . A A . 8 LEU HD22 1 1 1 153 1 1 8 LEU HD23 H 7.273 13.338 -6.077 1.00 . A A . 8 LEU HD23 1 1 1 154 1 1 8 LEU HG H 4.878 13.333 -6.669 1.00 . A A . 8 LEU HG 1 1 1 155 1 1 8 LEU N N 3.683 9.995 -4.550 1.00 . A A . 8 LEU N 1 1 1 156 1 1 8 LEU O O 3.094 11.471 -7.644 1.00 . A A . 8 LEU O 1 1 1 157 1 1 9 ALA C C 2.949 9.089 -9.084 1.00 . A A . 9 ALA C 1 1 1 158 1 1 9 ALA CA C 4.395 9.254 -8.593 1.00 . A A . 9 ALA CA 1 1 1 159 1 1 9 ALA CB C 5.143 7.923 -8.710 1.00 . A A . 9 ALA CB 1 1 1 160 1 1 9 ALA H H 4.910 9.224 -6.533 1.00 . A A . 9 ALA H 1 1 1 161 1 1 9 ALA HA H 4.890 9.991 -9.195 1.00 . A A . 9 ALA HA 1 1 1 162 1 1 9 ALA HB1 H 4.664 7.185 -8.085 1.00 . A A . 9 ALA HB1 1 1 1 163 1 1 9 ALA HB2 H 6.166 8.055 -8.389 1.00 . A A . 9 ALA HB2 1 1 1 164 1 1 9 ALA HB3 H 5.130 7.586 -9.737 1.00 . A A . 9 ALA HB3 1 1 1 165 1 1 9 ALA N N 4.408 9.717 -7.209 1.00 . A A . 9 ALA N 1 1 1 166 1 1 9 ALA O O 2.598 9.514 -10.183 1.00 . A A . 9 ALA O 1 1 1 167 1 1 10 LYS C C -0.004 9.660 -8.661 1.00 . A A . 10 LYS C 1 1 1 168 1 1 10 LYS CA C 0.697 8.306 -8.556 1.00 . A A . 10 LYS CA 1 1 1 169 1 1 10 LYS CB C 0.035 7.457 -7.453 1.00 . A A . 10 LYS CB 1 1 1 170 1 1 10 LYS CD C -0.136 5.174 -6.409 1.00 . A A . 10 LYS CD 1 1 1 171 1 1 10 LYS CE C 0.266 3.700 -6.526 1.00 . A A . 10 LYS CE 1 1 1 172 1 1 10 LYS CG C 0.519 5.999 -7.529 1.00 . A A . 10 LYS CG 1 1 1 173 1 1 10 LYS H H 2.451 8.200 -7.363 1.00 . A A . 10 LYS H 1 1 1 174 1 1 10 LYS HA H 0.605 7.802 -9.510 1.00 . A A . 10 LYS HA 1 1 1 175 1 1 10 LYS HB2 H 0.293 7.869 -6.488 1.00 . A A . 10 LYS HB2 1 1 1 176 1 1 10 LYS HB3 H -1.035 7.482 -7.569 1.00 . A A . 10 LYS HB3 1 1 1 177 1 1 10 LYS HD2 H 0.185 5.553 -5.449 1.00 . A A . 10 LYS HD2 1 1 1 178 1 1 10 LYS HD3 H -1.212 5.254 -6.481 1.00 . A A . 10 LYS HD3 1 1 1 179 1 1 10 LYS HE2 H -0.102 3.297 -7.460 1.00 . A A . 10 LYS HE2 1 1 1 180 1 1 10 LYS HE3 H 1.341 3.608 -6.491 1.00 . A A . 10 LYS HE3 1 1 1 181 1 1 10 LYS HG2 H 0.252 5.584 -8.491 1.00 . A A . 10 LYS HG2 1 1 1 182 1 1 10 LYS HG3 H 1.594 5.970 -7.413 1.00 . A A . 10 LYS HG3 1 1 1 183 1 1 10 LYS HZ1 H 0.072 1.993 -5.343 1.00 . A A . 10 LYS HZ1 1 1 1 184 1 1 10 LYS HZ2 H -1.366 2.880 -5.526 1.00 . A A . 10 LYS HZ2 1 1 1 185 1 1 10 LYS HZ3 H -0.137 3.451 -4.503 1.00 . A A . 10 LYS HZ3 1 1 1 186 1 1 10 LYS N N 2.114 8.495 -8.234 1.00 . A A . 10 LYS N 1 1 1 187 1 1 10 LYS NZ N -0.337 2.948 -5.390 1.00 . A A . 10 LYS NZ 1 1 1 188 1 1 10 LYS O O -0.790 9.897 -9.578 1.00 . A A . 10 LYS O 1 1 1 189 1 1 11 PHE C C -0.017 12.595 -9.005 1.00 . A A . 11 PHE C 1 1 1 190 1 1 11 PHE CA C -0.302 11.882 -7.688 1.00 . A A . 11 PHE CA 1 1 1 191 1 1 11 PHE CB C 0.312 12.666 -6.516 1.00 . A A . 11 PHE CB 1 1 1 192 1 1 11 PHE CD1 C -1.649 14.182 -5.989 1.00 . A A . 11 PHE CD1 1 1 1 193 1 1 11 PHE CD2 C 0.474 15.214 -6.574 1.00 . A A . 11 PHE CD2 1 1 1 194 1 1 11 PHE CE1 C -2.213 15.450 -5.814 1.00 . A A . 11 PHE CE1 1 1 1 195 1 1 11 PHE CE2 C -0.098 16.481 -6.402 1.00 . A A . 11 PHE CE2 1 1 1 196 1 1 11 PHE CG C -0.304 14.056 -6.369 1.00 . A A . 11 PHE CG 1 1 1 197 1 1 11 PHE CZ C -1.441 16.598 -6.020 1.00 . A A . 11 PHE CZ 1 1 1 198 1 1 11 PHE H H 0.925 10.283 -7.013 1.00 . A A . 11 PHE H 1 1 1 199 1 1 11 PHE HA H -1.368 11.800 -7.548 1.00 . A A . 11 PHE HA 1 1 1 200 1 1 11 PHE HB2 H 0.147 12.113 -5.610 1.00 . A A . 11 PHE HB2 1 1 1 201 1 1 11 PHE HB3 H 1.371 12.753 -6.672 1.00 . A A . 11 PHE HB3 1 1 1 202 1 1 11 PHE HD1 H -2.252 13.300 -5.830 1.00 . A A . 11 PHE HD1 1 1 1 203 1 1 11 PHE HD2 H 1.516 15.135 -6.870 1.00 . A A . 11 PHE HD2 1 1 1 204 1 1 11 PHE HE1 H -3.248 15.542 -5.518 1.00 . A A . 11 PHE HE1 1 1 1 205 1 1 11 PHE HE2 H 0.498 17.368 -6.560 1.00 . A A . 11 PHE HE2 1 1 1 206 1 1 11 PHE HZ H -1.881 17.575 -5.885 1.00 . A A . 11 PHE HZ 1 1 1 207 1 1 11 PHE N N 0.293 10.541 -7.713 1.00 . A A . 11 PHE N 1 1 1 208 1 1 11 PHE O O -0.922 13.103 -9.659 1.00 . A A . 11 PHE O 1 1 1 209 1 1 12 LEU C C 1.032 12.451 -11.826 1.00 . A A . 12 LEU C 1 1 1 210 1 1 12 LEU CA C 1.660 13.210 -10.658 1.00 . A A . 12 LEU CA 1 1 1 211 1 1 12 LEU CB C 3.193 13.170 -10.804 1.00 . A A . 12 LEU CB 1 1 1 212 1 1 12 LEU CD1 C 5.420 13.815 -9.818 1.00 . A A . 12 LEU CD1 1 1 1 213 1 1 12 LEU CD2 C 3.500 15.474 -9.705 1.00 . A A . 12 LEU CD2 1 1 1 214 1 1 12 LEU CG C 3.893 13.972 -9.677 1.00 . A A . 12 LEU CG 1 1 1 215 1 1 12 LEU H H 1.922 12.152 -8.830 1.00 . A A . 12 LEU H 1 1 1 216 1 1 12 LEU HA H 1.315 14.229 -10.698 1.00 . A A . 12 LEU HA 1 1 1 217 1 1 12 LEU HB2 H 3.521 12.139 -10.762 1.00 . A A . 12 LEU HB2 1 1 1 218 1 1 12 LEU HB3 H 3.471 13.589 -11.765 1.00 . A A . 12 LEU HB3 1 1 1 219 1 1 12 LEU HD11 H 5.916 14.396 -9.054 1.00 . A A . 12 LEU HD11 1 1 1 220 1 1 12 LEU HD12 H 5.734 14.158 -10.794 1.00 . A A . 12 LEU HD12 1 1 1 221 1 1 12 LEU HD13 H 5.683 12.774 -9.700 1.00 . A A . 12 LEU HD13 1 1 1 222 1 1 12 LEU HD21 H 2.550 15.598 -9.206 1.00 . A A . 12 LEU HD21 1 1 1 223 1 1 12 LEU HD22 H 3.421 15.825 -10.724 1.00 . A A . 12 LEU HD22 1 1 1 224 1 1 12 LEU HD23 H 4.241 16.066 -9.180 1.00 . A A . 12 LEU HD23 1 1 1 225 1 1 12 LEU HG H 3.597 13.554 -8.729 1.00 . A A . 12 LEU HG 1 1 1 226 1 1 12 LEU N N 1.252 12.593 -9.394 1.00 . A A . 12 LEU N 1 1 1 227 1 1 12 LEU O O 0.571 13.056 -12.791 1.00 . A A . 12 LEU O 1 1 1 228 1 1 13 GLY C C -1.023 10.487 -12.920 1.00 . A A . 13 GLY C 1 1 1 229 1 1 13 GLY CA C 0.479 10.290 -12.800 1.00 . A A . 13 GLY CA 1 1 1 230 1 1 13 GLY H H 1.432 10.692 -10.951 1.00 . A A . 13 GLY H 1 1 1 231 1 1 13 GLY HA2 H 0.948 10.544 -13.735 1.00 . A A . 13 GLY HA2 1 1 1 232 1 1 13 GLY HA3 H 0.678 9.267 -12.586 1.00 . A A . 13 GLY HA3 1 1 1 233 1 1 13 GLY N N 1.037 11.122 -11.738 1.00 . A A . 13 GLY N 1 1 1 234 1 1 13 GLY O O -1.644 10.074 -13.899 1.00 . A A . 13 GLY O 1 1 1 235 1 1 14 GLY C C -3.274 12.746 -12.632 1.00 . A A . 14 GLY C 1 1 1 236 1 1 14 GLY CA C -3.048 11.416 -11.926 1.00 . A A . 14 GLY CA 1 1 1 237 1 1 14 GLY H H -1.063 11.438 -11.163 1.00 . A A . 14 GLY H 1 1 1 238 1 1 14 GLY HA2 H -3.595 10.629 -12.439 1.00 . A A . 14 GLY HA2 1 1 1 239 1 1 14 GLY HA3 H -3.401 11.491 -10.909 1.00 . A A . 14 GLY HA3 1 1 1 240 1 1 14 GLY N N -1.610 11.131 -11.918 1.00 . A A . 14 GLY N 1 1 1 241 1 1 14 GLY O O -4.167 12.889 -13.467 1.00 . A A . 14 GLY O 1 1 1 242 1 1 15 ILE C C -2.006 15.035 -14.316 1.00 . A A . 15 ILE C 1 1 1 243 1 1 15 ILE CA C -2.472 15.057 -12.865 1.00 . A A . 15 ILE CA 1 1 1 244 1 1 15 ILE CB C -1.586 16.024 -12.044 1.00 . A A . 15 ILE CB 1 1 1 245 1 1 15 ILE CD1 C -1.064 16.787 -9.686 1.00 . A A . 15 ILE CD1 1 1 1 246 1 1 15 ILE CG1 C -2.092 16.073 -10.574 1.00 . A A . 15 ILE CG1 1 1 1 247 1 1 15 ILE CG2 C -1.628 17.454 -12.657 1.00 . A A . 15 ILE CG2 1 1 1 248 1 1 15 ILE H H -1.729 13.517 -11.625 1.00 . A A . 15 ILE H 1 1 1 249 1 1 15 ILE HA H -3.493 15.415 -12.838 1.00 . A A . 15 ILE HA 1 1 1 250 1 1 15 ILE HB H -0.565 15.661 -12.065 1.00 . A A . 15 ILE HB 1 1 1 251 1 1 15 ILE HD11 H -1.471 16.908 -8.702 1.00 . A A . 15 ILE HD11 1 1 1 252 1 1 15 ILE HD12 H -0.833 17.758 -10.098 1.00 . A A . 15 ILE HD12 1 1 1 253 1 1 15 ILE HD13 H -0.161 16.193 -9.636 1.00 . A A . 15 ILE HD13 1 1 1 254 1 1 15 ILE HG12 H -3.033 16.603 -10.526 1.00 . A A . 15 ILE HG12 1 1 1 255 1 1 15 ILE HG13 H -2.235 15.071 -10.198 1.00 . A A . 15 ILE HG13 1 1 1 256 1 1 15 ILE HG21 H -1.137 17.460 -13.619 1.00 . A A . 15 ILE HG21 1 1 1 257 1 1 15 ILE HG22 H -1.115 18.148 -12.005 1.00 . A A . 15 ILE HG22 1 1 1 258 1 1 15 ILE HG23 H -2.655 17.769 -12.775 1.00 . A A . 15 ILE HG23 1 1 1 259 1 1 15 ILE N N -2.425 13.715 -12.284 1.00 . A A . 15 ILE N 1 1 1 260 1 1 15 ILE O O -2.541 15.762 -15.151 1.00 . A A . 15 ILE O 1 1 1 261 1 1 16 VAL C C -1.553 13.962 -16.988 1.00 . A A . 16 VAL C 1 1 1 262 1 1 16 VAL CA C -0.424 14.212 -15.975 1.00 . A A . 16 VAL CA 1 1 1 263 1 1 16 VAL CB C 0.710 13.140 -16.072 1.00 . A A . 16 VAL CB 1 1 1 264 1 1 16 VAL CG1 C 0.132 11.712 -16.182 1.00 . A A . 16 VAL CG1 1 1 1 265 1 1 16 VAL CG2 C 1.612 13.413 -17.295 1.00 . A A . 16 VAL CG2 1 1 1 266 1 1 16 VAL H H -0.543 13.702 -13.907 1.00 . A A . 16 VAL H 1 1 1 267 1 1 16 VAL HA H -0.003 15.189 -16.169 1.00 . A A . 16 VAL HA 1 1 1 268 1 1 16 VAL HB H 1.312 13.191 -15.170 1.00 . A A . 16 VAL HB 1 1 1 269 1 1 16 VAL HG11 H 0.931 10.991 -16.092 1.00 . A A . 16 VAL HG11 1 1 1 270 1 1 16 VAL HG12 H -0.359 11.576 -17.135 1.00 . A A . 16 VAL HG12 1 1 1 271 1 1 16 VAL HG13 H -0.575 11.562 -15.390 1.00 . A A . 16 VAL HG13 1 1 1 272 1 1 16 VAL HG21 H 2.073 14.385 -17.194 1.00 . A A . 16 VAL HG21 1 1 1 273 1 1 16 VAL HG22 H 1.016 13.389 -18.195 1.00 . A A . 16 VAL HG22 1 1 1 274 1 1 16 VAL HG23 H 2.385 12.657 -17.354 1.00 . A A . 16 VAL HG23 1 1 1 275 1 1 16 VAL N N -0.968 14.242 -14.613 1.00 . A A . 16 VAL N 1 1 1 276 1 1 16 VAL O O -1.639 14.630 -18.019 1.00 . A A . 16 VAL O 1 1 1 277 1 1 17 ARG C C -4.549 13.890 -17.500 1.00 . A A . 17 ARG C 1 1 1 278 1 1 17 ARG CA C -3.584 12.699 -17.479 1.00 . A A . 17 ARG CA 1 1 1 279 1 1 17 ARG CB C -4.269 11.440 -16.906 1.00 . A A . 17 ARG CB 1 1 1 280 1 1 17 ARG CD C -5.387 10.933 -19.158 1.00 . A A . 17 ARG CD 1 1 1 281 1 1 17 ARG CG C -5.592 11.093 -17.637 1.00 . A A . 17 ARG CG 1 1 1 282 1 1 17 ARG CZ C -6.777 10.261 -21.069 1.00 . A A . 17 ARG CZ 1 1 1 283 1 1 17 ARG H H -2.318 12.547 -15.800 1.00 . A A . 17 ARG H 1 1 1 284 1 1 17 ARG HA H -3.248 12.495 -18.487 1.00 . A A . 17 ARG HA 1 1 1 285 1 1 17 ARG HB2 H -3.590 10.600 -16.991 1.00 . A A . 17 ARG HB2 1 1 1 286 1 1 17 ARG HB3 H -4.480 11.608 -15.859 1.00 . A A . 17 ARG HB3 1 1 1 287 1 1 17 ARG HD2 H -5.251 11.909 -19.611 1.00 . A A . 17 ARG HD2 1 1 1 288 1 1 17 ARG HD3 H -4.514 10.323 -19.351 1.00 . A A . 17 ARG HD3 1 1 1 289 1 1 17 ARG HE H -7.235 9.886 -19.153 1.00 . A A . 17 ARG HE 1 1 1 290 1 1 17 ARG HG2 H -5.966 10.162 -17.241 1.00 . A A . 17 ARG HG2 1 1 1 291 1 1 17 ARG HG3 H -6.327 11.865 -17.450 1.00 . A A . 17 ARG HG3 1 1 1 292 1 1 17 ARG HH11 H -5.069 11.203 -21.530 1.00 . A A . 17 ARG HH11 1 1 1 293 1 1 17 ARG HH12 H -6.056 10.742 -22.876 1.00 . A A . 17 ARG HH12 1 1 1 294 1 1 17 ARG HH21 H -8.531 9.302 -20.929 1.00 . A A . 17 ARG HH21 1 1 1 295 1 1 17 ARG HH22 H -8.015 9.692 -22.535 1.00 . A A . 17 ARG HH22 1 1 1 296 1 1 17 ARG N N -2.430 13.020 -16.650 1.00 . A A . 17 ARG N 1 1 1 297 1 1 17 ARG NE N -6.570 10.291 -19.747 1.00 . A A . 17 ARG NE 1 1 1 298 1 1 17 ARG NH1 N -5.899 10.779 -21.889 1.00 . A A . 17 ARG NH1 1 1 1 299 1 1 17 ARG NH2 N -7.858 9.706 -21.548 1.00 . A A . 17 ARG NH2 1 1 1 300 1 1 17 ARG O O -5.128 14.209 -18.535 1.00 . A A . 17 ARG O 1 1 1 301 1 1 18 ALA C C -5.250 16.799 -17.177 1.00 . A A . 18 ALA C 1 1 1 302 1 1 18 ALA CA C -5.654 15.664 -16.232 1.00 . A A . 18 ALA CA 1 1 1 303 1 1 18 ALA CB C -5.691 16.188 -14.788 1.00 . A A . 18 ALA CB 1 1 1 304 1 1 18 ALA H H -4.260 14.216 -15.540 1.00 . A A . 18 ALA H 1 1 1 305 1 1 18 ALA HA H -6.642 15.330 -16.496 1.00 . A A . 18 ALA HA 1 1 1 306 1 1 18 ALA HB1 H -5.916 15.371 -14.117 1.00 . A A . 18 ALA HB1 1 1 1 307 1 1 18 ALA HB2 H -6.453 16.949 -14.695 1.00 . A A . 18 ALA HB2 1 1 1 308 1 1 18 ALA HB3 H -4.735 16.612 -14.528 1.00 . A A . 18 ALA HB3 1 1 1 309 1 1 18 ALA N N -4.734 14.526 -16.339 1.00 . A A . 18 ALA N 1 1 1 310 1 1 18 ALA O O -6.103 17.427 -17.801 1.00 . A A . 18 ALA O 1 1 1 311 1 1 19 MET C C -3.787 17.813 -19.602 1.00 . A A . 19 MET C 1 1 1 312 1 1 19 MET CA C -3.432 18.100 -18.144 1.00 . A A . 19 MET CA 1 1 1 313 1 1 19 MET CB C -1.904 18.133 -17.986 1.00 . A A . 19 MET CB 1 1 1 314 1 1 19 MET CE C 0.738 19.974 -17.747 1.00 . A A . 19 MET CE 1 1 1 315 1 1 19 MET CG C -1.508 18.771 -16.645 1.00 . A A . 19 MET CG 1 1 1 316 1 1 19 MET H H -3.314 16.519 -16.770 1.00 . A A . 19 MET H 1 1 1 317 1 1 19 MET HA H -3.855 19.054 -17.859 1.00 . A A . 19 MET HA 1 1 1 318 1 1 19 MET HB2 H -1.523 17.123 -18.022 1.00 . A A . 19 MET HB2 1 1 1 319 1 1 19 MET HB3 H -1.479 18.690 -18.787 1.00 . A A . 19 MET HB3 1 1 1 320 1 1 19 MET HE1 H 1.689 20.425 -17.500 1.00 . A A . 19 MET HE1 1 1 1 321 1 1 19 MET HE2 H -0.013 20.745 -17.800 1.00 . A A . 19 MET HE2 1 1 1 322 1 1 19 MET HE3 H 0.812 19.480 -18.706 1.00 . A A . 19 MET HE3 1 1 1 323 1 1 19 MET HG2 H -1.876 19.782 -16.600 1.00 . A A . 19 MET HG2 1 1 1 324 1 1 19 MET HG3 H -1.944 18.197 -15.840 1.00 . A A . 19 MET HG3 1 1 1 325 1 1 19 MET N N -3.946 17.050 -17.280 1.00 . A A . 19 MET N 1 1 1 326 1 1 19 MET O O -4.400 18.631 -20.280 1.00 . A A . 19 MET O 1 1 1 327 1 1 19 MET SD S 0.303 18.759 -16.469 1.00 . A A . 19 MET SD 1 1 1 328 1 1 20 LEU C C -5.181 16.110 -21.622 1.00 . A A . 20 LEU C 1 1 1 329 1 1 20 LEU CA C -3.677 16.221 -21.437 1.00 . A A . 20 LEU CA 1 1 1 330 1 1 20 LEU CB C -3.028 14.854 -21.699 1.00 . A A . 20 LEU CB 1 1 1 331 1 1 20 LEU CD1 C -0.880 13.521 -21.725 1.00 . A A . 20 LEU CD1 1 1 1 332 1 1 20 LEU CD2 C -0.954 15.778 -22.899 1.00 . A A . 20 LEU CD2 1 1 1 333 1 1 20 LEU CG C -1.477 14.948 -21.690 1.00 . A A . 20 LEU CG 1 1 1 334 1 1 20 LEU H H -2.908 16.036 -19.469 1.00 . A A . 20 LEU H 1 1 1 335 1 1 20 LEU HA H -3.294 16.949 -22.131 1.00 . A A . 20 LEU HA 1 1 1 336 1 1 20 LEU HB2 H -3.342 14.178 -20.927 1.00 . A A . 20 LEU HB2 1 1 1 337 1 1 20 LEU HB3 H -3.361 14.474 -22.650 1.00 . A A . 20 LEU HB3 1 1 1 338 1 1 20 LEU HD11 H -1.258 12.989 -22.587 1.00 . A A . 20 LEU HD11 1 1 1 339 1 1 20 LEU HD12 H -1.162 12.995 -20.826 1.00 . A A . 20 LEU HD12 1 1 1 340 1 1 20 LEU HD13 H 0.198 13.580 -21.783 1.00 . A A . 20 LEU HD13 1 1 1 341 1 1 20 LEU HD21 H -1.002 16.828 -22.657 1.00 . A A . 20 LEU HD21 1 1 1 342 1 1 20 LEU HD22 H -1.552 15.584 -23.778 1.00 . A A . 20 LEU HD22 1 1 1 343 1 1 20 LEU HD23 H 0.076 15.519 -23.109 1.00 . A A . 20 LEU HD23 1 1 1 344 1 1 20 LEU HG H -1.164 15.427 -20.769 1.00 . A A . 20 LEU HG 1 1 1 345 1 1 20 LEU N N -3.396 16.639 -20.065 1.00 . A A . 20 LEU N 1 1 1 346 1 1 20 LEU O O -5.733 16.487 -22.656 1.00 . A A . 20 LEU O 1 1 1 347 1 1 21 GLY C C -7.957 16.758 -20.717 1.00 . A A . 21 GLY C 1 1 1 348 1 1 21 GLY CA C -7.269 15.410 -20.596 1.00 . A A . 21 GLY CA 1 1 1 349 1 1 21 GLY H H -5.302 15.322 -19.806 1.00 . A A . 21 GLY H 1 1 1 350 1 1 21 GLY HA2 H -7.554 14.787 -21.435 1.00 . A A . 21 GLY HA2 1 1 1 351 1 1 21 GLY HA3 H -7.578 14.936 -19.677 1.00 . A A . 21 GLY HA3 1 1 1 352 1 1 21 GLY N N -5.822 15.588 -20.592 1.00 . A A . 21 GLY N 1 1 1 353 1 1 21 GLY O O -9.065 16.859 -21.243 1.00 . A A . 21 GLY O 1 1 1 354 1 1 22 SER C C -8.004 19.550 -21.783 1.00 . A A . 22 SER C 1 1 1 355 1 1 22 SER CA C -7.811 19.159 -20.315 1.00 . A A . 22 SER CA 1 1 1 356 1 1 22 SER CB C -6.858 20.141 -19.603 1.00 . A A . 22 SER CB 1 1 1 357 1 1 22 SER H H -6.383 17.655 -19.855 1.00 . A A . 22 SER H 1 1 1 358 1 1 22 SER HA H -8.771 19.186 -19.815 1.00 . A A . 22 SER HA 1 1 1 359 1 1 22 SER HB2 H -6.454 19.676 -18.719 1.00 . A A . 22 SER HB2 1 1 1 360 1 1 22 SER HB3 H -6.039 20.416 -20.260 1.00 . A A . 22 SER HB3 1 1 1 361 1 1 22 SER HG H -7.635 21.329 -18.271 1.00 . A A . 22 SER HG 1 1 1 362 1 1 22 SER N N -7.275 17.801 -20.243 1.00 . A A . 22 SER N 1 1 1 363 1 1 22 SER O O -9.021 20.134 -22.159 1.00 . A A . 22 SER O 1 1 1 364 1 1 22 SER OG O -7.586 21.305 -19.229 1.00 . A A . 22 SER OG 1 1 1 365 1 1 23 PHE C C -7.615 18.286 -24.796 1.00 . A A . 23 PHE C 1 1 1 366 1 1 23 PHE CA C -7.030 19.488 -24.046 1.00 . A A . 23 PHE CA 1 1 1 367 1 1 23 PHE CB C -5.597 19.753 -24.548 1.00 . A A . 23 PHE CB 1 1 1 368 1 1 23 PHE CD1 C -5.609 19.202 -27.036 1.00 . A A . 23 PHE CD1 1 1 1 369 1 1 23 PHE CD2 C -5.699 21.537 -26.362 1.00 . A A . 23 PHE CD2 1 1 1 370 1 1 23 PHE CE1 C -5.654 19.591 -28.380 1.00 . A A . 23 PHE CE1 1 1 1 371 1 1 23 PHE CE2 C -5.744 21.920 -27.708 1.00 . A A . 23 PHE CE2 1 1 1 372 1 1 23 PHE CG C -5.632 20.177 -26.019 1.00 . A A . 23 PHE CG 1 1 1 373 1 1 23 PHE CZ C -5.721 20.948 -28.716 1.00 . A A . 23 PHE CZ 1 1 1 374 1 1 23 PHE H H -6.231 18.732 -22.231 1.00 . A A . 23 PHE H 1 1 1 375 1 1 23 PHE HA H -7.640 20.368 -24.242 1.00 . A A . 23 PHE HA 1 1 1 376 1 1 23 PHE HB2 H -5.146 20.532 -23.947 1.00 . A A . 23 PHE HB2 1 1 1 377 1 1 23 PHE HB3 H -5.007 18.848 -24.444 1.00 . A A . 23 PHE HB3 1 1 1 378 1 1 23 PHE HD1 H -5.557 18.154 -26.779 1.00 . A A . 23 PHE HD1 1 1 1 379 1 1 23 PHE HD2 H -5.718 22.290 -25.589 1.00 . A A . 23 PHE HD2 1 1 1 380 1 1 23 PHE HE1 H -5.639 18.843 -29.158 1.00 . A A . 23 PHE HE1 1 1 1 381 1 1 23 PHE HE2 H -5.794 22.966 -27.970 1.00 . A A . 23 PHE HE2 1 1 1 382 1 1 23 PHE HZ H -5.759 21.248 -29.752 1.00 . A A . 23 PHE HZ 1 1 1 383 1 1 23 PHE N N -7.003 19.204 -22.605 1.00 . A A . 23 PHE N 1 1 1 384 1 1 23 PHE O O -7.095 17.175 -24.705 1.00 . A A . 23 PHE O 1 1 1 385 1 1 24 ARG C C -8.936 17.481 -27.750 1.00 . A A . 24 ARG C 1 1 1 386 1 1 24 ARG CA C -9.393 17.466 -26.290 1.00 . A A . 24 ARG CA 1 1 1 387 1 1 24 ARG CB C -10.911 17.694 -26.226 1.00 . A A . 24 ARG CB 1 1 1 388 1 1 24 ARG CD C -12.893 17.890 -24.684 1.00 . A A . 24 ARG CD 1 1 1 389 1 1 24 ARG CG C -11.375 17.665 -24.759 1.00 . A A . 24 ARG CG 1 1 1 390 1 1 24 ARG CZ C -14.478 19.685 -25.177 1.00 . A A . 24 ARG CZ 1 1 1 391 1 1 24 ARG H H -9.068 19.429 -25.539 1.00 . A A . 24 ARG H 1 1 1 392 1 1 24 ARG HA H -9.172 16.490 -25.864 1.00 . A A . 24 ARG HA 1 1 1 393 1 1 24 ARG HB2 H -11.153 18.654 -26.661 1.00 . A A . 24 ARG HB2 1 1 1 394 1 1 24 ARG HB3 H -11.418 16.912 -26.774 1.00 . A A . 24 ARG HB3 1 1 1 395 1 1 24 ARG HD2 H -13.401 17.153 -25.290 1.00 . A A . 24 ARG HD2 1 1 1 396 1 1 24 ARG HD3 H -13.218 17.789 -23.656 1.00 . A A . 24 ARG HD3 1 1 1 397 1 1 24 ARG HE H -12.506 19.803 -25.511 1.00 . A A . 24 ARG HE 1 1 1 398 1 1 24 ARG HG2 H -11.131 16.705 -24.326 1.00 . A A . 24 ARG HG2 1 1 1 399 1 1 24 ARG HG3 H -10.871 18.445 -24.207 1.00 . A A . 24 ARG HG3 1 1 1 400 1 1 24 ARG HH11 H -15.268 18.039 -24.352 1.00 . A A . 24 ARG HH11 1 1 1 401 1 1 24 ARG HH12 H -16.390 19.305 -24.715 1.00 . A A . 24 ARG HH12 1 1 1 402 1 1 24 ARG HH21 H -13.980 21.443 -25.995 1.00 . A A . 24 ARG HH21 1 1 1 403 1 1 24 ARG HH22 H -15.664 21.227 -25.652 1.00 . A A . 24 ARG HH22 1 1 1 404 1 1 24 ARG N N -8.709 18.521 -25.522 1.00 . A A . 24 ARG N 1 1 1 405 1 1 24 ARG NE N -13.224 19.228 -25.171 1.00 . A A . 24 ARG NE 1 1 1 406 1 1 24 ARG NH1 N -15.455 18.952 -24.713 1.00 . A A . 24 ARG NH1 1 1 1 407 1 1 24 ARG NH2 N -14.727 20.878 -25.644 1.00 . A A . 24 ARG NH2 1 1 1 408 1 1 24 ARG O O -8.742 18.544 -28.338 1.00 . A A . 24 ARG O 1 1 1 409 1 1 25 LYS C C -9.380 16.795 -30.645 1.00 . A A . 25 LYS C 1 1 1 410 1 1 25 LYS CA C -8.333 16.170 -29.721 1.00 . A A . 25 LYS CA 1 1 1 411 1 1 25 LYS CB C -8.126 14.683 -30.063 1.00 . A A . 25 LYS CB 1 1 1 412 1 1 25 LYS CD C -7.278 13.035 -31.768 1.00 . A A . 25 LYS CD 1 1 1 413 1 1 25 LYS CE C -6.671 12.870 -33.169 1.00 . A A . 25 LYS CE 1 1 1 414 1 1 25 LYS CG C -7.533 14.524 -31.476 1.00 . A A . 25 LYS CG 1 1 1 415 1 1 25 LYS H H -8.934 15.478 -27.809 1.00 . A A . 25 LYS H 1 1 1 416 1 1 25 LYS HA H -7.396 16.697 -29.846 1.00 . A A . 25 LYS HA 1 1 1 417 1 1 25 LYS HB2 H -7.452 14.248 -29.339 1.00 . A A . 25 LYS HB2 1 1 1 418 1 1 25 LYS HB3 H -9.075 14.168 -30.017 1.00 . A A . 25 LYS HB3 1 1 1 419 1 1 25 LYS HD2 H -6.588 12.642 -31.033 1.00 . A A . 25 LYS HD2 1 1 1 420 1 1 25 LYS HD3 H -8.211 12.492 -31.711 1.00 . A A . 25 LYS HD3 1 1 1 421 1 1 25 LYS HE2 H -6.572 11.817 -33.398 1.00 . A A . 25 LYS HE2 1 1 1 422 1 1 25 LYS HE3 H -7.309 13.339 -33.905 1.00 . A A . 25 LYS HE3 1 1 1 423 1 1 25 LYS HG2 H -8.222 14.917 -32.209 1.00 . A A . 25 LYS HG2 1 1 1 424 1 1 25 LYS HG3 H -6.598 15.063 -31.534 1.00 . A A . 25 LYS HG3 1 1 1 425 1 1 25 LYS HZ1 H -5.422 14.537 -33.098 1.00 . A A . 25 LYS HZ1 1 1 1 426 1 1 25 LYS HZ2 H -4.854 13.283 -34.097 1.00 . A A . 25 LYS HZ2 1 1 1 427 1 1 25 LYS HZ3 H -4.756 13.141 -32.407 1.00 . A A . 25 LYS HZ3 1 1 1 428 1 1 25 LYS N N -8.766 16.291 -28.329 1.00 . A A . 25 LYS N 1 1 1 429 1 1 25 LYS NZ N -5.325 13.507 -33.196 1.00 . A A . 25 LYS NZ 1 1 1 430 1 1 25 LYS O O -9.043 17.446 -31.633 1.00 . A A . 25 LYS O 1 1 1 431 1 1 26 ASP C C -13.068 17.042 -30.328 1.00 . A A . 26 ASP C 1 1 1 432 1 1 26 ASP CA C -11.756 17.139 -31.108 1.00 . A A . 26 ASP CA 1 1 1 433 1 1 26 ASP CB C -11.876 16.378 -32.443 1.00 . A A . 26 ASP CB 1 1 1 434 1 1 26 ASP CG C -12.965 16.995 -33.333 1.00 . A A . 26 ASP CG 1 1 1 435 1 1 26 ASP H H -10.862 16.063 -29.511 1.00 . A A . 26 ASP H 1 1 1 436 1 1 26 ASP HA H -11.560 18.184 -31.319 1.00 . A A . 26 ASP HA 1 1 1 437 1 1 26 ASP HB2 H -10.929 16.423 -32.959 1.00 . A A . 26 ASP HB2 1 1 1 438 1 1 26 ASP HB3 H -12.124 15.345 -32.244 1.00 . A A . 26 ASP HB3 1 1 1 439 1 1 26 ASP N N -10.655 16.590 -30.311 1.00 . A A . 26 ASP N 1 1 1 440 1 1 26 ASP O O -13.745 16.035 -30.457 1.00 . A A . 26 ASP O 1 1 1 441 1 1 26 ASP OD1 O -13.654 17.894 -32.872 1.00 . A A . 26 ASP OD1 1 1 1 442 1 1 26 ASP OD2 O -13.098 16.552 -34.462 1.00 . A A . 26 ASP OD2 1 1 2 443 1 1 1 MET C C 11.296 5.724 -2.359 1.00 . A A . 1 MET C 1 1 2 444 1 1 1 MET CA C 11.646 6.399 -3.689 1.00 . A A . 1 MET CA 1 1 2 445 1 1 1 MET CB C 11.295 5.483 -4.875 1.00 . A A . 1 MET CB 1 1 2 446 1 1 1 MET CE C 9.410 5.395 -7.761 1.00 . A A . 1 MET CE 1 1 2 447 1 1 1 MET CG C 11.532 6.223 -6.202 1.00 . A A . 1 MET CG 1 1 2 448 1 1 1 MET H1 H 13.320 7.344 -4.488 1.00 . A A . 1 MET H1 1 1 2 449 1 1 1 MET H2 H 13.628 5.791 -3.872 1.00 . A A . 1 MET H2 1 1 2 450 1 1 1 MET H3 H 13.400 7.099 -2.812 1.00 . A A . 1 MET H3 1 1 2 451 1 1 1 MET HA H 11.099 7.329 -3.771 1.00 . A A . 1 MET HA 1 1 2 452 1 1 1 MET HB2 H 11.916 4.599 -4.843 1.00 . A A . 1 MET HB2 1 1 2 453 1 1 1 MET HB3 H 10.261 5.191 -4.812 1.00 . A A . 1 MET HB3 1 1 2 454 1 1 1 MET HE1 H 9.237 6.427 -8.033 1.00 . A A . 1 MET HE1 1 1 2 455 1 1 1 MET HE2 H 8.917 5.186 -6.827 1.00 . A A . 1 MET HE2 1 1 2 456 1 1 1 MET HE3 H 9.010 4.745 -8.527 1.00 . A A . 1 MET HE3 1 1 2 457 1 1 1 MET HG2 H 10.882 7.084 -6.257 1.00 . A A . 1 MET HG2 1 1 2 458 1 1 1 MET HG3 H 12.561 6.550 -6.252 1.00 . A A . 1 MET HG3 1 1 2 459 1 1 1 MET N N 13.108 6.680 -3.718 1.00 . A A . 1 MET N 1 1 2 460 1 1 1 MET O O 11.022 4.525 -2.309 1.00 . A A . 1 MET O 1 1 2 461 1 1 1 MET SD S 11.194 5.106 -7.596 1.00 . A A . 1 MET SD 1 1 2 462 1 1 2 LYS C C 9.618 5.391 0.131 1.00 . A A . 2 LYS C 1 1 2 463 1 1 2 LYS CA C 11.022 6.003 0.052 1.00 . A A . 2 LYS CA 1 1 2 464 1 1 2 LYS CB C 11.163 7.156 1.061 1.00 . A A . 2 LYS CB 1 1 2 465 1 1 2 LYS CD C 11.226 7.800 3.497 1.00 . A A . 2 LYS CD 1 1 2 466 1 1 2 LYS CE C 11.047 7.299 4.935 1.00 . A A . 2 LYS CE 1 1 2 467 1 1 2 LYS CG C 10.968 6.652 2.508 1.00 . A A . 2 LYS CG 1 1 2 468 1 1 2 LYS H H 11.554 7.456 -1.395 1.00 . A A . 2 LYS H 1 1 2 469 1 1 2 LYS HA H 11.744 5.239 0.301 1.00 . A A . 2 LYS HA 1 1 2 470 1 1 2 LYS HB2 H 12.148 7.588 0.959 1.00 . A A . 2 LYS HB2 1 1 2 471 1 1 2 LYS HB3 H 10.422 7.913 0.842 1.00 . A A . 2 LYS HB3 1 1 2 472 1 1 2 LYS HD2 H 12.235 8.165 3.367 1.00 . A A . 2 LYS HD2 1 1 2 473 1 1 2 LYS HD3 H 10.527 8.601 3.308 1.00 . A A . 2 LYS HD3 1 1 2 474 1 1 2 LYS HE2 H 10.035 6.949 5.069 1.00 . A A . 2 LYS HE2 1 1 2 475 1 1 2 LYS HE3 H 11.738 6.490 5.127 1.00 . A A . 2 LYS HE3 1 1 2 476 1 1 2 LYS HG2 H 9.955 6.298 2.637 1.00 . A A . 2 LYS HG2 1 1 2 477 1 1 2 LYS HG3 H 11.659 5.846 2.706 1.00 . A A . 2 LYS HG3 1 1 2 478 1 1 2 LYS HZ1 H 10.981 9.310 5.472 1.00 . A A . 2 LYS HZ1 1 1 2 479 1 1 2 LYS HZ2 H 12.335 8.477 6.075 1.00 . A A . 2 LYS HZ2 1 1 2 480 1 1 2 LYS HZ3 H 10.805 8.239 6.776 1.00 . A A . 2 LYS HZ3 1 1 2 481 1 1 2 LYS N N 11.321 6.510 -1.287 1.00 . A A . 2 LYS N 1 1 2 482 1 1 2 LYS NZ N 11.314 8.415 5.886 1.00 . A A . 2 LYS NZ 1 1 2 483 1 1 2 LYS O O 9.465 4.169 0.116 1.00 . A A . 2 LYS O 1 1 2 484 1 1 3 PHE C C 6.252 6.929 -0.021 1.00 . A A . 3 PHE C 1 1 2 485 1 1 3 PHE CA C 7.203 5.787 0.334 1.00 . A A . 3 PHE CA 1 1 2 486 1 1 3 PHE CB C 6.928 5.286 1.759 1.00 . A A . 3 PHE CB 1 1 2 487 1 1 3 PHE CD1 C 5.105 3.536 1.462 1.00 . A A . 3 PHE CD1 1 1 2 488 1 1 3 PHE CD2 C 4.498 5.677 2.436 1.00 . A A . 3 PHE CD2 1 1 2 489 1 1 3 PHE CE1 C 3.775 3.112 1.576 1.00 . A A . 3 PHE CE1 1 1 2 490 1 1 3 PHE CE2 C 3.170 5.250 2.547 1.00 . A A . 3 PHE CE2 1 1 2 491 1 1 3 PHE CG C 5.475 4.821 1.892 1.00 . A A . 3 PHE CG 1 1 2 492 1 1 3 PHE CZ C 2.810 3.967 2.118 1.00 . A A . 3 PHE CZ 1 1 2 493 1 1 3 PHE H H 8.780 7.208 0.252 1.00 . A A . 3 PHE H 1 1 2 494 1 1 3 PHE HA H 7.035 4.969 -0.356 1.00 . A A . 3 PHE HA 1 1 2 495 1 1 3 PHE HB2 H 7.593 4.460 1.971 1.00 . A A . 3 PHE HB2 1 1 2 496 1 1 3 PHE HB3 H 7.128 6.086 2.456 1.00 . A A . 3 PHE HB3 1 1 2 497 1 1 3 PHE HD1 H 5.848 2.872 1.044 1.00 . A A . 3 PHE HD1 1 1 2 498 1 1 3 PHE HD2 H 4.772 6.667 2.769 1.00 . A A . 3 PHE HD2 1 1 2 499 1 1 3 PHE HE1 H 3.495 2.123 1.246 1.00 . A A . 3 PHE HE1 1 1 2 500 1 1 3 PHE HE2 H 2.425 5.909 2.964 1.00 . A A . 3 PHE HE2 1 1 2 501 1 1 3 PHE HZ H 1.784 3.639 2.204 1.00 . A A . 3 PHE HZ 1 1 2 502 1 1 3 PHE N N 8.596 6.247 0.233 1.00 . A A . 3 PHE N 1 1 2 503 1 1 3 PHE O O 5.331 6.754 -0.816 1.00 . A A . 3 PHE O 1 1 2 504 1 1 4 TYR C C 5.766 9.640 -1.193 1.00 . A A . 4 TYR C 1 1 2 505 1 1 4 TYR CA C 5.633 9.267 0.281 1.00 . A A . 4 TYR CA 1 1 2 506 1 1 4 TYR CB C 6.026 10.453 1.189 1.00 . A A . 4 TYR CB 1 1 2 507 1 1 4 TYR CD1 C 8.564 10.402 1.412 1.00 . A A . 4 TYR CD1 1 1 2 508 1 1 4 TYR CD2 C 7.564 12.029 -0.089 1.00 . A A . 4 TYR CD2 1 1 2 509 1 1 4 TYR CE1 C 9.838 10.883 1.077 1.00 . A A . 4 TYR CE1 1 1 2 510 1 1 4 TYR CE2 C 8.836 12.505 -0.421 1.00 . A A . 4 TYR CE2 1 1 2 511 1 1 4 TYR CG C 7.421 10.974 0.830 1.00 . A A . 4 TYR CG 1 1 2 512 1 1 4 TYR CZ C 9.972 11.934 0.161 1.00 . A A . 4 TYR CZ 1 1 2 513 1 1 4 TYR H H 7.234 8.199 1.186 1.00 . A A . 4 TYR H 1 1 2 514 1 1 4 TYR HA H 4.601 9.003 0.476 1.00 . A A . 4 TYR HA 1 1 2 515 1 1 4 TYR HB2 H 5.296 11.247 1.076 1.00 . A A . 4 TYR HB2 1 1 2 516 1 1 4 TYR HB3 H 6.019 10.122 2.219 1.00 . A A . 4 TYR HB3 1 1 2 517 1 1 4 TYR HD1 H 8.462 9.591 2.118 1.00 . A A . 4 TYR HD1 1 1 2 518 1 1 4 TYR HD2 H 6.689 12.473 -0.541 1.00 . A A . 4 TYR HD2 1 1 2 519 1 1 4 TYR HE1 H 10.716 10.443 1.526 1.00 . A A . 4 TYR HE1 1 1 2 520 1 1 4 TYR HE2 H 8.939 13.316 -1.127 1.00 . A A . 4 TYR HE2 1 1 2 521 1 1 4 TYR HH H 11.175 12.794 -1.046 1.00 . A A . 4 TYR HH 1 1 2 522 1 1 4 TYR N N 6.482 8.107 0.564 1.00 . A A . 4 TYR N 1 1 2 523 1 1 4 TYR O O 4.851 10.195 -1.801 1.00 . A A . 4 TYR O 1 1 2 524 1 1 4 TYR OH O 11.226 12.404 -0.170 1.00 . A A . 4 TYR OH 1 1 2 525 1 1 5 THR C C 6.237 8.782 -4.033 1.00 . A A . 5 THR C 1 1 2 526 1 1 5 THR CA C 7.213 9.567 -3.154 1.00 . A A . 5 THR CA 1 1 2 527 1 1 5 THR CB C 8.661 9.144 -3.452 1.00 . A A . 5 THR CB 1 1 2 528 1 1 5 THR CG2 C 9.022 9.410 -4.923 1.00 . A A . 5 THR CG2 1 1 2 529 1 1 5 THR H H 7.600 8.856 -1.205 1.00 . A A . 5 THR H 1 1 2 530 1 1 5 THR HA H 7.103 10.623 -3.354 1.00 . A A . 5 THR HA 1 1 2 531 1 1 5 THR HB H 8.780 8.092 -3.237 1.00 . A A . 5 THR HB 1 1 2 532 1 1 5 THR HG1 H 10.096 9.277 -2.148 1.00 . A A . 5 THR HG1 1 1 2 533 1 1 5 THR HG21 H 8.488 8.723 -5.563 1.00 . A A . 5 THR HG21 1 1 2 534 1 1 5 THR HG22 H 10.084 9.271 -5.056 1.00 . A A . 5 THR HG22 1 1 2 535 1 1 5 THR HG23 H 8.761 10.426 -5.185 1.00 . A A . 5 THR HG23 1 1 2 536 1 1 5 THR N N 6.923 9.304 -1.752 1.00 . A A . 5 THR N 1 1 2 537 1 1 5 THR O O 5.705 9.302 -5.011 1.00 . A A . 5 THR O 1 1 2 538 1 1 5 THR OG1 O 9.540 9.897 -2.627 1.00 . A A . 5 THR OG1 1 1 2 539 1 1 6 ILE C C 3.671 7.244 -4.325 1.00 . A A . 6 ILE C 1 1 2 540 1 1 6 ILE CA C 5.080 6.655 -4.395 1.00 . A A . 6 ILE CA 1 1 2 541 1 1 6 ILE CB C 5.105 5.206 -3.810 1.00 . A A . 6 ILE CB 1 1 2 542 1 1 6 ILE CD1 C 7.663 5.249 -3.519 1.00 . A A . 6 ILE CD1 1 1 2 543 1 1 6 ILE CG1 C 6.462 4.517 -4.139 1.00 . A A . 6 ILE CG1 1 1 2 544 1 1 6 ILE CG2 C 3.950 4.342 -4.408 1.00 . A A . 6 ILE CG2 1 1 2 545 1 1 6 ILE H H 6.445 7.179 -2.860 1.00 . A A . 6 ILE H 1 1 2 546 1 1 6 ILE HA H 5.386 6.620 -5.433 1.00 . A A . 6 ILE HA 1 1 2 547 1 1 6 ILE HB H 4.988 5.259 -2.732 1.00 . A A . 6 ILE HB 1 1 2 548 1 1 6 ILE HD11 H 8.007 6.007 -4.205 1.00 . A A . 6 ILE HD11 1 1 2 549 1 1 6 ILE HD12 H 8.453 4.537 -3.347 1.00 . A A . 6 ILE HD12 1 1 2 550 1 1 6 ILE HD13 H 7.397 5.704 -2.581 1.00 . A A . 6 ILE HD13 1 1 2 551 1 1 6 ILE HG12 H 6.447 3.506 -3.761 1.00 . A A . 6 ILE HG12 1 1 2 552 1 1 6 ILE HG13 H 6.586 4.488 -5.210 1.00 . A A . 6 ILE HG13 1 1 2 553 1 1 6 ILE HG21 H 2.998 4.670 -4.012 1.00 . A A . 6 ILE HG21 1 1 2 554 1 1 6 ILE HG22 H 4.093 3.301 -4.150 1.00 . A A . 6 ILE HG22 1 1 2 555 1 1 6 ILE HG23 H 3.941 4.443 -5.485 1.00 . A A . 6 ILE HG23 1 1 2 556 1 1 6 ILE N N 6.002 7.523 -3.656 1.00 . A A . 6 ILE N 1 1 2 557 1 1 6 ILE O O 2.957 7.280 -5.325 1.00 . A A . 6 ILE O 1 1 2 558 1 1 7 LYS C C 1.760 9.475 -3.884 1.00 . A A . 7 LYS C 1 1 2 559 1 1 7 LYS CA C 1.951 8.282 -2.956 1.00 . A A . 7 LYS CA 1 1 2 560 1 1 7 LYS CB C 1.803 8.735 -1.488 1.00 . A A . 7 LYS CB 1 1 2 561 1 1 7 LYS CD C 0.259 9.719 0.244 1.00 . A A . 7 LYS CD 1 1 2 562 1 1 7 LYS CE C -1.128 10.330 0.480 1.00 . A A . 7 LYS CE 1 1 2 563 1 1 7 LYS CG C 0.411 9.342 -1.238 1.00 . A A . 7 LYS CG 1 1 2 564 1 1 7 LYS H H 3.889 7.647 -2.376 1.00 . A A . 7 LYS H 1 1 2 565 1 1 7 LYS HA H 1.202 7.537 -3.171 1.00 . A A . 7 LYS HA 1 1 2 566 1 1 7 LYS HB2 H 1.944 7.881 -0.841 1.00 . A A . 7 LYS HB2 1 1 2 567 1 1 7 LYS HB3 H 2.557 9.474 -1.267 1.00 . A A . 7 LYS HB3 1 1 2 568 1 1 7 LYS HD2 H 0.371 8.834 0.852 1.00 . A A . 7 LYS HD2 1 1 2 569 1 1 7 LYS HD3 H 1.017 10.439 0.512 1.00 . A A . 7 LYS HD3 1 1 2 570 1 1 7 LYS HE2 H -1.232 11.225 -0.120 1.00 . A A . 7 LYS HE2 1 1 2 571 1 1 7 LYS HE3 H -1.890 9.617 0.200 1.00 . A A . 7 LYS HE3 1 1 2 572 1 1 7 LYS HG2 H 0.285 10.233 -1.837 1.00 . A A . 7 LYS HG2 1 1 2 573 1 1 7 LYS HG3 H -0.339 8.623 -1.506 1.00 . A A . 7 LYS HG3 1 1 2 574 1 1 7 LYS HZ1 H -1.148 9.828 2.501 1.00 . A A . 7 LYS HZ1 1 1 2 575 1 1 7 LYS HZ2 H -2.233 11.065 2.083 1.00 . A A . 7 LYS HZ2 1 1 2 576 1 1 7 LYS HZ3 H -0.569 11.391 2.184 1.00 . A A . 7 LYS HZ3 1 1 2 577 1 1 7 LYS N N 3.279 7.702 -3.139 1.00 . A A . 7 LYS N 1 1 2 578 1 1 7 LYS NZ N -1.281 10.680 1.921 1.00 . A A . 7 LYS NZ 1 1 2 579 1 1 7 LYS O O 0.766 9.570 -4.604 1.00 . A A . 7 LYS O 1 1 2 580 1 1 8 LEU C C 2.773 11.208 -6.141 1.00 . A A . 8 LEU C 1 1 2 581 1 1 8 LEU CA C 2.678 11.582 -4.669 1.00 . A A . 8 LEU CA 1 1 2 582 1 1 8 LEU CB C 3.834 12.533 -4.264 1.00 . A A . 8 LEU CB 1 1 2 583 1 1 8 LEU CD1 C 2.395 14.659 -3.926 1.00 . A A . 8 LEU CD1 1 1 2 584 1 1 8 LEU CD2 C 4.839 14.842 -4.570 1.00 . A A . 8 LEU CD2 1 1 2 585 1 1 8 LEU CG C 3.559 13.998 -4.734 1.00 . A A . 8 LEU CG 1 1 2 586 1 1 8 LEU H H 3.479 10.241 -3.254 1.00 . A A . 8 LEU H 1 1 2 587 1 1 8 LEU HA H 1.733 12.069 -4.501 1.00 . A A . 8 LEU HA 1 1 2 588 1 1 8 LEU HB2 H 3.941 12.508 -3.194 1.00 . A A . 8 LEU HB2 1 1 2 589 1 1 8 LEU HB3 H 4.760 12.178 -4.706 1.00 . A A . 8 LEU HB3 1 1 2 590 1 1 8 LEU HD11 H 2.455 14.380 -2.881 1.00 . A A . 8 LEU HD11 1 1 2 591 1 1 8 LEU HD12 H 1.445 14.344 -4.324 1.00 . A A . 8 LEU HD12 1 1 2 592 1 1 8 LEU HD13 H 2.451 15.738 -4.003 1.00 . A A . 8 LEU HD13 1 1 2 593 1 1 8 LEU HD21 H 5.124 14.864 -3.530 1.00 . A A . 8 LEU HD21 1 1 2 594 1 1 8 LEU HD22 H 4.645 15.850 -4.911 1.00 . A A . 8 LEU HD22 1 1 2 595 1 1 8 LEU HD23 H 5.637 14.413 -5.157 1.00 . A A . 8 LEU HD23 1 1 2 596 1 1 8 LEU HG H 3.289 13.979 -5.781 1.00 . A A . 8 LEU HG 1 1 2 597 1 1 8 LEU N N 2.723 10.382 -3.848 1.00 . A A . 8 LEU N 1 1 2 598 1 1 8 LEU O O 2.107 11.783 -6.991 1.00 . A A . 8 LEU O 1 1 2 599 1 1 9 ALA C C 2.484 9.414 -8.459 1.00 . A A . 9 ALA C 1 1 2 600 1 1 9 ALA CA C 3.821 9.810 -7.818 1.00 . A A . 9 ALA CA 1 1 2 601 1 1 9 ALA CB C 4.794 8.626 -7.881 1.00 . A A . 9 ALA CB 1 1 2 602 1 1 9 ALA H H 4.149 9.831 -5.721 1.00 . A A . 9 ALA H 1 1 2 603 1 1 9 ALA HA H 4.241 10.634 -8.364 1.00 . A A . 9 ALA HA 1 1 2 604 1 1 9 ALA HB1 H 5.735 8.909 -7.437 1.00 . A A . 9 ALA HB1 1 1 2 605 1 1 9 ALA HB2 H 4.955 8.344 -8.912 1.00 . A A . 9 ALA HB2 1 1 2 606 1 1 9 ALA HB3 H 4.377 7.788 -7.341 1.00 . A A . 9 ALA HB3 1 1 2 607 1 1 9 ALA N N 3.629 10.242 -6.437 1.00 . A A . 9 ALA N 1 1 2 608 1 1 9 ALA O O 2.193 9.793 -9.591 1.00 . A A . 9 ALA O 1 1 2 609 1 1 10 LYS C C -0.538 9.471 -8.400 1.00 . A A . 10 LYS C 1 1 2 610 1 1 10 LYS CA C 0.355 8.245 -8.195 1.00 . A A . 10 LYS CA 1 1 2 611 1 1 10 LYS CB C -0.286 7.284 -7.167 1.00 . A A . 10 LYS CB 1 1 2 612 1 1 10 LYS CD C -0.314 4.887 -6.277 1.00 . A A . 10 LYS CD 1 1 2 613 1 1 10 LYS CE C -0.254 5.274 -4.784 1.00 . A A . 10 LYS CE 1 1 2 614 1 1 10 LYS CG C 0.438 5.911 -7.167 1.00 . A A . 10 LYS CG 1 1 2 615 1 1 10 LYS H H 1.954 8.409 -6.809 1.00 . A A . 10 LYS H 1 1 2 616 1 1 10 LYS HA H 0.459 7.744 -9.147 1.00 . A A . 10 LYS HA 1 1 2 617 1 1 10 LYS HB2 H -0.204 7.732 -6.188 1.00 . A A . 10 LYS HB2 1 1 2 618 1 1 10 LYS HB3 H -1.324 7.142 -7.400 1.00 . A A . 10 LYS HB3 1 1 2 619 1 1 10 LYS HD2 H -1.347 4.829 -6.593 1.00 . A A . 10 LYS HD2 1 1 2 620 1 1 10 LYS HD3 H 0.141 3.913 -6.402 1.00 . A A . 10 LYS HD3 1 1 2 621 1 1 10 LYS HE2 H 0.757 5.537 -4.510 1.00 . A A . 10 LYS HE2 1 1 2 622 1 1 10 LYS HE3 H -0.910 6.111 -4.591 1.00 . A A . 10 LYS HE3 1 1 2 623 1 1 10 LYS HG2 H 0.477 5.529 -8.179 1.00 . A A . 10 LYS HG2 1 1 2 624 1 1 10 LYS HG3 H 1.444 6.034 -6.799 1.00 . A A . 10 LYS HG3 1 1 2 625 1 1 10 LYS HZ1 H -0.253 4.158 -3.025 1.00 . A A . 10 LYS HZ1 1 1 2 626 1 1 10 LYS HZ2 H -0.411 3.228 -4.437 1.00 . A A . 10 LYS HZ2 1 1 2 627 1 1 10 LYS HZ3 H -1.730 4.131 -3.860 1.00 . A A . 10 LYS HZ3 1 1 2 628 1 1 10 LYS N N 1.671 8.666 -7.711 1.00 . A A . 10 LYS N 1 1 2 629 1 1 10 LYS NZ N -0.696 4.110 -3.965 1.00 . A A . 10 LYS NZ 1 1 2 630 1 1 10 LYS O O -1.226 9.590 -9.414 1.00 . A A . 10 LYS O 1 1 2 631 1 1 11 PHE C C -0.930 12.382 -8.762 1.00 . A A . 11 PHE C 1 1 2 632 1 1 11 PHE CA C -1.302 11.613 -7.498 1.00 . A A . 11 PHE CA 1 1 2 633 1 1 11 PHE CB C -1.007 12.454 -6.246 1.00 . A A . 11 PHE CB 1 1 2 634 1 1 11 PHE CD1 C -3.218 13.688 -6.103 1.00 . A A . 11 PHE CD1 1 1 2 635 1 1 11 PHE CD2 C -1.185 15.009 -6.316 1.00 . A A . 11 PHE CD2 1 1 2 636 1 1 11 PHE CE1 C -3.972 14.866 -6.063 1.00 . A A . 11 PHE CE1 1 1 2 637 1 1 11 PHE CE2 C -1.947 16.182 -6.277 1.00 . A A . 11 PHE CE2 1 1 2 638 1 1 11 PHE CG C -1.820 13.749 -6.231 1.00 . A A . 11 PHE CG 1 1 2 639 1 1 11 PHE CZ C -3.339 16.110 -6.150 1.00 . A A . 11 PHE CZ 1 1 2 640 1 1 11 PHE H H 0.065 10.218 -6.655 1.00 . A A . 11 PHE H 1 1 2 641 1 1 11 PHE HA H -2.351 11.362 -7.524 1.00 . A A . 11 PHE HA 1 1 2 642 1 1 11 PHE HB2 H -1.257 11.873 -5.379 1.00 . A A . 11 PHE HB2 1 1 2 643 1 1 11 PHE HB3 H 0.044 12.680 -6.214 1.00 . A A . 11 PHE HB3 1 1 2 644 1 1 11 PHE HD1 H -3.715 12.731 -6.035 1.00 . A A . 11 PHE HD1 1 1 2 645 1 1 11 PHE HD2 H -0.107 15.075 -6.415 1.00 . A A . 11 PHE HD2 1 1 2 646 1 1 11 PHE HE1 H -5.047 14.814 -5.965 1.00 . A A . 11 PHE HE1 1 1 2 647 1 1 11 PHE HE2 H -1.461 17.144 -6.345 1.00 . A A . 11 PHE HE2 1 1 2 648 1 1 11 PHE HZ H -3.926 17.016 -6.119 1.00 . A A . 11 PHE HZ 1 1 2 649 1 1 11 PHE N N -0.508 10.379 -7.431 1.00 . A A . 11 PHE N 1 1 2 650 1 1 11 PHE O O -1.791 12.792 -9.541 1.00 . A A . 11 PHE O 1 1 2 651 1 1 12 LEU C C 0.552 12.363 -11.395 1.00 . A A . 12 LEU C 1 1 2 652 1 1 12 LEU CA C 0.901 13.188 -10.157 1.00 . A A . 12 LEU CA 1 1 2 653 1 1 12 LEU CB C 2.434 13.312 -10.041 1.00 . A A . 12 LEU CB 1 1 2 654 1 1 12 LEU CD1 C 4.345 14.137 -8.600 1.00 . A A . 12 LEU CD1 1 1 2 655 1 1 12 LEU CD2 C 2.499 15.753 -9.215 1.00 . A A . 12 LEU CD2 1 1 2 656 1 1 12 LEU CG C 2.834 14.271 -8.878 1.00 . A A . 12 LEU CG 1 1 2 657 1 1 12 LEU H H 0.992 12.137 -8.312 1.00 . A A . 12 LEU H 1 1 2 658 1 1 12 LEU HA H 0.462 14.164 -10.262 1.00 . A A . 12 LEU HA 1 1 2 659 1 1 12 LEU HB2 H 2.838 12.326 -9.852 1.00 . A A . 12 LEU HB2 1 1 2 660 1 1 12 LEU HB3 H 2.842 13.684 -10.973 1.00 . A A . 12 LEU HB3 1 1 2 661 1 1 12 LEU HD11 H 4.621 14.790 -7.785 1.00 . A A . 12 LEU HD11 1 1 2 662 1 1 12 LEU HD12 H 4.900 14.412 -9.484 1.00 . A A . 12 LEU HD12 1 1 2 663 1 1 12 LEU HD13 H 4.575 13.116 -8.334 1.00 . A A . 12 LEU HD13 1 1 2 664 1 1 12 LEU HD21 H 1.444 15.923 -9.075 1.00 . A A . 12 LEU HD21 1 1 2 665 1 1 12 LEU HD22 H 2.769 15.978 -10.235 1.00 . A A . 12 LEU HD22 1 1 2 666 1 1 12 LEU HD23 H 3.044 16.414 -8.552 1.00 . A A . 12 LEU HD23 1 1 2 667 1 1 12 LEU HG H 2.293 13.987 -7.989 1.00 . A A . 12 LEU HG 1 1 2 668 1 1 12 LEU N N 0.371 12.521 -8.967 1.00 . A A . 12 LEU N 1 1 2 669 1 1 12 LEU O O 0.206 12.911 -12.436 1.00 . A A . 12 LEU O 1 1 2 670 1 1 13 GLY C C -1.097 10.209 -12.775 1.00 . A A . 13 GLY C 1 1 2 671 1 1 13 GLY CA C 0.371 10.140 -12.382 1.00 . A A . 13 GLY CA 1 1 2 672 1 1 13 GLY H H 0.954 10.668 -10.415 1.00 . A A . 13 GLY H 1 1 2 673 1 1 13 GLY HA2 H 0.978 10.414 -13.229 1.00 . A A . 13 GLY HA2 1 1 2 674 1 1 13 GLY HA3 H 0.612 9.143 -12.099 1.00 . A A . 13 GLY HA3 1 1 2 675 1 1 13 GLY N N 0.664 11.043 -11.271 1.00 . A A . 13 GLY N 1 1 2 676 1 1 13 GLY O O -1.485 9.802 -13.867 1.00 . A A . 13 GLY O 1 1 2 677 1 1 14 GLY C C -3.550 12.181 -12.938 1.00 . A A . 14 GLY C 1 1 2 678 1 1 14 GLY CA C -3.349 10.891 -12.155 1.00 . A A . 14 GLY CA 1 1 2 679 1 1 14 GLY H H -1.559 11.047 -11.021 1.00 . A A . 14 GLY H 1 1 2 680 1 1 14 GLY HA2 H -3.725 10.047 -12.726 1.00 . A A . 14 GLY HA2 1 1 2 681 1 1 14 GLY HA3 H -3.887 10.959 -11.223 1.00 . A A . 14 GLY HA3 1 1 2 682 1 1 14 GLY N N -1.920 10.736 -11.878 1.00 . A A . 14 GLY N 1 1 2 683 1 1 14 GLY O O -4.281 12.233 -13.927 1.00 . A A . 14 GLY O 1 1 2 684 1 1 15 ILE C C -2.192 14.572 -14.408 1.00 . A A . 15 ILE C 1 1 2 685 1 1 15 ILE CA C -2.908 14.552 -13.060 1.00 . A A . 15 ILE CA 1 1 2 686 1 1 15 ILE CB C -2.236 15.555 -12.085 1.00 . A A . 15 ILE CB 1 1 2 687 1 1 15 ILE CD1 C -2.277 16.369 -9.686 1.00 . A A . 15 ILE CD1 1 1 2 688 1 1 15 ILE CG1 C -3.066 15.628 -10.771 1.00 . A A . 15 ILE CG1 1 1 2 689 1 1 15 ILE CG2 C -2.140 16.975 -12.723 1.00 . A A . 15 ILE CG2 1 1 2 690 1 1 15 ILE H H -2.301 13.086 -11.676 1.00 . A A . 15 ILE H 1 1 2 691 1 1 15 ILE HA H -3.939 14.841 -13.214 1.00 . A A . 15 ILE HA 1 1 2 692 1 1 15 ILE HB H -1.237 15.199 -11.861 1.00 . A A . 15 ILE HB 1 1 2 693 1 1 15 ILE HD11 H -1.390 15.801 -9.443 1.00 . A A . 15 ILE HD11 1 1 2 694 1 1 15 ILE HD12 H -2.893 16.474 -8.811 1.00 . A A . 15 ILE HD12 1 1 2 695 1 1 15 ILE HD13 H -1.992 17.347 -10.043 1.00 . A A . 15 ILE HD13 1 1 2 696 1 1 15 ILE HG12 H -3.999 16.146 -10.953 1.00 . A A . 15 ILE HG12 1 1 2 697 1 1 15 ILE HG13 H -3.284 14.628 -10.417 1.00 . A A . 15 ILE HG13 1 1 2 698 1 1 15 ILE HG21 H -1.818 17.692 -11.980 1.00 . A A . 15 ILE HG21 1 1 2 699 1 1 15 ILE HG22 H -3.108 17.268 -13.101 1.00 . A A . 15 ILE HG22 1 1 2 700 1 1 15 ILE HG23 H -1.427 16.968 -13.534 1.00 . A A . 15 ILE HG23 1 1 2 701 1 1 15 ILE N N -2.867 13.220 -12.463 1.00 . A A . 15 ILE N 1 1 2 702 1 1 15 ILE O O -2.635 15.243 -15.338 1.00 . A A . 15 ILE O 1 1 2 703 1 1 16 VAL C C -1.134 13.555 -16.937 1.00 . A A . 16 VAL C 1 1 2 704 1 1 16 VAL CA C -0.257 13.920 -15.732 1.00 . A A . 16 VAL CA 1 1 2 705 1 1 16 VAL CB C 0.982 12.972 -15.604 1.00 . A A . 16 VAL CB 1 1 2 706 1 1 16 VAL CG1 C 0.591 11.493 -15.813 1.00 . A A . 16 VAL CG1 1 1 2 707 1 1 16 VAL CG2 C 2.062 13.353 -16.638 1.00 . A A . 16 VAL CG2 1 1 2 708 1 1 16 VAL H H -0.703 13.407 -13.715 1.00 . A A . 16 VAL H 1 1 2 709 1 1 16 VAL HA H 0.089 14.937 -15.858 1.00 . A A . 16 VAL HA 1 1 2 710 1 1 16 VAL HB H 1.394 13.075 -14.605 1.00 . A A . 16 VAL HB 1 1 2 711 1 1 16 VAL HG11 H 1.426 10.857 -15.557 1.00 . A A . 16 VAL HG11 1 1 2 712 1 1 16 VAL HG12 H 0.316 11.315 -16.844 1.00 . A A . 16 VAL HG12 1 1 2 713 1 1 16 VAL HG13 H -0.241 11.263 -15.180 1.00 . A A . 16 VAL HG13 1 1 2 714 1 1 16 VAL HG21 H 1.648 13.272 -17.633 1.00 . A A . 16 VAL HG21 1 1 2 715 1 1 16 VAL HG22 H 2.908 12.686 -16.543 1.00 . A A . 16 VAL HG22 1 1 2 716 1 1 16 VAL HG23 H 2.387 14.368 -16.465 1.00 . A A . 16 VAL HG23 1 1 2 717 1 1 16 VAL N N -1.045 13.892 -14.497 1.00 . A A . 16 VAL N 1 1 2 718 1 1 16 VAL O O -1.089 14.209 -17.978 1.00 . A A . 16 VAL O 1 1 2 719 1 1 17 ARG C C -3.937 13.134 -18.016 1.00 . A A . 17 ARG C 1 1 2 720 1 1 17 ARG CA C -2.856 12.072 -17.803 1.00 . A A . 17 ARG CA 1 1 2 721 1 1 17 ARG CB C -3.478 10.730 -17.378 1.00 . A A . 17 ARG CB 1 1 2 722 1 1 17 ARG CD C -3.687 9.767 -19.747 1.00 . A A . 17 ARG CD 1 1 2 723 1 1 17 ARG CG C -4.439 10.154 -18.448 1.00 . A A . 17 ARG CG 1 1 2 724 1 1 17 ARG CZ C -1.571 8.693 -20.370 1.00 . A A . 17 ARG CZ 1 1 2 725 1 1 17 ARG H H -1.945 12.048 -15.903 1.00 . A A . 17 ARG H 1 1 2 726 1 1 17 ARG HA H -2.302 11.937 -18.717 1.00 . A A . 17 ARG HA 1 1 2 727 1 1 17 ARG HB2 H -2.688 10.021 -17.190 1.00 . A A . 17 ARG HB2 1 1 2 728 1 1 17 ARG HB3 H -4.029 10.883 -16.457 1.00 . A A . 17 ARG HB3 1 1 2 729 1 1 17 ARG HD2 H -4.340 9.170 -20.370 1.00 . A A . 17 ARG HD2 1 1 2 730 1 1 17 ARG HD3 H -3.414 10.659 -20.295 1.00 . A A . 17 ARG HD3 1 1 2 731 1 1 17 ARG HE H -2.356 8.655 -18.525 1.00 . A A . 17 ARG HE 1 1 2 732 1 1 17 ARG HG2 H -4.908 9.271 -18.039 1.00 . A A . 17 ARG HG2 1 1 2 733 1 1 17 ARG HG3 H -5.208 10.877 -18.678 1.00 . A A . 17 ARG HG3 1 1 2 734 1 1 17 ARG HH11 H -2.511 9.678 -21.840 1.00 . A A . 17 ARG HH11 1 1 2 735 1 1 17 ARG HH12 H -1.024 8.909 -22.285 1.00 . A A . 17 ARG HH12 1 1 2 736 1 1 17 ARG HH21 H -0.417 7.644 -19.115 1.00 . A A . 17 ARG HH21 1 1 2 737 1 1 17 ARG HH22 H 0.159 7.759 -20.744 1.00 . A A . 17 ARG HH22 1 1 2 738 1 1 17 ARG N N -1.945 12.517 -16.763 1.00 . A A . 17 ARG N 1 1 2 739 1 1 17 ARG NE N -2.486 8.983 -19.439 1.00 . A A . 17 ARG NE 1 1 2 740 1 1 17 ARG NH1 N -1.713 9.126 -21.594 1.00 . A A . 17 ARG NH1 1 1 2 741 1 1 17 ARG NH2 N -0.529 7.975 -20.052 1.00 . A A . 17 ARG NH2 1 1 2 742 1 1 17 ARG O O -4.356 13.391 -19.145 1.00 . A A . 17 ARG O 1 1 2 743 1 1 18 ALA C C -4.985 15.952 -17.823 1.00 . A A . 18 ALA C 1 1 2 744 1 1 18 ALA CA C -5.439 14.761 -16.977 1.00 . A A . 18 ALA CA 1 1 2 745 1 1 18 ALA CB C -5.802 15.239 -15.556 1.00 . A A . 18 ALA CB 1 1 2 746 1 1 18 ALA H H -4.025 13.484 -16.042 1.00 . A A . 18 ALA H 1 1 2 747 1 1 18 ALA HA H -6.315 14.326 -17.425 1.00 . A A . 18 ALA HA 1 1 2 748 1 1 18 ALA HB1 H -6.707 15.832 -15.590 1.00 . A A . 18 ALA HB1 1 1 2 749 1 1 18 ALA HB2 H -5.000 15.840 -15.153 1.00 . A A . 18 ALA HB2 1 1 2 750 1 1 18 ALA HB3 H -5.960 14.381 -14.919 1.00 . A A . 18 ALA HB3 1 1 2 751 1 1 18 ALA N N -4.393 13.737 -16.913 1.00 . A A . 18 ALA N 1 1 2 752 1 1 18 ALA O O -5.758 16.503 -18.606 1.00 . A A . 18 ALA O 1 1 2 753 1 1 19 MET C C -3.162 17.192 -19.882 1.00 . A A . 19 MET C 1 1 2 754 1 1 19 MET CA C -3.157 17.461 -18.379 1.00 . A A . 19 MET CA 1 1 2 755 1 1 19 MET CB C -1.703 17.631 -17.903 1.00 . A A . 19 MET CB 1 1 2 756 1 1 19 MET CE C 0.731 19.584 -17.173 1.00 . A A . 19 MET CE 1 1 2 757 1 1 19 MET CG C -1.650 18.319 -16.530 1.00 . A A . 19 MET CG 1 1 2 758 1 1 19 MET H H -3.159 15.866 -17.013 1.00 . A A . 19 MET H 1 1 2 759 1 1 19 MET HA H -3.722 18.360 -18.174 1.00 . A A . 19 MET HA 1 1 2 760 1 1 19 MET HB2 H -1.243 16.657 -17.821 1.00 . A A . 19 MET HB2 1 1 2 761 1 1 19 MET HB3 H -1.161 18.205 -18.616 1.00 . A A . 19 MET HB3 1 1 2 762 1 1 19 MET HE1 H 1.050 19.045 -18.055 1.00 . A A . 19 MET HE1 1 1 2 763 1 1 19 MET HE2 H 1.578 20.099 -16.751 1.00 . A A . 19 MET HE2 1 1 2 764 1 1 19 MET HE3 H -0.026 20.308 -17.439 1.00 . A A . 19 MET HE3 1 1 2 765 1 1 19 MET HG2 H -2.063 19.312 -16.610 1.00 . A A . 19 MET HG2 1 1 2 766 1 1 19 MET HG3 H -2.234 17.747 -15.823 1.00 . A A . 19 MET HG3 1 1 2 767 1 1 19 MET N N -3.725 16.341 -17.650 1.00 . A A . 19 MET N 1 1 2 768 1 1 19 MET O O -3.609 18.014 -20.679 1.00 . A A . 19 MET O 1 1 2 769 1 1 19 MET SD S 0.072 18.409 -15.953 1.00 . A A . 19 MET SD 1 1 2 770 1 1 20 LEU C C -3.970 15.542 -22.229 1.00 . A A . 20 LEU C 1 1 2 771 1 1 20 LEU CA C -2.566 15.638 -21.650 1.00 . A A . 20 LEU CA 1 1 2 772 1 1 20 LEU CB C -1.888 14.263 -21.749 1.00 . A A . 20 LEU CB 1 1 2 773 1 1 20 LEU CD1 C 0.165 12.890 -21.230 1.00 . A A . 20 LEU CD1 1 1 2 774 1 1 20 LEU CD2 C 0.448 15.176 -22.295 1.00 . A A . 20 LEU CD2 1 1 2 775 1 1 20 LEU CG C -0.401 14.325 -21.309 1.00 . A A . 20 LEU CG 1 1 2 776 1 1 20 LEU H H -2.289 15.440 -19.557 1.00 . A A . 20 LEU H 1 1 2 777 1 1 20 LEU HA H -2.006 16.365 -22.208 1.00 . A A . 20 LEU HA 1 1 2 778 1 1 20 LEU HB2 H -2.414 13.582 -21.110 1.00 . A A . 20 LEU HB2 1 1 2 779 1 1 20 LEU HB3 H -1.950 13.906 -22.761 1.00 . A A . 20 LEU HB3 1 1 2 780 1 1 20 LEU HD11 H -0.386 12.328 -20.491 1.00 . A A . 20 LEU HD11 1 1 2 781 1 1 20 LEU HD12 H 1.207 12.928 -20.946 1.00 . A A . 20 LEU HD12 1 1 2 782 1 1 20 LEU HD13 H 0.071 12.409 -22.192 1.00 . A A . 20 LEU HD13 1 1 2 783 1 1 20 LEU HD21 H 1.494 14.909 -22.212 1.00 . A A . 20 LEU HD21 1 1 2 784 1 1 20 LEU HD22 H 0.342 16.217 -22.047 1.00 . A A . 20 LEU HD22 1 1 2 785 1 1 20 LEU HD23 H 0.119 15.014 -23.312 1.00 . A A . 20 LEU HD23 1 1 2 786 1 1 20 LEU HG H -0.349 14.768 -20.322 1.00 . A A . 20 LEU HG 1 1 2 787 1 1 20 LEU N N -2.643 16.035 -20.248 1.00 . A A . 20 LEU N 1 1 2 788 1 1 20 LEU O O -4.235 15.980 -23.348 1.00 . A A . 20 LEU O 1 1 2 789 1 1 21 GLY C C -6.911 16.166 -21.970 1.00 . A A . 21 GLY C 1 1 2 790 1 1 21 GLY CA C -6.249 14.805 -21.841 1.00 . A A . 21 GLY CA 1 1 2 791 1 1 21 GLY H H -4.564 14.654 -20.553 1.00 . A A . 21 GLY H 1 1 2 792 1 1 21 GLY HA2 H -6.298 14.286 -22.791 1.00 . A A . 21 GLY HA2 1 1 2 793 1 1 21 GLY HA3 H -6.772 14.228 -21.093 1.00 . A A . 21 GLY HA3 1 1 2 794 1 1 21 GLY N N -4.856 14.966 -21.438 1.00 . A A . 21 GLY N 1 1 2 795 1 1 21 GLY O O -7.791 16.372 -22.806 1.00 . A A . 21 GLY O 1 1 2 796 1 1 22 SER C C -6.513 19.256 -22.307 1.00 . A A . 22 SER C 1 1 2 797 1 1 22 SER CA C -7.013 18.457 -21.107 1.00 . A A . 22 SER CA 1 1 2 798 1 1 22 SER CB C -6.607 19.173 -19.816 1.00 . A A . 22 SER CB 1 1 2 799 1 1 22 SER H H -5.761 16.848 -20.485 1.00 . A A . 22 SER H 1 1 2 800 1 1 22 SER HA H -8.095 18.415 -21.147 1.00 . A A . 22 SER HA 1 1 2 801 1 1 22 SER HB2 H -6.972 18.624 -18.965 1.00 . A A . 22 SER HB2 1 1 2 802 1 1 22 SER HB3 H -5.529 19.240 -19.761 1.00 . A A . 22 SER HB3 1 1 2 803 1 1 22 SER HG H -8.099 20.396 -19.566 1.00 . A A . 22 SER HG 1 1 2 804 1 1 22 SER N N -6.473 17.092 -21.119 1.00 . A A . 22 SER N 1 1 2 805 1 1 22 SER O O -7.174 20.193 -22.757 1.00 . A A . 22 SER O 1 1 2 806 1 1 22 SER OG O -7.174 20.478 -19.807 1.00 . A A . 22 SER OG 1 1 2 807 1 1 23 PHE C C -5.668 19.550 -25.172 1.00 . A A . 23 PHE C 1 1 2 808 1 1 23 PHE CA C -4.747 19.609 -23.950 1.00 . A A . 23 PHE CA 1 1 2 809 1 1 23 PHE CB C -3.377 18.998 -24.300 1.00 . A A . 23 PHE CB 1 1 2 810 1 1 23 PHE CD1 C -1.936 20.939 -25.094 1.00 . A A . 23 PHE CD1 1 1 2 811 1 1 23 PHE CD2 C -2.874 19.437 -26.758 1.00 . A A . 23 PHE CD2 1 1 2 812 1 1 23 PHE CE1 C -1.335 21.688 -26.113 1.00 . A A . 23 PHE CE1 1 1 2 813 1 1 23 PHE CE2 C -2.270 20.190 -27.772 1.00 . A A . 23 PHE CE2 1 1 2 814 1 1 23 PHE CG C -2.708 19.810 -25.412 1.00 . A A . 23 PHE CG 1 1 2 815 1 1 23 PHE CZ C -1.501 21.314 -27.450 1.00 . A A . 23 PHE CZ 1 1 2 816 1 1 23 PHE H H -4.843 18.153 -22.406 1.00 . A A . 23 PHE H 1 1 2 817 1 1 23 PHE HA H -4.605 20.644 -23.671 1.00 . A A . 23 PHE HA 1 1 2 818 1 1 23 PHE HB2 H -2.752 19.005 -23.415 1.00 . A A . 23 PHE HB2 1 1 2 819 1 1 23 PHE HB3 H -3.513 17.973 -24.623 1.00 . A A . 23 PHE HB3 1 1 2 820 1 1 23 PHE HD1 H -1.804 21.229 -24.062 1.00 . A A . 23 PHE HD1 1 1 2 821 1 1 23 PHE HD2 H -3.467 18.571 -27.011 1.00 . A A . 23 PHE HD2 1 1 2 822 1 1 23 PHE HE1 H -0.742 22.556 -25.865 1.00 . A A . 23 PHE HE1 1 1 2 823 1 1 23 PHE HE2 H -2.398 19.902 -28.805 1.00 . A A . 23 PHE HE2 1 1 2 824 1 1 23 PHE HZ H -1.036 21.893 -28.234 1.00 . A A . 23 PHE HZ 1 1 2 825 1 1 23 PHE N N -5.334 18.898 -22.813 1.00 . A A . 23 PHE N 1 1 2 826 1 1 23 PHE O O -5.907 20.569 -25.822 1.00 . A A . 23 PHE O 1 1 2 827 1 1 24 ARG C C -8.531 18.015 -26.178 1.00 . A A . 24 ARG C 1 1 2 828 1 1 24 ARG CA C -7.075 18.140 -26.636 1.00 . A A . 24 ARG CA 1 1 2 829 1 1 24 ARG CB C -6.640 16.869 -27.397 1.00 . A A . 24 ARG CB 1 1 2 830 1 1 24 ARG CD C -6.204 14.396 -27.250 1.00 . A A . 24 ARG CD 1 1 2 831 1 1 24 ARG CG C -6.689 15.632 -26.480 1.00 . A A . 24 ARG CG 1 1 2 832 1 1 24 ARG CZ C -5.987 11.991 -26.849 1.00 . A A . 24 ARG CZ 1 1 2 833 1 1 24 ARG H H -5.941 17.579 -24.923 1.00 . A A . 24 ARG H 1 1 2 834 1 1 24 ARG HA H -7.003 18.980 -27.322 1.00 . A A . 24 ARG HA 1 1 2 835 1 1 24 ARG HB2 H -7.297 16.714 -28.240 1.00 . A A . 24 ARG HB2 1 1 2 836 1 1 24 ARG HB3 H -5.628 17.004 -27.757 1.00 . A A . 24 ARG HB3 1 1 2 837 1 1 24 ARG HD2 H -6.833 14.244 -28.116 1.00 . A A . 24 ARG HD2 1 1 2 838 1 1 24 ARG HD3 H -5.184 14.554 -27.572 1.00 . A A . 24 ARG HD3 1 1 2 839 1 1 24 ARG HE H -6.518 13.321 -25.449 1.00 . A A . 24 ARG HE 1 1 2 840 1 1 24 ARG HG2 H -6.054 15.794 -25.621 1.00 . A A . 24 ARG HG2 1 1 2 841 1 1 24 ARG HG3 H -7.701 15.458 -26.150 1.00 . A A . 24 ARG HG3 1 1 2 842 1 1 24 ARG HH11 H -5.595 12.595 -28.720 1.00 . A A . 24 ARG HH11 1 1 2 843 1 1 24 ARG HH12 H -5.442 10.894 -28.435 1.00 . A A . 24 ARG HH12 1 1 2 844 1 1 24 ARG HH21 H -6.314 11.098 -25.088 1.00 . A A . 24 ARG HH21 1 1 2 845 1 1 24 ARG HH22 H -5.849 10.048 -26.385 1.00 . A A . 24 ARG HH22 1 1 2 846 1 1 24 ARG N N -6.179 18.348 -25.481 1.00 . A A . 24 ARG N 1 1 2 847 1 1 24 ARG NE N -6.266 13.214 -26.390 1.00 . A A . 24 ARG NE 1 1 2 848 1 1 24 ARG NH1 N -5.648 11.813 -28.099 1.00 . A A . 24 ARG NH1 1 1 2 849 1 1 24 ARG NH2 N -6.055 10.966 -26.044 1.00 . A A . 24 ARG NH2 1 1 2 850 1 1 24 ARG O O -8.822 17.386 -25.160 1.00 . A A . 24 ARG O 1 1 2 851 1 1 25 LYS C C -11.369 17.126 -26.684 1.00 . A A . 25 LYS C 1 1 2 852 1 1 25 LYS CA C -10.870 18.570 -26.609 1.00 . A A . 25 LYS CA 1 1 2 853 1 1 25 LYS CB C -11.658 19.450 -27.600 1.00 . A A . 25 LYS CB 1 1 2 854 1 1 25 LYS CD C -11.936 21.842 -28.505 1.00 . A A . 25 LYS CD 1 1 2 855 1 1 25 LYS CE C -13.416 22.117 -28.170 1.00 . A A . 25 LYS CE 1 1 2 856 1 1 25 LYS CG C -11.257 20.936 -27.428 1.00 . A A . 25 LYS CG 1 1 2 857 1 1 25 LYS H H -9.156 19.108 -27.738 1.00 . A A . 25 LYS H 1 1 2 858 1 1 25 LYS HA H -11.022 18.943 -25.605 1.00 . A A . 25 LYS HA 1 1 2 859 1 1 25 LYS HB2 H -11.438 19.130 -28.609 1.00 . A A . 25 LYS HB2 1 1 2 860 1 1 25 LYS HB3 H -12.714 19.339 -27.412 1.00 . A A . 25 LYS HB3 1 1 2 861 1 1 25 LYS HD2 H -11.413 22.790 -28.549 1.00 . A A . 25 LYS HD2 1 1 2 862 1 1 25 LYS HD3 H -11.873 21.368 -29.476 1.00 . A A . 25 LYS HD3 1 1 2 863 1 1 25 LYS HE2 H -13.833 22.783 -28.914 1.00 . A A . 25 LYS HE2 1 1 2 864 1 1 25 LYS HE3 H -13.974 21.195 -28.175 1.00 . A A . 25 LYS HE3 1 1 2 865 1 1 25 LYS HG2 H -11.539 21.267 -26.438 1.00 . A A . 25 LYS HG2 1 1 2 866 1 1 25 LYS HG3 H -10.180 21.017 -27.527 1.00 . A A . 25 LYS HG3 1 1 2 867 1 1 25 LYS HZ1 H -14.502 23.056 -26.661 1.00 . A A . 25 LYS HZ1 1 1 2 868 1 1 25 LYS HZ2 H -12.894 23.587 -26.792 1.00 . A A . 25 LYS HZ2 1 1 2 869 1 1 25 LYS HZ3 H -13.238 22.078 -26.094 1.00 . A A . 25 LYS HZ3 1 1 2 870 1 1 25 LYS N N -9.445 18.620 -26.938 1.00 . A A . 25 LYS N 1 1 2 871 1 1 25 LYS NZ N -13.520 22.758 -26.828 1.00 . A A . 25 LYS NZ 1 1 2 872 1 1 25 LYS O O -12.130 16.674 -25.828 1.00 . A A . 25 LYS O 1 1 2 873 1 1 26 ASP C C -10.828 14.153 -26.756 1.00 . A A . 26 ASP C 1 1 2 874 1 1 26 ASP CA C -11.334 15.018 -27.911 1.00 . A A . 26 ASP CA 1 1 2 875 1 1 26 ASP CB C -10.773 14.500 -29.246 1.00 . A A . 26 ASP CB 1 1 2 876 1 1 26 ASP CG C -11.274 13.082 -29.529 1.00 . A A . 26 ASP CG 1 1 2 877 1 1 26 ASP H H -10.329 16.829 -28.368 1.00 . A A . 26 ASP H 1 1 2 878 1 1 26 ASP HA H -12.415 14.964 -27.942 1.00 . A A . 26 ASP HA 1 1 2 879 1 1 26 ASP HB2 H -11.097 15.155 -30.042 1.00 . A A . 26 ASP HB2 1 1 2 880 1 1 26 ASP HB3 H -9.693 14.498 -29.209 1.00 . A A . 26 ASP HB3 1 1 2 881 1 1 26 ASP N N -10.933 16.411 -27.719 1.00 . A A . 26 ASP N 1 1 2 882 1 1 26 ASP O O -11.608 13.882 -25.859 1.00 . A A . 26 ASP O 1 1 2 883 1 1 26 ASP OD1 O -12.473 12.870 -29.440 1.00 . A A . 26 ASP OD1 1 1 2 884 1 1 26 ASP OD2 O -10.452 12.234 -29.831 1.00 . A A . 26 ASP OD2 1 1 3 885 1 1 1 MET C C 11.071 4.688 0.286 1.00 . A A . 1 MET C 1 1 3 886 1 1 1 MET CA C 11.972 3.769 -0.540 1.00 . A A . 1 MET CA 1 1 3 887 1 1 1 MET CB C 11.193 3.206 -1.742 1.00 . A A . 1 MET CB 1 1 3 888 1 1 1 MET CE C 12.541 4.087 -4.672 1.00 . A A . 1 MET CE 1 1 3 889 1 1 1 MET CG C 12.094 2.291 -2.597 1.00 . A A . 1 MET CG 1 1 3 890 1 1 1 MET H1 H 13.295 2.228 -0.078 1.00 . A A . 1 MET H1 1 1 3 891 1 1 1 MET H2 H 11.685 1.914 0.360 1.00 . A A . 1 MET H2 1 1 3 892 1 1 1 MET H3 H 12.623 2.991 1.279 1.00 . A A . 1 MET H3 1 1 3 893 1 1 1 MET HA H 12.829 4.326 -0.885 1.00 . A A . 1 MET HA 1 1 3 894 1 1 1 MET HB2 H 10.349 2.636 -1.379 1.00 . A A . 1 MET HB2 1 1 3 895 1 1 1 MET HB3 H 10.832 4.021 -2.350 1.00 . A A . 1 MET HB3 1 1 3 896 1 1 1 MET HE1 H 12.012 4.935 -4.258 1.00 . A A . 1 MET HE1 1 1 3 897 1 1 1 MET HE2 H 11.836 3.414 -5.129 1.00 . A A . 1 MET HE2 1 1 3 898 1 1 1 MET HE3 H 13.240 4.430 -5.421 1.00 . A A . 1 MET HE3 1 1 3 899 1 1 1 MET HG2 H 12.513 1.517 -1.968 1.00 . A A . 1 MET HG2 1 1 3 900 1 1 1 MET HG3 H 11.503 1.826 -3.372 1.00 . A A . 1 MET HG3 1 1 3 901 1 1 1 MET N N 12.428 2.641 0.320 1.00 . A A . 1 MET N 1 1 3 902 1 1 1 MET O O 10.237 4.220 1.061 1.00 . A A . 1 MET O 1 1 3 903 1 1 1 MET SD S 13.456 3.237 -3.351 1.00 . A A . 1 MET SD 1 1 3 904 1 1 2 LYS C C 8.991 6.928 0.388 1.00 . A A . 2 LYS C 1 1 3 905 1 1 2 LYS CA C 10.449 6.981 0.851 1.00 . A A . 2 LYS CA 1 1 3 906 1 1 2 LYS CB C 11.017 8.393 0.606 1.00 . A A . 2 LYS CB 1 1 3 907 1 1 2 LYS CD C 13.004 9.898 0.935 1.00 . A A . 2 LYS CD 1 1 3 908 1 1 2 LYS CE C 14.415 10.002 1.525 1.00 . A A . 2 LYS CE 1 1 3 909 1 1 2 LYS CG C 12.436 8.493 1.186 1.00 . A A . 2 LYS CG 1 1 3 910 1 1 2 LYS H H 11.929 6.312 -0.514 1.00 . A A . 2 LYS H 1 1 3 911 1 1 2 LYS HA H 10.493 6.761 1.912 1.00 . A A . 2 LYS HA 1 1 3 912 1 1 2 LYS HB2 H 11.047 8.588 -0.457 1.00 . A A . 2 LYS HB2 1 1 3 913 1 1 2 LYS HB3 H 10.384 9.129 1.087 1.00 . A A . 2 LYS HB3 1 1 3 914 1 1 2 LYS HD2 H 13.045 10.083 -0.129 1.00 . A A . 2 LYS HD2 1 1 3 915 1 1 2 LYS HD3 H 12.367 10.634 1.404 1.00 . A A . 2 LYS HD3 1 1 3 916 1 1 2 LYS HE2 H 14.375 9.824 2.590 1.00 . A A . 2 LYS HE2 1 1 3 917 1 1 2 LYS HE3 H 15.057 9.267 1.061 1.00 . A A . 2 LYS HE3 1 1 3 918 1 1 2 LYS HG2 H 12.401 8.302 2.250 1.00 . A A . 2 LYS HG2 1 1 3 919 1 1 2 LYS HG3 H 13.072 7.761 0.711 1.00 . A A . 2 LYS HG3 1 1 3 920 1 1 2 LYS HZ1 H 15.960 11.296 1.002 1.00 . A A . 2 LYS HZ1 1 1 3 921 1 1 2 LYS HZ2 H 14.870 11.941 2.134 1.00 . A A . 2 LYS HZ2 1 1 3 922 1 1 2 LYS HZ3 H 14.426 11.815 0.499 1.00 . A A . 2 LYS HZ3 1 1 3 923 1 1 2 LYS N N 11.248 5.999 0.115 1.00 . A A . 2 LYS N 1 1 3 924 1 1 2 LYS NZ N 14.959 11.366 1.271 1.00 . A A . 2 LYS NZ 1 1 3 925 1 1 2 LYS O O 8.714 6.828 -0.806 1.00 . A A . 2 LYS O 1 1 3 926 1 1 3 PHE C C 6.273 8.199 0.181 1.00 . A A . 3 PHE C 1 1 3 927 1 1 3 PHE CA C 6.634 6.980 1.025 1.00 . A A . 3 PHE CA 1 1 3 928 1 1 3 PHE CB C 5.807 6.978 2.317 1.00 . A A . 3 PHE CB 1 1 3 929 1 1 3 PHE CD1 C 5.574 4.505 2.859 1.00 . A A . 3 PHE CD1 1 1 3 930 1 1 3 PHE CD2 C 7.081 5.845 4.215 1.00 . A A . 3 PHE CD2 1 1 3 931 1 1 3 PHE CE1 C 5.899 3.376 3.620 1.00 . A A . 3 PHE CE1 1 1 3 932 1 1 3 PHE CE2 C 7.401 4.712 4.972 1.00 . A A . 3 PHE CE2 1 1 3 933 1 1 3 PHE CG C 6.162 5.748 3.152 1.00 . A A . 3 PHE CG 1 1 3 934 1 1 3 PHE CZ C 6.812 3.480 4.675 1.00 . A A . 3 PHE CZ 1 1 3 935 1 1 3 PHE H H 8.343 7.094 2.278 1.00 . A A . 3 PHE H 1 1 3 936 1 1 3 PHE HA H 6.409 6.086 0.464 1.00 . A A . 3 PHE HA 1 1 3 937 1 1 3 PHE HB2 H 6.009 7.883 2.875 1.00 . A A . 3 PHE HB2 1 1 3 938 1 1 3 PHE HB3 H 4.754 6.948 2.064 1.00 . A A . 3 PHE HB3 1 1 3 939 1 1 3 PHE HD1 H 4.870 4.421 2.044 1.00 . A A . 3 PHE HD1 1 1 3 940 1 1 3 PHE HD2 H 7.539 6.795 4.448 1.00 . A A . 3 PHE HD2 1 1 3 941 1 1 3 PHE HE1 H 5.444 2.423 3.392 1.00 . A A . 3 PHE HE1 1 1 3 942 1 1 3 PHE HE2 H 8.107 4.791 5.787 1.00 . A A . 3 PHE HE2 1 1 3 943 1 1 3 PHE HZ H 7.060 2.607 5.261 1.00 . A A . 3 PHE HZ 1 1 3 944 1 1 3 PHE N N 8.062 7.007 1.343 1.00 . A A . 3 PHE N 1 1 3 945 1 1 3 PHE O O 5.290 8.194 -0.561 1.00 . A A . 3 PHE O 1 1 3 946 1 1 4 TYR C C 6.974 10.204 -1.945 1.00 . A A . 4 TYR C 1 1 3 947 1 1 4 TYR CA C 6.904 10.475 -0.434 1.00 . A A . 4 TYR CA 1 1 3 948 1 1 4 TYR CB C 7.992 11.486 0.050 1.00 . A A . 4 TYR CB 1 1 3 949 1 1 4 TYR CD1 C 9.225 12.214 -2.029 1.00 . A A . 4 TYR CD1 1 1 3 950 1 1 4 TYR CD2 C 7.697 13.795 -1.002 1.00 . A A . 4 TYR CD2 1 1 3 951 1 1 4 TYR CE1 C 9.532 13.149 -3.020 1.00 . A A . 4 TYR CE1 1 1 3 952 1 1 4 TYR CE2 C 8.005 14.733 -1.996 1.00 . A A . 4 TYR CE2 1 1 3 953 1 1 4 TYR CG C 8.310 12.533 -1.018 1.00 . A A . 4 TYR CG 1 1 3 954 1 1 4 TYR CZ C 8.923 14.411 -3.005 1.00 . A A . 4 TYR CZ 1 1 3 955 1 1 4 TYR H H 7.864 9.170 0.901 1.00 . A A . 4 TYR H 1 1 3 956 1 1 4 TYR HA H 5.926 10.873 -0.208 1.00 . A A . 4 TYR HA 1 1 3 957 1 1 4 TYR HB2 H 7.651 11.982 0.954 1.00 . A A . 4 TYR HB2 1 1 3 958 1 1 4 TYR HB3 H 8.897 10.938 0.290 1.00 . A A . 4 TYR HB3 1 1 3 959 1 1 4 TYR HD1 H 9.693 11.235 -2.038 1.00 . A A . 4 TYR HD1 1 1 3 960 1 1 4 TYR HD2 H 6.991 14.041 -0.223 1.00 . A A . 4 TYR HD2 1 1 3 961 1 1 4 TYR HE1 H 10.240 12.899 -3.795 1.00 . A A . 4 TYR HE1 1 1 3 962 1 1 4 TYR HE2 H 7.534 15.704 -1.984 1.00 . A A . 4 TYR HE2 1 1 3 963 1 1 4 TYR HH H 9.703 14.881 -4.682 1.00 . A A . 4 TYR HH 1 1 3 964 1 1 4 TYR N N 7.092 9.237 0.304 1.00 . A A . 4 TYR N 1 1 3 965 1 1 4 TYR O O 6.177 10.740 -2.716 1.00 . A A . 4 TYR O 1 1 3 966 1 1 4 TYR OH O 9.225 15.335 -3.984 1.00 . A A . 4 TYR OH 1 1 3 967 1 1 5 THR C C 6.860 8.379 -4.344 1.00 . A A . 5 THR C 1 1 3 968 1 1 5 THR CA C 8.105 9.071 -3.776 1.00 . A A . 5 THR CA 1 1 3 969 1 1 5 THR CB C 9.345 8.171 -3.953 1.00 . A A . 5 THR CB 1 1 3 970 1 1 5 THR CG2 C 9.680 7.998 -5.441 1.00 . A A . 5 THR CG2 1 1 3 971 1 1 5 THR H H 8.548 8.995 -1.702 1.00 . A A . 5 THR H 1 1 3 972 1 1 5 THR HA H 8.264 9.996 -4.317 1.00 . A A . 5 THR HA 1 1 3 973 1 1 5 THR HB H 9.155 7.202 -3.516 1.00 . A A . 5 THR HB 1 1 3 974 1 1 5 THR HG1 H 11.021 8.065 -2.974 1.00 . A A . 5 THR HG1 1 1 3 975 1 1 5 THR HG21 H 8.869 7.491 -5.941 1.00 . A A . 5 THR HG21 1 1 3 976 1 1 5 THR HG22 H 10.581 7.413 -5.538 1.00 . A A . 5 THR HG22 1 1 3 977 1 1 5 THR HG23 H 9.832 8.967 -5.893 1.00 . A A . 5 THR HG23 1 1 3 978 1 1 5 THR N N 7.936 9.386 -2.359 1.00 . A A . 5 THR N 1 1 3 979 1 1 5 THR O O 6.367 8.760 -5.404 1.00 . A A . 5 THR O 1 1 3 980 1 1 5 THR OG1 O 10.449 8.769 -3.289 1.00 . A A . 5 THR OG1 1 1 3 981 1 1 6 ILE C C 3.963 7.611 -4.077 1.00 . A A . 6 ILE C 1 1 3 982 1 1 6 ILE CA C 5.153 6.648 -4.087 1.00 . A A . 6 ILE CA 1 1 3 983 1 1 6 ILE CB C 4.869 5.403 -3.176 1.00 . A A . 6 ILE CB 1 1 3 984 1 1 6 ILE CD1 C 7.174 4.561 -2.373 1.00 . A A . 6 ILE CD1 1 1 3 985 1 1 6 ILE CG1 C 6.006 4.312 -3.340 1.00 . A A . 6 ILE CG1 1 1 3 986 1 1 6 ILE CG2 C 3.493 4.765 -3.552 1.00 . A A . 6 ILE CG2 1 1 3 987 1 1 6 ILE H H 6.772 7.116 -2.790 1.00 . A A . 6 ILE H 1 1 3 988 1 1 6 ILE HA H 5.306 6.311 -5.104 1.00 . A A . 6 ILE HA 1 1 3 989 1 1 6 ILE HB H 4.822 5.735 -2.145 1.00 . A A . 6 ILE HB 1 1 3 990 1 1 6 ILE HD11 H 6.808 4.564 -1.359 1.00 . A A . 6 ILE HD11 1 1 3 991 1 1 6 ILE HD12 H 7.636 5.506 -2.593 1.00 . A A . 6 ILE HD12 1 1 3 992 1 1 6 ILE HD13 H 7.904 3.773 -2.486 1.00 . A A . 6 ILE HD13 1 1 3 993 1 1 6 ILE HG12 H 5.606 3.328 -3.122 1.00 . A A . 6 ILE HG12 1 1 3 994 1 1 6 ILE HG13 H 6.384 4.307 -4.354 1.00 . A A . 6 ILE HG13 1 1 3 995 1 1 6 ILE HG21 H 3.383 3.814 -3.046 1.00 . A A . 6 ILE HG21 1 1 3 996 1 1 6 ILE HG22 H 3.445 4.606 -4.618 1.00 . A A . 6 ILE HG22 1 1 3 997 1 1 6 ILE HG23 H 2.685 5.418 -3.251 1.00 . A A . 6 ILE HG23 1 1 3 998 1 1 6 ILE N N 6.348 7.370 -3.633 1.00 . A A . 6 ILE N 1 1 3 999 1 1 6 ILE O O 3.154 7.625 -5.004 1.00 . A A . 6 ILE O 1 1 3 1000 1 1 7 LYS C C 2.760 10.355 -4.025 1.00 . A A . 7 LYS C 1 1 3 1001 1 1 7 LYS CA C 2.769 9.355 -2.874 1.00 . A A . 7 LYS CA 1 1 3 1002 1 1 7 LYS CB C 2.934 10.100 -1.534 1.00 . A A . 7 LYS CB 1 1 3 1003 1 1 7 LYS CD C 1.947 11.791 0.056 1.00 . A A . 7 LYS CD 1 1 3 1004 1 1 7 LYS CE C 0.835 12.830 0.250 1.00 . A A . 7 LYS CE 1 1 3 1005 1 1 7 LYS CG C 1.812 11.139 -1.327 1.00 . A A . 7 LYS CG 1 1 3 1006 1 1 7 LYS H H 4.537 8.336 -2.303 1.00 . A A . 7 LYS H 1 1 3 1007 1 1 7 LYS HA H 1.831 8.820 -2.861 1.00 . A A . 7 LYS HA 1 1 3 1008 1 1 7 LYS HB2 H 2.911 9.382 -0.726 1.00 . A A . 7 LYS HB2 1 1 3 1009 1 1 7 LYS HB3 H 3.888 10.605 -1.529 1.00 . A A . 7 LYS HB3 1 1 3 1010 1 1 7 LYS HD2 H 1.867 11.031 0.820 1.00 . A A . 7 LYS HD2 1 1 3 1011 1 1 7 LYS HD3 H 2.908 12.278 0.132 1.00 . A A . 7 LYS HD3 1 1 3 1012 1 1 7 LYS HE2 H 0.926 13.598 -0.507 1.00 . A A . 7 LYS HE2 1 1 3 1013 1 1 7 LYS HE3 H -0.129 12.350 0.164 1.00 . A A . 7 LYS HE3 1 1 3 1014 1 1 7 LYS HG2 H 1.881 11.910 -2.083 1.00 . A A . 7 LYS HG2 1 1 3 1015 1 1 7 LYS HG3 H 0.860 10.650 -1.405 1.00 . A A . 7 LYS HG3 1 1 3 1016 1 1 7 LYS HZ1 H 1.222 14.450 1.499 1.00 . A A . 7 LYS HZ1 1 1 3 1017 1 1 7 LYS HZ2 H 1.703 12.952 2.140 1.00 . A A . 7 LYS HZ2 1 1 3 1018 1 1 7 LYS HZ3 H 0.058 13.375 2.104 1.00 . A A . 7 LYS HZ3 1 1 3 1019 1 1 7 LYS N N 3.865 8.401 -3.013 1.00 . A A . 7 LYS N 1 1 3 1020 1 1 7 LYS NZ N 0.965 13.448 1.601 1.00 . A A . 7 LYS NZ 1 1 3 1021 1 1 7 LYS O O 1.729 10.571 -4.661 1.00 . A A . 7 LYS O 1 1 3 1022 1 1 8 LEU C C 3.797 11.295 -6.689 1.00 . A A . 8 LEU C 1 1 3 1023 1 1 8 LEU CA C 4.009 11.968 -5.345 1.00 . A A . 8 LEU CA 1 1 3 1024 1 1 8 LEU CB C 5.383 12.678 -5.297 1.00 . A A . 8 LEU CB 1 1 3 1025 1 1 8 LEU CD1 C 4.443 15.090 -5.477 1.00 . A A . 8 LEU CD1 1 1 3 1026 1 1 8 LEU CD2 C 6.795 14.547 -6.266 1.00 . A A . 8 LEU CD2 1 1 3 1027 1 1 8 LEU CG C 5.361 14.001 -6.131 1.00 . A A . 8 LEU CG 1 1 3 1028 1 1 8 LEU H H 4.690 10.771 -3.739 1.00 . A A . 8 LEU H 1 1 3 1029 1 1 8 LEU HA H 3.224 12.693 -5.198 1.00 . A A . 8 LEU HA 1 1 3 1030 1 1 8 LEU HB2 H 5.623 12.897 -4.270 1.00 . A A . 8 LEU HB2 1 1 3 1031 1 1 8 LEU HB3 H 6.143 12.013 -5.693 1.00 . A A . 8 LEU HB3 1 1 3 1032 1 1 8 LEU HD11 H 4.771 16.084 -5.763 1.00 . A A . 8 LEU HD11 1 1 3 1033 1 1 8 LEU HD12 H 4.465 15.013 -4.398 1.00 . A A . 8 LEU HD12 1 1 3 1034 1 1 8 LEU HD13 H 3.428 14.956 -5.819 1.00 . A A . 8 LEU HD13 1 1 3 1035 1 1 8 LEU HD21 H 6.776 15.449 -6.861 1.00 . A A . 8 LEU HD21 1 1 3 1036 1 1 8 LEU HD22 H 7.420 13.811 -6.748 1.00 . A A . 8 LEU HD22 1 1 3 1037 1 1 8 LEU HD23 H 7.189 14.770 -5.285 1.00 . A A . 8 LEU HD23 1 1 3 1038 1 1 8 LEU HG H 4.980 13.781 -7.119 1.00 . A A . 8 LEU HG 1 1 3 1039 1 1 8 LEU N N 3.908 10.977 -4.278 1.00 . A A . 8 LEU N 1 1 3 1040 1 1 8 LEU O O 3.104 11.806 -7.558 1.00 . A A . 8 LEU O 1 1 3 1041 1 1 9 ALA C C 2.777 9.198 -8.429 1.00 . A A . 9 ALA C 1 1 3 1042 1 1 9 ALA CA C 4.258 9.381 -8.096 1.00 . A A . 9 ALA CA 1 1 3 1043 1 1 9 ALA CB C 4.934 8.010 -7.972 1.00 . A A . 9 ALA CB 1 1 3 1044 1 1 9 ALA H H 4.934 9.765 -6.119 1.00 . A A . 9 ALA H 1 1 3 1045 1 1 9 ALA HA H 4.734 9.942 -8.878 1.00 . A A . 9 ALA HA 1 1 3 1046 1 1 9 ALA HB1 H 4.470 7.451 -7.171 1.00 . A A . 9 ALA HB1 1 1 3 1047 1 1 9 ALA HB2 H 5.984 8.144 -7.757 1.00 . A A . 9 ALA HB2 1 1 3 1048 1 1 9 ALA HB3 H 4.826 7.466 -8.900 1.00 . A A . 9 ALA HB3 1 1 3 1049 1 1 9 ALA N N 4.395 10.127 -6.849 1.00 . A A . 9 ALA N 1 1 3 1050 1 1 9 ALA O O 2.350 9.363 -9.571 1.00 . A A . 9 ALA O 1 1 3 1051 1 1 10 LYS C C -0.106 10.042 -7.853 1.00 . A A . 10 LYS C 1 1 3 1052 1 1 10 LYS CA C 0.564 8.705 -7.512 1.00 . A A . 10 LYS CA 1 1 3 1053 1 1 10 LYS CB C 0.030 8.132 -6.175 1.00 . A A . 10 LYS CB 1 1 3 1054 1 1 10 LYS CD C -1.849 6.867 -5.017 1.00 . A A . 10 LYS CD 1 1 3 1055 1 1 10 LYS CE C -0.974 5.658 -4.582 1.00 . A A . 10 LYS CE 1 1 3 1056 1 1 10 LYS CG C -1.360 7.489 -6.351 1.00 . A A . 10 LYS CG 1 1 3 1057 1 1 10 LYS H H 2.421 8.793 -6.509 1.00 . A A . 10 LYS H 1 1 3 1058 1 1 10 LYS HA H 0.362 8.006 -8.316 1.00 . A A . 10 LYS HA 1 1 3 1059 1 1 10 LYS HB2 H 0.725 7.385 -5.834 1.00 . A A . 10 LYS HB2 1 1 3 1060 1 1 10 LYS HB3 H -0.030 8.918 -5.433 1.00 . A A . 10 LYS HB3 1 1 3 1061 1 1 10 LYS HD2 H -1.828 7.623 -4.244 1.00 . A A . 10 LYS HD2 1 1 3 1062 1 1 10 LYS HD3 H -2.869 6.529 -5.144 1.00 . A A . 10 LYS HD3 1 1 3 1063 1 1 10 LYS HE2 H -0.716 5.050 -5.439 1.00 . A A . 10 LYS HE2 1 1 3 1064 1 1 10 LYS HE3 H -0.068 6.002 -4.099 1.00 . A A . 10 LYS HE3 1 1 3 1065 1 1 10 LYS HG2 H -2.061 8.249 -6.670 1.00 . A A . 10 LYS HG2 1 1 3 1066 1 1 10 LYS HG3 H -1.308 6.718 -7.106 1.00 . A A . 10 LYS HG3 1 1 3 1067 1 1 10 LYS HZ1 H -2.635 4.518 -4.057 1.00 . A A . 10 LYS HZ1 1 1 3 1068 1 1 10 LYS HZ2 H -1.962 5.396 -2.769 1.00 . A A . 10 LYS HZ2 1 1 3 1069 1 1 10 LYS HZ3 H -1.187 3.997 -3.344 1.00 . A A . 10 LYS HZ3 1 1 3 1070 1 1 10 LYS N N 2.007 8.885 -7.392 1.00 . A A . 10 LYS N 1 1 3 1071 1 1 10 LYS NZ N -1.748 4.829 -3.614 1.00 . A A . 10 LYS NZ 1 1 3 1072 1 1 10 LYS O O -1.030 10.096 -8.664 1.00 . A A . 10 LYS O 1 1 3 1073 1 1 11 PHE C C -0.005 12.825 -8.932 1.00 . A A . 11 PHE C 1 1 3 1074 1 1 11 PHE CA C -0.173 12.458 -7.461 1.00 . A A . 11 PHE CA 1 1 3 1075 1 1 11 PHE CB C 0.569 13.463 -6.560 1.00 . A A . 11 PHE CB 1 1 3 1076 1 1 11 PHE CD1 C -1.335 15.098 -6.183 1.00 . A A . 11 PHE CD1 1 1 3 1077 1 1 11 PHE CD2 C 0.718 15.945 -7.178 1.00 . A A . 11 PHE CD2 1 1 3 1078 1 1 11 PHE CE1 C -1.887 16.385 -6.242 1.00 . A A . 11 PHE CE1 1 1 3 1079 1 1 11 PHE CE2 C 0.160 17.228 -7.230 1.00 . A A . 11 PHE CE2 1 1 3 1080 1 1 11 PHE CG C -0.031 14.867 -6.651 1.00 . A A . 11 PHE CG 1 1 3 1081 1 1 11 PHE CZ C -1.140 17.447 -6.764 1.00 . A A . 11 PHE CZ 1 1 3 1082 1 1 11 PHE H H 1.116 11.012 -6.589 1.00 . A A . 11 PHE H 1 1 3 1083 1 1 11 PHE HA H -1.222 12.460 -7.212 1.00 . A A . 11 PHE HA 1 1 3 1084 1 1 11 PHE HB2 H 0.504 13.121 -5.543 1.00 . A A . 11 PHE HB2 1 1 3 1085 1 1 11 PHE HB3 H 1.606 13.490 -6.844 1.00 . A A . 11 PHE HB3 1 1 3 1086 1 1 11 PHE HD1 H -1.918 14.286 -5.776 1.00 . A A . 11 PHE HD1 1 1 3 1087 1 1 11 PHE HD2 H 1.728 15.786 -7.540 1.00 . A A . 11 PHE HD2 1 1 3 1088 1 1 11 PHE HE1 H -2.890 16.557 -5.882 1.00 . A A . 11 PHE HE1 1 1 3 1089 1 1 11 PHE HE2 H 0.734 18.050 -7.633 1.00 . A A . 11 PHE HE2 1 1 3 1090 1 1 11 PHE HZ H -1.569 18.438 -6.805 1.00 . A A . 11 PHE HZ 1 1 3 1091 1 1 11 PHE N N 0.376 11.120 -7.223 1.00 . A A . 11 PHE N 1 1 3 1092 1 1 11 PHE O O -0.965 13.182 -9.608 1.00 . A A . 11 PHE O 1 1 3 1093 1 1 12 LEU C C 0.830 11.932 -11.731 1.00 . A A . 12 LEU C 1 1 3 1094 1 1 12 LEU CA C 1.513 12.966 -10.838 1.00 . A A . 12 LEU CA 1 1 3 1095 1 1 12 LEU CB C 3.034 12.922 -11.098 1.00 . A A . 12 LEU CB 1 1 3 1096 1 1 12 LEU CD1 C 5.314 13.719 -10.393 1.00 . A A . 12 LEU CD1 1 1 3 1097 1 1 12 LEU CD2 C 3.372 15.334 -10.330 1.00 . A A . 12 LEU CD2 1 1 3 1098 1 1 12 LEU CG C 3.801 13.860 -10.136 1.00 . A A . 12 LEU CG 1 1 3 1099 1 1 12 LEU H H 1.938 12.372 -8.836 1.00 . A A . 12 LEU H 1 1 3 1100 1 1 12 LEU HA H 1.134 13.941 -11.105 1.00 . A A . 12 LEU HA 1 1 3 1101 1 1 12 LEU HB2 H 3.390 11.906 -10.952 1.00 . A A . 12 LEU HB2 1 1 3 1102 1 1 12 LEU HB3 H 3.230 13.219 -12.120 1.00 . A A . 12 LEU HB3 1 1 3 1103 1 1 12 LEU HD11 H 5.616 12.696 -10.225 1.00 . A A . 12 LEU HD11 1 1 3 1104 1 1 12 LEU HD12 H 5.856 14.367 -9.719 1.00 . A A . 12 LEU HD12 1 1 3 1105 1 1 12 LEU HD13 H 5.534 13.997 -11.413 1.00 . A A . 12 LEU HD13 1 1 3 1106 1 1 12 LEU HD21 H 2.409 15.490 -9.873 1.00 . A A . 12 LEU HD21 1 1 3 1107 1 1 12 LEU HD22 H 3.315 15.571 -11.383 1.00 . A A . 12 LEU HD22 1 1 3 1108 1 1 12 LEU HD23 H 4.091 15.993 -9.856 1.00 . A A . 12 LEU HD23 1 1 3 1109 1 1 12 LEU HG H 3.593 13.564 -9.124 1.00 . A A . 12 LEU HG 1 1 3 1110 1 1 12 LEU N N 1.222 12.689 -9.426 1.00 . A A . 12 LEU N 1 1 3 1111 1 1 12 LEU O O 0.311 12.261 -12.791 1.00 . A A . 12 LEU O 1 1 3 1112 1 1 13 GLY C C -1.220 9.725 -12.236 1.00 . A A . 13 GLY C 1 1 3 1113 1 1 13 GLY CA C 0.286 9.578 -12.068 1.00 . A A . 13 GLY CA 1 1 3 1114 1 1 13 GLY H H 1.318 10.476 -10.451 1.00 . A A . 13 GLY H 1 1 3 1115 1 1 13 GLY HA2 H 0.745 9.556 -13.041 1.00 . A A . 13 GLY HA2 1 1 3 1116 1 1 13 GLY HA3 H 0.494 8.660 -11.579 1.00 . A A . 13 GLY HA3 1 1 3 1117 1 1 13 GLY N N 0.869 10.674 -11.298 1.00 . A A . 13 GLY N 1 1 3 1118 1 1 13 GLY O O -1.825 9.062 -13.079 1.00 . A A . 13 GLY O 1 1 3 1119 1 1 14 GLY C C -3.513 12.016 -12.489 1.00 . A A . 14 GLY C 1 1 3 1120 1 1 14 GLY CA C -3.277 10.849 -11.540 1.00 . A A . 14 GLY CA 1 1 3 1121 1 1 14 GLY H H -1.299 11.101 -10.789 1.00 . A A . 14 GLY H 1 1 3 1122 1 1 14 GLY HA2 H -3.800 9.969 -11.908 1.00 . A A . 14 GLY HA2 1 1 3 1123 1 1 14 GLY HA3 H -3.658 11.108 -10.565 1.00 . A A . 14 GLY HA3 1 1 3 1124 1 1 14 GLY N N -1.831 10.599 -11.443 1.00 . A A . 14 GLY N 1 1 3 1125 1 1 14 GLY O O -4.396 11.978 -13.347 1.00 . A A . 14 GLY O 1 1 3 1126 1 1 15 ILE C C -2.225 14.010 -14.537 1.00 . A A . 15 ILE C 1 1 3 1127 1 1 15 ILE CA C -2.761 14.265 -13.133 1.00 . A A . 15 ILE CA 1 1 3 1128 1 1 15 ILE CB C -1.940 15.384 -12.449 1.00 . A A . 15 ILE CB 1 1 3 1129 1 1 15 ILE CD1 C -1.528 16.519 -10.229 1.00 . A A . 15 ILE CD1 1 1 3 1130 1 1 15 ILE CG1 C -2.503 15.646 -11.022 1.00 . A A . 15 ILE CG1 1 1 3 1131 1 1 15 ILE CG2 C -1.999 16.694 -13.283 1.00 . A A . 15 ILE CG2 1 1 3 1132 1 1 15 ILE H H -2.014 12.999 -11.616 1.00 . A A . 15 ILE H 1 1 3 1133 1 1 15 ILE HA H -3.791 14.590 -13.210 1.00 . A A . 15 ILE HA 1 1 3 1134 1 1 15 ILE HB H -0.908 15.056 -12.378 1.00 . A A . 15 ILE HB 1 1 3 1135 1 1 15 ILE HD11 H -0.580 16.004 -10.142 1.00 . A A . 15 ILE HD11 1 1 3 1136 1 1 15 ILE HD12 H -1.931 16.703 -9.250 1.00 . A A . 15 ILE HD12 1 1 3 1137 1 1 15 ILE HD13 H -1.381 17.457 -10.743 1.00 . A A . 15 ILE HD13 1 1 3 1138 1 1 15 ILE HG12 H -3.457 16.151 -11.093 1.00 . A A . 15 ILE HG12 1 1 3 1139 1 1 15 ILE HG13 H -2.640 14.715 -10.495 1.00 . A A . 15 ILE HG13 1 1 3 1140 1 1 15 ILE HG21 H -3.030 16.953 -13.476 1.00 . A A . 15 ILE HG21 1 1 3 1141 1 1 15 ILE HG22 H -1.483 16.558 -14.220 1.00 . A A . 15 ILE HG22 1 1 3 1142 1 1 15 ILE HG23 H -1.524 17.499 -12.741 1.00 . A A . 15 ILE HG23 1 1 3 1143 1 1 15 ILE N N -2.696 13.052 -12.317 1.00 . A A . 15 ILE N 1 1 3 1144 1 1 15 ILE O O -2.643 14.674 -15.486 1.00 . A A . 15 ILE O 1 1 3 1145 1 1 16 VAL C C -1.798 12.464 -16.991 1.00 . A A . 16 VAL C 1 1 3 1146 1 1 16 VAL CA C -0.685 12.822 -15.999 1.00 . A A . 16 VAL CA 1 1 3 1147 1 1 16 VAL CB C 0.371 11.678 -15.921 1.00 . A A . 16 VAL CB 1 1 3 1148 1 1 16 VAL CG1 C -0.300 10.312 -15.659 1.00 . A A . 16 VAL CG1 1 1 3 1149 1 1 16 VAL CG2 C 1.169 11.609 -17.236 1.00 . A A . 16 VAL CG2 1 1 3 1150 1 1 16 VAL H H -0.942 12.588 -13.891 1.00 . A A . 16 VAL H 1 1 3 1151 1 1 16 VAL HA H -0.201 13.731 -16.328 1.00 . A A . 16 VAL HA 1 1 3 1152 1 1 16 VAL HB H 1.052 11.885 -15.100 1.00 . A A . 16 VAL HB 1 1 3 1153 1 1 16 VAL HG11 H -0.980 10.410 -14.836 1.00 . A A . 16 VAL HG11 1 1 3 1154 1 1 16 VAL HG12 H 0.454 9.577 -15.420 1.00 . A A . 16 VAL HG12 1 1 3 1155 1 1 16 VAL HG13 H -0.841 9.982 -16.535 1.00 . A A . 16 VAL HG13 1 1 3 1156 1 1 16 VAL HG21 H 1.658 12.555 -17.412 1.00 . A A . 16 VAL HG21 1 1 3 1157 1 1 16 VAL HG22 H 0.494 11.394 -18.053 1.00 . A A . 16 VAL HG22 1 1 3 1158 1 1 16 VAL HG23 H 1.911 10.825 -17.167 1.00 . A A . 16 VAL HG23 1 1 3 1159 1 1 16 VAL N N -1.271 13.081 -14.679 1.00 . A A . 16 VAL N 1 1 3 1160 1 1 16 VAL O O -1.827 12.937 -18.126 1.00 . A A . 16 VAL O 1 1 3 1161 1 1 17 ARG C C -4.778 12.401 -17.570 1.00 . A A . 17 ARG C 1 1 3 1162 1 1 17 ARG CA C -3.860 11.192 -17.306 1.00 . A A . 17 ARG CA 1 1 3 1163 1 1 17 ARG CB C -4.600 10.066 -16.511 1.00 . A A . 17 ARG CB 1 1 3 1164 1 1 17 ARG CD C -6.262 9.658 -18.393 1.00 . A A . 17 ARG CD 1 1 3 1165 1 1 17 ARG CG C -5.237 9.011 -17.447 1.00 . A A . 17 ARG CG 1 1 3 1166 1 1 17 ARG CZ C -7.973 7.900 -18.520 1.00 . A A . 17 ARG CZ 1 1 3 1167 1 1 17 ARG H H -2.632 11.303 -15.598 1.00 . A A . 17 ARG H 1 1 3 1168 1 1 17 ARG HA H -3.504 10.803 -18.254 1.00 . A A . 17 ARG HA 1 1 3 1169 1 1 17 ARG HB2 H -3.885 9.560 -15.876 1.00 . A A . 17 ARG HB2 1 1 3 1170 1 1 17 ARG HB3 H -5.370 10.493 -15.880 1.00 . A A . 17 ARG HB3 1 1 3 1171 1 1 17 ARG HD2 H -6.947 10.277 -17.829 1.00 . A A . 17 ARG HD2 1 1 3 1172 1 1 17 ARG HD3 H -5.741 10.270 -19.114 1.00 . A A . 17 ARG HD3 1 1 3 1173 1 1 17 ARG HE H -6.788 8.434 -20.047 1.00 . A A . 17 ARG HE 1 1 3 1174 1 1 17 ARG HG2 H -4.460 8.533 -18.029 1.00 . A A . 17 ARG HG2 1 1 3 1175 1 1 17 ARG HG3 H -5.735 8.265 -16.846 1.00 . A A . 17 ARG HG3 1 1 3 1176 1 1 17 ARG HH11 H -7.801 8.819 -16.748 1.00 . A A . 17 ARG HH11 1 1 3 1177 1 1 17 ARG HH12 H -9.009 7.579 -16.835 1.00 . A A . 17 ARG HH12 1 1 3 1178 1 1 17 ARG HH21 H -8.369 6.815 -20.155 1.00 . A A . 17 ARG HH21 1 1 3 1179 1 1 17 ARG HH22 H -9.329 6.447 -18.761 1.00 . A A . 17 ARG HH22 1 1 3 1180 1 1 17 ARG N N -2.716 11.629 -16.518 1.00 . A A . 17 ARG N 1 1 3 1181 1 1 17 ARG NE N -7.006 8.614 -19.108 1.00 . A A . 17 ARG NE 1 1 3 1182 1 1 17 ARG NH1 N -8.285 8.116 -17.269 1.00 . A A . 17 ARG NH1 1 1 3 1183 1 1 17 ARG NH2 N -8.607 6.982 -19.198 1.00 . A A . 17 ARG NH2 1 1 3 1184 1 1 17 ARG O O -5.305 12.579 -18.668 1.00 . A A . 17 ARG O 1 1 3 1185 1 1 18 ALA C C -5.356 15.348 -17.758 1.00 . A A . 18 ALA C 1 1 3 1186 1 1 18 ALA CA C -5.826 14.406 -16.648 1.00 . A A . 18 ALA CA 1 1 3 1187 1 1 18 ALA CB C -5.857 15.162 -15.310 1.00 . A A . 18 ALA CB 1 1 3 1188 1 1 18 ALA H H -4.520 13.038 -15.686 1.00 . A A . 18 ALA H 1 1 3 1189 1 1 18 ALA HA H -6.826 14.074 -16.874 1.00 . A A . 18 ALA HA 1 1 3 1190 1 1 18 ALA HB1 H -6.098 14.472 -14.515 1.00 . A A . 18 ALA HB1 1 1 3 1191 1 1 18 ALA HB2 H -6.606 15.942 -15.348 1.00 . A A . 18 ALA HB2 1 1 3 1192 1 1 18 ALA HB3 H -4.892 15.607 -15.118 1.00 . A A . 18 ALA HB3 1 1 3 1193 1 1 18 ALA N N -4.964 13.228 -16.539 1.00 . A A . 18 ALA N 1 1 3 1194 1 1 18 ALA O O -6.169 15.909 -18.490 1.00 . A A . 18 ALA O 1 1 3 1195 1 1 19 MET C C -3.846 15.929 -20.282 1.00 . A A . 19 MET C 1 1 3 1196 1 1 19 MET CA C -3.474 16.404 -18.878 1.00 . A A . 19 MET CA 1 1 3 1197 1 1 19 MET CB C -1.945 16.368 -18.714 1.00 . A A . 19 MET CB 1 1 3 1198 1 1 19 MET CE C 0.481 18.456 -16.132 1.00 . A A . 19 MET CE 1 1 3 1199 1 1 19 MET CG C -1.507 17.196 -17.497 1.00 . A A . 19 MET CG 1 1 3 1200 1 1 19 MET H H -3.440 15.060 -17.263 1.00 . A A . 19 MET H 1 1 3 1201 1 1 19 MET HA H -3.839 17.411 -18.735 1.00 . A A . 19 MET HA 1 1 3 1202 1 1 19 MET HB2 H -1.629 15.346 -18.573 1.00 . A A . 19 MET HB2 1 1 3 1203 1 1 19 MET HB3 H -1.479 16.752 -19.593 1.00 . A A . 19 MET HB3 1 1 3 1204 1 1 19 MET HE1 H 1.469 18.412 -15.695 1.00 . A A . 19 MET HE1 1 1 3 1205 1 1 19 MET HE2 H -0.258 18.359 -15.354 1.00 . A A . 19 MET HE2 1 1 3 1206 1 1 19 MET HE3 H 0.348 19.402 -16.638 1.00 . A A . 19 MET HE3 1 1 3 1207 1 1 19 MET HG2 H -1.806 18.223 -17.632 1.00 . A A . 19 MET HG2 1 1 3 1208 1 1 19 MET HG3 H -1.975 16.798 -16.609 1.00 . A A . 19 MET HG3 1 1 3 1209 1 1 19 MET N N -4.044 15.524 -17.871 1.00 . A A . 19 MET N 1 1 3 1210 1 1 19 MET O O -4.415 16.676 -21.078 1.00 . A A . 19 MET O 1 1 3 1211 1 1 19 MET SD S 0.293 17.106 -17.324 1.00 . A A . 19 MET SD 1 1 3 1212 1 1 20 LEU C C -5.337 14.051 -22.055 1.00 . A A . 20 LEU C 1 1 3 1213 1 1 20 LEU CA C -3.827 14.080 -21.861 1.00 . A A . 20 LEU CA 1 1 3 1214 1 1 20 LEU CB C -3.286 12.643 -21.904 1.00 . A A . 20 LEU CB 1 1 3 1215 1 1 20 LEU CD1 C -1.270 11.141 -21.703 1.00 . A A . 20 LEU CD1 1 1 3 1216 1 1 20 LEU CD2 C -1.084 13.274 -23.055 1.00 . A A . 20 LEU CD2 1 1 3 1217 1 1 20 LEU CG C -1.737 12.608 -21.814 1.00 . A A . 20 LEU CG 1 1 3 1218 1 1 20 LEU H H -3.074 14.140 -19.879 1.00 . A A . 20 LEU H 1 1 3 1219 1 1 20 LEU HA H -3.387 14.665 -22.649 1.00 . A A . 20 LEU HA 1 1 3 1220 1 1 20 LEU HB2 H -3.694 12.102 -21.072 1.00 . A A . 20 LEU HB2 1 1 3 1221 1 1 20 LEU HB3 H -3.605 12.168 -22.815 1.00 . A A . 20 LEU HB3 1 1 3 1222 1 1 20 LEU HD11 H -0.192 11.110 -21.633 1.00 . A A . 20 LEU HD11 1 1 3 1223 1 1 20 LEU HD12 H -1.589 10.593 -22.577 1.00 . A A . 20 LEU HD12 1 1 3 1224 1 1 20 LEU HD13 H -1.700 10.691 -20.819 1.00 . A A . 20 LEU HD13 1 1 3 1225 1 1 20 LEU HD21 H -1.077 14.342 -22.923 1.00 . A A . 20 LEU HD21 1 1 3 1226 1 1 20 LEU HD22 H -1.637 13.025 -23.949 1.00 . A A . 20 LEU HD22 1 1 3 1227 1 1 20 LEU HD23 H -0.061 12.933 -23.168 1.00 . A A . 20 LEU HD23 1 1 3 1228 1 1 20 LEU HG H -1.430 13.139 -20.923 1.00 . A A . 20 LEU HG 1 1 3 1229 1 1 20 LEU N N -3.525 14.676 -20.563 1.00 . A A . 20 LEU N 1 1 3 1230 1 1 20 LEU O O -5.857 14.347 -23.130 1.00 . A A . 20 LEU O 1 1 3 1231 1 1 21 GLY C C -8.063 15.023 -21.200 1.00 . A A . 21 GLY C 1 1 3 1232 1 1 21 GLY CA C -7.482 13.634 -20.994 1.00 . A A . 21 GLY CA 1 1 3 1233 1 1 21 GLY H H -5.532 13.490 -20.160 1.00 . A A . 21 GLY H 1 1 3 1234 1 1 21 GLY HA2 H -7.812 12.981 -21.792 1.00 . A A . 21 GLY HA2 1 1 3 1235 1 1 21 GLY HA3 H -7.827 13.243 -20.049 1.00 . A A . 21 GLY HA3 1 1 3 1236 1 1 21 GLY N N -6.024 13.699 -20.984 1.00 . A A . 21 GLY N 1 1 3 1237 1 1 21 GLY O O -9.163 15.183 -21.729 1.00 . A A . 21 GLY O 1 1 3 1238 1 1 22 SER C C -7.348 18.005 -22.258 1.00 . A A . 22 SER C 1 1 3 1239 1 1 22 SER CA C -7.718 17.439 -20.883 1.00 . A A . 22 SER CA 1 1 3 1240 1 1 22 SER CB C -7.044 18.261 -19.771 1.00 . A A . 22 SER CB 1 1 3 1241 1 1 22 SER H H -6.434 15.822 -20.356 1.00 . A A . 22 SER H 1 1 3 1242 1 1 22 SER HA H -8.793 17.516 -20.756 1.00 . A A . 22 SER HA 1 1 3 1243 1 1 22 SER HB2 H -5.989 18.045 -19.748 1.00 . A A . 22 SER HB2 1 1 3 1244 1 1 22 SER HB3 H -7.190 19.322 -19.950 1.00 . A A . 22 SER HB3 1 1 3 1245 1 1 22 SER HG H -6.945 17.448 -18.006 1.00 . A A . 22 SER HG 1 1 3 1246 1 1 22 SER N N -7.302 16.032 -20.766 1.00 . A A . 22 SER N 1 1 3 1247 1 1 22 SER O O -7.832 19.066 -22.647 1.00 . A A . 22 SER O 1 1 3 1248 1 1 22 SER OG O -7.616 17.904 -18.519 1.00 . A A . 22 SER OG 1 1 3 1249 1 1 23 PHE C C -7.172 17.491 -25.343 1.00 . A A . 23 PHE C 1 1 3 1250 1 1 23 PHE CA C -6.061 17.743 -24.324 1.00 . A A . 23 PHE CA 1 1 3 1251 1 1 23 PHE CB C -4.784 16.998 -24.738 1.00 . A A . 23 PHE CB 1 1 3 1252 1 1 23 PHE CD1 C -3.763 18.815 -26.182 1.00 . A A . 23 PHE CD1 1 1 3 1253 1 1 23 PHE CD2 C -4.332 16.706 -27.244 1.00 . A A . 23 PHE CD2 1 1 3 1254 1 1 23 PHE CE1 C -3.300 19.304 -27.411 1.00 . A A . 23 PHE CE1 1 1 3 1255 1 1 23 PHE CE2 C -3.867 17.200 -28.469 1.00 . A A . 23 PHE CE2 1 1 3 1256 1 1 23 PHE CG C -4.280 17.514 -26.090 1.00 . A A . 23 PHE CG 1 1 3 1257 1 1 23 PHE CZ C -3.352 18.496 -28.552 1.00 . A A . 23 PHE CZ 1 1 3 1258 1 1 23 PHE H H -6.129 16.455 -22.631 1.00 . A A . 23 PHE H 1 1 3 1259 1 1 23 PHE HA H -5.850 18.807 -24.295 1.00 . A A . 23 PHE HA 1 1 3 1260 1 1 23 PHE HB2 H -4.022 17.164 -23.988 1.00 . A A . 23 PHE HB2 1 1 3 1261 1 1 23 PHE HB3 H -5.000 15.944 -24.794 1.00 . A A . 23 PHE HB3 1 1 3 1262 1 1 23 PHE HD1 H -3.721 19.446 -25.306 1.00 . A A . 23 PHE HD1 1 1 3 1263 1 1 23 PHE HD2 H -4.731 15.704 -27.188 1.00 . A A . 23 PHE HD2 1 1 3 1264 1 1 23 PHE HE1 H -2.901 20.305 -27.476 1.00 . A A . 23 PHE HE1 1 1 3 1265 1 1 23 PHE HE2 H -3.908 16.578 -29.351 1.00 . A A . 23 PHE HE2 1 1 3 1266 1 1 23 PHE HZ H -2.994 18.876 -29.497 1.00 . A A . 23 PHE HZ 1 1 3 1267 1 1 23 PHE N N -6.486 17.294 -22.991 1.00 . A A . 23 PHE N 1 1 3 1268 1 1 23 PHE O O -6.942 16.953 -26.426 1.00 . A A . 23 PHE O 1 1 3 1269 1 1 24 ARG C C -9.309 18.384 -27.215 1.00 . A A . 24 ARG C 1 1 3 1270 1 1 24 ARG CA C -9.543 17.723 -25.849 1.00 . A A . 24 ARG CA 1 1 3 1271 1 1 24 ARG CB C -10.785 18.331 -25.169 1.00 . A A . 24 ARG CB 1 1 3 1272 1 1 24 ARG CD C -11.759 20.405 -24.126 1.00 . A A . 24 ARG CD 1 1 3 1273 1 1 24 ARG CG C -10.511 19.798 -24.783 1.00 . A A . 24 ARG CG 1 1 3 1274 1 1 24 ARG CZ C -13.016 21.357 -26.015 1.00 . A A . 24 ARG CZ 1 1 3 1275 1 1 24 ARG H H -8.490 18.311 -24.105 1.00 . A A . 24 ARG H 1 1 3 1276 1 1 24 ARG HA H -9.712 16.667 -26.003 1.00 . A A . 24 ARG HA 1 1 3 1277 1 1 24 ARG HB2 H -11.630 18.286 -25.846 1.00 . A A . 24 ARG HB2 1 1 3 1278 1 1 24 ARG HB3 H -11.016 17.768 -24.275 1.00 . A A . 24 ARG HB3 1 1 3 1279 1 1 24 ARG HD2 H -12.032 19.812 -23.263 1.00 . A A . 24 ARG HD2 1 1 3 1280 1 1 24 ARG HD3 H -11.541 21.416 -23.804 1.00 . A A . 24 ARG HD3 1 1 3 1281 1 1 24 ARG HE H -13.549 19.698 -25.024 1.00 . A A . 24 ARG HE 1 1 3 1282 1 1 24 ARG HG2 H -9.689 19.834 -24.084 1.00 . A A . 24 ARG HG2 1 1 3 1283 1 1 24 ARG HG3 H -10.257 20.369 -25.662 1.00 . A A . 24 ARG HG3 1 1 3 1284 1 1 24 ARG HH11 H -11.362 22.356 -25.482 1.00 . A A . 24 ARG HH11 1 1 3 1285 1 1 24 ARG HH12 H -12.246 23.026 -26.812 1.00 . A A . 24 ARG HH12 1 1 3 1286 1 1 24 ARG HH21 H -14.700 20.578 -26.766 1.00 . A A . 24 ARG HH21 1 1 3 1287 1 1 24 ARG HH22 H -14.132 22.021 -27.538 1.00 . A A . 24 ARG HH22 1 1 3 1288 1 1 24 ARG N N -8.378 17.892 -24.980 1.00 . A A . 24 ARG N 1 1 3 1289 1 1 24 ARG NE N -12.880 20.411 -25.077 1.00 . A A . 24 ARG NE 1 1 3 1290 1 1 24 ARG NH1 N -12.139 22.322 -26.111 1.00 . A A . 24 ARG NH1 1 1 3 1291 1 1 24 ARG NH2 N -14.028 21.315 -26.838 1.00 . A A . 24 ARG NH2 1 1 3 1292 1 1 24 ARG O O -8.208 18.847 -27.510 1.00 . A A . 24 ARG O 1 1 3 1293 1 1 25 LYS C C -10.028 20.531 -29.238 1.00 . A A . 25 LYS C 1 1 3 1294 1 1 25 LYS CA C -10.264 19.025 -29.366 1.00 . A A . 25 LYS CA 1 1 3 1295 1 1 25 LYS CB C -11.568 18.769 -30.142 1.00 . A A . 25 LYS CB 1 1 3 1296 1 1 25 LYS CD C -13.063 17.007 -31.132 1.00 . A A . 25 LYS CD 1 1 3 1297 1 1 25 LYS CE C -13.263 15.501 -31.337 1.00 . A A . 25 LYS CE 1 1 3 1298 1 1 25 LYS CG C -11.753 17.260 -30.371 1.00 . A A . 25 LYS CG 1 1 3 1299 1 1 25 LYS H H -11.208 18.036 -27.744 1.00 . A A . 25 LYS H 1 1 3 1300 1 1 25 LYS HA H -9.437 18.582 -29.908 1.00 . A A . 25 LYS HA 1 1 3 1301 1 1 25 LYS HB2 H -12.402 19.151 -29.572 1.00 . A A . 25 LYS HB2 1 1 3 1302 1 1 25 LYS HB3 H -11.526 19.270 -31.100 1.00 . A A . 25 LYS HB3 1 1 3 1303 1 1 25 LYS HD2 H -13.893 17.404 -30.564 1.00 . A A . 25 LYS HD2 1 1 3 1304 1 1 25 LYS HD3 H -13.020 17.495 -32.094 1.00 . A A . 25 LYS HD3 1 1 3 1305 1 1 25 LYS HE2 H -13.306 15.008 -30.376 1.00 . A A . 25 LYS HE2 1 1 3 1306 1 1 25 LYS HE3 H -14.187 15.330 -31.869 1.00 . A A . 25 LYS HE3 1 1 3 1307 1 1 25 LYS HG2 H -10.922 16.880 -30.948 1.00 . A A . 25 LYS HG2 1 1 3 1308 1 1 25 LYS HG3 H -11.789 16.754 -29.417 1.00 . A A . 25 LYS HG3 1 1 3 1309 1 1 25 LYS HZ1 H -11.575 15.734 -32.533 1.00 . A A . 25 LYS HZ1 1 1 3 1310 1 1 25 LYS HZ2 H -12.494 14.352 -32.894 1.00 . A A . 25 LYS HZ2 1 1 3 1311 1 1 25 LYS HZ3 H -11.513 14.385 -31.508 1.00 . A A . 25 LYS HZ3 1 1 3 1312 1 1 25 LYS N N -10.356 18.421 -28.037 1.00 . A A . 25 LYS N 1 1 3 1313 1 1 25 LYS NZ N -12.126 14.952 -32.128 1.00 . A A . 25 LYS NZ 1 1 3 1314 1 1 25 LYS O O -10.568 21.178 -28.341 1.00 . A A . 25 LYS O 1 1 3 1315 1 1 26 ASP C C -10.185 23.344 -30.276 1.00 . A A . 26 ASP C 1 1 3 1316 1 1 26 ASP CA C -8.911 22.512 -30.120 1.00 . A A . 26 ASP CA 1 1 3 1317 1 1 26 ASP CB C -7.922 22.848 -31.251 1.00 . A A . 26 ASP CB 1 1 3 1318 1 1 26 ASP CG C -8.518 22.514 -32.625 1.00 . A A . 26 ASP CG 1 1 3 1319 1 1 26 ASP H H -8.813 20.515 -30.831 1.00 . A A . 26 ASP H 1 1 3 1320 1 1 26 ASP HA H -8.449 22.758 -29.174 1.00 . A A . 26 ASP HA 1 1 3 1321 1 1 26 ASP HB2 H -7.682 23.901 -31.215 1.00 . A A . 26 ASP HB2 1 1 3 1322 1 1 26 ASP HB3 H -7.017 22.274 -31.111 1.00 . A A . 26 ASP HB3 1 1 3 1323 1 1 26 ASP N N -9.215 21.081 -30.140 1.00 . A A . 26 ASP N 1 1 3 1324 1 1 26 ASP O O -11.235 22.752 -30.463 1.00 . A A . 26 ASP O 1 1 3 1325 1 1 26 ASP OD1 O -9.600 21.948 -32.670 1.00 . A A . 26 ASP OD1 1 1 3 1326 1 1 26 ASP OD2 O -7.877 22.831 -33.613 1.00 . A A . 26 ASP OD2 1 1 4 1327 1 1 1 MET C C 12.783 6.625 -2.145 1.00 . A A . 1 MET C 1 1 4 1328 1 1 1 MET CA C 13.955 5.971 -2.880 1.00 . A A . 1 MET CA 1 1 4 1329 1 1 1 MET CB C 13.472 4.979 -3.970 1.00 . A A . 1 MET CB 1 1 4 1330 1 1 1 MET CE C 10.216 3.800 -4.257 1.00 . A A . 1 MET CE 1 1 4 1331 1 1 1 MET CG C 12.817 3.712 -3.357 1.00 . A A . 1 MET CG 1 1 4 1332 1 1 1 MET H1 H 15.230 4.415 -2.342 1.00 . A A . 1 MET H1 1 1 4 1333 1 1 1 MET H2 H 14.256 4.982 -1.070 1.00 . A A . 1 MET H2 1 1 4 1334 1 1 1 MET H3 H 15.591 5.893 -1.594 1.00 . A A . 1 MET H3 1 1 4 1335 1 1 1 MET HA H 14.539 6.752 -3.351 1.00 . A A . 1 MET HA 1 1 4 1336 1 1 1 MET HB2 H 12.757 5.475 -4.608 1.00 . A A . 1 MET HB2 1 1 4 1337 1 1 1 MET HB3 H 14.326 4.679 -4.570 1.00 . A A . 1 MET HB3 1 1 4 1338 1 1 1 MET HE1 H 10.733 4.240 -5.095 1.00 . A A . 1 MET HE1 1 1 4 1339 1 1 1 MET HE2 H 9.242 4.244 -4.170 1.00 . A A . 1 MET HE2 1 1 4 1340 1 1 1 MET HE3 H 10.111 2.735 -4.412 1.00 . A A . 1 MET HE3 1 1 4 1341 1 1 1 MET HG2 H 12.742 2.943 -4.116 1.00 . A A . 1 MET HG2 1 1 4 1342 1 1 1 MET HG3 H 13.426 3.335 -2.548 1.00 . A A . 1 MET HG3 1 1 4 1343 1 1 1 MET N N 14.823 5.262 -1.897 1.00 . A A . 1 MET N 1 1 4 1344 1 1 1 MET O O 11.952 7.293 -2.759 1.00 . A A . 1 MET O 1 1 4 1345 1 1 1 MET SD S 11.154 4.098 -2.732 1.00 . A A . 1 MET SD 1 1 4 1346 1 1 2 LYS C C 10.296 6.595 -0.384 1.00 . A A . 2 LYS C 1 1 4 1347 1 1 2 LYS CA C 11.717 7.010 0.042 1.00 . A A . 2 LYS CA 1 1 4 1348 1 1 2 LYS CB C 11.832 8.543 0.054 1.00 . A A . 2 LYS CB 1 1 4 1349 1 1 2 LYS CD C 13.313 10.496 0.604 1.00 . A A . 2 LYS CD 1 1 4 1350 1 1 2 LYS CE C 14.671 10.932 1.161 1.00 . A A . 2 LYS CE 1 1 4 1351 1 1 2 LYS CG C 13.202 8.964 0.613 1.00 . A A . 2 LYS CG 1 1 4 1352 1 1 2 LYS H H 13.464 5.902 -0.411 1.00 . A A . 2 LYS H 1 1 4 1353 1 1 2 LYS HA H 11.885 6.648 1.048 1.00 . A A . 2 LYS HA 1 1 4 1354 1 1 2 LYS HB2 H 11.718 8.923 -0.951 1.00 . A A . 2 LYS HB2 1 1 4 1355 1 1 2 LYS HB3 H 11.056 8.950 0.683 1.00 . A A . 2 LYS HB3 1 1 4 1356 1 1 2 LYS HD2 H 13.215 10.854 -0.412 1.00 . A A . 2 LYS HD2 1 1 4 1357 1 1 2 LYS HD3 H 12.526 10.920 1.209 1.00 . A A . 2 LYS HD3 1 1 4 1358 1 1 2 LYS HE2 H 14.786 10.570 2.171 1.00 . A A . 2 LYS HE2 1 1 4 1359 1 1 2 LYS HE3 H 15.461 10.533 0.541 1.00 . A A . 2 LYS HE3 1 1 4 1360 1 1 2 LYS HG2 H 13.304 8.600 1.625 1.00 . A A . 2 LYS HG2 1 1 4 1361 1 1 2 LYS HG3 H 13.985 8.545 -0.002 1.00 . A A . 2 LYS HG3 1 1 4 1362 1 1 2 LYS HZ1 H 14.972 12.765 2.105 1.00 . A A . 2 LYS HZ1 1 1 4 1363 1 1 2 LYS HZ2 H 13.821 12.806 0.856 1.00 . A A . 2 LYS HZ2 1 1 4 1364 1 1 2 LYS HZ3 H 15.477 12.730 0.486 1.00 . A A . 2 LYS HZ3 1 1 4 1365 1 1 2 LYS N N 12.753 6.435 -0.825 1.00 . A A . 2 LYS N 1 1 4 1366 1 1 2 LYS NZ N 14.742 12.421 1.152 1.00 . A A . 2 LYS NZ 1 1 4 1367 1 1 2 LYS O O 9.990 6.468 -1.568 1.00 . A A . 2 LYS O 1 1 4 1368 1 1 3 PHE C C 7.192 7.125 -0.188 1.00 . A A . 3 PHE C 1 1 4 1369 1 1 3 PHE CA C 8.038 5.975 0.376 1.00 . A A . 3 PHE CA 1 1 4 1370 1 1 3 PHE CB C 7.408 5.466 1.683 1.00 . A A . 3 PHE CB 1 1 4 1371 1 1 3 PHE CD1 C 8.150 3.038 1.641 1.00 . A A . 3 PHE CD1 1 1 4 1372 1 1 3 PHE CD2 C 9.135 4.511 3.305 1.00 . A A . 3 PHE CD2 1 1 4 1373 1 1 3 PHE CE1 C 8.929 1.979 2.123 1.00 . A A . 3 PHE CE1 1 1 4 1374 1 1 3 PHE CE2 C 9.907 3.447 3.785 1.00 . A A . 3 PHE CE2 1 1 4 1375 1 1 3 PHE CG C 8.249 4.312 2.227 1.00 . A A . 3 PHE CG 1 1 4 1376 1 1 3 PHE CZ C 9.805 2.184 3.195 1.00 . A A . 3 PHE CZ 1 1 4 1377 1 1 3 PHE H H 9.738 6.497 1.539 1.00 . A A . 3 PHE H 1 1 4 1378 1 1 3 PHE HA H 8.026 5.166 -0.346 1.00 . A A . 3 PHE HA 1 1 4 1379 1 1 3 PHE HB2 H 7.359 6.275 2.403 1.00 . A A . 3 PHE HB2 1 1 4 1380 1 1 3 PHE HB3 H 6.405 5.113 1.481 1.00 . A A . 3 PHE HB3 1 1 4 1381 1 1 3 PHE HD1 H 7.474 2.874 0.814 1.00 . A A . 3 PHE HD1 1 1 4 1382 1 1 3 PHE HD2 H 9.216 5.485 3.766 1.00 . A A . 3 PHE HD2 1 1 4 1383 1 1 3 PHE HE1 H 8.852 1.002 1.671 1.00 . A A . 3 PHE HE1 1 1 4 1384 1 1 3 PHE HE2 H 10.586 3.603 4.610 1.00 . A A . 3 PHE HE2 1 1 4 1385 1 1 3 PHE HZ H 10.405 1.367 3.566 1.00 . A A . 3 PHE HZ 1 1 4 1386 1 1 3 PHE N N 9.430 6.380 0.616 1.00 . A A . 3 PHE N 1 1 4 1387 1 1 3 PHE O O 6.287 6.893 -0.991 1.00 . A A . 3 PHE O 1 1 4 1388 1 1 4 TYR C C 6.572 9.538 -1.769 1.00 . A A . 4 TYR C 1 1 4 1389 1 1 4 TYR CA C 6.674 9.527 -0.230 1.00 . A A . 4 TYR CA 1 1 4 1390 1 1 4 TYR CB C 7.270 10.866 0.356 1.00 . A A . 4 TYR CB 1 1 4 1391 1 1 4 TYR CD1 C 7.458 12.429 -1.647 1.00 . A A . 4 TYR CD1 1 1 4 1392 1 1 4 TYR CD2 C 9.511 11.617 -0.640 1.00 . A A . 4 TYR CD2 1 1 4 1393 1 1 4 TYR CE1 C 8.204 13.152 -2.583 1.00 . A A . 4 TYR CE1 1 1 4 1394 1 1 4 TYR CE2 C 10.255 12.344 -1.581 1.00 . A A . 4 TYR CE2 1 1 4 1395 1 1 4 TYR CG C 8.106 11.655 -0.670 1.00 . A A . 4 TYR CG 1 1 4 1396 1 1 4 TYR CZ C 9.601 13.109 -2.552 1.00 . A A . 4 TYR CZ 1 1 4 1397 1 1 4 TYR H H 8.178 8.501 0.896 1.00 . A A . 4 TYR H 1 1 4 1398 1 1 4 TYR HA H 5.669 9.401 0.155 1.00 . A A . 4 TYR HA 1 1 4 1399 1 1 4 TYR HB2 H 6.460 11.506 0.696 1.00 . A A . 4 TYR HB2 1 1 4 1400 1 1 4 TYR HB3 H 7.885 10.624 1.214 1.00 . A A . 4 TYR HB3 1 1 4 1401 1 1 4 TYR HD1 H 6.379 12.470 -1.677 1.00 . A A . 4 TYR HD1 1 1 4 1402 1 1 4 TYR HD2 H 10.018 11.034 0.106 1.00 . A A . 4 TYR HD2 1 1 4 1403 1 1 4 TYR HE1 H 7.700 13.745 -3.334 1.00 . A A . 4 TYR HE1 1 1 4 1404 1 1 4 TYR HE2 H 11.334 12.311 -1.557 1.00 . A A . 4 TYR HE2 1 1 4 1405 1 1 4 TYR HH H 10.508 13.245 -4.225 1.00 . A A . 4 TYR HH 1 1 4 1406 1 1 4 TYR N N 7.460 8.365 0.243 1.00 . A A . 4 TYR N 1 1 4 1407 1 1 4 TYR O O 5.722 10.213 -2.347 1.00 . A A . 4 TYR O 1 1 4 1408 1 1 4 TYR OH O 10.331 13.823 -3.480 1.00 . A A . 4 TYR OH 1 1 4 1409 1 1 5 THR C C 6.120 8.084 -4.360 1.00 . A A . 5 THR C 1 1 4 1410 1 1 5 THR CA C 7.455 8.653 -3.862 1.00 . A A . 5 THR CA 1 1 4 1411 1 1 5 THR CB C 8.620 7.734 -4.270 1.00 . A A . 5 THR CB 1 1 4 1412 1 1 5 THR CG2 C 8.696 7.576 -5.799 1.00 . A A . 5 THR CG2 1 1 4 1413 1 1 5 THR H H 8.080 8.241 -1.887 1.00 . A A . 5 THR H 1 1 4 1414 1 1 5 THR HA H 7.608 9.631 -4.295 1.00 . A A . 5 THR HA 1 1 4 1415 1 1 5 THR HB H 8.488 6.764 -3.813 1.00 . A A . 5 THR HB 1 1 4 1416 1 1 5 THR HG1 H 10.008 7.965 -2.931 1.00 . A A . 5 THR HG1 1 1 4 1417 1 1 5 THR HG21 H 7.846 7.012 -6.153 1.00 . A A . 5 THR HG21 1 1 4 1418 1 1 5 THR HG22 H 9.603 7.051 -6.054 1.00 . A A . 5 THR HG22 1 1 4 1419 1 1 5 THR HG23 H 8.704 8.550 -6.267 1.00 . A A . 5 THR HG23 1 1 4 1420 1 1 5 THR N N 7.439 8.763 -2.408 1.00 . A A . 5 THR N 1 1 4 1421 1 1 5 THR O O 5.542 8.591 -5.320 1.00 . A A . 5 THR O 1 1 4 1422 1 1 5 THR OG1 O 9.834 8.311 -3.809 1.00 . A A . 5 THR OG1 1 1 4 1423 1 1 6 ILE C C 3.228 7.436 -3.892 1.00 . A A . 6 ILE C 1 1 4 1424 1 1 6 ILE CA C 4.353 6.416 -4.080 1.00 . A A . 6 ILE CA 1 1 4 1425 1 1 6 ILE CB C 4.080 5.124 -3.244 1.00 . A A . 6 ILE CB 1 1 4 1426 1 1 6 ILE CD1 C 6.532 4.371 -3.356 1.00 . A A . 6 ILE CD1 1 1 4 1427 1 1 6 ILE CG1 C 5.074 4.000 -3.658 1.00 . A A . 6 ILE CG1 1 1 4 1428 1 1 6 ILE CG2 C 2.627 4.607 -3.474 1.00 . A A . 6 ILE CG2 1 1 4 1429 1 1 6 ILE H H 6.124 6.673 -2.928 1.00 . A A . 6 ILE H 1 1 4 1430 1 1 6 ILE HA H 4.399 6.153 -5.128 1.00 . A A . 6 ILE HA 1 1 4 1431 1 1 6 ILE HB H 4.213 5.347 -2.195 1.00 . A A . 6 ILE HB 1 1 4 1432 1 1 6 ILE HD11 H 6.917 4.974 -4.159 1.00 . A A . 6 ILE HD11 1 1 4 1433 1 1 6 ILE HD12 H 7.113 3.463 -3.287 1.00 . A A . 6 ILE HD12 1 1 4 1434 1 1 6 ILE HD13 H 6.607 4.910 -2.421 1.00 . A A . 6 ILE HD13 1 1 4 1435 1 1 6 ILE HG12 H 4.835 3.095 -3.120 1.00 . A A . 6 ILE HG12 1 1 4 1436 1 1 6 ILE HG13 H 4.975 3.815 -4.716 1.00 . A A . 6 ILE HG13 1 1 4 1437 1 1 6 ILE HG21 H 2.505 3.635 -3.012 1.00 . A A . 6 ILE HG21 1 1 4 1438 1 1 6 ILE HG22 H 2.435 4.524 -4.534 1.00 . A A . 6 ILE HG22 1 1 4 1439 1 1 6 ILE HG23 H 1.914 5.294 -3.038 1.00 . A A . 6 ILE HG23 1 1 4 1440 1 1 6 ILE N N 5.629 7.031 -3.692 1.00 . A A . 6 ILE N 1 1 4 1441 1 1 6 ILE O O 2.356 7.574 -4.749 1.00 . A A . 6 ILE O 1 1 4 1442 1 1 7 LYS C C 2.156 10.180 -3.622 1.00 . A A . 7 LYS C 1 1 4 1443 1 1 7 LYS CA C 2.232 9.158 -2.490 1.00 . A A . 7 LYS CA 1 1 4 1444 1 1 7 LYS CB C 2.558 9.860 -1.150 1.00 . A A . 7 LYS CB 1 1 4 1445 1 1 7 LYS CD C 1.805 11.575 0.547 1.00 . A A . 7 LYS CD 1 1 4 1446 1 1 7 LYS CE C 0.798 12.700 0.826 1.00 . A A . 7 LYS CE 1 1 4 1447 1 1 7 LYS CG C 1.541 10.982 -0.846 1.00 . A A . 7 LYS CG 1 1 4 1448 1 1 7 LYS H H 3.979 8.009 -2.123 1.00 . A A . 7 LYS H 1 1 4 1449 1 1 7 LYS HA H 1.275 8.665 -2.401 1.00 . A A . 7 LYS HA 1 1 4 1450 1 1 7 LYS HB2 H 2.531 9.128 -0.355 1.00 . A A . 7 LYS HB2 1 1 4 1451 1 1 7 LYS HB3 H 3.549 10.285 -1.203 1.00 . A A . 7 LYS HB3 1 1 4 1452 1 1 7 LYS HD2 H 1.690 10.799 1.291 1.00 . A A . 7 LYS HD2 1 1 4 1453 1 1 7 LYS HD3 H 2.808 11.971 0.590 1.00 . A A . 7 LYS HD3 1 1 4 1454 1 1 7 LYS HE2 H 0.919 13.481 0.086 1.00 . A A . 7 LYS HE2 1 1 4 1455 1 1 7 LYS HE3 H -0.207 12.305 0.770 1.00 . A A . 7 LYS HE3 1 1 4 1456 1 1 7 LYS HG2 H 1.633 11.770 -1.582 1.00 . A A . 7 LYS HG2 1 1 4 1457 1 1 7 LYS HG3 H 0.546 10.576 -0.882 1.00 . A A . 7 LYS HG3 1 1 4 1458 1 1 7 LYS HZ1 H 0.753 14.262 2.200 1.00 . A A . 7 LYS HZ1 1 1 4 1459 1 1 7 LYS HZ2 H 2.042 13.179 2.429 1.00 . A A . 7 LYS HZ2 1 1 4 1460 1 1 7 LYS HZ3 H 0.465 12.737 2.880 1.00 . A A . 7 LYS HZ3 1 1 4 1461 1 1 7 LYS N N 3.257 8.154 -2.769 1.00 . A A . 7 LYS N 1 1 4 1462 1 1 7 LYS NZ N 1.033 13.262 2.186 1.00 . A A . 7 LYS NZ 1 1 4 1463 1 1 7 LYS O O 1.077 10.460 -4.145 1.00 . A A . 7 LYS O 1 1 4 1464 1 1 8 LEU C C 2.956 11.081 -6.380 1.00 . A A . 8 LEU C 1 1 4 1465 1 1 8 LEU CA C 3.360 11.718 -5.059 1.00 . A A . 8 LEU CA 1 1 4 1466 1 1 8 LEU CB C 4.793 12.314 -5.173 1.00 . A A . 8 LEU CB 1 1 4 1467 1 1 8 LEU CD1 C 4.403 14.855 -4.993 1.00 . A A . 8 LEU CD1 1 1 4 1468 1 1 8 LEU CD2 C 6.143 13.979 -6.580 1.00 . A A . 8 LEU CD2 1 1 4 1469 1 1 8 LEU CG C 4.768 13.684 -5.945 1.00 . A A . 8 LEU CG 1 1 4 1470 1 1 8 LEU H H 4.125 10.461 -3.544 1.00 . A A . 8 LEU H 1 1 4 1471 1 1 8 LEU HA H 2.658 12.507 -4.833 1.00 . A A . 8 LEU HA 1 1 4 1472 1 1 8 LEU HB2 H 5.196 12.450 -4.177 1.00 . A A . 8 LEU HB2 1 1 4 1473 1 1 8 LEU HB3 H 5.430 11.608 -5.698 1.00 . A A . 8 LEU HB3 1 1 4 1474 1 1 8 LEU HD11 H 4.424 15.787 -5.543 1.00 . A A . 8 LEU HD11 1 1 4 1475 1 1 8 LEU HD12 H 5.121 14.902 -4.188 1.00 . A A . 8 LEU HD12 1 1 4 1476 1 1 8 LEU HD13 H 3.418 14.710 -4.580 1.00 . A A . 8 LEU HD13 1 1 4 1477 1 1 8 LEU HD21 H 6.894 14.038 -5.806 1.00 . A A . 8 LEU HD21 1 1 4 1478 1 1 8 LEU HD22 H 6.098 14.919 -7.112 1.00 . A A . 8 LEU HD22 1 1 4 1479 1 1 8 LEU HD23 H 6.396 13.190 -7.273 1.00 . A A . 8 LEU HD23 1 1 4 1480 1 1 8 LEU HG H 4.028 13.633 -6.735 1.00 . A A . 8 LEU HG 1 1 4 1481 1 1 8 LEU N N 3.304 10.729 -3.991 1.00 . A A . 8 LEU N 1 1 4 1482 1 1 8 LEU O O 2.259 11.676 -7.191 1.00 . A A . 8 LEU O 1 1 4 1483 1 1 9 ALA C C 1.647 9.087 -8.107 1.00 . A A . 9 ALA C 1 1 4 1484 1 1 9 ALA CA C 3.156 9.165 -7.848 1.00 . A A . 9 ALA CA 1 1 4 1485 1 1 9 ALA CB C 3.754 7.758 -7.808 1.00 . A A . 9 ALA CB 1 1 4 1486 1 1 9 ALA H H 4.016 9.461 -5.933 1.00 . A A . 9 ALA H 1 1 4 1487 1 1 9 ALA HA H 3.618 9.719 -8.646 1.00 . A A . 9 ALA HA 1 1 4 1488 1 1 9 ALA HB1 H 3.590 7.266 -8.755 1.00 . A A . 9 ALA HB1 1 1 4 1489 1 1 9 ALA HB2 H 3.279 7.190 -7.022 1.00 . A A . 9 ALA HB2 1 1 4 1490 1 1 9 ALA HB3 H 4.814 7.824 -7.614 1.00 . A A . 9 ALA HB3 1 1 4 1491 1 1 9 ALA N N 3.437 9.871 -6.602 1.00 . A A . 9 ALA N 1 1 4 1492 1 1 9 ALA O O 1.192 9.288 -9.228 1.00 . A A . 9 ALA O 1 1 4 1493 1 1 10 LYS C C -1.143 10.125 -7.489 1.00 . A A . 10 LYS C 1 1 4 1494 1 1 10 LYS CA C -0.577 8.747 -7.152 1.00 . A A . 10 LYS CA 1 1 4 1495 1 1 10 LYS CB C -1.160 8.235 -5.814 1.00 . A A . 10 LYS CB 1 1 4 1496 1 1 10 LYS CD C -1.635 6.146 -4.409 1.00 . A A . 10 LYS CD 1 1 4 1497 1 1 10 LYS CE C -1.171 6.772 -3.081 1.00 . A A . 10 LYS CE 1 1 4 1498 1 1 10 LYS CG C -0.853 6.723 -5.614 1.00 . A A . 10 LYS CG 1 1 4 1499 1 1 10 LYS H H 1.308 8.684 -6.177 1.00 . A A . 10 LYS H 1 1 4 1500 1 1 10 LYS HA H -0.854 8.073 -7.953 1.00 . A A . 10 LYS HA 1 1 4 1501 1 1 10 LYS HB2 H -0.711 8.801 -5.013 1.00 . A A . 10 LYS HB2 1 1 4 1502 1 1 10 LYS HB3 H -2.224 8.391 -5.800 1.00 . A A . 10 LYS HB3 1 1 4 1503 1 1 10 LYS HD2 H -2.692 6.332 -4.546 1.00 . A A . 10 LYS HD2 1 1 4 1504 1 1 10 LYS HD3 H -1.473 5.076 -4.364 1.00 . A A . 10 LYS HD3 1 1 4 1505 1 1 10 LYS HE2 H -0.094 6.728 -3.011 1.00 . A A . 10 LYS HE2 1 1 4 1506 1 1 10 LYS HE3 H -1.495 7.800 -3.021 1.00 . A A . 10 LYS HE3 1 1 4 1507 1 1 10 LYS HG2 H -1.145 6.179 -6.504 1.00 . A A . 10 LYS HG2 1 1 4 1508 1 1 10 LYS HG3 H 0.206 6.585 -5.449 1.00 . A A . 10 LYS HG3 1 1 4 1509 1 1 10 LYS HZ1 H -2.767 5.821 -2.138 1.00 . A A . 10 LYS HZ1 1 1 4 1510 1 1 10 LYS HZ2 H -1.679 6.575 -1.074 1.00 . A A . 10 LYS HZ2 1 1 4 1511 1 1 10 LYS HZ3 H -1.258 5.111 -1.825 1.00 . A A . 10 LYS HZ3 1 1 4 1512 1 1 10 LYS N N 0.884 8.817 -7.050 1.00 . A A . 10 LYS N 1 1 4 1513 1 1 10 LYS NZ N -1.764 6.011 -1.944 1.00 . A A . 10 LYS NZ 1 1 4 1514 1 1 10 LYS O O -2.017 10.257 -8.346 1.00 . A A . 10 LYS O 1 1 4 1515 1 1 11 PHE C C -0.887 12.869 -8.531 1.00 . A A . 11 PHE C 1 1 4 1516 1 1 11 PHE CA C -1.077 12.524 -7.056 1.00 . A A . 11 PHE CA 1 1 4 1517 1 1 11 PHE CB C -0.254 13.477 -6.175 1.00 . A A . 11 PHE CB 1 1 4 1518 1 1 11 PHE CD1 C -1.971 15.317 -5.880 1.00 . A A . 11 PHE CD1 1 1 4 1519 1 1 11 PHE CD2 C 0.149 15.893 -6.934 1.00 . A A . 11 PHE CD2 1 1 4 1520 1 1 11 PHE CE1 C -2.382 16.652 -5.996 1.00 . A A . 11 PHE CE1 1 1 4 1521 1 1 11 PHE CE2 C -0.273 17.222 -7.050 1.00 . A A . 11 PHE CE2 1 1 4 1522 1 1 11 PHE CG C -0.703 14.927 -6.344 1.00 . A A . 11 PHE CG 1 1 4 1523 1 1 11 PHE CZ C -1.535 17.601 -6.582 1.00 . A A . 11 PHE CZ 1 1 4 1524 1 1 11 PHE H H 0.067 10.973 -6.152 1.00 . A A . 11 PHE H 1 1 4 1525 1 1 11 PHE HA H -2.121 12.612 -6.798 1.00 . A A . 11 PHE HA 1 1 4 1526 1 1 11 PHE HB2 H -0.382 13.187 -5.149 1.00 . A A . 11 PHE HB2 1 1 4 1527 1 1 11 PHE HB3 H 0.789 13.382 -6.428 1.00 . A A . 11 PHE HB3 1 1 4 1528 1 1 11 PHE HD1 H -2.630 14.589 -5.431 1.00 . A A . 11 PHE HD1 1 1 4 1529 1 1 11 PHE HD2 H 1.129 15.609 -7.300 1.00 . A A . 11 PHE HD2 1 1 4 1530 1 1 11 PHE HE1 H -3.357 16.950 -5.637 1.00 . A A . 11 PHE HE1 1 1 4 1531 1 1 11 PHE HE2 H 0.379 17.956 -7.498 1.00 . A A . 11 PHE HE2 1 1 4 1532 1 1 11 PHE HZ H -1.855 18.629 -6.672 1.00 . A A . 11 PHE HZ 1 1 4 1533 1 1 11 PHE N N -0.629 11.148 -6.817 1.00 . A A . 11 PHE N 1 1 4 1534 1 1 11 PHE O O -1.813 13.320 -9.204 1.00 . A A . 11 PHE O 1 1 4 1535 1 1 12 LEU C C -0.144 11.842 -11.290 1.00 . A A . 12 LEU C 1 1 4 1536 1 1 12 LEU CA C 0.651 12.819 -10.426 1.00 . A A . 12 LEU CA 1 1 4 1537 1 1 12 LEU CB C 2.154 12.573 -10.643 1.00 . A A . 12 LEU CB 1 1 4 1538 1 1 12 LEU CD1 C 4.493 13.156 -9.902 1.00 . A A . 12 LEU CD1 1 1 4 1539 1 1 12 LEU CD2 C 2.812 15.025 -10.239 1.00 . A A . 12 LEU CD2 1 1 4 1540 1 1 12 LEU CG C 3.006 13.549 -9.789 1.00 . A A . 12 LEU CG 1 1 4 1541 1 1 12 LEU H H 0.988 12.210 -8.421 1.00 . A A . 12 LEU H 1 1 4 1542 1 1 12 LEU HA H 0.399 13.825 -10.716 1.00 . A A . 12 LEU HA 1 1 4 1543 1 1 12 LEU HB2 H 2.387 11.553 -10.357 1.00 . A A . 12 LEU HB2 1 1 4 1544 1 1 12 LEU HB3 H 2.394 12.708 -11.689 1.00 . A A . 12 LEU HB3 1 1 4 1545 1 1 12 LEU HD11 H 4.627 12.151 -9.530 1.00 . A A . 12 LEU HD11 1 1 4 1546 1 1 12 LEU HD12 H 5.093 13.839 -9.317 1.00 . A A . 12 LEU HD12 1 1 4 1547 1 1 12 LEU HD13 H 4.801 13.201 -10.936 1.00 . A A . 12 LEU HD13 1 1 4 1548 1 1 12 LEU HD21 H 1.908 15.413 -9.799 1.00 . A A . 12 LEU HD21 1 1 4 1549 1 1 12 LEU HD22 H 2.747 15.088 -11.315 1.00 . A A . 12 LEU HD22 1 1 4 1550 1 1 12 LEU HD23 H 3.647 15.628 -9.900 1.00 . A A . 12 LEU HD23 1 1 4 1551 1 1 12 LEU HG H 2.702 13.458 -8.760 1.00 . A A . 12 LEU HG 1 1 4 1552 1 1 12 LEU N N 0.314 12.599 -9.019 1.00 . A A . 12 LEU N 1 1 4 1553 1 1 12 LEU O O -0.585 12.175 -12.382 1.00 . A A . 12 LEU O 1 1 4 1554 1 1 13 GLY C C -2.440 9.921 -11.771 1.00 . A A . 13 GLY C 1 1 4 1555 1 1 13 GLY CA C -0.987 9.558 -11.499 1.00 . A A . 13 GLY CA 1 1 4 1556 1 1 13 GLY H H 0.116 10.422 -9.916 1.00 . A A . 13 GLY H 1 1 4 1557 1 1 13 GLY HA2 H -0.489 9.379 -12.435 1.00 . A A . 13 GLY HA2 1 1 4 1558 1 1 13 GLY HA3 H -0.952 8.669 -10.919 1.00 . A A . 13 GLY HA3 1 1 4 1559 1 1 13 GLY N N -0.283 10.620 -10.786 1.00 . A A . 13 GLY N 1 1 4 1560 1 1 13 GLY O O -3.101 9.300 -12.602 1.00 . A A . 13 GLY O 1 1 4 1561 1 1 14 GLY C C -4.301 12.534 -12.313 1.00 . A A . 14 GLY C 1 1 4 1562 1 1 14 GLY CA C -4.311 11.417 -11.274 1.00 . A A . 14 GLY CA 1 1 4 1563 1 1 14 GLY H H -2.351 11.398 -10.431 1.00 . A A . 14 GLY H 1 1 4 1564 1 1 14 GLY HA2 H -4.959 10.611 -11.612 1.00 . A A . 14 GLY HA2 1 1 4 1565 1 1 14 GLY HA3 H -4.688 11.811 -10.343 1.00 . A A . 14 GLY HA3 1 1 4 1566 1 1 14 GLY N N -2.932 10.940 -11.076 1.00 . A A . 14 GLY N 1 1 4 1567 1 1 14 GLY O O -5.123 12.569 -13.228 1.00 . A A . 14 GLY O 1 1 4 1568 1 1 15 ILE C C -2.600 14.145 -14.384 1.00 . A A . 15 ILE C 1 1 4 1569 1 1 15 ILE CA C -3.147 14.586 -13.033 1.00 . A A . 15 ILE CA 1 1 4 1570 1 1 15 ILE CB C -2.158 15.569 -12.359 1.00 . A A . 15 ILE CB 1 1 4 1571 1 1 15 ILE CD1 C -1.619 16.716 -10.168 1.00 . A A . 15 ILE CD1 1 1 4 1572 1 1 15 ILE CG1 C -2.706 15.987 -10.964 1.00 . A A . 15 ILE CG1 1 1 4 1573 1 1 15 ILE CG2 C -1.959 16.828 -13.242 1.00 . A A . 15 ILE CG2 1 1 4 1574 1 1 15 ILE H H -2.722 13.325 -11.395 1.00 . A A . 15 ILE H 1 1 4 1575 1 1 15 ILE HA H -4.093 15.090 -13.188 1.00 . A A . 15 ILE HA 1 1 4 1576 1 1 15 ILE HB H -1.205 15.066 -12.238 1.00 . A A . 15 ILE HB 1 1 4 1577 1 1 15 ILE HD11 H -0.755 16.075 -10.071 1.00 . A A . 15 ILE HD11 1 1 4 1578 1 1 15 ILE HD12 H -1.999 16.957 -9.189 1.00 . A A . 15 ILE HD12 1 1 4 1579 1 1 15 ILE HD13 H -1.340 17.623 -10.681 1.00 . A A . 15 ILE HD13 1 1 4 1580 1 1 15 ILE HG12 H -3.559 16.641 -11.086 1.00 . A A . 15 ILE HG12 1 1 4 1581 1 1 15 ILE HG13 H -3.010 15.114 -10.406 1.00 . A A . 15 ILE HG13 1 1 4 1582 1 1 15 ILE HG21 H -2.920 17.264 -13.473 1.00 . A A . 15 ILE HG21 1 1 4 1583 1 1 15 ILE HG22 H -1.457 16.559 -14.158 1.00 . A A . 15 ILE HG22 1 1 4 1584 1 1 15 ILE HG23 H -1.355 17.555 -12.716 1.00 . A A . 15 ILE HG23 1 1 4 1585 1 1 15 ILE N N -3.339 13.436 -12.147 1.00 . A A . 15 ILE N 1 1 4 1586 1 1 15 ILE O O -2.855 14.793 -15.398 1.00 . A A . 15 ILE O 1 1 4 1587 1 1 16 VAL C C -2.356 12.395 -16.701 1.00 . A A . 16 VAL C 1 1 4 1588 1 1 16 VAL CA C -1.238 12.601 -15.673 1.00 . A A . 16 VAL CA 1 1 4 1589 1 1 16 VAL CB C -0.432 11.287 -15.457 1.00 . A A . 16 VAL CB 1 1 4 1590 1 1 16 VAL CG1 C -1.376 10.097 -15.169 1.00 . A A . 16 VAL CG1 1 1 4 1591 1 1 16 VAL CG2 C 0.408 10.980 -16.711 1.00 . A A . 16 VAL CG2 1 1 4 1592 1 1 16 VAL H H -1.626 12.577 -13.577 1.00 . A A . 16 VAL H 1 1 4 1593 1 1 16 VAL HA H -0.571 13.377 -16.024 1.00 . A A . 16 VAL HA 1 1 4 1594 1 1 16 VAL HB H 0.229 11.418 -14.605 1.00 . A A . 16 VAL HB 1 1 4 1595 1 1 16 VAL HG11 H -1.901 9.805 -16.069 1.00 . A A . 16 VAL HG11 1 1 4 1596 1 1 16 VAL HG12 H -2.091 10.386 -14.424 1.00 . A A . 16 VAL HG12 1 1 4 1597 1 1 16 VAL HG13 H -0.800 9.257 -14.810 1.00 . A A . 16 VAL HG13 1 1 4 1598 1 1 16 VAL HG21 H 1.087 11.798 -16.900 1.00 . A A . 16 VAL HG21 1 1 4 1599 1 1 16 VAL HG22 H -0.250 10.854 -17.559 1.00 . A A . 16 VAL HG22 1 1 4 1600 1 1 16 VAL HG23 H 0.972 10.071 -16.555 1.00 . A A . 16 VAL HG23 1 1 4 1601 1 1 16 VAL N N -1.823 13.059 -14.410 1.00 . A A . 16 VAL N 1 1 4 1602 1 1 16 VAL O O -2.245 12.785 -17.857 1.00 . A A . 16 VAL O 1 1 4 1603 1 1 17 ARG C C -5.230 12.892 -17.476 1.00 . A A . 17 ARG C 1 1 4 1604 1 1 17 ARG CA C -4.607 11.540 -17.072 1.00 . A A . 17 ARG CA 1 1 4 1605 1 1 17 ARG CB C -5.619 10.663 -16.267 1.00 . A A . 17 ARG CB 1 1 4 1606 1 1 17 ARG CD C -7.198 10.625 -18.278 1.00 . A A . 17 ARG CD 1 1 4 1607 1 1 17 ARG CG C -6.494 9.778 -17.196 1.00 . A A . 17 ARG CG 1 1 4 1608 1 1 17 ARG CZ C -8.070 8.867 -19.756 1.00 . A A . 17 ARG CZ 1 1 4 1609 1 1 17 ARG H H -3.471 11.514 -15.296 1.00 . A A . 17 ARG H 1 1 4 1610 1 1 17 ARG HA H -4.292 11.012 -17.964 1.00 . A A . 17 ARG HA 1 1 4 1611 1 1 17 ARG HB2 H -5.065 10.014 -15.600 1.00 . A A . 17 ARG HB2 1 1 4 1612 1 1 17 ARG HB3 H -6.263 11.296 -15.666 1.00 . A A . 17 ARG HB3 1 1 4 1613 1 1 17 ARG HD2 H -7.603 11.524 -17.834 1.00 . A A . 17 ARG HD2 1 1 4 1614 1 1 17 ARG HD3 H -6.482 10.900 -19.045 1.00 . A A . 17 ARG HD3 1 1 4 1615 1 1 17 ARG HE H -9.218 10.084 -18.649 1.00 . A A . 17 ARG HE 1 1 4 1616 1 1 17 ARG HG2 H -5.869 9.033 -17.675 1.00 . A A . 17 ARG HG2 1 1 4 1617 1 1 17 ARG HG3 H -7.238 9.274 -16.600 1.00 . A A . 17 ARG HG3 1 1 4 1618 1 1 17 ARG HH11 H -6.078 9.060 -19.705 1.00 . A A . 17 ARG HH11 1 1 4 1619 1 1 17 ARG HH12 H -6.680 7.810 -20.741 1.00 . A A . 17 ARG HH12 1 1 4 1620 1 1 17 ARG HH21 H -10.012 8.450 -20.001 1.00 . A A . 17 ARG HH21 1 1 4 1621 1 1 17 ARG HH22 H -8.916 7.479 -20.926 1.00 . A A . 17 ARG HH22 1 1 4 1622 1 1 17 ARG N N -3.442 11.789 -16.236 1.00 . A A . 17 ARG N 1 1 4 1623 1 1 17 ARG NE N -8.295 9.859 -18.886 1.00 . A A . 17 ARG NE 1 1 4 1624 1 1 17 ARG NH1 N -6.848 8.555 -20.097 1.00 . A A . 17 ARG NH1 1 1 4 1625 1 1 17 ARG NH2 N -9.077 8.212 -20.266 1.00 . A A . 17 ARG NH2 1 1 4 1626 1 1 17 ARG O O -5.645 13.094 -18.617 1.00 . A A . 17 ARG O 1 1 4 1627 1 1 18 ALA C C -5.150 15.870 -17.895 1.00 . A A . 18 ALA C 1 1 4 1628 1 1 18 ALA CA C -5.875 15.138 -16.760 1.00 . A A . 18 ALA CA 1 1 4 1629 1 1 18 ALA CB C -5.824 15.989 -15.478 1.00 . A A . 18 ALA CB 1 1 4 1630 1 1 18 ALA H H -4.950 13.604 -15.621 1.00 . A A . 18 ALA H 1 1 4 1631 1 1 18 ALA HA H -6.908 15.005 -17.038 1.00 . A A . 18 ALA HA 1 1 4 1632 1 1 18 ALA HB1 H -6.251 15.428 -14.659 1.00 . A A . 18 ALA HB1 1 1 4 1633 1 1 18 ALA HB2 H -6.388 16.900 -15.621 1.00 . A A . 18 ALA HB2 1 1 4 1634 1 1 18 ALA HB3 H -4.801 16.239 -15.242 1.00 . A A . 18 ALA HB3 1 1 4 1635 1 1 18 ALA N N -5.293 13.817 -16.514 1.00 . A A . 18 ALA N 1 1 4 1636 1 1 18 ALA O O -5.780 16.547 -18.707 1.00 . A A . 18 ALA O 1 1 4 1637 1 1 19 MET C C -3.400 15.906 -20.357 1.00 . A A . 19 MET C 1 1 4 1638 1 1 19 MET CA C -3.024 16.395 -18.959 1.00 . A A . 19 MET CA 1 1 4 1639 1 1 19 MET CB C -1.550 16.065 -18.683 1.00 . A A . 19 MET CB 1 1 4 1640 1 1 19 MET CE C 1.097 17.771 -16.048 1.00 . A A . 19 MET CE 1 1 4 1641 1 1 19 MET CG C -1.028 16.855 -17.475 1.00 . A A . 19 MET CG 1 1 4 1642 1 1 19 MET H H -3.373 15.197 -17.269 1.00 . A A . 19 MET H 1 1 4 1643 1 1 19 MET HA H -3.175 17.464 -18.912 1.00 . A A . 19 MET HA 1 1 4 1644 1 1 19 MET HB2 H -1.459 15.011 -18.473 1.00 . A A . 19 MET HB2 1 1 4 1645 1 1 19 MET HB3 H -0.965 16.294 -19.543 1.00 . A A . 19 MET HB3 1 1 4 1646 1 1 19 MET HE1 H 0.988 18.710 -16.572 1.00 . A A . 19 MET HE1 1 1 4 1647 1 1 19 MET HE2 H 2.113 17.672 -15.702 1.00 . A A . 19 MET HE2 1 1 4 1648 1 1 19 MET HE3 H 0.426 17.746 -15.201 1.00 . A A . 19 MET HE3 1 1 4 1649 1 1 19 MET HG2 H -1.104 17.912 -17.670 1.00 . A A . 19 MET HG2 1 1 4 1650 1 1 19 MET HG3 H -1.620 16.607 -16.605 1.00 . A A . 19 MET HG3 1 1 4 1651 1 1 19 MET N N -3.826 15.739 -17.939 1.00 . A A . 19 MET N 1 1 4 1652 1 1 19 MET O O -3.759 16.700 -21.224 1.00 . A A . 19 MET O 1 1 4 1653 1 1 19 MET SD S 0.702 16.409 -17.171 1.00 . A A . 19 MET SD 1 1 4 1654 1 1 20 LEU C C -5.131 14.311 -22.176 1.00 . A A . 20 LEU C 1 1 4 1655 1 1 20 LEU CA C -3.667 14.009 -21.859 1.00 . A A . 20 LEU CA 1 1 4 1656 1 1 20 LEU CB C -3.435 12.472 -21.818 1.00 . A A . 20 LEU CB 1 1 4 1657 1 1 20 LEU CD1 C -1.009 12.789 -21.110 1.00 . A A . 20 LEU CD1 1 1 4 1658 1 1 20 LEU CD2 C -1.788 10.577 -22.025 1.00 . A A . 20 LEU CD2 1 1 4 1659 1 1 20 LEU CG C -1.956 12.105 -22.117 1.00 . A A . 20 LEU CG 1 1 4 1660 1 1 20 LEU H H -3.033 14.019 -19.828 1.00 . A A . 20 LEU H 1 1 4 1661 1 1 20 LEU HA H -3.049 14.451 -22.632 1.00 . A A . 20 LEU HA 1 1 4 1662 1 1 20 LEU HB2 H -3.695 12.108 -20.834 1.00 . A A . 20 LEU HB2 1 1 4 1663 1 1 20 LEU HB3 H -4.068 11.986 -22.550 1.00 . A A . 20 LEU HB3 1 1 4 1664 1 1 20 LEU HD11 H -1.022 13.857 -21.265 1.00 . A A . 20 LEU HD11 1 1 4 1665 1 1 20 LEU HD12 H 0.001 12.425 -21.249 1.00 . A A . 20 LEU HD12 1 1 4 1666 1 1 20 LEU HD13 H -1.329 12.568 -20.105 1.00 . A A . 20 LEU HD13 1 1 4 1667 1 1 20 LEU HD21 H -2.031 10.249 -21.025 1.00 . A A . 20 LEU HD21 1 1 4 1668 1 1 20 LEU HD22 H -0.765 10.314 -22.251 1.00 . A A . 20 LEU HD22 1 1 4 1669 1 1 20 LEU HD23 H -2.447 10.096 -22.734 1.00 . A A . 20 LEU HD23 1 1 4 1670 1 1 20 LEU HG H -1.705 12.432 -23.116 1.00 . A A . 20 LEU HG 1 1 4 1671 1 1 20 LEU N N -3.325 14.597 -20.561 1.00 . A A . 20 LEU N 1 1 4 1672 1 1 20 LEU O O -5.479 14.658 -23.305 1.00 . A A . 20 LEU O 1 1 4 1673 1 1 21 GLY C C -7.613 15.928 -21.645 1.00 . A A . 21 GLY C 1 1 4 1674 1 1 21 GLY CA C -7.397 14.461 -21.311 1.00 . A A . 21 GLY CA 1 1 4 1675 1 1 21 GLY H H -5.615 13.926 -20.279 1.00 . A A . 21 GLY H 1 1 4 1676 1 1 21 GLY HA2 H -7.800 13.849 -22.107 1.00 . A A . 21 GLY HA2 1 1 4 1677 1 1 21 GLY HA3 H -7.908 14.231 -20.388 1.00 . A A . 21 GLY HA3 1 1 4 1678 1 1 21 GLY N N -5.969 14.190 -21.157 1.00 . A A . 21 GLY N 1 1 4 1679 1 1 21 GLY O O -8.561 16.291 -22.340 1.00 . A A . 21 GLY O 1 1 4 1680 1 1 22 SER C C -6.093 18.603 -22.670 1.00 . A A . 22 SER C 1 1 4 1681 1 1 22 SER CA C -6.785 18.221 -21.359 1.00 . A A . 22 SER CA 1 1 4 1682 1 1 22 SER CB C -6.119 18.946 -20.178 1.00 . A A . 22 SER CB 1 1 4 1683 1 1 22 SER H H -5.984 16.407 -20.588 1.00 . A A . 22 SER H 1 1 4 1684 1 1 22 SER HA H -7.822 18.537 -21.410 1.00 . A A . 22 SER HA 1 1 4 1685 1 1 22 SER HB2 H -5.136 18.535 -20.007 1.00 . A A . 22 SER HB2 1 1 4 1686 1 1 22 SER HB3 H -6.034 20.006 -20.393 1.00 . A A . 22 SER HB3 1 1 4 1687 1 1 22 SER HG H -6.645 19.413 -18.365 1.00 . A A . 22 SER HG 1 1 4 1688 1 1 22 SER N N -6.716 16.771 -21.132 1.00 . A A . 22 SER N 1 1 4 1689 1 1 22 SER O O -6.452 19.597 -23.301 1.00 . A A . 22 SER O 1 1 4 1690 1 1 22 SER OG O -6.908 18.754 -19.011 1.00 . A A . 22 SER OG 1 1 4 1691 1 1 23 PHE C C -5.279 18.076 -25.517 1.00 . A A . 23 PHE C 1 1 4 1692 1 1 23 PHE CA C -4.354 18.095 -24.298 1.00 . A A . 23 PHE CA 1 1 4 1693 1 1 23 PHE CB C -3.226 17.059 -24.479 1.00 . A A . 23 PHE CB 1 1 4 1694 1 1 23 PHE CD1 C -1.333 18.397 -25.521 1.00 . A A . 23 PHE CD1 1 1 4 1695 1 1 23 PHE CD2 C -2.567 16.861 -26.940 1.00 . A A . 23 PHE CD2 1 1 4 1696 1 1 23 PHE CE1 C -0.538 18.763 -26.613 1.00 . A A . 23 PHE CE1 1 1 4 1697 1 1 23 PHE CE2 C -1.767 17.229 -28.029 1.00 . A A . 23 PHE CE2 1 1 4 1698 1 1 23 PHE CG C -2.352 17.443 -25.677 1.00 . A A . 23 PHE CG 1 1 4 1699 1 1 23 PHE CZ C -0.753 18.179 -27.865 1.00 . A A . 23 PHE CZ 1 1 4 1700 1 1 23 PHE H H -4.849 17.042 -22.524 1.00 . A A . 23 PHE H 1 1 4 1701 1 1 23 PHE HA H -3.910 19.079 -24.217 1.00 . A A . 23 PHE HA 1 1 4 1702 1 1 23 PHE HB2 H -2.621 17.035 -23.581 1.00 . A A . 23 PHE HB2 1 1 4 1703 1 1 23 PHE HB3 H -3.657 16.077 -24.635 1.00 . A A . 23 PHE HB3 1 1 4 1704 1 1 23 PHE HD1 H -1.163 18.851 -24.556 1.00 . A A . 23 PHE HD1 1 1 4 1705 1 1 23 PHE HD2 H -3.348 16.127 -27.070 1.00 . A A . 23 PHE HD2 1 1 4 1706 1 1 23 PHE HE1 H 0.247 19.496 -26.488 1.00 . A A . 23 PHE HE1 1 1 4 1707 1 1 23 PHE HE2 H -1.933 16.780 -28.998 1.00 . A A . 23 PHE HE2 1 1 4 1708 1 1 23 PHE HZ H -0.138 18.464 -28.706 1.00 . A A . 23 PHE HZ 1 1 4 1709 1 1 23 PHE N N -5.095 17.816 -23.068 1.00 . A A . 23 PHE N 1 1 4 1710 1 1 23 PHE O O -5.210 18.963 -26.366 1.00 . A A . 23 PHE O 1 1 4 1711 1 1 24 ARG C C -8.054 18.103 -26.720 1.00 . A A . 24 ARG C 1 1 4 1712 1 1 24 ARG CA C -7.062 16.938 -26.729 1.00 . A A . 24 ARG CA 1 1 4 1713 1 1 24 ARG CB C -7.818 15.599 -26.635 1.00 . A A . 24 ARG CB 1 1 4 1714 1 1 24 ARG CD C -7.576 13.094 -26.693 1.00 . A A . 24 ARG CD 1 1 4 1715 1 1 24 ARG CG C -6.831 14.431 -26.797 1.00 . A A . 24 ARG CG 1 1 4 1716 1 1 24 ARG CZ C -7.025 10.721 -26.985 1.00 . A A . 24 ARG CZ 1 1 4 1717 1 1 24 ARG H H -6.143 16.375 -24.899 1.00 . A A . 24 ARG H 1 1 4 1718 1 1 24 ARG HA H -6.504 16.965 -27.657 1.00 . A A . 24 ARG HA 1 1 4 1719 1 1 24 ARG HB2 H -8.298 15.529 -25.668 1.00 . A A . 24 ARG HB2 1 1 4 1720 1 1 24 ARG HB3 H -8.567 15.543 -27.413 1.00 . A A . 24 ARG HB3 1 1 4 1721 1 1 24 ARG HD2 H -8.080 13.035 -25.740 1.00 . A A . 24 ARG HD2 1 1 4 1722 1 1 24 ARG HD3 H -8.308 13.034 -27.490 1.00 . A A . 24 ARG HD3 1 1 4 1723 1 1 24 ARG HE H -5.666 12.174 -26.755 1.00 . A A . 24 ARG HE 1 1 4 1724 1 1 24 ARG HG2 H -6.350 14.500 -27.763 1.00 . A A . 24 ARG HG2 1 1 4 1725 1 1 24 ARG HG3 H -6.082 14.483 -26.019 1.00 . A A . 24 ARG HG3 1 1 4 1726 1 1 24 ARG HH11 H -8.980 11.155 -26.950 1.00 . A A . 24 ARG HH11 1 1 4 1727 1 1 24 ARG HH12 H -8.589 9.481 -27.160 1.00 . A A . 24 ARG HH12 1 1 4 1728 1 1 24 ARG HH21 H -5.161 9.995 -27.037 1.00 . A A . 24 ARG HH21 1 1 4 1729 1 1 24 ARG HH22 H -6.424 8.825 -27.228 1.00 . A A . 24 ARG HH22 1 1 4 1730 1 1 24 ARG N N -6.136 17.058 -25.602 1.00 . A A . 24 ARG N 1 1 4 1731 1 1 24 ARG NE N -6.626 11.984 -26.808 1.00 . A A . 24 ARG NE 1 1 4 1732 1 1 24 ARG NH1 N -8.298 10.429 -27.040 1.00 . A A . 24 ARG NH1 1 1 4 1733 1 1 24 ARG NH2 N -6.135 9.773 -27.091 1.00 . A A . 24 ARG NH2 1 1 4 1734 1 1 24 ARG O O -9.209 17.951 -26.323 1.00 . A A . 24 ARG O 1 1 4 1735 1 1 25 LYS C C -9.590 20.244 -28.190 1.00 . A A . 25 LYS C 1 1 4 1736 1 1 25 LYS CA C -8.428 20.465 -27.223 1.00 . A A . 25 LYS CA 1 1 4 1737 1 1 25 LYS CB C -7.573 21.664 -27.673 1.00 . A A . 25 LYS CB 1 1 4 1738 1 1 25 LYS CD C -7.503 24.156 -28.024 1.00 . A A . 25 LYS CD 1 1 4 1739 1 1 25 LYS CE C -8.311 25.456 -27.951 1.00 . A A . 25 LYS CE 1 1 4 1740 1 1 25 LYS CG C -8.392 22.969 -27.621 1.00 . A A . 25 LYS CG 1 1 4 1741 1 1 25 LYS H H -6.659 19.322 -27.478 1.00 . A A . 25 LYS H 1 1 4 1742 1 1 25 LYS HA H -8.822 20.663 -26.235 1.00 . A A . 25 LYS HA 1 1 4 1743 1 1 25 LYS HB2 H -6.722 21.752 -27.012 1.00 . A A . 25 LYS HB2 1 1 4 1744 1 1 25 LYS HB3 H -7.223 21.501 -28.682 1.00 . A A . 25 LYS HB3 1 1 4 1745 1 1 25 LYS HD2 H -6.657 24.217 -27.354 1.00 . A A . 25 LYS HD2 1 1 4 1746 1 1 25 LYS HD3 H -7.152 24.012 -29.035 1.00 . A A . 25 LYS HD3 1 1 4 1747 1 1 25 LYS HE2 H -8.664 25.609 -26.941 1.00 . A A . 25 LYS HE2 1 1 4 1748 1 1 25 LYS HE3 H -7.685 26.286 -28.243 1.00 . A A . 25 LYS HE3 1 1 4 1749 1 1 25 LYS HG2 H -9.229 22.904 -28.301 1.00 . A A . 25 LYS HG2 1 1 4 1750 1 1 25 LYS HG3 H -8.756 23.121 -26.616 1.00 . A A . 25 LYS HG3 1 1 4 1751 1 1 25 LYS HZ1 H -9.905 26.300 -28.992 1.00 . A A . 25 LYS HZ1 1 1 4 1752 1 1 25 LYS HZ2 H -10.176 24.699 -28.489 1.00 . A A . 25 LYS HZ2 1 1 4 1753 1 1 25 LYS HZ3 H -9.149 25.018 -29.804 1.00 . A A . 25 LYS HZ3 1 1 4 1754 1 1 25 LYS N N -7.588 19.267 -27.170 1.00 . A A . 25 LYS N 1 1 4 1755 1 1 25 LYS NZ N -9.474 25.362 -28.878 1.00 . A A . 25 LYS NZ 1 1 4 1756 1 1 25 LYS O O -10.722 20.644 -27.917 1.00 . A A . 25 LYS O 1 1 4 1757 1 1 26 ASP C C -11.005 20.605 -30.797 1.00 . A A . 26 ASP C 1 1 4 1758 1 1 26 ASP CA C -10.299 19.322 -30.346 1.00 . A A . 26 ASP CA 1 1 4 1759 1 1 26 ASP CB C -11.329 18.313 -29.804 1.00 . A A . 26 ASP CB 1 1 4 1760 1 1 26 ASP CG C -12.309 17.903 -30.905 1.00 . A A . 26 ASP CG 1 1 4 1761 1 1 26 ASP H H -8.366 19.317 -29.471 1.00 . A A . 26 ASP H 1 1 4 1762 1 1 26 ASP HA H -9.801 18.883 -31.199 1.00 . A A . 26 ASP HA 1 1 4 1763 1 1 26 ASP HB2 H -10.811 17.437 -29.444 1.00 . A A . 26 ASP HB2 1 1 4 1764 1 1 26 ASP HB3 H -11.877 18.761 -28.987 1.00 . A A . 26 ASP HB3 1 1 4 1765 1 1 26 ASP N N -9.291 19.606 -29.322 1.00 . A A . 26 ASP N 1 1 4 1766 1 1 26 ASP O O -11.208 20.758 -31.990 1.00 . A A . 26 ASP O 1 1 4 1767 1 1 26 ASP OD1 O -11.848 17.432 -31.932 1.00 . A A . 26 ASP OD1 1 1 4 1768 1 1 26 ASP OD2 O -13.501 18.073 -30.707 1.00 . A A . 26 ASP OD2 1 1 5 1769 1 1 1 MET C C 11.970 5.283 -0.884 1.00 . A A . 1 MET C 1 1 5 1770 1 1 1 MET CA C 12.832 4.814 -2.057 1.00 . A A . 1 MET CA 1 1 5 1771 1 1 1 MET CB C 12.369 3.431 -2.569 1.00 . A A . 1 MET CB 1 1 5 1772 1 1 1 MET CE C 9.620 3.812 -5.613 1.00 . A A . 1 MET CE 1 1 5 1773 1 1 1 MET CG C 10.981 3.521 -3.243 1.00 . A A . 1 MET CG 1 1 5 1774 1 1 1 MET H1 H 14.682 3.856 -1.991 1.00 . A A . 1 MET H1 1 1 5 1775 1 1 1 MET H2 H 14.279 4.684 -0.563 1.00 . A A . 1 MET H2 1 1 5 1776 1 1 1 MET H3 H 14.776 5.549 -1.938 1.00 . A A . 1 MET H3 1 1 5 1777 1 1 1 MET HA H 12.772 5.539 -2.854 1.00 . A A . 1 MET HA 1 1 5 1778 1 1 1 MET HB2 H 13.086 3.063 -3.288 1.00 . A A . 1 MET HB2 1 1 5 1779 1 1 1 MET HB3 H 12.318 2.740 -1.737 1.00 . A A . 1 MET HB3 1 1 5 1780 1 1 1 MET HE1 H 9.829 2.835 -6.026 1.00 . A A . 1 MET HE1 1 1 5 1781 1 1 1 MET HE2 H 9.328 4.479 -6.407 1.00 . A A . 1 MET HE2 1 1 5 1782 1 1 1 MET HE3 H 8.817 3.741 -4.892 1.00 . A A . 1 MET HE3 1 1 5 1783 1 1 1 MET HG2 H 10.623 2.522 -3.454 1.00 . A A . 1 MET HG2 1 1 5 1784 1 1 1 MET HG3 H 10.282 4.016 -2.585 1.00 . A A . 1 MET HG3 1 1 5 1785 1 1 1 MET N N 14.250 4.718 -1.603 1.00 . A A . 1 MET N 1 1 5 1786 1 1 1 MET O O 11.497 4.474 -0.085 1.00 . A A . 1 MET O 1 1 5 1787 1 1 1 MET SD S 11.110 4.452 -4.800 1.00 . A A . 1 MET SD 1 1 5 1788 1 1 2 LYS C C 9.488 6.826 0.080 1.00 . A A . 2 LYS C 1 1 5 1789 1 1 2 LYS CA C 10.963 7.184 0.283 1.00 . A A . 2 LYS CA 1 1 5 1790 1 1 2 LYS CB C 11.126 8.719 0.289 1.00 . A A . 2 LYS CB 1 1 5 1791 1 1 2 LYS CD C 13.210 8.882 1.788 1.00 . A A . 2 LYS CD 1 1 5 1792 1 1 2 LYS CE C 14.656 9.401 1.843 1.00 . A A . 2 LYS CE 1 1 5 1793 1 1 2 LYS CG C 12.618 9.150 0.386 1.00 . A A . 2 LYS CG 1 1 5 1794 1 1 2 LYS H H 12.172 7.190 -1.461 1.00 . A A . 2 LYS H 1 1 5 1795 1 1 2 LYS HA H 11.279 6.785 1.234 1.00 . A A . 2 LYS HA 1 1 5 1796 1 1 2 LYS HB2 H 10.705 9.121 -0.624 1.00 . A A . 2 LYS HB2 1 1 5 1797 1 1 2 LYS HB3 H 10.583 9.125 1.131 1.00 . A A . 2 LYS HB3 1 1 5 1798 1 1 2 LYS HD2 H 12.616 9.389 2.534 1.00 . A A . 2 LYS HD2 1 1 5 1799 1 1 2 LYS HD3 H 13.215 7.825 1.990 1.00 . A A . 2 LYS HD3 1 1 5 1800 1 1 2 LYS HE2 H 15.261 8.860 1.131 1.00 . A A . 2 LYS HE2 1 1 5 1801 1 1 2 LYS HE3 H 14.674 10.455 1.602 1.00 . A A . 2 LYS HE3 1 1 5 1802 1 1 2 LYS HG2 H 13.196 8.610 -0.349 1.00 . A A . 2 LYS HG2 1 1 5 1803 1 1 2 LYS HG3 H 12.690 10.211 0.171 1.00 . A A . 2 LYS HG3 1 1 5 1804 1 1 2 LYS HZ1 H 15.594 10.099 3.565 1.00 . A A . 2 LYS HZ1 1 1 5 1805 1 1 2 LYS HZ2 H 15.963 8.485 3.183 1.00 . A A . 2 LYS HZ2 1 1 5 1806 1 1 2 LYS HZ3 H 14.450 8.881 3.850 1.00 . A A . 2 LYS HZ3 1 1 5 1807 1 1 2 LYS N N 11.769 6.599 -0.792 1.00 . A A . 2 LYS N 1 1 5 1808 1 1 2 LYS NZ N 15.207 9.201 3.213 1.00 . A A . 2 LYS NZ 1 1 5 1809 1 1 2 LYS O O 9.041 6.607 -1.044 1.00 . A A . 2 LYS O 1 1 5 1810 1 1 3 PHE C C 6.498 7.462 0.400 1.00 . A A . 3 PHE C 1 1 5 1811 1 1 3 PHE CA C 7.327 6.399 1.136 1.00 . A A . 3 PHE CA 1 1 5 1812 1 1 3 PHE CB C 6.787 6.247 2.566 1.00 . A A . 3 PHE CB 1 1 5 1813 1 1 3 PHE CD1 C 7.192 3.818 3.206 1.00 . A A . 3 PHE CD1 1 1 5 1814 1 1 3 PHE CD2 C 8.694 5.514 4.082 1.00 . A A . 3 PHE CD2 1 1 5 1815 1 1 3 PHE CE1 C 7.918 2.830 3.881 1.00 . A A . 3 PHE CE1 1 1 5 1816 1 1 3 PHE CE2 C 9.416 4.522 4.756 1.00 . A A . 3 PHE CE2 1 1 5 1817 1 1 3 PHE CG C 7.576 5.166 3.303 1.00 . A A . 3 PHE CG 1 1 5 1818 1 1 3 PHE CZ C 9.028 3.181 4.657 1.00 . A A . 3 PHE CZ 1 1 5 1819 1 1 3 PHE H H 9.166 6.925 2.053 1.00 . A A . 3 PHE H 1 1 5 1820 1 1 3 PHE HA H 7.213 5.455 0.621 1.00 . A A . 3 PHE HA 1 1 5 1821 1 1 3 PHE HB2 H 6.876 7.194 3.086 1.00 . A A . 3 PHE HB2 1 1 5 1822 1 1 3 PHE HB3 H 5.741 5.966 2.525 1.00 . A A . 3 PHE HB3 1 1 5 1823 1 1 3 PHE HD1 H 6.334 3.544 2.609 1.00 . A A . 3 PHE HD1 1 1 5 1824 1 1 3 PHE HD2 H 8.996 6.547 4.161 1.00 . A A . 3 PHE HD2 1 1 5 1825 1 1 3 PHE HE1 H 7.620 1.794 3.804 1.00 . A A . 3 PHE HE1 1 1 5 1826 1 1 3 PHE HE2 H 10.274 4.792 5.354 1.00 . A A . 3 PHE HE2 1 1 5 1827 1 1 3 PHE HZ H 9.586 2.418 5.178 1.00 . A A . 3 PHE HZ 1 1 5 1828 1 1 3 PHE N N 8.748 6.751 1.184 1.00 . A A . 3 PHE N 1 1 5 1829 1 1 3 PHE O O 5.596 7.125 -0.367 1.00 . A A . 3 PHE O 1 1 5 1830 1 1 4 TYR C C 6.152 9.807 -1.483 1.00 . A A . 4 TYR C 1 1 5 1831 1 1 4 TYR CA C 6.002 9.825 0.038 1.00 . A A . 4 TYR CA 1 1 5 1832 1 1 4 TYR CB C 6.406 11.199 0.621 1.00 . A A . 4 TYR CB 1 1 5 1833 1 1 4 TYR CD1 C 8.031 12.198 -1.061 1.00 . A A . 4 TYR CD1 1 1 5 1834 1 1 4 TYR CD2 C 8.918 11.387 1.051 1.00 . A A . 4 TYR CD2 1 1 5 1835 1 1 4 TYR CE1 C 9.318 12.581 -1.452 1.00 . A A . 4 TYR CE1 1 1 5 1836 1 1 4 TYR CE2 C 10.203 11.777 0.656 1.00 . A A . 4 TYR CE2 1 1 5 1837 1 1 4 TYR CG C 7.822 11.597 0.195 1.00 . A A . 4 TYR CG 1 1 5 1838 1 1 4 TYR CZ C 10.404 12.372 -0.595 1.00 . A A . 4 TYR CZ 1 1 5 1839 1 1 4 TYR H H 7.483 8.962 1.303 1.00 . A A . 4 TYR H 1 1 5 1840 1 1 4 TYR HA H 4.957 9.660 0.265 1.00 . A A . 4 TYR HA 1 1 5 1841 1 1 4 TYR HB2 H 5.705 11.952 0.278 1.00 . A A . 4 TYR HB2 1 1 5 1842 1 1 4 TYR HB3 H 6.351 11.145 1.701 1.00 . A A . 4 TYR HB3 1 1 5 1843 1 1 4 TYR HD1 H 7.196 12.361 -1.727 1.00 . A A . 4 TYR HD1 1 1 5 1844 1 1 4 TYR HD2 H 8.769 10.927 2.017 1.00 . A A . 4 TYR HD2 1 1 5 1845 1 1 4 TYR HE1 H 9.475 13.043 -2.417 1.00 . A A . 4 TYR HE1 1 1 5 1846 1 1 4 TYR HE2 H 11.041 11.615 1.317 1.00 . A A . 4 TYR HE2 1 1 5 1847 1 1 4 TYR HH H 11.685 13.714 -1.043 1.00 . A A . 4 TYR HH 1 1 5 1848 1 1 4 TYR N N 6.775 8.744 0.663 1.00 . A A . 4 TYR N 1 1 5 1849 1 1 4 TYR O O 5.337 10.385 -2.201 1.00 . A A . 4 TYR O 1 1 5 1850 1 1 4 TYR OH O 11.671 12.756 -0.982 1.00 . A A . 4 TYR OH 1 1 5 1851 1 1 5 THR C C 6.248 8.289 -4.079 1.00 . A A . 5 THR C 1 1 5 1852 1 1 5 THR CA C 7.418 9.019 -3.409 1.00 . A A . 5 THR CA 1 1 5 1853 1 1 5 THR CB C 8.748 8.287 -3.675 1.00 . A A . 5 THR CB 1 1 5 1854 1 1 5 THR CG2 C 9.129 8.377 -5.159 1.00 . A A . 5 THR CG2 1 1 5 1855 1 1 5 THR H H 7.794 8.677 -1.350 1.00 . A A . 5 THR H 1 1 5 1856 1 1 5 THR HA H 7.482 10.020 -3.822 1.00 . A A . 5 THR HA 1 1 5 1857 1 1 5 THR HB H 8.651 7.251 -3.399 1.00 . A A . 5 THR HB 1 1 5 1858 1 1 5 THR HG1 H 9.350 9.382 -2.188 1.00 . A A . 5 THR HG1 1 1 5 1859 1 1 5 THR HG21 H 8.360 7.914 -5.760 1.00 . A A . 5 THR HG21 1 1 5 1860 1 1 5 THR HG22 H 10.066 7.866 -5.321 1.00 . A A . 5 THR HG22 1 1 5 1861 1 1 5 THR HG23 H 9.231 9.414 -5.442 1.00 . A A . 5 THR HG23 1 1 5 1862 1 1 5 THR N N 7.186 9.126 -1.969 1.00 . A A . 5 THR N 1 1 5 1863 1 1 5 THR O O 5.760 8.724 -5.122 1.00 . A A . 5 THR O 1 1 5 1864 1 1 5 THR OG1 O 9.769 8.877 -2.887 1.00 . A A . 5 THR OG1 1 1 5 1865 1 1 6 ILE C C 3.424 7.331 -4.027 1.00 . A A . 6 ILE C 1 1 5 1866 1 1 6 ILE CA C 4.659 6.428 -4.025 1.00 . A A . 6 ILE CA 1 1 5 1867 1 1 6 ILE CB C 4.375 5.141 -3.183 1.00 . A A . 6 ILE CB 1 1 5 1868 1 1 6 ILE CD1 C 6.851 4.656 -2.700 1.00 . A A . 6 ILE CD1 1 1 5 1869 1 1 6 ILE CG1 C 5.550 4.129 -3.325 1.00 . A A . 6 ILE CG1 1 1 5 1870 1 1 6 ILE CG2 C 3.066 4.445 -3.665 1.00 . A A . 6 ILE CG2 1 1 5 1871 1 1 6 ILE H H 6.202 6.892 -2.633 1.00 . A A . 6 ILE H 1 1 5 1872 1 1 6 ILE HA H 4.887 6.143 -5.043 1.00 . A A . 6 ILE HA 1 1 5 1873 1 1 6 ILE HB H 4.261 5.418 -2.144 1.00 . A A . 6 ILE HB 1 1 5 1874 1 1 6 ILE HD11 H 7.474 3.818 -2.427 1.00 . A A . 6 ILE HD11 1 1 5 1875 1 1 6 ILE HD12 H 6.647 5.247 -1.815 1.00 . A A . 6 ILE HD12 1 1 5 1876 1 1 6 ILE HD13 H 7.368 5.251 -3.427 1.00 . A A . 6 ILE HD13 1 1 5 1877 1 1 6 ILE HG12 H 5.288 3.202 -2.834 1.00 . A A . 6 ILE HG12 1 1 5 1878 1 1 6 ILE HG13 H 5.721 3.933 -4.375 1.00 . A A . 6 ILE HG13 1 1 5 1879 1 1 6 ILE HG21 H 2.207 5.052 -3.414 1.00 . A A . 6 ILE HG21 1 1 5 1880 1 1 6 ILE HG22 H 2.960 3.482 -3.181 1.00 . A A . 6 ILE HG22 1 1 5 1881 1 1 6 ILE HG23 H 3.105 4.303 -4.735 1.00 . A A . 6 ILE HG23 1 1 5 1882 1 1 6 ILE N N 5.788 7.186 -3.469 1.00 . A A . 6 ILE N 1 1 5 1883 1 1 6 ILE O O 2.678 7.379 -5.000 1.00 . A A . 6 ILE O 1 1 5 1884 1 1 7 LYS C C 2.092 10.027 -3.828 1.00 . A A . 7 LYS C 1 1 5 1885 1 1 7 LYS CA C 2.080 8.928 -2.772 1.00 . A A . 7 LYS CA 1 1 5 1886 1 1 7 LYS CB C 2.132 9.554 -1.360 1.00 . A A . 7 LYS CB 1 1 5 1887 1 1 7 LYS CD C 1.022 11.095 0.298 1.00 . A A . 7 LYS CD 1 1 5 1888 1 1 7 LYS CE C -0.116 12.100 0.509 1.00 . A A . 7 LYS CE 1 1 5 1889 1 1 7 LYS CG C 0.980 10.556 -1.140 1.00 . A A . 7 LYS CG 1 1 5 1890 1 1 7 LYS H H 3.856 7.945 -2.175 1.00 . A A . 7 LYS H 1 1 5 1891 1 1 7 LYS HA H 1.168 8.358 -2.866 1.00 . A A . 7 LYS HA 1 1 5 1892 1 1 7 LYS HB2 H 2.064 8.765 -0.624 1.00 . A A . 7 LYS HB2 1 1 5 1893 1 1 7 LYS HB3 H 3.074 10.067 -1.240 1.00 . A A . 7 LYS HB3 1 1 5 1894 1 1 7 LYS HD2 H 0.913 10.274 0.992 1.00 . A A . 7 LYS HD2 1 1 5 1895 1 1 7 LYS HD3 H 1.968 11.586 0.469 1.00 . A A . 7 LYS HD3 1 1 5 1896 1 1 7 LYS HE2 H 0.006 12.929 -0.177 1.00 . A A . 7 LYS HE2 1 1 5 1897 1 1 7 LYS HE3 H -1.065 11.618 0.327 1.00 . A A . 7 LYS HE3 1 1 5 1898 1 1 7 LYS HG2 H 1.080 11.387 -1.823 1.00 . A A . 7 LYS HG2 1 1 5 1899 1 1 7 LYS HG3 H 0.043 10.062 -1.314 1.00 . A A . 7 LYS HG3 1 1 5 1900 1 1 7 LYS HZ1 H 0.534 11.992 2.484 1.00 . A A . 7 LYS HZ1 1 1 5 1901 1 1 7 LYS HZ2 H -1.038 12.608 2.304 1.00 . A A . 7 LYS HZ2 1 1 5 1902 1 1 7 LYS HZ3 H 0.305 13.574 1.918 1.00 . A A . 7 LYS HZ3 1 1 5 1903 1 1 7 LYS N N 3.224 8.034 -2.918 1.00 . A A . 7 LYS N 1 1 5 1904 1 1 7 LYS NZ N -0.076 12.607 1.910 1.00 . A A . 7 LYS NZ 1 1 5 1905 1 1 7 LYS O O 1.082 10.269 -4.491 1.00 . A A . 7 LYS O 1 1 5 1906 1 1 8 LEU C C 3.253 11.251 -6.328 1.00 . A A . 8 LEU C 1 1 5 1907 1 1 8 LEU CA C 3.321 11.809 -4.917 1.00 . A A . 8 LEU CA 1 1 5 1908 1 1 8 LEU CB C 4.636 12.589 -4.700 1.00 . A A . 8 LEU CB 1 1 5 1909 1 1 8 LEU CD1 C 3.578 14.935 -4.987 1.00 . A A . 8 LEU CD1 1 1 5 1910 1 1 8 LEU CD2 C 6.041 14.554 -5.456 1.00 . A A . 8 LEU CD2 1 1 5 1911 1 1 8 LEU CG C 4.642 13.919 -5.521 1.00 . A A . 8 LEU CG 1 1 5 1912 1 1 8 LEU H H 3.982 10.493 -3.397 1.00 . A A . 8 LEU H 1 1 5 1913 1 1 8 LEU HA H 2.484 12.470 -4.763 1.00 . A A . 8 LEU HA 1 1 5 1914 1 1 8 LEU HB2 H 4.742 12.804 -3.650 1.00 . A A . 8 LEU HB2 1 1 5 1915 1 1 8 LEU HB3 H 5.471 11.972 -5.011 1.00 . A A . 8 LEU HB3 1 1 5 1916 1 1 8 LEU HD11 H 3.502 14.872 -3.907 1.00 . A A . 8 LEU HD11 1 1 5 1917 1 1 8 LEU HD12 H 2.617 14.715 -5.422 1.00 . A A . 8 LEU HD12 1 1 5 1918 1 1 8 LEU HD13 H 3.850 15.948 -5.264 1.00 . A A . 8 LEU HD13 1 1 5 1919 1 1 8 LEU HD21 H 6.762 13.876 -5.884 1.00 . A A . 8 LEU HD21 1 1 5 1920 1 1 8 LEU HD22 H 6.297 14.757 -4.428 1.00 . A A . 8 LEU HD22 1 1 5 1921 1 1 8 LEU HD23 H 6.037 15.478 -6.018 1.00 . A A . 8 LEU HD23 1 1 5 1922 1 1 8 LEU HG H 4.415 13.694 -6.551 1.00 . A A . 8 LEU HG 1 1 5 1923 1 1 8 LEU N N 3.219 10.714 -3.958 1.00 . A A . 8 LEU N 1 1 5 1924 1 1 8 LEU O O 2.616 11.810 -7.210 1.00 . A A . 8 LEU O 1 1 5 1925 1 1 9 ALA C C 2.497 9.190 -8.286 1.00 . A A . 9 ALA C 1 1 5 1926 1 1 9 ALA CA C 3.934 9.482 -7.838 1.00 . A A . 9 ALA CA 1 1 5 1927 1 1 9 ALA CB C 4.745 8.177 -7.771 1.00 . A A . 9 ALA CB 1 1 5 1928 1 1 9 ALA H H 4.415 9.738 -5.785 1.00 . A A . 9 ALA H 1 1 5 1929 1 1 9 ALA HA H 4.397 10.151 -8.542 1.00 . A A . 9 ALA HA 1 1 5 1930 1 1 9 ALA HB1 H 5.784 8.405 -7.578 1.00 . A A . 9 ALA HB1 1 1 5 1931 1 1 9 ALA HB2 H 4.664 7.645 -8.709 1.00 . A A . 9 ALA HB2 1 1 5 1932 1 1 9 ALA HB3 H 4.362 7.558 -6.973 1.00 . A A . 9 ALA HB3 1 1 5 1933 1 1 9 ALA N N 3.921 10.130 -6.528 1.00 . A A . 9 ALA N 1 1 5 1934 1 1 9 ALA O O 2.142 9.383 -9.447 1.00 . A A . 9 ALA O 1 1 5 1935 1 1 10 LYS C C -0.486 9.748 -7.866 1.00 . A A . 10 LYS C 1 1 5 1936 1 1 10 LYS CA C 0.270 8.448 -7.579 1.00 . A A . 10 LYS CA 1 1 5 1937 1 1 10 LYS CB C -0.315 7.724 -6.330 1.00 . A A . 10 LYS CB 1 1 5 1938 1 1 10 LYS CD C -1.236 5.463 -7.219 1.00 . A A . 10 LYS CD 1 1 5 1939 1 1 10 LYS CE C -0.966 4.473 -6.063 1.00 . A A . 10 LYS CE 1 1 5 1940 1 1 10 LYS CG C -1.602 6.893 -6.677 1.00 . A A . 10 LYS CG 1 1 5 1941 1 1 10 LYS H H 2.037 8.637 -6.425 1.00 . A A . 10 LYS H 1 1 5 1942 1 1 10 LYS HA H 0.184 7.807 -8.447 1.00 . A A . 10 LYS HA 1 1 5 1943 1 1 10 LYS HB2 H 0.441 7.070 -5.932 1.00 . A A . 10 LYS HB2 1 1 5 1944 1 1 10 LYS HB3 H -0.556 8.461 -5.568 1.00 . A A . 10 LYS HB3 1 1 5 1945 1 1 10 LYS HD2 H -2.060 5.080 -7.810 1.00 . A A . 10 LYS HD2 1 1 5 1946 1 1 10 LYS HD3 H -0.358 5.519 -7.845 1.00 . A A . 10 LYS HD3 1 1 5 1947 1 1 10 LYS HE2 H -0.731 3.501 -6.472 1.00 . A A . 10 LYS HE2 1 1 5 1948 1 1 10 LYS HE3 H -0.133 4.815 -5.467 1.00 . A A . 10 LYS HE3 1 1 5 1949 1 1 10 LYS HG2 H -2.220 6.797 -5.788 1.00 . A A . 10 LYS HG2 1 1 5 1950 1 1 10 LYS HG3 H -2.177 7.423 -7.430 1.00 . A A . 10 LYS HG3 1 1 5 1951 1 1 10 LYS HZ1 H -2.916 5.005 -5.568 1.00 . A A . 10 LYS HZ1 1 1 5 1952 1 1 10 LYS HZ2 H -1.941 4.631 -4.228 1.00 . A A . 10 LYS HZ2 1 1 5 1953 1 1 10 LYS HZ3 H -2.537 3.388 -5.225 1.00 . A A . 10 LYS HZ3 1 1 5 1954 1 1 10 LYS N N 1.683 8.746 -7.332 1.00 . A A . 10 LYS N 1 1 5 1955 1 1 10 LYS NZ N -2.181 4.365 -5.206 1.00 . A A . 10 LYS NZ 1 1 5 1956 1 1 10 LYS O O -1.353 9.799 -8.738 1.00 . A A . 10 LYS O 1 1 5 1957 1 1 11 PHE C C -0.510 12.611 -8.698 1.00 . A A . 11 PHE C 1 1 5 1958 1 1 11 PHE CA C -0.779 12.105 -7.288 1.00 . A A . 11 PHE CA 1 1 5 1959 1 1 11 PHE CB C -0.197 13.077 -6.244 1.00 . A A . 11 PHE CB 1 1 5 1960 1 1 11 PHE CD1 C -2.254 14.524 -5.918 1.00 . A A . 11 PHE CD1 1 1 5 1961 1 1 11 PHE CD2 C -0.203 15.606 -6.653 1.00 . A A . 11 PHE CD2 1 1 5 1962 1 1 11 PHE CE1 C -2.905 15.762 -5.927 1.00 . A A . 11 PHE CE1 1 1 5 1963 1 1 11 PHE CE2 C -0.863 16.841 -6.661 1.00 . A A . 11 PHE CE2 1 1 5 1964 1 1 11 PHE CG C -0.899 14.434 -6.281 1.00 . A A . 11 PHE CG 1 1 5 1965 1 1 11 PHE CZ C -2.213 16.919 -6.298 1.00 . A A . 11 PHE CZ 1 1 5 1966 1 1 11 PHE H H 0.559 10.694 -6.440 1.00 . A A . 11 PHE H 1 1 5 1967 1 1 11 PHE HA H -1.843 12.007 -7.138 1.00 . A A . 11 PHE HA 1 1 5 1968 1 1 11 PHE HB2 H -0.318 12.644 -5.267 1.00 . A A . 11 PHE HB2 1 1 5 1969 1 1 11 PHE HB3 H 0.855 13.205 -6.431 1.00 . A A . 11 PHE HB3 1 1 5 1970 1 1 11 PHE HD1 H -2.798 13.637 -5.627 1.00 . A A . 11 PHE HD1 1 1 5 1971 1 1 11 PHE HD2 H 0.848 15.557 -6.932 1.00 . A A . 11 PHE HD2 1 1 5 1972 1 1 11 PHE HE1 H -3.947 15.825 -5.646 1.00 . A A . 11 PHE HE1 1 1 5 1973 1 1 11 PHE HE2 H -0.330 17.737 -6.946 1.00 . A A . 11 PHE HE2 1 1 5 1974 1 1 11 PHE HZ H -2.720 17.871 -6.304 1.00 . A A . 11 PHE HZ 1 1 5 1975 1 1 11 PHE N N -0.142 10.798 -7.117 1.00 . A A . 11 PHE N 1 1 5 1976 1 1 11 PHE O O -1.423 12.972 -9.435 1.00 . A A . 11 PHE O 1 1 5 1977 1 1 12 LEU C C 0.675 12.018 -11.446 1.00 . A A . 12 LEU C 1 1 5 1978 1 1 12 LEU CA C 1.198 12.999 -10.400 1.00 . A A . 12 LEU CA 1 1 5 1979 1 1 12 LEU CB C 2.737 13.022 -10.458 1.00 . A A . 12 LEU CB 1 1 5 1980 1 1 12 LEU CD1 C 4.863 13.893 -9.419 1.00 . A A . 12 LEU CD1 1 1 5 1981 1 1 12 LEU CD2 C 2.964 15.512 -9.862 1.00 . A A . 12 LEU CD2 1 1 5 1982 1 1 12 LEU CG C 3.328 14.057 -9.462 1.00 . A A . 12 LEU CG 1 1 5 1983 1 1 12 LEU H H 1.429 12.256 -8.427 1.00 . A A . 12 LEU H 1 1 5 1984 1 1 12 LEU HA H 0.813 13.978 -10.626 1.00 . A A . 12 LEU HA 1 1 5 1985 1 1 12 LEU HB2 H 3.106 12.034 -10.207 1.00 . A A . 12 LEU HB2 1 1 5 1986 1 1 12 LEU HB3 H 3.056 13.270 -11.462 1.00 . A A . 12 LEU HB3 1 1 5 1987 1 1 12 LEU HD11 H 5.268 14.023 -10.414 1.00 . A A . 12 LEU HD11 1 1 5 1988 1 1 12 LEU HD12 H 5.107 12.906 -9.059 1.00 . A A . 12 LEU HD12 1 1 5 1989 1 1 12 LEU HD13 H 5.291 14.633 -8.758 1.00 . A A . 12 LEU HD13 1 1 5 1990 1 1 12 LEU HD21 H 3.047 15.641 -10.931 1.00 . A A . 12 LEU HD21 1 1 5 1991 1 1 12 LEU HD22 H 3.630 16.207 -9.367 1.00 . A A . 12 LEU HD22 1 1 5 1992 1 1 12 LEU HD23 H 1.955 15.727 -9.549 1.00 . A A . 12 LEU HD23 1 1 5 1993 1 1 12 LEU HG H 2.931 13.856 -8.479 1.00 . A A . 12 LEU HG 1 1 5 1994 1 1 12 LEU N N 0.763 12.586 -9.066 1.00 . A A . 12 LEU N 1 1 5 1995 1 1 12 LEU O O 0.286 12.412 -12.541 1.00 . A A . 12 LEU O 1 1 5 1996 1 1 13 GLY C C -1.214 9.792 -12.343 1.00 . A A . 13 GLY C 1 1 5 1997 1 1 13 GLY CA C 0.269 9.681 -12.019 1.00 . A A . 13 GLY CA 1 1 5 1998 1 1 13 GLY H H 1.050 10.482 -10.222 1.00 . A A . 13 GLY H 1 1 5 1999 1 1 13 GLY HA2 H 0.837 9.754 -12.931 1.00 . A A . 13 GLY HA2 1 1 5 2000 1 1 13 GLY HA3 H 0.460 8.734 -11.580 1.00 . A A . 13 GLY HA3 1 1 5 2001 1 1 13 GLY N N 0.707 10.731 -11.104 1.00 . A A . 13 GLY N 1 1 5 2002 1 1 13 GLY O O -1.703 9.175 -13.288 1.00 . A A . 13 GLY O 1 1 5 2003 1 1 14 GLY C C -3.538 12.042 -12.682 1.00 . A A . 14 GLY C 1 1 5 2004 1 1 14 GLY CA C -3.365 10.816 -11.793 1.00 . A A . 14 GLY CA 1 1 5 2005 1 1 14 GLY H H -1.483 11.062 -10.825 1.00 . A A . 14 GLY H 1 1 5 2006 1 1 14 GLY HA2 H -3.822 9.953 -12.271 1.00 . A A . 14 GLY HA2 1 1 5 2007 1 1 14 GLY HA3 H -3.853 10.998 -10.848 1.00 . A A . 14 GLY HA3 1 1 5 2008 1 1 14 GLY N N -1.930 10.594 -11.562 1.00 . A A . 14 GLY N 1 1 5 2009 1 1 14 GLY O O -4.330 12.044 -13.624 1.00 . A A . 14 GLY O 1 1 5 2010 1 1 15 ILE C C -2.131 14.186 -14.456 1.00 . A A . 15 ILE C 1 1 5 2011 1 1 15 ILE CA C -2.801 14.346 -13.098 1.00 . A A . 15 ILE CA 1 1 5 2012 1 1 15 ILE CB C -2.072 15.432 -12.270 1.00 . A A . 15 ILE CB 1 1 5 2013 1 1 15 ILE CD1 C -1.863 16.406 -9.946 1.00 . A A . 15 ILE CD1 1 1 5 2014 1 1 15 ILE CG1 C -2.756 15.583 -10.880 1.00 . A A . 15 ILE CG1 1 1 5 2015 1 1 15 ILE CG2 C -2.093 16.796 -13.004 1.00 . A A . 15 ILE CG2 1 1 5 2016 1 1 15 ILE H H -2.169 13.003 -11.596 1.00 . A A . 15 ILE H 1 1 5 2017 1 1 15 ILE HA H -3.829 14.654 -13.251 1.00 . A A . 15 ILE HA 1 1 5 2018 1 1 15 ILE HB H -1.042 15.123 -12.137 1.00 . A A . 15 ILE HB 1 1 5 2019 1 1 15 ILE HD11 H -1.716 17.392 -10.362 1.00 . A A . 15 ILE HD11 1 1 5 2020 1 1 15 ILE HD12 H -0.906 15.914 -9.838 1.00 . A A . 15 ILE HD12 1 1 5 2021 1 1 15 ILE HD13 H -2.336 16.488 -8.983 1.00 . A A . 15 ILE HD13 1 1 5 2022 1 1 15 ILE HG12 H -3.710 16.079 -10.991 1.00 . A A . 15 ILE HG12 1 1 5 2023 1 1 15 ILE HG13 H -2.918 14.613 -10.435 1.00 . A A . 15 ILE HG13 1 1 5 2024 1 1 15 ILE HG21 H -1.624 17.547 -12.385 1.00 . A A . 15 ILE HG21 1 1 5 2025 1 1 15 ILE HG22 H -3.114 17.084 -13.202 1.00 . A A . 15 ILE HG22 1 1 5 2026 1 1 15 ILE HG23 H -1.555 16.723 -13.936 1.00 . A A . 15 ILE HG23 1 1 5 2027 1 1 15 ILE N N -2.776 13.084 -12.358 1.00 . A A . 15 ILE N 1 1 5 2028 1 1 15 ILE O O -2.507 14.858 -15.412 1.00 . A A . 15 ILE O 1 1 5 2029 1 1 16 VAL C C -1.412 12.815 -16.926 1.00 . A A . 16 VAL C 1 1 5 2030 1 1 16 VAL CA C -0.407 13.148 -15.820 1.00 . A A . 16 VAL CA 1 1 5 2031 1 1 16 VAL CB C 0.670 12.029 -15.699 1.00 . A A . 16 VAL CB 1 1 5 2032 1 1 16 VAL CG1 C 0.018 10.632 -15.598 1.00 . A A . 16 VAL CG1 1 1 5 2033 1 1 16 VAL CG2 C 1.608 12.072 -16.919 1.00 . A A . 16 VAL CG2 1 1 5 2034 1 1 16 VAL H H -0.829 12.809 -13.755 1.00 . A A . 16 VAL H 1 1 5 2035 1 1 16 VAL HA H 0.076 14.087 -16.056 1.00 . A A . 16 VAL HA 1 1 5 2036 1 1 16 VAL HB H 1.249 12.200 -14.795 1.00 . A A . 16 VAL HB 1 1 5 2037 1 1 16 VAL HG11 H -0.412 10.346 -16.549 1.00 . A A . 16 VAL HG11 1 1 5 2038 1 1 16 VAL HG12 H -0.755 10.660 -14.856 1.00 . A A . 16 VAL HG12 1 1 5 2039 1 1 16 VAL HG13 H 0.763 9.903 -15.316 1.00 . A A . 16 VAL HG13 1 1 5 2040 1 1 16 VAL HG21 H 2.108 13.027 -16.953 1.00 . A A . 16 VAL HG21 1 1 5 2041 1 1 16 VAL HG22 H 1.028 11.935 -17.821 1.00 . A A . 16 VAL HG22 1 1 5 2042 1 1 16 VAL HG23 H 2.343 11.283 -16.839 1.00 . A A . 16 VAL HG23 1 1 5 2043 1 1 16 VAL N N -1.115 13.320 -14.547 1.00 . A A . 16 VAL N 1 1 5 2044 1 1 16 VAL O O -1.344 13.334 -18.039 1.00 . A A . 16 VAL O 1 1 5 2045 1 1 17 ARG C C -4.321 12.732 -17.783 1.00 . A A . 17 ARG C 1 1 5 2046 1 1 17 ARG CA C -3.407 11.527 -17.484 1.00 . A A . 17 ARG CA 1 1 5 2047 1 1 17 ARG CB C -4.202 10.353 -16.812 1.00 . A A . 17 ARG CB 1 1 5 2048 1 1 17 ARG CD C -5.609 9.919 -18.882 1.00 . A A . 17 ARG CD 1 1 5 2049 1 1 17 ARG CG C -4.672 9.297 -17.838 1.00 . A A . 17 ARG CG 1 1 5 2050 1 1 17 ARG CZ C -6.781 9.154 -20.901 1.00 . A A . 17 ARG CZ 1 1 5 2051 1 1 17 ARG H H -2.352 11.587 -15.663 1.00 . A A . 17 ARG H 1 1 5 2052 1 1 17 ARG HA H -2.955 11.185 -18.408 1.00 . A A . 17 ARG HA 1 1 5 2053 1 1 17 ARG HB2 H -3.557 9.861 -16.095 1.00 . A A . 17 ARG HB2 1 1 5 2054 1 1 17 ARG HB3 H -5.062 10.739 -16.280 1.00 . A A . 17 ARG HB3 1 1 5 2055 1 1 17 ARG HD2 H -6.424 10.423 -18.386 1.00 . A A . 17 ARG HD2 1 1 5 2056 1 1 17 ARG HD3 H -5.055 10.630 -19.478 1.00 . A A . 17 ARG HD3 1 1 5 2057 1 1 17 ARG HE H -6.031 7.931 -19.499 1.00 . A A . 17 ARG HE 1 1 5 2058 1 1 17 ARG HG2 H -3.808 8.876 -18.336 1.00 . A A . 17 ARG HG2 1 1 5 2059 1 1 17 ARG HG3 H -5.195 8.510 -17.317 1.00 . A A . 17 ARG HG3 1 1 5 2060 1 1 17 ARG HH11 H -6.635 11.140 -20.677 1.00 . A A . 17 ARG HH11 1 1 5 2061 1 1 17 ARG HH12 H -7.446 10.606 -22.112 1.00 . A A . 17 ARG HH12 1 1 5 2062 1 1 17 ARG HH21 H -7.071 7.234 -21.388 1.00 . A A . 17 ARG HH21 1 1 5 2063 1 1 17 ARG HH22 H -7.688 8.394 -22.517 1.00 . A A . 17 ARG HH22 1 1 5 2064 1 1 17 ARG N N -2.354 11.948 -16.574 1.00 . A A . 17 ARG N 1 1 5 2065 1 1 17 ARG NE N -6.148 8.869 -19.757 1.00 . A A . 17 ARG NE 1 1 5 2066 1 1 17 ARG NH1 N -6.968 10.396 -21.259 1.00 . A A . 17 ARG NH1 1 1 5 2067 1 1 17 ARG NH2 N -7.214 8.185 -21.661 1.00 . A A . 17 ARG NH2 1 1 5 2068 1 1 17 ARG O O -4.751 12.944 -18.916 1.00 . A A . 17 ARG O 1 1 5 2069 1 1 18 ALA C C -4.957 15.672 -17.916 1.00 . A A . 18 ALA C 1 1 5 2070 1 1 18 ALA CA C -5.492 14.681 -16.880 1.00 . A A . 18 ALA CA 1 1 5 2071 1 1 18 ALA CB C -5.662 15.393 -15.528 1.00 . A A . 18 ALA CB 1 1 5 2072 1 1 18 ALA H H -4.251 13.294 -15.857 1.00 . A A . 18 ALA H 1 1 5 2073 1 1 18 ALA HA H -6.459 14.336 -17.201 1.00 . A A . 18 ALA HA 1 1 5 2074 1 1 18 ALA HB1 H -6.002 14.683 -14.789 1.00 . A A . 18 ALA HB1 1 1 5 2075 1 1 18 ALA HB2 H -6.390 16.186 -15.625 1.00 . A A . 18 ALA HB2 1 1 5 2076 1 1 18 ALA HB3 H -4.721 15.815 -15.214 1.00 . A A . 18 ALA HB3 1 1 5 2077 1 1 18 ALA N N -4.616 13.515 -16.739 1.00 . A A . 18 ALA N 1 1 5 2078 1 1 18 ALA O O -5.732 16.271 -18.659 1.00 . A A . 18 ALA O 1 1 5 2079 1 1 19 MET C C -3.357 16.366 -20.349 1.00 . A A . 19 MET C 1 1 5 2080 1 1 19 MET CA C -3.027 16.767 -18.914 1.00 . A A . 19 MET CA 1 1 5 2081 1 1 19 MET CB C -1.507 16.717 -18.722 1.00 . A A . 19 MET CB 1 1 5 2082 1 1 19 MET CE C 0.841 18.380 -15.783 1.00 . A A . 19 MET CE 1 1 5 2083 1 1 19 MET CG C -1.104 17.345 -17.381 1.00 . A A . 19 MET CG 1 1 5 2084 1 1 19 MET H H -3.056 15.350 -17.358 1.00 . A A . 19 MET H 1 1 5 2085 1 1 19 MET HA H -3.384 17.770 -18.732 1.00 . A A . 19 MET HA 1 1 5 2086 1 1 19 MET HB2 H -1.184 15.688 -18.740 1.00 . A A . 19 MET HB2 1 1 5 2087 1 1 19 MET HB3 H -1.033 17.240 -19.518 1.00 . A A . 19 MET HB3 1 1 5 2088 1 1 19 MET HE1 H 0.416 19.343 -16.034 1.00 . A A . 19 MET HE1 1 1 5 2089 1 1 19 MET HE2 H 1.881 18.505 -15.527 1.00 . A A . 19 MET HE2 1 1 5 2090 1 1 19 MET HE3 H 0.315 17.957 -14.939 1.00 . A A . 19 MET HE3 1 1 5 2091 1 1 19 MET HG2 H -1.428 18.375 -17.352 1.00 . A A . 19 MET HG2 1 1 5 2092 1 1 19 MET HG3 H -1.568 16.801 -16.575 1.00 . A A . 19 MET HG3 1 1 5 2093 1 1 19 MET N N -3.635 15.846 -17.967 1.00 . A A . 19 MET N 1 1 5 2094 1 1 19 MET O O -3.917 17.148 -21.116 1.00 . A A . 19 MET O 1 1 5 2095 1 1 19 MET SD S 0.696 17.268 -17.203 1.00 . A A . 19 MET SD 1 1 5 2096 1 1 20 LEU C C -4.776 14.606 -22.275 1.00 . A A . 20 LEU C 1 1 5 2097 1 1 20 LEU CA C -3.269 14.616 -22.039 1.00 . A A . 20 LEU CA 1 1 5 2098 1 1 20 LEU CB C -2.704 13.179 -22.170 1.00 . A A . 20 LEU CB 1 1 5 2099 1 1 20 LEU CD1 C -0.403 13.940 -21.384 1.00 . A A . 20 LEU CD1 1 1 5 2100 1 1 20 LEU CD2 C -0.682 11.731 -22.566 1.00 . A A . 20 LEU CD2 1 1 5 2101 1 1 20 LEU CG C -1.184 13.185 -22.481 1.00 . A A . 20 LEU CG 1 1 5 2102 1 1 20 LEU H H -2.559 14.566 -20.035 1.00 . A A . 20 LEU H 1 1 5 2103 1 1 20 LEU HA H -2.804 15.263 -22.774 1.00 . A A . 20 LEU HA 1 1 5 2104 1 1 20 LEU HB2 H -2.873 12.650 -21.243 1.00 . A A . 20 LEU HB2 1 1 5 2105 1 1 20 LEU HB3 H -3.220 12.660 -22.967 1.00 . A A . 20 LEU HB3 1 1 5 2106 1 1 20 LEU HD11 H -0.679 13.557 -20.410 1.00 . A A . 20 LEU HD11 1 1 5 2107 1 1 20 LEU HD12 H -0.631 14.993 -21.436 1.00 . A A . 20 LEU HD12 1 1 5 2108 1 1 20 LEU HD13 H 0.661 13.805 -21.531 1.00 . A A . 20 LEU HD13 1 1 5 2109 1 1 20 LEU HD21 H 0.374 11.727 -22.797 1.00 . A A . 20 LEU HD21 1 1 5 2110 1 1 20 LEU HD22 H -1.220 11.205 -23.341 1.00 . A A . 20 LEU HD22 1 1 5 2111 1 1 20 LEU HD23 H -0.845 11.240 -21.617 1.00 . A A . 20 LEU HD23 1 1 5 2112 1 1 20 LEU HG H -1.019 13.674 -23.431 1.00 . A A . 20 LEU HG 1 1 5 2113 1 1 20 LEU N N -3.007 15.134 -20.696 1.00 . A A . 20 LEU N 1 1 5 2114 1 1 20 LEU O O -5.260 14.934 -23.356 1.00 . A A . 20 LEU O 1 1 5 2115 1 1 21 GLY C C -7.515 15.574 -21.556 1.00 . A A . 21 GLY C 1 1 5 2116 1 1 21 GLY CA C -6.960 14.180 -21.303 1.00 . A A . 21 GLY CA 1 1 5 2117 1 1 21 GLY H H -5.045 13.993 -20.398 1.00 . A A . 21 GLY H 1 1 5 2118 1 1 21 GLY HA2 H -7.264 13.514 -22.101 1.00 . A A . 21 GLY HA2 1 1 5 2119 1 1 21 GLY HA3 H -7.345 13.813 -20.365 1.00 . A A . 21 GLY HA3 1 1 5 2120 1 1 21 GLY N N -5.503 14.230 -21.236 1.00 . A A . 21 GLY N 1 1 5 2121 1 1 21 GLY O O -8.530 15.747 -22.232 1.00 . A A . 21 GLY O 1 1 5 2122 1 1 22 SER C C -6.727 18.553 -22.464 1.00 . A A . 22 SER C 1 1 5 2123 1 1 22 SER CA C -7.206 17.977 -21.131 1.00 . A A . 22 SER CA 1 1 5 2124 1 1 22 SER CB C -6.591 18.783 -19.982 1.00 . A A . 22 SER CB 1 1 5 2125 1 1 22 SER H H -6.017 16.339 -20.477 1.00 . A A . 22 SER H 1 1 5 2126 1 1 22 SER HA H -8.284 18.071 -21.075 1.00 . A A . 22 SER HA 1 1 5 2127 1 1 22 SER HB2 H -6.932 18.386 -19.040 1.00 . A A . 22 SER HB2 1 1 5 2128 1 1 22 SER HB3 H -5.510 18.712 -20.028 1.00 . A A . 22 SER HB3 1 1 5 2129 1 1 22 SER HG H -6.694 20.475 -20.935 1.00 . A A . 22 SER HG 1 1 5 2130 1 1 22 SER N N -6.820 16.567 -20.995 1.00 . A A . 22 SER N 1 1 5 2131 1 1 22 SER O O -7.292 19.524 -22.969 1.00 . A A . 22 SER O 1 1 5 2132 1 1 22 SER OG O -6.996 20.140 -20.088 1.00 . A A . 22 SER OG 1 1 5 2133 1 1 23 PHE C C -6.144 18.297 -25.415 1.00 . A A . 23 PHE C 1 1 5 2134 1 1 23 PHE CA C -5.113 18.415 -24.291 1.00 . A A . 23 PHE CA 1 1 5 2135 1 1 23 PHE CB C -3.855 17.595 -24.643 1.00 . A A . 23 PHE CB 1 1 5 2136 1 1 23 PHE CD1 C -2.397 19.308 -25.829 1.00 . A A . 23 PHE CD1 1 1 5 2137 1 1 23 PHE CD2 C -3.413 17.543 -27.160 1.00 . A A . 23 PHE CD2 1 1 5 2138 1 1 23 PHE CE1 C -1.808 19.834 -26.985 1.00 . A A . 23 PHE CE1 1 1 5 2139 1 1 23 PHE CE2 C -2.821 18.075 -28.312 1.00 . A A . 23 PHE CE2 1 1 5 2140 1 1 23 PHE CG C -3.203 18.156 -25.910 1.00 . A A . 23 PHE CG 1 1 5 2141 1 1 23 PHE CZ C -2.020 19.218 -28.225 1.00 . A A . 23 PHE CZ 1 1 5 2142 1 1 23 PHE H H -5.266 17.188 -22.567 1.00 . A A . 23 PHE H 1 1 5 2143 1 1 23 PHE HA H -4.832 19.455 -24.186 1.00 . A A . 23 PHE HA 1 1 5 2144 1 1 23 PHE HB2 H -3.154 17.651 -23.821 1.00 . A A . 23 PHE HB2 1 1 5 2145 1 1 23 PHE HB3 H -4.132 16.561 -24.797 1.00 . A A . 23 PHE HB3 1 1 5 2146 1 1 23 PHE HD1 H -2.229 19.786 -24.875 1.00 . A A . 23 PHE HD1 1 1 5 2147 1 1 23 PHE HD2 H -4.030 16.659 -27.232 1.00 . A A . 23 PHE HD2 1 1 5 2148 1 1 23 PHE HE1 H -1.189 20.716 -26.920 1.00 . A A . 23 PHE HE1 1 1 5 2149 1 1 23 PHE HE2 H -2.985 17.602 -29.269 1.00 . A A . 23 PHE HE2 1 1 5 2150 1 1 23 PHE HZ H -1.566 19.628 -29.115 1.00 . A A . 23 PHE HZ 1 1 5 2151 1 1 23 PHE N N -5.675 17.954 -23.021 1.00 . A A . 23 PHE N 1 1 5 2152 1 1 23 PHE O O -6.268 19.192 -26.251 1.00 . A A . 23 PHE O 1 1 5 2153 1 1 24 ARG C C -8.950 18.015 -26.457 1.00 . A A . 24 ARG C 1 1 5 2154 1 1 24 ARG CA C -7.865 16.934 -26.475 1.00 . A A . 24 ARG CA 1 1 5 2155 1 1 24 ARG CB C -8.518 15.560 -26.246 1.00 . A A . 24 ARG CB 1 1 5 2156 1 1 24 ARG CD C -8.112 13.084 -26.073 1.00 . A A . 24 ARG CD 1 1 5 2157 1 1 24 ARG CG C -7.464 14.446 -26.357 1.00 . A A . 24 ARG CG 1 1 5 2158 1 1 24 ARG CZ C -9.907 11.702 -26.994 1.00 . A A . 24 ARG CZ 1 1 5 2159 1 1 24 ARG H H -6.708 16.493 -24.755 1.00 . A A . 24 ARG H 1 1 5 2160 1 1 24 ARG HA H -7.383 16.936 -27.443 1.00 . A A . 24 ARG HA 1 1 5 2161 1 1 24 ARG HB2 H -8.960 15.540 -25.260 1.00 . A A . 24 ARG HB2 1 1 5 2162 1 1 24 ARG HB3 H -9.290 15.392 -26.987 1.00 . A A . 24 ARG HB3 1 1 5 2163 1 1 24 ARG HD2 H -7.357 12.314 -26.112 1.00 . A A . 24 ARG HD2 1 1 5 2164 1 1 24 ARG HD3 H -8.558 13.097 -25.086 1.00 . A A . 24 ARG HD3 1 1 5 2165 1 1 24 ARG HE H -9.270 13.415 -27.820 1.00 . A A . 24 ARG HE 1 1 5 2166 1 1 24 ARG HG2 H -7.045 14.444 -27.353 1.00 . A A . 24 ARG HG2 1 1 5 2167 1 1 24 ARG HG3 H -6.678 14.622 -25.637 1.00 . A A . 24 ARG HG3 1 1 5 2168 1 1 24 ARG HH11 H -9.088 11.047 -25.287 1.00 . A A . 24 ARG HH11 1 1 5 2169 1 1 24 ARG HH12 H -10.350 10.055 -25.938 1.00 . A A . 24 ARG HH12 1 1 5 2170 1 1 24 ARG HH21 H -10.934 12.116 -28.663 1.00 . A A . 24 ARG HH21 1 1 5 2171 1 1 24 ARG HH22 H -11.378 10.650 -27.855 1.00 . A A . 24 ARG HH22 1 1 5 2172 1 1 24 ARG N N -6.862 17.176 -25.440 1.00 . A A . 24 ARG N 1 1 5 2173 1 1 24 ARG NE N -9.140 12.794 -27.073 1.00 . A A . 24 ARG NE 1 1 5 2174 1 1 24 ARG NH1 N -9.770 10.868 -25.995 1.00 . A A . 24 ARG NH1 1 1 5 2175 1 1 24 ARG NH2 N -10.812 11.473 -27.907 1.00 . A A . 24 ARG NH2 1 1 5 2176 1 1 24 ARG O O -9.904 17.929 -25.682 1.00 . A A . 24 ARG O 1 1 5 2177 1 1 25 LYS C C -10.257 20.215 -28.917 1.00 . A A . 25 LYS C 1 1 5 2178 1 1 25 LYS CA C -9.780 20.123 -27.464 1.00 . A A . 25 LYS CA 1 1 5 2179 1 1 25 LYS CB C -9.130 21.459 -27.051 1.00 . A A . 25 LYS CB 1 1 5 2180 1 1 25 LYS CD C -8.178 22.793 -25.145 1.00 . A A . 25 LYS CD 1 1 5 2181 1 1 25 LYS CE C -7.854 22.791 -23.647 1.00 . A A . 25 LYS CE 1 1 5 2182 1 1 25 LYS CG C -8.781 21.440 -25.552 1.00 . A A . 25 LYS CG 1 1 5 2183 1 1 25 LYS H H -8.028 19.009 -27.935 1.00 . A A . 25 LYS H 1 1 5 2184 1 1 25 LYS HA H -10.646 19.945 -26.830 1.00 . A A . 25 LYS HA 1 1 5 2185 1 1 25 LYS HB2 H -8.228 21.611 -27.625 1.00 . A A . 25 LYS HB2 1 1 5 2186 1 1 25 LYS HB3 H -9.820 22.271 -27.244 1.00 . A A . 25 LYS HB3 1 1 5 2187 1 1 25 LYS HD2 H -7.271 22.965 -25.708 1.00 . A A . 25 LYS HD2 1 1 5 2188 1 1 25 LYS HD3 H -8.886 23.582 -25.356 1.00 . A A . 25 LYS HD3 1 1 5 2189 1 1 25 LYS HE2 H -8.754 22.593 -23.082 1.00 . A A . 25 LYS HE2 1 1 5 2190 1 1 25 LYS HE3 H -7.121 22.026 -23.436 1.00 . A A . 25 LYS HE3 1 1 5 2191 1 1 25 LYS HG2 H -9.679 21.255 -24.976 1.00 . A A . 25 LYS HG2 1 1 5 2192 1 1 25 LYS HG3 H -8.063 20.657 -25.360 1.00 . A A . 25 LYS HG3 1 1 5 2193 1 1 25 LYS HZ1 H -6.841 24.043 -22.328 1.00 . A A . 25 LYS HZ1 1 1 5 2194 1 1 25 LYS HZ2 H -8.085 24.809 -23.193 1.00 . A A . 25 LYS HZ2 1 1 5 2195 1 1 25 LYS HZ3 H -6.617 24.438 -23.962 1.00 . A A . 25 LYS HZ3 1 1 5 2196 1 1 25 LYS N N -8.806 19.019 -27.338 1.00 . A A . 25 LYS N 1 1 5 2197 1 1 25 LYS NZ N -7.308 24.121 -23.253 1.00 . A A . 25 LYS NZ 1 1 5 2198 1 1 25 LYS O O -9.531 20.698 -29.787 1.00 . A A . 25 LYS O 1 1 5 2199 1 1 26 ASP C C -12.412 21.205 -30.914 1.00 . A A . 26 ASP C 1 1 5 2200 1 1 26 ASP CA C -12.052 19.774 -30.522 1.00 . A A . 26 ASP CA 1 1 5 2201 1 1 26 ASP CB C -13.306 18.888 -30.570 1.00 . A A . 26 ASP CB 1 1 5 2202 1 1 26 ASP CG C -12.938 17.442 -30.240 1.00 . A A . 26 ASP CG 1 1 5 2203 1 1 26 ASP H H -12.011 19.370 -28.438 1.00 . A A . 26 ASP H 1 1 5 2204 1 1 26 ASP HA H -11.326 19.390 -31.231 1.00 . A A . 26 ASP HA 1 1 5 2205 1 1 26 ASP HB2 H -14.027 19.247 -29.849 1.00 . A A . 26 ASP HB2 1 1 5 2206 1 1 26 ASP HB3 H -13.739 18.926 -31.560 1.00 . A A . 26 ASP HB3 1 1 5 2207 1 1 26 ASP N N -11.481 19.744 -29.172 1.00 . A A . 26 ASP N 1 1 5 2208 1 1 26 ASP O O -12.794 21.961 -30.037 1.00 . A A . 26 ASP O 1 1 5 2209 1 1 26 ASP OD1 O -11.886 17.008 -30.679 1.00 . A A . 26 ASP OD1 1 1 5 2210 1 1 26 ASP OD2 O -13.709 16.796 -29.551 1.00 . A A . 26 ASP OD2 1 1 6 2211 1 1 1 MET C C 12.088 5.043 -0.161 1.00 . A A . 1 MET C 1 1 6 2212 1 1 1 MET CA C 13.287 4.839 -1.091 1.00 . A A . 1 MET CA 1 1 6 2213 1 1 1 MET CB C 13.384 5.975 -2.127 1.00 . A A . 1 MET CB 1 1 6 2214 1 1 1 MET CE C 13.442 6.859 -5.238 1.00 . A A . 1 MET CE 1 1 6 2215 1 1 1 MET CG C 14.650 5.800 -2.984 1.00 . A A . 1 MET CG 1 1 6 2216 1 1 1 MET H1 H 12.654 2.858 -1.184 1.00 . A A . 1 MET H1 1 1 6 2217 1 1 1 MET H2 H 14.067 3.177 -2.073 1.00 . A A . 1 MET H2 1 1 6 2218 1 1 1 MET H3 H 12.556 3.684 -2.661 1.00 . A A . 1 MET H3 1 1 6 2219 1 1 1 MET HA H 14.191 4.811 -0.499 1.00 . A A . 1 MET HA 1 1 6 2220 1 1 1 MET HB2 H 12.512 5.951 -2.763 1.00 . A A . 1 MET HB2 1 1 6 2221 1 1 1 MET HB3 H 13.431 6.927 -1.621 1.00 . A A . 1 MET HB3 1 1 6 2222 1 1 1 MET HE1 H 12.537 7.272 -4.822 1.00 . A A . 1 MET HE1 1 1 6 2223 1 1 1 MET HE2 H 13.323 5.797 -5.369 1.00 . A A . 1 MET HE2 1 1 6 2224 1 1 1 MET HE3 H 13.638 7.315 -6.199 1.00 . A A . 1 MET HE3 1 1 6 2225 1 1 1 MET HG2 H 15.518 5.757 -2.339 1.00 . A A . 1 MET HG2 1 1 6 2226 1 1 1 MET HG3 H 14.584 4.881 -3.547 1.00 . A A . 1 MET HG3 1 1 6 2227 1 1 1 MET N N 13.129 3.542 -1.807 1.00 . A A . 1 MET N 1 1 6 2228 1 1 1 MET O O 11.415 4.081 0.212 1.00 . A A . 1 MET O 1 1 6 2229 1 1 1 MET SD S 14.829 7.207 -4.119 1.00 . A A . 1 MET SD 1 1 6 2230 1 1 2 LYS C C 9.378 6.250 0.471 1.00 . A A . 2 LYS C 1 1 6 2231 1 1 2 LYS CA C 10.718 6.604 1.123 1.00 . A A . 2 LYS CA 1 1 6 2232 1 1 2 LYS CB C 10.742 8.103 1.474 1.00 . A A . 2 LYS CB 1 1 6 2233 1 1 2 LYS CD C 12.049 9.934 2.598 1.00 . A A . 2 LYS CD 1 1 6 2234 1 1 2 LYS CE C 13.321 10.264 3.389 1.00 . A A . 2 LYS CE 1 1 6 2235 1 1 2 LYS CG C 12.032 8.441 2.238 1.00 . A A . 2 LYS CG 1 1 6 2236 1 1 2 LYS H H 12.403 7.021 -0.095 1.00 . A A . 2 LYS H 1 1 6 2237 1 1 2 LYS HA H 10.828 6.028 2.033 1.00 . A A . 2 LYS HA 1 1 6 2238 1 1 2 LYS HB2 H 10.702 8.683 0.562 1.00 . A A . 2 LYS HB2 1 1 6 2239 1 1 2 LYS HB3 H 9.888 8.345 2.092 1.00 . A A . 2 LYS HB3 1 1 6 2240 1 1 2 LYS HD2 H 12.028 10.521 1.693 1.00 . A A . 2 LYS HD2 1 1 6 2241 1 1 2 LYS HD3 H 11.183 10.171 3.200 1.00 . A A . 2 LYS HD3 1 1 6 2242 1 1 2 LYS HE2 H 13.314 11.310 3.662 1.00 . A A . 2 LYS HE2 1 1 6 2243 1 1 2 LYS HE3 H 13.360 9.659 4.285 1.00 . A A . 2 LYS HE3 1 1 6 2244 1 1 2 LYS HG2 H 12.077 7.850 3.142 1.00 . A A . 2 LYS HG2 1 1 6 2245 1 1 2 LYS HG3 H 12.886 8.213 1.617 1.00 . A A . 2 LYS HG3 1 1 6 2246 1 1 2 LYS HZ1 H 14.218 9.820 1.564 1.00 . A A . 2 LYS HZ1 1 1 6 2247 1 1 2 LYS HZ2 H 15.005 9.138 2.907 1.00 . A A . 2 LYS HZ2 1 1 6 2248 1 1 2 LYS HZ3 H 15.163 10.797 2.578 1.00 . A A . 2 LYS HZ3 1 1 6 2249 1 1 2 LYS N N 11.830 6.293 0.222 1.00 . A A . 2 LYS N 1 1 6 2250 1 1 2 LYS NZ N 14.517 9.983 2.546 1.00 . A A . 2 LYS NZ 1 1 6 2251 1 1 2 LYS O O 9.209 6.380 -0.741 1.00 . A A . 2 LYS O 1 1 6 2252 1 1 3 PHE C C 6.366 6.642 0.247 1.00 . A A . 3 PHE C 1 1 6 2253 1 1 3 PHE CA C 7.100 5.426 0.815 1.00 . A A . 3 PHE CA 1 1 6 2254 1 1 3 PHE CB C 6.290 4.807 1.967 1.00 . A A . 3 PHE CB 1 1 6 2255 1 1 3 PHE CD1 C 7.176 5.828 4.124 1.00 . A A . 3 PHE CD1 1 1 6 2256 1 1 3 PHE CD2 C 5.113 6.705 3.187 1.00 . A A . 3 PHE CD2 1 1 6 2257 1 1 3 PHE CE1 C 7.084 6.742 5.180 1.00 . A A . 3 PHE CE1 1 1 6 2258 1 1 3 PHE CE2 C 5.025 7.618 4.246 1.00 . A A . 3 PHE CE2 1 1 6 2259 1 1 3 PHE CG C 6.190 5.803 3.122 1.00 . A A . 3 PHE CG 1 1 6 2260 1 1 3 PHE CZ C 6.010 7.636 5.241 1.00 . A A . 3 PHE CZ 1 1 6 2261 1 1 3 PHE H H 8.631 5.722 2.252 1.00 . A A . 3 PHE H 1 1 6 2262 1 1 3 PHE HA H 7.203 4.688 0.031 1.00 . A A . 3 PHE HA 1 1 6 2263 1 1 3 PHE HB2 H 5.298 4.550 1.613 1.00 . A A . 3 PHE HB2 1 1 6 2264 1 1 3 PHE HB3 H 6.784 3.904 2.306 1.00 . A A . 3 PHE HB3 1 1 6 2265 1 1 3 PHE HD1 H 8.007 5.140 4.079 1.00 . A A . 3 PHE HD1 1 1 6 2266 1 1 3 PHE HD2 H 4.352 6.694 2.421 1.00 . A A . 3 PHE HD2 1 1 6 2267 1 1 3 PHE HE1 H 7.843 6.756 5.948 1.00 . A A . 3 PHE HE1 1 1 6 2268 1 1 3 PHE HE2 H 4.198 8.310 4.295 1.00 . A A . 3 PHE HE2 1 1 6 2269 1 1 3 PHE HZ H 5.941 8.340 6.057 1.00 . A A . 3 PHE HZ 1 1 6 2270 1 1 3 PHE N N 8.431 5.801 1.296 1.00 . A A . 3 PHE N 1 1 6 2271 1 1 3 PHE O O 5.519 6.511 -0.636 1.00 . A A . 3 PHE O 1 1 6 2272 1 1 4 TYR C C 6.255 9.212 -1.228 1.00 . A A . 4 TYR C 1 1 6 2273 1 1 4 TYR CA C 6.079 9.075 0.296 1.00 . A A . 4 TYR CA 1 1 6 2274 1 1 4 TYR CB C 6.689 10.292 1.101 1.00 . A A . 4 TYR CB 1 1 6 2275 1 1 4 TYR CD1 C 6.315 12.435 -0.237 1.00 . A A . 4 TYR CD1 1 1 6 2276 1 1 4 TYR CD2 C 8.525 11.428 -0.255 1.00 . A A . 4 TYR CD2 1 1 6 2277 1 1 4 TYR CE1 C 6.777 13.455 -1.080 1.00 . A A . 4 TYR CE1 1 1 6 2278 1 1 4 TYR CE2 C 8.982 12.447 -1.098 1.00 . A A . 4 TYR CE2 1 1 6 2279 1 1 4 TYR CG C 7.190 11.418 0.181 1.00 . A A . 4 TYR CG 1 1 6 2280 1 1 4 TYR CZ C 8.108 13.461 -1.510 1.00 . A A . 4 TYR CZ 1 1 6 2281 1 1 4 TYR H H 7.391 7.869 1.455 1.00 . A A . 4 TYR H 1 1 6 2282 1 1 4 TYR HA H 5.017 9.011 0.496 1.00 . A A . 4 TYR HA 1 1 6 2283 1 1 4 TYR HB2 H 5.940 10.699 1.773 1.00 . A A . 4 TYR HB2 1 1 6 2284 1 1 4 TYR HB3 H 7.516 9.934 1.705 1.00 . A A . 4 TYR HB3 1 1 6 2285 1 1 4 TYR HD1 H 5.287 12.432 0.094 1.00 . A A . 4 TYR HD1 1 1 6 2286 1 1 4 TYR HD2 H 9.200 10.645 0.063 1.00 . A A . 4 TYR HD2 1 1 6 2287 1 1 4 TYR HE1 H 6.103 14.237 -1.398 1.00 . A A . 4 TYR HE1 1 1 6 2288 1 1 4 TYR HE2 H 10.009 12.452 -1.431 1.00 . A A . 4 TYR HE2 1 1 6 2289 1 1 4 TYR HH H 9.155 15.023 -1.838 1.00 . A A . 4 TYR HH 1 1 6 2290 1 1 4 TYR N N 6.703 7.827 0.757 1.00 . A A . 4 TYR N 1 1 6 2291 1 1 4 TYR O O 5.513 9.941 -1.888 1.00 . A A . 4 TYR O 1 1 6 2292 1 1 4 TYR OH O 8.562 14.462 -2.344 1.00 . A A . 4 TYR OH 1 1 6 2293 1 1 5 THR C C 6.322 7.982 -3.983 1.00 . A A . 5 THR C 1 1 6 2294 1 1 5 THR CA C 7.515 8.531 -3.198 1.00 . A A . 5 THR CA 1 1 6 2295 1 1 5 THR CB C 8.776 7.703 -3.493 1.00 . A A . 5 THR CB 1 1 6 2296 1 1 5 THR CG2 C 9.176 7.828 -4.972 1.00 . A A . 5 THR CG2 1 1 6 2297 1 1 5 THR H H 7.792 7.941 -1.187 1.00 . A A . 5 THR H 1 1 6 2298 1 1 5 THR HA H 7.690 9.556 -3.500 1.00 . A A . 5 THR HA 1 1 6 2299 1 1 5 THR HB H 8.588 6.667 -3.263 1.00 . A A . 5 THR HB 1 1 6 2300 1 1 5 THR HG1 H 10.551 7.521 -2.719 1.00 . A A . 5 THR HG1 1 1 6 2301 1 1 5 THR HG21 H 9.297 8.871 -5.229 1.00 . A A . 5 THR HG21 1 1 6 2302 1 1 5 THR HG22 H 8.412 7.390 -5.597 1.00 . A A . 5 THR HG22 1 1 6 2303 1 1 5 THR HG23 H 10.106 7.311 -5.132 1.00 . A A . 5 THR HG23 1 1 6 2304 1 1 5 THR N N 7.241 8.501 -1.765 1.00 . A A . 5 THR N 1 1 6 2305 1 1 5 THR O O 5.902 8.574 -4.977 1.00 . A A . 5 THR O 1 1 6 2306 1 1 5 THR OG1 O 9.842 8.167 -2.676 1.00 . A A . 5 THR OG1 1 1 6 2307 1 1 6 ILE C C 3.429 7.211 -4.102 1.00 . A A . 6 ILE C 1 1 6 2308 1 1 6 ILE CA C 4.610 6.249 -4.196 1.00 . A A . 6 ILE CA 1 1 6 2309 1 1 6 ILE CB C 4.250 4.865 -3.563 1.00 . A A . 6 ILE CB 1 1 6 2310 1 1 6 ILE CD1 C 6.713 4.190 -3.320 1.00 . A A . 6 ILE CD1 1 1 6 2311 1 1 6 ILE CG1 C 5.347 3.816 -3.907 1.00 . A A . 6 ILE CG1 1 1 6 2312 1 1 6 ILE CG2 C 2.884 4.342 -4.102 1.00 . A A . 6 ILE CG2 1 1 6 2313 1 1 6 ILE H H 6.134 6.431 -2.723 1.00 . A A . 6 ILE H 1 1 6 2314 1 1 6 ILE HA H 4.846 6.104 -5.243 1.00 . A A . 6 ILE HA 1 1 6 2315 1 1 6 ILE HB H 4.185 4.976 -2.490 1.00 . A A . 6 ILE HB 1 1 6 2316 1 1 6 ILE HD11 H 7.301 3.292 -3.209 1.00 . A A . 6 ILE HD11 1 1 6 2317 1 1 6 ILE HD12 H 6.600 4.662 -2.353 1.00 . A A . 6 ILE HD12 1 1 6 2318 1 1 6 ILE HD13 H 7.214 4.856 -3.999 1.00 . A A . 6 ILE HD13 1 1 6 2319 1 1 6 ILE HG12 H 5.056 2.851 -3.514 1.00 . A A . 6 ILE HG12 1 1 6 2320 1 1 6 ILE HG13 H 5.437 3.744 -4.980 1.00 . A A . 6 ILE HG13 1 1 6 2321 1 1 6 ILE HG21 H 2.076 4.951 -3.722 1.00 . A A . 6 ILE HG21 1 1 6 2322 1 1 6 ILE HG22 H 2.728 3.319 -3.781 1.00 . A A . 6 ILE HG22 1 1 6 2323 1 1 6 ILE HG23 H 2.886 4.380 -5.182 1.00 . A A . 6 ILE HG23 1 1 6 2324 1 1 6 ILE N N 5.768 6.852 -3.526 1.00 . A A . 6 ILE N 1 1 6 2325 1 1 6 ILE O O 2.715 7.421 -5.074 1.00 . A A . 6 ILE O 1 1 6 2326 1 1 7 LYS C C 2.189 9.874 -3.738 1.00 . A A . 7 LYS C 1 1 6 2327 1 1 7 LYS CA C 2.120 8.727 -2.732 1.00 . A A . 7 LYS CA 1 1 6 2328 1 1 7 LYS CB C 2.178 9.288 -1.293 1.00 . A A . 7 LYS CB 1 1 6 2329 1 1 7 LYS CD C 1.032 10.745 0.421 1.00 . A A . 7 LYS CD 1 1 6 2330 1 1 7 LYS CE C -0.119 11.730 0.658 1.00 . A A . 7 LYS CE 1 1 6 2331 1 1 7 LYS CG C 1.025 10.283 -1.043 1.00 . A A . 7 LYS CG 1 1 6 2332 1 1 7 LYS H H 3.831 7.595 -2.178 1.00 . A A . 7 LYS H 1 1 6 2333 1 1 7 LYS HA H 1.188 8.199 -2.863 1.00 . A A . 7 LYS HA 1 1 6 2334 1 1 7 LYS HB2 H 2.105 8.468 -0.592 1.00 . A A . 7 LYS HB2 1 1 6 2335 1 1 7 LYS HB3 H 3.121 9.795 -1.149 1.00 . A A . 7 LYS HB3 1 1 6 2336 1 1 7 LYS HD2 H 0.913 9.889 1.069 1.00 . A A . 7 LYS HD2 1 1 6 2337 1 1 7 LYS HD3 H 1.971 11.234 0.639 1.00 . A A . 7 LYS HD3 1 1 6 2338 1 1 7 LYS HE2 H 0.015 12.597 0.024 1.00 . A A . 7 LYS HE2 1 1 6 2339 1 1 7 LYS HE3 H -1.059 11.252 0.420 1.00 . A A . 7 LYS HE3 1 1 6 2340 1 1 7 LYS HG2 H 1.144 11.149 -1.679 1.00 . A A . 7 LYS HG2 1 1 6 2341 1 1 7 LYS HG3 H 0.090 9.804 -1.267 1.00 . A A . 7 LYS HG3 1 1 6 2342 1 1 7 LYS HZ1 H -1.094 12.413 2.365 1.00 . A A . 7 LYS HZ1 1 1 6 2343 1 1 7 LYS HZ2 H 0.500 12.977 2.206 1.00 . A A . 7 LYS HZ2 1 1 6 2344 1 1 7 LYS HZ3 H 0.206 11.373 2.683 1.00 . A A . 7 LYS HZ3 1 1 6 2345 1 1 7 LYS N N 3.229 7.796 -2.925 1.00 . A A . 7 LYS N 1 1 6 2346 1 1 7 LYS NZ N -0.127 12.155 2.086 1.00 . A A . 7 LYS NZ 1 1 6 2347 1 1 7 LYS O O 1.207 10.181 -4.414 1.00 . A A . 7 LYS O 1 1 6 2348 1 1 8 LEU C C 3.440 11.144 -6.178 1.00 . A A . 8 LEU C 1 1 6 2349 1 1 8 LEU CA C 3.535 11.626 -4.738 1.00 . A A . 8 LEU CA 1 1 6 2350 1 1 8 LEU CB C 4.905 12.304 -4.478 1.00 . A A . 8 LEU CB 1 1 6 2351 1 1 8 LEU CD1 C 4.068 14.744 -4.223 1.00 . A A . 8 LEU CD1 1 1 6 2352 1 1 8 LEU CD2 C 6.388 14.274 -5.123 1.00 . A A . 8 LEU CD2 1 1 6 2353 1 1 8 LEU CG C 4.936 13.757 -5.069 1.00 . A A . 8 LEU CG 1 1 6 2354 1 1 8 LEU H H 4.089 10.219 -3.260 1.00 . A A . 8 LEU H 1 1 6 2355 1 1 8 LEU HA H 2.743 12.338 -4.565 1.00 . A A . 8 LEU HA 1 1 6 2356 1 1 8 LEU HB2 H 5.081 12.333 -3.414 1.00 . A A . 8 LEU HB2 1 1 6 2357 1 1 8 LEU HB3 H 5.690 11.709 -4.933 1.00 . A A . 8 LEU HB3 1 1 6 2358 1 1 8 LEU HD11 H 3.026 14.621 -4.467 1.00 . A A . 8 LEU HD11 1 1 6 2359 1 1 8 LEU HD12 H 4.346 15.768 -4.443 1.00 . A A . 8 LEU HD12 1 1 6 2360 1 1 8 LEU HD13 H 4.212 14.562 -3.166 1.00 . A A . 8 LEU HD13 1 1 6 2361 1 1 8 LEU HD21 H 6.987 13.613 -5.728 1.00 . A A . 8 LEU HD21 1 1 6 2362 1 1 8 LEU HD22 H 6.794 14.321 -4.123 1.00 . A A . 8 LEU HD22 1 1 6 2363 1 1 8 LEU HD23 H 6.392 15.264 -5.560 1.00 . A A . 8 LEU HD23 1 1 6 2364 1 1 8 LEU HG H 4.544 13.729 -6.079 1.00 . A A . 8 LEU HG 1 1 6 2365 1 1 8 LEU N N 3.349 10.507 -3.822 1.00 . A A . 8 LEU N 1 1 6 2366 1 1 8 LEU O O 2.857 11.796 -7.034 1.00 . A A . 8 LEU O 1 1 6 2367 1 1 9 ALA C C 2.611 9.355 -8.351 1.00 . A A . 9 ALA C 1 1 6 2368 1 1 9 ALA CA C 4.038 9.445 -7.795 1.00 . A A . 9 ALA CA 1 1 6 2369 1 1 9 ALA CB C 4.685 8.055 -7.802 1.00 . A A . 9 ALA CB 1 1 6 2370 1 1 9 ALA H H 4.509 9.530 -5.725 1.00 . A A . 9 ALA H 1 1 6 2371 1 1 9 ALA HA H 4.616 10.103 -8.418 1.00 . A A . 9 ALA HA 1 1 6 2372 1 1 9 ALA HB1 H 5.682 8.121 -7.391 1.00 . A A . 9 ALA HB1 1 1 6 2373 1 1 9 ALA HB2 H 4.738 7.686 -8.817 1.00 . A A . 9 ALA HB2 1 1 6 2374 1 1 9 ALA HB3 H 4.093 7.376 -7.205 1.00 . A A . 9 ALA HB3 1 1 6 2375 1 1 9 ALA N N 4.040 9.997 -6.443 1.00 . A A . 9 ALA N 1 1 6 2376 1 1 9 ALA O O 2.350 9.741 -9.490 1.00 . A A . 9 ALA O 1 1 6 2377 1 1 10 LYS C C -0.311 10.108 -8.142 1.00 . A A . 10 LYS C 1 1 6 2378 1 1 10 LYS CA C 0.295 8.727 -7.905 1.00 . A A . 10 LYS CA 1 1 6 2379 1 1 10 LYS CB C -0.458 8.016 -6.767 1.00 . A A . 10 LYS CB 1 1 6 2380 1 1 10 LYS CD C -0.525 5.569 -7.583 1.00 . A A . 10 LYS CD 1 1 6 2381 1 1 10 LYS CE C 0.004 4.150 -7.298 1.00 . A A . 10 LYS CE 1 1 6 2382 1 1 10 LYS CG C 0.071 6.559 -6.558 1.00 . A A . 10 LYS CG 1 1 6 2383 1 1 10 LYS H H 1.975 8.578 -6.624 1.00 . A A . 10 LYS H 1 1 6 2384 1 1 10 LYS HA H 0.214 8.155 -8.812 1.00 . A A . 10 LYS HA 1 1 6 2385 1 1 10 LYS HB2 H -0.311 8.585 -5.856 1.00 . A A . 10 LYS HB2 1 1 6 2386 1 1 10 LYS HB3 H -1.509 7.995 -6.992 1.00 . A A . 10 LYS HB3 1 1 6 2387 1 1 10 LYS HD2 H -1.602 5.574 -7.501 1.00 . A A . 10 LYS HD2 1 1 6 2388 1 1 10 LYS HD3 H -0.240 5.854 -8.580 1.00 . A A . 10 LYS HD3 1 1 6 2389 1 1 10 LYS HE2 H -0.203 3.880 -6.271 1.00 . A A . 10 LYS HE2 1 1 6 2390 1 1 10 LYS HE3 H -0.477 3.443 -7.959 1.00 . A A . 10 LYS HE3 1 1 6 2391 1 1 10 LYS HG2 H 1.146 6.544 -6.653 1.00 . A A . 10 LYS HG2 1 1 6 2392 1 1 10 LYS HG3 H -0.193 6.228 -5.559 1.00 . A A . 10 LYS HG3 1 1 6 2393 1 1 10 LYS HZ1 H 1.840 3.170 -7.295 1.00 . A A . 10 LYS HZ1 1 1 6 2394 1 1 10 LYS HZ2 H 1.935 4.823 -6.915 1.00 . A A . 10 LYS HZ2 1 1 6 2395 1 1 10 LYS HZ3 H 1.680 4.331 -8.522 1.00 . A A . 10 LYS HZ3 1 1 6 2396 1 1 10 LYS N N 1.700 8.856 -7.523 1.00 . A A . 10 LYS N 1 1 6 2397 1 1 10 LYS NZ N 1.476 4.116 -7.525 1.00 . A A . 10 LYS NZ 1 1 6 2398 1 1 10 LYS O O -1.035 10.323 -9.114 1.00 . A A . 10 LYS O 1 1 6 2399 1 1 11 PHE C C -0.098 12.999 -8.703 1.00 . A A . 11 PHE C 1 1 6 2400 1 1 11 PHE CA C -0.502 12.413 -7.356 1.00 . A A . 11 PHE CA 1 1 6 2401 1 1 11 PHE CB C 0.090 13.257 -6.213 1.00 . A A . 11 PHE CB 1 1 6 2402 1 1 11 PHE CD1 C -1.769 14.956 -5.932 1.00 . A A . 11 PHE CD1 1 1 6 2403 1 1 11 PHE CD2 C 0.428 15.769 -6.591 1.00 . A A . 11 PHE CD2 1 1 6 2404 1 1 11 PHE CE1 C -2.254 16.268 -5.949 1.00 . A A . 11 PHE CE1 1 1 6 2405 1 1 11 PHE CE2 C -0.064 17.078 -6.599 1.00 . A A . 11 PHE CE2 1 1 6 2406 1 1 11 PHE CG C -0.429 14.694 -6.255 1.00 . A A . 11 PHE CG 1 1 6 2407 1 1 11 PHE CZ C -1.403 17.328 -6.280 1.00 . A A . 11 PHE CZ 1 1 6 2408 1 1 11 PHE H H 0.584 10.799 -6.502 1.00 . A A . 11 PHE H 1 1 6 2409 1 1 11 PHE HA H -1.578 12.408 -7.275 1.00 . A A . 11 PHE HA 1 1 6 2410 1 1 11 PHE HB2 H -0.191 12.809 -5.278 1.00 . A A . 11 PHE HB2 1 1 6 2411 1 1 11 PHE HB3 H 1.160 13.252 -6.286 1.00 . A A . 11 PHE HB3 1 1 6 2412 1 1 11 PHE HD1 H -2.431 14.142 -5.676 1.00 . A A . 11 PHE HD1 1 1 6 2413 1 1 11 PHE HD2 H 1.465 15.584 -6.846 1.00 . A A . 11 PHE HD2 1 1 6 2414 1 1 11 PHE HE1 H -3.288 16.464 -5.703 1.00 . A A . 11 PHE HE1 1 1 6 2415 1 1 11 PHE HE2 H 0.591 17.898 -6.856 1.00 . A A . 11 PHE HE2 1 1 6 2416 1 1 11 PHE HZ H -1.780 18.339 -6.290 1.00 . A A . 11 PHE HZ 1 1 6 2417 1 1 11 PHE N N 0.003 11.039 -7.247 1.00 . A A . 11 PHE N 1 1 6 2418 1 1 11 PHE O O -0.930 13.511 -9.446 1.00 . A A . 11 PHE O 1 1 6 2419 1 1 12 LEU C C 1.079 12.543 -11.434 1.00 . A A . 12 LEU C 1 1 6 2420 1 1 12 LEU CA C 1.704 13.351 -10.302 1.00 . A A . 12 LEU CA 1 1 6 2421 1 1 12 LEU CB C 3.236 13.184 -10.352 1.00 . A A . 12 LEU CB 1 1 6 2422 1 1 12 LEU CD1 C 5.444 13.733 -9.274 1.00 . A A . 12 LEU CD1 1 1 6 2423 1 1 12 LEU CD2 C 3.681 15.546 -9.440 1.00 . A A . 12 LEU CD2 1 1 6 2424 1 1 12 LEU CG C 3.931 14.024 -9.250 1.00 . A A . 12 LEU CG 1 1 6 2425 1 1 12 LEU H H 1.786 12.427 -8.386 1.00 . A A . 12 LEU H 1 1 6 2426 1 1 12 LEU HA H 1.445 14.387 -10.445 1.00 . A A . 12 LEU HA 1 1 6 2427 1 1 12 LEU HB2 H 3.478 12.138 -10.207 1.00 . A A . 12 LEU HB2 1 1 6 2428 1 1 12 LEU HB3 H 3.600 13.499 -11.323 1.00 . A A . 12 LEU HB3 1 1 6 2429 1 1 12 LEU HD11 H 5.934 14.308 -8.502 1.00 . A A . 12 LEU HD11 1 1 6 2430 1 1 12 LEU HD12 H 5.849 14.004 -10.237 1.00 . A A . 12 LEU HD12 1 1 6 2431 1 1 12 LEU HD13 H 5.611 12.680 -9.096 1.00 . A A . 12 LEU HD13 1 1 6 2432 1 1 12 LEU HD21 H 4.439 16.117 -8.918 1.00 . A A . 12 LEU HD21 1 1 6 2433 1 1 12 LEU HD22 H 2.719 15.801 -9.023 1.00 . A A . 12 LEU HD22 1 1 6 2434 1 1 12 LEU HD23 H 3.700 15.804 -10.490 1.00 . A A . 12 LEU HD23 1 1 6 2435 1 1 12 LEU HG H 3.538 13.726 -8.294 1.00 . A A . 12 LEU HG 1 1 6 2436 1 1 12 LEU N N 1.184 12.873 -9.020 1.00 . A A . 12 LEU N 1 1 6 2437 1 1 12 LEU O O 0.711 13.090 -12.470 1.00 . A A . 12 LEU O 1 1 6 2438 1 1 13 GLY C C -1.068 10.630 -12.452 1.00 . A A . 13 GLY C 1 1 6 2439 1 1 13 GLY CA C 0.411 10.340 -12.226 1.00 . A A . 13 GLY CA 1 1 6 2440 1 1 13 GLY H H 1.299 10.857 -10.377 1.00 . A A . 13 GLY H 1 1 6 2441 1 1 13 GLY HA2 H 0.946 10.467 -13.151 1.00 . A A . 13 GLY HA2 1 1 6 2442 1 1 13 GLY HA3 H 0.524 9.330 -11.905 1.00 . A A . 13 GLY HA3 1 1 6 2443 1 1 13 GLY N N 0.978 11.232 -11.222 1.00 . A A . 13 GLY N 1 1 6 2444 1 1 13 GLY O O -1.657 10.198 -13.442 1.00 . A A . 13 GLY O 1 1 6 2445 1 1 14 GLY C C -3.195 12.976 -12.522 1.00 . A A . 14 GLY C 1 1 6 2446 1 1 14 GLY CA C -3.085 11.738 -11.644 1.00 . A A . 14 GLY CA 1 1 6 2447 1 1 14 GLY H H -1.154 11.688 -10.757 1.00 . A A . 14 GLY H 1 1 6 2448 1 1 14 GLY HA2 H -3.657 10.926 -12.082 1.00 . A A . 14 GLY HA2 1 1 6 2449 1 1 14 GLY HA3 H -3.477 11.964 -10.665 1.00 . A A . 14 GLY HA3 1 1 6 2450 1 1 14 GLY N N -1.670 11.369 -11.526 1.00 . A A . 14 GLY N 1 1 6 2451 1 1 14 GLY O O -4.045 13.060 -13.409 1.00 . A A . 14 GLY O 1 1 6 2452 1 1 15 ILE C C -1.701 14.950 -14.403 1.00 . A A . 15 ILE C 1 1 6 2453 1 1 15 ILE CA C -2.247 15.187 -13.004 1.00 . A A . 15 ILE CA 1 1 6 2454 1 1 15 ILE CB C -1.357 16.210 -12.256 1.00 . A A . 15 ILE CB 1 1 6 2455 1 1 15 ILE CD1 C -0.883 17.208 -9.981 1.00 . A A . 15 ILE CD1 1 1 6 2456 1 1 15 ILE CG1 C -1.899 16.418 -10.814 1.00 . A A . 15 ILE CG1 1 1 6 2457 1 1 15 ILE CG2 C -1.353 17.568 -13.008 1.00 . A A . 15 ILE CG2 1 1 6 2458 1 1 15 ILE H H -1.653 13.784 -11.544 1.00 . A A . 15 ILE H 1 1 6 2459 1 1 15 ILE HA H -3.247 15.595 -13.089 1.00 . A A . 15 ILE HA 1 1 6 2460 1 1 15 ILE HB H -0.343 15.826 -12.213 1.00 . A A . 15 ILE HB 1 1 6 2461 1 1 15 ILE HD11 H -0.671 18.152 -10.461 1.00 . A A . 15 ILE HD11 1 1 6 2462 1 1 15 ILE HD12 H 0.030 16.635 -9.897 1.00 . A A . 15 ILE HD12 1 1 6 2463 1 1 15 ILE HD13 H -1.291 17.386 -9.003 1.00 . A A . 15 ILE HD13 1 1 6 2464 1 1 15 ILE HG12 H -2.833 16.962 -10.847 1.00 . A A . 15 ILE HG12 1 1 6 2465 1 1 15 ILE HG13 H -2.065 15.465 -10.338 1.00 . A A . 15 ILE HG13 1 1 6 2466 1 1 15 ILE HG21 H -2.370 17.912 -13.129 1.00 . A A . 15 ILE HG21 1 1 6 2467 1 1 15 ILE HG22 H -0.895 17.455 -13.977 1.00 . A A . 15 ILE HG22 1 1 6 2468 1 1 15 ILE HG23 H -0.796 18.299 -12.440 1.00 . A A . 15 ILE HG23 1 1 6 2469 1 1 15 ILE N N -2.305 13.932 -12.258 1.00 . A A . 15 ILE N 1 1 6 2470 1 1 15 ILE O O -2.164 15.558 -15.365 1.00 . A A . 15 ILE O 1 1 6 2471 1 1 16 VAL C C -1.170 13.439 -16.836 1.00 . A A . 16 VAL C 1 1 6 2472 1 1 16 VAL CA C -0.076 13.854 -15.840 1.00 . A A . 16 VAL CA 1 1 6 2473 1 1 16 VAL CB C 1.063 12.781 -15.731 1.00 . A A . 16 VAL CB 1 1 6 2474 1 1 16 VAL CG1 C 0.503 11.340 -15.776 1.00 . A A . 16 VAL CG1 1 1 6 2475 1 1 16 VAL CG2 C 2.081 12.958 -16.879 1.00 . A A . 16 VAL CG2 1 1 6 2476 1 1 16 VAL H H -0.314 13.647 -13.727 1.00 . A A . 16 VAL H 1 1 6 2477 1 1 16 VAL HA H 0.347 14.794 -16.171 1.00 . A A . 16 VAL HA 1 1 6 2478 1 1 16 VAL HB H 1.573 12.916 -14.781 1.00 . A A . 16 VAL HB 1 1 6 2479 1 1 16 VAL HG11 H 1.285 10.639 -15.525 1.00 . A A . 16 VAL HG11 1 1 6 2480 1 1 16 VAL HG12 H 0.131 11.110 -16.766 1.00 . A A . 16 VAL HG12 1 1 6 2481 1 1 16 VAL HG13 H -0.299 11.254 -15.069 1.00 . A A . 16 VAL HG13 1 1 6 2482 1 1 16 VAL HG21 H 1.566 12.869 -17.825 1.00 . A A . 16 VAL HG21 1 1 6 2483 1 1 16 VAL HG22 H 2.847 12.198 -16.810 1.00 . A A . 16 VAL HG22 1 1 6 2484 1 1 16 VAL HG23 H 2.539 13.933 -16.809 1.00 . A A . 16 VAL HG23 1 1 6 2485 1 1 16 VAL N N -0.679 14.094 -14.525 1.00 . A A . 16 VAL N 1 1 6 2486 1 1 16 VAL O O -1.239 13.939 -17.956 1.00 . A A . 16 VAL O 1 1 6 2487 1 1 17 ARG C C -4.140 13.204 -17.421 1.00 . A A . 17 ARG C 1 1 6 2488 1 1 17 ARG CA C -3.153 12.061 -17.176 1.00 . A A . 17 ARG CA 1 1 6 2489 1 1 17 ARG CB C -3.835 10.894 -16.436 1.00 . A A . 17 ARG CB 1 1 6 2490 1 1 17 ARG CD C -4.656 9.769 -18.589 1.00 . A A . 17 ARG CD 1 1 6 2491 1 1 17 ARG CG C -5.056 10.335 -17.208 1.00 . A A . 17 ARG CG 1 1 6 2492 1 1 17 ARG CZ C -5.644 8.340 -20.309 1.00 . A A . 17 ARG CZ 1 1 6 2493 1 1 17 ARG H H -1.931 12.199 -15.466 1.00 . A A . 17 ARG H 1 1 6 2494 1 1 17 ARG HA H -2.776 11.709 -18.123 1.00 . A A . 17 ARG HA 1 1 6 2495 1 1 17 ARG HB2 H -3.116 10.101 -16.296 1.00 . A A . 17 ARG HB2 1 1 6 2496 1 1 17 ARG HB3 H -4.163 11.243 -15.467 1.00 . A A . 17 ARG HB3 1 1 6 2497 1 1 17 ARG HD2 H -4.465 10.579 -19.279 1.00 . A A . 17 ARG HD2 1 1 6 2498 1 1 17 ARG HD3 H -3.765 9.161 -18.494 1.00 . A A . 17 ARG HD3 1 1 6 2499 1 1 17 ARG HE H -6.571 8.858 -18.608 1.00 . A A . 17 ARG HE 1 1 6 2500 1 1 17 ARG HG2 H -5.487 9.538 -16.623 1.00 . A A . 17 ARG HG2 1 1 6 2501 1 1 17 ARG HG3 H -5.798 11.110 -17.334 1.00 . A A . 17 ARG HG3 1 1 6 2502 1 1 17 ARG HH11 H -3.781 8.982 -20.672 1.00 . A A . 17 ARG HH11 1 1 6 2503 1 1 17 ARG HH12 H -4.481 7.983 -21.902 1.00 . A A . 17 ARG HH12 1 1 6 2504 1 1 17 ARG HH21 H -7.482 7.550 -20.223 1.00 . A A . 17 ARG HH21 1 1 6 2505 1 1 17 ARG HH22 H -6.571 7.174 -21.647 1.00 . A A . 17 ARG HH22 1 1 6 2506 1 1 17 ARG N N -2.035 12.538 -16.379 1.00 . A A . 17 ARG N 1 1 6 2507 1 1 17 ARG NE N -5.744 8.951 -19.125 1.00 . A A . 17 ARG NE 1 1 6 2508 1 1 17 ARG NH1 N -4.550 8.442 -21.017 1.00 . A A . 17 ARG NH1 1 1 6 2509 1 1 17 ARG NH2 N -6.643 7.633 -20.761 1.00 . A A . 17 ARG NH2 1 1 6 2510 1 1 17 ARG O O -4.735 13.299 -18.491 1.00 . A A . 17 ARG O 1 1 6 2511 1 1 18 ALA C C -4.906 16.081 -17.714 1.00 . A A . 18 ALA C 1 1 6 2512 1 1 18 ALA CA C -5.265 15.182 -16.525 1.00 . A A . 18 ALA CA 1 1 6 2513 1 1 18 ALA CB C -5.280 16.012 -15.226 1.00 . A A . 18 ALA CB 1 1 6 2514 1 1 18 ALA H H -3.837 13.929 -15.570 1.00 . A A . 18 ALA H 1 1 6 2515 1 1 18 ALA HA H -6.254 14.778 -16.681 1.00 . A A . 18 ALA HA 1 1 6 2516 1 1 18 ALA HB1 H -4.347 16.543 -15.116 1.00 . A A . 18 ALA HB1 1 1 6 2517 1 1 18 ALA HB2 H -5.418 15.356 -14.380 1.00 . A A . 18 ALA HB2 1 1 6 2518 1 1 18 ALA HB3 H -6.092 16.727 -15.261 1.00 . A A . 18 ALA HB3 1 1 6 2519 1 1 18 ALA N N -4.326 14.060 -16.408 1.00 . A A . 18 ALA N 1 1 6 2520 1 1 18 ALA O O -5.784 16.513 -18.457 1.00 . A A . 18 ALA O 1 1 6 2521 1 1 19 MET C C -3.510 16.578 -20.324 1.00 . A A . 19 MET C 1 1 6 2522 1 1 19 MET CA C -3.133 17.185 -18.974 1.00 . A A . 19 MET CA 1 1 6 2523 1 1 19 MET CB C -1.607 17.258 -18.868 1.00 . A A . 19 MET CB 1 1 6 2524 1 1 19 MET CE C 0.770 19.409 -16.292 1.00 . A A . 19 MET CE 1 1 6 2525 1 1 19 MET CG C -1.180 18.065 -17.633 1.00 . A A . 19 MET CG 1 1 6 2526 1 1 19 MET H H -2.959 15.978 -17.267 1.00 . A A . 19 MET H 1 1 6 2527 1 1 19 MET HA H -3.553 18.176 -18.892 1.00 . A A . 19 MET HA 1 1 6 2528 1 1 19 MET HB2 H -1.214 16.258 -18.784 1.00 . A A . 19 MET HB2 1 1 6 2529 1 1 19 MET HB3 H -1.211 17.710 -19.747 1.00 . A A . 19 MET HB3 1 1 6 2530 1 1 19 MET HE1 H 1.815 19.631 -16.120 1.00 . A A . 19 MET HE1 1 1 6 2531 1 1 19 MET HE2 H 0.328 19.048 -15.378 1.00 . A A . 19 MET HE2 1 1 6 2532 1 1 19 MET HE3 H 0.254 20.304 -16.611 1.00 . A A . 19 MET HE3 1 1 6 2533 1 1 19 MET HG2 H -1.582 19.066 -17.696 1.00 . A A . 19 MET HG2 1 1 6 2534 1 1 19 MET HG3 H -1.550 17.585 -16.739 1.00 . A A . 19 MET HG3 1 1 6 2535 1 1 19 MET N N -3.612 16.349 -17.884 1.00 . A A . 19 MET N 1 1 6 2536 1 1 19 MET O O -4.159 17.212 -21.152 1.00 . A A . 19 MET O 1 1 6 2537 1 1 19 MET SD S 0.627 18.141 -17.575 1.00 . A A . 19 MET SD 1 1 6 2538 1 1 20 LEU C C -4.913 14.476 -21.895 1.00 . A A . 20 LEU C 1 1 6 2539 1 1 20 LEU CA C -3.401 14.618 -21.762 1.00 . A A . 20 LEU CA 1 1 6 2540 1 1 20 LEU CB C -2.721 13.223 -21.737 1.00 . A A . 20 LEU CB 1 1 6 2541 1 1 20 LEU CD1 C -0.438 14.287 -21.370 1.00 . A A . 20 LEU CD1 1 1 6 2542 1 1 20 LEU CD2 C -0.622 11.898 -22.157 1.00 . A A . 20 LEU CD2 1 1 6 2543 1 1 20 LEU CG C -1.252 13.299 -22.231 1.00 . A A . 20 LEU CG 1 1 6 2544 1 1 20 LEU H H -2.583 14.889 -19.818 1.00 . A A . 20 LEU H 1 1 6 2545 1 1 20 LEU HA H -3.036 15.191 -22.607 1.00 . A A . 20 LEU HA 1 1 6 2546 1 1 20 LEU HB2 H -2.730 12.849 -20.724 1.00 . A A . 20 LEU HB2 1 1 6 2547 1 1 20 LEU HB3 H -3.269 12.538 -22.368 1.00 . A A . 20 LEU HB3 1 1 6 2548 1 1 20 LEU HD11 H 0.609 14.230 -21.640 1.00 . A A . 20 LEU HD11 1 1 6 2549 1 1 20 LEU HD12 H -0.550 14.040 -20.325 1.00 . A A . 20 LEU HD12 1 1 6 2550 1 1 20 LEU HD13 H -0.792 15.294 -21.544 1.00 . A A . 20 LEU HD13 1 1 6 2551 1 1 20 LEU HD21 H -0.637 11.549 -21.134 1.00 . A A . 20 LEU HD21 1 1 6 2552 1 1 20 LEU HD22 H 0.401 11.941 -22.506 1.00 . A A . 20 LEU HD22 1 1 6 2553 1 1 20 LEU HD23 H -1.184 11.215 -22.777 1.00 . A A . 20 LEU HD23 1 1 6 2554 1 1 20 LEU HG H -1.245 13.638 -23.257 1.00 . A A . 20 LEU HG 1 1 6 2555 1 1 20 LEU N N -3.099 15.336 -20.523 1.00 . A A . 20 LEU N 1 1 6 2556 1 1 20 LEU O O -5.471 14.591 -22.986 1.00 . A A . 20 LEU O 1 1 6 2557 1 1 21 GLY C C -7.660 15.406 -21.169 1.00 . A A . 21 GLY C 1 1 6 2558 1 1 21 GLY CA C -7.015 14.103 -20.738 1.00 . A A . 21 GLY CA 1 1 6 2559 1 1 21 GLY H H -5.051 14.183 -19.928 1.00 . A A . 21 GLY H 1 1 6 2560 1 1 21 GLY HA2 H -7.318 13.310 -21.410 1.00 . A A . 21 GLY HA2 1 1 6 2561 1 1 21 GLY HA3 H -7.337 13.865 -19.735 1.00 . A A . 21 GLY HA3 1 1 6 2562 1 1 21 GLY N N -5.561 14.242 -20.764 1.00 . A A . 21 GLY N 1 1 6 2563 1 1 21 GLY O O -8.697 15.414 -21.827 1.00 . A A . 21 GLY O 1 1 6 2564 1 1 22 SER C C -7.345 18.066 -22.668 1.00 . A A . 22 SER C 1 1 6 2565 1 1 22 SER CA C -7.498 17.845 -21.162 1.00 . A A . 22 SER CA 1 1 6 2566 1 1 22 SER CB C -6.721 18.920 -20.377 1.00 . A A . 22 SER CB 1 1 6 2567 1 1 22 SER H H -6.178 16.423 -20.292 1.00 . A A . 22 SER H 1 1 6 2568 1 1 22 SER HA H -8.547 17.924 -20.905 1.00 . A A . 22 SER HA 1 1 6 2569 1 1 22 SER HB2 H -6.634 18.620 -19.346 1.00 . A A . 22 SER HB2 1 1 6 2570 1 1 22 SER HB3 H -5.728 19.044 -20.790 1.00 . A A . 22 SER HB3 1 1 6 2571 1 1 22 SER HG H -8.332 19.989 -20.149 1.00 . A A . 22 SER HG 1 1 6 2572 1 1 22 SER N N -7.014 16.511 -20.801 1.00 . A A . 22 SER N 1 1 6 2573 1 1 22 SER O O -8.212 18.653 -23.316 1.00 . A A . 22 SER O 1 1 6 2574 1 1 22 SER OG O -7.431 20.151 -20.438 1.00 . A A . 22 SER OG 1 1 6 2575 1 1 23 PHE C C -6.926 16.954 -25.472 1.00 . A A . 23 PHE C 1 1 6 2576 1 1 23 PHE CA C -5.922 17.737 -24.629 1.00 . A A . 23 PHE CA 1 1 6 2577 1 1 23 PHE CB C -4.503 17.220 -24.895 1.00 . A A . 23 PHE CB 1 1 6 2578 1 1 23 PHE CD1 C -3.631 18.799 -26.683 1.00 . A A . 23 PHE CD1 1 1 6 2579 1 1 23 PHE CD2 C -4.157 16.517 -27.329 1.00 . A A . 23 PHE CD2 1 1 6 2580 1 1 23 PHE CE1 C -3.247 19.081 -28.000 1.00 . A A . 23 PHE CE1 1 1 6 2581 1 1 23 PHE CE2 C -3.771 16.803 -28.643 1.00 . A A . 23 PHE CE2 1 1 6 2582 1 1 23 PHE CG C -4.089 17.515 -26.338 1.00 . A A . 23 PHE CG 1 1 6 2583 1 1 23 PHE CZ C -3.318 18.083 -28.979 1.00 . A A . 23 PHE CZ 1 1 6 2584 1 1 23 PHE H H -5.570 17.143 -22.627 1.00 . A A . 23 PHE H 1 1 6 2585 1 1 23 PHE HA H -5.974 18.785 -24.897 1.00 . A A . 23 PHE HA 1 1 6 2586 1 1 23 PHE HB2 H -3.816 17.705 -24.213 1.00 . A A . 23 PHE HB2 1 1 6 2587 1 1 23 PHE HB3 H -4.479 16.157 -24.713 1.00 . A A . 23 PHE HB3 1 1 6 2588 1 1 23 PHE HD1 H -3.577 19.572 -25.930 1.00 . A A . 23 PHE HD1 1 1 6 2589 1 1 23 PHE HD2 H -4.506 15.527 -27.077 1.00 . A A . 23 PHE HD2 1 1 6 2590 1 1 23 PHE HE1 H -2.896 20.068 -28.260 1.00 . A A . 23 PHE HE1 1 1 6 2591 1 1 23 PHE HE2 H -3.824 16.033 -29.401 1.00 . A A . 23 PHE HE2 1 1 6 2592 1 1 23 PHE HZ H -3.019 18.302 -29.994 1.00 . A A . 23 PHE HZ 1 1 6 2593 1 1 23 PHE N N -6.221 17.593 -23.205 1.00 . A A . 23 PHE N 1 1 6 2594 1 1 23 PHE O O -6.660 15.830 -25.897 1.00 . A A . 23 PHE O 1 1 6 2595 1 1 24 ARG C C -9.373 17.740 -27.792 1.00 . A A . 24 ARG C 1 1 6 2596 1 1 24 ARG CA C -9.182 16.973 -26.486 1.00 . A A . 24 ARG CA 1 1 6 2597 1 1 24 ARG CB C -10.484 17.034 -25.669 1.00 . A A . 24 ARG CB 1 1 6 2598 1 1 24 ARG CD C -11.614 16.279 -23.555 1.00 . A A . 24 ARG CD 1 1 6 2599 1 1 24 ARG CG C -10.330 16.205 -24.386 1.00 . A A . 24 ARG CG 1 1 6 2600 1 1 24 ARG CZ C -11.495 14.165 -22.313 1.00 . A A . 24 ARG CZ 1 1 6 2601 1 1 24 ARG H H -8.206 18.457 -25.314 1.00 . A A . 24 ARG H 1 1 6 2602 1 1 24 ARG HA H -8.966 15.935 -26.723 1.00 . A A . 24 ARG HA 1 1 6 2603 1 1 24 ARG HB2 H -10.696 18.061 -25.410 1.00 . A A . 24 ARG HB2 1 1 6 2604 1 1 24 ARG HB3 H -11.301 16.634 -26.253 1.00 . A A . 24 ARG HB3 1 1 6 2605 1 1 24 ARG HD2 H -11.814 17.311 -23.299 1.00 . A A . 24 ARG HD2 1 1 6 2606 1 1 24 ARG HD3 H -12.443 15.891 -24.135 1.00 . A A . 24 ARG HD3 1 1 6 2607 1 1 24 ARG HE H -11.329 15.977 -21.472 1.00 . A A . 24 ARG HE 1 1 6 2608 1 1 24 ARG HG2 H -10.127 15.175 -24.646 1.00 . A A . 24 ARG HG2 1 1 6 2609 1 1 24 ARG HG3 H -9.508 16.597 -23.807 1.00 . A A . 24 ARG HG3 1 1 6 2610 1 1 24 ARG HH11 H -11.780 13.997 -24.289 1.00 . A A . 24 ARG HH11 1 1 6 2611 1 1 24 ARG HH12 H -11.698 12.504 -23.415 1.00 . A A . 24 ARG HH12 1 1 6 2612 1 1 24 ARG HH21 H -11.219 14.023 -20.335 1.00 . A A . 24 ARG HH21 1 1 6 2613 1 1 24 ARG HH22 H -11.380 12.518 -21.179 1.00 . A A . 24 ARG HH22 1 1 6 2614 1 1 24 ARG N N -8.083 17.570 -25.697 1.00 . A A . 24 ARG N 1 1 6 2615 1 1 24 ARG NE N -11.461 15.501 -22.319 1.00 . A A . 24 ARG NE 1 1 6 2616 1 1 24 ARG NH1 N -11.671 13.504 -23.426 1.00 . A A . 24 ARG NH1 1 1 6 2617 1 1 24 ARG NH2 N -11.353 13.518 -21.189 1.00 . A A . 24 ARG NH2 1 1 6 2618 1 1 24 ARG O O -9.063 18.929 -27.879 1.00 . A A . 24 ARG O 1 1 6 2619 1 1 25 LYS C C -11.215 18.749 -29.972 1.00 . A A . 25 LYS C 1 1 6 2620 1 1 25 LYS CA C -10.142 17.667 -30.107 1.00 . A A . 25 LYS CA 1 1 6 2621 1 1 25 LYS CB C -10.614 16.594 -31.112 1.00 . A A . 25 LYS CB 1 1 6 2622 1 1 25 LYS CD C -8.341 15.912 -32.101 1.00 . A A . 25 LYS CD 1 1 6 2623 1 1 25 LYS CE C -7.400 14.723 -32.348 1.00 . A A . 25 LYS CE 1 1 6 2624 1 1 25 LYS CG C -9.567 15.451 -31.276 1.00 . A A . 25 LYS CG 1 1 6 2625 1 1 25 LYS H H -10.128 16.107 -28.669 1.00 . A A . 25 LYS H 1 1 6 2626 1 1 25 LYS HA H -9.237 18.126 -30.468 1.00 . A A . 25 LYS HA 1 1 6 2627 1 1 25 LYS HB2 H -11.545 16.169 -30.752 1.00 . A A . 25 LYS HB2 1 1 6 2628 1 1 25 LYS HB3 H -10.792 17.059 -32.073 1.00 . A A . 25 LYS HB3 1 1 6 2629 1 1 25 LYS HD2 H -8.672 16.310 -33.049 1.00 . A A . 25 LYS HD2 1 1 6 2630 1 1 25 LYS HD3 H -7.799 16.671 -31.564 1.00 . A A . 25 LYS HD3 1 1 6 2631 1 1 25 LYS HE2 H -7.935 13.934 -32.856 1.00 . A A . 25 LYS HE2 1 1 6 2632 1 1 25 LYS HE3 H -6.570 15.044 -32.960 1.00 . A A . 25 LYS HE3 1 1 6 2633 1 1 25 LYS HG2 H -9.233 15.125 -30.300 1.00 . A A . 25 LYS HG2 1 1 6 2634 1 1 25 LYS HG3 H -10.038 14.615 -31.781 1.00 . A A . 25 LYS HG3 1 1 6 2635 1 1 25 LYS HZ1 H -6.385 14.982 -30.549 1.00 . A A . 25 LYS HZ1 1 1 6 2636 1 1 25 LYS HZ2 H -6.230 13.427 -31.216 1.00 . A A . 25 LYS HZ2 1 1 6 2637 1 1 25 LYS HZ3 H -7.679 13.889 -30.460 1.00 . A A . 25 LYS HZ3 1 1 6 2638 1 1 25 LYS N N -9.896 17.050 -28.804 1.00 . A A . 25 LYS N 1 1 6 2639 1 1 25 LYS NZ N -6.885 14.217 -31.044 1.00 . A A . 25 LYS NZ 1 1 6 2640 1 1 25 LYS O O -12.143 18.617 -29.174 1.00 . A A . 25 LYS O 1 1 6 2641 1 1 26 ASP C C -13.441 20.436 -31.066 1.00 . A A . 26 ASP C 1 1 6 2642 1 1 26 ASP CA C -12.036 20.926 -30.707 1.00 . A A . 26 ASP CA 1 1 6 2643 1 1 26 ASP CB C -11.604 22.026 -31.692 1.00 . A A . 26 ASP CB 1 1 6 2644 1 1 26 ASP CG C -10.236 22.590 -31.300 1.00 . A A . 26 ASP CG 1 1 6 2645 1 1 26 ASP H H -10.315 19.874 -31.365 1.00 . A A . 26 ASP H 1 1 6 2646 1 1 26 ASP HA H -12.055 21.338 -29.709 1.00 . A A . 26 ASP HA 1 1 6 2647 1 1 26 ASP HB2 H -11.545 21.609 -32.686 1.00 . A A . 26 ASP HB2 1 1 6 2648 1 1 26 ASP HB3 H -12.331 22.828 -31.683 1.00 . A A . 26 ASP HB3 1 1 6 2649 1 1 26 ASP N N -11.078 19.822 -30.752 1.00 . A A . 26 ASP N 1 1 6 2650 1 1 26 ASP O O -14.062 19.810 -30.222 1.00 . A A . 26 ASP O 1 1 6 2651 1 1 26 ASP OD1 O -9.885 22.500 -30.133 1.00 . A A . 26 ASP OD1 1 1 6 2652 1 1 26 ASP OD2 O -9.562 23.110 -32.173 1.00 . A A . 26 ASP OD2 1 1 7 2653 1 1 1 MET C C 11.618 4.381 -0.710 1.00 . A A . 1 MET C 1 1 7 2654 1 1 1 MET CA C 12.679 3.868 -1.682 1.00 . A A . 1 MET CA 1 1 7 2655 1 1 1 MET CB C 12.527 4.548 -3.056 1.00 . A A . 1 MET CB 1 1 7 2656 1 1 1 MET CE C 13.609 6.595 -5.257 1.00 . A A . 1 MET CE 1 1 7 2657 1 1 1 MET CG C 13.687 4.136 -3.978 1.00 . A A . 1 MET CG 1 1 7 2658 1 1 1 MET H1 H 11.901 2.026 -1.100 1.00 . A A . 1 MET H1 1 1 7 2659 1 1 1 MET H2 H 13.451 1.938 -1.792 1.00 . A A . 1 MET H2 1 1 7 2660 1 1 1 MET H3 H 12.093 2.197 -2.777 1.00 . A A . 1 MET H3 1 1 7 2661 1 1 1 MET HA H 13.660 4.078 -1.278 1.00 . A A . 1 MET HA 1 1 7 2662 1 1 1 MET HB2 H 11.591 4.248 -3.504 1.00 . A A . 1 MET HB2 1 1 7 2663 1 1 1 MET HB3 H 12.535 5.622 -2.932 1.00 . A A . 1 MET HB3 1 1 7 2664 1 1 1 MET HE1 H 14.323 6.734 -4.459 1.00 . A A . 1 MET HE1 1 1 7 2665 1 1 1 MET HE2 H 12.654 6.996 -4.958 1.00 . A A . 1 MET HE2 1 1 7 2666 1 1 1 MET HE3 H 13.950 7.115 -6.144 1.00 . A A . 1 MET HE3 1 1 7 2667 1 1 1 MET HG2 H 14.619 4.498 -3.571 1.00 . A A . 1 MET HG2 1 1 7 2668 1 1 1 MET HG3 H 13.727 3.058 -4.046 1.00 . A A . 1 MET HG3 1 1 7 2669 1 1 1 MET N N 12.519 2.395 -1.849 1.00 . A A . 1 MET N 1 1 7 2670 1 1 1 MET O O 10.887 3.597 -0.103 1.00 . A A . 1 MET O 1 1 7 2671 1 1 1 MET SD S 13.434 4.827 -5.639 1.00 . A A . 1 MET SD 1 1 7 2672 1 1 2 LYS C C 9.157 6.172 -0.210 1.00 . A A . 2 LYS C 1 1 7 2673 1 1 2 LYS CA C 10.577 6.326 0.342 1.00 . A A . 2 LYS CA 1 1 7 2674 1 1 2 LYS CB C 10.918 7.822 0.510 1.00 . A A . 2 LYS CB 1 1 7 2675 1 1 2 LYS CD C 12.613 9.463 1.385 1.00 . A A . 2 LYS CD 1 1 7 2676 1 1 2 LYS CE C 13.946 9.614 2.129 1.00 . A A . 2 LYS CE 1 1 7 2677 1 1 2 LYS CG C 12.273 7.972 1.218 1.00 . A A . 2 LYS CG 1 1 7 2678 1 1 2 LYS H H 12.161 6.273 -1.073 1.00 . A A . 2 LYS H 1 1 7 2679 1 1 2 LYS HA H 10.628 5.843 1.312 1.00 . A A . 2 LYS HA 1 1 7 2680 1 1 2 LYS HB2 H 10.965 8.293 -0.463 1.00 . A A . 2 LYS HB2 1 1 7 2681 1 1 2 LYS HB3 H 10.153 8.307 1.105 1.00 . A A . 2 LYS HB3 1 1 7 2682 1 1 2 LYS HD2 H 12.692 9.926 0.412 1.00 . A A . 2 LYS HD2 1 1 7 2683 1 1 2 LYS HD3 H 11.830 9.948 1.952 1.00 . A A . 2 LYS HD3 1 1 7 2684 1 1 2 LYS HE2 H 13.854 9.195 3.120 1.00 . A A . 2 LYS HE2 1 1 7 2685 1 1 2 LYS HE3 H 14.727 9.096 1.591 1.00 . A A . 2 LYS HE3 1 1 7 2686 1 1 2 LYS HG2 H 12.226 7.497 2.189 1.00 . A A . 2 LYS HG2 1 1 7 2687 1 1 2 LYS HG3 H 13.039 7.498 0.624 1.00 . A A . 2 LYS HG3 1 1 7 2688 1 1 2 LYS HZ1 H 13.935 11.561 1.395 1.00 . A A . 2 LYS HZ1 1 1 7 2689 1 1 2 LYS HZ2 H 15.324 11.165 2.289 1.00 . A A . 2 LYS HZ2 1 1 7 2690 1 1 2 LYS HZ3 H 13.852 11.462 3.086 1.00 . A A . 2 LYS HZ3 1 1 7 2691 1 1 2 LYS N N 11.546 5.703 -0.564 1.00 . A A . 2 LYS N 1 1 7 2692 1 1 2 LYS NZ N 14.289 11.060 2.233 1.00 . A A . 2 LYS NZ 1 1 7 2693 1 1 2 LYS O O 8.937 6.271 -1.415 1.00 . A A . 2 LYS O 1 1 7 2694 1 1 3 PHE C C 6.259 7.078 -0.271 1.00 . A A . 3 PHE C 1 1 7 2695 1 1 3 PHE CA C 6.800 5.775 0.309 1.00 . A A . 3 PHE CA 1 1 7 2696 1 1 3 PHE CB C 5.973 5.374 1.540 1.00 . A A . 3 PHE CB 1 1 7 2697 1 1 3 PHE CD1 C 6.109 2.836 1.571 1.00 . A A . 3 PHE CD1 1 1 7 2698 1 1 3 PHE CD2 C 7.432 4.083 3.183 1.00 . A A . 3 PHE CD2 1 1 7 2699 1 1 3 PHE CE1 C 6.611 1.637 2.091 1.00 . A A . 3 PHE CE1 1 1 7 2700 1 1 3 PHE CE2 C 7.931 2.880 3.699 1.00 . A A . 3 PHE CE2 1 1 7 2701 1 1 3 PHE CG C 6.517 4.067 2.113 1.00 . A A . 3 PHE CG 1 1 7 2702 1 1 3 PHE CZ C 7.520 1.658 3.155 1.00 . A A . 3 PHE CZ 1 1 7 2703 1 1 3 PHE H H 8.449 5.878 1.639 1.00 . A A . 3 PHE H 1 1 7 2704 1 1 3 PHE HA H 6.717 4.997 -0.437 1.00 . A A . 3 PHE HA 1 1 7 2705 1 1 3 PHE HB2 H 6.025 6.163 2.284 1.00 . A A . 3 PHE HB2 1 1 7 2706 1 1 3 PHE HB3 H 4.938 5.236 1.248 1.00 . A A . 3 PHE HB3 1 1 7 2707 1 1 3 PHE HD1 H 5.407 2.813 0.752 1.00 . A A . 3 PHE HD1 1 1 7 2708 1 1 3 PHE HD2 H 7.752 5.024 3.606 1.00 . A A . 3 PHE HD2 1 1 7 2709 1 1 3 PHE HE1 H 6.294 0.693 1.673 1.00 . A A . 3 PHE HE1 1 1 7 2710 1 1 3 PHE HE2 H 8.632 2.896 4.520 1.00 . A A . 3 PHE HE2 1 1 7 2711 1 1 3 PHE HZ H 7.907 0.733 3.552 1.00 . A A . 3 PHE HZ 1 1 7 2712 1 1 3 PHE N N 8.203 5.938 0.691 1.00 . A A . 3 PHE N 1 1 7 2713 1 1 3 PHE O O 5.267 7.086 -1.003 1.00 . A A . 3 PHE O 1 1 7 2714 1 1 4 TYR C C 6.640 9.592 -1.912 1.00 . A A . 4 TYR C 1 1 7 2715 1 1 4 TYR CA C 6.531 9.498 -0.383 1.00 . A A . 4 TYR CA 1 1 7 2716 1 1 4 TYR CB C 7.424 10.537 0.369 1.00 . A A . 4 TYR CB 1 1 7 2717 1 1 4 TYR CD1 C 8.671 11.917 -1.347 1.00 . A A . 4 TYR CD1 1 1 7 2718 1 1 4 TYR CD2 C 6.744 12.912 -0.258 1.00 . A A . 4 TYR CD2 1 1 7 2719 1 1 4 TYR CE1 C 8.867 13.089 -2.080 1.00 . A A . 4 TYR CE1 1 1 7 2720 1 1 4 TYR CE2 C 6.939 14.087 -0.997 1.00 . A A . 4 TYR CE2 1 1 7 2721 1 1 4 TYR CG C 7.611 11.826 -0.432 1.00 . A A . 4 TYR CG 1 1 7 2722 1 1 4 TYR CZ C 8.001 14.177 -1.905 1.00 . A A . 4 TYR CZ 1 1 7 2723 1 1 4 TYR H H 7.698 8.098 0.660 1.00 . A A . 4 TYR H 1 1 7 2724 1 1 4 TYR HA H 5.498 9.666 -0.115 1.00 . A A . 4 TYR HA 1 1 7 2725 1 1 4 TYR HB2 H 6.974 10.775 1.328 1.00 . A A . 4 TYR HB2 1 1 7 2726 1 1 4 TYR HB3 H 8.396 10.092 0.559 1.00 . A A . 4 TYR HB3 1 1 7 2727 1 1 4 TYR HD1 H 9.337 11.072 -1.481 1.00 . A A . 4 TYR HD1 1 1 7 2728 1 1 4 TYR HD2 H 5.925 12.841 0.443 1.00 . A A . 4 TYR HD2 1 1 7 2729 1 1 4 TYR HE1 H 9.683 13.153 -2.782 1.00 . A A . 4 TYR HE1 1 1 7 2730 1 1 4 TYR HE2 H 6.272 14.926 -0.861 1.00 . A A . 4 TYR HE2 1 1 7 2731 1 1 4 TYR HH H 8.165 16.076 -2.009 1.00 . A A . 4 TYR HH 1 1 7 2732 1 1 4 TYR N N 6.918 8.175 0.075 1.00 . A A . 4 TYR N 1 1 7 2733 1 1 4 TYR O O 5.801 10.220 -2.561 1.00 . A A . 4 TYR O 1 1 7 2734 1 1 4 TYR OH O 8.197 15.339 -2.624 1.00 . A A . 4 TYR OH 1 1 7 2735 1 1 5 THR C C 6.706 8.386 -4.675 1.00 . A A . 5 THR C 1 1 7 2736 1 1 5 THR CA C 7.885 9.014 -3.923 1.00 . A A . 5 THR CA 1 1 7 2737 1 1 5 THR CB C 9.189 8.272 -4.264 1.00 . A A . 5 THR CB 1 1 7 2738 1 1 5 THR CG2 C 9.531 8.423 -5.755 1.00 . A A . 5 THR CG2 1 1 7 2739 1 1 5 THR H H 8.312 8.501 -1.915 1.00 . A A . 5 THR H 1 1 7 2740 1 1 5 THR HA H 7.982 10.047 -4.232 1.00 . A A . 5 THR HA 1 1 7 2741 1 1 5 THR HB H 9.079 7.224 -4.026 1.00 . A A . 5 THR HB 1 1 7 2742 1 1 5 THR HG1 H 11.026 8.279 -3.622 1.00 . A A . 5 THR HG1 1 1 7 2743 1 1 5 THR HG21 H 10.491 7.967 -5.948 1.00 . A A . 5 THR HG21 1 1 7 2744 1 1 5 THR HG22 H 9.574 9.471 -6.012 1.00 . A A . 5 THR HG22 1 1 7 2745 1 1 5 THR HG23 H 8.777 7.935 -6.354 1.00 . A A . 5 THR HG23 1 1 7 2746 1 1 5 THR N N 7.674 8.979 -2.477 1.00 . A A . 5 THR N 1 1 7 2747 1 1 5 THR O O 6.201 8.967 -5.634 1.00 . A A . 5 THR O 1 1 7 2748 1 1 5 THR OG1 O 10.243 8.816 -3.483 1.00 . A A . 5 THR OG1 1 1 7 2749 1 1 6 ILE C C 3.862 7.340 -4.666 1.00 . A A . 6 ILE C 1 1 7 2750 1 1 6 ILE CA C 5.137 6.529 -4.886 1.00 . A A . 6 ILE CA 1 1 7 2751 1 1 6 ILE CB C 4.961 5.079 -4.345 1.00 . A A . 6 ILE CB 1 1 7 2752 1 1 6 ILE CD1 C 7.063 4.167 -3.178 1.00 . A A . 6 ILE CD1 1 1 7 2753 1 1 6 ILE CG1 C 6.305 4.251 -4.510 1.00 . A A . 6 ILE CG1 1 1 7 2754 1 1 6 ILE CG2 C 3.807 4.377 -5.109 1.00 . A A . 6 ILE CG2 1 1 7 2755 1 1 6 ILE H H 6.696 6.788 -3.466 1.00 . A A . 6 ILE H 1 1 7 2756 1 1 6 ILE HA H 5.330 6.473 -5.950 1.00 . A A . 6 ILE HA 1 1 7 2757 1 1 6 ILE HB H 4.684 5.135 -3.295 1.00 . A A . 6 ILE HB 1 1 7 2758 1 1 6 ILE HD11 H 7.991 3.635 -3.322 1.00 . A A . 6 ILE HD11 1 1 7 2759 1 1 6 ILE HD12 H 6.455 3.644 -2.456 1.00 . A A . 6 ILE HD12 1 1 7 2760 1 1 6 ILE HD13 H 7.269 5.160 -2.821 1.00 . A A . 6 ILE HD13 1 1 7 2761 1 1 6 ILE HG12 H 6.087 3.240 -4.833 1.00 . A A . 6 ILE HG12 1 1 7 2762 1 1 6 ILE HG13 H 6.949 4.713 -5.248 1.00 . A A . 6 ILE HG13 1 1 7 2763 1 1 6 ILE HG21 H 3.748 3.344 -4.794 1.00 . A A . 6 ILE HG21 1 1 7 2764 1 1 6 ILE HG22 H 3.999 4.413 -6.174 1.00 . A A . 6 ILE HG22 1 1 7 2765 1 1 6 ILE HG23 H 2.867 4.866 -4.898 1.00 . A A . 6 ILE HG23 1 1 7 2766 1 1 6 ILE N N 6.266 7.204 -4.238 1.00 . A A . 6 ILE N 1 1 7 2767 1 1 6 ILE O O 3.051 7.503 -5.575 1.00 . A A . 6 ILE O 1 1 7 2768 1 1 7 LYS C C 2.387 9.855 -3.965 1.00 . A A . 7 LYS C 1 1 7 2769 1 1 7 LYS CA C 2.503 8.609 -3.092 1.00 . A A . 7 LYS CA 1 1 7 2770 1 1 7 LYS CB C 2.589 9.015 -1.607 1.00 . A A . 7 LYS CB 1 1 7 2771 1 1 7 LYS CD C 1.267 9.971 0.366 1.00 . A A . 7 LYS CD 1 1 7 2772 1 1 7 LYS CE C 2.387 10.908 0.861 1.00 . A A . 7 LYS CE 1 1 7 2773 1 1 7 LYS CG C 1.319 9.789 -1.175 1.00 . A A . 7 LYS CG 1 1 7 2774 1 1 7 LYS H H 4.363 7.654 -2.754 1.00 . A A . 7 LYS H 1 1 7 2775 1 1 7 LYS HA H 1.625 7.997 -3.234 1.00 . A A . 7 LYS HA 1 1 7 2776 1 1 7 LYS HB2 H 2.697 8.122 -1.006 1.00 . A A . 7 LYS HB2 1 1 7 2777 1 1 7 LYS HB3 H 3.459 9.641 -1.471 1.00 . A A . 7 LYS HB3 1 1 7 2778 1 1 7 LYS HD2 H 0.312 10.403 0.638 1.00 . A A . 7 LYS HD2 1 1 7 2779 1 1 7 LYS HD3 H 1.366 9.007 0.844 1.00 . A A . 7 LYS HD3 1 1 7 2780 1 1 7 LYS HE2 H 3.342 10.415 0.787 1.00 . A A . 7 LYS HE2 1 1 7 2781 1 1 7 LYS HE3 H 2.400 11.813 0.268 1.00 . A A . 7 LYS HE3 1 1 7 2782 1 1 7 LYS HG2 H 1.311 10.763 -1.645 1.00 . A A . 7 LYS HG2 1 1 7 2783 1 1 7 LYS HG3 H 0.446 9.244 -1.496 1.00 . A A . 7 LYS HG3 1 1 7 2784 1 1 7 LYS HZ1 H 2.226 12.295 2.402 1.00 . A A . 7 LYS HZ1 1 1 7 2785 1 1 7 LYS HZ2 H 2.824 10.784 2.894 1.00 . A A . 7 LYS HZ2 1 1 7 2786 1 1 7 LYS HZ3 H 1.172 10.976 2.552 1.00 . A A . 7 LYS HZ3 1 1 7 2787 1 1 7 LYS N N 3.687 7.829 -3.441 1.00 . A A . 7 LYS N 1 1 7 2788 1 1 7 LYS NZ N 2.133 11.267 2.285 1.00 . A A . 7 LYS NZ 1 1 7 2789 1 1 7 LYS O O 1.327 10.136 -4.523 1.00 . A A . 7 LYS O 1 1 7 2790 1 1 8 LEU C C 3.282 11.447 -6.340 1.00 . A A . 8 LEU C 1 1 7 2791 1 1 8 LEU CA C 3.484 11.824 -4.884 1.00 . A A . 8 LEU CA 1 1 7 2792 1 1 8 LEU CB C 4.819 12.580 -4.706 1.00 . A A . 8 LEU CB 1 1 7 2793 1 1 8 LEU CD1 C 3.702 14.916 -4.738 1.00 . A A . 8 LEU CD1 1 1 7 2794 1 1 8 LEU CD2 C 6.159 14.638 -5.302 1.00 . A A . 8 LEU CD2 1 1 7 2795 1 1 8 LEU CG C 4.770 13.980 -5.394 1.00 . A A . 8 LEU CG 1 1 7 2796 1 1 8 LEU H H 4.289 10.335 -3.613 1.00 . A A . 8 LEU H 1 1 7 2797 1 1 8 LEU HA H 2.666 12.450 -4.563 1.00 . A A . 8 LEU HA 1 1 7 2798 1 1 8 LEU HB2 H 5.018 12.697 -3.655 1.00 . A A . 8 LEU HB2 1 1 7 2799 1 1 8 LEU HB3 H 5.619 11.995 -5.146 1.00 . A A . 8 LEU HB3 1 1 7 2800 1 1 8 LEU HD11 H 2.748 14.746 -5.204 1.00 . A A . 8 LEU HD11 1 1 7 2801 1 1 8 LEU HD12 H 3.971 15.957 -4.880 1.00 . A A . 8 LEU HD12 1 1 7 2802 1 1 8 LEU HD13 H 3.624 14.715 -3.677 1.00 . A A . 8 LEU HD13 1 1 7 2803 1 1 8 LEU HD21 H 6.435 14.751 -4.264 1.00 . A A . 8 LEU HD21 1 1 7 2804 1 1 8 LEU HD22 H 6.125 15.608 -5.774 1.00 . A A . 8 LEU HD22 1 1 7 2805 1 1 8 LEU HD23 H 6.886 14.018 -5.804 1.00 . A A . 8 LEU HD23 1 1 7 2806 1 1 8 LEU HG H 4.520 13.850 -6.436 1.00 . A A . 8 LEU HG 1 1 7 2807 1 1 8 LEU N N 3.480 10.605 -4.076 1.00 . A A . 8 LEU N 1 1 7 2808 1 1 8 LEU O O 2.535 12.083 -7.071 1.00 . A A . 8 LEU O 1 1 7 2809 1 1 9 ALA C C 2.380 9.658 -8.476 1.00 . A A . 9 ALA C 1 1 7 2810 1 1 9 ALA CA C 3.849 9.917 -8.130 1.00 . A A . 9 ALA CA 1 1 7 2811 1 1 9 ALA CB C 4.664 8.634 -8.327 1.00 . A A . 9 ALA CB 1 1 7 2812 1 1 9 ALA H H 4.543 9.923 -6.123 1.00 . A A . 9 ALA H 1 1 7 2813 1 1 9 ALA HA H 4.236 10.681 -8.780 1.00 . A A . 9 ALA HA 1 1 7 2814 1 1 9 ALA HB1 H 4.285 7.864 -7.672 1.00 . A A . 9 ALA HB1 1 1 7 2815 1 1 9 ALA HB2 H 5.701 8.827 -8.095 1.00 . A A . 9 ALA HB2 1 1 7 2816 1 1 9 ALA HB3 H 4.580 8.306 -9.352 1.00 . A A . 9 ALA HB3 1 1 7 2817 1 1 9 ALA N N 3.960 10.388 -6.753 1.00 . A A . 9 ALA N 1 1 7 2818 1 1 9 ALA O O 1.930 9.931 -9.587 1.00 . A A . 9 ALA O 1 1 7 2819 1 1 10 LYS C C -0.549 10.182 -7.792 1.00 . A A . 10 LYS C 1 1 7 2820 1 1 10 LYS CA C 0.221 8.865 -7.636 1.00 . A A . 10 LYS CA 1 1 7 2821 1 1 10 LYS CB C -0.261 8.064 -6.391 1.00 . A A . 10 LYS CB 1 1 7 2822 1 1 10 LYS CD C -1.315 5.890 -7.361 1.00 . A A . 10 LYS CD 1 1 7 2823 1 1 10 LYS CE C -0.913 4.805 -6.334 1.00 . A A . 10 LYS CE 1 1 7 2824 1 1 10 LYS CG C -1.588 7.274 -6.666 1.00 . A A . 10 LYS CG 1 1 7 2825 1 1 10 LYS H H 2.076 8.973 -6.625 1.00 . A A . 10 LYS H 1 1 7 2826 1 1 10 LYS HA H 0.066 8.278 -8.529 1.00 . A A . 10 LYS HA 1 1 7 2827 1 1 10 LYS HB2 H 0.522 7.377 -6.108 1.00 . A A . 10 LYS HB2 1 1 7 2828 1 1 10 LYS HB3 H -0.417 8.750 -5.564 1.00 . A A . 10 LYS HB3 1 1 7 2829 1 1 10 LYS HD2 H -2.213 5.563 -7.868 1.00 . A A . 10 LYS HD2 1 1 7 2830 1 1 10 LYS HD3 H -0.525 5.991 -8.089 1.00 . A A . 10 LYS HD3 1 1 7 2831 1 1 10 LYS HE2 H -0.769 3.863 -6.844 1.00 . A A . 10 LYS HE2 1 1 7 2832 1 1 10 LYS HE3 H 0.008 5.083 -5.842 1.00 . A A . 10 LYS HE3 1 1 7 2833 1 1 10 LYS HG2 H -2.106 7.108 -5.728 1.00 . A A . 10 LYS HG2 1 1 7 2834 1 1 10 LYS HG3 H -2.230 7.872 -7.304 1.00 . A A . 10 LYS HG3 1 1 7 2835 1 1 10 LYS HZ1 H -2.224 3.644 -5.205 1.00 . A A . 10 LYS HZ1 1 1 7 2836 1 1 10 LYS HZ2 H -2.840 5.169 -5.633 1.00 . A A . 10 LYS HZ2 1 1 7 2837 1 1 10 LYS HZ3 H -1.671 5.036 -4.407 1.00 . A A . 10 LYS HZ3 1 1 7 2838 1 1 10 LYS N N 1.648 9.147 -7.488 1.00 . A A . 10 LYS N 1 1 7 2839 1 1 10 LYS NZ N -1.994 4.651 -5.318 1.00 . A A . 10 LYS NZ 1 1 7 2840 1 1 10 LYS O O -1.429 10.302 -8.643 1.00 . A A . 10 LYS O 1 1 7 2841 1 1 11 PHE C C -0.575 13.092 -8.419 1.00 . A A . 11 PHE C 1 1 7 2842 1 1 11 PHE CA C -0.807 12.497 -7.037 1.00 . A A . 11 PHE CA 1 1 7 2843 1 1 11 PHE CB C -0.182 13.399 -5.955 1.00 . A A . 11 PHE CB 1 1 7 2844 1 1 11 PHE CD1 C -2.116 15.002 -5.633 1.00 . A A . 11 PHE CD1 1 1 7 2845 1 1 11 PHE CD2 C 0.017 15.923 -6.359 1.00 . A A . 11 PHE CD2 1 1 7 2846 1 1 11 PHE CE1 C -2.669 16.288 -5.643 1.00 . A A . 11 PHE CE1 1 1 7 2847 1 1 11 PHE CE2 C -0.543 17.206 -6.362 1.00 . A A . 11 PHE CE2 1 1 7 2848 1 1 11 PHE CG C -0.774 14.807 -5.989 1.00 . A A . 11 PHE CG 1 1 7 2849 1 1 11 PHE CZ C -1.884 17.387 -6.005 1.00 . A A . 11 PHE CZ 1 1 7 2850 1 1 11 PHE H H 0.548 11.023 -6.335 1.00 . A A . 11 PHE H 1 1 7 2851 1 1 11 PHE HA H -1.868 12.401 -6.857 1.00 . A A . 11 PHE HA 1 1 7 2852 1 1 11 PHE HB2 H -0.374 12.962 -4.994 1.00 . A A . 11 PHE HB2 1 1 7 2853 1 1 11 PHE HB3 H 0.878 13.442 -6.101 1.00 . A A . 11 PHE HB3 1 1 7 2854 1 1 11 PHE HD1 H -2.729 14.157 -5.353 1.00 . A A . 11 PHE HD1 1 1 7 2855 1 1 11 PHE HD2 H 1.057 15.791 -6.644 1.00 . A A . 11 PHE HD2 1 1 7 2856 1 1 11 PHE HE1 H -3.704 16.431 -5.369 1.00 . A A . 11 PHE HE1 1 1 7 2857 1 1 11 PHE HE2 H 0.059 18.056 -6.644 1.00 . A A . 11 PHE HE2 1 1 7 2858 1 1 11 PHE HZ H -2.314 18.377 -6.008 1.00 . A A . 11 PHE HZ 1 1 7 2859 1 1 11 PHE N N -0.179 11.176 -6.974 1.00 . A A . 11 PHE N 1 1 7 2860 1 1 11 PHE O O -1.503 13.555 -9.076 1.00 . A A . 11 PHE O 1 1 7 2861 1 1 12 LEU C C 0.382 12.687 -11.245 1.00 . A A . 12 LEU C 1 1 7 2862 1 1 12 LEU CA C 1.062 13.532 -10.170 1.00 . A A . 12 LEU CA 1 1 7 2863 1 1 12 LEU CB C 2.592 13.439 -10.340 1.00 . A A . 12 LEU CB 1 1 7 2864 1 1 12 LEU CD1 C 4.847 14.062 -9.398 1.00 . A A . 12 LEU CD1 1 1 7 2865 1 1 12 LEU CD2 C 3.068 15.853 -9.590 1.00 . A A . 12 LEU CD2 1 1 7 2866 1 1 12 LEU CG C 3.333 14.345 -9.318 1.00 . A A . 12 LEU CG 1 1 7 2867 1 1 12 LEU H H 1.357 12.631 -8.269 1.00 . A A . 12 LEU H 1 1 7 2868 1 1 12 LEU HA H 0.743 14.552 -10.289 1.00 . A A . 12 LEU HA 1 1 7 2869 1 1 12 LEU HB2 H 2.890 12.411 -10.188 1.00 . A A . 12 LEU HB2 1 1 7 2870 1 1 12 LEU HB3 H 2.864 13.739 -11.345 1.00 . A A . 12 LEU HB3 1 1 7 2871 1 1 12 LEU HD11 H 5.199 14.268 -10.399 1.00 . A A . 12 LEU HD11 1 1 7 2872 1 1 12 LEU HD12 H 5.032 13.025 -9.157 1.00 . A A . 12 LEU HD12 1 1 7 2873 1 1 12 LEU HD13 H 5.371 14.693 -8.695 1.00 . A A . 12 LEU HD13 1 1 7 2874 1 1 12 LEU HD21 H 2.093 16.122 -9.216 1.00 . A A . 12 LEU HD21 1 1 7 2875 1 1 12 LEU HD22 H 3.118 16.060 -10.648 1.00 . A A . 12 LEU HD22 1 1 7 2876 1 1 12 LEU HD23 H 3.810 16.455 -9.078 1.00 . A A . 12 LEU HD23 1 1 7 2877 1 1 12 LEU HG H 2.989 14.104 -8.325 1.00 . A A . 12 LEU HG 1 1 7 2878 1 1 12 LEU N N 0.677 13.036 -8.850 1.00 . A A . 12 LEU N 1 1 7 2879 1 1 12 LEU O O -0.080 13.209 -12.252 1.00 . A A . 12 LEU O 1 1 7 2880 1 1 13 GLY C C -1.748 10.761 -12.177 1.00 . A A . 13 GLY C 1 1 7 2881 1 1 13 GLY CA C -0.270 10.451 -11.969 1.00 . A A . 13 GLY CA 1 1 7 2882 1 1 13 GLY H H 0.734 11.024 -10.194 1.00 . A A . 13 GLY H 1 1 7 2883 1 1 13 GLY HA2 H 0.246 10.527 -12.911 1.00 . A A . 13 GLY HA2 1 1 7 2884 1 1 13 GLY HA3 H -0.170 9.454 -11.600 1.00 . A A . 13 GLY HA3 1 1 7 2885 1 1 13 GLY N N 0.340 11.377 -11.018 1.00 . A A . 13 GLY N 1 1 7 2886 1 1 13 GLY O O -2.332 10.409 -13.198 1.00 . A A . 13 GLY O 1 1 7 2887 1 1 14 GLY C C -3.889 13.011 -12.233 1.00 . A A . 14 GLY C 1 1 7 2888 1 1 14 GLY CA C -3.771 11.800 -11.317 1.00 . A A . 14 GLY CA 1 1 7 2889 1 1 14 GLY H H -1.851 11.686 -10.409 1.00 . A A . 14 GLY H 1 1 7 2890 1 1 14 GLY HA2 H -4.354 10.976 -11.719 1.00 . A A . 14 GLY HA2 1 1 7 2891 1 1 14 GLY HA3 H -4.148 12.061 -10.342 1.00 . A A . 14 GLY HA3 1 1 7 2892 1 1 14 GLY N N -2.359 11.426 -11.205 1.00 . A A . 14 GLY N 1 1 7 2893 1 1 14 GLY O O -4.755 13.082 -13.106 1.00 . A A . 14 GLY O 1 1 7 2894 1 1 15 ILE C C -2.394 14.981 -14.172 1.00 . A A . 15 ILE C 1 1 7 2895 1 1 15 ILE CA C -2.924 15.214 -12.761 1.00 . A A . 15 ILE CA 1 1 7 2896 1 1 15 ILE CB C -2.006 16.217 -12.015 1.00 . A A . 15 ILE CB 1 1 7 2897 1 1 15 ILE CD1 C -1.461 17.182 -9.740 1.00 . A A . 15 ILE CD1 1 1 7 2898 1 1 15 ILE CG1 C -2.508 16.414 -10.556 1.00 . A A . 15 ILE CG1 1 1 7 2899 1 1 15 ILE CG2 C -1.997 17.585 -12.739 1.00 . A A . 15 ILE CG2 1 1 7 2900 1 1 15 ILE H H -2.336 13.825 -11.291 1.00 . A A . 15 ILE H 1 1 7 2901 1 1 15 ILE HA H -3.919 15.637 -12.835 1.00 . A A . 15 ILE HA 1 1 7 2902 1 1 15 ILE HB H -0.997 15.817 -12.000 1.00 . A A . 15 ILE HB 1 1 7 2903 1 1 15 ILE HD11 H -1.828 17.326 -8.740 1.00 . A A . 15 ILE HD11 1 1 7 2904 1 1 15 ILE HD12 H -1.276 18.140 -10.197 1.00 . A A . 15 ILE HD12 1 1 7 2905 1 1 15 ILE HD13 H -0.543 16.610 -9.712 1.00 . A A . 15 ILE HD13 1 1 7 2906 1 1 15 ILE HG12 H -3.437 16.970 -10.557 1.00 . A A . 15 ILE HG12 1 1 7 2907 1 1 15 ILE HG13 H -2.674 15.458 -10.086 1.00 . A A . 15 ILE HG13 1 1 7 2908 1 1 15 ILE HG21 H -1.364 18.276 -12.196 1.00 . A A . 15 ILE HG21 1 1 7 2909 1 1 15 ILE HG22 H -3.000 17.978 -12.774 1.00 . A A . 15 ILE HG22 1 1 7 2910 1 1 15 ILE HG23 H -1.615 17.477 -13.740 1.00 . A A . 15 ILE HG23 1 1 7 2911 1 1 15 ILE N N -2.989 13.965 -12.002 1.00 . A A . 15 ILE N 1 1 7 2912 1 1 15 ILE O O -2.858 15.602 -15.125 1.00 . A A . 15 ILE O 1 1 7 2913 1 1 16 VAL C C -1.847 13.480 -16.618 1.00 . A A . 16 VAL C 1 1 7 2914 1 1 16 VAL CA C -0.764 13.894 -15.614 1.00 . A A . 16 VAL CA 1 1 7 2915 1 1 16 VAL CB C 0.384 12.823 -15.484 1.00 . A A . 16 VAL CB 1 1 7 2916 1 1 16 VAL CG1 C -0.154 11.377 -15.574 1.00 . A A . 16 VAL CG1 1 1 7 2917 1 1 16 VAL CG2 C 1.456 13.023 -16.578 1.00 . A A . 16 VAL CG2 1 1 7 2918 1 1 16 VAL H H -1.006 13.685 -13.509 1.00 . A A . 16 VAL H 1 1 7 2919 1 1 16 VAL HA H -0.339 14.833 -15.944 1.00 . A A . 16 VAL HA 1 1 7 2920 1 1 16 VAL HB H 0.853 12.944 -14.512 1.00 . A A . 16 VAL HB 1 1 7 2921 1 1 16 VAL HG11 H 0.633 10.678 -15.322 1.00 . A A . 16 VAL HG11 1 1 7 2922 1 1 16 VAL HG12 H -0.504 11.167 -16.576 1.00 . A A . 16 VAL HG12 1 1 7 2923 1 1 16 VAL HG13 H -0.963 11.264 -14.886 1.00 . A A . 16 VAL HG13 1 1 7 2924 1 1 16 VAL HG21 H 2.234 12.280 -16.462 1.00 . A A . 16 VAL HG21 1 1 7 2925 1 1 16 VAL HG22 H 1.889 14.008 -16.488 1.00 . A A . 16 VAL HG22 1 1 7 2926 1 1 16 VAL HG23 H 0.998 12.917 -17.551 1.00 . A A . 16 VAL HG23 1 1 7 2927 1 1 16 VAL N N -1.373 14.128 -14.302 1.00 . A A . 16 VAL N 1 1 7 2928 1 1 16 VAL O O -1.963 14.048 -17.695 1.00 . A A . 16 VAL O 1 1 7 2929 1 1 17 ARG C C -4.739 13.204 -17.313 1.00 . A A . 17 ARG C 1 1 7 2930 1 1 17 ARG CA C -3.762 12.058 -17.057 1.00 . A A . 17 ARG CA 1 1 7 2931 1 1 17 ARG CB C -4.459 10.885 -16.352 1.00 . A A . 17 ARG CB 1 1 7 2932 1 1 17 ARG CD C -5.334 9.958 -18.580 1.00 . A A . 17 ARG CD 1 1 7 2933 1 1 17 ARG CG C -5.696 10.368 -17.133 1.00 . A A . 17 ARG CG 1 1 7 2934 1 1 17 ARG CZ C -6.671 7.910 -18.800 1.00 . A A . 17 ARG CZ 1 1 7 2935 1 1 17 ARG H H -2.557 12.128 -15.332 1.00 . A A . 17 ARG H 1 1 7 2936 1 1 17 ARG HA H -3.354 11.720 -17.998 1.00 . A A . 17 ARG HA 1 1 7 2937 1 1 17 ARG HB2 H -3.750 10.076 -16.232 1.00 . A A . 17 ARG HB2 1 1 7 2938 1 1 17 ARG HB3 H -4.773 11.220 -15.377 1.00 . A A . 17 ARG HB3 1 1 7 2939 1 1 17 ARG HD2 H -5.192 10.844 -19.185 1.00 . A A . 17 ARG HD2 1 1 7 2940 1 1 17 ARG HD3 H -4.418 9.375 -18.582 1.00 . A A . 17 ARG HD3 1 1 7 2941 1 1 17 ARG HE H -6.983 9.583 -19.861 1.00 . A A . 17 ARG HE 1 1 7 2942 1 1 17 ARG HG2 H -6.088 9.507 -16.616 1.00 . A A . 17 ARG HG2 1 1 7 2943 1 1 17 ARG HG3 H -6.460 11.132 -17.155 1.00 . A A . 17 ARG HG3 1 1 7 2944 1 1 17 ARG HH11 H -5.178 7.825 -17.466 1.00 . A A . 17 ARG HH11 1 1 7 2945 1 1 17 ARG HH12 H -6.128 6.385 -17.619 1.00 . A A . 17 ARG HH12 1 1 7 2946 1 1 17 ARG HH21 H -8.201 7.702 -20.068 1.00 . A A . 17 ARG HH21 1 1 7 2947 1 1 17 ARG HH22 H -7.846 6.315 -19.093 1.00 . A A . 17 ARG HH22 1 1 7 2948 1 1 17 ARG N N -2.670 12.521 -16.221 1.00 . A A . 17 ARG N 1 1 7 2949 1 1 17 ARG NE N -6.421 9.171 -19.170 1.00 . A A . 17 ARG NE 1 1 7 2950 1 1 17 ARG NH1 N -5.935 7.328 -17.891 1.00 . A A . 17 ARG NH1 1 1 7 2951 1 1 17 ARG NH2 N -7.648 7.257 -19.364 1.00 . A A . 17 ARG NH2 1 1 7 2952 1 1 17 ARG O O -5.273 13.334 -18.411 1.00 . A A . 17 ARG O 1 1 7 2953 1 1 18 ALA C C -5.389 16.126 -17.513 1.00 . A A . 18 ALA C 1 1 7 2954 1 1 18 ALA CA C -5.888 15.164 -16.428 1.00 . A A . 18 ALA CA 1 1 7 2955 1 1 18 ALA CB C -6.032 15.909 -15.084 1.00 . A A . 18 ALA CB 1 1 7 2956 1 1 18 ALA H H -4.518 13.883 -15.432 1.00 . A A . 18 ALA H 1 1 7 2957 1 1 18 ALA HA H -6.854 14.785 -16.711 1.00 . A A . 18 ALA HA 1 1 7 2958 1 1 18 ALA HB1 H -5.121 16.445 -14.856 1.00 . A A . 18 ALA HB1 1 1 7 2959 1 1 18 ALA HB2 H -6.228 15.195 -14.299 1.00 . A A . 18 ALA HB2 1 1 7 2960 1 1 18 ALA HB3 H -6.854 16.612 -15.141 1.00 . A A . 18 ALA HB3 1 1 7 2961 1 1 18 ALA N N -4.971 14.034 -16.287 1.00 . A A . 18 ALA N 1 1 7 2962 1 1 18 ALA O O -6.168 16.613 -18.331 1.00 . A A . 18 ALA O 1 1 7 2963 1 1 19 MET C C -3.552 16.701 -19.887 1.00 . A A . 19 MET C 1 1 7 2964 1 1 19 MET CA C -3.461 17.280 -18.474 1.00 . A A . 19 MET CA 1 1 7 2965 1 1 19 MET CB C -1.982 17.442 -18.082 1.00 . A A . 19 MET CB 1 1 7 2966 1 1 19 MET CE C 0.364 19.883 -17.519 1.00 . A A . 19 MET CE 1 1 7 2967 1 1 19 MET CG C -1.842 18.358 -16.856 1.00 . A A . 19 MET CG 1 1 7 2968 1 1 19 MET H H -3.514 15.969 -16.836 1.00 . A A . 19 MET H 1 1 7 2969 1 1 19 MET HA H -3.954 18.241 -18.455 1.00 . A A . 19 MET HA 1 1 7 2970 1 1 19 MET HB2 H -1.575 16.471 -17.841 1.00 . A A . 19 MET HB2 1 1 7 2971 1 1 19 MET HB3 H -1.435 17.850 -18.901 1.00 . A A . 19 MET HB3 1 1 7 2972 1 1 19 MET HE1 H 0.275 19.555 -18.544 1.00 . A A . 19 MET HE1 1 1 7 2973 1 1 19 MET HE2 H 1.383 20.179 -17.330 1.00 . A A . 19 MET HE2 1 1 7 2974 1 1 19 MET HE3 H -0.289 20.727 -17.346 1.00 . A A . 19 MET HE3 1 1 7 2975 1 1 19 MET HG2 H -2.258 19.328 -17.080 1.00 . A A . 19 MET HG2 1 1 7 2976 1 1 19 MET HG3 H -2.384 17.924 -16.029 1.00 . A A . 19 MET HG3 1 1 7 2977 1 1 19 MET N N -4.081 16.387 -17.506 1.00 . A A . 19 MET N 1 1 7 2978 1 1 19 MET O O -4.063 17.344 -20.804 1.00 . A A . 19 MET O 1 1 7 2979 1 1 19 MET SD S -0.089 18.525 -16.403 1.00 . A A . 19 MET SD 1 1 7 2980 1 1 20 LEU C C -4.521 14.590 -21.756 1.00 . A A . 20 LEU C 1 1 7 2981 1 1 20 LEU CA C -3.065 14.801 -21.344 1.00 . A A . 20 LEU CA 1 1 7 2982 1 1 20 LEU CB C -2.327 13.427 -21.252 1.00 . A A . 20 LEU CB 1 1 7 2983 1 1 20 LEU CD1 C -0.384 14.057 -22.839 1.00 . A A . 20 LEU CD1 1 1 7 2984 1 1 20 LEU CD2 C -0.160 14.419 -20.339 1.00 . A A . 20 LEU CD2 1 1 7 2985 1 1 20 LEU CG C -0.777 13.532 -21.433 1.00 . A A . 20 LEU CG 1 1 7 2986 1 1 20 LEU H H -2.646 15.031 -19.271 1.00 . A A . 20 LEU H 1 1 7 2987 1 1 20 LEU HA H -2.593 15.427 -22.080 1.00 . A A . 20 LEU HA 1 1 7 2988 1 1 20 LEU HB2 H -2.527 13.001 -20.282 1.00 . A A . 20 LEU HB2 1 1 7 2989 1 1 20 LEU HB3 H -2.716 12.756 -22.008 1.00 . A A . 20 LEU HB3 1 1 7 2990 1 1 20 LEU HD11 H -1.065 13.671 -23.586 1.00 . A A . 20 LEU HD11 1 1 7 2991 1 1 20 LEU HD12 H 0.614 13.719 -23.069 1.00 . A A . 20 LEU HD12 1 1 7 2992 1 1 20 LEU HD13 H -0.398 15.139 -22.863 1.00 . A A . 20 LEU HD13 1 1 7 2993 1 1 20 LEU HD21 H 0.910 14.479 -20.484 1.00 . A A . 20 LEU HD21 1 1 7 2994 1 1 20 LEU HD22 H -0.358 13.987 -19.377 1.00 . A A . 20 LEU HD22 1 1 7 2995 1 1 20 LEU HD23 H -0.581 15.408 -20.388 1.00 . A A . 20 LEU HD23 1 1 7 2996 1 1 20 LEU HG H -0.366 12.535 -21.330 1.00 . A A . 20 LEU HG 1 1 7 2997 1 1 20 LEU N N -3.044 15.480 -20.045 1.00 . A A . 20 LEU N 1 1 7 2998 1 1 20 LEU O O -4.889 14.737 -22.919 1.00 . A A . 20 LEU O 1 1 7 2999 1 1 21 GLY C C -7.422 15.326 -21.438 1.00 . A A . 21 GLY C 1 1 7 3000 1 1 21 GLY CA C -6.758 14.029 -21.001 1.00 . A A . 21 GLY CA 1 1 7 3001 1 1 21 GLY H H -4.970 14.167 -19.868 1.00 . A A . 21 GLY H 1 1 7 3002 1 1 21 GLY HA2 H -6.890 13.275 -21.767 1.00 . A A . 21 GLY HA2 1 1 7 3003 1 1 21 GLY HA3 H -7.217 13.692 -20.084 1.00 . A A . 21 GLY HA3 1 1 7 3004 1 1 21 GLY N N -5.335 14.252 -20.773 1.00 . A A . 21 GLY N 1 1 7 3005 1 1 21 GLY O O -8.420 15.322 -22.158 1.00 . A A . 21 GLY O 1 1 7 3006 1 1 22 SER C C -6.753 18.327 -22.574 1.00 . A A . 22 SER C 1 1 7 3007 1 1 22 SER CA C -7.362 17.786 -21.274 1.00 . A A . 22 SER CA 1 1 7 3008 1 1 22 SER CB C -7.030 18.718 -20.097 1.00 . A A . 22 SER CB 1 1 7 3009 1 1 22 SER H H -6.059 16.356 -20.394 1.00 . A A . 22 SER H 1 1 7 3010 1 1 22 SER HA H -8.440 17.755 -21.385 1.00 . A A . 22 SER HA 1 1 7 3011 1 1 22 SER HB2 H -5.984 18.624 -19.842 1.00 . A A . 22 SER HB2 1 1 7 3012 1 1 22 SER HB3 H -7.247 19.747 -20.361 1.00 . A A . 22 SER HB3 1 1 7 3013 1 1 22 SER HG H -8.701 18.130 -19.294 1.00 . A A . 22 SER HG 1 1 7 3014 1 1 22 SER N N -6.851 16.442 -20.970 1.00 . A A . 22 SER N 1 1 7 3015 1 1 22 SER O O -7.253 19.295 -23.145 1.00 . A A . 22 SER O 1 1 7 3016 1 1 22 SER OG O -7.816 18.331 -18.977 1.00 . A A . 22 SER OG 1 1 7 3017 1 1 23 PHE C C -5.959 17.972 -25.466 1.00 . A A . 23 PHE C 1 1 7 3018 1 1 23 PHE CA C -5.010 18.119 -24.274 1.00 . A A . 23 PHE CA 1 1 7 3019 1 1 23 PHE CB C -3.738 17.285 -24.508 1.00 . A A . 23 PHE CB 1 1 7 3020 1 1 23 PHE CD1 C -2.080 18.827 -25.667 1.00 . A A . 23 PHE CD1 1 1 7 3021 1 1 23 PHE CD2 C -3.256 17.182 -27.010 1.00 . A A . 23 PHE CD2 1 1 7 3022 1 1 23 PHE CE1 C -1.412 19.280 -26.811 1.00 . A A . 23 PHE CE1 1 1 7 3023 1 1 23 PHE CE2 C -2.585 17.638 -28.153 1.00 . A A . 23 PHE CE2 1 1 7 3024 1 1 23 PHE CG C -3.005 17.776 -25.760 1.00 . A A . 23 PHE CG 1 1 7 3025 1 1 23 PHE CZ C -1.664 18.685 -28.053 1.00 . A A . 23 PHE CZ 1 1 7 3026 1 1 23 PHE H H -5.318 16.926 -22.542 1.00 . A A . 23 PHE H 1 1 7 3027 1 1 23 PHE HA H -4.729 19.160 -24.178 1.00 . A A . 23 PHE HA 1 1 7 3028 1 1 23 PHE HB2 H -3.090 17.380 -23.647 1.00 . A A . 23 PHE HB2 1 1 7 3029 1 1 23 PHE HB3 H -4.008 16.247 -24.629 1.00 . A A . 23 PHE HB3 1 1 7 3030 1 1 23 PHE HD1 H -1.882 19.288 -24.711 1.00 . A A . 23 PHE HD1 1 1 7 3031 1 1 23 PHE HD2 H -3.966 16.373 -27.091 1.00 . A A . 23 PHE HD2 1 1 7 3032 1 1 23 PHE HE1 H -0.699 20.088 -26.734 1.00 . A A . 23 PHE HE1 1 1 7 3033 1 1 23 PHE HE2 H -2.779 17.181 -29.111 1.00 . A A . 23 PHE HE2 1 1 7 3034 1 1 23 PHE HZ H -1.148 19.038 -28.933 1.00 . A A . 23 PHE HZ 1 1 7 3035 1 1 23 PHE N N -5.673 17.695 -23.037 1.00 . A A . 23 PHE N 1 1 7 3036 1 1 23 PHE O O -6.009 18.837 -26.341 1.00 . A A . 23 PHE O 1 1 7 3037 1 1 24 ARG C C -8.442 17.771 -27.022 1.00 . A A . 24 ARG C 1 1 7 3038 1 1 24 ARG CA C -7.626 16.540 -26.585 1.00 . A A . 24 ARG CA 1 1 7 3039 1 1 24 ARG CB C -8.593 15.440 -26.115 1.00 . A A . 24 ARG CB 1 1 7 3040 1 1 24 ARG CD C -8.777 13.066 -25.305 1.00 . A A . 24 ARG CD 1 1 7 3041 1 1 24 ARG CG C -7.812 14.161 -25.779 1.00 . A A . 24 ARG CG 1 1 7 3042 1 1 24 ARG CZ C -7.502 11.031 -25.826 1.00 . A A . 24 ARG CZ 1 1 7 3043 1 1 24 ARG H H -6.577 16.199 -24.774 1.00 . A A . 24 ARG H 1 1 7 3044 1 1 24 ARG HA H -7.067 16.171 -27.435 1.00 . A A . 24 ARG HA 1 1 7 3045 1 1 24 ARG HB2 H -9.116 15.783 -25.233 1.00 . A A . 24 ARG HB2 1 1 7 3046 1 1 24 ARG HB3 H -9.312 15.224 -26.895 1.00 . A A . 24 ARG HB3 1 1 7 3047 1 1 24 ARG HD2 H -9.330 13.424 -24.448 1.00 . A A . 24 ARG HD2 1 1 7 3048 1 1 24 ARG HD3 H -9.471 12.830 -26.102 1.00 . A A . 24 ARG HD3 1 1 7 3049 1 1 24 ARG HE H -7.895 11.675 -23.967 1.00 . A A . 24 ARG HE 1 1 7 3050 1 1 24 ARG HG2 H -7.284 13.820 -26.658 1.00 . A A . 24 ARG HG2 1 1 7 3051 1 1 24 ARG HG3 H -7.100 14.372 -24.994 1.00 . A A . 24 ARG HG3 1 1 7 3052 1 1 24 ARG HH11 H -8.209 12.037 -27.407 1.00 . A A . 24 ARG HH11 1 1 7 3053 1 1 24 ARG HH12 H -7.283 10.619 -27.775 1.00 . A A . 24 ARG HH12 1 1 7 3054 1 1 24 ARG HH21 H -6.682 9.825 -24.453 1.00 . A A . 24 ARG HH21 1 1 7 3055 1 1 24 ARG HH22 H -6.429 9.363 -26.103 1.00 . A A . 24 ARG HH22 1 1 7 3056 1 1 24 ARG N N -6.687 16.851 -25.497 1.00 . A A . 24 ARG N 1 1 7 3057 1 1 24 ARG NE N -8.027 11.866 -24.920 1.00 . A A . 24 ARG NE 1 1 7 3058 1 1 24 ARG NH1 N -7.679 11.245 -27.101 1.00 . A A . 24 ARG NH1 1 1 7 3059 1 1 24 ARG NH2 N -6.817 9.993 -25.430 1.00 . A A . 24 ARG NH2 1 1 7 3060 1 1 24 ARG O O -9.385 18.175 -26.341 1.00 . A A . 24 ARG O 1 1 7 3061 1 1 25 LYS C C -10.219 19.143 -29.041 1.00 . A A . 25 LYS C 1 1 7 3062 1 1 25 LYS CA C -8.778 19.513 -28.700 1.00 . A A . 25 LYS CA 1 1 7 3063 1 1 25 LYS CB C -8.038 20.029 -29.948 1.00 . A A . 25 LYS CB 1 1 7 3064 1 1 25 LYS CD C -7.884 21.863 -31.665 1.00 . A A . 25 LYS CD 1 1 7 3065 1 1 25 LYS CE C -8.526 23.156 -32.183 1.00 . A A . 25 LYS CE 1 1 7 3066 1 1 25 LYS CG C -8.688 21.324 -30.474 1.00 . A A . 25 LYS CG 1 1 7 3067 1 1 25 LYS H H -7.322 17.972 -28.670 1.00 . A A . 25 LYS H 1 1 7 3068 1 1 25 LYS HA H -8.788 20.295 -27.952 1.00 . A A . 25 LYS HA 1 1 7 3069 1 1 25 LYS HB2 H -7.008 20.227 -29.684 1.00 . A A . 25 LYS HB2 1 1 7 3070 1 1 25 LYS HB3 H -8.068 19.273 -30.721 1.00 . A A . 25 LYS HB3 1 1 7 3071 1 1 25 LYS HD2 H -6.871 22.071 -31.350 1.00 . A A . 25 LYS HD2 1 1 7 3072 1 1 25 LYS HD3 H -7.872 21.128 -32.456 1.00 . A A . 25 LYS HD3 1 1 7 3073 1 1 25 LYS HE2 H -9.541 22.955 -32.496 1.00 . A A . 25 LYS HE2 1 1 7 3074 1 1 25 LYS HE3 H -8.532 23.897 -31.398 1.00 . A A . 25 LYS HE3 1 1 7 3075 1 1 25 LYS HG2 H -9.700 21.119 -30.791 1.00 . A A . 25 LYS HG2 1 1 7 3076 1 1 25 LYS HG3 H -8.701 22.064 -29.685 1.00 . A A . 25 LYS HG3 1 1 7 3077 1 1 25 LYS HZ1 H -8.374 24.173 -33.995 1.00 . A A . 25 LYS HZ1 1 1 7 3078 1 1 25 LYS HZ2 H -7.300 22.867 -33.841 1.00 . A A . 25 LYS HZ2 1 1 7 3079 1 1 25 LYS HZ3 H -7.004 24.317 -33.007 1.00 . A A . 25 LYS HZ3 1 1 7 3080 1 1 25 LYS N N -8.074 18.347 -28.167 1.00 . A A . 25 LYS N 1 1 7 3081 1 1 25 LYS NZ N -7.741 23.667 -33.344 1.00 . A A . 25 LYS NZ 1 1 7 3082 1 1 25 LYS O O -11.155 19.870 -28.706 1.00 . A A . 25 LYS O 1 1 7 3083 1 1 26 ASP C C -12.426 16.913 -28.872 1.00 . A A . 26 ASP C 1 1 7 3084 1 1 26 ASP CA C -11.728 17.523 -30.086 1.00 . A A . 26 ASP CA 1 1 7 3085 1 1 26 ASP CB C -11.607 16.468 -31.201 1.00 . A A . 26 ASP CB 1 1 7 3086 1 1 26 ASP CG C -11.026 17.089 -32.475 1.00 . A A . 26 ASP CG 1 1 7 3087 1 1 26 ASP H H -9.610 17.459 -29.940 1.00 . A A . 26 ASP H 1 1 7 3088 1 1 26 ASP HA H -12.326 18.353 -30.452 1.00 . A A . 26 ASP HA 1 1 7 3089 1 1 26 ASP HB2 H -10.957 15.672 -30.868 1.00 . A A . 26 ASP HB2 1 1 7 3090 1 1 26 ASP HB3 H -12.585 16.061 -31.422 1.00 . A A . 26 ASP HB3 1 1 7 3091 1 1 26 ASP N N -10.394 17.999 -29.706 1.00 . A A . 26 ASP N 1 1 7 3092 1 1 26 ASP O O -12.051 15.817 -28.486 1.00 . A A . 26 ASP O 1 1 7 3093 1 1 26 ASP OD1 O -11.126 18.296 -32.629 1.00 . A A . 26 ASP OD1 1 1 7 3094 1 1 26 ASP OD2 O -10.489 16.343 -33.277 1.00 . A A . 26 ASP OD2 1 1 8 3095 1 1 1 MET C C 11.480 4.459 -1.804 1.00 . A A . 1 MET C 1 1 8 3096 1 1 1 MET CA C 11.989 3.707 -3.031 1.00 . A A . 1 MET CA 1 1 8 3097 1 1 1 MET CB C 11.296 4.231 -4.299 1.00 . A A . 1 MET CB 1 1 8 3098 1 1 1 MET CE C 9.420 3.543 -6.847 1.00 . A A . 1 MET CE 1 1 8 3099 1 1 1 MET CG C 11.866 3.526 -5.538 1.00 . A A . 1 MET CG 1 1 8 3100 1 1 1 MET H1 H 12.204 1.880 -2.055 1.00 . A A . 1 MET H1 1 1 8 3101 1 1 1 MET H2 H 11.964 1.746 -3.732 1.00 . A A . 1 MET H2 1 1 8 3102 1 1 1 MET H3 H 10.662 2.136 -2.712 1.00 . A A . 1 MET H3 1 1 8 3103 1 1 1 MET HA H 13.058 3.844 -3.117 1.00 . A A . 1 MET HA 1 1 8 3104 1 1 1 MET HB2 H 10.237 4.038 -4.230 1.00 . A A . 1 MET HB2 1 1 8 3105 1 1 1 MET HB3 H 11.460 5.296 -4.390 1.00 . A A . 1 MET HB3 1 1 8 3106 1 1 1 MET HE1 H 8.953 3.473 -7.819 1.00 . A A . 1 MET HE1 1 1 8 3107 1 1 1 MET HE2 H 8.841 4.203 -6.223 1.00 . A A . 1 MET HE2 1 1 8 3108 1 1 1 MET HE3 H 9.458 2.563 -6.392 1.00 . A A . 1 MET HE3 1 1 8 3109 1 1 1 MET HG2 H 12.934 3.686 -5.583 1.00 . A A . 1 MET HG2 1 1 8 3110 1 1 1 MET HG3 H 11.669 2.467 -5.474 1.00 . A A . 1 MET HG3 1 1 8 3111 1 1 1 MET N N 11.683 2.258 -2.871 1.00 . A A . 1 MET N 1 1 8 3112 1 1 1 MET O O 10.939 3.855 -0.877 1.00 . A A . 1 MET O 1 1 8 3113 1 1 1 MET SD S 11.102 4.204 -7.042 1.00 . A A . 1 MET SD 1 1 8 3114 1 1 2 LYS C C 9.685 6.637 -0.632 1.00 . A A . 2 LYS C 1 1 8 3115 1 1 2 LYS CA C 11.216 6.610 -0.679 1.00 . A A . 2 LYS CA 1 1 8 3116 1 1 2 LYS CB C 11.757 8.052 -0.841 1.00 . A A . 2 LYS CB 1 1 8 3117 1 1 2 LYS CD C 14.057 7.548 0.168 1.00 . A A . 2 LYS CD 1 1 8 3118 1 1 2 LYS CE C 15.569 7.704 -0.056 1.00 . A A . 2 LYS CE 1 1 8 3119 1 1 2 LYS CG C 13.290 8.071 -1.064 1.00 . A A . 2 LYS CG 1 1 8 3120 1 1 2 LYS H H 12.099 6.204 -2.567 1.00 . A A . 2 LYS H 1 1 8 3121 1 1 2 LYS HA H 11.574 6.192 0.250 1.00 . A A . 2 LYS HA 1 1 8 3122 1 1 2 LYS HB2 H 11.277 8.522 -1.694 1.00 . A A . 2 LYS HB2 1 1 8 3123 1 1 2 LYS HB3 H 11.523 8.621 0.048 1.00 . A A . 2 LYS HB3 1 1 8 3124 1 1 2 LYS HD2 H 13.764 8.105 1.044 1.00 . A A . 2 LYS HD2 1 1 8 3125 1 1 2 LYS HD3 H 13.844 6.503 0.319 1.00 . A A . 2 LYS HD3 1 1 8 3126 1 1 2 LYS HE2 H 15.866 7.137 -0.925 1.00 . A A . 2 LYS HE2 1 1 8 3127 1 1 2 LYS HE3 H 15.803 8.747 -0.208 1.00 . A A . 2 LYS HE3 1 1 8 3128 1 1 2 LYS HG2 H 13.531 7.457 -1.919 1.00 . A A . 2 LYS HG2 1 1 8 3129 1 1 2 LYS HG3 H 13.599 9.090 -1.269 1.00 . A A . 2 LYS HG3 1 1 8 3130 1 1 2 LYS HZ1 H 17.154 6.692 0.839 1.00 . A A . 2 LYS HZ1 1 1 8 3131 1 1 2 LYS HZ2 H 15.681 6.557 1.676 1.00 . A A . 2 LYS HZ2 1 1 8 3132 1 1 2 LYS HZ3 H 16.572 8.002 1.746 1.00 . A A . 2 LYS HZ3 1 1 8 3133 1 1 2 LYS N N 11.659 5.780 -1.802 1.00 . A A . 2 LYS N 1 1 8 3134 1 1 2 LYS NZ N 16.299 7.202 1.142 1.00 . A A . 2 LYS NZ 1 1 8 3135 1 1 2 LYS O O 9.030 6.696 -1.670 1.00 . A A . 2 LYS O 1 1 8 3136 1 1 3 PHE C C 7.073 7.884 0.129 1.00 . A A . 3 PHE C 1 1 8 3137 1 1 3 PHE CA C 7.671 6.621 0.754 1.00 . A A . 3 PHE CA 1 1 8 3138 1 1 3 PHE CB C 7.331 6.559 2.252 1.00 . A A . 3 PHE CB 1 1 8 3139 1 1 3 PHE CD1 C 7.244 8.963 3.076 1.00 . A A . 3 PHE CD1 1 1 8 3140 1 1 3 PHE CD2 C 9.248 7.663 3.515 1.00 . A A . 3 PHE CD2 1 1 8 3141 1 1 3 PHE CE1 C 7.819 10.063 3.723 1.00 . A A . 3 PHE CE1 1 1 8 3142 1 1 3 PHE CE2 C 9.819 8.766 4.160 1.00 . A A . 3 PHE CE2 1 1 8 3143 1 1 3 PHE CG C 7.954 7.756 2.970 1.00 . A A . 3 PHE CG 1 1 8 3144 1 1 3 PHE CZ C 9.105 9.966 4.264 1.00 . A A . 3 PHE CZ 1 1 8 3145 1 1 3 PHE H H 9.701 6.557 1.369 1.00 . A A . 3 PHE H 1 1 8 3146 1 1 3 PHE HA H 7.247 5.757 0.266 1.00 . A A . 3 PHE HA 1 1 8 3147 1 1 3 PHE HB2 H 6.254 6.572 2.373 1.00 . A A . 3 PHE HB2 1 1 8 3148 1 1 3 PHE HB3 H 7.720 5.639 2.667 1.00 . A A . 3 PHE HB3 1 1 8 3149 1 1 3 PHE HD1 H 6.251 9.043 2.659 1.00 . A A . 3 PHE HD1 1 1 8 3150 1 1 3 PHE HD2 H 9.799 6.738 3.438 1.00 . A A . 3 PHE HD2 1 1 8 3151 1 1 3 PHE HE1 H 7.268 10.990 3.804 1.00 . A A . 3 PHE HE1 1 1 8 3152 1 1 3 PHE HE2 H 10.813 8.693 4.577 1.00 . A A . 3 PHE HE2 1 1 8 3153 1 1 3 PHE HZ H 9.548 10.817 4.761 1.00 . A A . 3 PHE HZ 1 1 8 3154 1 1 3 PHE N N 9.125 6.599 0.578 1.00 . A A . 3 PHE N 1 1 8 3155 1 1 3 PHE O O 5.935 7.887 -0.341 1.00 . A A . 3 PHE O 1 1 8 3156 1 1 4 TYR C C 7.202 10.061 -1.949 1.00 . A A . 4 TYR C 1 1 8 3157 1 1 4 TYR CA C 7.469 10.223 -0.444 1.00 . A A . 4 TYR CA 1 1 8 3158 1 1 4 TYR CB C 8.602 11.253 -0.135 1.00 . A A . 4 TYR CB 1 1 8 3159 1 1 4 TYR CD1 C 9.282 12.192 -2.379 1.00 . A A . 4 TYR CD1 1 1 8 3160 1 1 4 TYR CD2 C 8.040 13.634 -0.872 1.00 . A A . 4 TYR CD2 1 1 8 3161 1 1 4 TYR CE1 C 9.337 13.222 -3.322 1.00 . A A . 4 TYR CE1 1 1 8 3162 1 1 4 TYR CE2 C 8.094 14.665 -1.819 1.00 . A A . 4 TYR CE2 1 1 8 3163 1 1 4 TYR CG C 8.635 12.394 -1.152 1.00 . A A . 4 TYR CG 1 1 8 3164 1 1 4 TYR CZ C 8.745 14.460 -3.043 1.00 . A A . 4 TYR CZ 1 1 8 3165 1 1 4 TYR H H 8.770 8.870 0.497 1.00 . A A . 4 TYR H 1 1 8 3166 1 1 4 TYR HA H 6.551 10.548 0.027 1.00 . A A . 4 TYR HA 1 1 8 3167 1 1 4 TYR HB2 H 8.462 11.658 0.862 1.00 . A A . 4 TYR HB2 1 1 8 3168 1 1 4 TYR HB3 H 9.557 10.737 -0.156 1.00 . A A . 4 TYR HB3 1 1 8 3169 1 1 4 TYR HD1 H 9.738 11.231 -2.591 1.00 . A A . 4 TYR HD1 1 1 8 3170 1 1 4 TYR HD2 H 7.539 13.792 0.072 1.00 . A A . 4 TYR HD2 1 1 8 3171 1 1 4 TYR HE1 H 9.838 13.060 -4.265 1.00 . A A . 4 TYR HE1 1 1 8 3172 1 1 4 TYR HE2 H 7.637 15.619 -1.604 1.00 . A A . 4 TYR HE2 1 1 8 3173 1 1 4 TYR HH H 9.475 15.254 -4.618 1.00 . A A . 4 TYR HH 1 1 8 3174 1 1 4 TYR N N 7.870 8.946 0.122 1.00 . A A . 4 TYR N 1 1 8 3175 1 1 4 TYR O O 6.295 10.686 -2.498 1.00 . A A . 4 TYR O 1 1 8 3176 1 1 4 TYR OH O 8.803 15.479 -3.971 1.00 . A A . 4 TYR OH 1 1 8 3177 1 1 5 THR C C 6.490 8.418 -4.377 1.00 . A A . 5 THR C 1 1 8 3178 1 1 5 THR CA C 7.865 9.005 -4.039 1.00 . A A . 5 THR CA 1 1 8 3179 1 1 5 THR CB C 8.984 8.064 -4.525 1.00 . A A . 5 THR CB 1 1 8 3180 1 1 5 THR CG2 C 8.985 7.968 -6.058 1.00 . A A . 5 THR CG2 1 1 8 3181 1 1 5 THR H H 8.719 8.773 -2.115 1.00 . A A . 5 THR H 1 1 8 3182 1 1 5 THR HA H 7.968 9.956 -4.547 1.00 . A A . 5 THR HA 1 1 8 3183 1 1 5 THR HB H 8.836 7.080 -4.109 1.00 . A A . 5 THR HB 1 1 8 3184 1 1 5 THR HG1 H 10.112 8.968 -3.223 1.00 . A A . 5 THR HG1 1 1 8 3185 1 1 5 THR HG21 H 9.093 8.956 -6.482 1.00 . A A . 5 THR HG21 1 1 8 3186 1 1 5 THR HG22 H 8.058 7.531 -6.398 1.00 . A A . 5 THR HG22 1 1 8 3187 1 1 5 THR HG23 H 9.810 7.349 -6.377 1.00 . A A . 5 THR HG23 1 1 8 3188 1 1 5 THR N N 8.008 9.233 -2.603 1.00 . A A . 5 THR N 1 1 8 3189 1 1 5 THR O O 5.852 8.853 -5.333 1.00 . A A . 5 THR O 1 1 8 3190 1 1 5 THR OG1 O 10.238 8.568 -4.087 1.00 . A A . 5 THR OG1 1 1 8 3191 1 1 6 ILE C C 3.627 7.886 -3.693 1.00 . A A . 6 ILE C 1 1 8 3192 1 1 6 ILE CA C 4.715 6.821 -3.843 1.00 . A A . 6 ILE CA 1 1 8 3193 1 1 6 ILE CB C 4.460 5.625 -2.867 1.00 . A A . 6 ILE CB 1 1 8 3194 1 1 6 ILE CD1 C 6.883 4.789 -3.010 1.00 . A A . 6 ILE CD1 1 1 8 3195 1 1 6 ILE CG1 C 5.405 4.434 -3.216 1.00 . A A . 6 ILE CG1 1 1 8 3196 1 1 6 ILE CG2 C 2.984 5.132 -2.961 1.00 . A A . 6 ILE CG2 1 1 8 3197 1 1 6 ILE H H 6.569 7.131 -2.837 1.00 . A A . 6 ILE H 1 1 8 3198 1 1 6 ILE HA H 4.691 6.453 -4.860 1.00 . A A . 6 ILE HA 1 1 8 3199 1 1 6 ILE HB H 4.657 5.951 -1.855 1.00 . A A . 6 ILE HB 1 1 8 3200 1 1 6 ILE HD11 H 7.004 5.418 -2.140 1.00 . A A . 6 ILE HD11 1 1 8 3201 1 1 6 ILE HD12 H 7.248 5.297 -3.882 1.00 . A A . 6 ILE HD12 1 1 8 3202 1 1 6 ILE HD13 H 7.447 3.879 -2.871 1.00 . A A . 6 ILE HD13 1 1 8 3203 1 1 6 ILE HG12 H 5.164 3.589 -2.587 1.00 . A A . 6 ILE HG12 1 1 8 3204 1 1 6 ILE HG13 H 5.255 4.156 -4.249 1.00 . A A . 6 ILE HG13 1 1 8 3205 1 1 6 ILE HG21 H 2.717 4.985 -3.998 1.00 . A A . 6 ILE HG21 1 1 8 3206 1 1 6 ILE HG22 H 2.322 5.864 -2.521 1.00 . A A . 6 ILE HG22 1 1 8 3207 1 1 6 ILE HG23 H 2.872 4.196 -2.427 1.00 . A A . 6 ILE HG23 1 1 8 3208 1 1 6 ILE N N 6.028 7.437 -3.591 1.00 . A A . 6 ILE N 1 1 8 3209 1 1 6 ILE O O 2.701 7.955 -4.500 1.00 . A A . 6 ILE O 1 1 8 3210 1 1 7 LYS C C 2.703 10.731 -3.601 1.00 . A A . 7 LYS C 1 1 8 3211 1 1 7 LYS CA C 2.772 9.766 -2.416 1.00 . A A . 7 LYS CA 1 1 8 3212 1 1 7 LYS CB C 3.177 10.527 -1.133 1.00 . A A . 7 LYS CB 1 1 8 3213 1 1 7 LYS CD C 2.565 12.354 0.500 1.00 . A A . 7 LYS CD 1 1 8 3214 1 1 7 LYS CE C 1.638 13.550 0.755 1.00 . A A . 7 LYS CE 1 1 8 3215 1 1 7 LYS CG C 2.200 11.685 -0.836 1.00 . A A . 7 LYS CG 1 1 8 3216 1 1 7 LYS H H 4.509 8.608 -2.049 1.00 . A A . 7 LYS H 1 1 8 3217 1 1 7 LYS HA H 1.799 9.324 -2.266 1.00 . A A . 7 LYS HA 1 1 8 3218 1 1 7 LYS HB2 H 3.176 9.836 -0.301 1.00 . A A . 7 LYS HB2 1 1 8 3219 1 1 7 LYS HB3 H 4.173 10.925 -1.258 1.00 . A A . 7 LYS HB3 1 1 8 3220 1 1 7 LYS HD2 H 2.457 11.639 1.302 1.00 . A A . 7 LYS HD2 1 1 8 3221 1 1 7 LYS HD3 H 3.589 12.700 0.463 1.00 . A A . 7 LYS HD3 1 1 8 3222 1 1 7 LYS HE2 H 1.919 14.033 1.680 1.00 . A A . 7 LYS HE2 1 1 8 3223 1 1 7 LYS HE3 H 1.729 14.256 -0.061 1.00 . A A . 7 LYS HE3 1 1 8 3224 1 1 7 LYS HG2 H 2.260 12.423 -1.624 1.00 . A A . 7 LYS HG2 1 1 8 3225 1 1 7 LYS HG3 H 1.199 11.300 -0.786 1.00 . A A . 7 LYS HG3 1 1 8 3226 1 1 7 LYS HZ1 H -0.229 13.516 1.675 1.00 . A A . 7 LYS HZ1 1 1 8 3227 1 1 7 LYS HZ2 H 0.213 12.044 0.953 1.00 . A A . 7 LYS HZ2 1 1 8 3228 1 1 7 LYS HZ3 H -0.287 13.351 -0.011 1.00 . A A . 7 LYS HZ3 1 1 8 3229 1 1 7 LYS N N 3.750 8.711 -2.660 1.00 . A A . 7 LYS N 1 1 8 3230 1 1 7 LYS NZ N 0.227 13.080 0.850 1.00 . A A . 7 LYS NZ 1 1 8 3231 1 1 7 LYS O O 1.622 11.025 -4.109 1.00 . A A . 7 LYS O 1 1 8 3232 1 1 8 LEU C C 3.493 11.483 -6.425 1.00 . A A . 8 LEU C 1 1 8 3233 1 1 8 LEU CA C 3.916 12.171 -5.139 1.00 . A A . 8 LEU CA 1 1 8 3234 1 1 8 LEU CB C 5.349 12.750 -5.277 1.00 . A A . 8 LEU CB 1 1 8 3235 1 1 8 LEU CD1 C 4.878 15.291 -5.308 1.00 . A A . 8 LEU CD1 1 1 8 3236 1 1 8 LEU CD2 C 6.769 14.348 -6.676 1.00 . A A . 8 LEU CD2 1 1 8 3237 1 1 8 LEU CG C 5.351 14.066 -6.140 1.00 . A A . 8 LEU CG 1 1 8 3238 1 1 8 LEU H H 4.683 10.962 -3.581 1.00 . A A . 8 LEU H 1 1 8 3239 1 1 8 LEU HA H 3.223 12.973 -4.940 1.00 . A A . 8 LEU HA 1 1 8 3240 1 1 8 LEU HB2 H 5.735 12.950 -4.289 1.00 . A A . 8 LEU HB2 1 1 8 3241 1 1 8 LEU HB3 H 5.988 12.006 -5.744 1.00 . A A . 8 LEU HB3 1 1 8 3242 1 1 8 LEU HD11 H 3.833 15.199 -5.066 1.00 . A A . 8 LEU HD11 1 1 8 3243 1 1 8 LEU HD12 H 5.019 16.199 -5.880 1.00 . A A . 8 LEU HD12 1 1 8 3244 1 1 8 LEU HD13 H 5.452 15.355 -4.394 1.00 . A A . 8 LEU HD13 1 1 8 3245 1 1 8 LEU HD21 H 6.754 15.254 -7.268 1.00 . A A . 8 LEU HD21 1 1 8 3246 1 1 8 LEU HD22 H 7.093 13.525 -7.293 1.00 . A A . 8 LEU HD22 1 1 8 3247 1 1 8 LEU HD23 H 7.450 14.470 -5.848 1.00 . A A . 8 LEU HD23 1 1 8 3248 1 1 8 LEU HG H 4.682 13.937 -6.984 1.00 . A A . 8 LEU HG 1 1 8 3249 1 1 8 LEU N N 3.859 11.229 -4.024 1.00 . A A . 8 LEU N 1 1 8 3250 1 1 8 LEU O O 2.771 12.040 -7.242 1.00 . A A . 8 LEU O 1 1 8 3251 1 1 9 ALA C C 2.124 9.381 -7.967 1.00 . A A . 9 ALA C 1 1 8 3252 1 1 9 ALA CA C 3.639 9.496 -7.804 1.00 . A A . 9 ALA CA 1 1 8 3253 1 1 9 ALA CB C 4.251 8.091 -7.729 1.00 . A A . 9 ALA CB 1 1 8 3254 1 1 9 ALA H H 4.546 9.875 -5.924 1.00 . A A . 9 ALA H 1 1 8 3255 1 1 9 ALA HA H 4.051 10.013 -8.651 1.00 . A A . 9 ALA HA 1 1 8 3256 1 1 9 ALA HB1 H 5.322 8.169 -7.628 1.00 . A A . 9 ALA HB1 1 1 8 3257 1 1 9 ALA HB2 H 4.016 7.545 -8.632 1.00 . A A . 9 ALA HB2 1 1 8 3258 1 1 9 ALA HB3 H 3.842 7.566 -6.875 1.00 . A A . 9 ALA HB3 1 1 8 3259 1 1 9 ALA N N 3.963 10.260 -6.603 1.00 . A A . 9 ALA N 1 1 8 3260 1 1 9 ALA O O 1.600 9.444 -9.073 1.00 . A A . 9 ALA O 1 1 8 3261 1 1 10 LYS C C -0.650 10.450 -7.192 1.00 . A A . 10 LYS C 1 1 8 3262 1 1 10 LYS CA C -0.018 9.103 -6.816 1.00 . A A . 10 LYS CA 1 1 8 3263 1 1 10 LYS CB C -0.452 8.635 -5.399 1.00 . A A . 10 LYS CB 1 1 8 3264 1 1 10 LYS CD C -2.165 7.314 -4.016 1.00 . A A . 10 LYS CD 1 1 8 3265 1 1 10 LYS CE C -1.456 5.955 -3.808 1.00 . A A . 10 LYS CE 1 1 8 3266 1 1 10 LYS CG C -1.833 7.928 -5.417 1.00 . A A . 10 LYS CG 1 1 8 3267 1 1 10 LYS H H 1.931 9.179 -5.992 1.00 . A A . 10 LYS H 1 1 8 3268 1 1 10 LYS HA H -0.324 8.371 -7.556 1.00 . A A . 10 LYS HA 1 1 8 3269 1 1 10 LYS HB2 H 0.290 7.953 -5.030 1.00 . A A . 10 LYS HB2 1 1 8 3270 1 1 10 LYS HB3 H -0.497 9.486 -4.728 1.00 . A A . 10 LYS HB3 1 1 8 3271 1 1 10 LYS HD2 H -1.861 7.995 -3.233 1.00 . A A . 10 LYS HD2 1 1 8 3272 1 1 10 LYS HD3 H -3.235 7.157 -3.939 1.00 . A A . 10 LYS HD3 1 1 8 3273 1 1 10 LYS HE2 H -0.384 6.071 -3.871 1.00 . A A . 10 LYS HE2 1 1 8 3274 1 1 10 LYS HE3 H -1.712 5.568 -2.833 1.00 . A A . 10 LYS HE3 1 1 8 3275 1 1 10 LYS HG2 H -2.593 8.657 -5.680 1.00 . A A . 10 LYS HG2 1 1 8 3276 1 1 10 LYS HG3 H -1.829 7.144 -6.163 1.00 . A A . 10 LYS HG3 1 1 8 3277 1 1 10 LYS HZ1 H -1.227 4.974 -5.631 1.00 . A A . 10 LYS HZ1 1 1 8 3278 1 1 10 LYS HZ2 H -2.843 5.287 -5.210 1.00 . A A . 10 LYS HZ2 1 1 8 3279 1 1 10 LYS HZ3 H -1.985 4.042 -4.436 1.00 . A A . 10 LYS HZ3 1 1 8 3280 1 1 10 LYS N N 1.441 9.216 -6.840 1.00 . A A . 10 LYS N 1 1 8 3281 1 1 10 LYS NZ N -1.912 4.992 -4.850 1.00 . A A . 10 LYS NZ 1 1 8 3282 1 1 10 LYS O O -1.622 10.504 -7.945 1.00 . A A . 10 LYS O 1 1 8 3283 1 1 11 PHE C C -0.446 13.140 -8.459 1.00 . A A . 11 PHE C 1 1 8 3284 1 1 11 PHE CA C -0.558 12.884 -6.960 1.00 . A A . 11 PHE CA 1 1 8 3285 1 1 11 PHE CB C 0.304 13.889 -6.175 1.00 . A A . 11 PHE CB 1 1 8 3286 1 1 11 PHE CD1 C -1.383 15.774 -5.997 1.00 . A A . 11 PHE CD1 1 1 8 3287 1 1 11 PHE CD2 C 0.739 16.243 -7.093 1.00 . A A . 11 PHE CD2 1 1 8 3288 1 1 11 PHE CE1 C -1.778 17.101 -6.210 1.00 . A A . 11 PHE CE1 1 1 8 3289 1 1 11 PHE CE2 C 0.334 17.565 -7.304 1.00 . A A . 11 PHE CE2 1 1 8 3290 1 1 11 PHE CG C -0.126 15.333 -6.437 1.00 . A A . 11 PHE CG 1 1 8 3291 1 1 11 PHE CZ C -0.921 17.994 -6.861 1.00 . A A . 11 PHE CZ 1 1 8 3292 1 1 11 PHE H H 0.710 11.424 -6.086 1.00 . A A . 11 PHE H 1 1 8 3293 1 1 11 PHE HA H -1.588 12.971 -6.653 1.00 . A A . 11 PHE HA 1 1 8 3294 1 1 11 PHE HB2 H 0.204 13.679 -5.126 1.00 . A A . 11 PHE HB2 1 1 8 3295 1 1 11 PHE HB3 H 1.335 13.757 -6.450 1.00 . A A . 11 PHE HB3 1 1 8 3296 1 1 11 PHE HD1 H -2.051 15.090 -5.493 1.00 . A A . 11 PHE HD1 1 1 8 3297 1 1 11 PHE HD2 H 1.716 15.919 -7.439 1.00 . A A . 11 PHE HD2 1 1 8 3298 1 1 11 PHE HE1 H -2.748 17.434 -5.870 1.00 . A A . 11 PHE HE1 1 1 8 3299 1 1 11 PHE HE2 H 0.994 18.257 -7.808 1.00 . A A . 11 PHE HE2 1 1 8 3300 1 1 11 PHE HZ H -1.229 19.016 -7.023 1.00 . A A . 11 PHE HZ 1 1 8 3301 1 1 11 PHE N N -0.071 11.534 -6.669 1.00 . A A . 11 PHE N 1 1 8 3302 1 1 11 PHE O O -1.408 13.538 -9.116 1.00 . A A . 11 PHE O 1 1 8 3303 1 1 12 LEU C C 0.220 11.976 -11.206 1.00 . A A . 12 LEU C 1 1 8 3304 1 1 12 LEU CA C 1.014 13.014 -10.414 1.00 . A A . 12 LEU CA 1 1 8 3305 1 1 12 LEU CB C 2.520 12.802 -10.677 1.00 . A A . 12 LEU CB 1 1 8 3306 1 1 12 LEU CD1 C 4.871 13.511 -10.107 1.00 . A A . 12 LEU CD1 1 1 8 3307 1 1 12 LEU CD2 C 3.098 15.293 -10.436 1.00 . A A . 12 LEU CD2 1 1 8 3308 1 1 12 LEU CG C 3.377 13.854 -9.924 1.00 . A A . 12 LEU CG 1 1 8 3309 1 1 12 LEU H H 1.447 12.529 -8.391 1.00 . A A . 12 LEU H 1 1 8 3310 1 1 12 LEU HA H 0.722 13.995 -10.748 1.00 . A A . 12 LEU HA 1 1 8 3311 1 1 12 LEU HB2 H 2.795 11.810 -10.340 1.00 . A A . 12 LEU HB2 1 1 8 3312 1 1 12 LEU HB3 H 2.712 12.879 -11.740 1.00 . A A . 12 LEU HB3 1 1 8 3313 1 1 12 LEU HD11 H 5.475 14.250 -9.600 1.00 . A A . 12 LEU HD11 1 1 8 3314 1 1 12 LEU HD12 H 5.115 13.507 -11.159 1.00 . A A . 12 LEU HD12 1 1 8 3315 1 1 12 LEU HD13 H 5.068 12.535 -9.688 1.00 . A A . 12 LEU HD13 1 1 8 3316 1 1 12 LEU HD21 H 2.200 15.667 -9.972 1.00 . A A . 12 LEU HD21 1 1 8 3317 1 1 12 LEU HD22 H 2.981 15.296 -11.510 1.00 . A A . 12 LEU HD22 1 1 8 3318 1 1 12 LEU HD23 H 3.920 15.948 -10.168 1.00 . A A . 12 LEU HD23 1 1 8 3319 1 1 12 LEU HG H 3.138 13.805 -8.874 1.00 . A A . 12 LEU HG 1 1 8 3320 1 1 12 LEU N N 0.740 12.865 -8.984 1.00 . A A . 12 LEU N 1 1 8 3321 1 1 12 LEU O O -0.287 12.260 -12.285 1.00 . A A . 12 LEU O 1 1 8 3322 1 1 13 GLY C C -2.017 9.937 -11.518 1.00 . A A . 13 GLY C 1 1 8 3323 1 1 13 GLY CA C -0.536 9.657 -11.318 1.00 . A A . 13 GLY CA 1 1 8 3324 1 1 13 GLY H H 0.603 10.609 -9.809 1.00 . A A . 13 GLY H 1 1 8 3325 1 1 13 GLY HA2 H -0.080 9.482 -12.278 1.00 . A A . 13 GLY HA2 1 1 8 3326 1 1 13 GLY HA3 H -0.424 8.780 -10.725 1.00 . A A . 13 GLY HA3 1 1 8 3327 1 1 13 GLY N N 0.156 10.766 -10.664 1.00 . A A . 13 GLY N 1 1 8 3328 1 1 13 GLY O O -2.682 9.268 -12.307 1.00 . A A . 13 GLY O 1 1 8 3329 1 1 14 GLY C C -4.070 12.395 -12.000 1.00 . A A . 14 GLY C 1 1 8 3330 1 1 14 GLY CA C -3.951 11.309 -10.935 1.00 . A A . 14 GLY CA 1 1 8 3331 1 1 14 GLY H H -1.960 11.425 -10.186 1.00 . A A . 14 GLY H 1 1 8 3332 1 1 14 GLY HA2 H -4.560 10.453 -11.213 1.00 . A A . 14 GLY HA2 1 1 8 3333 1 1 14 GLY HA3 H -4.302 11.702 -9.994 1.00 . A A . 14 GLY HA3 1 1 8 3334 1 1 14 GLY N N -2.537 10.928 -10.804 1.00 . A A . 14 GLY N 1 1 8 3335 1 1 14 GLY O O -4.952 12.361 -12.859 1.00 . A A . 14 GLY O 1 1 8 3336 1 1 15 ILE C C -2.567 14.061 -14.212 1.00 . A A . 15 ILE C 1 1 8 3337 1 1 15 ILE CA C -3.087 14.488 -12.844 1.00 . A A . 15 ILE CA 1 1 8 3338 1 1 15 ILE CB C -2.165 15.574 -12.244 1.00 . A A . 15 ILE CB 1 1 8 3339 1 1 15 ILE CD1 C -1.676 16.864 -10.127 1.00 . A A . 15 ILE CD1 1 1 8 3340 1 1 15 ILE CG1 C -2.711 16.003 -10.854 1.00 . A A . 15 ILE CG1 1 1 8 3341 1 1 15 ILE CG2 C -2.085 16.808 -13.185 1.00 . A A . 15 ILE CG2 1 1 8 3342 1 1 15 ILE H H -2.484 13.301 -11.207 1.00 . A A . 15 ILE H 1 1 8 3343 1 1 15 ILE HA H -4.078 14.907 -12.969 1.00 . A A . 15 ILE HA 1 1 8 3344 1 1 15 ILE HB H -1.171 15.153 -12.128 1.00 . A A . 15 ILE HB 1 1 8 3345 1 1 15 ILE HD11 H -1.470 17.751 -10.707 1.00 . A A . 15 ILE HD11 1 1 8 3346 1 1 15 ILE HD12 H -0.765 16.297 -10.000 1.00 . A A . 15 ILE HD12 1 1 8 3347 1 1 15 ILE HD13 H -2.065 17.145 -9.163 1.00 . A A . 15 ILE HD13 1 1 8 3348 1 1 15 ILE HG12 H -3.623 16.568 -10.976 1.00 . A A . 15 ILE HG12 1 1 8 3349 1 1 15 ILE HG13 H -2.916 15.133 -10.247 1.00 . A A . 15 ILE HG13 1 1 8 3350 1 1 15 ILE HG21 H -3.083 17.148 -13.423 1.00 . A A . 15 ILE HG21 1 1 8 3351 1 1 15 ILE HG22 H -1.571 16.543 -14.096 1.00 . A A . 15 ILE HG22 1 1 8 3352 1 1 15 ILE HG23 H -1.542 17.606 -12.702 1.00 . A A . 15 ILE HG23 1 1 8 3353 1 1 15 ILE N N -3.153 13.356 -11.918 1.00 . A A . 15 ILE N 1 1 8 3354 1 1 15 ILE O O -2.892 14.687 -15.221 1.00 . A A . 15 ILE O 1 1 8 3355 1 1 16 VAL C C -2.267 12.333 -16.555 1.00 . A A . 16 VAL C 1 1 8 3356 1 1 16 VAL CA C -1.147 12.595 -15.535 1.00 . A A . 16 VAL CA 1 1 8 3357 1 1 16 VAL CB C -0.273 11.323 -15.331 1.00 . A A . 16 VAL CB 1 1 8 3358 1 1 16 VAL CG1 C -1.153 10.103 -14.980 1.00 . A A . 16 VAL CG1 1 1 8 3359 1 1 16 VAL CG2 C 0.542 11.029 -16.606 1.00 . A A . 16 VAL CG2 1 1 8 3360 1 1 16 VAL H H -1.465 12.570 -13.425 1.00 . A A . 16 VAL H 1 1 8 3361 1 1 16 VAL HA H -0.521 13.397 -15.901 1.00 . A A . 16 VAL HA 1 1 8 3362 1 1 16 VAL HB H 0.410 11.499 -14.505 1.00 . A A . 16 VAL HB 1 1 8 3363 1 1 16 VAL HG11 H -0.529 9.289 -14.644 1.00 . A A . 16 VAL HG11 1 1 8 3364 1 1 16 VAL HG12 H -1.714 9.782 -15.846 1.00 . A A . 16 VAL HG12 1 1 8 3365 1 1 16 VAL HG13 H -1.835 10.379 -14.197 1.00 . A A . 16 VAL HG13 1 1 8 3366 1 1 16 VAL HG21 H 1.209 11.855 -16.806 1.00 . A A . 16 VAL HG21 1 1 8 3367 1 1 16 VAL HG22 H -0.129 10.898 -17.443 1.00 . A A . 16 VAL HG22 1 1 8 3368 1 1 16 VAL HG23 H 1.122 10.126 -16.467 1.00 . A A . 16 VAL HG23 1 1 8 3369 1 1 16 VAL N N -1.723 13.026 -14.256 1.00 . A A . 16 VAL N 1 1 8 3370 1 1 16 VAL O O -2.177 12.727 -17.717 1.00 . A A . 16 VAL O 1 1 8 3371 1 1 17 ARG C C -5.235 12.659 -17.245 1.00 . A A . 17 ARG C 1 1 8 3372 1 1 17 ARG CA C -4.486 11.369 -16.909 1.00 . A A . 17 ARG CA 1 1 8 3373 1 1 17 ARG CB C -5.394 10.391 -16.131 1.00 . A A . 17 ARG CB 1 1 8 3374 1 1 17 ARG CD C -6.299 8.865 -17.988 1.00 . A A . 17 ARG CD 1 1 8 3375 1 1 17 ARG CG C -6.648 9.947 -16.948 1.00 . A A . 17 ARG CG 1 1 8 3376 1 1 17 ARG CZ C -6.506 6.801 -16.669 1.00 . A A . 17 ARG CZ 1 1 8 3377 1 1 17 ARG H H -3.337 11.404 -15.142 1.00 . A A . 17 ARG H 1 1 8 3378 1 1 17 ARG HA H -4.155 10.903 -17.822 1.00 . A A . 17 ARG HA 1 1 8 3379 1 1 17 ARG HB2 H -4.814 9.520 -15.859 1.00 . A A . 17 ARG HB2 1 1 8 3380 1 1 17 ARG HB3 H -5.718 10.884 -15.222 1.00 . A A . 17 ARG HB3 1 1 8 3381 1 1 17 ARG HD2 H -7.197 8.587 -18.527 1.00 . A A . 17 ARG HD2 1 1 8 3382 1 1 17 ARG HD3 H -5.584 9.253 -18.693 1.00 . A A . 17 ARG HD3 1 1 8 3383 1 1 17 ARG HE H -4.772 7.527 -17.363 1.00 . A A . 17 ARG HE 1 1 8 3384 1 1 17 ARG HG2 H -7.379 9.538 -16.266 1.00 . A A . 17 ARG HG2 1 1 8 3385 1 1 17 ARG HG3 H -7.086 10.793 -17.452 1.00 . A A . 17 ARG HG3 1 1 8 3386 1 1 17 ARG HH11 H -8.218 7.778 -17.025 1.00 . A A . 17 ARG HH11 1 1 8 3387 1 1 17 ARG HH12 H -8.368 6.317 -16.105 1.00 . A A . 17 ARG HH12 1 1 8 3388 1 1 17 ARG HH21 H -4.972 5.621 -16.156 1.00 . A A . 17 ARG HH21 1 1 8 3389 1 1 17 ARG HH22 H -6.531 5.100 -15.613 1.00 . A A . 17 ARG HH22 1 1 8 3390 1 1 17 ARG N N -3.327 11.678 -16.082 1.00 . A A . 17 ARG N 1 1 8 3391 1 1 17 ARG NE N -5.738 7.680 -17.323 1.00 . A A . 17 ARG NE 1 1 8 3392 1 1 17 ARG NH1 N -7.799 6.979 -16.593 1.00 . A A . 17 ARG NH1 1 1 8 3393 1 1 17 ARG NH2 N -5.960 5.759 -16.102 1.00 . A A . 17 ARG NH2 1 1 8 3394 1 1 17 ARG O O -5.730 12.828 -18.359 1.00 . A A . 17 ARG O 1 1 8 3395 1 1 18 ALA C C -5.458 15.631 -17.601 1.00 . A A . 18 ALA C 1 1 8 3396 1 1 18 ALA CA C -6.047 14.819 -16.444 1.00 . A A . 18 ALA CA 1 1 8 3397 1 1 18 ALA CB C -5.987 15.644 -15.150 1.00 . A A . 18 ALA CB 1 1 8 3398 1 1 18 ALA H H -4.931 13.355 -15.390 1.00 . A A . 18 ALA H 1 1 8 3399 1 1 18 ALA HA H -7.077 14.599 -16.661 1.00 . A A . 18 ALA HA 1 1 8 3400 1 1 18 ALA HB1 H -6.624 16.513 -15.241 1.00 . A A . 18 ALA HB1 1 1 8 3401 1 1 18 ALA HB2 H -4.972 15.966 -14.968 1.00 . A A . 18 ALA HB2 1 1 8 3402 1 1 18 ALA HB3 H -6.324 15.038 -14.324 1.00 . A A . 18 ALA HB3 1 1 8 3403 1 1 18 ALA N N -5.333 13.555 -16.261 1.00 . A A . 18 ALA N 1 1 8 3404 1 1 18 ALA O O -6.192 16.258 -18.362 1.00 . A A . 18 ALA O 1 1 8 3405 1 1 19 MET C C -3.904 15.861 -20.159 1.00 . A A . 19 MET C 1 1 8 3406 1 1 19 MET CA C -3.457 16.348 -18.781 1.00 . A A . 19 MET CA 1 1 8 3407 1 1 19 MET CB C -1.949 16.105 -18.613 1.00 . A A . 19 MET CB 1 1 8 3408 1 1 19 MET CE C 1.051 17.149 -18.626 1.00 . A A . 19 MET CE 1 1 8 3409 1 1 19 MET CG C -1.410 16.863 -17.386 1.00 . A A . 19 MET CG 1 1 8 3410 1 1 19 MET H H -3.596 15.098 -17.095 1.00 . A A . 19 MET H 1 1 8 3411 1 1 19 MET HA H -3.669 17.403 -18.689 1.00 . A A . 19 MET HA 1 1 8 3412 1 1 19 MET HB2 H -1.778 15.048 -18.475 1.00 . A A . 19 MET HB2 1 1 8 3413 1 1 19 MET HB3 H -1.437 16.426 -19.490 1.00 . A A . 19 MET HB3 1 1 8 3414 1 1 19 MET HE1 H 0.497 18.029 -18.923 1.00 . A A . 19 MET HE1 1 1 8 3415 1 1 19 MET HE2 H 1.014 16.418 -19.418 1.00 . A A . 19 MET HE2 1 1 8 3416 1 1 19 MET HE3 H 2.083 17.416 -18.439 1.00 . A A . 19 MET HE3 1 1 8 3417 1 1 19 MET HG2 H -1.508 17.925 -17.545 1.00 . A A . 19 MET HG2 1 1 8 3418 1 1 19 MET HG3 H -1.982 16.583 -16.514 1.00 . A A . 19 MET HG3 1 1 8 3419 1 1 19 MET N N -4.134 15.614 -17.725 1.00 . A A . 19 MET N 1 1 8 3420 1 1 19 MET O O -4.406 16.636 -20.974 1.00 . A A . 19 MET O 1 1 8 3421 1 1 19 MET SD S 0.336 16.441 -17.115 1.00 . A A . 19 MET SD 1 1 8 3422 1 1 20 LEU C C -5.620 14.079 -21.834 1.00 . A A . 20 LEU C 1 1 8 3423 1 1 20 LEU CA C -4.107 13.959 -21.668 1.00 . A A . 20 LEU CA 1 1 8 3424 1 1 20 LEU CB C -3.676 12.467 -21.674 1.00 . A A . 20 LEU CB 1 1 8 3425 1 1 20 LEU CD1 C -1.271 13.080 -21.115 1.00 . A A . 20 LEU CD1 1 1 8 3426 1 1 20 LEU CD2 C -1.819 10.810 -22.058 1.00 . A A . 20 LEU CD2 1 1 8 3427 1 1 20 LEU CG C -2.190 12.304 -22.081 1.00 . A A . 20 LEU CG 1 1 8 3428 1 1 20 LEU H H -3.312 14.016 -19.701 1.00 . A A . 20 LEU H 1 1 8 3429 1 1 20 LEU HA H -3.625 14.484 -22.484 1.00 . A A . 20 LEU HA 1 1 8 3430 1 1 20 LEU HB2 H -3.813 12.061 -20.681 1.00 . A A . 20 LEU HB2 1 1 8 3431 1 1 20 LEU HB3 H -4.293 11.911 -22.368 1.00 . A A . 20 LEU HB3 1 1 8 3432 1 1 20 LEU HD11 H -1.421 14.141 -21.246 1.00 . A A . 20 LEU HD11 1 1 8 3433 1 1 20 LEU HD12 H -0.236 12.845 -21.326 1.00 . A A . 20 LEU HD12 1 1 8 3434 1 1 20 LEU HD13 H -1.499 12.807 -20.094 1.00 . A A . 20 LEU HD13 1 1 8 3435 1 1 20 LEU HD21 H -0.787 10.690 -22.357 1.00 . A A . 20 LEU HD21 1 1 8 3436 1 1 20 LEU HD22 H -2.455 10.268 -22.742 1.00 . A A . 20 LEU HD22 1 1 8 3437 1 1 20 LEU HD23 H -1.951 10.423 -21.059 1.00 . A A . 20 LEU HD23 1 1 8 3438 1 1 20 LEU HG H -2.054 12.690 -23.083 1.00 . A A . 20 LEU HG 1 1 8 3439 1 1 20 LEU N N -3.719 14.571 -20.397 1.00 . A A . 20 LEU N 1 1 8 3440 1 1 20 LEU O O -6.127 14.352 -22.921 1.00 . A A . 20 LEU O 1 1 8 3441 1 1 21 GLY C C -8.225 15.380 -21.026 1.00 . A A . 21 GLY C 1 1 8 3442 1 1 21 GLY CA C -7.780 13.955 -20.730 1.00 . A A . 21 GLY CA 1 1 8 3443 1 1 21 GLY H H -5.846 13.665 -19.898 1.00 . A A . 21 GLY H 1 1 8 3444 1 1 21 GLY HA2 H -8.185 13.287 -21.481 1.00 . A A . 21 GLY HA2 1 1 8 3445 1 1 21 GLY HA3 H -8.150 13.663 -19.760 1.00 . A A . 21 GLY HA3 1 1 8 3446 1 1 21 GLY N N -6.323 13.871 -20.733 1.00 . A A . 21 GLY N 1 1 8 3447 1 1 21 GLY O O -9.295 15.608 -21.590 1.00 . A A . 21 GLY O 1 1 8 3448 1 1 22 SER C C -7.093 18.262 -22.164 1.00 . A A . 22 SER C 1 1 8 3449 1 1 22 SER CA C -7.664 17.772 -20.834 1.00 . A A . 22 SER CA 1 1 8 3450 1 1 22 SER CB C -7.041 18.584 -19.696 1.00 . A A . 22 SER CB 1 1 8 3451 1 1 22 SER H H -6.546 16.076 -20.188 1.00 . A A . 22 SER H 1 1 8 3452 1 1 22 SER HA H -8.735 17.945 -20.832 1.00 . A A . 22 SER HA 1 1 8 3453 1 1 22 SER HB2 H -7.488 18.297 -18.757 1.00 . A A . 22 SER HB2 1 1 8 3454 1 1 22 SER HB3 H -5.976 18.396 -19.659 1.00 . A A . 22 SER HB3 1 1 8 3455 1 1 22 SER HG H -7.330 20.403 -19.067 1.00 . A A . 22 SER HG 1 1 8 3456 1 1 22 SER N N -7.384 16.340 -20.629 1.00 . A A . 22 SER N 1 1 8 3457 1 1 22 SER O O -7.474 19.324 -22.655 1.00 . A A . 22 SER O 1 1 8 3458 1 1 22 SER OG O -7.285 19.967 -19.921 1.00 . A A . 22 SER OG 1 1 8 3459 1 1 23 PHE C C -6.603 18.000 -25.117 1.00 . A A . 23 PHE C 1 1 8 3460 1 1 23 PHE CA C -5.550 17.876 -24.011 1.00 . A A . 23 PHE CA 1 1 8 3461 1 1 23 PHE CB C -4.492 16.828 -24.403 1.00 . A A . 23 PHE CB 1 1 8 3462 1 1 23 PHE CD1 C -2.873 18.226 -25.769 1.00 . A A . 23 PHE CD1 1 1 8 3463 1 1 23 PHE CD2 C -4.195 16.546 -26.926 1.00 . A A . 23 PHE CD2 1 1 8 3464 1 1 23 PHE CE1 C -2.274 18.582 -26.985 1.00 . A A . 23 PHE CE1 1 1 8 3465 1 1 23 PHE CE2 C -3.594 16.907 -28.136 1.00 . A A . 23 PHE CE2 1 1 8 3466 1 1 23 PHE CG C -3.835 17.206 -25.733 1.00 . A A . 23 PHE CG 1 1 8 3467 1 1 23 PHE CZ C -2.635 17.923 -28.167 1.00 . A A . 23 PHE CZ 1 1 8 3468 1 1 23 PHE H H -5.896 16.659 -22.303 1.00 . A A . 23 PHE H 1 1 8 3469 1 1 23 PHE HA H -5.060 18.832 -23.889 1.00 . A A . 23 PHE HA 1 1 8 3470 1 1 23 PHE HB2 H -3.735 16.784 -23.629 1.00 . A A . 23 PHE HB2 1 1 8 3471 1 1 23 PHE HB3 H -4.965 15.861 -24.482 1.00 . A A . 23 PHE HB3 1 1 8 3472 1 1 23 PHE HD1 H -2.591 18.738 -24.861 1.00 . A A . 23 PHE HD1 1 1 8 3473 1 1 23 PHE HD2 H -4.936 15.760 -26.908 1.00 . A A . 23 PHE HD2 1 1 8 3474 1 1 23 PHE HE1 H -1.534 19.368 -27.012 1.00 . A A . 23 PHE HE1 1 1 8 3475 1 1 23 PHE HE2 H -3.872 16.399 -29.048 1.00 . A A . 23 PHE HE2 1 1 8 3476 1 1 23 PHE HZ H -2.173 18.201 -29.103 1.00 . A A . 23 PHE HZ 1 1 8 3477 1 1 23 PHE N N -6.170 17.492 -22.740 1.00 . A A . 23 PHE N 1 1 8 3478 1 1 23 PHE O O -6.641 19.000 -25.832 1.00 . A A . 23 PHE O 1 1 8 3479 1 1 24 ARG C C -7.957 17.409 -27.643 1.00 . A A . 24 ARG C 1 1 8 3480 1 1 24 ARG CA C -8.509 16.977 -26.275 1.00 . A A . 24 ARG CA 1 1 8 3481 1 1 24 ARG CB C -9.650 17.912 -25.837 1.00 . A A . 24 ARG CB 1 1 8 3482 1 1 24 ARG CD C -11.408 18.321 -24.079 1.00 . A A . 24 ARG CD 1 1 8 3483 1 1 24 ARG CG C -10.292 17.376 -24.547 1.00 . A A . 24 ARG CG 1 1 8 3484 1 1 24 ARG CZ C -13.535 19.175 -24.929 1.00 . A A . 24 ARG CZ 1 1 8 3485 1 1 24 ARG H H -7.376 16.211 -24.651 1.00 . A A . 24 ARG H 1 1 8 3486 1 1 24 ARG HA H -8.897 15.971 -26.371 1.00 . A A . 24 ARG HA 1 1 8 3487 1 1 24 ARG HB2 H -9.249 18.899 -25.656 1.00 . A A . 24 ARG HB2 1 1 8 3488 1 1 24 ARG HB3 H -10.401 17.964 -26.613 1.00 . A A . 24 ARG HB3 1 1 8 3489 1 1 24 ARG HD2 H -11.810 17.961 -23.143 1.00 . A A . 24 ARG HD2 1 1 8 3490 1 1 24 ARG HD3 H -11.000 19.313 -23.932 1.00 . A A . 24 ARG HD3 1 1 8 3491 1 1 24 ARG HE H -12.419 17.802 -25.869 1.00 . A A . 24 ARG HE 1 1 8 3492 1 1 24 ARG HG2 H -10.704 16.394 -24.733 1.00 . A A . 24 ARG HG2 1 1 8 3493 1 1 24 ARG HG3 H -9.538 17.307 -23.774 1.00 . A A . 24 ARG HG3 1 1 8 3494 1 1 24 ARG HH11 H -12.942 19.924 -23.167 1.00 . A A . 24 ARG HH11 1 1 8 3495 1 1 24 ARG HH12 H -14.441 20.542 -23.777 1.00 . A A . 24 ARG HH12 1 1 8 3496 1 1 24 ARG HH21 H -14.380 18.613 -26.655 1.00 . A A . 24 ARG HH21 1 1 8 3497 1 1 24 ARG HH22 H -15.256 19.796 -25.743 1.00 . A A . 24 ARG HH22 1 1 8 3498 1 1 24 ARG N N -7.455 16.979 -25.250 1.00 . A A . 24 ARG N 1 1 8 3499 1 1 24 ARG NE N -12.479 18.371 -25.073 1.00 . A A . 24 ARG NE 1 1 8 3500 1 1 24 ARG NH1 N -13.648 19.941 -23.874 1.00 . A A . 24 ARG NH1 1 1 8 3501 1 1 24 ARG NH2 N -14.463 19.198 -25.847 1.00 . A A . 24 ARG NH2 1 1 8 3502 1 1 24 ARG O O -6.741 17.488 -27.822 1.00 . A A . 24 ARG O 1 1 8 3503 1 1 25 LYS C C -8.845 19.578 -30.178 1.00 . A A . 25 LYS C 1 1 8 3504 1 1 25 LYS CA C -8.471 18.107 -29.963 1.00 . A A . 25 LYS CA 1 1 8 3505 1 1 25 LYS CB C -9.198 17.219 -30.998 1.00 . A A . 25 LYS CB 1 1 8 3506 1 1 25 LYS CD C -9.365 16.578 -33.431 1.00 . A A . 25 LYS CD 1 1 8 3507 1 1 25 LYS CE C -8.845 16.866 -34.844 1.00 . A A . 25 LYS CE 1 1 8 3508 1 1 25 LYS CG C -8.694 17.525 -32.424 1.00 . A A . 25 LYS CG 1 1 8 3509 1 1 25 LYS H H -9.812 17.597 -28.386 1.00 . A A . 25 LYS H 1 1 8 3510 1 1 25 LYS HA H -7.399 17.995 -30.102 1.00 . A A . 25 LYS HA 1 1 8 3511 1 1 25 LYS HB2 H -9.005 16.181 -30.766 1.00 . A A . 25 LYS HB2 1 1 8 3512 1 1 25 LYS HB3 H -10.263 17.402 -30.950 1.00 . A A . 25 LYS HB3 1 1 8 3513 1 1 25 LYS HD2 H -9.140 15.554 -33.167 1.00 . A A . 25 LYS HD2 1 1 8 3514 1 1 25 LYS HD3 H -10.434 16.728 -33.407 1.00 . A A . 25 LYS HD3 1 1 8 3515 1 1 25 LYS HE2 H -9.092 17.881 -35.121 1.00 . A A . 25 LYS HE2 1 1 8 3516 1 1 25 LYS HE3 H -7.773 16.738 -34.867 1.00 . A A . 25 LYS HE3 1 1 8 3517 1 1 25 LYS HG2 H -8.932 18.547 -32.683 1.00 . A A . 25 LYS HG2 1 1 8 3518 1 1 25 LYS HG3 H -7.623 17.386 -32.464 1.00 . A A . 25 LYS HG3 1 1 8 3519 1 1 25 LYS HZ1 H -9.097 16.097 -36.761 1.00 . A A . 25 LYS HZ1 1 1 8 3520 1 1 25 LYS HZ2 H -10.507 16.065 -35.812 1.00 . A A . 25 LYS HZ2 1 1 8 3521 1 1 25 LYS HZ3 H -9.261 14.945 -35.528 1.00 . A A . 25 LYS HZ3 1 1 8 3522 1 1 25 LYS N N -8.860 17.683 -28.599 1.00 . A A . 25 LYS N 1 1 8 3523 1 1 25 LYS NZ N -9.476 15.922 -35.809 1.00 . A A . 25 LYS NZ 1 1 8 3524 1 1 25 LYS O O -9.955 19.999 -29.849 1.00 . A A . 25 LYS O 1 1 8 3525 1 1 26 ASP C C -9.291 21.952 -31.977 1.00 . A A . 26 ASP C 1 1 8 3526 1 1 26 ASP CA C -8.147 21.775 -30.979 1.00 . A A . 26 ASP CA 1 1 8 3527 1 1 26 ASP CB C -6.868 22.423 -31.532 1.00 . A A . 26 ASP CB 1 1 8 3528 1 1 26 ASP CG C -5.733 22.328 -30.512 1.00 . A A . 26 ASP CG 1 1 8 3529 1 1 26 ASP H H -7.043 19.964 -30.965 1.00 . A A . 26 ASP H 1 1 8 3530 1 1 26 ASP HA H -8.414 22.262 -30.050 1.00 . A A . 26 ASP HA 1 1 8 3531 1 1 26 ASP HB2 H -6.575 21.914 -32.439 1.00 . A A . 26 ASP HB2 1 1 8 3532 1 1 26 ASP HB3 H -7.056 23.465 -31.754 1.00 . A A . 26 ASP HB3 1 1 8 3533 1 1 26 ASP N N -7.909 20.354 -30.727 1.00 . A A . 26 ASP N 1 1 8 3534 1 1 26 ASP O O -9.273 21.275 -32.993 1.00 . A A . 26 ASP O 1 1 8 3535 1 1 26 ASP OD1 O -6.025 22.261 -29.327 1.00 . A A . 26 ASP OD1 1 1 8 3536 1 1 26 ASP OD2 O -4.587 22.324 -30.931 1.00 . A A . 26 ASP OD2 1 1 9 3537 1 1 1 MET C C 11.240 5.017 -0.919 1.00 . A A . 1 MET C 1 1 9 3538 1 1 1 MET CA C 12.103 4.439 -2.041 1.00 . A A . 1 MET CA 1 1 9 3539 1 1 1 MET CB C 12.114 5.388 -3.252 1.00 . A A . 1 MET CB 1 1 9 3540 1 1 1 MET CE C 13.925 7.342 -5.119 1.00 . A A . 1 MET CE 1 1 9 3541 1 1 1 MET CG C 13.039 4.829 -4.344 1.00 . A A . 1 MET CG 1 1 9 3542 1 1 1 MET H1 H 12.298 2.500 -2.775 1.00 . A A . 1 MET H1 1 1 9 3543 1 1 1 MET H2 H 10.855 3.273 -3.232 1.00 . A A . 1 MET H2 1 1 9 3544 1 1 1 MET H3 H 11.045 2.689 -1.647 1.00 . A A . 1 MET H3 1 1 9 3545 1 1 1 MET HA H 13.111 4.297 -1.679 1.00 . A A . 1 MET HA 1 1 9 3546 1 1 1 MET HB2 H 11.112 5.482 -3.644 1.00 . A A . 1 MET HB2 1 1 9 3547 1 1 1 MET HB3 H 12.473 6.357 -2.946 1.00 . A A . 1 MET HB3 1 1 9 3548 1 1 1 MET HE1 H 14.712 6.995 -4.464 1.00 . A A . 1 MET HE1 1 1 9 3549 1 1 1 MET HE2 H 13.254 7.978 -4.567 1.00 . A A . 1 MET HE2 1 1 9 3550 1 1 1 MET HE3 H 14.357 7.907 -5.934 1.00 . A A . 1 MET HE3 1 1 9 3551 1 1 1 MET HG2 H 14.044 4.749 -3.961 1.00 . A A . 1 MET HG2 1 1 9 3552 1 1 1 MET HG3 H 12.693 3.847 -4.636 1.00 . A A . 1 MET HG3 1 1 9 3553 1 1 1 MET N N 11.533 3.126 -2.455 1.00 . A A . 1 MET N 1 1 9 3554 1 1 1 MET O O 10.460 4.296 -0.298 1.00 . A A . 1 MET O 1 1 9 3555 1 1 1 MET SD S 13.013 5.925 -5.797 1.00 . A A . 1 MET SD 1 1 9 3556 1 1 2 LYS C C 9.122 6.940 0.040 1.00 . A A . 2 LYS C 1 1 9 3557 1 1 2 LYS CA C 10.616 6.981 0.389 1.00 . A A . 2 LYS CA 1 1 9 3558 1 1 2 LYS CB C 11.100 8.438 0.542 1.00 . A A . 2 LYS CB 1 1 9 3559 1 1 2 LYS CD C 10.990 10.524 1.944 1.00 . A A . 2 LYS CD 1 1 9 3560 1 1 2 LYS CE C 10.364 11.173 3.184 1.00 . A A . 2 LYS CE 1 1 9 3561 1 1 2 LYS CG C 10.458 9.093 1.778 1.00 . A A . 2 LYS CG 1 1 9 3562 1 1 2 LYS H H 12.026 6.840 -1.189 1.00 . A A . 2 LYS H 1 1 9 3563 1 1 2 LYS HA H 10.776 6.455 1.323 1.00 . A A . 2 LYS HA 1 1 9 3564 1 1 2 LYS HB2 H 12.175 8.440 0.654 1.00 . A A . 2 LYS HB2 1 1 9 3565 1 1 2 LYS HB3 H 10.834 9.003 -0.342 1.00 . A A . 2 LYS HB3 1 1 9 3566 1 1 2 LYS HD2 H 12.065 10.497 2.061 1.00 . A A . 2 LYS HD2 1 1 9 3567 1 1 2 LYS HD3 H 10.740 11.106 1.070 1.00 . A A . 2 LYS HD3 1 1 9 3568 1 1 2 LYS HE2 H 9.289 11.191 3.080 1.00 . A A . 2 LYS HE2 1 1 9 3569 1 1 2 LYS HE3 H 10.631 10.605 4.062 1.00 . A A . 2 LYS HE3 1 1 9 3570 1 1 2 LYS HG2 H 9.389 9.118 1.657 1.00 . A A . 2 LYS HG2 1 1 9 3571 1 1 2 LYS HG3 H 10.704 8.516 2.658 1.00 . A A . 2 LYS HG3 1 1 9 3572 1 1 2 LYS HZ1 H 11.039 12.780 4.327 1.00 . A A . 2 LYS HZ1 1 1 9 3573 1 1 2 LYS HZ2 H 10.168 13.233 2.940 1.00 . A A . 2 LYS HZ2 1 1 9 3574 1 1 2 LYS HZ3 H 11.764 12.666 2.798 1.00 . A A . 2 LYS HZ3 1 1 9 3575 1 1 2 LYS N N 11.388 6.318 -0.663 1.00 . A A . 2 LYS N 1 1 9 3576 1 1 2 LYS NZ N 10.873 12.568 3.323 1.00 . A A . 2 LYS NZ 1 1 9 3577 1 1 2 LYS O O 8.749 7.055 -1.125 1.00 . A A . 2 LYS O 1 1 9 3578 1 1 3 PHE C C 6.272 7.889 0.115 1.00 . A A . 3 PHE C 1 1 9 3579 1 1 3 PHE CA C 6.828 6.660 0.850 1.00 . A A . 3 PHE CA 1 1 9 3580 1 1 3 PHE CB C 6.125 6.501 2.209 1.00 . A A . 3 PHE CB 1 1 9 3581 1 1 3 PHE CD1 C 5.662 8.865 3.027 1.00 . A A . 3 PHE CD1 1 1 9 3582 1 1 3 PHE CD2 C 7.531 7.651 3.996 1.00 . A A . 3 PHE CD2 1 1 9 3583 1 1 3 PHE CE1 C 5.958 9.964 3.843 1.00 . A A . 3 PHE CE1 1 1 9 3584 1 1 3 PHE CE2 C 7.821 8.752 4.810 1.00 . A A . 3 PHE CE2 1 1 9 3585 1 1 3 PHE CG C 6.446 7.701 3.100 1.00 . A A . 3 PHE CG 1 1 9 3586 1 1 3 PHE CZ C 7.035 9.906 4.733 1.00 . A A . 3 PHE CZ 1 1 9 3587 1 1 3 PHE H H 8.641 6.644 1.960 1.00 . A A . 3 PHE H 1 1 9 3588 1 1 3 PHE HA H 6.619 5.784 0.255 1.00 . A A . 3 PHE HA 1 1 9 3589 1 1 3 PHE HB2 H 5.055 6.431 2.055 1.00 . A A . 3 PHE HB2 1 1 9 3590 1 1 3 PHE HB3 H 6.470 5.590 2.684 1.00 . A A . 3 PHE HB3 1 1 9 3591 1 1 3 PHE HD1 H 4.828 8.912 2.343 1.00 . A A . 3 PHE HD1 1 1 9 3592 1 1 3 PHE HD2 H 8.141 6.762 4.056 1.00 . A A . 3 PHE HD2 1 1 9 3593 1 1 3 PHE HE1 H 5.355 10.859 3.783 1.00 . A A . 3 PHE HE1 1 1 9 3594 1 1 3 PHE HE2 H 8.651 8.709 5.498 1.00 . A A . 3 PHE HE2 1 1 9 3595 1 1 3 PHE HZ H 7.262 10.755 5.362 1.00 . A A . 3 PHE HZ 1 1 9 3596 1 1 3 PHE N N 8.280 6.748 1.055 1.00 . A A . 3 PHE N 1 1 9 3597 1 1 3 PHE O O 5.264 7.799 -0.586 1.00 . A A . 3 PHE O 1 1 9 3598 1 1 4 TYR C C 6.577 10.134 -1.886 1.00 . A A . 4 TYR C 1 1 9 3599 1 1 4 TYR CA C 6.511 10.273 -0.355 1.00 . A A . 4 TYR CA 1 1 9 3600 1 1 4 TYR CB C 7.407 11.445 0.194 1.00 . A A . 4 TYR CB 1 1 9 3601 1 1 4 TYR CD1 C 8.803 12.283 -1.751 1.00 . A A . 4 TYR CD1 1 1 9 3602 1 1 4 TYR CD2 C 6.936 13.651 -1.009 1.00 . A A . 4 TYR CD2 1 1 9 3603 1 1 4 TYR CE1 C 9.099 13.227 -2.741 1.00 . A A . 4 TYR CE1 1 1 9 3604 1 1 4 TYR CE2 C 7.235 14.592 -2.002 1.00 . A A . 4 TYR CE2 1 1 9 3605 1 1 4 TYR CG C 7.719 12.492 -0.881 1.00 . A A . 4 TYR CG 1 1 9 3606 1 1 4 TYR CZ C 8.316 14.379 -2.866 1.00 . A A . 4 TYR CZ 1 1 9 3607 1 1 4 TYR H H 7.727 9.039 0.851 1.00 . A A . 4 TYR H 1 1 9 3608 1 1 4 TYR HA H 5.478 10.464 -0.088 1.00 . A A . 4 TYR HA 1 1 9 3609 1 1 4 TYR HB2 H 6.906 11.929 1.028 1.00 . A A . 4 TYR HB2 1 1 9 3610 1 1 4 TYR HB3 H 8.337 11.032 0.561 1.00 . A A . 4 TYR HB3 1 1 9 3611 1 1 4 TYR HD1 H 9.407 11.390 -1.650 1.00 . A A . 4 TYR HD1 1 1 9 3612 1 1 4 TYR HD2 H 6.102 13.814 -0.343 1.00 . A A . 4 TYR HD2 1 1 9 3613 1 1 4 TYR HE1 H 9.932 13.064 -3.411 1.00 . A A . 4 TYR HE1 1 1 9 3614 1 1 4 TYR HE2 H 6.631 15.482 -2.101 1.00 . A A . 4 TYR HE2 1 1 9 3615 1 1 4 TYR HH H 8.253 14.985 -4.676 1.00 . A A . 4 TYR HH 1 1 9 3616 1 1 4 TYR N N 6.932 9.027 0.284 1.00 . A A . 4 TYR N 1 1 9 3617 1 1 4 TYR O O 5.740 10.684 -2.602 1.00 . A A . 4 TYR O 1 1 9 3618 1 1 4 TYR OH O 8.607 15.309 -3.845 1.00 . A A . 4 TYR OH 1 1 9 3619 1 1 5 THR C C 6.549 8.544 -4.452 1.00 . A A . 5 THR C 1 1 9 3620 1 1 5 THR CA C 7.756 9.246 -3.820 1.00 . A A . 5 THR CA 1 1 9 3621 1 1 5 THR CB C 9.038 8.429 -4.081 1.00 . A A . 5 THR CB 1 1 9 3622 1 1 5 THR CG2 C 9.370 8.405 -5.580 1.00 . A A . 5 THR CG2 1 1 9 3623 1 1 5 THR H H 8.231 9.016 -1.765 1.00 . A A . 5 THR H 1 1 9 3624 1 1 5 THR HA H 7.868 10.223 -4.275 1.00 . A A . 5 THR HA 1 1 9 3625 1 1 5 THR HB H 8.902 7.415 -3.730 1.00 . A A . 5 THR HB 1 1 9 3626 1 1 5 THR HG1 H 9.831 9.888 -3.070 1.00 . A A . 5 THR HG1 1 1 9 3627 1 1 5 THR HG21 H 10.281 7.846 -5.737 1.00 . A A . 5 THR HG21 1 1 9 3628 1 1 5 THR HG22 H 9.506 9.416 -5.931 1.00 . A A . 5 THR HG22 1 1 9 3629 1 1 5 THR HG23 H 8.565 7.940 -6.126 1.00 . A A . 5 THR HG23 1 1 9 3630 1 1 5 THR N N 7.584 9.420 -2.378 1.00 . A A . 5 THR N 1 1 9 3631 1 1 5 THR O O 6.011 9.011 -5.455 1.00 . A A . 5 THR O 1 1 9 3632 1 1 5 THR OG1 O 10.117 9.024 -3.376 1.00 . A A . 5 THR OG1 1 1 9 3633 1 1 6 ILE C C 3.710 7.502 -4.282 1.00 . A A . 6 ILE C 1 1 9 3634 1 1 6 ILE CA C 4.983 6.673 -4.408 1.00 . A A . 6 ILE CA 1 1 9 3635 1 1 6 ILE CB C 4.819 5.308 -3.678 1.00 . A A . 6 ILE CB 1 1 9 3636 1 1 6 ILE CD1 C 6.907 4.530 -2.399 1.00 . A A . 6 ILE CD1 1 1 9 3637 1 1 6 ILE CG1 C 6.169 4.477 -3.743 1.00 . A A . 6 ILE CG1 1 1 9 3638 1 1 6 ILE CG2 C 3.661 4.502 -4.336 1.00 . A A . 6 ILE CG2 1 1 9 3639 1 1 6 ILE H H 6.587 7.090 -3.075 1.00 . A A . 6 ILE H 1 1 9 3640 1 1 6 ILE HA H 5.162 6.477 -5.459 1.00 . A A . 6 ILE HA 1 1 9 3641 1 1 6 ILE HB H 4.548 5.502 -2.644 1.00 . A A . 6 ILE HB 1 1 9 3642 1 1 6 ILE HD11 H 6.289 4.079 -1.636 1.00 . A A . 6 ILE HD11 1 1 9 3643 1 1 6 ILE HD12 H 7.104 5.555 -2.141 1.00 . A A . 6 ILE HD12 1 1 9 3644 1 1 6 ILE HD13 H 7.838 3.990 -2.476 1.00 . A A . 6 ILE HD13 1 1 9 3645 1 1 6 ILE HG12 H 5.964 3.438 -3.969 1.00 . A A . 6 ILE HG12 1 1 9 3646 1 1 6 ILE HG13 H 6.823 4.871 -4.513 1.00 . A A . 6 ILE HG13 1 1 9 3647 1 1 6 ILE HG21 H 2.715 4.988 -4.143 1.00 . A A . 6 ILE HG21 1 1 9 3648 1 1 6 ILE HG22 H 3.637 3.506 -3.920 1.00 . A A . 6 ILE HG22 1 1 9 3649 1 1 6 ILE HG23 H 3.821 4.435 -5.404 1.00 . A A . 6 ILE HG23 1 1 9 3650 1 1 6 ILE N N 6.127 7.420 -3.871 1.00 . A A . 6 ILE N 1 1 9 3651 1 1 6 ILE O O 2.896 7.554 -5.204 1.00 . A A . 6 ILE O 1 1 9 3652 1 1 7 LYS C C 2.254 10.092 -3.897 1.00 . A A . 7 LYS C 1 1 9 3653 1 1 7 LYS CA C 2.364 8.962 -2.878 1.00 . A A . 7 LYS CA 1 1 9 3654 1 1 7 LYS CB C 2.460 9.538 -1.447 1.00 . A A . 7 LYS CB 1 1 9 3655 1 1 7 LYS CD C 1.305 10.898 0.338 1.00 . A A . 7 LYS CD 1 1 9 3656 1 1 7 LYS CE C 0.111 11.811 0.646 1.00 . A A . 7 LYS CE 1 1 9 3657 1 1 7 LYS CG C 1.262 10.463 -1.134 1.00 . A A . 7 LYS CG 1 1 9 3658 1 1 7 LYS H H 4.225 8.057 -2.430 1.00 . A A . 7 LYS H 1 1 9 3659 1 1 7 LYS HA H 1.481 8.344 -2.945 1.00 . A A . 7 LYS HA 1 1 9 3660 1 1 7 LYS HB2 H 2.474 8.718 -0.741 1.00 . A A . 7 LYS HB2 1 1 9 3661 1 1 7 LYS HB3 H 3.378 10.100 -1.352 1.00 . A A . 7 LYS HB3 1 1 9 3662 1 1 7 LYS HD2 H 1.260 10.023 0.972 1.00 . A A . 7 LYS HD2 1 1 9 3663 1 1 7 LYS HD3 H 2.222 11.433 0.530 1.00 . A A . 7 LYS HD3 1 1 9 3664 1 1 7 LYS HE2 H 0.171 12.698 0.030 1.00 . A A . 7 LYS HE2 1 1 9 3665 1 1 7 LYS HE3 H -0.810 11.287 0.435 1.00 . A A . 7 LYS HE3 1 1 9 3666 1 1 7 LYS HG2 H 1.306 11.344 -1.758 1.00 . A A . 7 LYS HG2 1 1 9 3667 1 1 7 LYS HG3 H 0.346 9.935 -1.328 1.00 . A A . 7 LYS HG3 1 1 9 3668 1 1 7 LYS HZ1 H 0.746 11.532 2.608 1.00 . A A . 7 LYS HZ1 1 1 9 3669 1 1 7 LYS HZ2 H -0.821 12.174 2.473 1.00 . A A . 7 LYS HZ2 1 1 9 3670 1 1 7 LYS HZ3 H 0.532 13.158 2.178 1.00 . A A . 7 LYS HZ3 1 1 9 3671 1 1 7 LYS N N 3.544 8.141 -3.129 1.00 . A A . 7 LYS N 1 1 9 3672 1 1 7 LYS NZ N 0.145 12.198 2.084 1.00 . A A . 7 LYS NZ 1 1 9 3673 1 1 7 LYS O O 1.204 10.285 -4.509 1.00 . A A . 7 LYS O 1 1 9 3674 1 1 8 LEU C C 3.196 11.428 -6.426 1.00 . A A . 8 LEU C 1 1 9 3675 1 1 8 LEU CA C 3.347 11.954 -5.010 1.00 . A A . 8 LEU CA 1 1 9 3676 1 1 8 LEU CB C 4.654 12.771 -4.863 1.00 . A A . 8 LEU CB 1 1 9 3677 1 1 8 LEU CD1 C 3.493 15.089 -4.742 1.00 . A A . 8 LEU CD1 1 1 9 3678 1 1 8 LEU CD2 C 5.891 14.866 -5.559 1.00 . A A . 8 LEU CD2 1 1 9 3679 1 1 8 LEU CG C 4.512 14.184 -5.519 1.00 . A A . 8 LEU CG 1 1 9 3680 1 1 8 LEU H H 4.142 10.638 -3.557 1.00 . A A . 8 LEU H 1 1 9 3681 1 1 8 LEU HA H 2.500 12.585 -4.789 1.00 . A A . 8 LEU HA 1 1 9 3682 1 1 8 LEU HB2 H 4.881 12.876 -3.815 1.00 . A A . 8 LEU HB2 1 1 9 3683 1 1 8 LEU HB3 H 5.469 12.232 -5.337 1.00 . A A . 8 LEU HB3 1 1 9 3684 1 1 8 LEU HD11 H 3.494 14.848 -3.685 1.00 . A A . 8 LEU HD11 1 1 9 3685 1 1 8 LEU HD12 H 2.502 14.932 -5.139 1.00 . A A . 8 LEU HD12 1 1 9 3686 1 1 8 LEU HD13 H 3.744 16.137 -4.866 1.00 . A A . 8 LEU HD13 1 1 9 3687 1 1 8 LEU HD21 H 5.792 15.841 -6.015 1.00 . A A . 8 LEU HD21 1 1 9 3688 1 1 8 LEU HD22 H 6.576 14.266 -6.138 1.00 . A A . 8 LEU HD22 1 1 9 3689 1 1 8 LEU HD23 H 6.265 14.975 -4.554 1.00 . A A . 8 LEU HD23 1 1 9 3690 1 1 8 LEU HG H 4.158 14.058 -6.531 1.00 . A A . 8 LEU HG 1 1 9 3691 1 1 8 LEU N N 3.338 10.839 -4.068 1.00 . A A . 8 LEU N 1 1 9 3692 1 1 8 LEU O O 2.467 11.982 -7.240 1.00 . A A . 8 LEU O 1 1 9 3693 1 1 9 ALA C C 2.380 9.434 -8.411 1.00 . A A . 9 ALA C 1 1 9 3694 1 1 9 ALA CA C 3.835 9.739 -8.041 1.00 . A A . 9 ALA CA 1 1 9 3695 1 1 9 ALA CB C 4.661 8.448 -8.082 1.00 . A A . 9 ALA CB 1 1 9 3696 1 1 9 ALA H H 4.465 9.943 -6.024 1.00 . A A . 9 ALA H 1 1 9 3697 1 1 9 ALA HA H 4.241 10.440 -8.747 1.00 . A A . 9 ALA HA 1 1 9 3698 1 1 9 ALA HB1 H 4.278 7.755 -7.348 1.00 . A A . 9 ALA HB1 1 1 9 3699 1 1 9 ALA HB2 H 5.694 8.673 -7.860 1.00 . A A . 9 ALA HB2 1 1 9 3700 1 1 9 ALA HB3 H 4.596 8.005 -9.065 1.00 . A A . 9 ALA HB3 1 1 9 3701 1 1 9 ALA N N 3.896 10.340 -6.714 1.00 . A A . 9 ALA N 1 1 9 3702 1 1 9 ALA O O 1.966 9.616 -9.554 1.00 . A A . 9 ALA O 1 1 9 3703 1 1 10 LYS C C -0.574 9.973 -7.903 1.00 . A A . 10 LYS C 1 1 9 3704 1 1 10 LYS CA C 0.194 8.681 -7.605 1.00 . A A . 10 LYS CA 1 1 9 3705 1 1 10 LYS CB C -0.347 7.982 -6.322 1.00 . A A . 10 LYS CB 1 1 9 3706 1 1 10 LYS CD C -1.346 5.729 -7.151 1.00 . A A . 10 LYS CD 1 1 9 3707 1 1 10 LYS CE C -0.877 4.764 -6.028 1.00 . A A . 10 LYS CE 1 1 9 3708 1 1 10 LYS CG C -1.657 7.165 -6.605 1.00 . A A . 10 LYS CG 1 1 9 3709 1 1 10 LYS H H 2.006 8.883 -6.524 1.00 . A A . 10 LYS H 1 1 9 3710 1 1 10 LYS HA H 0.086 8.023 -8.456 1.00 . A A . 10 LYS HA 1 1 9 3711 1 1 10 LYS HB2 H 0.420 7.325 -5.943 1.00 . A A . 10 LYS HB2 1 1 9 3712 1 1 10 LYS HB3 H -0.549 8.733 -5.565 1.00 . A A . 10 LYS HB3 1 1 9 3713 1 1 10 LYS HD2 H -2.243 5.318 -7.597 1.00 . A A . 10 LYS HD2 1 1 9 3714 1 1 10 LYS HD3 H -0.580 5.786 -7.910 1.00 . A A . 10 LYS HD3 1 1 9 3715 1 1 10 LYS HE2 H 0.148 4.977 -5.748 1.00 . A A . 10 LYS HE2 1 1 9 3716 1 1 10 LYS HE3 H -1.512 4.861 -5.161 1.00 . A A . 10 LYS HE3 1 1 9 3717 1 1 10 LYS HG2 H -2.236 7.082 -5.692 1.00 . A A . 10 LYS HG2 1 1 9 3718 1 1 10 LYS HG3 H -2.258 7.698 -7.335 1.00 . A A . 10 LYS HG3 1 1 9 3719 1 1 10 LYS HZ1 H 0.000 3.025 -6.764 1.00 . A A . 10 LYS HZ1 1 1 9 3720 1 1 10 LYS HZ2 H -1.548 3.339 -7.390 1.00 . A A . 10 LYS HZ2 1 1 9 3721 1 1 10 LYS HZ3 H -1.371 2.754 -5.804 1.00 . A A . 10 LYS HZ3 1 1 9 3722 1 1 10 LYS N N 1.613 8.989 -7.416 1.00 . A A . 10 LYS N 1 1 9 3723 1 1 10 LYS NZ N -0.955 3.365 -6.534 1.00 . A A . 10 LYS NZ 1 1 9 3724 1 1 10 LYS O O -1.412 10.016 -8.803 1.00 . A A . 10 LYS O 1 1 9 3725 1 1 11 PHE C C -0.613 12.821 -8.761 1.00 . A A . 11 PHE C 1 1 9 3726 1 1 11 PHE CA C -0.897 12.334 -7.344 1.00 . A A . 11 PHE CA 1 1 9 3727 1 1 11 PHE CB C -0.329 13.323 -6.313 1.00 . A A . 11 PHE CB 1 1 9 3728 1 1 11 PHE CD1 C -2.321 14.882 -6.145 1.00 . A A . 11 PHE CD1 1 1 9 3729 1 1 11 PHE CD2 C -0.195 15.820 -6.871 1.00 . A A . 11 PHE CD2 1 1 9 3730 1 1 11 PHE CE1 C -2.910 16.148 -6.252 1.00 . A A . 11 PHE CE1 1 1 9 3731 1 1 11 PHE CE2 C -0.789 17.082 -6.972 1.00 . A A . 11 PHE CE2 1 1 9 3732 1 1 11 PHE CG C -0.962 14.706 -6.453 1.00 . A A . 11 PHE CG 1 1 9 3733 1 1 11 PHE CZ C -2.144 17.246 -6.663 1.00 . A A . 11 PHE CZ 1 1 9 3734 1 1 11 PHE H H 0.432 10.937 -6.461 1.00 . A A . 11 PHE H 1 1 9 3735 1 1 11 PHE HA H -1.964 12.238 -7.203 1.00 . A A . 11 PHE HA 1 1 9 3736 1 1 11 PHE HB2 H -0.528 12.941 -5.329 1.00 . A A . 11 PHE HB2 1 1 9 3737 1 1 11 PHE HB3 H 0.736 13.392 -6.442 1.00 . A A . 11 PHE HB3 1 1 9 3738 1 1 11 PHE HD1 H -2.917 14.038 -5.826 1.00 . A A . 11 PHE HD1 1 1 9 3739 1 1 11 PHE HD2 H 0.856 15.702 -7.113 1.00 . A A . 11 PHE HD2 1 1 9 3740 1 1 11 PHE HE1 H -3.956 16.279 -6.015 1.00 . A A . 11 PHE HE1 1 1 9 3741 1 1 11 PHE HE2 H -0.201 17.930 -7.292 1.00 . A A . 11 PHE HE2 1 1 9 3742 1 1 11 PHE HZ H -2.600 18.222 -6.742 1.00 . A A . 11 PHE HZ 1 1 9 3743 1 1 11 PHE N N -0.258 11.031 -7.150 1.00 . A A . 11 PHE N 1 1 9 3744 1 1 11 PHE O O -1.515 13.222 -9.493 1.00 . A A . 11 PHE O 1 1 9 3745 1 1 12 LEU C C 0.499 12.193 -11.508 1.00 . A A . 12 LEU C 1 1 9 3746 1 1 12 LEU CA C 1.099 13.138 -10.469 1.00 . A A . 12 LEU CA 1 1 9 3747 1 1 12 LEU CB C 2.637 13.068 -10.546 1.00 . A A . 12 LEU CB 1 1 9 3748 1 1 12 LEU CD1 C 4.814 13.819 -9.501 1.00 . A A . 12 LEU CD1 1 1 9 3749 1 1 12 LEU CD2 C 3.061 15.558 -10.043 1.00 . A A . 12 LEU CD2 1 1 9 3750 1 1 12 LEU CG C 3.297 14.093 -9.578 1.00 . A A . 12 LEU CG 1 1 9 3751 1 1 12 LEU H H 1.309 12.394 -8.491 1.00 . A A . 12 LEU H 1 1 9 3752 1 1 12 LEU HA H 0.769 14.138 -10.686 1.00 . A A . 12 LEU HA 1 1 9 3753 1 1 12 LEU HB2 H 2.945 12.066 -10.278 1.00 . A A . 12 LEU HB2 1 1 9 3754 1 1 12 LEU HB3 H 2.959 13.274 -11.560 1.00 . A A . 12 LEU HB3 1 1 9 3755 1 1 12 LEU HD11 H 4.982 12.810 -9.153 1.00 . A A . 12 LEU HD11 1 1 9 3756 1 1 12 LEU HD12 H 5.270 14.516 -8.812 1.00 . A A . 12 LEU HD12 1 1 9 3757 1 1 12 LEU HD13 H 5.252 13.941 -10.479 1.00 . A A . 12 LEU HD13 1 1 9 3758 1 1 12 LEU HD21 H 3.761 16.219 -9.546 1.00 . A A . 12 LEU HD21 1 1 9 3759 1 1 12 LEU HD22 H 2.062 15.864 -9.779 1.00 . A A . 12 LEU HD22 1 1 9 3760 1 1 12 LEU HD23 H 3.194 15.640 -11.113 1.00 . A A . 12 LEU HD23 1 1 9 3761 1 1 12 LEU HG H 2.872 13.966 -8.594 1.00 . A A . 12 LEU HG 1 1 9 3762 1 1 12 LEU N N 0.655 12.744 -9.131 1.00 . A A . 12 LEU N 1 1 9 3763 1 1 12 LEU O O 0.111 12.617 -12.589 1.00 . A A . 12 LEU O 1 1 9 3764 1 1 13 GLY C C -1.546 10.140 -12.401 1.00 . A A . 13 GLY C 1 1 9 3765 1 1 13 GLY CA C -0.077 9.896 -12.085 1.00 . A A . 13 GLY CA 1 1 9 3766 1 1 13 GLY H H 0.792 10.631 -10.297 1.00 . A A . 13 GLY H 1 1 9 3767 1 1 13 GLY HA2 H 0.488 9.923 -13.003 1.00 . A A . 13 GLY HA2 1 1 9 3768 1 1 13 GLY HA3 H 0.032 8.931 -11.645 1.00 . A A . 13 GLY HA3 1 1 9 3769 1 1 13 GLY N N 0.452 10.907 -11.172 1.00 . A A . 13 GLY N 1 1 9 3770 1 1 13 GLY O O -2.063 9.673 -13.414 1.00 . A A . 13 GLY O 1 1 9 3771 1 1 14 GLY C C -3.722 12.362 -12.743 1.00 . A A . 14 GLY C 1 1 9 3772 1 1 14 GLY CA C -3.641 11.196 -11.763 1.00 . A A . 14 GLY CA 1 1 9 3773 1 1 14 GLY H H -1.778 11.227 -10.738 1.00 . A A . 14 GLY H 1 1 9 3774 1 1 14 GLY HA2 H -4.168 10.338 -12.169 1.00 . A A . 14 GLY HA2 1 1 9 3775 1 1 14 GLY HA3 H -4.099 11.488 -10.832 1.00 . A A . 14 GLY HA3 1 1 9 3776 1 1 14 GLY N N -2.230 10.876 -11.533 1.00 . A A . 14 GLY N 1 1 9 3777 1 1 14 GLY O O -4.531 12.371 -13.670 1.00 . A A . 14 GLY O 1 1 9 3778 1 1 15 ILE C C -2.138 14.258 -14.684 1.00 . A A . 15 ILE C 1 1 9 3779 1 1 15 ILE CA C -2.760 14.552 -13.324 1.00 . A A . 15 ILE CA 1 1 9 3780 1 1 15 ILE CB C -1.916 15.613 -12.575 1.00 . A A . 15 ILE CB 1 1 9 3781 1 1 15 ILE CD1 C -1.576 16.702 -10.318 1.00 . A A . 15 ILE CD1 1 1 9 3782 1 1 15 ILE CG1 C -2.550 15.897 -11.182 1.00 . A A . 15 ILE CG1 1 1 9 3783 1 1 15 ILE CG2 C -1.847 16.930 -13.392 1.00 . A A . 15 ILE CG2 1 1 9 3784 1 1 15 ILE H H -2.240 13.251 -11.750 1.00 . A A . 15 ILE H 1 1 9 3785 1 1 15 ILE HA H -3.754 14.950 -13.480 1.00 . A A . 15 ILE HA 1 1 9 3786 1 1 15 ILE HB H -0.912 15.225 -12.444 1.00 . A A . 15 ILE HB 1 1 9 3787 1 1 15 ILE HD11 H -1.317 17.623 -10.819 1.00 . A A . 15 ILE HD11 1 1 9 3788 1 1 15 ILE HD12 H -0.682 16.119 -10.153 1.00 . A A . 15 ILE HD12 1 1 9 3789 1 1 15 ILE HD13 H -2.043 16.924 -9.374 1.00 . A A . 15 ILE HD13 1 1 9 3790 1 1 15 ILE HG12 H -3.466 16.458 -11.301 1.00 . A A . 15 ILE HG12 1 1 9 3791 1 1 15 ILE HG13 H -2.772 14.970 -10.674 1.00 . A A . 15 ILE HG13 1 1 9 3792 1 1 15 ILE HG21 H -1.304 16.770 -14.312 1.00 . A A . 15 ILE HG21 1 1 9 3793 1 1 15 ILE HG22 H -1.338 17.691 -12.816 1.00 . A A . 15 ILE HG22 1 1 9 3794 1 1 15 ILE HG23 H -2.849 17.266 -13.619 1.00 . A A . 15 ILE HG23 1 1 9 3795 1 1 15 ILE N N -2.853 13.344 -12.506 1.00 . A A . 15 ILE N 1 1 9 3796 1 1 15 ILE O O -2.550 14.828 -15.692 1.00 . A A . 15 ILE O 1 1 9 3797 1 1 16 VAL C C -1.458 12.663 -17.030 1.00 . A A . 16 VAL C 1 1 9 3798 1 1 16 VAL CA C -0.430 13.108 -15.981 1.00 . A A . 16 VAL CA 1 1 9 3799 1 1 16 VAL CB C 0.695 12.038 -15.757 1.00 . A A . 16 VAL CB 1 1 9 3800 1 1 16 VAL CG1 C 0.125 10.601 -15.733 1.00 . A A . 16 VAL CG1 1 1 9 3801 1 1 16 VAL CG2 C 1.760 12.135 -16.872 1.00 . A A . 16 VAL CG2 1 1 9 3802 1 1 16 VAL H H -0.793 12.989 -13.887 1.00 . A A . 16 VAL H 1 1 9 3803 1 1 16 VAL HA H 0.016 14.029 -16.316 1.00 . A A . 16 VAL HA 1 1 9 3804 1 1 16 VAL HB H 1.168 12.233 -14.798 1.00 . A A . 16 VAL HB 1 1 9 3805 1 1 16 VAL HG11 H -0.709 10.571 -15.063 1.00 . A A . 16 VAL HG11 1 1 9 3806 1 1 16 VAL HG12 H 0.885 9.913 -15.395 1.00 . A A . 16 VAL HG12 1 1 9 3807 1 1 16 VAL HG13 H -0.200 10.309 -16.722 1.00 . A A . 16 VAL HG13 1 1 9 3808 1 1 16 VAL HG21 H 2.206 13.118 -16.863 1.00 . A A . 16 VAL HG21 1 1 9 3809 1 1 16 VAL HG22 H 1.290 11.961 -17.829 1.00 . A A . 16 VAL HG22 1 1 9 3810 1 1 16 VAL HG23 H 2.527 11.391 -16.707 1.00 . A A . 16 VAL HG23 1 1 9 3811 1 1 16 VAL N N -1.111 13.400 -14.717 1.00 . A A . 16 VAL N 1 1 9 3812 1 1 16 VAL O O -1.443 13.114 -18.176 1.00 . A A . 16 VAL O 1 1 9 3813 1 1 17 ARG C C -4.386 12.469 -17.786 1.00 . A A . 17 ARG C 1 1 9 3814 1 1 17 ARG CA C -3.450 11.315 -17.421 1.00 . A A . 17 ARG CA 1 1 9 3815 1 1 17 ARG CB C -4.203 10.222 -16.637 1.00 . A A . 17 ARG CB 1 1 9 3816 1 1 17 ARG CD C -5.054 9.020 -18.735 1.00 . A A . 17 ARG CD 1 1 9 3817 1 1 17 ARG CG C -5.441 9.679 -17.395 1.00 . A A . 17 ARG CG 1 1 9 3818 1 1 17 ARG CZ C -7.227 8.816 -19.871 1.00 . A A . 17 ARG CZ 1 1 9 3819 1 1 17 ARG H H -2.330 11.522 -15.652 1.00 . A A . 17 ARG H 1 1 9 3820 1 1 17 ARG HA H -3.035 10.892 -18.320 1.00 . A A . 17 ARG HA 1 1 9 3821 1 1 17 ARG HB2 H -3.528 9.399 -16.445 1.00 . A A . 17 ARG HB2 1 1 9 3822 1 1 17 ARG HB3 H -4.524 10.635 -15.691 1.00 . A A . 17 ARG HB3 1 1 9 3823 1 1 17 ARG HD2 H -4.784 9.778 -19.460 1.00 . A A . 17 ARG HD2 1 1 9 3824 1 1 17 ARG HD3 H -4.212 8.357 -18.586 1.00 . A A . 17 ARG HD3 1 1 9 3825 1 1 17 ARG HE H -6.198 7.271 -19.111 1.00 . A A . 17 ARG HE 1 1 9 3826 1 1 17 ARG HG2 H -5.920 8.938 -16.775 1.00 . A A . 17 ARG HG2 1 1 9 3827 1 1 17 ARG HG3 H -6.143 10.480 -17.575 1.00 . A A . 17 ARG HG3 1 1 9 3828 1 1 17 ARG HH11 H -6.476 10.670 -19.759 1.00 . A A . 17 ARG HH11 1 1 9 3829 1 1 17 ARG HH12 H -8.013 10.534 -20.542 1.00 . A A . 17 ARG HH12 1 1 9 3830 1 1 17 ARG HH21 H -8.213 7.094 -20.132 1.00 . A A . 17 ARG HH21 1 1 9 3831 1 1 17 ARG HH22 H -8.998 8.508 -20.755 1.00 . A A . 17 ARG HH22 1 1 9 3832 1 1 17 ARG N N -2.369 11.810 -16.586 1.00 . A A . 17 ARG N 1 1 9 3833 1 1 17 ARG NE N -6.193 8.241 -19.244 1.00 . A A . 17 ARG NE 1 1 9 3834 1 1 17 ARG NH1 N -7.240 10.108 -20.074 1.00 . A A . 17 ARG NH1 1 1 9 3835 1 1 17 ARG NH2 N -8.224 8.083 -20.285 1.00 . A A . 17 ARG NH2 1 1 9 3836 1 1 17 ARG O O -4.898 12.531 -18.904 1.00 . A A . 17 ARG O 1 1 9 3837 1 1 18 ALA C C -5.030 15.389 -18.183 1.00 . A A . 18 ALA C 1 1 9 3838 1 1 18 ALA CA C -5.529 14.494 -17.050 1.00 . A A . 18 ALA CA 1 1 9 3839 1 1 18 ALA CB C -5.681 15.320 -15.758 1.00 . A A . 18 ALA CB 1 1 9 3840 1 1 18 ALA H H -4.202 13.260 -15.948 1.00 . A A . 18 ALA H 1 1 9 3841 1 1 18 ALA HA H -6.498 14.105 -17.317 1.00 . A A . 18 ALA HA 1 1 9 3842 1 1 18 ALA HB1 H -4.757 15.833 -15.537 1.00 . A A . 18 ALA HB1 1 1 9 3843 1 1 18 ALA HB2 H -5.928 14.661 -14.938 1.00 . A A . 18 ALA HB2 1 1 9 3844 1 1 18 ALA HB3 H -6.472 16.049 -15.882 1.00 . A A . 18 ALA HB3 1 1 9 3845 1 1 18 ALA N N -4.627 13.366 -16.825 1.00 . A A . 18 ALA N 1 1 9 3846 1 1 18 ALA O O -5.816 15.846 -19.008 1.00 . A A . 18 ALA O 1 1 9 3847 1 1 19 MET C C -3.341 15.889 -20.619 1.00 . A A . 19 MET C 1 1 9 3848 1 1 19 MET CA C -3.128 16.487 -19.233 1.00 . A A . 19 MET CA 1 1 9 3849 1 1 19 MET CB C -1.615 16.604 -18.948 1.00 . A A . 19 MET CB 1 1 9 3850 1 1 19 MET CE C 1.122 16.579 -17.019 1.00 . A A . 19 MET CE 1 1 9 3851 1 1 19 MET CG C -1.324 17.596 -17.787 1.00 . A A . 19 MET CG 1 1 9 3852 1 1 19 MET H H -3.142 15.255 -17.532 1.00 . A A . 19 MET H 1 1 9 3853 1 1 19 MET HA H -3.587 17.464 -19.207 1.00 . A A . 19 MET HA 1 1 9 3854 1 1 19 MET HB2 H -1.237 15.625 -18.681 1.00 . A A . 19 MET HB2 1 1 9 3855 1 1 19 MET HB3 H -1.116 16.927 -19.832 1.00 . A A . 19 MET HB3 1 1 9 3856 1 1 19 MET HE1 H 0.604 16.374 -16.093 1.00 . A A . 19 MET HE1 1 1 9 3857 1 1 19 MET HE2 H 2.168 16.738 -16.812 1.00 . A A . 19 MET HE2 1 1 9 3858 1 1 19 MET HE3 H 1.016 15.743 -17.696 1.00 . A A . 19 MET HE3 1 1 9 3859 1 1 19 MET HG2 H -1.914 18.491 -17.909 1.00 . A A . 19 MET HG2 1 1 9 3860 1 1 19 MET HG3 H -1.578 17.131 -16.839 1.00 . A A . 19 MET HG3 1 1 9 3861 1 1 19 MET N N -3.722 15.639 -18.211 1.00 . A A . 19 MET N 1 1 9 3862 1 1 19 MET O O -3.777 16.567 -21.545 1.00 . A A . 19 MET O 1 1 9 3863 1 1 19 MET SD S 0.432 18.063 -17.787 1.00 . A A . 19 MET SD 1 1 9 3864 1 1 20 LEU C C -4.679 13.965 -22.411 1.00 . A A . 20 LEU C 1 1 9 3865 1 1 20 LEU CA C -3.206 13.921 -22.025 1.00 . A A . 20 LEU CA 1 1 9 3866 1 1 20 LEU CB C -2.763 12.455 -21.890 1.00 . A A . 20 LEU CB 1 1 9 3867 1 1 20 LEU CD1 C -0.883 10.856 -21.386 1.00 . A A . 20 LEU CD1 1 1 9 3868 1 1 20 LEU CD2 C -0.438 12.841 -22.904 1.00 . A A . 20 LEU CD2 1 1 9 3869 1 1 20 LEU CG C -1.233 12.333 -21.666 1.00 . A A . 20 LEU CG 1 1 9 3870 1 1 20 LEU H H -2.685 14.132 -19.971 1.00 . A A . 20 LEU H 1 1 9 3871 1 1 20 LEU HA H -2.632 14.413 -22.790 1.00 . A A . 20 LEU HA 1 1 9 3872 1 1 20 LEU HB2 H -3.272 12.027 -21.049 1.00 . A A . 20 LEU HB2 1 1 9 3873 1 1 20 LEU HB3 H -3.042 11.914 -22.777 1.00 . A A . 20 LEU HB3 1 1 9 3874 1 1 20 LEU HD11 H -1.180 10.250 -22.230 1.00 . A A . 20 LEU HD11 1 1 9 3875 1 1 20 LEU HD12 H -1.405 10.522 -20.502 1.00 . A A . 20 LEU HD12 1 1 9 3876 1 1 20 LEU HD13 H 0.182 10.759 -21.232 1.00 . A A . 20 LEU HD13 1 1 9 3877 1 1 20 LEU HD21 H -0.317 13.910 -22.828 1.00 . A A . 20 LEU HD21 1 1 9 3878 1 1 20 LEU HD22 H -0.967 12.606 -23.815 1.00 . A A . 20 LEU HD22 1 1 9 3879 1 1 20 LEU HD23 H 0.543 12.383 -22.937 1.00 . A A . 20 LEU HD23 1 1 9 3880 1 1 20 LEU HG H -0.960 12.923 -20.800 1.00 . A A . 20 LEU HG 1 1 9 3881 1 1 20 LEU N N -3.035 14.614 -20.748 1.00 . A A . 20 LEU N 1 1 9 3882 1 1 20 LEU O O -5.036 14.163 -23.571 1.00 . A A . 20 LEU O 1 1 9 3883 1 1 21 GLY C C -7.417 15.220 -21.970 1.00 . A A . 21 GLY C 1 1 9 3884 1 1 21 GLY CA C -6.962 13.813 -21.600 1.00 . A A . 21 GLY CA 1 1 9 3885 1 1 21 GLY H H -5.147 13.645 -20.509 1.00 . A A . 21 GLY H 1 1 9 3886 1 1 21 GLY HA2 H -7.239 13.125 -22.389 1.00 . A A . 21 GLY HA2 1 1 9 3887 1 1 21 GLY HA3 H -7.449 13.517 -20.683 1.00 . A A . 21 GLY HA3 1 1 9 3888 1 1 21 GLY N N -5.515 13.786 -21.407 1.00 . A A . 21 GLY N 1 1 9 3889 1 1 21 GLY O O -8.449 15.401 -22.617 1.00 . A A . 21 GLY O 1 1 9 3890 1 1 22 SER C C -6.683 17.974 -23.273 1.00 . A A . 22 SER C 1 1 9 3891 1 1 22 SER CA C -6.968 17.628 -21.813 1.00 . A A . 22 SER CA 1 1 9 3892 1 1 22 SER CB C -6.142 18.553 -20.891 1.00 . A A . 22 SER CB 1 1 9 3893 1 1 22 SER H H -5.832 16.002 -21.024 1.00 . A A . 22 SER H 1 1 9 3894 1 1 22 SER HA H -8.025 17.792 -21.618 1.00 . A A . 22 SER HA 1 1 9 3895 1 1 22 SER HB2 H -6.626 19.513 -20.791 1.00 . A A . 22 SER HB2 1 1 9 3896 1 1 22 SER HB3 H -6.058 18.097 -19.912 1.00 . A A . 22 SER HB3 1 1 9 3897 1 1 22 SER HG H -4.380 19.380 -20.879 1.00 . A A . 22 SER HG 1 1 9 3898 1 1 22 SER N N -6.642 16.219 -21.538 1.00 . A A . 22 SER N 1 1 9 3899 1 1 22 SER O O -7.223 18.941 -23.809 1.00 . A A . 22 SER O 1 1 9 3900 1 1 22 SER OG O -4.845 18.752 -21.438 1.00 . A A . 22 SER OG 1 1 9 3901 1 1 23 PHE C C -6.707 17.330 -26.205 1.00 . A A . 23 PHE C 1 1 9 3902 1 1 23 PHE CA C -5.466 17.404 -25.310 1.00 . A A . 23 PHE CA 1 1 9 3903 1 1 23 PHE CB C -4.432 16.354 -25.755 1.00 . A A . 23 PHE CB 1 1 9 3904 1 1 23 PHE CD1 C -3.081 17.727 -27.404 1.00 . A A . 23 PHE CD1 1 1 9 3905 1 1 23 PHE CD2 C -4.365 15.852 -28.264 1.00 . A A . 23 PHE CD2 1 1 9 3906 1 1 23 PHE CE1 C -2.629 18.007 -28.700 1.00 . A A . 23 PHE CE1 1 1 9 3907 1 1 23 PHE CE2 C -3.909 16.137 -29.557 1.00 . A A . 23 PHE CE2 1 1 9 3908 1 1 23 PHE CG C -3.951 16.648 -27.177 1.00 . A A . 23 PHE CG 1 1 9 3909 1 1 23 PHE CZ C -3.043 17.213 -29.775 1.00 . A A . 23 PHE CZ 1 1 9 3910 1 1 23 PHE H H -5.429 16.422 -23.427 1.00 . A A . 23 PHE H 1 1 9 3911 1 1 23 PHE HA H -5.027 18.389 -25.400 1.00 . A A . 23 PHE HA 1 1 9 3912 1 1 23 PHE HB2 H -3.587 16.384 -25.079 1.00 . A A . 23 PHE HB2 1 1 9 3913 1 1 23 PHE HB3 H -4.880 15.369 -25.708 1.00 . A A . 23 PHE HB3 1 1 9 3914 1 1 23 PHE HD1 H -2.759 18.345 -26.578 1.00 . A A . 23 PHE HD1 1 1 9 3915 1 1 23 PHE HD2 H -5.034 15.019 -28.104 1.00 . A A . 23 PHE HD2 1 1 9 3916 1 1 23 PHE HE1 H -1.961 18.838 -28.870 1.00 . A A . 23 PHE HE1 1 1 9 3917 1 1 23 PHE HE2 H -4.229 15.525 -30.388 1.00 . A A . 23 PHE HE2 1 1 9 3918 1 1 23 PHE HZ H -2.693 17.429 -30.773 1.00 . A A . 23 PHE HZ 1 1 9 3919 1 1 23 PHE N N -5.828 17.176 -23.910 1.00 . A A . 23 PHE N 1 1 9 3920 1 1 23 PHE O O -6.909 18.177 -27.076 1.00 . A A . 23 PHE O 1 1 9 3921 1 1 24 ARG C C -9.684 17.331 -26.606 1.00 . A A . 24 ARG C 1 1 9 3922 1 1 24 ARG CA C -8.753 16.122 -26.759 1.00 . A A . 24 ARG CA 1 1 9 3923 1 1 24 ARG CB C -9.476 14.851 -26.280 1.00 . A A . 24 ARG CB 1 1 9 3924 1 1 24 ARG CD C -9.297 12.350 -26.016 1.00 . A A . 24 ARG CD 1 1 9 3925 1 1 24 ARG CG C -8.594 13.615 -26.535 1.00 . A A . 24 ARG CG 1 1 9 3926 1 1 24 ARG CZ C -9.985 11.419 -23.862 1.00 . A A . 24 ARG CZ 1 1 9 3927 1 1 24 ARG H H -7.317 15.670 -25.267 1.00 . A A . 24 ARG H 1 1 9 3928 1 1 24 ARG HA H -8.492 16.006 -27.803 1.00 . A A . 24 ARG HA 1 1 9 3929 1 1 24 ARG HB2 H -9.677 14.936 -25.221 1.00 . A A . 24 ARG HB2 1 1 9 3930 1 1 24 ARG HB3 H -10.408 14.737 -26.814 1.00 . A A . 24 ARG HB3 1 1 9 3931 1 1 24 ARG HD2 H -10.285 12.276 -26.447 1.00 . A A . 24 ARG HD2 1 1 9 3932 1 1 24 ARG HD3 H -8.721 11.480 -26.300 1.00 . A A . 24 ARG HD3 1 1 9 3933 1 1 24 ARG HE H -9.025 13.166 -24.077 1.00 . A A . 24 ARG HE 1 1 9 3934 1 1 24 ARG HG2 H -8.416 13.520 -27.598 1.00 . A A . 24 ARG HG2 1 1 9 3935 1 1 24 ARG HG3 H -7.650 13.734 -26.023 1.00 . A A . 24 ARG HG3 1 1 9 3936 1 1 24 ARG HH11 H -10.503 10.349 -25.476 1.00 . A A . 24 ARG HH11 1 1 9 3937 1 1 24 ARG HH12 H -10.956 9.668 -23.948 1.00 . A A . 24 ARG HH12 1 1 9 3938 1 1 24 ARG HH21 H -9.623 12.271 -22.087 1.00 . A A . 24 ARG HH21 1 1 9 3939 1 1 24 ARG HH22 H -10.461 10.755 -22.034 1.00 . A A . 24 ARG HH22 1 1 9 3940 1 1 24 ARG N N -7.532 16.309 -25.978 1.00 . A A . 24 ARG N 1 1 9 3941 1 1 24 ARG NE N -9.403 12.399 -24.558 1.00 . A A . 24 ARG NE 1 1 9 3942 1 1 24 ARG NH1 N -10.524 10.400 -24.476 1.00 . A A . 24 ARG NH1 1 1 9 3943 1 1 24 ARG NH2 N -10.027 11.487 -22.560 1.00 . A A . 24 ARG NH2 1 1 9 3944 1 1 24 ARG O O -10.345 17.488 -25.579 1.00 . A A . 24 ARG O 1 1 9 3945 1 1 25 LYS C C -10.317 20.220 -26.364 1.00 . A A . 25 LYS C 1 1 9 3946 1 1 25 LYS CA C -10.577 19.378 -27.620 1.00 . A A . 25 LYS CA 1 1 9 3947 1 1 25 LYS CB C -12.062 18.968 -27.676 1.00 . A A . 25 LYS CB 1 1 9 3948 1 1 25 LYS CD C -13.845 17.856 -29.060 1.00 . A A . 25 LYS CD 1 1 9 3949 1 1 25 LYS CE C -14.163 17.196 -30.409 1.00 . A A . 25 LYS CE 1 1 9 3950 1 1 25 LYS CG C -12.363 18.265 -29.011 1.00 . A A . 25 LYS CG 1 1 9 3951 1 1 25 LYS H H -9.175 18.001 -28.425 1.00 . A A . 25 LYS H 1 1 9 3952 1 1 25 LYS HA H -10.345 19.980 -28.488 1.00 . A A . 25 LYS HA 1 1 9 3953 1 1 25 LYS HB2 H -12.281 18.296 -26.859 1.00 . A A . 25 LYS HB2 1 1 9 3954 1 1 25 LYS HB3 H -12.685 19.849 -27.593 1.00 . A A . 25 LYS HB3 1 1 9 3955 1 1 25 LYS HD2 H -14.047 17.154 -28.263 1.00 . A A . 25 LYS HD2 1 1 9 3956 1 1 25 LYS HD3 H -14.467 18.731 -28.935 1.00 . A A . 25 LYS HD3 1 1 9 3957 1 1 25 LYS HE2 H -15.220 16.973 -30.461 1.00 . A A . 25 LYS HE2 1 1 9 3958 1 1 25 LYS HE3 H -13.898 17.866 -31.216 1.00 . A A . 25 LYS HE3 1 1 9 3959 1 1 25 LYS HG2 H -12.148 18.942 -29.825 1.00 . A A . 25 LYS HG2 1 1 9 3960 1 1 25 LYS HG3 H -11.744 17.385 -29.101 1.00 . A A . 25 LYS HG3 1 1 9 3961 1 1 25 LYS HZ1 H -12.533 16.100 -31.111 1.00 . A A . 25 LYS HZ1 1 1 9 3962 1 1 25 LYS HZ2 H -13.980 15.214 -31.011 1.00 . A A . 25 LYS HZ2 1 1 9 3963 1 1 25 LYS HZ3 H -13.113 15.590 -29.599 1.00 . A A . 25 LYS HZ3 1 1 9 3964 1 1 25 LYS N N -9.727 18.181 -27.636 1.00 . A A . 25 LYS N 1 1 9 3965 1 1 25 LYS NZ N -13.388 15.930 -30.543 1.00 . A A . 25 LYS NZ 1 1 9 3966 1 1 25 LYS O O -10.953 20.018 -25.328 1.00 . A A . 25 LYS O 1 1 9 3967 1 1 26 ASP C C -10.278 22.774 -24.830 1.00 . A A . 26 ASP C 1 1 9 3968 1 1 26 ASP CA C -9.039 22.033 -25.341 1.00 . A A . 26 ASP CA 1 1 9 3969 1 1 26 ASP CB C -7.977 23.052 -25.783 1.00 . A A . 26 ASP CB 1 1 9 3970 1 1 26 ASP CG C -6.720 22.332 -26.262 1.00 . A A . 26 ASP CG 1 1 9 3971 1 1 26 ASP H H -8.909 21.275 -27.320 1.00 . A A . 26 ASP H 1 1 9 3972 1 1 26 ASP HA H -8.635 21.432 -24.541 1.00 . A A . 26 ASP HA 1 1 9 3973 1 1 26 ASP HB2 H -8.372 23.653 -26.587 1.00 . A A . 26 ASP HB2 1 1 9 3974 1 1 26 ASP HB3 H -7.722 23.692 -24.949 1.00 . A A . 26 ASP HB3 1 1 9 3975 1 1 26 ASP N N -9.380 21.162 -26.468 1.00 . A A . 26 ASP N 1 1 9 3976 1 1 26 ASP O O -11.271 22.784 -25.537 1.00 . A A . 26 ASP O 1 1 9 3977 1 1 26 ASP OD1 O -6.431 21.267 -25.740 1.00 . A A . 26 ASP OD1 1 1 9 3978 1 1 26 ASP OD2 O -6.062 22.857 -27.145 1.00 . A A . 26 ASP OD2 1 1 10 3979 1 1 1 MET C C 11.615 5.802 0.085 1.00 . A A . 1 MET C 1 1 10 3980 1 1 1 MET CA C 12.899 5.126 -0.394 1.00 . A A . 1 MET CA 1 1 10 3981 1 1 1 MET CB C 13.058 5.317 -1.912 1.00 . A A . 1 MET CB 1 1 10 3982 1 1 1 MET CE C 13.237 3.950 -4.824 1.00 . A A . 1 MET CE 1 1 10 3983 1 1 1 MET CG C 14.357 4.654 -2.389 1.00 . A A . 1 MET CG 1 1 10 3984 1 1 1 MET H1 H 11.914 3.452 0.359 1.00 . A A . 1 MET H1 1 1 10 3985 1 1 1 MET H2 H 13.597 3.424 0.578 1.00 . A A . 1 MET H2 1 1 10 3986 1 1 1 MET H3 H 12.932 3.119 -0.954 1.00 . A A . 1 MET H3 1 1 10 3987 1 1 1 MET HA H 13.745 5.564 0.115 1.00 . A A . 1 MET HA 1 1 10 3988 1 1 1 MET HB2 H 12.217 4.870 -2.419 1.00 . A A . 1 MET HB2 1 1 10 3989 1 1 1 MET HB3 H 13.094 6.371 -2.138 1.00 . A A . 1 MET HB3 1 1 10 3990 1 1 1 MET HE1 H 12.324 4.530 -4.846 1.00 . A A . 1 MET HE1 1 1 10 3991 1 1 1 MET HE2 H 13.090 3.078 -4.210 1.00 . A A . 1 MET HE2 1 1 10 3992 1 1 1 MET HE3 H 13.489 3.638 -5.828 1.00 . A A . 1 MET HE3 1 1 10 3993 1 1 1 MET HG2 H 15.194 5.070 -1.846 1.00 . A A . 1 MET HG2 1 1 10 3994 1 1 1 MET HG3 H 14.310 3.591 -2.212 1.00 . A A . 1 MET HG3 1 1 10 3995 1 1 1 MET N N 12.830 3.671 -0.081 1.00 . A A . 1 MET N 1 1 10 3996 1 1 1 MET O O 11.102 6.705 -0.573 1.00 . A A . 1 MET O 1 1 10 3997 1 1 1 MET SD S 14.585 4.974 -4.163 1.00 . A A . 1 MET SD 1 1 10 3998 1 1 2 LYS C C 8.710 5.796 0.823 1.00 . A A . 2 LYS C 1 1 10 3999 1 1 2 LYS CA C 9.877 5.896 1.814 1.00 . A A . 2 LYS CA 1 1 10 4000 1 1 2 LYS CB C 10.087 7.367 2.235 1.00 . A A . 2 LYS CB 1 1 10 4001 1 1 2 LYS CD C 11.324 8.920 3.777 1.00 . A A . 2 LYS CD 1 1 10 4002 1 1 2 LYS CE C 12.371 9.017 4.892 1.00 . A A . 2 LYS CE 1 1 10 4003 1 1 2 LYS CG C 11.122 7.453 3.370 1.00 . A A . 2 LYS CG 1 1 10 4004 1 1 2 LYS H H 11.569 4.620 1.701 1.00 . A A . 2 LYS H 1 1 10 4005 1 1 2 LYS HA H 9.625 5.315 2.691 1.00 . A A . 2 LYS HA 1 1 10 4006 1 1 2 LYS HB2 H 10.438 7.937 1.390 1.00 . A A . 2 LYS HB2 1 1 10 4007 1 1 2 LYS HB3 H 9.150 7.784 2.582 1.00 . A A . 2 LYS HB3 1 1 10 4008 1 1 2 LYS HD2 H 11.657 9.489 2.920 1.00 . A A . 2 LYS HD2 1 1 10 4009 1 1 2 LYS HD3 H 10.387 9.323 4.133 1.00 . A A . 2 LYS HD3 1 1 10 4010 1 1 2 LYS HE2 H 13.305 8.586 4.555 1.00 . A A . 2 LYS HE2 1 1 10 4011 1 1 2 LYS HE3 H 12.528 10.057 5.147 1.00 . A A . 2 LYS HE3 1 1 10 4012 1 1 2 LYS HG2 H 10.770 6.887 4.219 1.00 . A A . 2 LYS HG2 1 1 10 4013 1 1 2 LYS HG3 H 12.062 7.042 3.029 1.00 . A A . 2 LYS HG3 1 1 10 4014 1 1 2 LYS HZ1 H 11.938 8.906 6.924 1.00 . A A . 2 LYS HZ1 1 1 10 4015 1 1 2 LYS HZ2 H 12.490 7.447 6.254 1.00 . A A . 2 LYS HZ2 1 1 10 4016 1 1 2 LYS HZ3 H 10.906 7.979 5.948 1.00 . A A . 2 LYS HZ3 1 1 10 4017 1 1 2 LYS N N 11.108 5.347 1.232 1.00 . A A . 2 LYS N 1 1 10 4018 1 1 2 LYS NZ N 11.890 8.281 6.096 1.00 . A A . 2 LYS NZ 1 1 10 4019 1 1 2 LYS O O 8.909 5.602 -0.375 1.00 . A A . 2 LYS O 1 1 10 4020 1 1 3 PHE C C 6.060 7.194 -0.197 1.00 . A A . 3 PHE C 1 1 10 4021 1 1 3 PHE CA C 6.277 5.864 0.520 1.00 . A A . 3 PHE CA 1 1 10 4022 1 1 3 PHE CB C 5.070 5.551 1.418 1.00 . A A . 3 PHE CB 1 1 10 4023 1 1 3 PHE CD1 C 4.864 3.016 1.491 1.00 . A A . 3 PHE CD1 1 1 10 4024 1 1 3 PHE CD2 C 5.932 4.145 3.357 1.00 . A A . 3 PHE CD2 1 1 10 4025 1 1 3 PHE CE1 C 5.076 1.784 2.119 1.00 . A A . 3 PHE CE1 1 1 10 4026 1 1 3 PHE CE2 C 6.140 2.911 3.983 1.00 . A A . 3 PHE CE2 1 1 10 4027 1 1 3 PHE CG C 5.289 4.206 2.108 1.00 . A A . 3 PHE CG 1 1 10 4028 1 1 3 PHE CZ C 5.712 1.731 3.364 1.00 . A A . 3 PHE CZ 1 1 10 4029 1 1 3 PHE H H 7.400 6.086 2.308 1.00 . A A . 3 PHE H 1 1 10 4030 1 1 3 PHE HA H 6.376 5.077 -0.218 1.00 . A A . 3 PHE HA 1 1 10 4031 1 1 3 PHE HB2 H 4.960 6.335 2.158 1.00 . A A . 3 PHE HB2 1 1 10 4032 1 1 3 PHE HB3 H 4.173 5.509 0.812 1.00 . A A . 3 PHE HB3 1 1 10 4033 1 1 3 PHE HD1 H 4.371 3.052 0.531 1.00 . A A . 3 PHE HD1 1 1 10 4034 1 1 3 PHE HD2 H 6.262 5.054 3.837 1.00 . A A . 3 PHE HD2 1 1 10 4035 1 1 3 PHE HE1 H 4.748 0.872 1.642 1.00 . A A . 3 PHE HE1 1 1 10 4036 1 1 3 PHE HE2 H 6.631 2.868 4.944 1.00 . A A . 3 PHE HE2 1 1 10 4037 1 1 3 PHE HZ H 5.875 0.779 3.848 1.00 . A A . 3 PHE HZ 1 1 10 4038 1 1 3 PHE N N 7.489 5.932 1.344 1.00 . A A . 3 PHE N 1 1 10 4039 1 1 3 PHE O O 5.092 7.366 -0.937 1.00 . A A . 3 PHE O 1 1 10 4040 1 1 4 TYR C C 7.008 9.348 -2.107 1.00 . A A . 4 TYR C 1 1 10 4041 1 1 4 TYR CA C 6.921 9.458 -0.572 1.00 . A A . 4 TYR CA 1 1 10 4042 1 1 4 TYR CB C 8.067 10.342 0.063 1.00 . A A . 4 TYR CB 1 1 10 4043 1 1 4 TYR CD1 C 8.349 12.279 -1.562 1.00 . A A . 4 TYR CD1 1 1 10 4044 1 1 4 TYR CD2 C 10.163 10.676 -1.358 1.00 . A A . 4 TYR CD2 1 1 10 4045 1 1 4 TYR CE1 C 9.095 12.993 -2.508 1.00 . A A . 4 TYR CE1 1 1 10 4046 1 1 4 TYR CE2 C 10.904 11.392 -2.303 1.00 . A A . 4 TYR CE2 1 1 10 4047 1 1 4 TYR CG C 8.882 11.118 -0.980 1.00 . A A . 4 TYR CG 1 1 10 4048 1 1 4 TYR CZ C 10.370 12.550 -2.878 1.00 . A A . 4 TYR CZ 1 1 10 4049 1 1 4 TYR H H 7.728 7.919 0.634 1.00 . A A . 4 TYR H 1 1 10 4050 1 1 4 TYR HA H 5.959 9.899 -0.327 1.00 . A A . 4 TYR HA 1 1 10 4051 1 1 4 TYR HB2 H 7.631 11.056 0.753 1.00 . A A . 4 TYR HB2 1 1 10 4052 1 1 4 TYR HB3 H 8.731 9.700 0.632 1.00 . A A . 4 TYR HB3 1 1 10 4053 1 1 4 TYR HD1 H 7.365 12.623 -1.278 1.00 . A A . 4 TYR HD1 1 1 10 4054 1 1 4 TYR HD2 H 10.576 9.780 -0.915 1.00 . A A . 4 TYR HD2 1 1 10 4055 1 1 4 TYR HE1 H 8.687 13.888 -2.949 1.00 . A A . 4 TYR HE1 1 1 10 4056 1 1 4 TYR HE2 H 11.888 11.050 -2.588 1.00 . A A . 4 TYR HE2 1 1 10 4057 1 1 4 TYR HH H 11.003 12.815 -4.661 1.00 . A A . 4 TYR HH 1 1 10 4058 1 1 4 TYR N N 6.979 8.128 0.036 1.00 . A A . 4 TYR N 1 1 10 4059 1 1 4 TYR O O 6.270 10.021 -2.827 1.00 . A A . 4 TYR O 1 1 10 4060 1 1 4 TYR OH O 11.101 13.255 -3.812 1.00 . A A . 4 TYR OH 1 1 10 4061 1 1 5 THR C C 6.842 7.803 -4.703 1.00 . A A . 5 THR C 1 1 10 4062 1 1 5 THR CA C 8.107 8.341 -4.033 1.00 . A A . 5 THR CA 1 1 10 4063 1 1 5 THR CB C 9.260 7.361 -4.272 1.00 . A A . 5 THR CB 1 1 10 4064 1 1 5 THR CG2 C 10.547 7.899 -3.634 1.00 . A A . 5 THR CG2 1 1 10 4065 1 1 5 THR H H 8.490 8.009 -1.984 1.00 . A A . 5 THR H 1 1 10 4066 1 1 5 THR HA H 8.362 9.295 -4.477 1.00 . A A . 5 THR HA 1 1 10 4067 1 1 5 THR HB H 9.409 7.237 -5.323 1.00 . A A . 5 THR HB 1 1 10 4068 1 1 5 THR HG1 H 9.633 5.488 -3.905 1.00 . A A . 5 THR HG1 1 1 10 4069 1 1 5 THR HG21 H 10.408 7.988 -2.569 1.00 . A A . 5 THR HG21 1 1 10 4070 1 1 5 THR HG22 H 10.779 8.869 -4.050 1.00 . A A . 5 THR HG22 1 1 10 4071 1 1 5 THR HG23 H 11.360 7.218 -3.837 1.00 . A A . 5 THR HG23 1 1 10 4072 1 1 5 THR N N 7.922 8.513 -2.596 1.00 . A A . 5 THR N 1 1 10 4073 1 1 5 THR O O 6.367 8.362 -5.693 1.00 . A A . 5 THR O 1 1 10 4074 1 1 5 THR OG1 O 8.931 6.106 -3.690 1.00 . A A . 5 THR OG1 1 1 10 4075 1 1 6 ILE C C 3.918 7.064 -4.567 1.00 . A A . 6 ILE C 1 1 10 4076 1 1 6 ILE CA C 5.091 6.102 -4.703 1.00 . A A . 6 ILE CA 1 1 10 4077 1 1 6 ILE CB C 4.772 4.751 -3.989 1.00 . A A . 6 ILE CB 1 1 10 4078 1 1 6 ILE CD1 C 6.860 3.792 -2.790 1.00 . A A . 6 ILE CD1 1 1 10 4079 1 1 6 ILE CG1 C 6.008 3.759 -4.073 1.00 . A A . 6 ILE CG1 1 1 10 4080 1 1 6 ILE CG2 C 3.515 4.106 -4.644 1.00 . A A . 6 ILE CG2 1 1 10 4081 1 1 6 ILE H H 6.723 6.326 -3.371 1.00 . A A . 6 ILE H 1 1 10 4082 1 1 6 ILE HA H 5.248 5.901 -5.755 1.00 . A A . 6 ILE HA 1 1 10 4083 1 1 6 ILE HB H 4.540 4.963 -2.949 1.00 . A A . 6 ILE HB 1 1 10 4084 1 1 6 ILE HD11 H 7.123 4.806 -2.549 1.00 . A A . 6 ILE HD11 1 1 10 4085 1 1 6 ILE HD12 H 7.762 3.217 -2.943 1.00 . A A . 6 ILE HD12 1 1 10 4086 1 1 6 ILE HD13 H 6.297 3.362 -1.975 1.00 . A A . 6 ILE HD13 1 1 10 4087 1 1 6 ILE HG12 H 5.657 2.743 -4.207 1.00 . A A . 6 ILE HG12 1 1 10 4088 1 1 6 ILE HG13 H 6.638 4.013 -4.917 1.00 . A A . 6 ILE HG13 1 1 10 4089 1 1 6 ILE HG21 H 2.639 4.703 -4.431 1.00 . A A . 6 ILE HG21 1 1 10 4090 1 1 6 ILE HG22 H 3.372 3.113 -4.243 1.00 . A A . 6 ILE HG22 1 1 10 4091 1 1 6 ILE HG23 H 3.653 4.038 -5.713 1.00 . A A . 6 ILE HG23 1 1 10 4092 1 1 6 ILE N N 6.302 6.716 -4.158 1.00 . A A . 6 ILE N 1 1 10 4093 1 1 6 ILE O O 3.101 7.199 -5.478 1.00 . A A . 6 ILE O 1 1 10 4094 1 1 7 LYS C C 2.751 9.786 -4.187 1.00 . A A . 7 LYS C 1 1 10 4095 1 1 7 LYS CA C 2.756 8.663 -3.154 1.00 . A A . 7 LYS CA 1 1 10 4096 1 1 7 LYS CB C 2.942 9.246 -1.734 1.00 . A A . 7 LYS CB 1 1 10 4097 1 1 7 LYS CD C 1.991 10.755 0.052 1.00 . A A . 7 LYS CD 1 1 10 4098 1 1 7 LYS CE C 0.915 11.800 0.372 1.00 . A A . 7 LYS CE 1 1 10 4099 1 1 7 LYS CG C 1.863 10.305 -1.411 1.00 . A A . 7 LYS CG 1 1 10 4100 1 1 7 LYS H H 4.521 7.563 -2.730 1.00 . A A . 7 LYS H 1 1 10 4101 1 1 7 LYS HA H 1.811 8.141 -3.195 1.00 . A A . 7 LYS HA 1 1 10 4102 1 1 7 LYS HB2 H 2.879 8.440 -1.014 1.00 . A A . 7 LYS HB2 1 1 10 4103 1 1 7 LYS HB3 H 3.917 9.702 -1.665 1.00 . A A . 7 LYS HB3 1 1 10 4104 1 1 7 LYS HD2 H 1.863 9.900 0.700 1.00 . A A . 7 LYS HD2 1 1 10 4105 1 1 7 LYS HD3 H 2.967 11.187 0.214 1.00 . A A . 7 LYS HD3 1 1 10 4106 1 1 7 LYS HE2 H 1.044 12.659 -0.274 1.00 . A A . 7 LYS HE2 1 1 10 4107 1 1 7 LYS HE3 H -0.064 11.371 0.213 1.00 . A A . 7 LYS HE3 1 1 10 4108 1 1 7 LYS HG2 H 1.995 11.166 -2.050 1.00 . A A . 7 LYS HG2 1 1 10 4109 1 1 7 LYS HG3 H 0.888 9.885 -1.578 1.00 . A A . 7 LYS HG3 1 1 10 4110 1 1 7 LYS HZ1 H 1.662 13.061 1.852 1.00 . A A . 7 LYS HZ1 1 1 10 4111 1 1 7 LYS HZ2 H 1.466 11.447 2.347 1.00 . A A . 7 LYS HZ2 1 1 10 4112 1 1 7 LYS HZ3 H 0.111 12.455 2.178 1.00 . A A . 7 LYS HZ3 1 1 10 4113 1 1 7 LYS N N 3.838 7.719 -3.417 1.00 . A A . 7 LYS N 1 1 10 4114 1 1 7 LYS NZ N 1.049 12.223 1.795 1.00 . A A . 7 LYS NZ 1 1 10 4115 1 1 7 LYS O O 1.716 10.092 -4.779 1.00 . A A . 7 LYS O 1 1 10 4116 1 1 8 LEU C C 3.805 11.003 -6.752 1.00 . A A . 8 LEU C 1 1 10 4117 1 1 8 LEU CA C 4.026 11.505 -5.333 1.00 . A A . 8 LEU CA 1 1 10 4118 1 1 8 LEU CB C 5.418 12.165 -5.199 1.00 . A A . 8 LEU CB 1 1 10 4119 1 1 8 LEU CD1 C 4.568 14.611 -5.046 1.00 . A A . 8 LEU CD1 1 1 10 4120 1 1 8 LEU CD2 C 6.890 14.094 -5.920 1.00 . A A . 8 LEU CD2 1 1 10 4121 1 1 8 LEU CG C 5.438 13.588 -5.852 1.00 . A A . 8 LEU CG 1 1 10 4122 1 1 8 LEU H H 4.690 10.118 -3.882 1.00 . A A . 8 LEU H 1 1 10 4123 1 1 8 LEU HA H 3.266 12.227 -5.099 1.00 . A A . 8 LEU HA 1 1 10 4124 1 1 8 LEU HB2 H 5.666 12.241 -4.152 1.00 . A A . 8 LEU HB2 1 1 10 4125 1 1 8 LEU HB3 H 6.161 11.536 -5.682 1.00 . A A . 8 LEU HB3 1 1 10 4126 1 1 8 LEU HD11 H 4.662 14.432 -3.983 1.00 . A A . 8 LEU HD11 1 1 10 4127 1 1 8 LEU HD12 H 3.533 14.518 -5.333 1.00 . A A . 8 LEU HD12 1 1 10 4128 1 1 8 LEU HD13 H 4.887 15.625 -5.261 1.00 . A A . 8 LEU HD13 1 1 10 4129 1 1 8 LEU HD21 H 6.904 15.078 -6.365 1.00 . A A . 8 LEU HD21 1 1 10 4130 1 1 8 LEU HD22 H 7.479 13.419 -6.518 1.00 . A A . 8 LEU HD22 1 1 10 4131 1 1 8 LEU HD23 H 7.294 14.143 -4.923 1.00 . A A . 8 LEU HD23 1 1 10 4132 1 1 8 LEU HG H 5.050 13.515 -6.855 1.00 . A A . 8 LEU HG 1 1 10 4133 1 1 8 LEU N N 3.906 10.405 -4.385 1.00 . A A . 8 LEU N 1 1 10 4134 1 1 8 LEU O O 3.181 11.658 -7.576 1.00 . A A . 8 LEU O 1 1 10 4135 1 1 9 ALA C C 2.783 9.145 -8.804 1.00 . A A . 9 ALA C 1 1 10 4136 1 1 9 ALA CA C 4.248 9.248 -8.362 1.00 . A A . 9 ALA CA 1 1 10 4137 1 1 9 ALA CB C 4.898 7.860 -8.375 1.00 . A A . 9 ALA CB 1 1 10 4138 1 1 9 ALA H H 4.862 9.378 -6.337 1.00 . A A . 9 ALA H 1 1 10 4139 1 1 9 ALA HA H 4.777 9.883 -9.049 1.00 . A A . 9 ALA HA 1 1 10 4140 1 1 9 ALA HB1 H 5.936 7.947 -8.085 1.00 . A A . 9 ALA HB1 1 1 10 4141 1 1 9 ALA HB2 H 4.837 7.439 -9.369 1.00 . A A . 9 ALA HB2 1 1 10 4142 1 1 9 ALA HB3 H 4.382 7.214 -7.678 1.00 . A A . 9 ALA HB3 1 1 10 4143 1 1 9 ALA N N 4.355 9.837 -7.032 1.00 . A A . 9 ALA N 1 1 10 4144 1 1 9 ALA O O 2.427 9.573 -9.902 1.00 . A A . 9 ALA O 1 1 10 4145 1 1 10 LYS C C -0.130 9.844 -8.353 1.00 . A A . 10 LYS C 1 1 10 4146 1 1 10 LYS CA C 0.516 8.465 -8.226 1.00 . A A . 10 LYS CA 1 1 10 4147 1 1 10 LYS CB C -0.169 7.669 -7.094 1.00 . A A . 10 LYS CB 1 1 10 4148 1 1 10 LYS CD C -0.464 5.409 -6.026 1.00 . A A . 10 LYS CD 1 1 10 4149 1 1 10 LYS CE C -0.090 3.925 -6.106 1.00 . A A . 10 LYS CE 1 1 10 4150 1 1 10 LYS CG C 0.234 6.184 -7.155 1.00 . A A . 10 LYS CG 1 1 10 4151 1 1 10 LYS H H 2.283 8.289 -7.068 1.00 . A A . 10 LYS H 1 1 10 4152 1 1 10 LYS HA H 0.385 7.942 -9.165 1.00 . A A . 10 LYS HA 1 1 10 4153 1 1 10 LYS HB2 H 0.132 8.080 -6.141 1.00 . A A . 10 LYS HB2 1 1 10 4154 1 1 10 LYS HB3 H -1.239 7.753 -7.187 1.00 . A A . 10 LYS HB3 1 1 10 4155 1 1 10 LYS HD2 H -0.149 5.806 -5.073 1.00 . A A . 10 LYS HD2 1 1 10 4156 1 1 10 LYS HD3 H -1.534 5.513 -6.124 1.00 . A A . 10 LYS HD3 1 1 10 4157 1 1 10 LYS HE2 H -0.387 3.528 -7.067 1.00 . A A . 10 LYS HE2 1 1 10 4158 1 1 10 LYS HE3 H 0.977 3.812 -5.987 1.00 . A A . 10 LYS HE3 1 1 10 4159 1 1 10 LYS HG2 H -0.065 5.773 -8.108 1.00 . A A . 10 LYS HG2 1 1 10 4160 1 1 10 LYS HG3 H 1.305 6.095 -7.043 1.00 . A A . 10 LYS HG3 1 1 10 4161 1 1 10 LYS HZ1 H -1.229 2.321 -5.422 1.00 . A A . 10 LYS HZ1 1 1 10 4162 1 1 10 LYS HZ2 H -1.528 3.780 -4.607 1.00 . A A . 10 LYS HZ2 1 1 10 4163 1 1 10 LYS HZ3 H -0.108 2.904 -4.291 1.00 . A A . 10 LYS HZ3 1 1 10 4164 1 1 10 LYS N N 1.943 8.596 -7.933 1.00 . A A . 10 LYS N 1 1 10 4165 1 1 10 LYS NZ N -0.791 3.177 -5.025 1.00 . A A . 10 LYS NZ 1 1 10 4166 1 1 10 LYS O O -0.952 10.081 -9.238 1.00 . A A . 10 LYS O 1 1 10 4167 1 1 11 PHE C C -0.076 12.769 -8.789 1.00 . A A . 11 PHE C 1 1 10 4168 1 1 11 PHE CA C -0.308 12.100 -7.440 1.00 . A A . 11 PHE CA 1 1 10 4169 1 1 11 PHE CB C 0.388 12.896 -6.326 1.00 . A A . 11 PHE CB 1 1 10 4170 1 1 11 PHE CD1 C -1.440 14.566 -5.775 1.00 . A A . 11 PHE CD1 1 1 10 4171 1 1 11 PHE CD2 C 0.689 15.428 -6.584 1.00 . A A . 11 PHE CD2 1 1 10 4172 1 1 11 PHE CE1 C -1.923 15.876 -5.666 1.00 . A A . 11 PHE CE1 1 1 10 4173 1 1 11 PHE CE2 C 0.198 16.735 -6.470 1.00 . A A . 11 PHE CE2 1 1 10 4174 1 1 11 PHE CG C -0.133 14.331 -6.235 1.00 . A A . 11 PHE CG 1 1 10 4175 1 1 11 PHE CZ C -1.106 16.958 -6.012 1.00 . A A . 11 PHE CZ 1 1 10 4176 1 1 11 PHE H H 0.887 10.481 -6.765 1.00 . A A . 11 PHE H 1 1 10 4177 1 1 11 PHE HA H -1.369 12.058 -7.239 1.00 . A A . 11 PHE HA 1 1 10 4178 1 1 11 PHE HB2 H 0.210 12.398 -5.390 1.00 . A A . 11 PHE HB2 1 1 10 4179 1 1 11 PHE HB3 H 1.444 12.903 -6.513 1.00 . A A . 11 PHE HB3 1 1 10 4180 1 1 11 PHE HD1 H -2.076 13.736 -5.508 1.00 . A A . 11 PHE HD1 1 1 10 4181 1 1 11 PHE HD2 H 1.703 15.263 -6.939 1.00 . A A . 11 PHE HD2 1 1 10 4182 1 1 11 PHE HE1 H -2.930 16.051 -5.312 1.00 . A A . 11 PHE HE1 1 1 10 4183 1 1 11 PHE HE2 H 0.826 17.572 -6.737 1.00 . A A . 11 PHE HE2 1 1 10 4184 1 1 11 PHE HZ H -1.481 17.966 -5.925 1.00 . A A . 11 PHE HZ 1 1 10 4185 1 1 11 PHE N N 0.241 10.741 -7.449 1.00 . A A . 11 PHE N 1 1 10 4186 1 1 11 PHE O O -1.007 13.269 -9.412 1.00 . A A . 11 PHE O 1 1 10 4187 1 1 12 LEU C C 0.844 12.538 -11.657 1.00 . A A . 12 LEU C 1 1 10 4188 1 1 12 LEU CA C 1.522 13.322 -10.537 1.00 . A A . 12 LEU CA 1 1 10 4189 1 1 12 LEU CB C 3.049 13.276 -10.743 1.00 . A A . 12 LEU CB 1 1 10 4190 1 1 12 LEU CD1 C 5.310 13.937 -9.851 1.00 . A A . 12 LEU CD1 1 1 10 4191 1 1 12 LEU CD2 C 3.408 15.618 -9.750 1.00 . A A . 12 LEU CD2 1 1 10 4192 1 1 12 LEU CG C 3.789 14.115 -9.669 1.00 . A A . 12 LEU CG 1 1 10 4193 1 1 12 LEU H H 1.862 12.308 -8.697 1.00 . A A . 12 LEU H 1 1 10 4194 1 1 12 LEU HA H 1.179 14.343 -10.587 1.00 . A A . 12 LEU HA 1 1 10 4195 1 1 12 LEU HB2 H 3.377 12.246 -10.676 1.00 . A A . 12 LEU HB2 1 1 10 4196 1 1 12 LEU HB3 H 3.293 13.662 -11.725 1.00 . A A . 12 LEU HB3 1 1 10 4197 1 1 12 LEU HD11 H 5.596 14.239 -10.847 1.00 . A A . 12 LEU HD11 1 1 10 4198 1 1 12 LEU HD12 H 5.567 12.899 -9.703 1.00 . A A . 12 LEU HD12 1 1 10 4199 1 1 12 LEU HD13 H 5.835 14.543 -9.125 1.00 . A A . 12 LEU HD13 1 1 10 4200 1 1 12 LEU HD21 H 2.492 15.773 -9.203 1.00 . A A . 12 LEU HD21 1 1 10 4201 1 1 12 LEU HD22 H 3.271 15.922 -10.777 1.00 . A A . 12 LEU HD22 1 1 10 4202 1 1 12 LEU HD23 H 4.184 16.225 -9.300 1.00 . A A . 12 LEU HD23 1 1 10 4203 1 1 12 LEU HG H 3.514 13.743 -8.699 1.00 . A A . 12 LEU HG 1 1 10 4204 1 1 12 LEU N N 1.169 12.742 -9.240 1.00 . A A . 12 LEU N 1 1 10 4205 1 1 12 LEU O O 0.360 13.117 -12.623 1.00 . A A . 12 LEU O 1 1 10 4206 1 1 13 GLY C C -1.253 10.599 -12.697 1.00 . A A . 13 GLY C 1 1 10 4207 1 1 13 GLY CA C 0.245 10.352 -12.547 1.00 . A A . 13 GLY CA 1 1 10 4208 1 1 13 GLY H H 1.258 10.810 -10.742 1.00 . A A . 13 GLY H 1 1 10 4209 1 1 13 GLY HA2 H 0.728 10.545 -13.492 1.00 . A A . 13 GLY HA2 1 1 10 4210 1 1 13 GLY HA3 H 0.410 9.333 -12.282 1.00 . A A . 13 GLY HA3 1 1 10 4211 1 1 13 GLY N N 0.839 11.216 -11.529 1.00 . A A . 13 GLY N 1 1 10 4212 1 1 13 GLY O O -1.841 10.286 -13.728 1.00 . A A . 13 GLY O 1 1 10 4213 1 1 14 GLY C C -3.489 12.767 -12.517 1.00 . A A . 14 GLY C 1 1 10 4214 1 1 14 GLY CA C -3.306 11.476 -11.732 1.00 . A A . 14 GLY CA 1 1 10 4215 1 1 14 GLY H H -1.364 11.407 -10.868 1.00 . A A . 14 GLY H 1 1 10 4216 1 1 14 GLY HA2 H -3.850 10.670 -12.215 1.00 . A A . 14 GLY HA2 1 1 10 4217 1 1 14 GLY HA3 H -3.686 11.614 -10.733 1.00 . A A . 14 GLY HA3 1 1 10 4218 1 1 14 GLY N N -1.876 11.168 -11.671 1.00 . A A . 14 GLY N 1 1 10 4219 1 1 14 GLY O O -4.363 12.885 -13.373 1.00 . A A . 14 GLY O 1 1 10 4220 1 1 15 ILE C C -2.139 14.959 -14.279 1.00 . A A . 15 ILE C 1 1 10 4221 1 1 15 ILE CA C -2.625 15.047 -12.837 1.00 . A A . 15 ILE CA 1 1 10 4222 1 1 15 ILE CB C -1.711 16.003 -12.033 1.00 . A A . 15 ILE CB 1 1 10 4223 1 1 15 ILE CD1 C -1.146 16.768 -9.687 1.00 . A A . 15 ILE CD1 1 1 10 4224 1 1 15 ILE CG1 C -2.212 16.096 -10.561 1.00 . A A . 15 ILE CG1 1 1 10 4225 1 1 15 ILE CG2 C -1.709 17.421 -12.664 1.00 . A A . 15 ILE CG2 1 1 10 4226 1 1 15 ILE H H -1.956 13.550 -11.513 1.00 . A A . 15 ILE H 1 1 10 4227 1 1 15 ILE HA H -3.632 15.442 -12.833 1.00 . A A . 15 ILE HA 1 1 10 4228 1 1 15 ILE HB H -0.702 15.609 -12.048 1.00 . A A . 15 ILE HB 1 1 10 4229 1 1 15 ILE HD11 H -1.531 16.893 -8.692 1.00 . A A . 15 ILE HD11 1 1 10 4230 1 1 15 ILE HD12 H -0.888 17.735 -10.097 1.00 . A A . 15 ILE HD12 1 1 10 4231 1 1 15 ILE HD13 H -0.264 16.144 -9.660 1.00 . A A . 15 ILE HD13 1 1 10 4232 1 1 15 ILE HG12 H -3.122 16.676 -10.519 1.00 . A A . 15 ILE HG12 1 1 10 4233 1 1 15 ILE HG13 H -2.408 15.112 -10.170 1.00 . A A . 15 ILE HG13 1 1 10 4234 1 1 15 ILE HG21 H -1.259 17.391 -13.645 1.00 . A A . 15 ILE HG21 1 1 10 4235 1 1 15 ILE HG22 H -1.140 18.097 -12.041 1.00 . A A . 15 ILE HG22 1 1 10 4236 1 1 15 ILE HG23 H -2.726 17.780 -12.746 1.00 . A A . 15 ILE HG23 1 1 10 4237 1 1 15 ILE N N -2.627 13.732 -12.199 1.00 . A A . 15 ILE N 1 1 10 4238 1 1 15 ILE O O -2.676 15.631 -15.158 1.00 . A A . 15 ILE O 1 1 10 4239 1 1 16 VAL C C -1.625 13.703 -16.875 1.00 . A A . 16 VAL C 1 1 10 4240 1 1 16 VAL CA C -0.522 14.074 -15.871 1.00 . A A . 16 VAL CA 1 1 10 4241 1 1 16 VAL CB C 0.673 13.053 -15.898 1.00 . A A . 16 VAL CB 1 1 10 4242 1 1 16 VAL CG1 C 0.185 11.594 -16.070 1.00 . A A . 16 VAL CG1 1 1 10 4243 1 1 16 VAL CG2 C 1.642 13.404 -17.051 1.00 . A A . 16 VAL CG2 1 1 10 4244 1 1 16 VAL H H -0.667 13.675 -13.784 1.00 . A A . 16 VAL H 1 1 10 4245 1 1 16 VAL HA H -0.153 15.059 -16.123 1.00 . A A . 16 VAL HA 1 1 10 4246 1 1 16 VAL HB H 1.205 13.124 -14.953 1.00 . A A . 16 VAL HB 1 1 10 4247 1 1 16 VAL HG11 H -0.609 11.405 -15.376 1.00 . A A . 16 VAL HG11 1 1 10 4248 1 1 16 VAL HG12 H 1.000 10.912 -15.878 1.00 . A A . 16 VAL HG12 1 1 10 4249 1 1 16 VAL HG13 H -0.175 11.437 -17.080 1.00 . A A . 16 VAL HG13 1 1 10 4250 1 1 16 VAL HG21 H 1.092 13.429 -17.982 1.00 . A A . 16 VAL HG21 1 1 10 4251 1 1 16 VAL HG22 H 2.425 12.660 -17.114 1.00 . A A . 16 VAL HG22 1 1 10 4252 1 1 16 VAL HG23 H 2.083 14.373 -16.869 1.00 . A A . 16 VAL HG23 1 1 10 4253 1 1 16 VAL N N -1.086 14.167 -14.522 1.00 . A A . 16 VAL N 1 1 10 4254 1 1 16 VAL O O -1.746 14.301 -17.938 1.00 . A A . 16 VAL O 1 1 10 4255 1 1 17 ARG C C -4.591 13.413 -17.408 1.00 . A A . 17 ARG C 1 1 10 4256 1 1 17 ARG CA C -3.556 12.291 -17.316 1.00 . A A . 17 ARG CA 1 1 10 4257 1 1 17 ARG CB C -4.166 11.023 -16.692 1.00 . A A . 17 ARG CB 1 1 10 4258 1 1 17 ARG CD C -4.992 10.024 -18.904 1.00 . A A . 17 ARG CD 1 1 10 4259 1 1 17 ARG CG C -5.388 10.490 -17.487 1.00 . A A . 17 ARG CG 1 1 10 4260 1 1 17 ARG CZ C -7.157 9.893 -20.066 1.00 . A A . 17 ARG CZ 1 1 10 4261 1 1 17 ARG H H -2.303 12.306 -15.623 1.00 . A A . 17 ARG H 1 1 10 4262 1 1 17 ARG HA H -3.189 12.063 -18.304 1.00 . A A . 17 ARG HA 1 1 10 4263 1 1 17 ARG HB2 H -3.410 10.251 -16.660 1.00 . A A . 17 ARG HB2 1 1 10 4264 1 1 17 ARG HB3 H -4.475 11.249 -15.680 1.00 . A A . 17 ARG HB3 1 1 10 4265 1 1 17 ARG HD2 H -4.759 10.880 -19.523 1.00 . A A . 17 ARG HD2 1 1 10 4266 1 1 17 ARG HD3 H -4.123 9.383 -18.846 1.00 . A A . 17 ARG HD3 1 1 10 4267 1 1 17 ARG HE H -6.064 8.298 -19.528 1.00 . A A . 17 ARG HE 1 1 10 4268 1 1 17 ARG HG2 H -5.797 9.647 -16.954 1.00 . A A . 17 ARG HG2 1 1 10 4269 1 1 17 ARG HG3 H -6.147 11.255 -17.557 1.00 . A A . 17 ARG HG3 1 1 10 4270 1 1 17 ARG HH11 H -6.505 11.738 -19.637 1.00 . A A . 17 ARG HH11 1 1 10 4271 1 1 17 ARG HH12 H -8.021 11.657 -20.471 1.00 . A A . 17 ARG HH12 1 1 10 4272 1 1 17 ARG HH21 H -8.053 8.193 -20.626 1.00 . A A . 17 ARG HH21 1 1 10 4273 1 1 17 ARG HH22 H -8.895 9.651 -21.026 1.00 . A A . 17 ARG HH22 1 1 10 4274 1 1 17 ARG N N -2.440 12.729 -16.493 1.00 . A A . 17 ARG N 1 1 10 4275 1 1 17 ARG NE N -6.102 9.276 -19.516 1.00 . A A . 17 ARG NE 1 1 10 4276 1 1 17 ARG NH1 N -7.234 11.198 -20.056 1.00 . A A . 17 ARG NH1 1 1 10 4277 1 1 17 ARG NH2 N -8.109 9.190 -20.616 1.00 . A A . 17 ARG NH2 1 1 10 4278 1 1 17 ARG O O -5.216 13.611 -18.451 1.00 . A A . 17 ARG O 1 1 10 4279 1 1 18 ALA C C -5.421 16.314 -17.269 1.00 . A A . 18 ALA C 1 1 10 4280 1 1 18 ALA CA C -5.765 15.220 -16.255 1.00 . A A . 18 ALA CA 1 1 10 4281 1 1 18 ALA CB C -5.834 15.823 -14.838 1.00 . A A . 18 ALA CB 1 1 10 4282 1 1 18 ALA H H -4.269 13.922 -15.492 1.00 . A A . 18 ALA H 1 1 10 4283 1 1 18 ALA HA H -6.734 14.813 -16.498 1.00 . A A . 18 ALA HA 1 1 10 4284 1 1 18 ALA HB1 H -5.912 15.025 -14.114 1.00 . A A . 18 ALA HB1 1 1 10 4285 1 1 18 ALA HB2 H -6.700 16.466 -14.755 1.00 . A A . 18 ALA HB2 1 1 10 4286 1 1 18 ALA HB3 H -4.944 16.401 -14.636 1.00 . A A . 18 ALA HB3 1 1 10 4287 1 1 18 ALA N N -4.784 14.134 -16.298 1.00 . A A . 18 ALA N 1 1 10 4288 1 1 18 ALA O O -6.308 16.884 -17.902 1.00 . A A . 18 ALA O 1 1 10 4289 1 1 19 MET C C -4.021 17.248 -19.767 1.00 . A A . 19 MET C 1 1 10 4290 1 1 19 MET CA C -3.661 17.626 -18.331 1.00 . A A . 19 MET CA 1 1 10 4291 1 1 19 MET CB C -2.130 17.725 -18.178 1.00 . A A . 19 MET CB 1 1 10 4292 1 1 19 MET CE C 0.107 19.851 -15.463 1.00 . A A . 19 MET CE 1 1 10 4293 1 1 19 MET CG C -1.761 18.521 -16.918 1.00 . A A . 19 MET CG 1 1 10 4294 1 1 19 MET H H -3.469 16.121 -16.875 1.00 . A A . 19 MET H 1 1 10 4295 1 1 19 MET HA H -4.122 18.574 -18.093 1.00 . A A . 19 MET HA 1 1 10 4296 1 1 19 MET HB2 H -1.719 16.732 -18.091 1.00 . A A . 19 MET HB2 1 1 10 4297 1 1 19 MET HB3 H -1.711 18.197 -19.037 1.00 . A A . 19 MET HB3 1 1 10 4298 1 1 19 MET HE1 H 1.137 20.023 -15.185 1.00 . A A . 19 MET HE1 1 1 10 4299 1 1 19 MET HE2 H -0.447 19.527 -14.598 1.00 . A A . 19 MET HE2 1 1 10 4300 1 1 19 MET HE3 H -0.326 20.764 -15.845 1.00 . A A . 19 MET HE3 1 1 10 4301 1 1 19 MET HG2 H -2.144 19.524 -17.003 1.00 . A A . 19 MET HG2 1 1 10 4302 1 1 19 MET HG3 H -2.195 18.041 -16.052 1.00 . A A . 19 MET HG3 1 1 10 4303 1 1 19 MET N N -4.129 16.603 -17.407 1.00 . A A . 19 MET N 1 1 10 4304 1 1 19 MET O O -4.647 18.014 -20.492 1.00 . A A . 19 MET O 1 1 10 4305 1 1 19 MET SD S 0.038 18.573 -16.741 1.00 . A A . 19 MET SD 1 1 10 4306 1 1 20 LEU C C -5.458 15.422 -21.644 1.00 . A A . 20 LEU C 1 1 10 4307 1 1 20 LEU CA C -3.944 15.548 -21.499 1.00 . A A . 20 LEU CA 1 1 10 4308 1 1 20 LEU CB C -3.256 14.175 -21.722 1.00 . A A . 20 LEU CB 1 1 10 4309 1 1 20 LEU CD1 C -0.970 15.188 -21.242 1.00 . A A . 20 LEU CD1 1 1 10 4310 1 1 20 LEU CD2 C -1.156 12.956 -22.399 1.00 . A A . 20 LEU CD2 1 1 10 4311 1 1 20 LEU CG C -1.800 14.344 -22.229 1.00 . A A . 20 LEU CG 1 1 10 4312 1 1 20 LEU H H -3.144 15.478 -19.530 1.00 . A A . 20 LEU H 1 1 10 4313 1 1 20 LEU HA H -3.591 16.261 -22.236 1.00 . A A . 20 LEU HA 1 1 10 4314 1 1 20 LEU HB2 H -3.241 13.636 -20.786 1.00 . A A . 20 LEU HB2 1 1 10 4315 1 1 20 LEU HB3 H -3.814 13.602 -22.446 1.00 . A A . 20 LEU HB3 1 1 10 4316 1 1 20 LEU HD11 H -1.044 14.769 -20.251 1.00 . A A . 20 LEU HD11 1 1 10 4317 1 1 20 LEU HD12 H -1.341 16.204 -21.234 1.00 . A A . 20 LEU HD12 1 1 10 4318 1 1 20 LEU HD13 H 0.067 15.197 -21.551 1.00 . A A . 20 LEU HD13 1 1 10 4319 1 1 20 LEU HD21 H -1.103 12.463 -21.440 1.00 . A A . 20 LEU HD21 1 1 10 4320 1 1 20 LEU HD22 H -0.161 13.067 -22.801 1.00 . A A . 20 LEU HD22 1 1 10 4321 1 1 20 LEU HD23 H -1.752 12.361 -23.077 1.00 . A A . 20 LEU HD23 1 1 10 4322 1 1 20 LEU HG H -1.820 14.844 -23.187 1.00 . A A . 20 LEU HG 1 1 10 4323 1 1 20 LEU N N -3.635 16.046 -20.159 1.00 . A A . 20 LEU N 1 1 10 4324 1 1 20 LEU O O -6.026 15.730 -22.692 1.00 . A A . 20 LEU O 1 1 10 4325 1 1 21 GLY C C -8.212 16.169 -20.696 1.00 . A A . 21 GLY C 1 1 10 4326 1 1 21 GLY CA C -7.551 14.810 -20.569 1.00 . A A . 21 GLY CA 1 1 10 4327 1 1 21 GLY H H -5.582 14.754 -19.765 1.00 . A A . 21 GLY H 1 1 10 4328 1 1 21 GLY HA2 H -7.849 14.188 -21.404 1.00 . A A . 21 GLY HA2 1 1 10 4329 1 1 21 GLY HA3 H -7.863 14.348 -19.647 1.00 . A A . 21 GLY HA3 1 1 10 4330 1 1 21 GLY N N -6.098 14.970 -20.572 1.00 . A A . 21 GLY N 1 1 10 4331 1 1 21 GLY O O -9.240 16.321 -21.357 1.00 . A A . 21 GLY O 1 1 10 4332 1 1 22 SER C C -7.980 19.033 -21.577 1.00 . A A . 22 SER C 1 1 10 4333 1 1 22 SER CA C -8.091 18.537 -20.143 1.00 . A A . 22 SER CA 1 1 10 4334 1 1 22 SER CB C -7.307 19.460 -19.203 1.00 . A A . 22 SER CB 1 1 10 4335 1 1 22 SER H H -6.750 16.979 -19.595 1.00 . A A . 22 SER H 1 1 10 4336 1 1 22 SER HA H -9.134 18.550 -19.851 1.00 . A A . 22 SER HA 1 1 10 4337 1 1 22 SER HB2 H -7.418 19.121 -18.186 1.00 . A A . 22 SER HB2 1 1 10 4338 1 1 22 SER HB3 H -6.262 19.450 -19.466 1.00 . A A . 22 SER HB3 1 1 10 4339 1 1 22 SER HG H -8.676 20.804 -18.875 1.00 . A A . 22 SER HG 1 1 10 4340 1 1 22 SER N N -7.586 17.167 -20.076 1.00 . A A . 22 SER N 1 1 10 4341 1 1 22 SER O O -8.883 19.691 -22.095 1.00 . A A . 22 SER O 1 1 10 4342 1 1 22 SER OG O -7.823 20.779 -19.311 1.00 . A A . 22 SER OG 1 1 10 4343 1 1 23 PHE C C -7.561 18.289 -24.521 1.00 . A A . 23 PHE C 1 1 10 4344 1 1 23 PHE CA C -6.621 19.074 -23.607 1.00 . A A . 23 PHE CA 1 1 10 4345 1 1 23 PHE CB C -5.164 18.772 -23.983 1.00 . A A . 23 PHE CB 1 1 10 4346 1 1 23 PHE CD1 C -4.536 20.677 -25.538 1.00 . A A . 23 PHE CD1 1 1 10 4347 1 1 23 PHE CD2 C -4.880 18.475 -26.505 1.00 . A A . 23 PHE CD2 1 1 10 4348 1 1 23 PHE CE1 C -4.248 21.187 -26.808 1.00 . A A . 23 PHE CE1 1 1 10 4349 1 1 23 PHE CE2 C -4.591 18.992 -27.775 1.00 . A A . 23 PHE CE2 1 1 10 4350 1 1 23 PHE CG C -4.852 19.319 -25.377 1.00 . A A . 23 PHE CG 1 1 10 4351 1 1 23 PHE CZ C -4.277 20.346 -27.925 1.00 . A A . 23 PHE CZ 1 1 10 4352 1 1 23 PHE H H -6.189 18.152 -21.751 1.00 . A A . 23 PHE H 1 1 10 4353 1 1 23 PHE HA H -6.806 20.138 -23.726 1.00 . A A . 23 PHE HA 1 1 10 4354 1 1 23 PHE HB2 H -4.507 19.235 -23.254 1.00 . A A . 23 PHE HB2 1 1 10 4355 1 1 23 PHE HB3 H -5.007 17.704 -23.961 1.00 . A A . 23 PHE HB3 1 1 10 4356 1 1 23 PHE HD1 H -4.513 21.331 -24.679 1.00 . A A . 23 PHE HD1 1 1 10 4357 1 1 23 PHE HD2 H -5.124 17.429 -26.392 1.00 . A A . 23 PHE HD2 1 1 10 4358 1 1 23 PHE HE1 H -4.003 22.233 -26.925 1.00 . A A . 23 PHE HE1 1 1 10 4359 1 1 23 PHE HE2 H -4.614 18.345 -28.640 1.00 . A A . 23 PHE HE2 1 1 10 4360 1 1 23 PHE HZ H -4.053 20.742 -28.906 1.00 . A A . 23 PHE HZ 1 1 10 4361 1 1 23 PHE N N -6.862 18.689 -22.219 1.00 . A A . 23 PHE N 1 1 10 4362 1 1 23 PHE O O -7.297 17.135 -24.862 1.00 . A A . 23 PHE O 1 1 10 4363 1 1 24 ARG C C -9.030 17.863 -27.105 1.00 . A A . 24 ARG C 1 1 10 4364 1 1 24 ARG CA C -9.652 18.293 -25.768 1.00 . A A . 24 ARG CA 1 1 10 4365 1 1 24 ARG CB C -10.823 19.271 -26.011 1.00 . A A . 24 ARG CB 1 1 10 4366 1 1 24 ARG CD C -11.470 21.578 -26.808 1.00 . A A . 24 ARG CD 1 1 10 4367 1 1 24 ARG CG C -10.297 20.617 -26.543 1.00 . A A . 24 ARG CG 1 1 10 4368 1 1 24 ARG CZ C -13.362 21.742 -28.348 1.00 . A A . 24 ARG CZ 1 1 10 4369 1 1 24 ARG H H -8.798 19.829 -24.585 1.00 . A A . 24 ARG H 1 1 10 4370 1 1 24 ARG HA H -10.036 17.414 -25.268 1.00 . A A . 24 ARG HA 1 1 10 4371 1 1 24 ARG HB2 H -11.513 18.845 -26.728 1.00 . A A . 24 ARG HB2 1 1 10 4372 1 1 24 ARG HB3 H -11.346 19.445 -25.080 1.00 . A A . 24 ARG HB3 1 1 10 4373 1 1 24 ARG HD2 H -12.097 21.644 -25.929 1.00 . A A . 24 ARG HD2 1 1 10 4374 1 1 24 ARG HD3 H -11.081 22.561 -27.040 1.00 . A A . 24 ARG HD3 1 1 10 4375 1 1 24 ARG HE H -11.978 20.292 -28.416 1.00 . A A . 24 ARG HE 1 1 10 4376 1 1 24 ARG HG2 H -9.629 21.055 -25.812 1.00 . A A . 24 ARG HG2 1 1 10 4377 1 1 24 ARG HG3 H -9.760 20.456 -27.465 1.00 . A A . 24 ARG HG3 1 1 10 4378 1 1 24 ARG HH11 H -13.283 23.144 -26.917 1.00 . A A . 24 ARG HH11 1 1 10 4379 1 1 24 ARG HH12 H -14.599 23.288 -28.034 1.00 . A A . 24 ARG HH12 1 1 10 4380 1 1 24 ARG HH21 H -13.711 20.482 -29.865 1.00 . A A . 24 ARG HH21 1 1 10 4381 1 1 24 ARG HH22 H -14.841 21.787 -29.698 1.00 . A A . 24 ARG HH22 1 1 10 4382 1 1 24 ARG N N -8.654 18.923 -24.902 1.00 . A A . 24 ARG N 1 1 10 4383 1 1 24 ARG NE N -12.266 21.098 -27.938 1.00 . A A . 24 ARG NE 1 1 10 4384 1 1 24 ARG NH1 N -13.782 22.807 -27.715 1.00 . A A . 24 ARG NH1 1 1 10 4385 1 1 24 ARG NH2 N -14.024 21.302 -29.383 1.00 . A A . 24 ARG NH2 1 1 10 4386 1 1 24 ARG O O -8.202 18.571 -27.677 1.00 . A A . 24 ARG O 1 1 10 4387 1 1 25 LYS C C -9.532 16.938 -30.042 1.00 . A A . 25 LYS C 1 1 10 4388 1 1 25 LYS CA C -8.938 16.161 -28.866 1.00 . A A . 25 LYS CA 1 1 10 4389 1 1 25 LYS CB C -9.283 14.664 -28.974 1.00 . A A . 25 LYS CB 1 1 10 4390 1 1 25 LYS CD C -11.129 12.941 -28.942 1.00 . A A . 25 LYS CD 1 1 10 4391 1 1 25 LYS CE C -12.647 12.731 -29.003 1.00 . A A . 25 LYS CE 1 1 10 4392 1 1 25 LYS CG C -10.810 14.449 -28.905 1.00 . A A . 25 LYS CG 1 1 10 4393 1 1 25 LYS H H -10.106 16.173 -27.094 1.00 . A A . 25 LYS H 1 1 10 4394 1 1 25 LYS HA H -7.859 16.267 -28.895 1.00 . A A . 25 LYS HA 1 1 10 4395 1 1 25 LYS HB2 H -8.911 14.279 -29.913 1.00 . A A . 25 LYS HB2 1 1 10 4396 1 1 25 LYS HB3 H -8.811 14.132 -28.160 1.00 . A A . 25 LYS HB3 1 1 10 4397 1 1 25 LYS HD2 H -10.673 12.494 -29.817 1.00 . A A . 25 LYS HD2 1 1 10 4398 1 1 25 LYS HD3 H -10.740 12.466 -28.053 1.00 . A A . 25 LYS HD3 1 1 10 4399 1 1 25 LYS HE2 H -13.036 13.188 -29.902 1.00 . A A . 25 LYS HE2 1 1 10 4400 1 1 25 LYS HE3 H -12.864 11.674 -29.016 1.00 . A A . 25 LYS HE3 1 1 10 4401 1 1 25 LYS HG2 H -11.189 14.873 -27.986 1.00 . A A . 25 LYS HG2 1 1 10 4402 1 1 25 LYS HG3 H -11.284 14.935 -29.748 1.00 . A A . 25 LYS HG3 1 1 10 4403 1 1 25 LYS HZ1 H -12.774 13.072 -26.953 1.00 . A A . 25 LYS HZ1 1 1 10 4404 1 1 25 LYS HZ2 H -14.277 13.040 -27.744 1.00 . A A . 25 LYS HZ2 1 1 10 4405 1 1 25 LYS HZ3 H -13.257 14.389 -27.905 1.00 . A A . 25 LYS HZ3 1 1 10 4406 1 1 25 LYS N N -9.444 16.692 -27.596 1.00 . A A . 25 LYS N 1 1 10 4407 1 1 25 LYS NZ N -13.287 13.355 -27.810 1.00 . A A . 25 LYS NZ 1 1 10 4408 1 1 25 LYS O O -10.681 17.377 -29.984 1.00 . A A . 25 LYS O 1 1 10 4409 1 1 26 ASP C C -9.709 19.224 -31.934 1.00 . A A . 26 ASP C 1 1 10 4410 1 1 26 ASP CA C -9.190 17.829 -32.296 1.00 . A A . 26 ASP CA 1 1 10 4411 1 1 26 ASP CB C -10.293 17.034 -33.011 1.00 . A A . 26 ASP CB 1 1 10 4412 1 1 26 ASP CG C -9.775 15.654 -33.403 1.00 . A A . 26 ASP CG 1 1 10 4413 1 1 26 ASP H H -7.836 16.733 -31.086 1.00 . A A . 26 ASP H 1 1 10 4414 1 1 26 ASP HA H -8.353 17.941 -32.970 1.00 . A A . 26 ASP HA 1 1 10 4415 1 1 26 ASP HB2 H -11.143 16.926 -32.356 1.00 . A A . 26 ASP HB2 1 1 10 4416 1 1 26 ASP HB3 H -10.595 17.563 -33.904 1.00 . A A . 26 ASP HB3 1 1 10 4417 1 1 26 ASP N N -8.741 17.105 -31.103 1.00 . A A . 26 ASP N 1 1 10 4418 1 1 26 ASP O O -10.136 19.927 -32.833 1.00 . A A . 26 ASP O 1 1 10 4419 1 1 26 ASP OD1 O -8.598 15.544 -33.703 1.00 . A A . 26 ASP OD1 1 1 10 4420 1 1 26 ASP OD2 O -10.563 14.723 -33.393 1.00 . A A . 26 ASP OD2 1 1 stop_ save_
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