NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
630612 | 6cos | 30431 | cing | 4-filtered-FRED | STAR | entry | full | 383 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6cos # This FRED archive file contains, for PDB entry <6cos>: # # - 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_6cos _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6cos _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2246.72 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 $Competence_stimulating_peptide_type_1 A . 1 1 stop_ save_ save_Competence_stimulating_peptide_type_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Competence stimulating peptide type 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code EMRLSKFFRDXILQRKK _Entity.Number_of_monomers 17 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 GLU . 1 1 2 MET . 1 1 3 ARG . 1 1 4 LEU . 1 1 5 SER . 1 1 6 LYS . 1 1 7 PHE . 1 1 8 PHE . 1 1 9 ARG . 1 1 10 ASP . 1 1 11 . $. 1 1 12 ILE . 1 1 13 LEU . 1 1 14 GLN . 1 1 15 ARG . 1 1 16 LYS . 1 1 17 LYS . 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 GLU 1 1 1 1 MET 2 2 1 1 ARG 3 3 1 1 LEU 4 4 1 1 SER 5 5 1 1 LYS 6 6 1 1 PHE 7 7 1 1 PHE 8 8 1 1 ARG 9 9 1 1 ASP 10 10 1 1 . 11 11 1 1 ILE 12 12 1 1 LEU 13 13 1 1 GLN 14 14 1 1 ARG 15 15 1 1 LYS 16 16 1 1 LYS 17 17 1 1 stop_ save_ save_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 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 2 MET HA . 2 . HA 1 1 1 1 2 1 1 2 MET ME . 2 . HE# 1 1 2 1 1 1 1 2 MET HA . 2 . HA 1 1 2 1 2 1 1 2 MET QG . 2 . HG2 1 1 3 1 1 1 1 2 MET ME . 2 . HE# 1 1 3 1 2 1 1 2 MET QG . 2 . HG2 1 1 4 1 1 1 1 2 MET HA . 2 . HA 1 1 4 1 2 1 1 3 ARG QB . 3 . HB2 1 1 5 1 1 1 1 2 MET HA . 2 . HA 1 1 5 1 2 1 1 3 ARG H . 3 . HN 1 1 6 1 1 1 1 2 MET QB . 2 . HB2 1 1 6 1 2 1 1 3 ARG H . 3 . HN 1 1 7 1 1 1 1 2 MET ME . 2 . HE# 1 1 7 1 2 1 1 3 ARG HA . 3 . HA 1 1 8 1 1 1 1 2 MET ME . 2 . HE# 1 1 8 1 2 1 1 3 ARG H . 3 . HN 1 1 9 1 1 1 1 2 MET QG . 2 . HG2 1 1 9 1 2 1 1 3 ARG H . 3 . HN 1 1 10 1 1 1 1 2 MET HA . 2 . HA 1 1 10 1 2 1 1 4 LEU H . 4 . HN 1 1 11 1 1 1 1 2 MET QB . 2 . HB2 1 1 11 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 12 1 1 1 1 2 MET QB . 2 . HB2 1 1 12 1 2 1 1 4 LEU H . 4 . HN 1 1 13 1 1 1 1 2 MET ME . 2 . HE# 1 1 13 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 14 1 1 1 1 2 MET ME . 2 . HE# 1 1 14 1 2 1 1 4 LEU H . 4 . HN 1 1 15 1 1 1 1 2 MET QG . 2 . HG2 1 1 15 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 16 1 1 1 1 2 MET QG . 2 . HG2 1 1 16 1 2 1 1 4 LEU H . 4 . HN 1 1 17 1 1 1 1 2 MET HA . 2 . HA 1 1 17 1 2 1 1 5 SER H . 5 . HN 1 1 18 1 1 1 1 2 MET QB . 2 . HB2 1 1 18 1 2 1 1 5 SER QB . 5 . HB2 1 1 19 1 1 1 1 2 MET QB . 2 . HB2 1 1 19 1 2 1 1 5 SER H . 5 . HN 1 1 20 1 1 1 1 2 MET ME . 2 . HE# 1 1 20 1 2 1 1 5 SER QB . 5 . HB2 1 1 21 1 1 1 1 2 MET ME . 2 . HE# 1 1 21 1 2 1 1 5 SER H . 5 . HN 1 1 22 1 1 1 1 2 MET QG . 2 . HG2 1 1 22 1 2 1 1 5 SER H . 5 . HN 1 1 23 1 1 1 1 2 MET QB . 2 . HB2 1 1 23 1 2 1 1 7 PHE QE . 7 . HE# 1 1 24 1 1 1 1 2 MET QB . 2 . HB2 1 1 24 1 2 1 1 8 PHE QE . 8 . HE# 1 1 25 1 1 1 1 2 MET QB . 2 . HB2 1 1 25 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 26 1 1 1 1 3 ARG HA . 3 . HA 1 1 26 1 2 1 1 3 ARG QB . 3 . HB2 1 1 27 1 1 1 1 3 ARG HA . 3 . HA 1 1 27 1 2 1 1 3 ARG QD . 3 . HD2 1 1 28 1 1 1 1 3 ARG HA . 3 . HA 1 1 28 1 2 1 1 3 ARG QG . 3 . HG# 1 1 29 1 1 1 1 3 ARG H . 3 . HN 1 1 29 1 2 1 1 3 ARG HA . 3 . HA 1 1 30 1 1 1 1 3 ARG QB . 3 . HB2 1 1 30 1 2 1 1 3 ARG QD . 3 . HD2 1 1 31 1 1 1 1 3 ARG QB . 3 . HB2 1 1 31 1 2 1 1 3 ARG HE . 3 . HE 1 1 32 1 1 1 1 3 ARG H . 3 . HN 1 1 32 1 2 1 1 3 ARG QB . 3 . HB2 1 1 33 1 1 1 1 3 ARG QD . 3 . HD2 1 1 33 1 2 1 1 3 ARG HE . 3 . HE 1 1 34 1 1 1 1 3 ARG QD . 3 . HD2 1 1 34 1 2 1 1 3 ARG QG . 3 . HG# 1 1 35 1 1 1 1 3 ARG H . 3 . HN 1 1 35 1 2 1 1 3 ARG QD . 3 . HD2 1 1 36 1 1 1 1 3 ARG HE . 3 . HE 1 1 36 1 2 1 1 3 ARG QG . 3 . HG# 1 1 37 1 1 1 1 3 ARG H . 3 . HN 1 1 37 1 2 1 1 3 ARG QG . 3 . HG# 1 1 38 1 1 1 1 3 ARG HA . 3 . HA 1 1 38 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 39 1 1 1 1 3 ARG HA . 3 . HA 1 1 39 1 2 1 1 4 LEU HG . 4 . HG 1 1 40 1 1 1 1 3 ARG HA . 3 . HA 1 1 40 1 2 1 1 4 LEU H . 4 . HN 1 1 41 1 1 1 1 3 ARG QB . 3 . HB2 1 1 41 1 2 1 1 4 LEU HA . 4 . HA 1 1 42 1 1 1 1 3 ARG QB . 3 . HB2 1 1 42 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 43 1 1 1 1 3 ARG QB . 3 . HB2 1 1 43 1 2 1 1 4 LEU H . 4 . HN 1 1 44 1 1 1 1 3 ARG QD . 3 . HD2 1 1 44 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 45 1 1 1 1 3 ARG QD . 3 . HD2 1 1 45 1 2 1 1 4 LEU H . 4 . HN 1 1 46 1 1 1 1 3 ARG H . 3 . HN 1 1 46 1 2 1 1 4 LEU HA . 4 . HA 1 1 47 1 1 1 1 3 ARG H . 3 . HN 1 1 47 1 2 1 1 4 LEU QB . 4 . HB2 1 1 48 1 1 1 1 3 ARG H . 3 . HN 1 1 48 1 2 1 1 4 LEU HG . 4 . HG 1 1 49 1 1 1 1 3 ARG H . 3 . HN 1 1 49 1 2 1 1 4 LEU H . 4 . HN 1 1 50 1 1 1 1 3 ARG HA . 3 . HA 1 1 50 1 2 1 1 5 SER H . 5 . HN 1 1 51 1 1 1 1 3 ARG QB . 3 . HB2 1 1 51 1 2 1 1 5 SER QB . 5 . HB2 1 1 52 1 1 1 1 3 ARG QB . 3 . HB2 1 1 52 1 2 1 1 5 SER H . 5 . HN 1 1 53 1 1 1 1 3 ARG H . 3 . HN 1 1 53 1 2 1 1 5 SER H . 5 . HN 1 1 54 1 1 1 1 3 ARG HA . 3 . HA 1 1 54 1 2 1 1 7 PHE H . 7 . HN 1 1 55 1 1 1 1 3 ARG QB . 3 . HB2 1 1 55 1 2 1 1 7 PHE QD . 7 . HD# 1 1 56 1 1 1 1 3 ARG QB . 3 . HB2 1 1 56 1 2 1 1 7 PHE QE . 7 . HE# 1 1 57 1 1 1 1 4 LEU HA . 4 . HA 1 1 57 1 2 1 1 4 LEU QB . 4 . HB2 1 1 58 1 1 1 1 4 LEU HA . 4 . HA 1 1 58 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 59 1 1 1 1 4 LEU H . 4 . HN 1 1 59 1 2 1 1 4 LEU HA . 4 . HA 1 1 60 1 1 1 1 4 LEU QB . 4 . HB2 1 1 60 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 61 1 1 1 1 4 LEU H . 4 . HN 1 1 61 1 2 1 1 4 LEU QB . 4 . HB2 1 1 62 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 62 1 2 1 1 4 LEU HG . 4 . HG 1 1 63 1 1 1 1 4 LEU H . 4 . HN 1 1 63 1 2 1 1 4 LEU QD . 4 . HD1# 1 1 64 1 1 1 1 4 LEU H . 4 . HN 1 1 64 1 2 1 1 4 LEU HG . 4 . HG 1 1 65 1 1 1 1 4 LEU QB . 4 . HB2 1 1 65 1 2 1 1 5 SER QB . 5 . HB2 1 1 66 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 66 1 2 1 1 5 SER QB . 5 . HB2 1 1 67 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 67 1 2 1 1 5 SER H . 5 . HN 1 1 68 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 68 1 2 1 1 5 SER HA . 5 . HA 1 1 69 1 1 1 1 4 LEU HG . 4 . HG 1 1 69 1 2 1 1 5 SER QB . 5 . HB2 1 1 70 1 1 1 1 4 LEU H . 4 . HN 1 1 70 1 2 1 1 5 SER HA . 5 . HA 1 1 71 1 1 1 1 4 LEU H . 4 . HN 1 1 71 1 2 1 1 5 SER QB . 5 . HB2 1 1 72 1 1 1 1 4 LEU H . 4 . HN 1 1 72 1 2 1 1 5 SER H . 5 . HN 1 1 73 1 1 1 1 4 LEU HA . 4 . HA 1 1 73 1 2 1 1 7 PHE QB . 7 . HB2 1 1 74 1 1 1 1 4 LEU HA . 4 . HA 1 1 74 1 2 1 1 7 PHE QD . 7 . HD# 1 1 75 1 1 1 1 4 LEU HA . 4 . HA 1 1 75 1 2 1 1 7 PHE QE . 7 . HE# 1 1 76 1 1 1 1 4 LEU HA . 4 . HA 1 1 76 1 2 1 1 7 PHE H . 7 . HN 1 1 77 1 1 1 1 4 LEU QB . 4 . HB2 1 1 77 1 2 1 1 7 PHE QD . 7 . HD# 1 1 78 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 78 1 2 1 1 7 PHE QB . 7 . HB2 1 1 79 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 79 1 2 1 1 7 PHE QD . 7 . HD# 1 1 80 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 80 1 2 1 1 7 PHE QE . 7 . HE# 1 1 81 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 81 1 2 1 1 7 PHE H . 7 . HN 1 1 82 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 82 1 2 1 1 7 PHE HA . 7 . HA 1 1 83 1 1 1 1 4 LEU HG . 4 . HG 1 1 83 1 2 1 1 7 PHE QD . 7 . HD# 1 1 84 1 1 1 1 4 LEU HG . 4 . HG 1 1 84 1 2 1 1 7 PHE QE . 7 . HE# 1 1 85 1 1 1 1 4 LEU H . 4 . HN 1 1 85 1 2 1 1 7 PHE QD . 7 . HD# 1 1 86 1 1 1 1 4 LEU HA . 4 . HA 1 1 86 1 2 1 1 8 PHE QB . 8 . HB2 1 1 87 1 1 1 1 4 LEU HA . 4 . HA 1 1 87 1 2 1 1 8 PHE QE . 8 . HE# 1 1 88 1 1 1 1 4 LEU HA . 4 . HA 1 1 88 1 2 1 1 8 PHE H . 8 . HN 1 1 89 1 1 1 1 4 LEU HA . 4 . HA 1 1 89 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 90 1 1 1 1 4 LEU QB . 4 . HB2 1 1 90 1 2 1 1 8 PHE QD . 8 . HD# 1 1 91 1 1 1 1 4 LEU QB . 4 . HB2 1 1 91 1 2 1 1 8 PHE QE . 8 . HE# 1 1 92 1 1 1 1 4 LEU QB . 4 . HB2 1 1 92 1 2 1 1 8 PHE H . 8 . HN 1 1 93 1 1 1 1 4 LEU QB . 4 . HB2 1 1 93 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 94 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 94 1 2 1 1 8 PHE HA . 8 . HA 1 1 95 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 95 1 2 1 1 8 PHE QB . 8 . HB2 1 1 96 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 96 1 2 1 1 8 PHE QD . 8 . HD# 1 1 97 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 97 1 2 1 1 8 PHE QE . 8 . HE# 1 1 98 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 98 1 2 1 1 8 PHE H . 8 . HN 1 1 99 1 1 1 1 4 LEU QD . 4 . HD1# 1 1 99 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 100 1 1 1 1 4 LEU HG . 4 . HG 1 1 100 1 2 1 1 8 PHE QE . 8 . HE# 1 1 101 1 1 1 1 4 LEU HG . 4 . HG 1 1 101 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 102 1 1 1 1 4 LEU H . 4 . HN 1 1 102 1 2 1 1 8 PHE QE . 8 . HE# 1 1 103 1 1 1 1 4 LEU HA . 4 . HA 1 1 103 1 2 1 1 9 ARG H . 9 . HN 1 1 104 1 1 1 1 4 LEU H . 4 . HN 1 1 104 1 2 1 1 9 ARG H . 9 . HN 1 1 105 1 1 1 1 5 SER H . 5 . HN 1 1 105 1 2 1 1 5 SER HA . 5 . HA 1 1 106 1 1 1 1 5 SER H . 5 . HN 1 1 106 1 2 1 1 5 SER QB . 5 . HB2 1 1 107 1 1 1 1 5 SER HA . 5 . HA 1 1 107 1 2 1 1 7 PHE QB . 7 . HB2 1 1 108 1 1 1 1 5 SER HA . 5 . HA 1 1 108 1 2 1 1 7 PHE QD . 7 . HD# 1 1 109 1 1 1 1 5 SER QB . 5 . HB2 1 1 109 1 2 1 1 7 PHE QB . 7 . HB2 1 1 110 1 1 1 1 5 SER QB . 5 . HB2 1 1 110 1 2 1 1 7 PHE H . 7 . HN 1 1 111 1 1 1 1 5 SER H . 5 . HN 1 1 111 1 2 1 1 7 PHE QB . 7 . HB2 1 1 112 1 1 1 1 5 SER H . 5 . HN 1 1 112 1 2 1 1 7 PHE QD . 7 . HD# 1 1 113 1 1 1 1 5 SER H . 5 . HN 1 1 113 1 2 1 1 7 PHE QE . 7 . HE# 1 1 114 1 1 1 1 5 SER HA . 5 . HA 1 1 114 1 2 1 1 8 PHE QB . 8 . HB2 1 1 115 1 1 1 1 5 SER HA . 5 . HA 1 1 115 1 2 1 1 8 PHE QD . 8 . HD# 1 1 116 1 1 1 1 5 SER HA . 5 . HA 1 1 116 1 2 1 1 8 PHE QE . 8 . HE# 1 1 117 1 1 1 1 5 SER HA . 5 . HA 1 1 117 1 2 1 1 8 PHE H . 8 . HN 1 1 118 1 1 1 1 5 SER HA . 5 . HA 1 1 118 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 119 1 1 1 1 5 SER QB . 5 . HB2 1 1 119 1 2 1 1 8 PHE QB . 8 . HB2 1 1 120 1 1 1 1 5 SER QB . 5 . HB2 1 1 120 1 2 1 1 8 PHE QE . 8 . HE# 1 1 121 1 1 1 1 5 SER QB . 5 . HB2 1 1 121 1 2 1 1 8 PHE H . 8 . HN 1 1 122 1 1 1 1 5 SER QB . 5 . HB2 1 1 122 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 123 1 1 1 1 5 SER H . 5 . HN 1 1 123 1 2 1 1 8 PHE QB . 8 . HB2 1 1 124 1 1 1 1 5 SER H . 5 . HN 1 1 124 1 2 1 1 8 PHE QE . 8 . HE# 1 1 125 1 1 1 1 5 SER H . 5 . HN 1 1 125 1 2 1 1 8 PHE H . 8 . HN 1 1 126 1 1 1 1 5 SER HA . 5 . HA 1 1 126 1 2 1 1 9 ARG H . 9 . HN 1 1 127 1 1 1 1 5 SER QB . 5 . HB2 1 1 127 1 2 1 1 9 ARG H . 9 . HN 1 1 128 1 1 1 1 5 SER H . 5 . HN 1 1 128 1 2 1 1 9 ARG QB . 9 . HB2 1 1 129 1 1 1 1 5 SER H . 5 . HN 1 1 129 1 2 1 1 9 ARG H . 9 . HN 1 1 130 1 1 1 1 6 LYS H . 6 . HN 1 1 130 1 2 1 1 6 LYS QB . 6 . HB2 1 1 131 1 1 1 1 6 LYS H . 6 . HN 1 1 131 1 2 1 1 6 LYS QD . 6 . HD# 1 1 132 1 1 1 1 6 LYS H . 6 . HN 1 1 132 1 2 1 1 6 LYS QG . 6 . HG# 1 1 133 1 1 1 1 6 LYS H . 6 . HN 1 1 133 1 2 1 1 7 PHE HA . 7 . HA 1 1 134 1 1 1 1 6 LYS QB . 6 . HB2 1 1 134 1 2 1 1 10 ASP HA . 10 . HA 1 1 135 1 1 1 1 7 PHE HA . 7 . HA 1 1 135 1 2 1 1 7 PHE QB . 7 . HB2 1 1 136 1 1 1 1 7 PHE HA . 7 . HA 1 1 136 1 2 1 1 7 PHE QD . 7 . HD# 1 1 137 1 1 1 1 7 PHE HA . 7 . HA 1 1 137 1 2 1 1 7 PHE QE . 7 . HE# 1 1 138 1 1 1 1 7 PHE H . 7 . HN 1 1 138 1 2 1 1 7 PHE HA . 7 . HA 1 1 139 1 1 1 1 7 PHE QB . 7 . HB2 1 1 139 1 2 1 1 7 PHE QD . 7 . HD# 1 1 140 1 1 1 1 7 PHE H . 7 . HN 1 1 140 1 2 1 1 7 PHE QB . 7 . HB2 1 1 141 1 1 1 1 7 PHE H . 7 . HN 1 1 141 1 2 1 1 7 PHE QD . 7 . HD# 1 1 142 1 1 1 1 7 PHE H . 7 . HN 1 1 142 1 2 1 1 7 PHE QE . 7 . HE# 1 1 143 1 1 1 1 7 PHE HA . 7 . HA 1 1 143 1 2 1 1 8 PHE QE . 8 . HE# 1 1 144 1 1 1 1 7 PHE HA . 7 . HA 1 1 144 1 2 1 1 8 PHE H . 8 . HN 1 1 145 1 1 1 1 7 PHE QB . 7 . HB2 1 1 145 1 2 1 1 8 PHE HA . 8 . HA 1 1 146 1 1 1 1 7 PHE QB . 7 . HB2 1 1 146 1 2 1 1 8 PHE QB . 8 . HB2 1 1 147 1 1 1 1 7 PHE QB . 7 . HB2 1 1 147 1 2 1 1 8 PHE QE . 8 . HE# 1 1 148 1 1 1 1 7 PHE QB . 7 . HB2 1 1 148 1 2 1 1 8 PHE H . 8 . HN 1 1 149 1 1 1 1 7 PHE QD . 7 . HD# 1 1 149 1 2 1 1 8 PHE HA . 8 . HA 1 1 150 1 1 1 1 7 PHE QD . 7 . HD# 1 1 150 1 2 1 1 8 PHE QB . 8 . HB2 1 1 151 1 1 1 1 7 PHE QD . 7 . HD# 1 1 151 1 2 1 1 8 PHE H . 8 . HN 1 1 152 1 1 1 1 7 PHE QE . 7 . HE# 1 1 152 1 2 1 1 8 PHE HA . 8 . HA 1 1 153 1 1 1 1 7 PHE QE . 7 . HE# 1 1 153 1 2 1 1 8 PHE H . 8 . HN 1 1 154 1 1 1 1 7 PHE H . 7 . HN 1 1 154 1 2 1 1 8 PHE HA . 8 . HA 1 1 155 1 1 1 1 7 PHE H . 7 . HN 1 1 155 1 2 1 1 8 PHE QB . 8 . HB2 1 1 156 1 1 1 1 7 PHE H . 7 . HN 1 1 156 1 2 1 1 8 PHE QE . 8 . HE# 1 1 157 1 1 1 1 7 PHE H . 7 . HN 1 1 157 1 2 1 1 8 PHE H . 8 . HN 1 1 158 1 1 1 1 7 PHE H . 7 . HN 1 1 158 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 159 1 1 1 1 7 PHE QB . 7 . HB2 1 1 159 1 2 1 1 9 ARG QB . 9 . HB2 1 1 160 1 1 1 1 7 PHE QE . 7 . HE# 1 1 160 1 2 1 1 9 ARG QB . 9 . HB2 1 1 161 1 1 1 1 7 PHE H . 7 . HN 1 1 161 1 2 1 1 9 ARG HA . 9 . HA 1 1 162 1 1 1 1 7 PHE H . 7 . HN 1 1 162 1 2 1 1 9 ARG QB . 9 . HB2 1 1 163 1 1 1 1 7 PHE H . 7 . HN 1 1 163 1 2 1 1 9 ARG QG . 9 . HG# 1 1 164 1 1 1 1 7 PHE HA . 7 . HA 1 1 164 1 2 1 1 10 ASP QB . 10 . HB2 1 1 165 1 1 1 1 7 PHE QB . 7 . HB2 1 1 165 1 2 1 1 10 ASP H . 10 . HN 1 1 166 1 1 1 1 7 PHE QB . 7 . HB2 1 1 166 1 2 1 1 10 ASP HA . 10 . HA 1 1 167 1 1 1 1 7 PHE QD . 7 . HD# 1 1 167 1 2 1 1 10 ASP H . 10 . HN 1 1 168 1 1 1 1 7 PHE QE . 7 . HE# 1 1 168 1 2 1 1 10 ASP H . 10 . HN 1 1 169 1 1 1 1 7 PHE H . 7 . HN 1 1 169 1 2 1 1 10 ASP HA . 10 . HA 1 1 170 1 1 1 1 7 PHE H . 7 . HN 1 1 170 1 2 1 1 10 ASP H . 10 . HN 1 1 171 1 1 1 1 7 PHE QB . 7 . HB2 1 1 171 1 2 1 1 12 ILE MD . 12 . HD# 1 1 172 1 1 1 1 7 PHE QD . 7 . HD# 1 1 172 1 2 1 1 12 ILE MD . 12 . HD# 1 1 173 1 1 1 1 7 PHE QE . 7 . HE# 1 1 173 1 2 1 1 12 ILE HA . 12 . HA 1 1 174 1 1 1 1 7 PHE QE . 7 . HE# 1 1 174 1 2 1 1 12 ILE MD . 12 . HD# 1 1 175 1 1 1 1 7 PHE QE . 7 . HE# 1 1 175 1 2 1 1 12 ILE QG . 12 . HG12 1 1 176 1 1 1 1 7 PHE QE . 7 . HE# 1 1 176 1 2 1 1 12 ILE H . 12 . HN 1 1 177 1 1 1 1 7 PHE QB . 7 . HB2 1 1 177 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 178 1 1 1 1 7 PHE QE . 7 . HE# 1 1 178 1 2 1 1 13 LEU QB . 13 . HB2 1 1 179 1 1 1 1 7 PHE QE . 7 . HE# 1 1 179 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 180 1 1 1 1 7 PHE QE . 7 . HE# 1 1 180 1 2 1 1 13 LEU HG . 13 . HG 1 1 181 1 1 1 1 8 PHE HA . 8 . HA 1 1 181 1 2 1 1 8 PHE QB . 8 . HB2 1 1 182 1 1 1 1 8 PHE HA . 8 . HA 1 1 182 1 2 1 1 8 PHE QE . 8 . HE# 1 1 183 1 1 1 1 8 PHE H . 8 . HN 1 1 183 1 2 1 1 8 PHE HA . 8 . HA 1 1 184 1 1 1 1 8 PHE HA . 8 . HA 1 1 184 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 185 1 1 1 1 8 PHE H . 8 . HN 1 1 185 1 2 1 1 8 PHE QB . 8 . HB2 1 1 186 1 1 1 1 8 PHE QB . 8 . HB2 1 1 186 1 2 1 1 8 PHE QD . 8 . HD# 1 1 187 1 1 1 1 8 PHE H . 8 . HN 1 1 187 1 2 1 1 8 PHE QE . 8 . HE# 1 1 188 1 1 1 1 8 PHE H . 8 . HN 1 1 188 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 189 1 1 1 1 8 PHE HA . 8 . HA 1 1 189 1 2 1 1 9 ARG QB . 9 . HB2 1 1 190 1 1 1 1 8 PHE HA . 8 . HA 1 1 190 1 2 1 1 9 ARG H . 9 . HN 1 1 191 1 1 1 1 8 PHE QB . 8 . HB2 1 1 191 1 2 1 1 9 ARG HA . 9 . HA 1 1 192 1 1 1 1 8 PHE QE . 8 . HE# 1 1 192 1 2 1 1 9 ARG HA . 9 . HA 1 1 193 1 1 1 1 8 PHE QE . 8 . HE# 1 1 193 1 2 1 1 9 ARG QB . 9 . HB2 1 1 194 1 1 1 1 8 PHE QE . 8 . HE# 1 1 194 1 2 1 1 9 ARG QD . 9 . HD# 1 1 195 1 1 1 1 8 PHE QE . 8 . HE# 1 1 195 1 2 1 1 9 ARG QG . 9 . HG# 1 1 196 1 1 1 1 8 PHE H . 8 . HN 1 1 196 1 2 1 1 9 ARG HA . 9 . HA 1 1 197 1 1 1 1 8 PHE H . 8 . HN 1 1 197 1 2 1 1 9 ARG QB . 9 . HB2 1 1 198 1 1 1 1 8 PHE H . 8 . HN 1 1 198 1 2 1 1 9 ARG QG . 9 . HG# 1 1 199 1 1 1 1 8 PHE HZ . 8 . HZ 1 1 199 1 2 1 1 9 ARG HA . 9 . HA 1 1 200 1 1 1 1 8 PHE HA . 8 . HA 1 1 200 1 2 1 1 10 ASP H . 10 . HN 1 1 201 1 1 1 1 8 PHE QB . 8 . HB2 1 1 201 1 2 1 1 10 ASP H . 10 . HN 1 1 202 1 1 1 1 8 PHE QE . 8 . HE# 1 1 202 1 2 1 1 10 ASP H . 10 . HN 1 1 203 1 1 1 1 8 PHE H . 8 . HN 1 1 203 1 2 1 1 10 ASP HA . 10 . HA 1 1 204 1 1 1 1 8 PHE H . 8 . HN 1 1 204 1 2 1 1 10 ASP H . 10 . HN 1 1 205 1 1 1 1 8 PHE HA . 8 . HA 1 1 205 1 2 1 1 12 ILE HB . 12 . HB 1 1 206 1 1 1 1 8 PHE HA . 8 . HA 1 1 206 1 2 1 1 12 ILE MD . 12 . HD# 1 1 207 1 1 1 1 8 PHE HA . 8 . HA 1 1 207 1 2 1 1 12 ILE H . 12 . HN 1 1 208 1 1 1 1 8 PHE QB . 8 . HB2 1 1 208 1 2 1 1 12 ILE MD . 12 . HD# 1 1 209 1 1 1 1 8 PHE QB . 8 . HB2 1 1 209 1 2 1 1 12 ILE QG . 12 . HG12 1 1 210 1 1 1 1 8 PHE QD . 8 . HD# 1 1 210 1 2 1 1 12 ILE MD . 12 . HD# 1 1 211 1 1 1 1 8 PHE QE . 8 . HE# 1 1 211 1 2 1 1 12 ILE MD . 12 . HD# 1 1 212 1 1 1 1 8 PHE QE . 8 . HE# 1 1 212 1 2 1 1 12 ILE QG . 12 . HG12 1 1 213 1 1 1 1 8 PHE QE . 8 . HE# 1 1 213 1 2 1 1 12 ILE H . 12 . HN 1 1 214 1 1 1 1 8 PHE H . 8 . HN 1 1 214 1 2 1 1 12 ILE MD . 12 . HD# 1 1 215 1 1 1 1 8 PHE HZ . 8 . HZ 1 1 215 1 2 1 1 12 ILE MD . 12 . HD# 1 1 216 1 1 1 1 8 PHE HA . 8 . HA 1 1 216 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 217 1 1 1 1 8 PHE QD . 8 . HD# 1 1 217 1 2 1 1 13 LEU QB . 13 . HB2 1 1 218 1 1 1 1 8 PHE QD . 8 . HD# 1 1 218 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 219 1 1 1 1 8 PHE QE . 8 . HE# 1 1 219 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 220 1 1 1 1 8 PHE QE . 8 . HE# 1 1 220 1 2 1 1 13 LEU HG . 13 . HG 1 1 221 1 1 1 1 8 PHE H . 8 . HN 1 1 221 1 2 1 1 13 LEU H . 13 . HN 1 1 222 1 1 1 1 8 PHE HZ . 8 . HZ 1 1 222 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 223 1 1 1 1 9 ARG HA . 9 . HA 1 1 223 1 2 1 1 9 ARG QB . 9 . HB2 1 1 224 1 1 1 1 9 ARG HA . 9 . HA 1 1 224 1 2 1 1 9 ARG QD . 9 . HD# 1 1 225 1 1 1 1 9 ARG HA . 9 . HA 1 1 225 1 2 1 1 9 ARG QG . 9 . HG# 1 1 226 1 1 1 1 9 ARG H . 9 . HN 1 1 226 1 2 1 1 9 ARG HA . 9 . HA 1 1 227 1 1 1 1 9 ARG QB . 9 . HB2 1 1 227 1 2 1 1 9 ARG QD . 9 . HD# 1 1 228 1 1 1 1 9 ARG QB . 9 . HB2 1 1 228 1 2 1 1 9 ARG HE . 9 . HE 1 1 229 1 1 1 1 9 ARG H . 9 . HN 1 1 229 1 2 1 1 9 ARG QB . 9 . HB2 1 1 230 1 1 1 1 9 ARG QD . 9 . HD# 1 1 230 1 2 1 1 9 ARG HE . 9 . HE 1 1 231 1 1 1 1 9 ARG H . 9 . HN 1 1 231 1 2 1 1 9 ARG QD . 9 . HD# 1 1 232 1 1 1 1 9 ARG HE . 9 . HE 1 1 232 1 2 1 1 9 ARG QG . 9 . HG# 1 1 233 1 1 1 1 9 ARG H . 9 . HN 1 1 233 1 2 1 1 9 ARG QG . 9 . HG# 1 1 234 1 1 1 1 9 ARG HA . 9 . HA 1 1 234 1 2 1 1 10 ASP QB . 10 . HB2 1 1 235 1 1 1 1 9 ARG HA . 9 . HA 1 1 235 1 2 1 1 10 ASP H . 10 . HN 1 1 236 1 1 1 1 9 ARG QB . 9 . HB2 1 1 236 1 2 1 1 10 ASP HA . 10 . HA 1 1 237 1 1 1 1 9 ARG H . 9 . HN 1 1 237 1 2 1 1 10 ASP HA . 10 . HA 1 1 238 1 1 1 1 9 ARG H . 9 . HN 1 1 238 1 2 1 1 10 ASP QB . 10 . HB2 1 1 239 1 1 1 1 9 ARG HA . 9 . HA 1 1 239 1 2 1 1 12 ILE H . 12 . HN 1 1 240 1 1 1 1 9 ARG H . 9 . HN 1 1 240 1 2 1 1 12 ILE MD . 12 . HD# 1 1 241 1 1 1 1 9 ARG HA . 9 . HA 1 1 241 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 242 1 1 1 1 9 ARG QB . 9 . HB2 1 1 242 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 243 1 1 1 1 9 ARG QD . 9 . HD# 1 1 243 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 244 1 1 1 1 9 ARG H . 9 . HN 1 1 244 1 2 1 1 13 LEU H . 13 . HN 1 1 245 1 1 1 1 10 ASP HA . 10 . HA 1 1 245 1 2 1 1 10 ASP QB . 10 . HB2 1 1 246 1 1 1 1 10 ASP H . 10 . HN 1 1 246 1 2 1 1 10 ASP HA . 10 . HA 1 1 247 1 1 1 1 10 ASP H . 10 . HN 1 1 247 1 2 1 1 10 ASP QB . 10 . HB2 1 1 248 1 1 1 1 10 ASP H . 10 . HN 1 1 248 1 2 1 1 12 ILE MD . 12 . HD# 1 1 249 1 1 1 1 10 ASP H . 10 . HN 1 1 249 1 2 1 1 12 ILE MD . 12 . HD1# 1 1 249 1 2 1 1 12 ILE MG . 12 . HG2# 1 1 250 1 1 1 1 10 ASP HA . 10 . HA 1 1 250 1 2 1 1 13 LEU QB . 13 . HB2 1 1 251 1 1 1 1 10 ASP HA . 10 . HA 1 1 251 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 252 1 1 1 1 10 ASP HA . 10 . HA 1 1 252 1 2 1 1 13 LEU HG . 13 . HG 1 1 253 1 1 1 1 10 ASP HA . 10 . HA 1 1 253 1 2 1 1 13 LEU H . 13 . HN 1 1 254 1 1 1 1 10 ASP QB . 10 . HB2 1 1 254 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 255 1 1 1 1 10 ASP H . 10 . HN 1 1 255 1 2 1 1 13 LEU HG . 13 . HG 1 1 256 1 1 1 1 10 ASP QB . 10 . HB2 1 1 256 1 2 1 1 14 GLN QE . 14 . HE2# 1 1 257 1 1 1 1 12 ILE HA . 12 . HA 1 1 257 1 2 1 1 12 ILE HB . 12 . HB 1 1 258 1 1 1 1 12 ILE HA . 12 . HA 1 1 258 1 2 1 1 12 ILE MD . 12 . HD# 1 1 259 1 1 1 1 12 ILE HA . 12 . HA 1 1 259 1 2 1 1 12 ILE QG . 12 . HG12 1 1 260 1 1 1 1 12 ILE HA . 12 . HA 1 1 260 1 2 1 1 12 ILE MD . 12 . HD1# 1 1 260 1 2 1 1 12 ILE MG . 12 . HG2# 1 1 261 1 1 1 1 12 ILE H . 12 . HN 1 1 261 1 2 1 1 12 ILE HA . 12 . HA 1 1 262 1 1 1 1 12 ILE HB . 12 . HB 1 1 262 1 2 1 1 12 ILE MD . 12 . HD# 1 1 263 1 1 1 1 12 ILE H . 12 . HN 1 1 263 1 2 1 1 12 ILE HB . 12 . HB 1 1 264 1 1 1 1 12 ILE MD . 12 . HD# 1 1 264 1 2 1 1 12 ILE QG . 12 . HG12 1 1 265 1 1 1 1 12 ILE H . 12 . HN 1 1 265 1 2 1 1 12 ILE MD . 12 . HD# 1 1 266 1 1 1 1 12 ILE H . 12 . HN 1 1 266 1 2 1 1 12 ILE QG . 12 . HG12 1 1 267 1 1 1 1 12 ILE H . 12 . HN 1 1 267 1 2 1 1 12 ILE MD . 12 . HD1# 1 1 267 1 2 1 1 12 ILE MG . 12 . HG2# 1 1 268 1 1 1 1 12 ILE HA . 12 . HA 1 1 268 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 269 1 1 1 1 12 ILE HA . 12 . HA 1 1 269 1 2 1 1 13 LEU HG . 13 . HG 1 1 270 1 1 1 1 12 ILE HA . 12 . HA 1 1 270 1 2 1 1 13 LEU H . 13 . HN 1 1 271 1 1 1 1 12 ILE MD . 12 . HD# 1 1 271 1 2 1 1 13 LEU HA . 13 . HA 1 1 272 1 1 1 1 12 ILE MD . 12 . HD# 1 1 272 1 2 1 1 13 LEU QB . 13 . HB2 1 1 273 1 1 1 1 12 ILE MD . 12 . HD# 1 1 273 1 2 1 1 13 LEU HG . 13 . HG 1 1 274 1 1 1 1 12 ILE MD . 12 . HD# 1 1 274 1 2 1 1 13 LEU H . 13 . HN 1 1 275 1 1 1 1 12 ILE QG . 12 . HG12 1 1 275 1 2 1 1 13 LEU H . 13 . HN 1 1 276 1 1 1 1 12 ILE H . 12 . HN 1 1 276 1 2 1 1 13 LEU HA . 13 . HA 1 1 277 1 1 1 1 12 ILE H . 12 . HN 1 1 277 1 2 1 1 13 LEU QB . 13 . HB2 1 1 278 1 1 1 1 12 ILE H . 12 . HN 1 1 278 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 279 1 1 1 1 12 ILE H . 12 . HN 1 1 279 1 2 1 1 13 LEU HG . 13 . HG 1 1 280 1 1 1 1 12 ILE H . 12 . HN 1 1 280 1 2 1 1 13 LEU H . 13 . HN 1 1 281 1 1 1 1 12 ILE MD . 12 . HD# 1 1 281 1 2 1 1 14 GLN QE . 14 . HE2# 1 1 282 1 1 1 1 12 ILE MD . 12 . HD# 1 1 282 1 2 1 1 14 GLN QG . 14 . HG# 1 1 283 1 1 1 1 12 ILE MD . 12 . HD# 1 1 283 1 2 1 1 14 GLN H . 14 . HN 1 1 284 1 1 1 1 12 ILE QG . 12 . HG12 1 1 284 1 2 1 1 14 GLN H . 14 . HN 1 1 285 1 1 1 1 12 ILE H . 12 . HN 1 1 285 1 2 1 1 14 GLN HA . 14 . HA 1 1 286 1 1 1 1 12 ILE HA . 12 . HA 1 1 286 1 2 1 1 15 ARG QD . 15 . HD# 1 1 287 1 1 1 1 12 ILE MD . 12 . HD# 1 1 287 1 2 1 1 15 ARG QD . 15 . HD# 1 1 288 1 1 1 1 12 ILE MD . 12 . HD# 1 1 288 1 2 1 1 16 LYS HA . 16 . HA 1 1 289 1 1 1 1 12 ILE MD . 12 . HD# 1 1 289 1 2 1 1 17 LYS H . 17 . HN 1 1 290 1 1 1 1 12 ILE H . 12 . HN 1 1 290 1 2 1 1 17 LYS HA . 17 . HA 1 1 291 1 1 1 1 13 LEU HA . 13 . HA 1 1 291 1 2 1 1 13 LEU QB . 13 . HB2 1 1 292 1 1 1 1 13 LEU HA . 13 . HA 1 1 292 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 293 1 1 1 1 13 LEU HA . 13 . HA 1 1 293 1 2 1 1 13 LEU HG . 13 . HG 1 1 294 1 1 1 1 13 LEU H . 13 . HN 1 1 294 1 2 1 1 13 LEU HA . 13 . HA 1 1 295 1 1 1 1 13 LEU QB . 13 . HB2 1 1 295 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 296 1 1 1 1 13 LEU H . 13 . HN 1 1 296 1 2 1 1 13 LEU QB . 13 . HB2 1 1 297 1 1 1 1 13 LEU H . 13 . HN 1 1 297 1 2 1 1 13 LEU QD . 13 . HD1# 1 1 298 1 1 1 1 13 LEU H . 13 . HN 1 1 298 1 2 1 1 13 LEU HG . 13 . HG 1 1 299 1 1 1 1 13 LEU QB . 13 . HB2 1 1 299 1 2 1 1 14 GLN QE . 14 . HE2# 1 1 300 1 1 1 1 13 LEU QB . 13 . HB2 1 1 300 1 2 1 1 14 GLN H . 14 . HN 1 1 301 1 1 1 1 13 LEU QD . 13 . HD1# 1 1 301 1 2 1 1 14 GLN QE . 14 . HE2# 1 1 302 1 1 1 1 13 LEU QD . 13 . HD1# 1 1 302 1 2 1 1 14 GLN QG . 14 . HG# 1 1 303 1 1 1 1 13 LEU QD . 13 . HD1# 1 1 303 1 2 1 1 14 GLN H . 14 . HN 1 1 304 1 1 1 1 13 LEU HG . 13 . HG 1 1 304 1 2 1 1 14 GLN QE . 14 . HE2# 1 1 305 1 1 1 1 13 LEU HG . 13 . HG 1 1 305 1 2 1 1 14 GLN H . 14 . HN 1 1 306 1 1 1 1 13 LEU QD . 13 . HD1# 1 1 306 1 2 1 1 15 ARG QD . 15 . HD# 1 1 307 1 1 1 1 13 LEU QD . 13 . HD1# 1 1 307 1 2 1 1 15 ARG H . 15 . HN 1 1 308 1 1 1 1 13 LEU HG . 13 . HG 1 1 308 1 2 1 1 15 ARG H . 15 . HN 1 1 309 1 1 1 1 13 LEU HA . 13 . HA 1 1 309 1 2 1 1 16 LYS H . 16 . HN 1 1 310 1 1 1 1 13 LEU QD . 13 . HD1# 1 1 310 1 2 1 1 16 LYS HA . 16 . HA 1 1 311 1 1 1 1 13 LEU HG . 13 . HG 1 1 311 1 2 1 1 16 LYS H . 16 . HN 1 1 312 1 1 1 1 14 GLN H . 14 . HN 1 1 312 1 2 1 1 14 GLN HA . 14 . HA 1 1 313 1 1 1 1 14 GLN QB . 14 . HB2 1 1 313 1 2 1 1 14 GLN QE . 14 . HE2# 1 1 314 1 1 1 1 14 GLN QB . 14 . HB2 1 1 314 1 2 1 1 14 GLN QG . 14 . HG# 1 1 315 1 1 1 1 14 GLN H . 14 . HN 1 1 315 1 2 1 1 14 GLN QB . 14 . HB2 1 1 316 1 1 1 1 14 GLN QE . 14 . HE2# 1 1 316 1 2 1 1 14 GLN QG . 14 . HG# 1 1 317 1 1 1 1 14 GLN H . 14 . HN 1 1 317 1 2 1 1 14 GLN QE . 14 . HE2# 1 1 318 1 1 1 1 14 GLN H . 14 . HN 1 1 318 1 2 1 1 14 GLN QG . 14 . HG# 1 1 319 1 1 1 1 14 GLN QB . 14 . HB2 1 1 319 1 2 1 1 15 ARG HA . 15 . HA 1 1 320 1 1 1 1 14 GLN QB . 14 . HB2 1 1 320 1 2 1 1 15 ARG H . 15 . HN 1 1 321 1 1 1 1 14 GLN QE . 14 . HE2# 1 1 321 1 2 1 1 15 ARG HA . 15 . HA 1 1 322 1 1 1 1 14 GLN QE . 14 . HE2# 1 1 322 1 2 1 1 15 ARG H . 15 . HN 1 1 323 1 1 1 1 14 GLN QG . 14 . HG# 1 1 323 1 2 1 1 15 ARG HA . 15 . HA 1 1 324 1 1 1 1 14 GLN QG . 14 . HG# 1 1 324 1 2 1 1 15 ARG H . 15 . HN 1 1 325 1 1 1 1 14 GLN H . 14 . HN 1 1 325 1 2 1 1 15 ARG QD . 15 . HD# 1 1 326 1 1 1 1 15 ARG H . 15 . HN 1 1 326 1 2 1 1 15 ARG HA . 15 . HA 1 1 327 1 1 1 1 15 ARG QB . 15 . HB2 1 1 327 1 2 1 1 15 ARG HE . 15 . HE 1 1 328 1 1 1 1 15 ARG H . 15 . HN 1 1 328 1 2 1 1 15 ARG QB . 15 . HB2 1 1 329 1 1 1 1 15 ARG QD . 15 . HD# 1 1 329 1 2 1 1 15 ARG HE . 15 . HE 1 1 330 1 1 1 1 15 ARG QD . 15 . HD# 1 1 330 1 2 1 1 15 ARG QG . 15 . HG# 1 1 331 1 1 1 1 15 ARG H . 15 . HN 1 1 331 1 2 1 1 15 ARG QD . 15 . HD# 1 1 332 1 1 1 1 15 ARG HE . 15 . HE 1 1 332 1 2 1 1 15 ARG QG . 15 . HG# 1 1 333 1 1 1 1 15 ARG H . 15 . HN 1 1 333 1 2 1 1 15 ARG QG . 15 . HG# 1 1 334 1 1 1 1 15 ARG QD . 15 . HD# 1 1 334 1 2 1 1 16 LYS HA . 16 . HA 1 1 335 1 1 1 1 15 ARG QG . 15 . HG# 1 1 335 1 2 1 1 16 LYS HA . 16 . HA 1 1 336 1 1 1 1 15 ARG QG . 15 . HG# 1 1 336 1 2 1 1 16 LYS H . 16 . HN 1 1 337 1 1 1 1 15 ARG H . 15 . HN 1 1 337 1 2 1 1 16 LYS H . 16 . HN 1 1 338 1 1 1 1 15 ARG QB . 15 . HB2 1 1 338 1 2 1 1 17 LYS QE . 17 . HE# 1 1 339 1 1 1 1 15 ARG HE . 15 . HE 1 1 339 1 2 1 1 17 LYS QD . 17 . HD# 1 1 340 1 1 1 1 15 ARG H . 15 . HN 1 1 340 1 2 1 1 17 LYS H . 17 . HN 1 1 341 1 1 1 1 16 LYS HA . 16 . HA 1 1 341 1 2 1 1 16 LYS QB . 16 . HB2 1 1 342 1 1 1 1 16 LYS H . 16 . HN 1 1 342 1 2 1 1 16 LYS HA . 16 . HA 1 1 343 1 1 1 1 16 LYS H . 16 . HN 1 1 343 1 2 1 1 16 LYS QB . 16 . HB2 1 1 344 1 1 1 1 16 LYS H . 16 . HN 1 1 344 1 2 1 1 16 LYS QD . 16 . HD# 1 1 345 1 1 1 1 16 LYS H . 16 . HN 1 1 345 1 2 1 1 16 LYS QG . 16 . HG# 1 1 346 1 1 1 1 16 LYS HA . 16 . HA 1 1 346 1 2 1 1 17 LYS H . 17 . HN 1 1 347 1 1 1 1 16 LYS QB . 16 . HB2 1 1 347 1 2 1 1 17 LYS H . 17 . HN 1 1 348 1 1 1 1 16 LYS H . 16 . HN 1 1 348 1 2 1 1 17 LYS H . 17 . HN 1 1 349 1 1 1 1 17 LYS HA . 17 . HA 1 1 349 1 2 1 1 17 LYS QB . 17 . HB2 1 1 350 1 1 1 1 17 LYS HA . 17 . HA 1 1 350 1 2 1 1 17 LYS QG . 17 . HG# 1 1 351 1 1 1 1 17 LYS H . 17 . HN 1 1 351 1 2 1 1 17 LYS HA . 17 . HA 1 1 352 1 1 1 1 17 LYS H . 17 . HN 1 1 352 1 2 1 1 17 LYS QB . 17 . HB2 1 1 353 1 1 1 1 17 LYS H . 17 . HN 1 1 353 1 2 1 1 17 LYS QD . 17 . HD# 1 1 354 1 1 1 1 17 LYS H . 17 . HN 1 1 354 1 2 1 1 17 LYS QE . 17 . HE# 1 1 355 1 1 1 1 17 LYS H . 17 . HN 1 1 355 1 2 1 1 17 LYS QG . 17 . HG# 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 . . . . . 2.3 1.5 3.5 1 1 2 1 . . . . . 2.5 1.6 3.2 1 1 3 1 . . . . . 2.3 1.5 3.1 1 1 4 1 . . . . . 2.5 2.1 3.4 1 1 5 1 . . . . . 2.4 1.6 3.2 1 1 6 1 . . . . . 2.7 1.8 3.6 1 1 7 1 . . . . . 2.5 1.6 3.4 1 1 8 1 . . . . . 2.4 1.6 3.2 1 1 9 1 . . . . . 2.7 1.8 3.5 1 1 10 1 . . . . . 2.6 1.7 3.5 1 1 11 1 . . . . . 2.6 1.7 3.2 1 1 12 1 . . . . . 2.7 1.8 3.5 1 1 13 1 . . . . . 2.4 1.6 3.6 1 1 14 1 . . . . . 2.5 1.6 3.4 1 1 15 1 . . . . . 3.1 2.0 3.2 1 1 16 1 . . . . . 2.6 1.7 3.5 1 1 17 1 . . . . . 2.6 1.7 4.6 1 1 18 1 . . . . . 2.5 1.8 3.2 1 1 19 1 . . . . . 2.5 1.6 3.4 1 1 20 1 . . . . . 2.5 1.6 3.4 1 1 21 1 . . . . . 2.4 1.6 3.2 1 1 22 1 . . . . . 2.6 1.7 3.5 1 1 23 1 . . . . . 2.7 1.8 6.6 1 1 24 1 . . . . . 2.7 1.8 3.6 1 1 25 1 . . . . . 2.7 1.8 3.6 1 1 26 1 . . . . . 2.3 1.5 3.1 1 1 27 1 . . . . . 2.4 1.6 3.2 1 1 28 1 . . . . . 2.3 1.5 3.1 1 1 29 1 . . . . . 2.4 1.6 3.2 1 1 30 1 . . . . . 2.3 1.5 3.0 1 1 31 1 . . . . . 2.5 1.7 3.4 1 1 32 1 . . . . . 2.4 1.6 3.2 1 1 33 1 . . . . . 2.5 1.7 3.4 1 1 34 1 . . . . . 2.3 1.5 3.1 1 1 35 1 . . . . . 2.6 1.7 3.7 1 1 36 1 . . . . . 2.6 1.7 3.5 1 1 37 1 . . . . . 2.5 1.6 3.8 1 1 38 1 . . . . . 2.5 1.7 3.8 1 1 39 1 . . . . . 2.3 1.5 4.7 1 1 40 1 . . . . . 2.3 1.5 3.1 1 1 41 1 . . . . . 2.5 1.6 3.4 1 1 42 1 . . . . . 2.5 1.6 3.2 1 1 43 1 . . . . . 2.3 1.5 3.1 1 1 44 1 . . . . . 2.5 1.8 3.4 1 1 45 1 . . . . . 2.6 1.8 3.5 1 1 46 1 . . . . . 2.7 1.8 3.8 1 1 47 1 . . . . . 2.2 1.4 3.6 1 1 48 1 . . . . . 2.3 1.5 3.1 1 1 49 1 . . . . . 2.5 1.6 3.4 1 1 50 1 . . . . . 2.6 1.7 3.8 1 1 51 1 . . . . . . 3.2 4.6 1 1 52 1 . . . . . 2.3 1.5 4.0 1 1 53 1 . . . . . 2.6 1.7 3.5 1 1 54 1 . . . . . 2.4 1.6 5.9 1 1 55 1 . . . . . 2.6 1.7 5.1 1 1 56 1 . . . . . 2.7 1.8 6.3 1 1 57 1 . . . . . 2.4 1.6 3.0 1 1 58 1 . . . . . 2.3 1.5 3.0 1 1 59 1 . . . . . 2.3 1.5 3.1 1 1 60 1 . . . . . 2.3 1.5 3.1 1 1 61 1 . . . . . 2.3 1.5 3.1 1 1 62 1 . . . . . 2.2 1.5 3.0 1 1 63 1 . . . . . 2.4 1.6 3.2 1 1 64 1 . . . . . 2.3 1.5 3.1 1 1 65 1 . . . . . 2.6 1.7 3.7 1 1 66 1 . . . . . 2.6 1.8 3.5 1 1 67 1 . . . . . 2.4 1.6 3.2 1 1 68 1 . . . . . 2.5 1.6 3.7 1 1 69 1 . . . . . 2.2 1.8 3.0 1 1 70 1 . . . . . 2.5 1.6 4.4 1 1 71 1 . . . . . 2.6 1.7 3.5 1 1 72 1 . . . . . 2.4 1.6 3.2 1 1 73 1 . . . . . 2.4 1.6 3.2 1 1 74 1 . . . . . 2.5 1.6 3.4 1 1 75 1 . . . . . 2.5 1.6 3.9 1 1 76 1 . . . . . 2.3 1.5 3.6 1 1 77 1 . . . . . 2.4 1.6 3.2 1 1 78 1 . . . . . 2.4 1.6 3.4 1 1 79 1 . . . . . 2.5 1.6 3.4 1 1 80 1 . . . . . 2.5 1.6 3.2 1 1 81 1 . . . . . 2.5 1.6 4.2 1 1 82 1 . . . . . 2.3 1.5 5.6 1 1 83 1 . . . . . 2.5 1.6 4.2 1 1 84 1 . . . . . 2.5 1.6 5.2 1 1 85 1 . . . . . 2.7 1.8 4.3 1 1 86 1 . . . . . 2.7 1.8 6.2 1 1 87 1 . . . . . 2.5 1.6 3.8 1 1 88 1 . . . . . 2.5 1.6 4.6 1 1 89 1 . . . . . 2.5 1.6 6.0 1 1 90 1 . . . . . 2.7 1.8 3.2 1 1 91 1 . . . . . 2.5 1.6 3.4 1 1 92 1 . . . . . 2.5 1.6 3.4 1 1 93 1 . . . . . 2.5 1.6 4.4 1 1 94 1 . . . . . 2.6 1.7 4.7 1 1 95 1 . . . . . 2.6 1.7 3.4 1 1 96 1 . . . . . 2.5 1.6 3.4 1 1 97 1 . . . . . 2.5 1.6 3.4 1 1 98 1 . . . . . 2.6 1.7 3.5 1 1 99 1 . . . . . 2.4 1.6 3.2 1 1 100 1 . . . . . 2.4 1.6 3.2 1 1 101 1 . . . . . 2.4 1.6 3.9 1 1 102 1 . . . . . 2.8 1.8 3.8 1 1 103 1 . . . . . 2.4 1.6 6.0 1 1 104 1 . . . . . 2.5 1.6 6.2 1 1 105 1 . . . . . 2.3 1.5 3.1 1 1 106 1 . . . . . 2.3 1.5 3.1 1 1 107 1 . . . . . 2.4 1.6 3.2 1 1 108 1 . . . . . 2.5 1.6 4.5 1 1 109 1 . . . . . 2.4 1.8 4.0 1 1 110 1 . . . . . 2.5 1.6 3.4 1 1 111 1 . . . . . 2.5 1.6 3.4 1 1 112 1 . . . . . 2.7 1.8 4.2 1 1 113 1 . . . . . 2.8 1.8 5.7 1 1 114 1 . . . . . 2.4 1.6 3.8 1 1 115 1 . . . . . 2.8 1.8 3.8 1 1 116 1 . . . . . 2.4 1.6 3.2 1 1 117 1 . . . . . 2.4 1.6 3.2 1 1 118 1 . . . . . 2.6 1.7 3.5 1 1 119 1 . . . . . 2.7 1.8 4.5 1 1 120 1 . . . . . 2.5 1.8 3.4 1 1 121 1 . . . . . 2.6 1.7 3.7 1 1 122 1 . . . . . 2.4 1.8 3.2 1 1 123 1 . . . . . 2.6 1.7 4.8 1 1 124 1 . . . . . 2.6 1.7 3.5 1 1 125 1 . . . . . 2.6 1.7 3.9 1 1 126 1 . . . . . 2.4 1.6 3.2 1 1 127 1 . . . . . 2.3 1.8 3.1 1 1 128 1 . . . . . 2.3 1.5 3.9 1 1 129 1 . . . . . 2.3 1.5 4.1 1 1 130 1 . . . . . 2.5 1.6 3.4 1 1 131 1 . . . . . 2.7 1.8 3.6 1 1 132 1 . . . . . 2.5 1.6 3.4 1 1 133 1 . . . . . 2.5 1.6 4.0 1 1 134 1 . . . . . 2.5 1.6 6.0 1 1 135 1 . . . . . 2.3 1.5 3.1 1 1 136 1 . . . . . 2.4 1.6 3.2 1 1 137 1 . . . . . 2.4 1.6 4.6 1 1 138 1 . . . . . 2.3 1.5 3.1 1 1 139 1 . . . . . 2.3 1.6 3.1 1 1 140 1 . . . . . 2.3 1.5 3.1 1 1 141 1 . . . . . 2.3 1.5 3.4 1 1 142 1 . . . . . 2.5 1.6 5.3 1 1 143 1 . . . . . 2.5 1.6 5.8 1 1 144 1 . . . . . 2.4 1.6 3.2 1 1 145 1 . . . . . 2.3 1.6 3.5 1 1 146 1 . . . . . 2.2 1.4 3.0 1 1 147 1 . . . . . 2.3 1.6 3.4 1 1 148 1 . . . . . 2.3 1.6 3.1 1 1 149 1 . . . . . 2.6 1.7 3.5 1 1 150 1 . . . . . 2.4 1.6 3.2 1 1 151 1 . . . . . 2.4 1.6 3.2 1 1 152 1 . . . . . 2.6 1.7 3.5 1 1 153 1 . . . . . 2.6 1.7 4.3 1 1 154 1 . . . . . 2.4 1.6 4.4 1 1 155 1 . . . . . 2.3 1.5 4.7 1 1 156 1 . . . . . 2.4 1.6 3.7 1 1 157 1 . . . . . 2.3 1.5 3.1 1 1 158 1 . . . . . 2.5 1.6 5.3 1 1 159 1 . . . . . 2.6 1.7 4.0 1 1 160 1 . . . . . 2.7 1.8 6.6 1 1 161 1 . . . . . 2.3 1.5 5.3 1 1 162 1 . . . . . 2.2 1.4 3.0 1 1 163 1 . . . . . 2.2 1.4 4.7 1 1 164 1 . . . . . 2.4 1.6 3.7 1 1 165 1 . . . . . 2.4 1.6 3.5 1 1 166 1 . . . . . 2.5 1.6 5.5 1 1 167 1 . . . . . 2.6 1.7 3.5 1 1 168 1 . . . . . 2.8 1.8 5.2 1 1 169 1 . . . . . 2.6 1.7 5.0 1 1 170 1 . . . . . 2.3 1.5 3.3 1 1 171 1 . . . . . 2.4 1.6 4.5 1 1 172 1 . . . . . 2.4 1.6 3.4 1 1 173 1 . . . . . 2.5 1.6 4.6 1 1 174 1 . . . . . 2.4 1.6 3.2 1 1 175 1 . . . . . 2.6 1.7 3.5 1 1 176 1 . . . . . 2.9 1.9 4.8 1 1 177 1 . . . . . 2.6 1.7 5.2 1 1 178 1 . . . . . 2.4 1.6 6.9 1 1 179 1 . . . . . 2.6 1.7 4.6 1 1 180 1 . . . . . 2.6 1.7 5.5 1 1 181 1 . . . . . 2.3 1.5 3.1 1 1 182 1 . . . . . 2.3 1.5 4.7 1 1 183 1 . . . . . 2.4 1.6 3.2 1 1 184 1 . . . . . 2.6 1.7 6.3 1 1 185 1 . . . . . 2.3 1.5 3.1 1 1 186 1 . . . . . 2.4 1.6 3.2 1 1 187 1 . . . . . 2.4 1.6 3.2 1 1 188 1 . . . . . 2.5 1.6 4.5 1 1 189 1 . . . . . 2.4 1.6 4.5 1 1 190 1 . . . . . 2.3 1.5 3.1 1 1 191 1 . . . . . 2.5 1.6 4.0 1 1 192 1 . . . . . 2.4 1.6 3.6 1 1 193 1 . . . . . 2.5 1.6 3.4 1 1 194 1 . . . . . 2.7 1.8 3.6 1 1 195 1 . . . . . 2.5 1.6 3.4 1 1 196 1 . . . . . 2.4 1.6 3.9 1 1 197 1 . . . . . 2.4 1.6 3.2 1 1 198 1 . . . . . 2.6 1.7 4.2 1 1 199 1 . . . . . 3.5 2.3 5.3 1 1 200 1 . . . . . 2.6 1.7 3.5 1 1 201 1 . . . . . 2.6 1.7 3.5 1 1 202 1 . . . . . 2.6 1.7 4.8 1 1 203 1 . . . . . 2.6 1.7 4.8 1 1 204 1 . . . . . 2.5 1.6 3.4 1 1 205 1 . . . . . 2.6 1.7 4.2 1 1 206 1 . . . . . 2.5 1.6 3.4 1 1 207 1 . . . . . 2.5 1.6 3.4 1 1 208 1 . . . . . 2.4 1.6 3.2 1 1 209 1 . . . . . 2.4 1.6 3.2 1 1 210 1 . . . . . 2.5 1.6 3.4 1 1 211 1 . . . . . 2.4 1.6 4.5 1 1 212 1 . . . . . 2.2 1.4 5.4 1 1 213 1 . . . . . 2.7 1.8 7.4 1 1 214 1 . . . . . 2.6 1.7 3.5 1 1 215 1 . . . . . 2.4 1.6 5.8 1 1 216 1 . . . . . 2.6 1.7 3.5 1 1 217 1 . . . . . 2.8 1.8 4.1 1 1 218 1 . . . . . 2.6 1.7 3.5 1 1 219 1 . . . . . 2.7 1.8 3.6 1 1 220 1 . . . . . 2.3 1.5 5.5 1 1 221 1 . . . . . 2.7 1.8 6.4 1 1 222 1 . . . . . 3.0 2.0 4.6 1 1 223 1 . . . . . 2.2 1.4 3.0 1 1 224 1 . . . . . 2.3 1.5 3.1 1 1 225 1 . . . . . 2.3 1.5 3.1 1 1 226 1 . . . . . 2.2 1.4 3.0 1 1 227 1 . . . . . 2.2 1.4 3.0 1 1 228 1 . . . . . 2.7 1.8 3.4 1 1 229 1 . . . . . 2.2 1.4 3.0 1 1 230 1 . . . . . 2.4 1.6 3.2 1 1 231 1 . . . . . 2.4 1.6 4.1 1 1 232 1 . . . . . 2.5 1.6 3.4 1 1 233 1 . . . . . 2.2 1.4 3.0 1 1 234 1 . . . . . 2.2 1.7 4.0 1 1 235 1 . . . . . 2.3 1.5 3.1 1 1 236 1 . . . . . 2.4 1.6 3.6 1 1 237 1 . . . . . 2.5 1.6 4.1 1 1 238 1 . . . . . 2.5 1.6 3.4 1 1 239 1 . . . . . 2.6 1.7 5.3 1 1 240 1 . . . . . 2.5 1.6 3.5 1 1 241 1 . . . . . 2.4 1.9 3.2 1 1 242 1 . . . . . 3.1 2.0 4.2 1 1 243 1 . . . . . 2.5 1.6 3.4 1 1 244 1 . . . . . 2.3 1.5 6.0 1 1 245 1 . . . . . 2.3 1.5 3.1 1 1 246 1 . . . . . 2.4 1.6 3.2 1 1 247 1 . . . . . 2.3 1.5 3.1 1 1 248 1 . . . . . 2.5 1.6 3.4 1 1 249 1 . . . . . 2.3 1.5 3.2 1 1 250 1 . . . . . 2.5 1.6 5.8 1 1 251 1 . . . . . 2.6 1.7 4.6 1 1 252 1 . . . . . 2.7 1.8 5.6 1 1 253 1 . . . . . 2.3 1.5 5.9 1 1 254 1 . . . . . 2.5 1.7 4.8 1 1 255 1 . . . . . 2.5 1.6 4.4 1 1 256 1 . . . . . 2.7 1.8 6.2 1 1 257 1 . . . . . 2.2 1.4 3.0 1 1 258 1 . . . . . 2.2 1.4 3.0 1 1 259 1 . . . . . 2.3 1.5 3.1 1 1 260 1 . . . . . 2.3 1.5 3.1 1 1 261 1 . . . . . 2.3 1.5 3.1 1 1 262 1 . . . . . 2.2 1.4 3.0 1 1 263 1 . . . . . 2.3 1.5 3.3 1 1 264 1 . . . . . 2.2 1.4 3.0 1 1 265 1 . . . . . 2.3 1.5 3.1 1 1 266 1 . . . . . 2.4 1.6 3.2 1 1 267 1 . . . . . 2.4 1.6 3.2 1 1 268 1 . . . . . 2.6 1.7 3.8 1 1 269 1 . . . . . 2.4 1.6 4.4 1 1 270 1 . . . . . 2.3 1.5 3.1 1 1 271 1 . . . . . 2.4 1.6 3.2 1 1 272 1 . . . . . 2.4 1.6 3.2 1 1 273 1 . . . . . 2.5 1.6 3.4 1 1 274 1 . . . . . 2.4 1.6 3.2 1 1 275 1 . . . . . 2.5 1.6 3.4 1 1 276 1 . . . . . 2.5 1.6 3.8 1 1 277 1 . . . . . 2.4 1.6 3.3 1 1 278 1 . . . . . 2.8 1.8 3.4 1 1 279 1 . . . . . 2.5 1.6 3.4 1 1 280 1 . . . . . 2.3 1.5 3.1 1 1 281 1 . . . . . 2.7 1.8 4.1 1 1 282 1 . . . . . 2.6 1.7 4.4 1 1 283 1 . . . . . 2.4 1.6 3.4 1 1 284 1 . . . . . 2.3 1.5 5.1 1 1 285 1 . . . . . 2.4 1.6 5.4 1 1 286 1 . . . . . 2.7 1.8 3.6 1 1 287 1 . . . . . 2.4 1.6 3.5 1 1 288 1 . . . . . 2.3 1.5 4.5 1 1 289 1 . . . . . 2.4 1.6 4.3 1 1 290 1 . . . . . 2.5 1.6 5.6 1 1 291 1 . . . . . 2.2 1.4 3.0 1 1 292 1 . . . . . 2.3 1.5 3.1 1 1 293 1 . . . . . 2.3 1.5 3.1 1 1 294 1 . . . . . 2.3 1.5 3.1 1 1 295 1 . . . . . 2.2 1.5 3.0 1 1 296 1 . . . . . 2.2 1.5 3.0 1 1 297 1 . . . . . 2.4 1.6 3.2 1 1 298 1 . . . . . 2.3 1.5 3.1 1 1 299 1 . . . . . 2.5 1.8 3.4 1 1 300 1 . . . . . 2.3 1.5 3.1 1 1 301 1 . . . . . 2.8 1.8 4.0 1 1 302 1 . . . . . 2.7 1.8 3.6 1 1 303 1 . . . . . 2.5 1.6 3.2 1 1 304 1 . . . . . 2.8 1.8 4.0 1 1 305 1 . . . . . 2.3 1.5 3.1 1 1 306 1 . . . . . 2.6 1.7 4.5 1 1 307 1 . . . . . 2.5 1.6 4.1 1 1 308 1 . . . . . 2.4 1.6 4.4 1 1 309 1 . . . . . 2.4 1.6 3.2 1 1 310 1 . . . . . 2.3 1.6 3.1 1 1 311 1 . . . . . 2.6 1.7 4.4 1 1 312 1 . . . . . 2.2 1.4 3.0 1 1 313 1 . . . . . 2.6 1.7 3.5 1 1 314 1 . . . . . 2.3 1.5 3.1 1 1 315 1 . . . . . 2.3 1.5 3.1 1 1 316 1 . . . . . 2.4 1.6 3.2 1 1 317 1 . . . . . 2.7 1.8 3.6 1 1 318 1 . . . . . 2.4 1.6 3.2 1 1 319 1 . . . . . 2.3 1.5 3.6 1 1 320 1 . . . . . 2.4 1.6 3.2 1 1 321 1 . . . . . 2.5 1.6 5.9 1 1 322 1 . . . . . 2.9 1.9 3.9 1 1 323 1 . . . . . 2.4 1.6 5.1 1 1 324 1 . . . . . 2.5 1.6 3.4 1 1 325 1 . . . . . 2.7 1.8 4.2 1 1 326 1 . . . . . 2.2 1.4 3.0 1 1 327 1 . . . . . 2.6 1.7 3.5 1 1 328 1 . . . . . 2.3 1.5 3.1 1 1 329 1 . . . . . 2.4 1.6 3.2 1 1 330 1 . . . . . 2.2 1.4 3.0 1 1 331 1 . . . . . 2.4 1.6 3.2 1 1 332 1 . . . . . 2.5 1.6 3.4 1 1 333 1 . . . . . 2.3 1.5 3.1 1 1 334 1 . . . . . 2.3 1.5 4.9 1 1 335 1 . . . . . 2.3 1.5 4.9 1 1 336 1 . . . . . 2.4 1.6 3.2 1 1 337 1 . . . . . 2.4 1.6 3.2 1 1 338 1 . . . . . 2.2 1.4 3.0 1 1 339 1 . . . . . 2.3 1.5 3.1 1 1 340 1 . . . . . 2.3 1.5 3.3 1 1 341 1 . . . . . 2.3 1.5 3.0 1 1 342 1 . . . . . 2.3 1.5 3.1 1 1 343 1 . . . . . 2.3 1.5 3.1 1 1 344 1 . . . . . 2.4 1.6 3.2 1 1 345 1 . . . . . 2.4 1.6 3.2 1 1 346 1 . . . . . 2.3 1.5 3.1 1 1 347 1 . . . . . 2.5 1.6 3.2 1 1 348 1 . . . . . 2.5 1.6 3.4 1 1 349 1 . . . . . 2.4 1.6 3.2 1 1 350 1 . . . . . 2.4 1.6 3.2 1 1 351 1 . . . . . 2.3 1.5 3.1 1 1 352 1 . . . . . 2.5 1.6 3.2 1 1 353 1 . . . . . 2.9 1.9 3.9 1 1 354 1 . . . . . 2.5 1.6 3.4 1 1 355 1 . . . . . 2.4 1.6 3.2 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 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 4 LEU O . 4 . O 1 2 1 1 2 1 1 8 PHE H . 8 . HN 1 2 2 1 1 1 1 4 LEU O . 4 . O 1 2 2 1 2 1 1 8 PHE N . 8 . N 1 2 3 1 1 1 1 5 SER O . 5 . O 1 2 3 1 2 1 1 9 ARG H . 9 . HN 1 2 4 1 1 1 1 5 SER O . 5 . O 1 2 4 1 2 1 1 9 ARG N . 9 . N 1 2 5 1 1 1 1 6 LYS O . 6 . O 1 2 5 1 2 1 1 10 ASP H . 10 . HN 1 2 6 1 1 1 1 6 LYS O . 6 . O 1 2 6 1 2 1 1 10 ASP N . 10 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.9 1.5 2.5 1 2 2 1 . . . . . 2.9 2.4 3.6 1 2 3 1 . . . . . 1.9 1.5 2.5 1 2 4 1 . . . . . 2.9 2.4 3.6 1 2 5 1 . . . . . 1.9 1.5 2.5 1 2 6 1 . . . . . 2.9 2.4 3.6 1 2 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 ARG C 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C -80.2 -40.2 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 2 . 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C 1 1 5 SER N -51.8 -11.8 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 3 . 1 1 4 LEU C 1 1 5 SER N 1 1 5 SER CA 1 1 5 SER C -84.0 -44.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 4 . 1 1 5 SER N 1 1 5 SER CA 1 1 5 SER C 1 1 6 LYS N -53.1 -13.1 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 5 . 1 1 5 SER C 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C -86.3 -46.3 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 6 . 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C 1 1 7 PHE N -54.5 -14.5 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 7 . 1 1 6 LYS C 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE C -88.2 -48.2 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 8 . 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE C 1 1 8 PHE N -55.1 -15.099999 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 9 . 1 1 7 PHE C 1 1 8 PHE N 1 1 8 PHE CA 1 1 8 PHE C -93.799995 -50.4 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 10 . 1 1 8 PHE N 1 1 8 PHE CA 1 1 8 PHE C 1 1 9 ARG N -56.3 4.1 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 11 . 1 1 8 PHE C 1 1 9 ARG N 1 1 9 ARG CA 1 1 9 ARG C -82.8 -42.799995 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 12 . 1 1 9 ARG N 1 1 9 ARG CA 1 1 9 ARG C 1 1 10 ASP N -51.4 -11.4 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 13 . 1 1 9 ARG C 1 1 10 ASP N 1 1 10 ASP CA 1 1 10 ASP C -91.7 -51.7 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 14 . 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU CB 1 1 4 LEU CG -89.99999 -30.0 . 4 . N . 4 . CA . 4 . CB . 4 . CG 1 1 15 . 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS CB 1 1 6 LYS CG -89.99999 -30.0 . 6 . N . 6 . CA . 6 . CB . 6 . CG 1 1 16 . 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE CB 1 1 7 PHE CG -89.99999 -30.0 . 7 . N . 7 . CA . 7 . CB . 7 . CG 1 1 17 . 1 1 8 PHE N 1 1 8 PHE CA 1 1 8 PHE CB 1 1 8 PHE CG -89.99999 -30.0 . 8 . N . 8 . CA . 8 . CB . 8 . CG 1 1 18 . 1 1 9 ARG N 1 1 9 ARG CA 1 1 9 ARG CB 1 1 9 ARG CG -89.99999 -30.0 . 9 . N . 9 . CA . 9 . CB . 9 . CG 1 1 19 . 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU CB 1 1 13 LEU CG -89.99999 -30.0 . 13 . N . 13 . CA . 13 . CB . 13 . CG 1 1 20 . 1 1 14 GLN N 1 1 14 GLN CA 1 1 14 GLN CB 1 1 14 GLN CG -89.99999 -30.0 . 14 . N . 14 . CA . 14 . CB . 14 . CG 1 1 21 . 1 1 15 ARG N 1 1 15 ARG CA 1 1 15 ARG CB 1 1 15 ARG CG -89.99999 -30.0 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1 22 . 1 1 16 LYS N 1 1 16 LYS CA 1 1 16 LYS CB 1 1 16 LYS CG -89.99999 -30.0 . 16 . N . 16 . CA . 16 . CB . 16 . CG 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 GLU C C -1.833 -8.632 -3.799 1.00 . A A . 1 GLU C 1 1 1 2 1 1 1 GLU CA C -1.112 -9.609 -4.688 1.00 . A A . 1 GLU CA 1 1 1 3 1 1 1 GLU CB C -0.105 -10.410 -3.835 1.00 . A A . 1 GLU CB 1 1 1 4 1 1 1 GLU CD C 1.948 -10.407 -2.414 1.00 . A A . 1 GLU CD 1 1 1 5 1 1 1 GLU CG C 0.966 -9.522 -3.175 1.00 . A A . 1 GLU CG 1 1 1 6 1 1 1 GLU H1 H 0.381 -9.504 -6.136 1.00 . A A . 1 GLU H1 1 1 1 7 1 1 1 GLU H2 H -0.012 -8.006 -5.439 1.00 . A A . 1 GLU H2 1 1 1 8 1 1 1 GLU H3 H -1.061 -8.718 -6.571 1.00 . A A . 1 GLU H3 1 1 1 9 1 1 1 GLU HA H -1.830 -10.274 -5.141 1.00 . A A . 1 GLU HA 1 1 1 10 1 1 1 GLU HB2 H -0.661 -10.962 -3.044 1.00 . A A . 1 GLU HB2 1 1 1 11 1 1 1 GLU HB3 H 0.399 -11.159 -4.484 1.00 . A A . 1 GLU HB3 1 1 1 12 1 1 1 GLU HG2 H 1.515 -8.945 -3.950 1.00 . A A . 1 GLU HG2 1 1 1 13 1 1 1 GLU HG3 H 0.493 -8.815 -2.464 1.00 . A A . 1 GLU HG3 1 1 1 14 1 1 1 GLU N N -0.398 -8.906 -5.791 1.00 . A A . 1 GLU N 1 1 1 15 1 1 1 GLU O O -2.132 -8.932 -2.644 1.00 . A A . 1 GLU O 1 1 1 16 1 1 1 GLU OE1 O 1.760 -11.654 -2.421 1.00 . A A . 1 GLU OE1 1 1 1 17 1 1 1 GLU OE2 O 2.902 -9.845 -1.815 1.00 . A A . 1 GLU OE2 1 1 1 18 1 1 2 MET C C -3.854 -5.809 -4.429 1.00 . A A . 2 MET C 1 1 1 19 1 1 2 MET CA C -2.829 -6.434 -3.557 1.00 . A A . 2 MET CA 1 1 1 20 1 1 2 MET CB C -1.912 -5.340 -2.978 1.00 . A A . 2 MET CB 1 1 1 21 1 1 2 MET CE C -4.119 -5.346 -0.917 1.00 . A A . 2 MET CE 1 1 1 22 1 1 2 MET CG C -1.512 -5.556 -1.507 1.00 . A A . 2 MET CG 1 1 1 23 1 1 2 MET H H -1.914 -7.188 -5.275 1.00 . A A . 2 MET H 1 1 1 24 1 1 2 MET HA H -3.360 -6.923 -2.770 1.00 . A A . 2 MET HA 1 1 1 25 1 1 2 MET HB2 H -0.987 -5.308 -3.588 1.00 . A A . 2 MET HB2 1 1 1 26 1 1 2 MET HB3 H -2.409 -4.346 -3.063 1.00 . A A . 2 MET HB3 1 1 1 27 1 1 2 MET HE1 H -3.771 -4.532 -1.582 1.00 . A A . 2 MET HE1 1 1 1 28 1 1 2 MET HE2 H -4.558 -4.888 -0.008 1.00 . A A . 2 MET HE2 1 1 1 29 1 1 2 MET HE3 H -4.923 -5.901 -1.450 1.00 . A A . 2 MET HE3 1 1 1 30 1 1 2 MET HG2 H -0.548 -6.103 -1.482 1.00 . A A . 2 MET HG2 1 1 1 31 1 1 2 MET HG3 H -1.336 -4.551 -1.065 1.00 . A A . 2 MET HG3 1 1 1 32 1 1 2 MET N N -2.140 -7.430 -4.334 1.00 . A A . 2 MET N 1 1 1 33 1 1 2 MET O O -4.025 -6.169 -5.592 1.00 . A A . 2 MET O 1 1 1 34 1 1 2 MET SD S -2.742 -6.445 -0.494 1.00 . A A . 2 MET SD 1 1 1 35 1 1 3 ARG C C -5.339 -2.778 -4.534 1.00 . A A . 3 ARG C 1 1 1 36 1 1 3 ARG CA C -5.620 -4.192 -4.500 1.00 . A A . 3 ARG CA 1 1 1 37 1 1 3 ARG CB C -6.865 -4.360 -3.670 1.00 . A A . 3 ARG CB 1 1 1 38 1 1 3 ARG CD C -8.535 -2.645 -4.361 1.00 . A A . 3 ARG CD 1 1 1 39 1 1 3 ARG CG C -8.141 -4.114 -4.447 1.00 . A A . 3 ARG CG 1 1 1 40 1 1 3 ARG CZ C -10.302 -1.289 -3.269 1.00 . A A . 3 ARG CZ 1 1 1 41 1 1 3 ARG H H -4.368 -4.490 -2.944 1.00 . A A . 3 ARG H 1 1 1 42 1 1 3 ARG HA H -5.716 -4.553 -5.456 1.00 . A A . 3 ARG HA 1 1 1 43 1 1 3 ARG HB2 H -6.865 -5.383 -3.240 1.00 . A A . 3 ARG HB2 1 1 1 44 1 1 3 ARG HB3 H -6.801 -3.624 -2.827 1.00 . A A . 3 ARG HB3 1 1 1 45 1 1 3 ARG HD2 H -7.709 -2.064 -3.882 1.00 . A A . 3 ARG HD2 1 1 1 46 1 1 3 ARG HD3 H -8.754 -2.233 -5.367 1.00 . A A . 3 ARG HD3 1 1 1 47 1 1 3 ARG HE H -10.182 -3.337 -3.126 1.00 . A A . 3 ARG HE 1 1 1 48 1 1 3 ARG HG2 H -7.980 -4.396 -5.509 1.00 . A A . 3 ARG HG2 1 1 1 49 1 1 3 ARG HG3 H -8.953 -4.746 -4.034 1.00 . A A . 3 ARG HG3 1 1 1 50 1 1 3 ARG HH11 H -8.910 -0.253 -4.369 1.00 . A A . 3 ARG HH11 1 1 1 51 1 1 3 ARG HH12 H -10.124 0.729 -3.621 1.00 . A A . 3 ARG HH12 1 1 1 52 1 1 3 ARG HH21 H -11.838 -2.003 -2.107 1.00 . A A . 3 ARG HH21 1 1 1 53 1 1 3 ARG HH22 H -11.818 -0.284 -2.312 1.00 . A A . 3 ARG HH22 1 1 1 54 1 1 3 ARG N N -4.560 -4.831 -3.851 1.00 . A A . 3 ARG N 1 1 1 55 1 1 3 ARG NE N -9.759 -2.518 -3.515 1.00 . A A . 3 ARG NE 1 1 1 56 1 1 3 ARG NH1 N -9.728 -0.170 -3.800 1.00 . A A . 3 ARG NH1 1 1 1 57 1 1 3 ARG NH2 N -11.419 -1.182 -2.494 1.00 . A A . 3 ARG NH2 1 1 1 58 1 1 3 ARG O O -5.738 -2.042 -5.434 1.00 . A A . 3 ARG O 1 1 1 59 1 1 4 LEU C C -3.402 -0.756 -4.444 1.00 . A A . 4 LEU C 1 1 1 60 1 1 4 LEU CA C -4.295 -1.048 -3.346 1.00 . A A . 4 LEU CA 1 1 1 61 1 1 4 LEU CB C -3.503 -0.814 -2.084 1.00 . A A . 4 LEU CB 1 1 1 62 1 1 4 LEU CD1 C -2.476 -1.811 -0.100 1.00 . A A . 4 LEU CD1 1 1 1 63 1 1 4 LEU CD2 C -4.978 -2.166 -0.576 1.00 . A A . 4 LEU CD2 1 1 1 64 1 1 4 LEU CG C -3.571 -1.964 -1.140 1.00 . A A . 4 LEU CG 1 1 1 65 1 1 4 LEU H H -4.229 -3.019 -2.869 1.00 . A A . 4 LEU H 1 1 1 66 1 1 4 LEU HA H -5.121 -0.440 -3.393 1.00 . A A . 4 LEU HA 1 1 1 67 1 1 4 LEU HB2 H -2.465 -0.611 -2.332 1.00 . A A . 4 LEU HB2 1 1 1 68 1 1 4 LEU HB3 H -3.910 0.057 -1.562 1.00 . A A . 4 LEU HB3 1 1 1 69 1 1 4 LEU HD11 H -2.886 -1.843 0.927 1.00 . A A . 4 LEU HD11 1 1 1 70 1 1 4 LEU HD12 H -1.952 -0.836 -0.265 1.00 . A A . 4 LEU HD12 1 1 1 71 1 1 4 LEU HD13 H -1.728 -2.627 -0.230 1.00 . A A . 4 LEU HD13 1 1 1 72 1 1 4 LEU HD21 H -4.935 -2.698 0.396 1.00 . A A . 4 LEU HD21 1 1 1 73 1 1 4 LEU HD22 H -5.584 -2.772 -1.296 1.00 . A A . 4 LEU HD22 1 1 1 74 1 1 4 LEU HD23 H -5.476 -1.184 -0.431 1.00 . A A . 4 LEU HD23 1 1 1 75 1 1 4 LEU HG H -3.311 -2.845 -1.736 1.00 . A A . 4 LEU HG 1 1 1 76 1 1 4 LEU N N -4.613 -2.384 -3.523 1.00 . A A . 4 LEU N 1 1 1 77 1 1 4 LEU O O -3.785 -0.019 -5.324 1.00 . A A . 4 LEU O 1 1 1 78 1 1 5 SER C C -1.133 -0.993 -6.579 1.00 . A A . 5 SER C 1 1 1 79 1 1 5 SER CA C -1.169 -1.694 -5.245 1.00 . A A . 5 SER CA 1 1 1 80 1 1 5 SER CB C -0.727 -3.117 -5.330 1.00 . A A . 5 SER CB 1 1 1 81 1 1 5 SER H H -2.454 -2.395 -3.822 1.00 . A A . 5 SER H 1 1 1 82 1 1 5 SER HA H -0.456 -1.176 -4.614 1.00 . A A . 5 SER HA 1 1 1 83 1 1 5 SER HB2 H 0.345 -3.157 -5.059 1.00 . A A . 5 SER HB2 1 1 1 84 1 1 5 SER HB3 H -1.326 -3.675 -4.559 1.00 . A A . 5 SER HB3 1 1 1 85 1 1 5 SER HG H -0.462 -3.141 -7.241 1.00 . A A . 5 SER HG 1 1 1 86 1 1 5 SER N N -2.401 -1.653 -4.470 1.00 . A A . 5 SER N 1 1 1 87 1 1 5 SER O O -0.118 -0.961 -7.260 1.00 . A A . 5 SER O 1 1 1 88 1 1 5 SER OG O -0.939 -3.697 -6.615 1.00 . A A . 5 SER OG 1 1 1 89 1 1 6 LYS C C -1.956 1.699 -7.217 1.00 . A A . 6 LYS C 1 1 1 90 1 1 6 LYS CA C -2.259 0.453 -8.049 1.00 . A A . 6 LYS CA 1 1 1 91 1 1 6 LYS CB C -3.621 0.622 -8.721 1.00 . A A . 6 LYS CB 1 1 1 92 1 1 6 LYS CD C -5.473 -0.496 -10.034 1.00 . A A . 6 LYS CD 1 1 1 93 1 1 6 LYS CE C -5.950 -1.761 -10.748 1.00 . A A . 6 LYS CE 1 1 1 94 1 1 6 LYS CG C -4.084 -0.652 -9.426 1.00 . A A . 6 LYS CG 1 1 1 95 1 1 6 LYS H H -3.130 -0.668 -6.573 1.00 . A A . 6 LYS H 1 1 1 96 1 1 6 LYS HA H -1.458 0.245 -8.747 1.00 . A A . 6 LYS HA 1 1 1 97 1 1 6 LYS HB2 H -4.371 0.912 -7.953 1.00 . A A . 6 LYS HB2 1 1 1 98 1 1 6 LYS HB3 H -3.552 1.443 -9.465 1.00 . A A . 6 LYS HB3 1 1 1 99 1 1 6 LYS HD2 H -6.186 -0.248 -9.219 1.00 . A A . 6 LYS HD2 1 1 1 100 1 1 6 LYS HD3 H -5.462 0.350 -10.752 1.00 . A A . 6 LYS HD3 1 1 1 101 1 1 6 LYS HE2 H -5.269 -2.015 -11.588 1.00 . A A . 6 LYS HE2 1 1 1 102 1 1 6 LYS HE3 H -5.996 -2.616 -10.039 1.00 . A A . 6 LYS HE3 1 1 1 103 1 1 6 LYS HG2 H -3.361 -0.908 -10.230 1.00 . A A . 6 LYS HG2 1 1 1 104 1 1 6 LYS HG3 H -4.098 -1.490 -8.695 1.00 . A A . 6 LYS HG3 1 1 1 105 1 1 6 LYS HZ1 H -7.943 -1.227 -10.555 1.00 . A A . 6 LYS HZ1 1 1 1 106 1 1 6 LYS HZ2 H -7.659 -2.453 -11.694 1.00 . A A . 6 LYS HZ2 1 1 1 107 1 1 6 LYS HZ3 H -7.263 -0.844 -12.062 1.00 . A A . 6 LYS HZ3 1 1 1 108 1 1 6 LYS N N -2.242 -0.474 -6.999 1.00 . A A . 6 LYS N 1 1 1 109 1 1 6 LYS NZ N -7.304 -1.556 -11.306 1.00 . A A . 6 LYS NZ 1 1 1 110 1 1 6 LYS O O -1.954 2.827 -7.700 1.00 . A A . 6 LYS O 1 1 1 111 1 1 7 PHE C C -0.336 2.563 -4.246 1.00 . A A . 7 PHE C 1 1 1 112 1 1 7 PHE CA C -1.612 2.313 -4.806 1.00 . A A . 7 PHE CA 1 1 1 113 1 1 7 PHE CB C -2.214 1.677 -3.585 1.00 . A A . 7 PHE CB 1 1 1 114 1 1 7 PHE CD1 C -3.840 2.198 -1.929 1.00 . A A . 7 PHE CD1 1 1 1 115 1 1 7 PHE CD2 C -1.723 3.199 -1.894 1.00 . A A . 7 PHE CD2 1 1 1 116 1 1 7 PHE CE1 C -4.084 2.730 -0.724 1.00 . A A . 7 PHE CE1 1 1 1 117 1 1 7 PHE CE2 C -1.906 3.761 -0.761 1.00 . A A . 7 PHE CE2 1 1 1 118 1 1 7 PHE CG C -2.679 2.440 -2.506 1.00 . A A . 7 PHE CG 1 1 1 119 1 1 7 PHE CZ C -3.113 3.545 -0.099 1.00 . A A . 7 PHE CZ 1 1 1 120 1 1 7 PHE H H -1.761 0.451 -5.488 1.00 . A A . 7 PHE H 1 1 1 121 1 1 7 PHE HA H -2.136 3.207 -4.991 1.00 . A A . 7 PHE HA 1 1 1 122 1 1 7 PHE HB2 H -3.147 1.274 -3.932 1.00 . A A . 7 PHE HB2 1 1 1 123 1 1 7 PHE HB3 H -1.635 0.833 -3.184 1.00 . A A . 7 PHE HB3 1 1 1 124 1 1 7 PHE HD1 H -4.573 1.558 -2.432 1.00 . A A . 7 PHE HD1 1 1 1 125 1 1 7 PHE HD2 H -0.789 3.380 -2.362 1.00 . A A . 7 PHE HD2 1 1 1 126 1 1 7 PHE HE1 H -4.998 2.478 -0.266 1.00 . A A . 7 PHE HE1 1 1 1 127 1 1 7 PHE HE2 H -1.048 4.330 -0.380 1.00 . A A . 7 PHE HE2 1 1 1 128 1 1 7 PHE HZ H -3.297 3.980 0.872 1.00 . A A . 7 PHE HZ 1 1 1 129 1 1 7 PHE N N -1.839 1.422 -5.850 1.00 . A A . 7 PHE N 1 1 1 130 1 1 7 PHE O O 0.120 3.665 -4.250 1.00 . A A . 7 PHE O 1 1 1 131 1 1 8 PHE C C 2.254 1.532 -3.502 1.00 . A A . 8 PHE C 1 1 1 132 1 1 8 PHE CA C 1.206 1.723 -2.676 1.00 . A A . 8 PHE CA 1 1 1 133 1 1 8 PHE CB C 1.573 0.661 -1.696 1.00 . A A . 8 PHE CB 1 1 1 134 1 1 8 PHE CD1 C 2.036 -1.448 -2.262 1.00 . A A . 8 PHE CD1 1 1 1 135 1 1 8 PHE CD2 C -0.165 -0.821 -1.970 1.00 . A A . 8 PHE CD2 1 1 1 136 1 1 8 PHE CE1 C 1.711 -2.621 -2.605 1.00 . A A . 8 PHE CE1 1 1 1 137 1 1 8 PHE CE2 C -0.527 -2.025 -2.312 1.00 . A A . 8 PHE CE2 1 1 1 138 1 1 8 PHE CG C 1.096 -0.560 -1.950 1.00 . A A . 8 PHE CG 1 1 1 139 1 1 8 PHE CZ C 0.416 -2.939 -2.641 1.00 . A A . 8 PHE CZ 1 1 1 140 1 1 8 PHE H H -0.177 0.609 -3.647 1.00 . A A . 8 PHE H 1 1 1 141 1 1 8 PHE HA H 1.223 2.681 -2.330 1.00 . A A . 8 PHE HA 1 1 1 142 1 1 8 PHE HB2 H 2.635 0.556 -1.567 1.00 . A A . 8 PHE HB2 1 1 1 143 1 1 8 PHE HB3 H 1.090 0.917 -0.754 1.00 . A A . 8 PHE HB3 1 1 1 144 1 1 8 PHE HD1 H 3.081 -1.168 -2.229 1.00 . A A . 8 PHE HD1 1 1 1 145 1 1 8 PHE HD2 H -0.881 -0.070 -1.691 1.00 . A A . 8 PHE HD2 1 1 1 146 1 1 8 PHE HE1 H 2.472 -3.284 -2.871 1.00 . A A . 8 PHE HE1 1 1 1 147 1 1 8 PHE HE2 H -1.536 -2.243 -2.371 1.00 . A A . 8 PHE HE2 1 1 1 148 1 1 8 PHE HZ H 0.141 -3.866 -2.919 1.00 . A A . 8 PHE HZ 1 1 1 149 1 1 8 PHE N N 0.169 1.520 -3.571 1.00 . A A . 8 PHE N 1 1 1 150 1 1 8 PHE O O 3.172 2.202 -3.475 1.00 . A A . 8 PHE O 1 1 1 151 1 1 9 ARG C C 2.949 1.296 -6.186 1.00 . A A . 9 ARG C 1 1 1 152 1 1 9 ARG CA C 2.915 0.195 -5.274 1.00 . A A . 9 ARG CA 1 1 1 153 1 1 9 ARG CB C 2.431 -1.031 -5.973 1.00 . A A . 9 ARG CB 1 1 1 154 1 1 9 ARG CD C 4.377 -2.638 -6.084 1.00 . A A . 9 ARG CD 1 1 1 155 1 1 9 ARG CG C 3.036 -2.316 -5.434 1.00 . A A . 9 ARG CG 1 1 1 156 1 1 9 ARG CZ C 5.174 -3.419 -8.301 1.00 . A A . 9 ARG CZ 1 1 1 157 1 1 9 ARG H H 1.152 0.131 -4.345 1.00 . A A . 9 ARG H 1 1 1 158 1 1 9 ARG HA H 3.822 0.080 -4.805 1.00 . A A . 9 ARG HA 1 1 1 159 1 1 9 ARG HB2 H 1.323 -1.055 -5.787 1.00 . A A . 9 ARG HB2 1 1 1 160 1 1 9 ARG HB3 H 2.615 -0.933 -7.058 1.00 . A A . 9 ARG HB3 1 1 1 161 1 1 9 ARG HD2 H 5.001 -1.721 -6.155 1.00 . A A . 9 ARG HD2 1 1 1 162 1 1 9 ARG HD3 H 4.916 -3.421 -5.513 1.00 . A A . 9 ARG HD3 1 1 1 163 1 1 9 ARG HE H 3.189 -3.296 -7.778 1.00 . A A . 9 ARG HE 1 1 1 164 1 1 9 ARG HG2 H 3.188 -2.206 -4.347 1.00 . A A . 9 ARG HG2 1 1 1 165 1 1 9 ARG HG3 H 2.328 -3.153 -5.606 1.00 . A A . 9 ARG HG3 1 1 1 166 1 1 9 ARG HH11 H 6.629 -2.884 -6.953 1.00 . A A . 9 ARG HH11 1 1 1 167 1 1 9 ARG HH12 H 7.222 -3.420 -8.489 1.00 . A A . 9 ARG HH12 1 1 1 168 1 1 9 ARG HH21 H 3.994 -4.026 -9.869 1.00 . A A . 9 ARG HH21 1 1 1 169 1 1 9 ARG HH22 H 5.697 -4.080 -10.175 1.00 . A A . 9 ARG HH22 1 1 1 170 1 1 9 ARG N N 2.026 0.572 -4.325 1.00 . A A . 9 ARG N 1 1 1 171 1 1 9 ARG NE N 4.127 -3.151 -7.464 1.00 . A A . 9 ARG NE 1 1 1 172 1 1 9 ARG NH1 N 6.456 -3.224 -7.877 1.00 . A A . 9 ARG NH1 1 1 1 173 1 1 9 ARG NH2 N 4.934 -3.883 -9.561 1.00 . A A . 9 ARG NH2 1 1 1 174 1 1 9 ARG O O 3.635 1.289 -7.208 1.00 . A A . 9 ARG O 1 1 1 175 1 1 10 ASP C C 2.133 4.567 -5.895 1.00 . A A . 10 ASP C 1 1 1 176 1 1 10 ASP CA C 1.903 3.307 -6.632 1.00 . A A . 10 ASP CA 1 1 1 177 1 1 10 ASP CB C 0.655 3.273 -7.290 1.00 . A A . 10 ASP CB 1 1 1 178 1 1 10 ASP CG C 0.631 3.941 -8.661 1.00 . A A . 10 ASP CG 1 1 1 179 1 1 10 ASP H H 1.467 2.143 -5.030 1.00 . A A . 10 ASP H 1 1 1 180 1 1 10 ASP HA H 2.663 3.204 -7.292 1.00 . A A . 10 ASP HA 1 1 1 181 1 1 10 ASP HB2 H 0.460 2.190 -7.377 1.00 . A A . 10 ASP HB2 1 1 1 182 1 1 10 ASP HB3 H -0.067 3.735 -6.614 1.00 . A A . 10 ASP HB3 1 1 1 183 1 1 10 ASP N N 2.021 2.196 -5.894 1.00 . A A . 10 ASP N 1 1 1 184 1 1 10 ASP O O 2.127 5.631 -6.517 1.00 . A A . 10 ASP O 1 1 1 185 1 1 10 ASP OD1 O 0.909 3.232 -9.665 1.00 . A A . 10 ASP OD1 1 1 1 186 1 1 10 ASP OD2 O 0.338 5.164 -8.723 1.00 . A A . 10 ASP OD2 1 1 1 187 1 1 11 . C C 2.346 6.048 -2.511 1.00 . A A . 11 DPN C 1 1 1 188 1 1 11 . CA C 2.593 5.847 -3.976 1.00 . A A . 11 DPN CA 1 1 1 189 1 1 11 . CB C 4.055 6.165 -4.209 1.00 . A A . 11 DPN CB 1 1 1 190 1 1 11 . CD1 C 4.708 4.789 -6.101 1.00 . A A . 11 DPN CD1 1 1 1 191 1 1 11 . CD2 C 4.907 4.170 -3.867 1.00 . A A . 11 DPN CD2 1 1 1 192 1 1 11 . CE1 C 4.922 3.520 -6.425 1.00 . A A . 11 DPN CE1 1 1 1 193 1 1 11 . CE2 C 5.189 2.997 -4.177 1.00 . A A . 11 DPN CE2 1 1 1 194 1 1 11 . CG C 4.680 5.070 -4.775 1.00 . A A . 11 DPN CG 1 1 1 195 1 1 11 . CZ C 5.160 2.651 -5.408 1.00 . A A . 11 DPN CZ 1 1 1 196 1 1 11 . H H 2.307 3.679 -3.993 1.00 . A A . 11 DPN H 1 1 1 197 1 1 11 . HA H 2.015 6.534 -4.472 1.00 . A A . 11 DPN HA 1 1 1 198 1 1 11 . HB2 H 4.524 6.272 -3.238 1.00 . A A . 11 DPN HB2 1 1 1 199 1 1 11 . HB3 H 4.181 6.988 -4.857 1.00 . A A . 11 DPN HB3 1 1 1 200 1 1 11 . HD1 H 4.520 5.545 -6.849 1.00 . A A . 11 DPN HD1 1 1 1 201 1 1 11 . HD2 H 4.937 4.454 -2.874 1.00 . A A . 11 DPN HD2 1 1 1 202 1 1 11 . HE1 H 4.918 3.192 -7.450 1.00 . A A . 11 DPN HE1 1 1 1 203 1 1 11 . HE2 H 5.319 2.275 -3.426 1.00 . A A . 11 DPN HE2 1 1 1 204 1 1 11 . HZ H 5.220 1.710 -5.566 1.00 . A A . 11 DPN HZ 1 1 1 205 1 1 11 . N N 2.299 4.545 -4.557 1.00 . A A . 11 DPN N 1 1 1 206 1 1 11 . O O 1.375 6.684 -2.109 1.00 . A A . 11 DPN O 1 1 1 207 1 1 12 ILE C C 4.582 5.044 0.191 1.00 . A A . 12 ILE C 1 1 1 208 1 1 12 ILE CA C 3.306 5.719 -0.284 1.00 . A A . 12 ILE CA 1 1 1 209 1 1 12 ILE CB C 2.133 5.151 0.445 1.00 . A A . 12 ILE CB 1 1 1 210 1 1 12 ILE CD1 C 2.559 3.110 -0.660 1.00 . A A . 12 ILE CD1 1 1 1 211 1 1 12 ILE CG1 C 1.524 4.093 -0.419 1.00 . A A . 12 ILE CG1 1 1 1 212 1 1 12 ILE CG2 C 1.154 6.278 0.815 1.00 . A A . 12 ILE CG2 1 1 1 213 1 1 12 ILE H H 3.898 4.847 -2.042 1.00 . A A . 12 ILE H 1 1 1 214 1 1 12 ILE HA H 3.387 6.740 -0.113 1.00 . A A . 12 ILE HA 1 1 1 215 1 1 12 ILE HB H 2.495 4.661 1.359 1.00 . A A . 12 ILE HB 1 1 1 216 1 1 12 ILE HD11 H 3.422 3.345 -0.073 1.00 . A A . 12 ILE HD11 1 1 1 217 1 1 12 ILE HD12 H 2.859 3.135 -1.746 1.00 . A A . 12 ILE HD12 1 1 1 218 1 1 12 ILE HD13 H 2.219 2.131 -0.371 1.00 . A A . 12 ILE HD13 1 1 1 219 1 1 12 ILE HG12 H 0.662 3.615 0.076 1.00 . A A . 12 ILE HG12 1 1 1 220 1 1 12 ILE HG13 H 1.216 4.506 -1.402 1.00 . A A . 12 ILE HG13 1 1 1 221 1 1 12 ILE HG21 H 1.270 6.557 1.884 1.00 . A A . 12 ILE HG21 1 1 1 222 1 1 12 ILE HG22 H 0.107 5.949 0.646 1.00 . A A . 12 ILE HG22 1 1 1 223 1 1 12 ILE HG23 H 1.346 7.178 0.190 1.00 . A A . 12 ILE HG23 1 1 1 224 1 1 12 ILE N N 3.269 5.511 -1.702 1.00 . A A . 12 ILE N 1 1 1 225 1 1 12 ILE O O 4.872 4.994 1.373 1.00 . A A . 12 ILE O 1 1 1 226 1 1 13 LEU C C 7.653 4.317 -1.145 1.00 . A A . 13 LEU C 1 1 1 227 1 1 13 LEU CA C 6.507 3.638 -0.523 1.00 . A A . 13 LEU CA 1 1 1 228 1 1 13 LEU CB C 6.461 2.301 -1.235 1.00 . A A . 13 LEU CB 1 1 1 229 1 1 13 LEU CD1 C 5.051 0.423 -1.962 1.00 . A A . 13 LEU CD1 1 1 1 230 1 1 13 LEU CD2 C 4.747 1.572 0.342 1.00 . A A . 13 LEU CD2 1 1 1 231 1 1 13 LEU CG C 5.123 1.701 -1.132 1.00 . A A . 13 LEU CG 1 1 1 232 1 1 13 LEU H H 4.939 4.307 -1.715 1.00 . A A . 13 LEU H 1 1 1 233 1 1 13 LEU HA H 6.645 3.516 0.530 1.00 . A A . 13 LEU HA 1 1 1 234 1 1 13 LEU HB2 H 6.671 2.452 -2.310 1.00 . A A . 13 LEU HB2 1 1 1 235 1 1 13 LEU HB3 H 7.202 1.606 -0.811 1.00 . A A . 13 LEU HB3 1 1 1 236 1 1 13 LEU HD11 H 4.582 -0.397 -1.390 1.00 . A A . 13 LEU HD11 1 1 1 237 1 1 13 LEU HD12 H 6.071 0.124 -2.275 1.00 . A A . 13 LEU HD12 1 1 1 238 1 1 13 LEU HD13 H 4.451 0.617 -2.890 1.00 . A A . 13 LEU HD13 1 1 1 239 1 1 13 LEU HD21 H 3.716 1.181 0.446 1.00 . A A . 13 LEU HD21 1 1 1 240 1 1 13 LEU HD22 H 4.795 2.599 0.816 1.00 . A A . 13 LEU HD22 1 1 1 241 1 1 13 LEU HD23 H 5.453 0.904 0.867 1.00 . A A . 13 LEU HD23 1 1 1 242 1 1 13 LEU HG H 4.431 2.427 -1.604 1.00 . A A . 13 LEU HG 1 1 1 243 1 1 13 LEU N N 5.289 4.385 -0.778 1.00 . A A . 13 LEU N 1 1 1 244 1 1 13 LEU O O 8.691 4.519 -0.540 1.00 . A A . 13 LEU O 1 1 1 245 1 1 14 GLN C C 8.700 6.613 -2.514 1.00 . A A . 14 GLN C 1 1 1 246 1 1 14 GLN CA C 8.568 5.303 -3.142 1.00 . A A . 14 GLN CA 1 1 1 247 1 1 14 GLN CB C 8.296 5.572 -4.619 1.00 . A A . 14 GLN CB 1 1 1 248 1 1 14 GLN CD C 8.791 3.194 -4.956 1.00 . A A . 14 GLN CD 1 1 1 249 1 1 14 GLN CG C 7.886 4.331 -5.340 1.00 . A A . 14 GLN CG 1 1 1 250 1 1 14 GLN H H 6.639 4.420 -2.943 1.00 . A A . 14 GLN H 1 1 1 251 1 1 14 GLN HA H 9.468 4.734 -3.003 1.00 . A A . 14 GLN HA 1 1 1 252 1 1 14 GLN HB2 H 7.468 6.308 -4.700 1.00 . A A . 14 GLN HB2 1 1 1 253 1 1 14 GLN HB3 H 9.197 5.995 -5.098 1.00 . A A . 14 GLN HB3 1 1 1 254 1 1 14 GLN HE21 H 7.270 2.490 -3.813 1.00 . A A . 14 GLN HE21 1 1 1 255 1 1 14 GLN HE22 H 8.724 1.531 -3.784 1.00 . A A . 14 GLN HE22 1 1 1 256 1 1 14 GLN HG2 H 6.868 4.092 -5.022 1.00 . A A . 14 GLN HG2 1 1 1 257 1 1 14 GLN HG3 H 7.911 4.485 -6.432 1.00 . A A . 14 GLN HG3 1 1 1 258 1 1 14 GLN N N 7.491 4.642 -2.434 1.00 . A A . 14 GLN N 1 1 1 259 1 1 14 GLN NE2 N 8.220 2.319 -4.114 1.00 . A A . 14 GLN NE2 1 1 1 260 1 1 14 GLN O O 9.723 7.288 -2.609 1.00 . A A . 14 GLN O 1 1 1 261 1 1 14 GLN OE1 O 9.956 3.118 -5.334 1.00 . A A . 14 GLN OE1 1 1 1 262 1 1 15 ARG C C 7.764 7.962 0.255 1.00 . A A . 15 ARG C 1 1 1 263 1 1 15 ARG CA C 7.607 8.251 -1.203 1.00 . A A . 15 ARG CA 1 1 1 264 1 1 15 ARG CB C 6.292 9.018 -1.349 1.00 . A A . 15 ARG CB 1 1 1 265 1 1 15 ARG CD C 4.024 8.608 -2.305 1.00 . A A . 15 ARG CD 1 1 1 266 1 1 15 ARG CG C 5.516 8.635 -2.595 1.00 . A A . 15 ARG CG 1 1 1 267 1 1 15 ARG CZ C 3.219 10.892 -2.888 1.00 . A A . 15 ARG CZ 1 1 1 268 1 1 15 ARG H H 6.794 6.395 -1.770 1.00 . A A . 15 ARG H 1 1 1 269 1 1 15 ARG HA H 8.435 8.804 -1.589 1.00 . A A . 15 ARG HA 1 1 1 270 1 1 15 ARG HB2 H 5.655 8.830 -0.459 1.00 . A A . 15 ARG HB2 1 1 1 271 1 1 15 ARG HB3 H 6.511 10.106 -1.386 1.00 . A A . 15 ARG HB3 1 1 1 272 1 1 15 ARG HD2 H 3.452 8.276 -3.192 1.00 . A A . 15 ARG HD2 1 1 1 273 1 1 15 ARG HD3 H 3.820 7.918 -1.448 1.00 . A A . 15 ARG HD3 1 1 1 274 1 1 15 ARG HE H 3.539 10.244 -0.959 1.00 . A A . 15 ARG HE 1 1 1 275 1 1 15 ARG HG2 H 5.730 9.357 -3.409 1.00 . A A . 15 ARG HG2 1 1 1 276 1 1 15 ARG HG3 H 5.832 7.622 -2.929 1.00 . A A . 15 ARG HG3 1 1 1 277 1 1 15 ARG HH11 H 3.556 9.636 -4.478 1.00 . A A . 15 ARG HH11 1 1 1 278 1 1 15 ARG HH12 H 3.000 11.219 -4.907 1.00 . A A . 15 ARG HH12 1 1 1 279 1 1 15 ARG HH21 H 2.783 12.390 -1.551 1.00 . A A . 15 ARG HH21 1 1 1 280 1 1 15 ARG HH22 H 2.554 12.810 -3.215 1.00 . A A . 15 ARG HH22 1 1 1 281 1 1 15 ARG N N 7.617 6.992 -1.847 1.00 . A A . 15 ARG N 1 1 1 282 1 1 15 ARG NE N 3.575 9.984 -1.928 1.00 . A A . 15 ARG NE 1 1 1 283 1 1 15 ARG NH1 N 3.262 10.553 -4.209 1.00 . A A . 15 ARG NH1 1 1 1 284 1 1 15 ARG NH2 N 2.816 12.142 -2.519 1.00 . A A . 15 ARG NH2 1 1 1 285 1 1 15 ARG O O 8.279 8.772 1.020 1.00 . A A . 15 ARG O 1 1 1 286 1 1 16 LYS C C 6.202 6.947 2.779 1.00 . A A . 16 LYS C 1 1 1 287 1 1 16 LYS CA C 7.271 6.268 1.981 1.00 . A A . 16 LYS CA 1 1 1 288 1 1 16 LYS CB C 8.592 6.456 2.715 1.00 . A A . 16 LYS CB 1 1 1 289 1 1 16 LYS CD C 9.556 4.161 2.215 1.00 . A A . 16 LYS CD 1 1 1 290 1 1 16 LYS CE C 10.759 3.369 1.699 1.00 . A A . 16 LYS CE 1 1 1 291 1 1 16 LYS CG C 9.756 5.675 2.104 1.00 . A A . 16 LYS CG 1 1 1 292 1 1 16 LYS H H 6.863 6.140 -0.025 1.00 . A A . 16 LYS H 1 1 1 293 1 1 16 LYS HA H 7.020 5.219 1.905 1.00 . A A . 16 LYS HA 1 1 1 294 1 1 16 LYS HB2 H 8.828 7.532 2.697 1.00 . A A . 16 LYS HB2 1 1 1 295 1 1 16 LYS HB3 H 8.462 6.149 3.768 1.00 . A A . 16 LYS HB3 1 1 1 296 1 1 16 LYS HD2 H 9.374 3.896 3.278 1.00 . A A . 16 LYS HD2 1 1 1 297 1 1 16 LYS HD3 H 8.653 3.875 1.630 1.00 . A A . 16 LYS HD3 1 1 1 298 1 1 16 LYS HE2 H 10.941 3.591 0.626 1.00 . A A . 16 LYS HE2 1 1 1 299 1 1 16 LYS HE3 H 11.670 3.616 2.286 1.00 . A A . 16 LYS HE3 1 1 1 300 1 1 16 LYS HG2 H 9.860 5.952 1.033 1.00 . A A . 16 LYS HG2 1 1 1 301 1 1 16 LYS HG3 H 10.696 5.957 2.624 1.00 . A A . 16 LYS HG3 1 1 1 302 1 1 16 LYS HZ1 H 9.664 1.760 2.407 1.00 . A A . 16 LYS HZ1 1 1 1 303 1 1 16 LYS HZ2 H 11.331 1.465 2.282 1.00 . A A . 16 LYS HZ2 1 1 1 304 1 1 16 LYS HZ3 H 10.368 1.505 0.884 1.00 . A A . 16 LYS HZ3 1 1 1 305 1 1 16 LYS N N 7.258 6.761 0.634 1.00 . A A . 16 LYS N 1 1 1 306 1 1 16 LYS NZ N 10.512 1.916 1.827 1.00 . A A . 16 LYS NZ 1 1 1 307 1 1 16 LYS O O 6.151 6.823 4.002 1.00 . A A . 16 LYS O 1 1 1 308 1 1 17 LYS C C 3.288 8.948 1.765 1.00 . A A . 17 LYS C 1 1 1 309 1 1 17 LYS CA C 4.232 8.322 2.790 1.00 . A A . 17 LYS CA 1 1 1 310 1 1 17 LYS CB C 4.687 9.436 3.756 1.00 . A A . 17 LYS CB 1 1 1 311 1 1 17 LYS CD C 5.466 11.492 2.454 1.00 . A A . 17 LYS CD 1 1 1 312 1 1 17 LYS CE C 6.520 11.910 1.431 1.00 . A A . 17 LYS CE 1 1 1 313 1 1 17 LYS CG C 5.883 10.243 3.238 1.00 . A A . 17 LYS CG 1 1 1 314 1 1 17 LYS H H 5.372 7.788 1.115 1.00 . A A . 17 LYS H 1 1 1 315 1 1 17 LYS HA H 3.698 7.555 3.319 1.00 . A A . 17 LYS HA 1 1 1 316 1 1 17 LYS HB2 H 3.837 10.125 3.940 1.00 . A A . 17 LYS HB2 1 1 1 317 1 1 17 LYS HB3 H 4.966 8.970 4.722 1.00 . A A . 17 LYS HB3 1 1 1 318 1 1 17 LYS HD2 H 4.509 11.291 1.925 1.00 . A A . 17 LYS HD2 1 1 1 319 1 1 17 LYS HD3 H 5.297 12.329 3.165 1.00 . A A . 17 LYS HD3 1 1 1 320 1 1 17 LYS HE2 H 7.482 12.142 1.934 1.00 . A A . 17 LYS HE2 1 1 1 321 1 1 17 LYS HE3 H 6.678 11.099 0.686 1.00 . A A . 17 LYS HE3 1 1 1 322 1 1 17 LYS HG2 H 6.507 10.554 4.102 1.00 . A A . 17 LYS HG2 1 1 1 323 1 1 17 LYS HG3 H 6.506 9.598 2.587 1.00 . A A . 17 LYS HG3 1 1 1 324 1 1 17 LYS HZ1 H 5.804 12.863 -0.264 1.00 . A A . 17 LYS HZ1 1 1 1 325 1 1 17 LYS HZ2 H 6.863 13.806 0.670 1.00 . A A . 17 LYS HZ2 1 1 1 326 1 1 17 LYS HZ3 H 5.270 13.545 1.196 1.00 . A A . 17 LYS HZ3 1 1 1 327 1 1 17 LYS N N 5.310 7.669 2.095 1.00 . A A . 17 LYS N 1 1 1 328 1 1 17 LYS NZ N 6.081 13.121 0.704 1.00 . A A . 17 LYS NZ 1 1 1 329 1 1 17 LYS O O 2.062 9.015 2.054 1.00 . A A . 17 LYS O 1 1 1 330 1 1 17 LYS OXT O 3.777 9.377 0.696 1.00 . A A . 17 LYS OXT 1 1 2 331 1 1 1 GLU C C -2.022 -8.814 -3.769 1.00 . A A . 1 GLU C 1 1 2 332 1 1 1 GLU CA C -1.348 -9.868 -4.601 1.00 . A A . 1 GLU CA 1 1 2 333 1 1 1 GLU CB C -2.227 -11.134 -4.601 1.00 . A A . 1 GLU CB 1 1 2 334 1 1 1 GLU CD C -4.398 -12.205 -5.218 1.00 . A A . 1 GLU CD 1 1 2 335 1 1 1 GLU CG C -3.620 -10.893 -5.210 1.00 . A A . 1 GLU CG 1 1 2 336 1 1 1 GLU H1 H 0.290 -11.130 -4.369 1.00 . A A . 1 GLU H1 1 1 2 337 1 1 1 GLU H2 H -0.036 -10.159 -3.014 1.00 . A A . 1 GLU H2 1 1 2 338 1 1 1 GLU H3 H 0.686 -9.478 -4.392 1.00 . A A . 1 GLU H3 1 1 2 339 1 1 1 GLU HA H -1.214 -9.501 -5.606 1.00 . A A . 1 GLU HA 1 1 2 340 1 1 1 GLU HB2 H -1.708 -11.931 -5.181 1.00 . A A . 1 GLU HB2 1 1 2 341 1 1 1 GLU HB3 H -2.346 -11.494 -3.556 1.00 . A A . 1 GLU HB3 1 1 2 342 1 1 1 GLU HG2 H -4.174 -10.142 -4.606 1.00 . A A . 1 GLU HG2 1 1 2 343 1 1 1 GLU HG3 H -3.525 -10.522 -6.251 1.00 . A A . 1 GLU HG3 1 1 2 344 1 1 1 GLU N N -0.001 -10.182 -4.053 1.00 . A A . 1 GLU N 1 1 2 345 1 1 1 GLU O O -2.447 -9.071 -2.642 1.00 . A A . 1 GLU O 1 1 2 346 1 1 1 GLU OE1 O -3.832 -13.238 -4.769 1.00 . A A . 1 GLU OE1 1 1 2 347 1 1 1 GLU OE2 O -5.571 -12.189 -5.674 1.00 . A A . 1 GLU OE2 1 1 2 348 1 1 2 MET C C -3.772 -5.901 -4.516 1.00 . A A . 2 MET C 1 1 2 349 1 1 2 MET CA C -2.776 -6.515 -3.612 1.00 . A A . 2 MET CA 1 1 2 350 1 1 2 MET CB C -1.810 -5.426 -3.109 1.00 . A A . 2 MET CB 1 1 2 351 1 1 2 MET CE C -3.911 -5.414 -0.933 1.00 . A A . 2 MET CE 1 1 2 352 1 1 2 MET CG C -1.335 -5.615 -1.659 1.00 . A A . 2 MET CG 1 1 2 353 1 1 2 MET H H -1.807 -7.381 -5.243 1.00 . A A . 2 MET H 1 1 2 354 1 1 2 MET HA H -3.333 -6.923 -2.792 1.00 . A A . 2 MET HA 1 1 2 355 1 1 2 MET HB2 H -0.920 -5.417 -3.771 1.00 . A A . 2 MET HB2 1 1 2 356 1 1 2 MET HB3 H -2.300 -4.428 -3.188 1.00 . A A . 2 MET HB3 1 1 2 357 1 1 2 MET HE1 H -4.221 -4.849 -0.031 1.00 . A A . 2 MET HE1 1 1 2 358 1 1 2 MET HE2 H -4.783 -6.000 -1.292 1.00 . A A . 2 MET HE2 1 1 2 359 1 1 2 MET HE3 H -3.646 -4.683 -1.724 1.00 . A A . 2 MET HE3 1 1 2 360 1 1 2 MET HG2 H -0.366 -6.153 -1.674 1.00 . A A . 2 MET HG2 1 1 2 361 1 1 2 MET HG3 H -1.147 -4.603 -1.241 1.00 . A A . 2 MET HG3 1 1 2 362 1 1 2 MET N N -2.141 -7.590 -4.327 1.00 . A A . 2 MET N 1 1 2 363 1 1 2 MET O O -3.904 -6.260 -5.685 1.00 . A A . 2 MET O 1 1 2 364 1 1 2 MET SD S -2.504 -6.497 -0.572 1.00 . A A . 2 MET SD 1 1 2 365 1 1 3 ARG C C -5.316 -2.878 -4.623 1.00 . A A . 3 ARG C 1 1 2 366 1 1 3 ARG CA C -5.552 -4.297 -4.645 1.00 . A A . 3 ARG CA 1 1 2 367 1 1 3 ARG CB C -6.837 -4.485 -3.891 1.00 . A A . 3 ARG CB 1 1 2 368 1 1 3 ARG CD C -6.815 -6.933 -3.377 1.00 . A A . 3 ARG CD 1 1 2 369 1 1 3 ARG CG C -7.510 -5.822 -4.159 1.00 . A A . 3 ARG CG 1 1 2 370 1 1 3 ARG CZ C -8.363 -8.883 -3.327 1.00 . A A . 3 ARG CZ 1 1 2 371 1 1 3 ARG H H -4.318 -4.593 -3.037 1.00 . A A . 3 ARG H 1 1 2 372 1 1 3 ARG HA H -5.588 -4.636 -5.615 1.00 . A A . 3 ARG HA 1 1 2 373 1 1 3 ARG HB2 H -6.567 -4.427 -2.810 1.00 . A A . 3 ARG HB2 1 1 2 374 1 1 3 ARG HB3 H -7.527 -3.651 -4.124 1.00 . A A . 3 ARG HB3 1 1 2 375 1 1 3 ARG HD2 H -6.208 -7.574 -4.051 1.00 . A A . 3 ARG HD2 1 1 2 376 1 1 3 ARG HD3 H -6.159 -6.493 -2.590 1.00 . A A . 3 ARG HD3 1 1 2 377 1 1 3 ARG HE H -8.175 -7.522 -1.795 1.00 . A A . 3 ARG HE 1 1 2 378 1 1 3 ARG HG2 H -8.580 -5.763 -3.862 1.00 . A A . 3 ARG HG2 1 1 2 379 1 1 3 ARG HG3 H -7.462 -6.051 -5.245 1.00 . A A . 3 ARG HG3 1 1 2 380 1 1 3 ARG HH11 H -7.248 -8.678 -5.040 1.00 . A A . 3 ARG HH11 1 1 2 381 1 1 3 ARG HH12 H -8.311 -10.045 -5.024 1.00 . A A . 3 ARG HH12 1 1 2 382 1 1 3 ARG HH21 H -9.620 -9.380 -1.780 1.00 . A A . 3 ARG HH21 1 1 2 383 1 1 3 ARG HH22 H -9.682 -10.448 -3.141 1.00 . A A . 3 ARG HH22 1 1 2 384 1 1 3 ARG N N -4.495 -4.929 -3.954 1.00 . A A . 3 ARG N 1 1 2 385 1 1 3 ARG NE N -7.851 -7.774 -2.707 1.00 . A A . 3 ARG NE 1 1 2 386 1 1 3 ARG NH1 N -7.937 -9.234 -4.575 1.00 . A A . 3 ARG NH1 1 1 2 387 1 1 3 ARG NH2 N -9.306 -9.638 -2.693 1.00 . A A . 3 ARG NH2 1 1 2 388 1 1 3 ARG O O -5.804 -2.113 -5.450 1.00 . A A . 3 ARG O 1 1 2 389 1 1 4 LEU C C -3.392 -0.831 -4.514 1.00 . A A . 4 LEU C 1 1 2 390 1 1 4 LEU CA C -4.276 -1.165 -3.422 1.00 . A A . 4 LEU CA 1 1 2 391 1 1 4 LEU CB C -3.494 -0.937 -2.154 1.00 . A A . 4 LEU CB 1 1 2 392 1 1 4 LEU CD1 C -2.451 -1.950 -0.189 1.00 . A A . 4 LEU CD1 1 1 2 393 1 1 4 LEU CD2 C -4.944 -2.356 -0.687 1.00 . A A . 4 LEU CD2 1 1 2 394 1 1 4 LEU CG C -3.539 -2.108 -1.236 1.00 . A A . 4 LEU CG 1 1 2 395 1 1 4 LEU H H -4.138 -3.160 -3.006 1.00 . A A . 4 LEU H 1 1 2 396 1 1 4 LEU HA H -5.119 -0.578 -3.460 1.00 . A A . 4 LEU HA 1 1 2 397 1 1 4 LEU HB2 H -2.461 -0.704 -2.396 1.00 . A A . 4 LEU HB2 1 1 2 398 1 1 4 LEU HB3 H -3.923 -0.087 -1.616 1.00 . A A . 4 LEU HB3 1 1 2 399 1 1 4 LEU HD11 H -1.684 -2.746 -0.334 1.00 . A A . 4 LEU HD11 1 1 2 400 1 1 4 LEU HD12 H -2.865 -2.012 0.835 1.00 . A A . 4 LEU HD12 1 1 2 401 1 1 4 LEU HD13 H -1.949 -0.961 -0.332 1.00 . A A . 4 LEU HD13 1 1 2 402 1 1 4 LEU HD21 H -4.895 -2.848 0.304 1.00 . A A . 4 LEU HD21 1 1 2 403 1 1 4 LEU HD22 H -5.509 -3.018 -1.395 1.00 . A A . 4 LEU HD22 1 1 2 404 1 1 4 LEU HD23 H -5.492 -1.394 -0.590 1.00 . A A . 4 LEU HD23 1 1 2 405 1 1 4 LEU HG H -3.253 -2.968 -1.849 1.00 . A A . 4 LEU HG 1 1 2 406 1 1 4 LEU N N -4.559 -2.507 -3.630 1.00 . A A . 4 LEU N 1 1 2 407 1 1 4 LEU O O -3.793 -0.085 -5.380 1.00 . A A . 4 LEU O 1 1 2 408 1 1 5 SER C C -1.121 -0.988 -6.659 1.00 . A A . 5 SER C 1 1 2 409 1 1 5 SER CA C -1.143 -1.713 -5.338 1.00 . A A . 5 SER CA 1 1 2 410 1 1 5 SER CB C -0.682 -3.129 -5.448 1.00 . A A . 5 SER CB 1 1 2 411 1 1 5 SER H H -2.411 -2.458 -3.924 1.00 . A A . 5 SER H 1 1 2 412 1 1 5 SER HA H -0.436 -1.196 -4.698 1.00 . A A . 5 SER HA 1 1 2 413 1 1 5 SER HB2 H 0.390 -3.159 -5.176 1.00 . A A . 5 SER HB2 1 1 2 414 1 1 5 SER HB3 H -1.276 -3.710 -4.687 1.00 . A A . 5 SER HB3 1 1 2 415 1 1 5 SER HG H -0.430 -3.103 -7.361 1.00 . A A . 5 SER HG 1 1 2 416 1 1 5 SER N N -2.373 -1.706 -4.559 1.00 . A A . 5 SER N 1 1 2 417 1 1 5 SER O O -0.111 -0.938 -7.347 1.00 . A A . 5 SER O 1 1 2 418 1 1 5 SER OG O -0.885 -3.687 -6.744 1.00 . A A . 5 SER OG 1 1 2 419 1 1 6 LYS C C -1.992 1.710 -7.239 1.00 . A A . 6 LYS C 1 1 2 420 1 1 6 LYS CA C -2.269 0.476 -8.097 1.00 . A A . 6 LYS CA 1 1 2 421 1 1 6 LYS CB C -3.626 0.647 -8.797 1.00 . A A . 6 LYS CB 1 1 2 422 1 1 6 LYS CD C -3.227 -1.149 -10.565 1.00 . A A . 6 LYS CD 1 1 2 423 1 1 6 LYS CE C -3.769 -2.413 -11.235 1.00 . A A . 6 LYS CE 1 1 2 424 1 1 6 LYS CG C -4.137 -0.647 -9.439 1.00 . A A . 6 LYS CG 1 1 2 425 1 1 6 LYS H H -3.113 -0.675 -6.619 1.00 . A A . 6 LYS H 1 1 2 426 1 1 6 LYS HA H -1.452 0.297 -8.786 1.00 . A A . 6 LYS HA 1 1 2 427 1 1 6 LYS HB2 H -4.371 1.007 -8.056 1.00 . A A . 6 LYS HB2 1 1 2 428 1 1 6 LYS HB3 H -3.521 1.424 -9.585 1.00 . A A . 6 LYS HB3 1 1 2 429 1 1 6 LYS HD2 H -3.119 -0.351 -11.329 1.00 . A A . 6 LYS HD2 1 1 2 430 1 1 6 LYS HD3 H -2.218 -1.364 -10.149 1.00 . A A . 6 LYS HD3 1 1 2 431 1 1 6 LYS HE2 H -3.862 -3.237 -10.497 1.00 . A A . 6 LYS HE2 1 1 2 432 1 1 6 LYS HE3 H -4.762 -2.215 -11.695 1.00 . A A . 6 LYS HE3 1 1 2 433 1 1 6 LYS HG2 H -4.215 -1.434 -8.659 1.00 . A A . 6 LYS HG2 1 1 2 434 1 1 6 LYS HG3 H -5.156 -0.469 -9.849 1.00 . A A . 6 LYS HG3 1 1 2 435 1 1 6 LYS HZ1 H -3.387 -3.008 -13.183 1.00 . A A . 6 LYS HZ1 1 1 2 436 1 1 6 LYS HZ2 H -2.400 -3.755 -12.021 1.00 . A A . 6 LYS HZ2 1 1 2 437 1 1 6 LYS HZ3 H -2.120 -2.139 -12.459 1.00 . A A . 6 LYS HZ3 1 1 2 438 1 1 6 LYS N N -2.237 -0.472 -7.059 1.00 . A A . 6 LYS N 1 1 2 439 1 1 6 LYS NZ N -2.851 -2.862 -12.304 1.00 . A A . 6 LYS NZ 1 1 2 440 1 1 6 LYS O O -2.012 2.848 -7.697 1.00 . A A . 6 LYS O 1 1 2 441 1 1 7 PHE C C -0.385 2.540 -4.250 1.00 . A A . 7 PHE C 1 1 2 442 1 1 7 PHE CA C -1.658 2.278 -4.814 1.00 . A A . 7 PHE CA 1 1 2 443 1 1 7 PHE CB C -2.247 1.604 -3.608 1.00 . A A . 7 PHE CB 1 1 2 444 1 1 7 PHE CD1 C -3.883 2.063 -1.945 1.00 . A A . 7 PHE CD1 1 1 2 445 1 1 7 PHE CD2 C -1.781 3.089 -1.880 1.00 . A A . 7 PHE CD2 1 1 2 446 1 1 7 PHE CE1 C -4.138 2.562 -0.728 1.00 . A A . 7 PHE CE1 1 1 2 447 1 1 7 PHE CE2 C -1.973 3.622 -0.735 1.00 . A A . 7 PHE CE2 1 1 2 448 1 1 7 PHE CG C -2.725 2.333 -2.513 1.00 . A A . 7 PHE CG 1 1 2 449 1 1 7 PHE CZ C -3.178 3.375 -0.081 1.00 . A A . 7 PHE CZ 1 1 2 450 1 1 7 PHE H H -1.770 0.429 -5.537 1.00 . A A . 7 PHE H 1 1 2 451 1 1 7 PHE HA H -2.199 3.168 -4.979 1.00 . A A . 7 PHE HA 1 1 2 452 1 1 7 PHE HB2 H -3.171 1.191 -3.964 1.00 . A A . 7 PHE HB2 1 1 2 453 1 1 7 PHE HB3 H -1.651 0.763 -3.226 1.00 . A A . 7 PHE HB3 1 1 2 454 1 1 7 PHE HD1 H -4.607 1.426 -2.466 1.00 . A A . 7 PHE HD1 1 1 2 455 1 1 7 PHE HD2 H -0.848 3.294 -2.342 1.00 . A A . 7 PHE HD2 1 1 2 456 1 1 7 PHE HE1 H -5.049 2.289 -0.278 1.00 . A A . 7 PHE HE1 1 1 2 457 1 1 7 PHE HE2 H -1.122 4.192 -0.339 1.00 . A A . 7 PHE HE2 1 1 2 458 1 1 7 PHE HZ H -3.370 3.784 0.900 1.00 . A A . 7 PHE HZ 1 1 2 459 1 1 7 PHE N N -1.869 1.406 -5.878 1.00 . A A . 7 PHE N 1 1 2 460 1 1 7 PHE O O 0.049 3.650 -4.229 1.00 . A A . 7 PHE O 1 1 2 461 1 1 8 PHE C C 2.226 1.535 -3.531 1.00 . A A . 8 PHE C 1 1 2 462 1 1 8 PHE CA C 1.175 1.694 -2.701 1.00 . A A . 8 PHE CA 1 1 2 463 1 1 8 PHE CB C 1.558 0.620 -1.742 1.00 . A A . 8 PHE CB 1 1 2 464 1 1 8 PHE CD1 C 2.053 -1.466 -2.360 1.00 . A A . 8 PHE CD1 1 1 2 465 1 1 8 PHE CD2 C -0.157 -0.887 -2.041 1.00 . A A . 8 PHE CD2 1 1 2 466 1 1 8 PHE CE1 C 1.750 -2.636 -2.729 1.00 . A A . 8 PHE CE1 1 1 2 467 1 1 8 PHE CE2 C -0.498 -2.090 -2.410 1.00 . A A . 8 PHE CE2 1 1 2 468 1 1 8 PHE CG C 1.099 -0.603 -2.022 1.00 . A A . 8 PHE CG 1 1 2 469 1 1 8 PHE CZ C 0.461 -2.977 -2.765 1.00 . A A . 8 PHE CZ 1 1 2 470 1 1 8 PHE H H -0.192 0.577 -3.693 1.00 . A A . 8 PHE H 1 1 2 471 1 1 8 PHE HA H 1.178 2.646 -2.337 1.00 . A A . 8 PHE HA 1 1 2 472 1 1 8 PHE HB2 H 2.621 0.528 -1.616 1.00 . A A . 8 PHE HB2 1 1 2 473 1 1 8 PHE HB3 H 1.072 0.851 -0.795 1.00 . A A . 8 PHE HB3 1 1 2 474 1 1 8 PHE HD1 H 3.093 -1.168 -2.328 1.00 . A A . 8 PHE HD1 1 1 2 475 1 1 8 PHE HD2 H -0.885 -0.156 -1.740 1.00 . A A . 8 PHE HD2 1 1 2 476 1 1 8 PHE HE1 H 2.521 -3.277 -3.015 1.00 . A A . 8 PHE HE1 1 1 2 477 1 1 8 PHE HE2 H -1.503 -2.325 -2.470 1.00 . A A . 8 PHE HE2 1 1 2 478 1 1 8 PHE HZ H 0.203 -3.904 -3.064 1.00 . A A . 8 PHE HZ 1 1 2 479 1 1 8 PHE N N 0.140 1.492 -3.599 1.00 . A A . 8 PHE N 1 1 2 480 1 1 8 PHE O O 3.139 2.209 -3.485 1.00 . A A . 8 PHE O 1 1 2 481 1 1 9 ARG C C 2.921 1.381 -6.218 1.00 . A A . 9 ARG C 1 1 2 482 1 1 9 ARG CA C 2.907 0.256 -5.332 1.00 . A A . 9 ARG CA 1 1 2 483 1 1 9 ARG CB C 2.446 -0.961 -6.062 1.00 . A A . 9 ARG CB 1 1 2 484 1 1 9 ARG CD C 4.415 -2.536 -6.212 1.00 . A A . 9 ARG CD 1 1 2 485 1 1 9 ARG CG C 3.071 -2.247 -5.551 1.00 . A A . 9 ARG CG 1 1 2 486 1 1 9 ARG CZ C 5.215 -3.270 -8.442 1.00 . A A . 9 ARG CZ 1 1 2 487 1 1 9 ARG H H 1.143 0.141 -4.411 1.00 . A A . 9 ARG H 1 1 2 488 1 1 9 ARG HA H 3.816 0.148 -4.865 1.00 . A A . 9 ARG HA 1 1 2 489 1 1 9 ARG HB2 H 1.338 -1.008 -5.879 1.00 . A A . 9 ARG HB2 1 1 2 490 1 1 9 ARG HB3 H 2.630 -0.834 -7.143 1.00 . A A . 9 ARG HB3 1 1 2 491 1 1 9 ARG HD2 H 5.023 -1.607 -6.269 1.00 . A A . 9 ARG HD2 1 1 2 492 1 1 9 ARG HD3 H 4.969 -3.319 -5.655 1.00 . A A . 9 ARG HD3 1 1 2 493 1 1 9 ARG HE H 3.230 -3.181 -7.913 1.00 . A A . 9 ARG HE 1 1 2 494 1 1 9 ARG HG2 H 3.226 -2.158 -4.462 1.00 . A A . 9 ARG HG2 1 1 2 495 1 1 9 ARG HG3 H 2.376 -3.092 -5.738 1.00 . A A . 9 ARG HG3 1 1 2 496 1 1 9 ARG HH11 H 6.668 -2.738 -7.091 1.00 . A A . 9 ARG HH11 1 1 2 497 1 1 9 ARG HH12 H 7.262 -3.242 -8.638 1.00 . A A . 9 ARG HH12 1 1 2 498 1 1 9 ARG HH21 H 4.037 -3.866 -10.017 1.00 . A A . 9 ARG HH21 1 1 2 499 1 1 9 ARG HH22 H 5.740 -3.893 -10.330 1.00 . A A . 9 ARG HH22 1 1 2 500 1 1 9 ARG N N 2.010 0.595 -4.377 1.00 . A A . 9 ARG N 1 1 2 501 1 1 9 ARG NE N 4.168 -3.029 -7.599 1.00 . A A . 9 ARG NE 1 1 2 502 1 1 9 ARG NH1 N 6.496 -3.065 -8.020 1.00 . A A . 9 ARG NH1 1 1 2 503 1 1 9 ARG NH2 N 4.976 -3.716 -9.710 1.00 . A A . 9 ARG NH2 1 1 2 504 1 1 9 ARG O O 3.608 1.410 -7.239 1.00 . A A . 9 ARG O 1 1 2 505 1 1 10 ASP C C 2.043 4.630 -5.848 1.00 . A A . 10 ASP C 1 1 2 506 1 1 10 ASP CA C 1.838 3.383 -6.615 1.00 . A A . 10 ASP CA 1 1 2 507 1 1 10 ASP CB C 0.591 3.341 -7.276 1.00 . A A . 10 ASP CB 1 1 2 508 1 1 10 ASP CG C 0.558 4.038 -8.632 1.00 . A A . 10 ASP CG 1 1 2 509 1 1 10 ASP H H 1.425 2.173 -5.040 1.00 . A A . 10 ASP H 1 1 2 510 1 1 10 ASP HA H 2.602 3.310 -7.274 1.00 . A A . 10 ASP HA 1 1 2 511 1 1 10 ASP HB2 H 0.418 2.256 -7.390 1.00 . A A . 10 ASP HB2 1 1 2 512 1 1 10 ASP HB3 H -0.141 3.773 -6.591 1.00 . A A . 10 ASP HB3 1 1 2 513 1 1 10 ASP N N 1.977 2.256 -5.903 1.00 . A A . 10 ASP N 1 1 2 514 1 1 10 ASP O O 2.012 5.708 -6.445 1.00 . A A . 10 ASP O 1 1 2 515 1 1 10 ASP OD1 O 0.850 3.359 -9.651 1.00 . A A . 10 ASP OD1 1 1 2 516 1 1 10 ASP OD2 O 0.241 5.257 -8.666 1.00 . A A . 10 ASP OD2 1 1 2 517 1 1 11 . C C 2.225 6.034 -2.432 1.00 . A A . 11 DPN C 1 1 2 518 1 1 11 . CA C 2.477 5.876 -3.900 1.00 . A A . 11 DPN CA 1 1 2 519 1 1 11 . CB C 3.932 6.232 -4.125 1.00 . A A . 11 DPN CB 1 1 2 520 1 1 11 . CD1 C 4.610 4.905 -6.045 1.00 . A A . 11 DPN CD1 1 1 2 521 1 1 11 . CD2 C 4.829 4.245 -3.824 1.00 . A A . 11 DPN CD2 1 1 2 522 1 1 11 . CE1 C 4.847 3.648 -6.397 1.00 . A A . 11 DPN CE1 1 1 2 523 1 1 11 . CE2 C 5.134 3.083 -4.160 1.00 . A A . 11 DPN CE2 1 1 2 524 1 1 11 . CG C 4.581 5.160 -4.714 1.00 . A A . 11 DPN CG 1 1 2 525 1 1 11 . CZ C 5.106 2.761 -5.402 1.00 . A A . 11 DPN CZ 1 1 2 526 1 1 11 . H H 2.238 3.702 -3.968 1.00 . A A . 11 DPN H 1 1 2 527 1 1 11 . HA H 1.884 6.561 -4.378 1.00 . A A . 11 DPN HA 1 1 2 528 1 1 11 . HB2 H 4.398 6.330 -3.156 1.00 . A A . 11 DPN HB2 1 1 2 529 1 1 11 . HB3 H 4.039 7.069 -4.758 1.00 . A A . 11 DPN HB3 1 1 2 530 1 1 11 . HD1 H 4.405 5.673 -6.777 1.00 . A A . 11 DPN HD1 1 1 2 531 1 1 11 . HD2 H 4.859 4.510 -2.824 1.00 . A A . 11 DPN HD2 1 1 2 532 1 1 11 . HE1 H 4.845 3.342 -7.429 1.00 . A A . 11 DPN HE1 1 1 2 533 1 1 11 . HE2 H 5.280 2.345 -3.425 1.00 . A A . 11 DPN HE2 1 1 2 534 1 1 11 . HZ H 5.183 1.822 -5.582 1.00 . A A . 11 DPN HZ 1 1 2 535 1 1 11 . N N 2.212 4.580 -4.511 1.00 . A A . 11 DPN N 1 1 2 536 1 1 11 . O O 1.238 6.634 -2.013 1.00 . A A . 11 DPN O 1 1 2 537 1 1 12 ILE C C 4.500 5.047 0.245 1.00 . A A . 12 ILE C 1 1 2 538 1 1 12 ILE CA C 3.189 5.671 -0.215 1.00 . A A . 12 ILE CA 1 1 2 539 1 1 12 ILE CB C 2.029 5.036 0.492 1.00 . A A . 12 ILE CB 1 1 2 540 1 1 12 ILE CD1 C 2.526 3.048 -0.659 1.00 . A A . 12 ILE CD1 1 1 2 541 1 1 12 ILE CG1 C 1.460 3.984 -0.398 1.00 . A A . 12 ILE CG1 1 1 2 542 1 1 12 ILE CG2 C 0.994 6.107 0.863 1.00 . A A . 12 ILE CG2 1 1 2 543 1 1 12 ILE H H 3.820 4.877 -2.004 1.00 . A A . 12 ILE H 1 1 2 544 1 1 12 ILE HA H 3.223 6.687 -0.013 1.00 . A A . 12 ILE HA 1 1 2 545 1 1 12 ILE HB H 2.399 4.541 1.399 1.00 . A A . 12 ILE HB 1 1 2 546 1 1 12 ILE HD11 H 3.381 3.310 -0.071 1.00 . A A . 12 ILE HD11 1 1 2 547 1 1 12 ILE HD12 H 2.816 3.103 -1.745 1.00 . A A . 12 ILE HD12 1 1 2 548 1 1 12 ILE HD13 H 2.226 2.050 -0.383 1.00 . A A . 12 ILE HD13 1 1 2 549 1 1 12 ILE HG12 H 0.613 3.465 0.082 1.00 . A A . 12 ILE HG12 1 1 2 550 1 1 12 ILE HG13 H 1.139 4.413 -1.371 1.00 . A A . 12 ILE HG13 1 1 2 551 1 1 12 ILE HG21 H 0.005 5.851 0.430 1.00 . A A . 12 ILE HG21 1 1 2 552 1 1 12 ILE HG22 H 1.305 7.095 0.467 1.00 . A A . 12 ILE HG22 1 1 2 553 1 1 12 ILE HG23 H 0.889 6.179 1.966 1.00 . A A . 12 ILE HG23 1 1 2 554 1 1 12 ILE N N 3.162 5.503 -1.640 1.00 . A A . 12 ILE N 1 1 2 555 1 1 12 ILE O O 4.855 5.098 1.411 1.00 . A A . 12 ILE O 1 1 2 556 1 1 13 LEU C C 7.578 4.332 -1.110 1.00 . A A . 13 LEU C 1 1 2 557 1 1 13 LEU CA C 6.437 3.645 -0.494 1.00 . A A . 13 LEU CA 1 1 2 558 1 1 13 LEU CB C 6.416 2.321 -1.228 1.00 . A A . 13 LEU CB 1 1 2 559 1 1 13 LEU CD1 C 5.037 0.439 -1.990 1.00 . A A . 13 LEU CD1 1 1 2 560 1 1 13 LEU CD2 C 4.723 1.544 0.340 1.00 . A A . 13 LEU CD2 1 1 2 561 1 1 13 LEU CG C 5.092 1.700 -1.135 1.00 . A A . 13 LEU CG 1 1 2 562 1 1 13 LEU H H 4.831 4.277 -1.659 1.00 . A A . 13 LEU H 1 1 2 563 1 1 13 LEU HA H 6.583 3.505 0.555 1.00 . A A . 13 LEU HA 1 1 2 564 1 1 13 LEU HB2 H 6.622 2.493 -2.301 1.00 . A A . 13 LEU HB2 1 1 2 565 1 1 13 LEU HB3 H 7.169 1.632 -0.816 1.00 . A A . 13 LEU HB3 1 1 2 566 1 1 13 LEU HD11 H 4.463 0.656 -2.933 1.00 . A A . 13 LEU HD11 1 1 2 567 1 1 13 LEU HD12 H 4.549 -0.389 -1.446 1.00 . A A . 13 LEU HD12 1 1 2 568 1 1 13 LEU HD13 H 6.062 0.138 -2.281 1.00 . A A . 13 LEU HD13 1 1 2 569 1 1 13 LEU HD21 H 3.700 1.132 0.443 1.00 . A A . 13 LEU HD21 1 1 2 570 1 1 13 LEU HD22 H 4.753 2.568 0.830 1.00 . A A . 13 LEU HD22 1 1 2 571 1 1 13 LEU HD23 H 5.445 0.884 0.853 1.00 . A A . 13 LEU HD23 1 1 2 572 1 1 13 LEU HG H 4.393 2.424 -1.596 1.00 . A A . 13 LEU HG 1 1 2 573 1 1 13 LEU N N 5.198 4.372 -0.730 1.00 . A A . 13 LEU N 1 1 2 574 1 1 13 LEU O O 8.619 4.506 -0.504 1.00 . A A . 13 LEU O 1 1 2 575 1 1 14 GLN C C 8.653 6.632 -2.442 1.00 . A A . 14 GLN C 1 1 2 576 1 1 14 GLN CA C 8.504 5.340 -3.098 1.00 . A A . 14 GLN CA 1 1 2 577 1 1 14 GLN CB C 8.234 5.648 -4.570 1.00 . A A . 14 GLN CB 1 1 2 578 1 1 14 GLN CD C 8.712 3.276 -4.966 1.00 . A A . 14 GLN CD 1 1 2 579 1 1 14 GLN CG C 7.813 4.429 -5.320 1.00 . A A . 14 GLN CG 1 1 2 580 1 1 14 GLN H H 6.565 4.471 -2.909 1.00 . A A . 14 GLN H 1 1 2 581 1 1 14 GLN HA H 9.397 4.757 -2.972 1.00 . A A . 14 GLN HA 1 1 2 582 1 1 14 GLN HB2 H 7.415 6.394 -4.634 1.00 . A A . 14 GLN HB2 1 1 2 583 1 1 14 GLN HB3 H 9.141 6.073 -5.037 1.00 . A A . 14 GLN HB3 1 1 2 584 1 1 14 GLN HE21 H 7.194 2.558 -3.828 1.00 . A A . 14 GLN HE21 1 1 2 585 1 1 14 GLN HE22 H 8.640 1.588 -3.831 1.00 . A A . 14 GLN HE22 1 1 2 586 1 1 14 GLN HG2 H 6.795 4.190 -5.005 1.00 . A A . 14 GLN HG2 1 1 2 587 1 1 14 GLN HG3 H 7.837 4.610 -6.407 1.00 . A A . 14 GLN HG3 1 1 2 588 1 1 14 GLN N N 7.419 4.677 -2.398 1.00 . A A . 14 GLN N 1 1 2 589 1 1 14 GLN NE2 N 8.140 2.387 -4.140 1.00 . A A . 14 GLN NE2 1 1 2 590 1 1 14 GLN O O 9.685 7.294 -2.514 1.00 . A A . 14 GLN O 1 1 2 591 1 1 14 GLN OE1 O 9.874 3.201 -5.353 1.00 . A A . 14 GLN OE1 1 1 2 592 1 1 15 ARG C C 7.804 7.916 0.338 1.00 . A A . 15 ARG C 1 1 2 593 1 1 15 ARG CA C 7.572 8.241 -1.097 1.00 . A A . 15 ARG CA 1 1 2 594 1 1 15 ARG CB C 6.234 8.995 -1.151 1.00 . A A . 15 ARG CB 1 1 2 595 1 1 15 ARG CD C 3.929 8.618 -2.017 1.00 . A A . 15 ARG CD 1 1 2 596 1 1 15 ARG CG C 5.407 8.640 -2.368 1.00 . A A . 15 ARG CG 1 1 2 597 1 1 15 ARG CZ C 3.263 11.007 -2.254 1.00 . A A . 15 ARG CZ 1 1 2 598 1 1 15 ARG H H 6.744 6.413 -1.717 1.00 . A A . 15 ARG H 1 1 2 599 1 1 15 ARG HA H 8.372 8.822 -1.506 1.00 . A A . 15 ARG HA 1 1 2 600 1 1 15 ARG HB2 H 5.636 8.768 -0.237 1.00 . A A . 15 ARG HB2 1 1 2 601 1 1 15 ARG HB3 H 6.435 10.086 -1.162 1.00 . A A . 15 ARG HB3 1 1 2 602 1 1 15 ARG HD2 H 3.307 8.419 -2.914 1.00 . A A . 15 ARG HD2 1 1 2 603 1 1 15 ARG HD3 H 3.742 7.832 -1.251 1.00 . A A . 15 ARG HD3 1 1 2 604 1 1 15 ARG HE H 3.500 10.058 -0.439 1.00 . A A . 15 ARG HE 1 1 2 605 1 1 15 ARG HG2 H 5.593 9.375 -3.177 1.00 . A A . 15 ARG HG2 1 1 2 606 1 1 15 ARG HG3 H 5.702 7.631 -2.731 1.00 . A A . 15 ARG HG3 1 1 2 607 1 1 15 ARG HH11 H 3.523 9.972 -4.010 1.00 . A A . 15 ARG HH11 1 1 2 608 1 1 15 ARG HH12 H 3.088 11.636 -4.205 1.00 . A A . 15 ARG HH12 1 1 2 609 1 1 15 ARG HH21 H 2.919 12.325 -0.717 1.00 . A A . 15 ARG HH21 1 1 2 610 1 1 15 ARG HH22 H 2.740 12.994 -2.303 1.00 . A A . 15 ARG HH22 1 1 2 611 1 1 15 ARG N N 7.572 7.005 -1.774 1.00 . A A . 15 ARG N 1 1 2 612 1 1 15 ARG NE N 3.544 9.945 -1.437 1.00 . A A . 15 ARG NE 1 1 2 613 1 1 15 ARG NH1 N 3.294 10.860 -3.611 1.00 . A A . 15 ARG NH1 1 1 2 614 1 1 15 ARG NH2 N 2.946 12.216 -1.710 1.00 . A A . 15 ARG NH2 1 1 2 615 1 1 15 ARG O O 8.376 8.703 1.090 1.00 . A A . 15 ARG O 1 1 2 616 1 1 16 LYS C C 6.543 7.176 2.902 1.00 . A A . 16 LYS C 1 1 2 617 1 1 16 LYS CA C 7.373 6.233 2.087 1.00 . A A . 16 LYS CA 1 1 2 618 1 1 16 LYS CB C 8.784 6.227 2.668 1.00 . A A . 16 LYS CB 1 1 2 619 1 1 16 LYS CD C 10.670 5.252 1.282 1.00 . A A . 16 LYS CD 1 1 2 620 1 1 16 LYS CE C 11.931 5.864 1.896 1.00 . A A . 16 LYS CE 1 1 2 621 1 1 16 LYS CG C 9.582 4.971 2.322 1.00 . A A . 16 LYS CG 1 1 2 622 1 1 16 LYS H H 6.894 6.081 0.079 1.00 . A A . 16 LYS H 1 1 2 623 1 1 16 LYS HA H 6.925 5.243 2.095 1.00 . A A . 16 LYS HA 1 1 2 624 1 1 16 LYS HB2 H 9.310 7.112 2.272 1.00 . A A . 16 LYS HB2 1 1 2 625 1 1 16 LYS HB3 H 8.721 6.326 3.767 1.00 . A A . 16 LYS HB3 1 1 2 626 1 1 16 LYS HD2 H 10.937 4.303 0.771 1.00 . A A . 16 LYS HD2 1 1 2 627 1 1 16 LYS HD3 H 10.260 5.949 0.515 1.00 . A A . 16 LYS HD3 1 1 2 628 1 1 16 LYS HE2 H 11.711 6.863 2.327 1.00 . A A . 16 LYS HE2 1 1 2 629 1 1 16 LYS HE3 H 12.340 5.201 2.690 1.00 . A A . 16 LYS HE3 1 1 2 630 1 1 16 LYS HG2 H 10.054 4.572 3.245 1.00 . A A . 16 LYS HG2 1 1 2 631 1 1 16 LYS HG3 H 8.890 4.198 1.925 1.00 . A A . 16 LYS HG3 1 1 2 632 1 1 16 LYS HZ1 H 13.549 6.873 1.084 1.00 . A A . 16 LYS HZ1 1 1 2 633 1 1 16 LYS HZ2 H 12.523 6.161 -0.067 1.00 . A A . 16 LYS HZ2 1 1 2 634 1 1 16 LYS HZ3 H 13.583 5.193 0.840 1.00 . A A . 16 LYS HZ3 1 1 2 635 1 1 16 LYS N N 7.304 6.710 0.730 1.00 . A A . 16 LYS N 1 1 2 636 1 1 16 LYS NZ N 12.974 6.035 0.862 1.00 . A A . 16 LYS NZ 1 1 2 637 1 1 16 LYS O O 6.691 7.300 4.117 1.00 . A A . 16 LYS O 1 1 2 638 1 1 17 LYS C C 5.620 9.941 3.394 1.00 . A A . 17 LYS C 1 1 2 639 1 1 17 LYS CA C 4.761 8.826 2.764 1.00 . A A . 17 LYS CA 1 1 2 640 1 1 17 LYS CB C 3.772 8.279 3.814 1.00 . A A . 17 LYS CB 1 1 2 641 1 1 17 LYS CD C 1.910 9.622 2.723 1.00 . A A . 17 LYS CD 1 1 2 642 1 1 17 LYS CE C 1.529 9.566 1.247 1.00 . A A . 17 LYS CE 1 1 2 643 1 1 17 LYS CG C 2.352 8.256 3.264 1.00 . A A . 17 LYS CG 1 1 2 644 1 1 17 LYS H H 5.499 7.644 1.231 1.00 . A A . 17 LYS H 1 1 2 645 1 1 17 LYS HA H 4.216 9.245 1.930 1.00 . A A . 17 LYS HA 1 1 2 646 1 1 17 LYS HB2 H 4.074 7.248 4.101 1.00 . A A . 17 LYS HB2 1 1 2 647 1 1 17 LYS HB3 H 3.795 8.914 4.724 1.00 . A A . 17 LYS HB3 1 1 2 648 1 1 17 LYS HD2 H 1.042 9.986 3.310 1.00 . A A . 17 LYS HD2 1 1 2 649 1 1 17 LYS HD3 H 2.741 10.348 2.849 1.00 . A A . 17 LYS HD3 1 1 2 650 1 1 17 LYS HE2 H 2.395 9.215 0.637 1.00 . A A . 17 LYS HE2 1 1 2 651 1 1 17 LYS HE3 H 0.666 8.885 1.093 1.00 . A A . 17 LYS HE3 1 1 2 652 1 1 17 LYS HG2 H 2.306 7.512 2.445 1.00 . A A . 17 LYS HG2 1 1 2 653 1 1 17 LYS HG3 H 1.653 7.933 4.066 1.00 . A A . 17 LYS HG3 1 1 2 654 1 1 17 LYS HZ1 H 1.342 10.980 -0.255 1.00 . A A . 17 LYS HZ1 1 1 2 655 1 1 17 LYS HZ2 H 1.687 11.631 1.277 1.00 . A A . 17 LYS HZ2 1 1 2 656 1 1 17 LYS HZ3 H 0.127 11.058 0.929 1.00 . A A . 17 LYS HZ3 1 1 2 657 1 1 17 LYS N N 5.627 7.838 2.195 1.00 . A A . 17 LYS N 1 1 2 658 1 1 17 LYS NZ N 1.144 10.910 0.764 1.00 . A A . 17 LYS NZ 1 1 2 659 1 1 17 LYS O O 5.788 9.942 4.646 1.00 . A A . 17 LYS O 1 1 2 660 1 1 17 LYS OXT O 6.105 10.813 2.623 1.00 . A A . 17 LYS OXT 1 1 3 661 1 1 1 GLU C C -1.509 -7.499 -4.854 1.00 . A A . 1 GLU C 1 1 3 662 1 1 1 GLU CA C -0.910 -8.764 -5.402 1.00 . A A . 1 GLU CA 1 1 3 663 1 1 1 GLU CB C -2.002 -9.540 -6.171 1.00 . A A . 1 GLU CB 1 1 3 664 1 1 1 GLU CD C -1.542 -8.480 -8.396 1.00 . A A . 1 GLU CD 1 1 3 665 1 1 1 GLU CG C -2.614 -8.742 -7.341 1.00 . A A . 1 GLU CG 1 1 3 666 1 1 1 GLU H1 H -0.259 -9.028 -3.440 1.00 . A A . 1 GLU H1 1 1 3 667 1 1 1 GLU H2 H 0.552 -9.995 -4.577 1.00 . A A . 1 GLU H2 1 1 3 668 1 1 1 GLU H3 H -1.031 -10.389 -4.105 1.00 . A A . 1 GLU H3 1 1 3 669 1 1 1 GLU HA H -0.088 -8.518 -6.054 1.00 . A A . 1 GLU HA 1 1 3 670 1 1 1 GLU HB2 H -1.561 -10.483 -6.566 1.00 . A A . 1 GLU HB2 1 1 3 671 1 1 1 GLU HB3 H -2.813 -9.816 -5.464 1.00 . A A . 1 GLU HB3 1 1 3 672 1 1 1 GLU HG2 H -3.445 -9.320 -7.799 1.00 . A A . 1 GLU HG2 1 1 3 673 1 1 1 GLU HG3 H -3.010 -7.771 -6.977 1.00 . A A . 1 GLU HG3 1 1 3 674 1 1 1 GLU N N -0.372 -9.606 -4.298 1.00 . A A . 1 GLU N 1 1 3 675 1 1 1 GLU O O -1.264 -6.411 -5.377 1.00 . A A . 1 GLU O 1 1 3 676 1 1 1 GLU OE1 O -0.520 -9.218 -8.407 1.00 . A A . 1 GLU OE1 1 1 3 677 1 1 1 GLU OE2 O -1.737 -7.538 -9.207 1.00 . A A . 1 GLU OE2 1 1 3 678 1 1 2 MET C C -3.980 -5.932 -4.086 1.00 . A A . 2 MET C 1 1 3 679 1 1 2 MET CA C -2.963 -6.490 -3.156 1.00 . A A . 2 MET CA 1 1 3 680 1 1 2 MET CB C -1.993 -5.371 -2.704 1.00 . A A . 2 MET CB 1 1 3 681 1 1 2 MET CE C -4.127 -5.145 -0.552 1.00 . A A . 2 MET CE 1 1 3 682 1 1 2 MET CG C -1.558 -5.471 -1.230 1.00 . A A . 2 MET CG 1 1 3 683 1 1 2 MET H H -2.519 -8.520 -3.368 1.00 . A A . 2 MET H 1 1 3 684 1 1 2 MET HA H -3.518 -6.839 -2.312 1.00 . A A . 2 MET HA 1 1 3 685 1 1 2 MET HB2 H -1.086 -5.413 -3.338 1.00 . A A . 2 MET HB2 1 1 3 686 1 1 2 MET HB3 H -2.469 -4.375 -2.859 1.00 . A A . 2 MET HB3 1 1 3 687 1 1 2 MET HE1 H -4.401 -4.499 0.307 1.00 . A A . 2 MET HE1 1 1 3 688 1 1 2 MET HE2 H -5.029 -5.714 -0.856 1.00 . A A . 2 MET HE2 1 1 3 689 1 1 2 MET HE3 H -3.839 -4.489 -1.400 1.00 . A A . 2 MET HE3 1 1 3 690 1 1 2 MET HG2 H -0.597 -6.026 -1.185 1.00 . A A . 2 MET HG2 1 1 3 691 1 1 2 MET HG3 H -1.360 -4.437 -0.876 1.00 . A A . 2 MET HG3 1 1 3 692 1 1 2 MET N N -2.326 -7.632 -3.777 1.00 . A A . 2 MET N 1 1 3 693 1 1 2 MET O O -4.242 -6.456 -5.168 1.00 . A A . 2 MET O 1 1 3 694 1 1 2 MET SD S -2.768 -6.261 -0.119 1.00 . A A . 2 MET SD 1 1 3 695 1 1 3 ARG C C -5.380 -2.816 -4.423 1.00 . A A . 3 ARG C 1 1 3 696 1 1 3 ARG CA C -5.644 -4.228 -4.353 1.00 . A A . 3 ARG CA 1 1 3 697 1 1 3 ARG CB C -6.928 -4.343 -3.575 1.00 . A A . 3 ARG CB 1 1 3 698 1 1 3 ARG CD C -7.091 -6.707 -2.764 1.00 . A A . 3 ARG CD 1 1 3 699 1 1 3 ARG CG C -7.628 -5.682 -3.759 1.00 . A A . 3 ARG CG 1 1 3 700 1 1 3 ARG CZ C -7.837 -7.740 -0.634 1.00 . A A . 3 ARG CZ 1 1 3 701 1 1 3 ARG H H -4.333 -4.397 -2.786 1.00 . A A . 3 ARG H 1 1 3 702 1 1 3 ARG HA H -5.699 -4.627 -5.297 1.00 . A A . 3 ARG HA 1 1 3 703 1 1 3 ARG HB2 H -6.646 -4.222 -2.502 1.00 . A A . 3 ARG HB2 1 1 3 704 1 1 3 ARG HB3 H -7.605 -3.511 -3.854 1.00 . A A . 3 ARG HB3 1 1 3 705 1 1 3 ARG HD2 H -6.894 -7.681 -3.262 1.00 . A A . 3 ARG HD2 1 1 3 706 1 1 3 ARG HD3 H -6.156 -6.322 -2.292 1.00 . A A . 3 ARG HD3 1 1 3 707 1 1 3 ARG HE H -8.984 -6.438 -1.736 1.00 . A A . 3 ARG HE 1 1 3 708 1 1 3 ARG HG2 H -8.722 -5.550 -3.611 1.00 . A A . 3 ARG HG2 1 1 3 709 1 1 3 ARG HG3 H -7.458 -6.049 -4.793 1.00 . A A . 3 ARG HG3 1 1 3 710 1 1 3 ARG HH11 H -5.963 -8.270 -1.289 1.00 . A A . 3 ARG HH11 1 1 3 711 1 1 3 ARG HH12 H -6.446 -9.001 0.205 1.00 . A A . 3 ARG HH12 1 1 3 712 1 1 3 ARG HH21 H -9.644 -7.434 0.294 1.00 . A A . 3 ARG HH21 1 1 3 713 1 1 3 ARG HH22 H -8.576 -8.518 1.119 1.00 . A A . 3 ARG HH22 1 1 3 714 1 1 3 ARG N N -4.591 -4.837 -3.635 1.00 . A A . 3 ARG N 1 1 3 715 1 1 3 ARG NE N -8.105 -6.911 -1.688 1.00 . A A . 3 ARG NE 1 1 3 716 1 1 3 ARG NH1 N -6.642 -8.396 -0.566 1.00 . A A . 3 ARG NH1 1 1 3 717 1 1 3 ARG NH2 N -8.768 -7.912 0.347 1.00 . A A . 3 ARG NH2 1 1 3 718 1 1 3 ARG O O -5.825 -2.102 -5.319 1.00 . A A . 3 ARG O 1 1 3 719 1 1 4 LEU C C -3.422 -0.801 -4.392 1.00 . A A . 4 LEU C 1 1 3 720 1 1 4 LEU CA C -4.336 -1.047 -3.300 1.00 . A A . 4 LEU CA 1 1 3 721 1 1 4 LEU CB C -3.572 -0.762 -2.033 1.00 . A A . 4 LEU CB 1 1 3 722 1 1 4 LEU CD1 C -2.594 -1.684 0.011 1.00 . A A . 4 LEU CD1 1 1 3 723 1 1 4 LEU CD2 C -5.085 -2.065 -0.517 1.00 . A A . 4 LEU CD2 1 1 3 724 1 1 4 LEU CG C -3.663 -1.877 -1.049 1.00 . A A . 4 LEU CG 1 1 3 725 1 1 4 LEU H H -4.269 -3.009 -2.749 1.00 . A A . 4 LEU H 1 1 3 726 1 1 4 LEU HA H -5.162 -0.440 -3.391 1.00 . A A . 4 LEU HA 1 1 3 727 1 1 4 LEU HB2 H -2.528 -0.567 -2.265 1.00 . A A . 4 LEU HB2 1 1 3 728 1 1 4 LEU HB3 H -3.992 0.128 -1.552 1.00 . A A . 4 LEU HB3 1 1 3 729 1 1 4 LEU HD11 H -1.843 -2.504 -0.069 1.00 . A A . 4 LEU HD11 1 1 3 730 1 1 4 LEU HD12 H -3.031 -1.675 1.029 1.00 . A A . 4 LEU HD12 1 1 3 731 1 1 4 LEU HD13 H -2.064 -0.717 -0.179 1.00 . A A . 4 LEU HD13 1 1 3 732 1 1 4 LEU HD21 H -5.066 -2.474 0.513 1.00 . A A . 4 LEU HD21 1 1 3 733 1 1 4 LEU HD22 H -5.640 -2.778 -1.181 1.00 . A A . 4 LEU HD22 1 1 3 734 1 1 4 LEU HD23 H -5.622 -1.093 -0.513 1.00 . A A . 4 LEU HD23 1 1 3 735 1 1 4 LEU HG H -3.384 -2.780 -1.604 1.00 . A A . 4 LEU HG 1 1 3 736 1 1 4 LEU N N -4.649 -2.392 -3.432 1.00 . A A . 4 LEU N 1 1 3 737 1 1 4 LEU O O -3.784 -0.097 -5.307 1.00 . A A . 4 LEU O 1 1 3 738 1 1 5 SER C C -1.115 -1.136 -6.472 1.00 . A A . 5 SER C 1 1 3 739 1 1 5 SER CA C -1.182 -1.786 -5.113 1.00 . A A . 5 SER CA 1 1 3 740 1 1 5 SER CB C -0.761 -3.217 -5.135 1.00 . A A . 5 SER CB 1 1 3 741 1 1 5 SER H H -2.497 -2.418 -3.689 1.00 . A A . 5 SER H 1 1 3 742 1 1 5 SER HA H -0.474 -1.254 -4.488 1.00 . A A . 5 SER HA 1 1 3 743 1 1 5 SER HB2 H 0.318 -3.260 -4.900 1.00 . A A . 5 SER HB2 1 1 3 744 1 1 5 SER HB3 H -1.343 -3.724 -4.315 1.00 . A A . 5 SER HB3 1 1 3 745 1 1 5 SER HG H -1.113 -4.803 -6.179 1.00 . A A . 5 SER HG 1 1 3 746 1 1 5 SER N N -2.427 -1.704 -4.364 1.00 . A A . 5 SER N 1 1 3 747 1 1 5 SER O O -0.082 -1.110 -7.125 1.00 . A A . 5 SER O 1 1 3 748 1 1 5 SER OG O -1.029 -3.860 -6.378 1.00 . A A . 5 SER OG 1 1 3 749 1 1 6 LYS C C -1.897 1.531 -7.232 1.00 . A A . 6 LYS C 1 1 3 750 1 1 6 LYS CA C -2.199 0.257 -8.020 1.00 . A A . 6 LYS CA 1 1 3 751 1 1 6 LYS CB C -3.547 0.416 -8.725 1.00 . A A . 6 LYS CB 1 1 3 752 1 1 6 LYS CD C -5.410 -0.743 -9.989 1.00 . A A . 6 LYS CD 1 1 3 753 1 1 6 LYS CE C -5.904 -2.035 -10.644 1.00 . A A . 6 LYS CE 1 1 3 754 1 1 6 LYS CG C -4.010 -0.875 -9.397 1.00 . A A . 6 LYS CG 1 1 3 755 1 1 6 LYS H H -3.109 -0.802 -6.521 1.00 . A A . 6 LYS H 1 1 3 756 1 1 6 LYS HA H -1.388 0.013 -8.694 1.00 . A A . 6 LYS HA 1 1 3 757 1 1 6 LYS HB2 H -4.308 0.740 -7.982 1.00 . A A . 6 LYS HB2 1 1 3 758 1 1 6 LYS HB3 H -3.453 1.212 -9.495 1.00 . A A . 6 LYS HB3 1 1 3 759 1 1 6 LYS HD2 H -6.110 -0.460 -9.175 1.00 . A A . 6 LYS HD2 1 1 3 760 1 1 6 LYS HD3 H -5.410 0.073 -10.742 1.00 . A A . 6 LYS HD3 1 1 3 761 1 1 6 LYS HE2 H -5.832 -2.885 -9.931 1.00 . A A . 6 LYS HE2 1 1 3 762 1 1 6 LYS HE3 H -6.957 -1.924 -10.980 1.00 . A A . 6 LYS HE3 1 1 3 763 1 1 6 LYS HG2 H -3.295 -1.143 -10.204 1.00 . A A . 6 LYS HG2 1 1 3 764 1 1 6 LYS HG3 H -4.006 -1.698 -8.649 1.00 . A A . 6 LYS HG3 1 1 3 765 1 1 6 LYS HZ1 H -5.697 -2.533 -12.645 1.00 . A A . 6 LYS HZ1 1 1 3 766 1 1 6 LYS HZ2 H -4.520 -3.219 -11.633 1.00 . A A . 6 LYS HZ2 1 1 3 767 1 1 6 LYS HZ3 H -4.439 -1.571 -12.034 1.00 . A A . 6 LYS HZ3 1 1 3 768 1 1 6 LYS N N -2.213 -0.630 -6.935 1.00 . A A . 6 LYS N 1 1 3 769 1 1 6 LYS NZ N -5.079 -2.364 -11.826 1.00 . A A . 6 LYS NZ 1 1 3 770 1 1 6 LYS O O -1.872 2.638 -7.757 1.00 . A A . 6 LYS O 1 1 3 771 1 1 7 PHE C C -0.324 2.496 -4.265 1.00 . A A . 7 PHE C 1 1 3 772 1 1 7 PHE CA C -1.592 2.236 -4.840 1.00 . A A . 7 PHE CA 1 1 3 773 1 1 7 PHE CB C -2.223 1.652 -3.607 1.00 . A A . 7 PHE CB 1 1 3 774 1 1 7 PHE CD1 C -3.875 2.252 -2.006 1.00 . A A . 7 PHE CD1 1 1 3 775 1 1 7 PHE CD2 C -1.747 3.227 -1.963 1.00 . A A . 7 PHE CD2 1 1 3 776 1 1 7 PHE CE1 C -4.136 2.830 -0.827 1.00 . A A . 7 PHE CE1 1 1 3 777 1 1 7 PHE CE2 C -1.945 3.833 -0.855 1.00 . A A . 7 PHE CE2 1 1 3 778 1 1 7 PHE CG C -2.700 2.460 -2.566 1.00 . A A . 7 PHE CG 1 1 3 779 1 1 7 PHE CZ C -3.168 3.656 -0.210 1.00 . A A . 7 PHE CZ 1 1 3 780 1 1 7 PHE H H -1.748 0.351 -5.452 1.00 . A A . 7 PHE H 1 1 3 781 1 1 7 PHE HA H -2.104 3.127 -5.068 1.00 . A A . 7 PHE HA 1 1 3 782 1 1 7 PHE HB2 H -3.153 1.245 -3.957 1.00 . A A . 7 PHE HB2 1 1 3 783 1 1 7 PHE HB3 H -1.660 0.818 -3.163 1.00 . A A . 7 PHE HB3 1 1 3 784 1 1 7 PHE HD1 H -4.606 1.605 -2.502 1.00 . A A . 7 PHE HD1 1 1 3 785 1 1 7 PHE HD2 H -0.801 3.381 -2.417 1.00 . A A . 7 PHE HD2 1 1 3 786 1 1 7 PHE HE1 H -5.062 2.606 -0.379 1.00 . A A . 7 PHE HE1 1 1 3 787 1 1 7 PHE HE2 H -1.088 4.404 -0.476 1.00 . A A . 7 PHE HE2 1 1 3 788 1 1 7 PHE HZ H -3.367 4.127 0.740 1.00 . A A . 7 PHE HZ 1 1 3 789 1 1 7 PHE N N -1.810 1.307 -5.853 1.00 . A A . 7 PHE N 1 1 3 790 1 1 7 PHE O O 0.142 3.593 -4.300 1.00 . A A . 7 PHE O 1 1 3 791 1 1 8 PHE C C 2.241 1.466 -3.435 1.00 . A A . 8 PHE C 1 1 3 792 1 1 8 PHE CA C 1.180 1.699 -2.637 1.00 . A A . 8 PHE CA 1 1 3 793 1 1 8 PHE CB C 1.517 0.671 -1.612 1.00 . A A . 8 PHE CB 1 1 3 794 1 1 8 PHE CD1 C 1.964 -1.460 -2.099 1.00 . A A . 8 PHE CD1 1 1 3 795 1 1 8 PHE CD2 C -0.234 -0.802 -1.855 1.00 . A A . 8 PHE CD2 1 1 3 796 1 1 8 PHE CE1 C 1.631 -2.642 -2.405 1.00 . A A . 8 PHE CE1 1 1 3 797 1 1 8 PHE CE2 C -0.604 -2.012 -2.161 1.00 . A A . 8 PHE CE2 1 1 3 798 1 1 8 PHE CG C 1.029 -0.553 -1.829 1.00 . A A . 8 PHE CG 1 1 3 799 1 1 8 PHE CZ C 0.334 -2.947 -2.447 1.00 . A A . 8 PHE CZ 1 1 3 800 1 1 8 PHE H H -0.198 0.565 -3.590 1.00 . A A . 8 PHE H 1 1 3 801 1 1 8 PHE HA H 1.202 2.670 -2.326 1.00 . A A . 8 PHE HA 1 1 3 802 1 1 8 PHE HB2 H 2.576 0.558 -1.459 1.00 . A A . 8 PHE HB2 1 1 3 803 1 1 8 PHE HB3 H 1.020 0.967 -0.688 1.00 . A A . 8 PHE HB3 1 1 3 804 1 1 8 PHE HD1 H 3.012 -1.190 -2.063 1.00 . A A . 8 PHE HD1 1 1 3 805 1 1 8 PHE HD2 H -0.944 -0.035 -1.612 1.00 . A A . 8 PHE HD2 1 1 3 806 1 1 8 PHE HE1 H 2.389 -3.320 -2.639 1.00 . A A . 8 PHE HE1 1 1 3 807 1 1 8 PHE HE2 H -1.614 -2.222 -2.225 1.00 . A A . 8 PHE HE2 1 1 3 808 1 1 8 PHE HZ H 0.052 -3.882 -2.696 1.00 . A A . 8 PHE HZ 1 1 3 809 1 1 8 PHE N N 0.157 1.474 -3.542 1.00 . A A . 8 PHE N 1 1 3 810 1 1 8 PHE O O 3.168 2.124 -3.412 1.00 . A A . 8 PHE O 1 1 3 811 1 1 9 ARG C C 2.979 1.133 -6.097 1.00 . A A . 9 ARG C 1 1 3 812 1 1 9 ARG CA C 2.918 0.065 -5.148 1.00 . A A . 9 ARG CA 1 1 3 813 1 1 9 ARG CB C 2.439 -1.183 -5.809 1.00 . A A . 9 ARG CB 1 1 3 814 1 1 9 ARG CD C 4.380 -2.799 -5.825 1.00 . A A . 9 ARG CD 1 1 3 815 1 1 9 ARG CG C 3.027 -2.451 -5.214 1.00 . A A . 9 ARG CG 1 1 3 816 1 1 9 ARG CZ C 5.219 -3.649 -8.000 1.00 . A A . 9 ARG CZ 1 1 3 817 1 1 9 ARG H H 1.134 0.058 -4.260 1.00 . A A . 9 ARG H 1 1 3 818 1 1 9 ARG HA H 3.815 -0.039 -4.657 1.00 . A A . 9 ARG HA 1 1 3 819 1 1 9 ARG HB2 H 1.329 -1.194 -5.640 1.00 . A A . 9 ARG HB2 1 1 3 820 1 1 9 ARG HB3 H 2.640 -1.125 -6.894 1.00 . A A . 9 ARG HB3 1 1 3 821 1 1 9 ARG HD2 H 5.011 -1.887 -5.912 1.00 . A A . 9 ARG HD2 1 1 3 822 1 1 9 ARG HD3 H 4.904 -3.565 -5.218 1.00 . A A . 9 ARG HD3 1 1 3 823 1 1 9 ARG HE H 3.224 -3.508 -7.520 1.00 . A A . 9 ARG HE 1 1 3 824 1 1 9 ARG HG2 H 3.157 -2.305 -4.129 1.00 . A A . 9 ARG HG2 1 1 3 825 1 1 9 ARG HG3 H 2.320 -3.291 -5.373 1.00 . A A . 9 ARG HG3 1 1 3 826 1 1 9 ARG HH11 H 6.649 -3.075 -6.642 1.00 . A A . 9 ARG HH11 1 1 3 827 1 1 9 ARG HH12 H 7.270 -3.659 -8.149 1.00 . A A . 9 ARG HH12 1 1 3 828 1 1 9 ARG HH21 H 4.067 -4.303 -9.571 1.00 . A A . 9 ARG HH21 1 1 3 829 1 1 9 ARG HH22 H 5.776 -4.368 -9.843 1.00 . A A . 9 ARG HH22 1 1 3 830 1 1 9 ARG N N 2.015 0.484 -4.232 1.00 . A A . 9 ARG N 1 1 3 831 1 1 9 ARG NE N 4.157 -3.354 -7.193 1.00 . A A . 9 ARG NE 1 1 3 832 1 1 9 ARG NH1 N 6.494 -3.443 -7.558 1.00 . A A . 9 ARG NH1 1 1 3 833 1 1 9 ARG NH2 N 5.002 -4.152 -9.249 1.00 . A A . 9 ARG NH2 1 1 3 834 1 1 9 ARG O O 3.686 1.083 -7.104 1.00 . A A . 9 ARG O 1 1 3 835 1 1 10 ASP C C 2.194 4.418 -5.935 1.00 . A A . 10 ASP C 1 1 3 836 1 1 10 ASP CA C 1.967 3.137 -6.633 1.00 . A A . 10 ASP CA 1 1 3 837 1 1 10 ASP CB C 0.736 3.106 -7.319 1.00 . A A . 10 ASP CB 1 1 3 838 1 1 10 ASP CG C 0.738 3.830 -8.662 1.00 . A A . 10 ASP CG 1 1 3 839 1 1 10 ASP H H 1.484 2.035 -4.999 1.00 . A A . 10 ASP H 1 1 3 840 1 1 10 ASP HA H 2.740 3.002 -7.271 1.00 . A A . 10 ASP HA 1 1 3 841 1 1 10 ASP HB2 H 0.559 2.025 -7.450 1.00 . A A . 10 ASP HB2 1 1 3 842 1 1 10 ASP HB3 H -0.006 3.532 -6.642 1.00 . A A . 10 ASP HB3 1 1 3 843 1 1 10 ASP N N 2.055 2.050 -5.854 1.00 . A A . 10 ASP N 1 1 3 844 1 1 10 ASP O O 2.201 5.460 -6.593 1.00 . A A . 10 ASP O 1 1 3 845 1 1 10 ASP OD1 O 1.592 3.482 -9.519 1.00 . A A . 10 ASP OD1 1 1 3 846 1 1 10 ASP OD2 O -0.111 4.743 -8.845 1.00 . A A . 10 ASP OD2 1 1 3 847 1 1 11 . C C 2.360 6.006 -2.600 1.00 . A A . 11 DPN C 1 1 3 848 1 1 11 . CA C 2.632 5.757 -4.053 1.00 . A A . 11 DPN CA 1 1 3 849 1 1 11 . CB C 4.099 6.057 -4.270 1.00 . A A . 11 DPN CB 1 1 3 850 1 1 11 . CD1 C 4.774 4.611 -6.102 1.00 . A A . 11 DPN CD1 1 1 3 851 1 1 11 . CD2 C 4.925 4.067 -3.845 1.00 . A A . 11 DPN CD2 1 1 3 852 1 1 11 . CE1 C 4.983 3.329 -6.378 1.00 . A A . 11 DPN CE1 1 1 3 853 1 1 11 . CE2 C 5.202 2.883 -4.108 1.00 . A A . 11 DPN CE2 1 1 3 854 1 1 11 . CG C 4.725 4.938 -4.786 1.00 . A A . 11 DPN CG 1 1 3 855 1 1 11 . CZ C 5.193 2.495 -5.328 1.00 . A A . 11 DPN CZ 1 1 3 856 1 1 11 . H H 2.326 3.594 -4.001 1.00 . A A . 11 DPN H 1 1 3 857 1 1 11 . HA H 2.066 6.432 -4.580 1.00 . A A . 11 DPN HA 1 1 3 858 1 1 11 . HB2 H 4.552 6.195 -3.296 1.00 . A A . 11 DPN HB2 1 1 3 859 1 1 11 . HB3 H 4.242 6.855 -4.945 1.00 . A A . 11 DPN HB3 1 1 3 860 1 1 11 . HD1 H 4.608 5.343 -6.879 1.00 . A A . 11 DPN HD1 1 1 3 861 1 1 11 . HD2 H 4.940 4.386 -2.861 1.00 . A A . 11 DPN HD2 1 1 3 862 1 1 11 . HE1 H 4.994 2.966 -7.391 1.00 . A A . 11 DPN HE1 1 1 3 863 1 1 11 . HE2 H 5.310 2.186 -3.331 1.00 . A A . 11 DPN HE2 1 1 3 864 1 1 11 . HZ H 5.246 1.547 -5.451 1.00 . A A . 11 DPN HZ 1 1 3 865 1 1 11 . N N 2.337 4.440 -4.594 1.00 . A A . 11 DPN N 1 1 3 866 1 1 11 . O O 1.379 6.652 -2.238 1.00 . A A . 11 DPN O 1 1 3 867 1 1 12 ILE C C 4.538 5.079 0.176 1.00 . A A . 12 ILE C 1 1 3 868 1 1 12 ILE CA C 3.278 5.752 -0.346 1.00 . A A . 12 ILE CA 1 1 3 869 1 1 12 ILE CB C 2.086 5.224 0.381 1.00 . A A . 12 ILE CB 1 1 3 870 1 1 12 ILE CD1 C 2.512 3.142 -0.646 1.00 . A A . 12 ILE CD1 1 1 3 871 1 1 12 ILE CG1 C 1.480 4.142 -0.455 1.00 . A A . 12 ILE CG1 1 1 3 872 1 1 12 ILE CG2 C 1.114 6.375 0.692 1.00 . A A . 12 ILE CG2 1 1 3 873 1 1 12 ILE H H 3.900 4.823 -2.059 1.00 . A A . 12 ILE H 1 1 3 874 1 1 12 ILE HA H 3.370 6.776 -0.210 1.00 . A A . 12 ILE HA 1 1 3 875 1 1 12 ILE HB H 2.425 4.763 1.318 1.00 . A A . 12 ILE HB 1 1 3 876 1 1 12 ILE HD11 H 2.831 3.132 -1.730 1.00 . A A . 12 ILE HD11 1 1 3 877 1 1 12 ILE HD12 H 2.163 2.177 -0.327 1.00 . A A . 12 ILE HD12 1 1 3 878 1 1 12 ILE HD13 H 3.364 3.384 -0.052 1.00 . A A . 12 ILE HD13 1 1 3 879 1 1 12 ILE HG12 H 0.606 3.688 0.042 1.00 . A A . 12 ILE HG12 1 1 3 880 1 1 12 ILE HG13 H 1.191 4.522 -1.456 1.00 . A A . 12 ILE HG13 1 1 3 881 1 1 12 ILE HG21 H 1.336 7.254 0.049 1.00 . A A . 12 ILE HG21 1 1 3 882 1 1 12 ILE HG22 H 1.203 6.681 1.756 1.00 . A A . 12 ILE HG22 1 1 3 883 1 1 12 ILE HG23 H 0.066 6.057 0.501 1.00 . A A . 12 ILE HG23 1 1 3 884 1 1 12 ILE N N 3.266 5.497 -1.755 1.00 . A A . 12 ILE N 1 1 3 885 1 1 12 ILE O O 4.805 5.066 1.364 1.00 . A A . 12 ILE O 1 1 3 886 1 1 13 LEU C C 7.623 4.276 -1.080 1.00 . A A . 13 LEU C 1 1 3 887 1 1 13 LEU CA C 6.460 3.629 -0.454 1.00 . A A . 13 LEU CA 1 1 3 888 1 1 13 LEU CB C 6.413 2.271 -1.122 1.00 . A A . 13 LEU CB 1 1 3 889 1 1 13 LEU CD1 C 4.997 0.382 -1.809 1.00 . A A . 13 LEU CD1 1 1 3 890 1 1 13 LEU CD2 C 4.662 1.614 0.447 1.00 . A A . 13 LEU CD2 1 1 3 891 1 1 13 LEU CG C 5.067 1.688 -1.023 1.00 . A A . 13 LEU CG 1 1 3 892 1 1 13 LEU H H 4.921 4.273 -1.697 1.00 . A A . 13 LEU H 1 1 3 893 1 1 13 LEU HA H 6.579 3.543 0.604 1.00 . A A . 13 LEU HA 1 1 3 894 1 1 13 LEU HB2 H 6.644 2.383 -2.197 1.00 . A A . 13 LEU HB2 1 1 3 895 1 1 13 LEU HB3 H 7.139 1.583 -0.660 1.00 . A A . 13 LEU HB3 1 1 3 896 1 1 13 LEU HD11 H 4.424 0.554 -2.761 1.00 . A A . 13 LEU HD11 1 1 3 897 1 1 13 LEU HD12 H 4.501 -0.410 -1.221 1.00 . A A . 13 LEU HD12 1 1 3 898 1 1 13 LEU HD13 H 6.019 0.057 -2.084 1.00 . A A . 13 LEU HD13 1 1 3 899 1 1 13 LEU HD21 H 3.626 1.235 0.545 1.00 . A A . 13 LEU HD21 1 1 3 900 1 1 13 LEU HD22 H 4.710 2.658 0.885 1.00 . A A . 13 LEU HD22 1 1 3 901 1 1 13 LEU HD23 H 5.353 0.959 1.009 1.00 . A A . 13 LEU HD23 1 1 3 902 1 1 13 LEU HG H 4.392 2.404 -1.532 1.00 . A A . 13 LEU HG 1 1 3 903 1 1 13 LEU N N 5.256 4.380 -0.758 1.00 . A A . 13 LEU N 1 1 3 904 1 1 13 LEU O O 8.655 4.483 -0.465 1.00 . A A . 13 LEU O 1 1 3 905 1 1 14 GLN C C 8.715 6.517 -2.501 1.00 . A A . 14 GLN C 1 1 3 906 1 1 14 GLN CA C 8.581 5.190 -3.091 1.00 . A A . 14 GLN CA 1 1 3 907 1 1 14 GLN CB C 8.336 5.414 -4.580 1.00 . A A . 14 GLN CB 1 1 3 908 1 1 14 GLN CD C 8.819 3.023 -4.831 1.00 . A A . 14 GLN CD 1 1 3 909 1 1 14 GLN CG C 7.930 4.154 -5.268 1.00 . A A . 14 GLN CG 1 1 3 910 1 1 14 GLN H H 6.639 4.335 -2.896 1.00 . A A . 14 GLN H 1 1 3 911 1 1 14 GLN HA H 9.473 4.617 -2.917 1.00 . A A . 14 GLN HA 1 1 3 912 1 1 14 GLN HB2 H 7.516 6.153 -4.698 1.00 . A A . 14 GLN HB2 1 1 3 913 1 1 14 GLN HB3 H 9.249 5.816 -5.055 1.00 . A A . 14 GLN HB3 1 1 3 914 1 1 14 GLN HE21 H 7.272 2.370 -3.691 1.00 . A A . 14 GLN HE21 1 1 3 915 1 1 14 GLN HE22 H 8.717 1.400 -3.606 1.00 . A A . 14 GLN HE22 1 1 3 916 1 1 14 GLN HG2 H 6.905 3.933 -4.960 1.00 . A A . 14 GLN HG2 1 1 3 917 1 1 14 GLN HG3 H 7.976 4.273 -6.363 1.00 . A A . 14 GLN HG3 1 1 3 918 1 1 14 GLN N N 7.485 4.563 -2.379 1.00 . A A . 14 GLN N 1 1 3 919 1 1 14 GLN NE2 N 8.226 2.181 -3.971 1.00 . A A . 14 GLN NE2 1 1 3 920 1 1 14 GLN O O 9.746 7.179 -2.597 1.00 . A A . 14 GLN O 1 1 3 921 1 1 14 GLN OE1 O 9.988 2.926 -5.185 1.00 . A A . 14 GLN OE1 1 1 3 922 1 1 15 ARG C C 7.750 7.956 0.208 1.00 . A A . 15 ARG C 1 1 3 923 1 1 15 ARG CA C 7.615 8.203 -1.259 1.00 . A A . 15 ARG CA 1 1 3 924 1 1 15 ARG CB C 6.310 8.978 -1.451 1.00 . A A . 15 ARG CB 1 1 3 925 1 1 15 ARG CD C 4.058 8.584 -2.458 1.00 . A A . 15 ARG CD 1 1 3 926 1 1 15 ARG CG C 5.557 8.566 -2.704 1.00 . A A . 15 ARG CG 1 1 3 927 1 1 15 ARG CZ C 2.327 10.332 -2.051 1.00 . A A . 15 ARG CZ 1 1 3 928 1 1 15 ARG H H 6.792 6.341 -1.785 1.00 . A A . 15 ARG H 1 1 3 929 1 1 15 ARG HA H 8.455 8.736 -1.649 1.00 . A A . 15 ARG HA 1 1 3 930 1 1 15 ARG HB2 H 5.653 8.821 -0.570 1.00 . A A . 15 ARG HB2 1 1 3 931 1 1 15 ARG HB3 H 6.540 10.062 -1.515 1.00 . A A . 15 ARG HB3 1 1 3 932 1 1 15 ARG HD2 H 3.507 8.236 -3.354 1.00 . A A . 15 ARG HD2 1 1 3 933 1 1 15 ARG HD3 H 3.809 7.930 -1.583 1.00 . A A . 15 ARG HD3 1 1 3 934 1 1 15 ARG HE H 4.351 10.689 -2.011 1.00 . A A . 15 ARG HE 1 1 3 935 1 1 15 ARG HG2 H 5.810 9.251 -3.538 1.00 . A A . 15 ARG HG2 1 1 3 936 1 1 15 ARG HG3 H 5.858 7.534 -2.992 1.00 . A A . 15 ARG HG3 1 1 3 937 1 1 15 ARG HH11 H 1.605 8.439 -2.403 1.00 . A A . 15 ARG HH11 1 1 3 938 1 1 15 ARG HH12 H 0.392 9.648 -2.140 1.00 . A A . 15 ARG HH12 1 1 3 939 1 1 15 ARG HH21 H 2.695 12.314 -1.651 1.00 . A A . 15 ARG HH21 1 1 3 940 1 1 15 ARG HH22 H 1.020 11.881 -1.705 1.00 . A A . 15 ARG HH22 1 1 3 941 1 1 15 ARG N N 7.623 6.927 -1.865 1.00 . A A . 15 ARG N 1 1 3 942 1 1 15 ARG NE N 3.648 9.990 -2.150 1.00 . A A . 15 ARG NE 1 1 3 943 1 1 15 ARG NH1 N 1.355 9.391 -2.212 1.00 . A A . 15 ARG NH1 1 1 3 944 1 1 15 ARG NH2 N 1.983 11.624 -1.778 1.00 . A A . 15 ARG NH2 1 1 3 945 1 1 15 ARG O O 8.272 8.778 0.955 1.00 . A A . 15 ARG O 1 1 3 946 1 1 16 LYS C C 6.145 7.036 2.740 1.00 . A A . 16 LYS C 1 1 3 947 1 1 16 LYS CA C 7.214 6.321 1.976 1.00 . A A . 16 LYS CA 1 1 3 948 1 1 16 LYS CB C 8.527 6.512 2.723 1.00 . A A . 16 LYS CB 1 1 3 949 1 1 16 LYS CD C 9.462 4.188 2.310 1.00 . A A . 16 LYS CD 1 1 3 950 1 1 16 LYS CE C 10.660 3.361 1.837 1.00 . A A . 16 LYS CE 1 1 3 951 1 1 16 LYS CG C 9.688 5.694 2.153 1.00 . A A . 16 LYS CG 1 1 3 952 1 1 16 LYS H H 6.829 6.140 -0.030 1.00 . A A . 16 LYS H 1 1 3 953 1 1 16 LYS HA H 6.949 5.275 1.926 1.00 . A A . 16 LYS HA 1 1 3 954 1 1 16 LYS HB2 H 8.780 7.583 2.674 1.00 . A A . 16 LYS HB2 1 1 3 955 1 1 16 LYS HB3 H 8.378 6.240 3.783 1.00 . A A . 16 LYS HB3 1 1 3 956 1 1 16 LYS HD2 H 9.260 3.960 3.377 1.00 . A A . 16 LYS HD2 1 1 3 957 1 1 16 LYS HD3 H 8.563 3.897 1.719 1.00 . A A . 16 LYS HD3 1 1 3 958 1 1 16 LYS HE2 H 10.861 3.545 0.761 1.00 . A A . 16 LYS HE2 1 1 3 959 1 1 16 LYS HE3 H 11.566 3.613 2.430 1.00 . A A . 16 LYS HE3 1 1 3 960 1 1 16 LYS HG2 H 9.809 5.935 1.075 1.00 . A A . 16 LYS HG2 1 1 3 961 1 1 16 LYS HG3 H 10.625 5.979 2.677 1.00 . A A . 16 LYS HG3 1 1 3 962 1 1 16 LYS HZ1 H 11.184 1.473 2.510 1.00 . A A . 16 LYS HZ1 1 1 3 963 1 1 16 LYS HZ2 H 10.273 1.474 1.076 1.00 . A A . 16 LYS HZ2 1 1 3 964 1 1 16 LYS HZ3 H 9.518 1.792 2.563 1.00 . A A . 16 LYS HZ3 1 1 3 965 1 1 16 LYS N N 7.223 6.774 0.616 1.00 . A A . 16 LYS N 1 1 3 966 1 1 16 LYS NZ N 10.388 1.917 2.010 1.00 . A A . 16 LYS NZ 1 1 3 967 1 1 16 LYS O O 6.078 6.950 3.967 1.00 . A A . 16 LYS O 1 1 3 968 1 1 17 LYS C C 3.197 8.930 1.656 1.00 . A A . 17 LYS C 1 1 3 969 1 1 17 LYS CA C 4.194 8.430 2.697 1.00 . A A . 17 LYS CA 1 1 3 970 1 1 17 LYS CB C 4.643 9.637 3.548 1.00 . A A . 17 LYS CB 1 1 3 971 1 1 17 LYS CD C 5.482 11.389 1.881 1.00 . A A . 17 LYS CD 1 1 3 972 1 1 17 LYS CE C 6.695 11.844 1.075 1.00 . A A . 17 LYS CE 1 1 3 973 1 1 17 LYS CG C 5.857 10.373 2.968 1.00 . A A . 17 LYS CG 1 1 3 974 1 1 17 LYS H H 5.346 7.848 1.044 1.00 . A A . 17 LYS H 1 1 3 975 1 1 17 LYS HA H 3.702 7.697 3.308 1.00 . A A . 17 LYS HA 1 1 3 976 1 1 17 LYS HB2 H 3.799 10.350 3.640 1.00 . A A . 17 LYS HB2 1 1 3 977 1 1 17 LYS HB3 H 4.901 9.277 4.563 1.00 . A A . 17 LYS HB3 1 1 3 978 1 1 17 LYS HD2 H 4.742 10.932 1.189 1.00 . A A . 17 LYS HD2 1 1 3 979 1 1 17 LYS HD3 H 5.008 12.273 2.357 1.00 . A A . 17 LYS HD3 1 1 3 980 1 1 17 LYS HE2 H 7.468 12.279 1.744 1.00 . A A . 17 LYS HE2 1 1 3 981 1 1 17 LYS HE3 H 7.128 10.987 0.516 1.00 . A A . 17 LYS HE3 1 1 3 982 1 1 17 LYS HG2 H 6.379 10.906 3.789 1.00 . A A . 17 LYS HG2 1 1 3 983 1 1 17 LYS HG3 H 6.565 9.633 2.543 1.00 . A A . 17 LYS HG3 1 1 3 984 1 1 17 LYS HZ1 H 5.964 13.724 0.598 1.00 . A A . 17 LYS HZ1 1 1 3 985 1 1 17 LYS HZ2 H 5.546 12.512 -0.515 1.00 . A A . 17 LYS HZ2 1 1 3 986 1 1 17 LYS HZ3 H 7.126 13.132 -0.489 1.00 . A A . 17 LYS HZ3 1 1 3 987 1 1 17 LYS N N 5.271 7.750 2.027 1.00 . A A . 17 LYS N 1 1 3 988 1 1 17 LYS NZ N 6.304 12.880 0.095 1.00 . A A . 17 LYS NZ 1 1 3 989 1 1 17 LYS O O 3.572 8.995 0.466 1.00 . A A . 17 LYS O 1 1 3 990 1 1 17 LYS OXT O 2.043 9.254 2.047 1.00 . A A . 17 LYS OXT 1 1 4 991 1 1 1 GLU C C -1.764 -8.583 -3.788 1.00 . A A . 1 GLU C 1 1 4 992 1 1 1 GLU CA C -1.041 -9.545 -4.687 1.00 . A A . 1 GLU CA 1 1 4 993 1 1 1 GLU CB C 0.391 -9.017 -4.919 1.00 . A A . 1 GLU CB 1 1 4 994 1 1 1 GLU CD C 1.367 -11.302 -5.182 1.00 . A A . 1 GLU CD 1 1 4 995 1 1 1 GLU CG C 1.233 -9.930 -5.831 1.00 . A A . 1 GLU CG 1 1 4 996 1 1 1 GLU H1 H -2.721 -9.315 -5.897 1.00 . A A . 1 GLU H1 1 1 4 997 1 1 1 GLU H2 H -1.793 -10.692 -6.253 1.00 . A A . 1 GLU H2 1 1 4 998 1 1 1 GLU H3 H -1.244 -9.155 -6.722 1.00 . A A . 1 GLU H3 1 1 4 999 1 1 1 GLU HA H -1.015 -10.516 -4.221 1.00 . A A . 1 GLU HA 1 1 4 1000 1 1 1 GLU HB2 H 0.333 -8.005 -5.376 1.00 . A A . 1 GLU HB2 1 1 4 1001 1 1 1 GLU HB3 H 0.905 -8.919 -3.937 1.00 . A A . 1 GLU HB3 1 1 4 1002 1 1 1 GLU HG2 H 0.740 -10.036 -6.821 1.00 . A A . 1 GLU HG2 1 1 4 1003 1 1 1 GLU HG3 H 2.244 -9.497 -5.975 1.00 . A A . 1 GLU HG3 1 1 4 1004 1 1 1 GLU N N -1.753 -9.687 -5.987 1.00 . A A . 1 GLU N 1 1 4 1005 1 1 1 GLU O O -1.992 -8.868 -2.614 1.00 . A A . 1 GLU O 1 1 4 1006 1 1 1 GLU OE1 O 1.494 -11.358 -3.929 1.00 . A A . 1 GLU OE1 1 1 4 1007 1 1 1 GLU OE2 O 1.345 -12.313 -5.933 1.00 . A A . 1 GLU OE2 1 1 4 1008 1 1 2 MET C C -3.869 -5.800 -4.420 1.00 . A A . 2 MET C 1 1 4 1009 1 1 2 MET CA C -2.842 -6.425 -3.550 1.00 . A A . 2 MET CA 1 1 4 1010 1 1 2 MET CB C -1.931 -5.331 -2.960 1.00 . A A . 2 MET CB 1 1 4 1011 1 1 2 MET CE C -4.150 -5.336 -0.909 1.00 . A A . 2 MET CE 1 1 4 1012 1 1 2 MET CG C -1.541 -5.550 -1.488 1.00 . A A . 2 MET CG 1 1 4 1013 1 1 2 MET H H -1.975 -7.181 -5.290 1.00 . A A . 2 MET H 1 1 4 1014 1 1 2 MET HA H -3.371 -6.924 -2.767 1.00 . A A . 2 MET HA 1 1 4 1015 1 1 2 MET HB2 H -1.003 -5.296 -3.563 1.00 . A A . 2 MET HB2 1 1 4 1016 1 1 2 MET HB3 H -2.431 -4.338 -3.046 1.00 . A A . 2 MET HB3 1 1 4 1017 1 1 2 MET HE1 H -4.594 -4.882 -0.001 1.00 . A A . 2 MET HE1 1 1 4 1018 1 1 2 MET HE2 H -4.951 -5.885 -1.452 1.00 . A A . 2 MET HE2 1 1 4 1019 1 1 2 MET HE3 H -3.796 -4.519 -1.568 1.00 . A A . 2 MET HE3 1 1 4 1020 1 1 2 MET HG2 H -0.578 -6.100 -1.458 1.00 . A A . 2 MET HG2 1 1 4 1021 1 1 2 MET HG3 H -1.365 -4.547 -1.042 1.00 . A A . 2 MET HG3 1 1 4 1022 1 1 2 MET N N -2.145 -7.409 -4.335 1.00 . A A . 2 MET N 1 1 4 1023 1 1 2 MET O O -4.041 -6.160 -5.583 1.00 . A A . 2 MET O 1 1 4 1024 1 1 2 MET SD S -2.778 -6.440 -0.484 1.00 . A A . 2 MET SD 1 1 4 1025 1 1 3 ARG C C -5.353 -2.771 -4.525 1.00 . A A . 3 ARG C 1 1 4 1026 1 1 3 ARG CA C -5.636 -4.185 -4.488 1.00 . A A . 3 ARG CA 1 1 4 1027 1 1 3 ARG CB C -6.879 -4.351 -3.655 1.00 . A A . 3 ARG CB 1 1 4 1028 1 1 3 ARG CD C -8.549 -2.636 -4.343 1.00 . A A . 3 ARG CD 1 1 4 1029 1 1 3 ARG CG C -8.156 -4.105 -4.429 1.00 . A A . 3 ARG CG 1 1 4 1030 1 1 3 ARG CZ C -10.299 -1.276 -3.227 1.00 . A A . 3 ARG CZ 1 1 4 1031 1 1 3 ARG H H -4.381 -4.482 -2.934 1.00 . A A . 3 ARG H 1 1 4 1032 1 1 3 ARG HA H -5.734 -4.548 -5.443 1.00 . A A . 3 ARG HA 1 1 4 1033 1 1 3 ARG HB2 H -6.878 -5.374 -3.222 1.00 . A A . 3 ARG HB2 1 1 4 1034 1 1 3 ARG HB3 H -6.812 -3.614 -2.813 1.00 . A A . 3 ARG HB3 1 1 4 1035 1 1 3 ARG HD2 H -7.719 -2.054 -3.872 1.00 . A A . 3 ARG HD2 1 1 4 1036 1 1 3 ARG HD3 H -8.778 -2.227 -5.348 1.00 . A A . 3 ARG HD3 1 1 4 1037 1 1 3 ARG HE H -10.192 -3.325 -3.101 1.00 . A A . 3 ARG HE 1 1 4 1038 1 1 3 ARG HG2 H -7.999 -4.388 -5.491 1.00 . A A . 3 ARG HG2 1 1 4 1039 1 1 3 ARG HG3 H -8.968 -4.736 -4.012 1.00 . A A . 3 ARG HG3 1 1 4 1040 1 1 3 ARG HH11 H -8.909 -0.241 -4.331 1.00 . A A . 3 ARG HH11 1 1 4 1041 1 1 3 ARG HH12 H -10.111 0.743 -3.566 1.00 . A A . 3 ARG HH12 1 1 4 1042 1 1 3 ARG HH21 H -11.830 -1.989 -2.059 1.00 . A A . 3 ARG HH21 1 1 4 1043 1 1 3 ARG HH22 H -11.800 -0.269 -2.251 1.00 . A A . 3 ARG HH22 1 1 4 1044 1 1 3 ARG N N -4.574 -4.824 -3.840 1.00 . A A . 3 ARG N 1 1 4 1045 1 1 3 ARG NE N -9.766 -2.507 -3.487 1.00 . A A . 3 ARG NE 1 1 4 1046 1 1 3 ARG NH1 N -9.722 -0.158 -3.755 1.00 . A A . 3 ARG NH1 1 1 4 1047 1 1 3 ARG NH2 N -11.409 -1.168 -2.442 1.00 . A A . 3 ARG NH2 1 1 4 1048 1 1 3 ARG O O -5.753 -2.037 -5.426 1.00 . A A . 3 ARG O 1 1 4 1049 1 1 4 LEU C C -3.410 -0.754 -4.442 1.00 . A A . 4 LEU C 1 1 4 1050 1 1 4 LEU CA C -4.303 -1.041 -3.343 1.00 . A A . 4 LEU CA 1 1 4 1051 1 1 4 LEU CB C -3.512 -0.805 -2.082 1.00 . A A . 4 LEU CB 1 1 4 1052 1 1 4 LEU CD1 C -2.487 -1.798 -0.095 1.00 . A A . 4 LEU CD1 1 1 4 1053 1 1 4 LEU CD2 C -4.990 -2.148 -0.569 1.00 . A A . 4 LEU CD2 1 1 4 1054 1 1 4 LEU CG C -3.583 -1.952 -1.135 1.00 . A A . 4 LEU CG 1 1 4 1055 1 1 4 LEU H H -4.239 -3.012 -2.863 1.00 . A A . 4 LEU H 1 1 4 1056 1 1 4 LEU HA H -5.130 -0.432 -3.392 1.00 . A A . 4 LEU HA 1 1 4 1057 1 1 4 LEU HB2 H -2.473 -0.606 -2.330 1.00 . A A . 4 LEU HB2 1 1 4 1058 1 1 4 LEU HB3 H -3.916 0.068 -1.563 1.00 . A A . 4 LEU HB3 1 1 4 1059 1 1 4 LEU HD11 H -1.739 -2.614 -0.225 1.00 . A A . 4 LEU HD11 1 1 4 1060 1 1 4 LEU HD12 H -2.897 -1.829 0.932 1.00 . A A . 4 LEU HD12 1 1 4 1061 1 1 4 LEU HD13 H -1.963 -0.824 -0.260 1.00 . A A . 4 LEU HD13 1 1 4 1062 1 1 4 LEU HD21 H -5.599 -2.754 -1.289 1.00 . A A . 4 LEU HD21 1 1 4 1063 1 1 4 LEU HD22 H -5.484 -1.164 -0.424 1.00 . A A . 4 LEU HD22 1 1 4 1064 1 1 4 LEU HD23 H -4.950 -2.681 0.402 1.00 . A A . 4 LEU HD23 1 1 4 1065 1 1 4 LEU HG H -3.324 -2.835 -1.727 1.00 . A A . 4 LEU HG 1 1 4 1066 1 1 4 LEU N N -4.625 -2.376 -3.517 1.00 . A A . 4 LEU N 1 1 4 1067 1 1 4 LEU O O -3.792 -0.020 -5.325 1.00 . A A . 4 LEU O 1 1 4 1068 1 1 5 SER C C -1.141 -1.010 -6.580 1.00 . A A . 5 SER C 1 1 4 1069 1 1 5 SER CA C -1.179 -1.703 -5.242 1.00 . A A . 5 SER CA 1 1 4 1070 1 1 5 SER CB C -0.740 -3.126 -5.319 1.00 . A A . 5 SER CB 1 1 4 1071 1 1 5 SER H H -2.465 -2.393 -3.814 1.00 . A A . 5 SER H 1 1 4 1072 1 1 5 SER HA H -0.465 -1.183 -4.613 1.00 . A A . 5 SER HA 1 1 4 1073 1 1 5 SER HB2 H 0.332 -3.166 -5.046 1.00 . A A . 5 SER HB2 1 1 4 1074 1 1 5 SER HB3 H -1.341 -3.680 -4.546 1.00 . A A . 5 SER HB3 1 1 4 1075 1 1 5 SER HG H -0.489 -3.149 -7.232 1.00 . A A . 5 SER HG 1 1 4 1076 1 1 5 SER N N -2.411 -1.654 -4.465 1.00 . A A . 5 SER N 1 1 4 1077 1 1 5 SER O O -0.131 -0.996 -7.268 1.00 . A A . 5 SER O 1 1 4 1078 1 1 5 SER OG O -0.951 -3.713 -6.601 1.00 . A A . 5 SER OG 1 1 4 1079 1 1 6 LYS C C -1.956 1.689 -7.223 1.00 . A A . 6 LYS C 1 1 4 1080 1 1 6 LYS CA C -2.257 0.441 -8.052 1.00 . A A . 6 LYS CA 1 1 4 1081 1 1 6 LYS CB C -3.609 0.624 -8.759 1.00 . A A . 6 LYS CB 1 1 4 1082 1 1 6 LYS CD C -3.247 -1.245 -10.469 1.00 . A A . 6 LYS CD 1 1 4 1083 1 1 6 LYS CE C -3.220 -0.369 -11.724 1.00 . A A . 6 LYS CE 1 1 4 1084 1 1 6 LYS CG C -4.151 -0.676 -9.368 1.00 . A A . 6 LYS CG 1 1 4 1085 1 1 6 LYS H H -3.126 -0.656 -6.550 1.00 . A A . 6 LYS H 1 1 4 1086 1 1 6 LYS HA H -1.443 0.230 -8.736 1.00 . A A . 6 LYS HA 1 1 4 1087 1 1 6 LYS HB2 H -4.348 1.019 -8.028 1.00 . A A . 6 LYS HB2 1 1 4 1088 1 1 6 LYS HB3 H -3.488 1.378 -9.565 1.00 . A A . 6 LYS HB3 1 1 4 1089 1 1 6 LYS HD2 H -2.213 -1.345 -10.076 1.00 . A A . 6 LYS HD2 1 1 4 1090 1 1 6 LYS HD3 H -3.607 -2.260 -10.743 1.00 . A A . 6 LYS HD3 1 1 4 1091 1 1 6 LYS HE2 H -4.248 -0.222 -12.119 1.00 . A A . 6 LYS HE2 1 1 4 1092 1 1 6 LYS HE3 H -2.764 0.620 -11.501 1.00 . A A . 6 LYS HE3 1 1 4 1093 1 1 6 LYS HG2 H -4.260 -1.434 -8.564 1.00 . A A . 6 LYS HG2 1 1 4 1094 1 1 6 LYS HG3 H -5.160 -0.482 -9.792 1.00 . A A . 6 LYS HG3 1 1 4 1095 1 1 6 LYS HZ1 H -3.046 -1.361 -13.535 1.00 . A A . 6 LYS HZ1 1 1 4 1096 1 1 6 LYS HZ2 H -1.888 -1.815 -12.379 1.00 . A A . 6 LYS HZ2 1 1 4 1097 1 1 6 LYS HZ3 H -1.748 -0.325 -13.180 1.00 . A A . 6 LYS HZ3 1 1 4 1098 1 1 6 LYS N N -2.247 -0.481 -6.993 1.00 . A A . 6 LYS N 1 1 4 1099 1 1 6 LYS NZ N -2.416 -1.015 -12.783 1.00 . A A . 6 LYS NZ 1 1 4 1100 1 1 6 LYS O O -1.951 2.813 -7.708 1.00 . A A . 6 LYS O 1 1 4 1101 1 1 7 PHE C C -0.340 2.560 -4.251 1.00 . A A . 7 PHE C 1 1 4 1102 1 1 7 PHE CA C -1.616 2.311 -4.811 1.00 . A A . 7 PHE CA 1 1 4 1103 1 1 7 PHE CB C -2.219 1.679 -3.588 1.00 . A A . 7 PHE CB 1 1 4 1104 1 1 7 PHE CD1 C -3.847 2.208 -1.936 1.00 . A A . 7 PHE CD1 1 1 4 1105 1 1 7 PHE CD2 C -1.727 3.205 -1.902 1.00 . A A . 7 PHE CD2 1 1 4 1106 1 1 7 PHE CE1 C -4.090 2.744 -0.733 1.00 . A A . 7 PHE CE1 1 1 4 1107 1 1 7 PHE CE2 C -1.909 3.770 -0.770 1.00 . A A . 7 PHE CE2 1 1 4 1108 1 1 7 PHE CG C -2.684 2.445 -2.512 1.00 . A A . 7 PHE CG 1 1 4 1109 1 1 7 PHE CZ C -3.118 3.559 -0.109 1.00 . A A . 7 PHE CZ 1 1 4 1110 1 1 7 PHE H H -1.767 0.446 -5.489 1.00 . A A . 7 PHE H 1 1 4 1111 1 1 7 PHE HA H -2.139 3.206 -5.000 1.00 . A A . 7 PHE HA 1 1 4 1112 1 1 7 PHE HB2 H -3.152 1.276 -3.936 1.00 . A A . 7 PHE HB2 1 1 4 1113 1 1 7 PHE HB3 H -1.642 0.836 -3.185 1.00 . A A . 7 PHE HB3 1 1 4 1114 1 1 7 PHE HD1 H -4.580 1.568 -2.438 1.00 . A A . 7 PHE HD1 1 1 4 1115 1 1 7 PHE HD2 H -0.792 3.382 -2.369 1.00 . A A . 7 PHE HD2 1 1 4 1116 1 1 7 PHE HE1 H -5.005 2.496 -0.274 1.00 . A A . 7 PHE HE1 1 1 4 1117 1 1 7 PHE HE2 H -1.051 4.338 -0.390 1.00 . A A . 7 PHE HE2 1 1 4 1118 1 1 7 PHE HZ H -3.303 3.998 0.861 1.00 . A A . 7 PHE HZ 1 1 4 1119 1 1 7 PHE N N -1.842 1.416 -5.855 1.00 . A A . 7 PHE N 1 1 4 1120 1 1 7 PHE O O 0.119 3.662 -4.259 1.00 . A A . 7 PHE O 1 1 4 1121 1 1 8 PHE C C 2.248 1.528 -3.506 1.00 . A A . 8 PHE C 1 1 4 1122 1 1 8 PHE CA C 1.200 1.723 -2.680 1.00 . A A . 8 PHE CA 1 1 4 1123 1 1 8 PHE CB C 1.566 0.663 -1.699 1.00 . A A . 8 PHE CB 1 1 4 1124 1 1 8 PHE CD1 C 2.026 -1.446 -2.263 1.00 . A A . 8 PHE CD1 1 1 4 1125 1 1 8 PHE CD2 C -0.174 -0.819 -1.966 1.00 . A A . 8 PHE CD2 1 1 4 1126 1 1 8 PHE CE1 C 1.699 -2.620 -2.603 1.00 . A A . 8 PHE CE1 1 1 4 1127 1 1 8 PHE CE2 C -0.537 -2.022 -2.305 1.00 . A A . 8 PHE CE2 1 1 4 1128 1 1 8 PHE CG C 1.087 -0.558 -1.950 1.00 . A A . 8 PHE CG 1 1 4 1129 1 1 8 PHE CZ C 0.405 -2.938 -2.635 1.00 . A A . 8 PHE CZ 1 1 4 1130 1 1 8 PHE H H -0.185 0.609 -3.647 1.00 . A A . 8 PHE H 1 1 4 1131 1 1 8 PHE HA H 1.220 2.681 -2.337 1.00 . A A . 8 PHE HA 1 1 4 1132 1 1 8 PHE HB2 H 2.628 0.557 -1.569 1.00 . A A . 8 PHE HB2 1 1 4 1133 1 1 8 PHE HB3 H 1.084 0.921 -0.757 1.00 . A A . 8 PHE HB3 1 1 4 1134 1 1 8 PHE HD1 H 3.071 -1.167 -2.233 1.00 . A A . 8 PHE HD1 1 1 4 1135 1 1 8 PHE HD2 H -0.889 -0.066 -1.686 1.00 . A A . 8 PHE HD2 1 1 4 1136 1 1 8 PHE HE1 H 2.460 -3.283 -2.870 1.00 . A A . 8 PHE HE1 1 1 4 1137 1 1 8 PHE HE2 H -1.546 -2.240 -2.362 1.00 . A A . 8 PHE HE2 1 1 4 1138 1 1 8 PHE HZ H 0.129 -3.865 -2.911 1.00 . A A . 8 PHE HZ 1 1 4 1139 1 1 8 PHE N N 0.164 1.519 -3.575 1.00 . A A . 8 PHE N 1 1 4 1140 1 1 8 PHE O O 3.170 2.192 -3.477 1.00 . A A . 8 PHE O 1 1 4 1141 1 1 9 ARG C C 2.939 1.294 -6.190 1.00 . A A . 9 ARG C 1 1 4 1142 1 1 9 ARG CA C 2.904 0.192 -5.280 1.00 . A A . 9 ARG CA 1 1 4 1143 1 1 9 ARG CB C 2.418 -1.032 -5.979 1.00 . A A . 9 ARG CB 1 1 4 1144 1 1 9 ARG CD C 4.360 -2.644 -6.089 1.00 . A A . 9 ARG CD 1 1 4 1145 1 1 9 ARG CG C 3.019 -2.318 -5.440 1.00 . A A . 9 ARG CG 1 1 4 1146 1 1 9 ARG CZ C 5.157 -3.436 -8.302 1.00 . A A . 9 ARG CZ 1 1 4 1147 1 1 9 ARG H H 1.136 0.139 -4.359 1.00 . A A . 9 ARG H 1 1 4 1148 1 1 9 ARG HA H 3.810 0.076 -4.811 1.00 . A A . 9 ARG HA 1 1 4 1149 1 1 9 ARG HB2 H 1.310 -1.054 -5.795 1.00 . A A . 9 ARG HB2 1 1 4 1150 1 1 9 ARG HB3 H 2.602 -0.934 -7.064 1.00 . A A . 9 ARG HB3 1 1 4 1151 1 1 9 ARG HD2 H 4.986 -1.728 -6.162 1.00 . A A . 9 ARG HD2 1 1 4 1152 1 1 9 ARG HD3 H 4.898 -3.427 -5.517 1.00 . A A . 9 ARG HD3 1 1 4 1153 1 1 9 ARG HE H 3.172 -3.294 -7.786 1.00 . A A . 9 ARG HE 1 1 4 1154 1 1 9 ARG HG2 H 3.171 -2.210 -4.353 1.00 . A A . 9 ARG HG2 1 1 4 1155 1 1 9 ARG HG3 H 2.310 -3.155 -5.613 1.00 . A A . 9 ARG HG3 1 1 4 1156 1 1 9 ARG HH11 H 6.612 -2.914 -6.950 1.00 . A A . 9 ARG HH11 1 1 4 1157 1 1 9 ARG HH12 H 7.205 -3.456 -8.484 1.00 . A A . 9 ARG HH12 1 1 4 1158 1 1 9 ARG HH21 H 3.976 -4.033 -9.873 1.00 . A A . 9 ARG HH21 1 1 4 1159 1 1 9 ARG HH22 H 5.679 -4.104 -10.175 1.00 . A A . 9 ARG HH22 1 1 4 1160 1 1 9 ARG N N 2.014 0.572 -4.332 1.00 . A A . 9 ARG N 1 1 4 1161 1 1 9 ARG NE N 4.110 -3.157 -7.469 1.00 . A A . 9 ARG NE 1 1 4 1162 1 1 9 ARG NH1 N 6.440 -3.252 -7.875 1.00 . A A . 9 ARG NH1 1 1 4 1163 1 1 9 ARG NH2 N 4.916 -3.900 -9.562 1.00 . A A . 9 ARG NH2 1 1 4 1164 1 1 9 ARG O O 3.627 1.286 -7.211 1.00 . A A . 9 ARG O 1 1 4 1165 1 1 10 ASP C C 2.135 4.566 -5.899 1.00 . A A . 10 ASP C 1 1 4 1166 1 1 10 ASP CA C 1.904 3.309 -6.635 1.00 . A A . 10 ASP CA 1 1 4 1167 1 1 10 ASP CB C 0.662 3.292 -7.302 1.00 . A A . 10 ASP CB 1 1 4 1168 1 1 10 ASP CG C 0.635 4.067 -8.616 1.00 . A A . 10 ASP CG 1 1 4 1169 1 1 10 ASP H H 1.459 2.145 -5.034 1.00 . A A . 10 ASP H 1 1 4 1170 1 1 10 ASP HA H 2.668 3.203 -7.291 1.00 . A A . 10 ASP HA 1 1 4 1171 1 1 10 ASP HB2 H 0.493 2.215 -7.471 1.00 . A A . 10 ASP HB2 1 1 4 1172 1 1 10 ASP HB3 H -0.072 3.685 -6.598 1.00 . A A . 10 ASP HB3 1 1 4 1173 1 1 10 ASP N N 2.014 2.197 -5.898 1.00 . A A . 10 ASP N 1 1 4 1174 1 1 10 ASP O O 2.125 5.631 -6.521 1.00 . A A . 10 ASP O 1 1 4 1175 1 1 10 ASP OD1 O 1.478 3.758 -9.501 1.00 . A A . 10 ASP OD1 1 1 4 1176 1 1 10 ASP OD2 O -0.223 4.978 -8.751 1.00 . A A . 10 ASP OD2 1 1 4 1177 1 1 11 . C C 2.348 6.046 -2.514 1.00 . A A . 11 DPN C 1 1 4 1178 1 1 11 . CA C 2.595 5.845 -3.979 1.00 . A A . 11 DPN CA 1 1 4 1179 1 1 11 . CB C 4.057 6.160 -4.213 1.00 . A A . 11 DPN CB 1 1 4 1180 1 1 11 . CD1 C 4.710 4.781 -6.104 1.00 . A A . 11 DPN CD1 1 1 4 1181 1 1 11 . CD2 C 4.905 4.162 -3.870 1.00 . A A . 11 DPN CD2 1 1 4 1182 1 1 11 . CE1 C 4.922 3.512 -6.427 1.00 . A A . 11 DPN CE1 1 1 4 1183 1 1 11 . CE2 C 5.186 2.990 -4.180 1.00 . A A . 11 DPN CE2 1 1 4 1184 1 1 11 . CG C 4.682 5.063 -4.777 1.00 . A A . 11 DPN CG 1 1 4 1185 1 1 11 . CZ C 5.158 2.644 -5.411 1.00 . A A . 11 DPN CZ 1 1 4 1186 1 1 11 . H H 2.304 3.678 -3.996 1.00 . A A . 11 DPN H 1 1 4 1187 1 1 11 . HA H 2.018 6.533 -4.475 1.00 . A A . 11 DPN HA 1 1 4 1188 1 1 11 . HB2 H 4.527 6.266 -3.243 1.00 . A A . 11 DPN HB2 1 1 4 1189 1 1 11 . HB3 H 4.185 6.981 -4.862 1.00 . A A . 11 DPN HB3 1 1 4 1190 1 1 11 . HD1 H 4.525 5.538 -6.852 1.00 . A A . 11 DPN HD1 1 1 4 1191 1 1 11 . HD2 H 4.935 4.447 -2.877 1.00 . A A . 11 DPN HD2 1 1 4 1192 1 1 11 . HE1 H 4.921 3.184 -7.453 1.00 . A A . 11 DPN HE1 1 1 4 1193 1 1 11 . HE2 H 5.314 2.267 -3.429 1.00 . A A . 11 DPN HE2 1 1 4 1194 1 1 11 . HZ H 5.217 1.703 -5.569 1.00 . A A . 11 DPN HZ 1 1 4 1195 1 1 11 . N N 2.300 4.543 -4.560 1.00 . A A . 11 DPN N 1 1 4 1196 1 1 11 . O O 1.378 6.684 -2.115 1.00 . A A . 11 DPN O 1 1 4 1197 1 1 12 ILE C C 4.578 5.036 0.189 1.00 . A A . 12 ILE C 1 1 4 1198 1 1 12 ILE CA C 3.305 5.715 -0.287 1.00 . A A . 12 ILE CA 1 1 4 1199 1 1 12 ILE CB C 2.130 5.149 0.440 1.00 . A A . 12 ILE CB 1 1 4 1200 1 1 12 ILE CD1 C 2.555 3.108 -0.666 1.00 . A A . 12 ILE CD1 1 1 4 1201 1 1 12 ILE CG1 C 1.520 4.094 -0.425 1.00 . A A . 12 ILE CG1 1 1 4 1202 1 1 12 ILE CG2 C 1.153 6.279 0.808 1.00 . A A . 12 ILE CG2 1 1 4 1203 1 1 12 ILE H H 3.898 4.843 -2.046 1.00 . A A . 12 ILE H 1 1 4 1204 1 1 12 ILE HA H 3.389 6.736 -0.115 1.00 . A A . 12 ILE HA 1 1 4 1205 1 1 12 ILE HB H 2.489 4.659 1.354 1.00 . A A . 12 ILE HB 1 1 4 1206 1 1 12 ILE HD11 H 2.855 3.136 -1.755 1.00 . A A . 12 ILE HD11 1 1 4 1207 1 1 12 ILE HD12 H 2.219 2.130 -0.372 1.00 . A A . 12 ILE HD12 1 1 4 1208 1 1 12 ILE HD13 H 3.416 3.337 -0.080 1.00 . A A . 12 ILE HD13 1 1 4 1209 1 1 12 ILE HG12 H 0.656 3.616 0.069 1.00 . A A . 12 ILE HG12 1 1 4 1210 1 1 12 ILE HG13 H 1.213 4.507 -1.408 1.00 . A A . 12 ILE HG13 1 1 4 1211 1 1 12 ILE HG21 H 0.105 5.952 0.638 1.00 . A A . 12 ILE HG21 1 1 4 1212 1 1 12 ILE HG22 H 1.347 7.178 0.184 1.00 . A A . 12 ILE HG22 1 1 4 1213 1 1 12 ILE HG23 H 1.267 6.557 1.878 1.00 . A A . 12 ILE HG23 1 1 4 1214 1 1 12 ILE N N 3.269 5.508 -1.706 1.00 . A A . 12 ILE N 1 1 4 1215 1 1 12 ILE O O 4.866 4.984 1.372 1.00 . A A . 12 ILE O 1 1 4 1216 1 1 13 LEU C C 7.650 4.305 -1.143 1.00 . A A . 13 LEU C 1 1 4 1217 1 1 13 LEU CA C 6.503 3.628 -0.523 1.00 . A A . 13 LEU CA 1 1 4 1218 1 1 13 LEU CB C 6.455 2.292 -1.236 1.00 . A A . 13 LEU CB 1 1 4 1219 1 1 13 LEU CD1 C 5.043 0.415 -1.964 1.00 . A A . 13 LEU CD1 1 1 4 1220 1 1 13 LEU CD2 C 4.738 1.564 0.339 1.00 . A A . 13 LEU CD2 1 1 4 1221 1 1 13 LEU CG C 5.116 1.693 -1.134 1.00 . A A . 13 LEU CG 1 1 4 1222 1 1 13 LEU H H 4.936 4.301 -1.717 1.00 . A A . 13 LEU H 1 1 4 1223 1 1 13 LEU HA H 6.638 3.505 0.530 1.00 . A A . 13 LEU HA 1 1 4 1224 1 1 13 LEU HB2 H 6.666 2.442 -2.310 1.00 . A A . 13 LEU HB2 1 1 4 1225 1 1 13 LEU HB3 H 7.195 1.596 -0.812 1.00 . A A . 13 LEU HB3 1 1 4 1226 1 1 13 LEU HD11 H 6.062 0.114 -2.275 1.00 . A A . 13 LEU HD11 1 1 4 1227 1 1 13 LEU HD12 H 4.445 0.610 -2.895 1.00 . A A . 13 LEU HD12 1 1 4 1228 1 1 13 LEU HD13 H 4.573 -0.405 -1.392 1.00 . A A . 13 LEU HD13 1 1 4 1229 1 1 13 LEU HD21 H 3.707 1.173 0.442 1.00 . A A . 13 LEU HD21 1 1 4 1230 1 1 13 LEU HD22 H 4.787 2.591 0.814 1.00 . A A . 13 LEU HD22 1 1 4 1231 1 1 13 LEU HD23 H 5.444 0.896 0.866 1.00 . A A . 13 LEU HD23 1 1 4 1232 1 1 13 LEU HG H 4.426 2.420 -1.606 1.00 . A A . 13 LEU HG 1 1 4 1233 1 1 13 LEU N N 5.286 4.377 -0.780 1.00 . A A . 13 LEU N 1 1 4 1234 1 1 13 LEU O O 8.688 4.504 -0.536 1.00 . A A . 13 LEU O 1 1 4 1235 1 1 14 GLN C C 8.703 6.598 -2.512 1.00 . A A . 14 GLN C 1 1 4 1236 1 1 14 GLN CA C 8.570 5.288 -3.141 1.00 . A A . 14 GLN CA 1 1 4 1237 1 1 14 GLN CB C 8.298 5.559 -4.617 1.00 . A A . 14 GLN CB 1 1 4 1238 1 1 14 GLN CD C 8.789 3.180 -4.956 1.00 . A A . 14 GLN CD 1 1 4 1239 1 1 14 GLN CG C 7.887 4.320 -5.340 1.00 . A A . 14 GLN CG 1 1 4 1240 1 1 14 GLN H H 6.639 4.409 -2.943 1.00 . A A . 14 GLN H 1 1 4 1241 1 1 14 GLN HA H 9.468 4.718 -3.000 1.00 . A A . 14 GLN HA 1 1 4 1242 1 1 14 GLN HB2 H 7.473 6.297 -4.698 1.00 . A A . 14 GLN HB2 1 1 4 1243 1 1 14 GLN HB3 H 9.201 5.980 -5.094 1.00 . A A . 14 GLN HB3 1 1 4 1244 1 1 14 GLN HE21 H 7.266 2.479 -3.814 1.00 . A A . 14 GLN HE21 1 1 4 1245 1 1 14 GLN HE22 H 8.718 1.517 -3.785 1.00 . A A . 14 GLN HE22 1 1 4 1246 1 1 14 GLN HG2 H 6.868 4.083 -5.022 1.00 . A A . 14 GLN HG2 1 1 4 1247 1 1 14 GLN HG3 H 7.912 4.474 -6.430 1.00 . A A . 14 GLN HG3 1 1 4 1248 1 1 14 GLN N N 7.490 4.630 -2.433 1.00 . A A . 14 GLN N 1 1 4 1249 1 1 14 GLN NE2 N 8.216 2.307 -4.115 1.00 . A A . 14 GLN NE2 1 1 4 1250 1 1 14 GLN O O 9.728 7.270 -2.605 1.00 . A A . 14 GLN O 1 1 4 1251 1 1 14 GLN OE1 O 9.954 3.102 -5.334 1.00 . A A . 14 GLN OE1 1 1 4 1252 1 1 15 ARG C C 7.766 7.948 0.258 1.00 . A A . 15 ARG C 1 1 4 1253 1 1 15 ARG CA C 7.612 8.238 -1.200 1.00 . A A . 15 ARG CA 1 1 4 1254 1 1 15 ARG CB C 6.298 9.008 -1.348 1.00 . A A . 15 ARG CB 1 1 4 1255 1 1 15 ARG CD C 4.032 8.602 -2.308 1.00 . A A . 15 ARG CD 1 1 4 1256 1 1 15 ARG CG C 5.525 8.626 -2.596 1.00 . A A . 15 ARG CG 1 1 4 1257 1 1 15 ARG CZ C 3.231 10.886 -2.897 1.00 . A A . 15 ARG CZ 1 1 4 1258 1 1 15 ARG H H 6.797 6.383 -1.769 1.00 . A A . 15 ARG H 1 1 4 1259 1 1 15 ARG HA H 8.442 8.788 -1.585 1.00 . A A . 15 ARG HA 1 1 4 1260 1 1 15 ARG HB2 H 5.661 8.820 -0.459 1.00 . A A . 15 ARG HB2 1 1 4 1261 1 1 15 ARG HB3 H 6.521 10.095 -1.386 1.00 . A A . 15 ARG HB3 1 1 4 1262 1 1 15 ARG HD2 H 3.461 8.269 -3.196 1.00 . A A . 15 ARG HD2 1 1 4 1263 1 1 15 ARG HD3 H 3.824 7.914 -1.450 1.00 . A A . 15 ARG HD3 1 1 4 1264 1 1 15 ARG HE H 3.549 10.242 -0.967 1.00 . A A . 15 ARG HE 1 1 4 1265 1 1 15 ARG HG2 H 5.742 9.347 -3.409 1.00 . A A . 15 ARG HG2 1 1 4 1266 1 1 15 ARG HG3 H 5.839 7.612 -2.930 1.00 . A A . 15 ARG HG3 1 1 4 1267 1 1 15 ARG HH11 H 3.569 9.626 -4.484 1.00 . A A . 15 ARG HH11 1 1 4 1268 1 1 15 ARG HH12 H 3.015 11.209 -4.916 1.00 . A A . 15 ARG HH12 1 1 4 1269 1 1 15 ARG HH21 H 2.795 12.388 -1.564 1.00 . A A . 15 ARG HH21 1 1 4 1270 1 1 15 ARG HH22 H 2.569 12.804 -3.229 1.00 . A A . 15 ARG HH22 1 1 4 1271 1 1 15 ARG N N 7.620 6.979 -1.845 1.00 . A A . 15 ARG N 1 1 4 1272 1 1 15 ARG NE N 3.585 9.980 -1.934 1.00 . A A . 15 ARG NE 1 1 4 1273 1 1 15 ARG NH1 N 3.275 10.544 -4.217 1.00 . A A . 15 ARG NH1 1 1 4 1274 1 1 15 ARG NH2 N 2.829 12.137 -2.531 1.00 . A A . 15 ARG NH2 1 1 4 1275 1 1 15 ARG O O 8.283 8.756 1.023 1.00 . A A . 15 ARG O 1 1 4 1276 1 1 16 LYS C C 6.196 6.938 2.779 1.00 . A A . 16 LYS C 1 1 4 1277 1 1 16 LYS CA C 7.264 6.256 1.984 1.00 . A A . 16 LYS CA 1 1 4 1278 1 1 16 LYS CB C 8.584 6.441 2.721 1.00 . A A . 16 LYS CB 1 1 4 1279 1 1 16 LYS CD C 9.543 4.143 2.223 1.00 . A A . 16 LYS CD 1 1 4 1280 1 1 16 LYS CE C 10.745 3.348 1.711 1.00 . A A . 16 LYS CE 1 1 4 1281 1 1 16 LYS CG C 9.747 5.656 2.112 1.00 . A A . 16 LYS CG 1 1 4 1282 1 1 16 LYS H H 6.860 6.128 -0.023 1.00 . A A . 16 LYS H 1 1 4 1283 1 1 16 LYS HA H 7.011 5.208 1.908 1.00 . A A . 16 LYS HA 1 1 4 1284 1 1 16 LYS HB2 H 8.823 7.516 2.702 1.00 . A A . 16 LYS HB2 1 1 4 1285 1 1 16 LYS HB3 H 8.450 6.134 3.773 1.00 . A A . 16 LYS HB3 1 1 4 1286 1 1 16 LYS HD2 H 9.356 3.879 3.284 1.00 . A A . 16 LYS HD2 1 1 4 1287 1 1 16 LYS HD3 H 8.640 3.860 1.634 1.00 . A A . 16 LYS HD3 1 1 4 1288 1 1 16 LYS HE2 H 10.932 3.569 0.639 1.00 . A A . 16 LYS HE2 1 1 4 1289 1 1 16 LYS HE3 H 11.654 3.591 2.302 1.00 . A A . 16 LYS HE3 1 1 4 1290 1 1 16 LYS HG2 H 9.854 5.933 1.042 1.00 . A A . 16 LYS HG2 1 1 4 1291 1 1 16 LYS HG3 H 10.687 5.936 2.635 1.00 . A A . 16 LYS HG3 1 1 4 1292 1 1 16 LYS HZ1 H 9.626 1.742 2.390 1.00 . A A . 16 LYS HZ1 1 1 4 1293 1 1 16 LYS HZ2 H 11.296 1.446 2.321 1.00 . A A . 16 LYS HZ2 1 1 4 1294 1 1 16 LYS HZ3 H 10.380 1.480 0.891 1.00 . A A . 16 LYS HZ3 1 1 4 1295 1 1 16 LYS N N 7.256 6.748 0.637 1.00 . A A . 16 LYS N 1 1 4 1296 1 1 16 LYS NZ N 10.493 1.896 1.838 1.00 . A A . 16 LYS NZ 1 1 4 1297 1 1 16 LYS O O 6.141 6.816 4.002 1.00 . A A . 16 LYS O 1 1 4 1298 1 1 17 LYS C C 3.289 8.947 1.757 1.00 . A A . 17 LYS C 1 1 4 1299 1 1 17 LYS CA C 4.229 8.318 2.785 1.00 . A A . 17 LYS CA 1 1 4 1300 1 1 17 LYS CB C 4.685 9.432 3.750 1.00 . A A . 17 LYS CB 1 1 4 1301 1 1 17 LYS CD C 5.478 11.484 2.449 1.00 . A A . 17 LYS CD 1 1 4 1302 1 1 17 LYS CE C 6.538 11.895 1.429 1.00 . A A . 17 LYS CE 1 1 4 1303 1 1 17 LYS CG C 5.887 10.234 3.236 1.00 . A A . 17 LYS CG 1 1 4 1304 1 1 17 LYS H H 5.371 7.780 1.113 1.00 . A A . 17 LYS H 1 1 4 1305 1 1 17 LYS HA H 3.691 7.554 3.313 1.00 . A A . 17 LYS HA 1 1 4 1306 1 1 17 LYS HB2 H 3.837 10.125 3.930 1.00 . A A . 17 LYS HB2 1 1 4 1307 1 1 17 LYS HB3 H 4.958 8.967 4.719 1.00 . A A . 17 LYS HB3 1 1 4 1308 1 1 17 LYS HD2 H 4.522 11.287 1.918 1.00 . A A . 17 LYS HD2 1 1 4 1309 1 1 17 LYS HD3 H 5.311 12.322 3.159 1.00 . A A . 17 LYS HD3 1 1 4 1310 1 1 17 LYS HE2 H 7.499 12.125 1.935 1.00 . A A . 17 LYS HE2 1 1 4 1311 1 1 17 LYS HE3 H 6.696 11.081 0.687 1.00 . A A . 17 LYS HE3 1 1 4 1312 1 1 17 LYS HG2 H 6.509 10.542 4.102 1.00 . A A . 17 LYS HG2 1 1 4 1313 1 1 17 LYS HG3 H 6.509 9.585 2.588 1.00 . A A . 17 LYS HG3 1 1 4 1314 1 1 17 LYS HZ1 H 6.904 13.770 0.627 1.00 . A A . 17 LYS HZ1 1 1 4 1315 1 1 17 LYS HZ2 H 5.323 13.559 1.209 1.00 . A A . 17 LYS HZ2 1 1 4 1316 1 1 17 LYS HZ3 H 5.791 12.841 -0.257 1.00 . A A . 17 LYS HZ3 1 1 4 1317 1 1 17 LYS N N 5.307 7.662 2.093 1.00 . A A . 17 LYS N 1 1 4 1318 1 1 17 LYS NZ N 6.107 13.106 0.697 1.00 . A A . 17 LYS NZ 1 1 4 1319 1 1 17 LYS O O 2.063 9.012 2.040 1.00 . A A . 17 LYS O 1 1 4 1320 1 1 17 LYS OXT O 3.782 9.378 0.690 1.00 . A A . 17 LYS OXT 1 1 5 1321 1 1 1 GLU C C -2.597 -8.998 -2.151 1.00 . A A . 1 GLU C 1 1 5 1322 1 1 1 GLU CA C -2.460 -10.480 -2.350 1.00 . A A . 1 GLU CA 1 1 5 1323 1 1 1 GLU CB C -1.109 -10.761 -3.037 1.00 . A A . 1 GLU CB 1 1 5 1324 1 1 1 GLU CD C 0.524 -12.466 -3.851 1.00 . A A . 1 GLU CD 1 1 5 1325 1 1 1 GLU CG C -0.737 -12.253 -3.020 1.00 . A A . 1 GLU CG 1 1 5 1326 1 1 1 GLU H1 H -4.283 -10.256 -3.329 1.00 . A A . 1 GLU H1 1 1 5 1327 1 1 1 GLU H2 H -4.022 -11.810 -2.697 1.00 . A A . 1 GLU H2 1 1 5 1328 1 1 1 GLU H3 H -3.206 -11.317 -4.103 1.00 . A A . 1 GLU H3 1 1 5 1329 1 1 1 GLU HA H -2.506 -10.975 -1.393 1.00 . A A . 1 GLU HA 1 1 5 1330 1 1 1 GLU HB2 H -1.161 -10.408 -4.092 1.00 . A A . 1 GLU HB2 1 1 5 1331 1 1 1 GLU HB3 H -0.310 -10.186 -2.522 1.00 . A A . 1 GLU HB3 1 1 5 1332 1 1 1 GLU HG2 H -0.551 -12.588 -1.976 1.00 . A A . 1 GLU HG2 1 1 5 1333 1 1 1 GLU HG3 H -1.561 -12.858 -3.452 1.00 . A A . 1 GLU HG3 1 1 5 1334 1 1 1 GLU N N -3.576 -11.005 -3.182 1.00 . A A . 1 GLU N 1 1 5 1335 1 1 1 GLU O O -2.597 -8.510 -1.021 1.00 . A A . 1 GLU O 1 1 5 1336 1 1 1 GLU OE1 O 0.925 -11.522 -4.582 1.00 . A A . 1 GLU OE1 1 1 5 1337 1 1 1 GLU OE2 O 1.104 -13.580 -3.763 1.00 . A A . 1 GLU OE2 1 1 5 1338 1 1 2 MET C C -3.571 -6.340 -4.372 1.00 . A A . 2 MET C 1 1 5 1339 1 1 2 MET CA C -2.856 -6.819 -3.163 1.00 . A A . 2 MET CA 1 1 5 1340 1 1 2 MET CB C -1.523 -6.071 -2.932 1.00 . A A . 2 MET CB 1 1 5 1341 1 1 2 MET CE C -1.481 -6.060 -6.544 1.00 . A A . 2 MET CE 1 1 5 1342 1 1 2 MET CG C -0.554 -6.014 -4.106 1.00 . A A . 2 MET CG 1 1 5 1343 1 1 2 MET H H -2.733 -8.633 -4.181 1.00 . A A . 2 MET H 1 1 5 1344 1 1 2 MET HA H -3.508 -6.601 -2.355 1.00 . A A . 2 MET HA 1 1 5 1345 1 1 2 MET HB2 H -1.757 -5.028 -2.635 1.00 . A A . 2 MET HB2 1 1 5 1346 1 1 2 MET HB3 H -1.004 -6.546 -2.073 1.00 . A A . 2 MET HB3 1 1 5 1347 1 1 2 MET HE1 H -2.041 -5.275 -5.975 1.00 . A A . 2 MET HE1 1 1 5 1348 1 1 2 MET HE2 H -2.189 -6.547 -7.245 1.00 . A A . 2 MET HE2 1 1 5 1349 1 1 2 MET HE3 H -0.690 -5.558 -7.137 1.00 . A A . 2 MET HE3 1 1 5 1350 1 1 2 MET HG2 H -0.670 -5.020 -4.560 1.00 . A A . 2 MET HG2 1 1 5 1351 1 1 2 MET HG3 H 0.473 -6.075 -3.699 1.00 . A A . 2 MET HG3 1 1 5 1352 1 1 2 MET N N -2.723 -8.244 -3.262 1.00 . A A . 2 MET N 1 1 5 1353 1 1 2 MET O O -3.731 -7.053 -5.361 1.00 . A A . 2 MET O 1 1 5 1354 1 1 2 MET SD S -0.768 -7.268 -5.396 1.00 . A A . 2 MET SD 1 1 5 1355 1 1 3 ARG C C -4.705 -3.100 -5.246 1.00 . A A . 3 ARG C 1 1 5 1356 1 1 3 ARG CA C -4.892 -4.542 -5.306 1.00 . A A . 3 ARG CA 1 1 5 1357 1 1 3 ARG CB C -6.358 -4.689 -5.036 1.00 . A A . 3 ARG CB 1 1 5 1358 1 1 3 ARG CD C -6.739 -6.897 -3.895 1.00 . A A . 3 ARG CD 1 1 5 1359 1 1 3 ARG CG C -6.876 -6.113 -5.199 1.00 . A A . 3 ARG CG 1 1 5 1360 1 1 3 ARG CZ C -8.090 -7.263 -1.846 1.00 . A A . 3 ARG CZ 1 1 5 1361 1 1 3 ARG H H -4.068 -4.622 -3.397 1.00 . A A . 3 ARG H 1 1 5 1362 1 1 3 ARG HA H -4.595 -4.924 -6.239 1.00 . A A . 3 ARG HA 1 1 5 1363 1 1 3 ARG HB2 H -6.502 -4.356 -3.979 1.00 . A A . 3 ARG HB2 1 1 5 1364 1 1 3 ARG HB3 H -6.913 -3.999 -5.696 1.00 . A A . 3 ARG HB3 1 1 5 1365 1 1 3 ARG HD2 H -6.585 -7.979 -4.095 1.00 . A A . 3 ARG HD2 1 1 5 1366 1 1 3 ARG HD3 H -5.890 -6.493 -3.295 1.00 . A A . 3 ARG HD3 1 1 5 1367 1 1 3 ARG HE H -8.759 -6.214 -3.483 1.00 . A A . 3 ARG HE 1 1 5 1368 1 1 3 ARG HG2 H -7.945 -6.085 -5.506 1.00 . A A . 3 ARG HG2 1 1 5 1369 1 1 3 ARG HG3 H -6.299 -6.627 -5.997 1.00 . A A . 3 ARG HG3 1 1 5 1370 1 1 3 ARG HH11 H -6.209 -8.088 -1.849 1.00 . A A . 3 ARG HH11 1 1 5 1371 1 1 3 ARG HH12 H -7.120 -8.358 -0.401 1.00 . A A . 3 ARG HH12 1 1 5 1372 1 1 3 ARG HH21 H -10.001 -6.582 -1.515 1.00 . A A . 3 ARG HH21 1 1 5 1373 1 1 3 ARG HH22 H -9.314 -7.489 -0.210 1.00 . A A . 3 ARG HH22 1 1 5 1374 1 1 3 ARG N N -4.123 -5.133 -4.245 1.00 . A A . 3 ARG N 1 1 5 1375 1 1 3 ARG NE N -7.990 -6.726 -3.099 1.00 . A A . 3 ARG NE 1 1 5 1376 1 1 3 ARG NH1 N -7.047 -7.966 -1.318 1.00 . A A . 3 ARG NH1 1 1 5 1377 1 1 3 ARG NH2 N -9.237 -7.097 -1.126 1.00 . A A . 3 ARG NH2 1 1 5 1378 1 1 3 ARG O O -5.111 -2.343 -6.125 1.00 . A A . 3 ARG O 1 1 5 1379 1 1 4 LEU C C -3.105 -0.848 -4.920 1.00 . A A . 4 LEU C 1 1 5 1380 1 1 4 LEU CA C -3.872 -1.392 -3.823 1.00 . A A . 4 LEU CA 1 1 5 1381 1 1 4 LEU CB C -2.995 -1.305 -2.593 1.00 . A A . 4 LEU CB 1 1 5 1382 1 1 4 LEU CD1 C -1.686 -2.575 -0.936 1.00 . A A . 4 LEU CD1 1 1 5 1383 1 1 4 LEU CD2 C -4.174 -3.094 -1.254 1.00 . A A . 4 LEU CD2 1 1 5 1384 1 1 4 LEU CG C -2.865 -2.625 -1.886 1.00 . A A . 4 LEU CG 1 1 5 1385 1 1 4 LEU H H -3.692 -3.368 -3.547 1.00 . A A . 4 LEU H 1 1 5 1386 1 1 4 LEU HA H -4.749 -0.860 -3.704 1.00 . A A . 4 LEU HA 1 1 5 1387 1 1 4 LEU HB2 H -2.008 -0.938 -2.866 1.00 . A A . 4 LEU HB2 1 1 5 1388 1 1 4 LEU HB3 H -3.442 -0.599 -1.883 1.00 . A A . 4 LEU HB3 1 1 5 1389 1 1 4 LEU HD11 H -1.248 -1.548 -0.951 1.00 . A A . 4 LEU HD11 1 1 5 1390 1 1 4 LEU HD12 H -0.904 -3.290 -1.289 1.00 . A A . 4 LEU HD12 1 1 5 1391 1 1 4 LEU HD13 H -1.988 -2.833 0.097 1.00 . A A . 4 LEU HD13 1 1 5 1392 1 1 4 LEU HD21 H -4.723 -3.742 -1.982 1.00 . A A . 4 LEU HD21 1 1 5 1393 1 1 4 LEU HD22 H -4.810 -2.220 -1.003 1.00 . A A . 4 LEU HD22 1 1 5 1394 1 1 4 LEU HD23 H -3.975 -3.677 -0.334 1.00 . A A . 4 LEU HD23 1 1 5 1395 1 1 4 LEU HG H -2.589 -3.350 -2.663 1.00 . A A . 4 LEU HG 1 1 5 1396 1 1 4 LEU N N -4.088 -2.720 -4.163 1.00 . A A . 4 LEU N 1 1 5 1397 1 1 4 LEU O O -3.621 -0.014 -5.630 1.00 . A A . 4 LEU O 1 1 5 1398 1 1 5 SER C C -1.015 -0.510 -7.217 1.00 . A A . 5 SER C 1 1 5 1399 1 1 5 SER CA C -0.884 -1.429 -6.029 1.00 . A A . 5 SER CA 1 1 5 1400 1 1 5 SER CB C -0.340 -2.768 -6.406 1.00 . A A . 5 SER CB 1 1 5 1401 1 1 5 SER H H -1.977 -2.463 -4.643 1.00 . A A . 5 SER H 1 1 5 1402 1 1 5 SER HA H -0.162 -0.966 -5.368 1.00 . A A . 5 SER HA 1 1 5 1403 1 1 5 SER HB2 H 0.750 -2.755 -6.211 1.00 . A A . 5 SER HB2 1 1 5 1404 1 1 5 SER HB3 H -0.833 -3.515 -5.721 1.00 . A A . 5 SER HB3 1 1 5 1405 1 1 5 SER HG H -0.235 -2.400 -8.297 1.00 . A A . 5 SER HG 1 1 5 1406 1 1 5 SER N N -2.042 -1.630 -5.168 1.00 . A A . 5 SER N 1 1 5 1407 1 1 5 SER O O -0.070 -0.283 -7.961 1.00 . A A . 5 SER O 1 1 5 1408 1 1 5 SER OG O -0.596 -3.117 -7.764 1.00 . A A . 5 SER OG 1 1 5 1409 1 1 6 LYS C C -2.088 2.176 -7.296 1.00 . A A . 6 LYS C 1 1 5 1410 1 1 6 LYS CA C -2.358 1.072 -8.317 1.00 . A A . 6 LYS CA 1 1 5 1411 1 1 6 LYS CB C -3.775 1.251 -8.887 1.00 . A A . 6 LYS CB 1 1 5 1412 1 1 6 LYS CD C -3.409 -0.224 -10.936 1.00 . A A . 6 LYS CD 1 1 5 1413 1 1 6 LYS CE C -3.927 -1.407 -11.756 1.00 . A A . 6 LYS CE 1 1 5 1414 1 1 6 LYS CG C -4.258 0.037 -9.687 1.00 . A A . 6 LYS CG 1 1 5 1415 1 1 6 LYS H H -3.011 -0.349 -6.987 1.00 . A A . 6 LYS H 1 1 5 1416 1 1 6 LYS HA H -1.590 1.062 -9.082 1.00 . A A . 6 LYS HA 1 1 5 1417 1 1 6 LYS HB2 H -4.479 1.440 -8.047 1.00 . A A . 6 LYS HB2 1 1 5 1418 1 1 6 LYS HB3 H -3.780 2.144 -9.547 1.00 . A A . 6 LYS HB3 1 1 5 1419 1 1 6 LYS HD2 H -3.410 0.686 -11.572 1.00 . A A . 6 LYS HD2 1 1 5 1420 1 1 6 LYS HD3 H -2.361 -0.427 -10.627 1.00 . A A . 6 LYS HD3 1 1 5 1421 1 1 6 LYS HE2 H -3.913 -2.338 -11.151 1.00 . A A . 6 LYS HE2 1 1 5 1422 1 1 6 LYS HE3 H -4.961 -1.213 -12.112 1.00 . A A . 6 LYS HE3 1 1 5 1423 1 1 6 LYS HG2 H -4.229 -0.863 -9.036 1.00 . A A . 6 LYS HG2 1 1 5 1424 1 1 6 LYS HG3 H -5.313 0.203 -9.994 1.00 . A A . 6 LYS HG3 1 1 5 1425 1 1 6 LYS HZ1 H -3.030 -0.752 -13.506 1.00 . A A . 6 LYS HZ1 1 1 5 1426 1 1 6 LYS HZ2 H -3.463 -2.394 -13.519 1.00 . A A . 6 LYS HZ2 1 1 5 1427 1 1 6 LYS HZ3 H -2.109 -1.879 -12.633 1.00 . A A . 6 LYS HZ3 1 1 5 1428 1 1 6 LYS N N -2.186 -0.019 -7.449 1.00 . A A . 6 LYS N 1 1 5 1429 1 1 6 LYS NZ N -3.068 -1.625 -12.942 1.00 . A A . 6 LYS NZ 1 1 5 1430 1 1 6 LYS O O -2.217 3.364 -7.565 1.00 . A A . 6 LYS O 1 1 5 1431 1 1 7 PHE C C -0.305 2.655 -4.328 1.00 . A A . 7 PHE C 1 1 5 1432 1 1 7 PHE CA C -1.600 2.391 -4.839 1.00 . A A . 7 PHE CA 1 1 5 1433 1 1 7 PHE CB C -2.049 1.500 -3.718 1.00 . A A . 7 PHE CB 1 1 5 1434 1 1 7 PHE CD1 C -3.585 1.580 -1.902 1.00 . A A . 7 PHE CD1 1 1 5 1435 1 1 7 PHE CD2 C -1.548 2.735 -1.813 1.00 . A A . 7 PHE CD2 1 1 5 1436 1 1 7 PHE CE1 C -3.778 1.872 -0.608 1.00 . A A . 7 PHE CE1 1 1 5 1437 1 1 7 PHE CE2 C -1.686 3.074 -0.589 1.00 . A A . 7 PHE CE2 1 1 5 1438 1 1 7 PHE CG C -2.489 2.017 -2.493 1.00 . A A . 7 PHE CG 1 1 5 1439 1 1 7 PHE CZ C -2.824 2.645 0.095 1.00 . A A . 7 PHE CZ 1 1 5 1440 1 1 7 PHE H H -1.649 0.671 -5.838 1.00 . A A . 7 PHE H 1 1 5 1441 1 1 7 PHE HA H -2.205 3.253 -4.826 1.00 . A A . 7 PHE HA 1 1 5 1442 1 1 7 PHE HB2 H -2.969 1.075 -4.073 1.00 . A A . 7 PHE HB2 1 1 5 1443 1 1 7 PHE HB3 H -1.372 0.659 -3.511 1.00 . A A . 7 PHE HB3 1 1 5 1444 1 1 7 PHE HD1 H -4.306 0.981 -2.468 1.00 . A A . 7 PHE HD1 1 1 5 1445 1 1 7 PHE HD2 H -0.666 3.071 -2.296 1.00 . A A . 7 PHE HD2 1 1 5 1446 1 1 7 PHE HE1 H -4.637 1.467 -0.148 1.00 . A A . 7 PHE HE1 1 1 5 1447 1 1 7 PHE HE2 H -0.845 3.640 -0.165 1.00 . A A . 7 PHE HE2 1 1 5 1448 1 1 7 PHE HZ H -2.968 2.887 1.138 1.00 . A A . 7 PHE HZ 1 1 5 1449 1 1 7 PHE N N -1.839 1.678 -6.012 1.00 . A A . 7 PHE N 1 1 5 1450 1 1 7 PHE O O 0.059 3.778 -4.157 1.00 . A A . 7 PHE O 1 1 5 1451 1 1 8 PHE C C 2.408 1.757 -3.968 1.00 . A A . 8 PHE C 1 1 5 1452 1 1 8 PHE CA C 1.425 1.696 -3.050 1.00 . A A . 8 PHE CA 1 1 5 1453 1 1 8 PHE CB C 1.965 0.516 -2.313 1.00 . A A . 8 PHE CB 1 1 5 1454 1 1 8 PHE CD1 C 2.545 -1.410 -3.282 1.00 . A A . 8 PHE CD1 1 1 5 1455 1 1 8 PHE CD2 C 0.335 -1.045 -2.741 1.00 . A A . 8 PHE CD2 1 1 5 1456 1 1 8 PHE CE1 C 2.284 -2.529 -3.813 1.00 . A A . 8 PHE CE1 1 1 5 1457 1 1 8 PHE CE2 C 0.038 -2.195 -3.273 1.00 . A A . 8 PHE CE2 1 1 5 1458 1 1 8 PHE CG C 1.568 -0.679 -2.753 1.00 . A A . 8 PHE CG 1 1 5 1459 1 1 8 PHE CZ C 1.017 -2.949 -3.824 1.00 . A A . 8 PHE CZ 1 1 5 1460 1 1 8 PHE H H 0.058 0.650 -4.114 1.00 . A A . 8 PHE H 1 1 5 1461 1 1 8 PHE HA H 1.395 2.575 -2.534 1.00 . A A . 8 PHE HA 1 1 5 1462 1 1 8 PHE HB2 H 3.038 0.493 -2.282 1.00 . A A . 8 PHE HB2 1 1 5 1463 1 1 8 PHE HB3 H 1.547 0.552 -1.308 1.00 . A A . 8 PHE HB3 1 1 5 1464 1 1 8 PHE HD1 H 3.565 -1.049 -3.265 1.00 . A A . 8 PHE HD1 1 1 5 1465 1 1 8 PHE HD2 H -0.409 -0.421 -2.282 1.00 . A A . 8 PHE HD2 1 1 5 1466 1 1 8 PHE HE1 H 3.069 -3.063 -4.244 1.00 . A A . 8 PHE HE1 1 1 5 1467 1 1 8 PHE HE2 H -0.954 -2.485 -3.304 1.00 . A A . 8 PHE HE2 1 1 5 1468 1 1 8 PHE HZ H 0.792 -3.833 -4.252 1.00 . A A . 8 PHE HZ 1 1 5 1469 1 1 8 PHE N N 0.335 1.560 -3.893 1.00 . A A . 8 PHE N 1 1 5 1470 1 1 8 PHE O O 3.269 2.494 -3.881 1.00 . A A . 8 PHE O 1 1 5 1471 1 1 9 ARG C C 2.885 2.081 -6.689 1.00 . A A . 9 ARG C 1 1 5 1472 1 1 9 ARG CA C 3.015 0.834 -6.004 1.00 . A A . 9 ARG CA 1 1 5 1473 1 1 9 ARG CB C 2.574 -0.282 -6.891 1.00 . A A . 9 ARG CB 1 1 5 1474 1 1 9 ARG CD C 4.702 -1.583 -7.331 1.00 . A A . 9 ARG CD 1 1 5 1475 1 1 9 ARG CG C 3.328 -1.581 -6.662 1.00 . A A . 9 ARG CG 1 1 5 1476 1 1 9 ARG CZ C 4.294 -2.692 -9.524 1.00 . A A . 9 ARG CZ 1 1 5 1477 1 1 9 ARG H H 1.344 0.442 -4.984 1.00 . A A . 9 ARG H 1 1 5 1478 1 1 9 ARG HA H 3.965 0.721 -5.629 1.00 . A A . 9 ARG HA 1 1 5 1479 1 1 9 ARG HB2 H 1.494 -0.449 -6.630 1.00 . A A . 9 ARG HB2 1 1 5 1480 1 1 9 ARG HB3 H 2.646 0.036 -7.946 1.00 . A A . 9 ARG HB3 1 1 5 1481 1 1 9 ARG HD2 H 5.279 -0.684 -7.026 1.00 . A A . 9 ARG HD2 1 1 5 1482 1 1 9 ARG HD3 H 5.270 -2.500 -7.070 1.00 . A A . 9 ARG HD3 1 1 5 1483 1 1 9 ARG HE H 4.560 -0.666 -9.293 1.00 . A A . 9 ARG HE 1 1 5 1484 1 1 9 ARG HG2 H 3.465 -1.721 -5.580 1.00 . A A . 9 ARG HG2 1 1 5 1485 1 1 9 ARG HG3 H 2.723 -2.427 -7.051 1.00 . A A . 9 ARG HG3 1 1 5 1486 1 1 9 ARG HH11 H 4.372 -3.943 -7.896 1.00 . A A . 9 ARG HH11 1 1 5 1487 1 1 9 ARG HH12 H 4.077 -4.734 -9.407 1.00 . A A . 9 ARG HH12 1 1 5 1488 1 1 9 ARG HH21 H 4.160 -1.746 -11.342 1.00 . A A . 9 ARG HH21 1 1 5 1489 1 1 9 ARG HH22 H 3.955 -3.464 -11.398 1.00 . A A . 9 ARG HH22 1 1 5 1490 1 1 9 ARG N N 2.183 0.946 -4.940 1.00 . A A . 9 ARG N 1 1 5 1491 1 1 9 ARG NE N 4.520 -1.542 -8.815 1.00 . A A . 9 ARG NE 1 1 5 1492 1 1 9 ARG NH1 N 4.243 -3.898 -8.886 1.00 . A A . 9 ARG NH1 1 1 5 1493 1 1 9 ARG NH2 N 4.121 -2.629 -10.875 1.00 . A A . 9 ARG NH2 1 1 5 1494 1 1 9 ARG O O 3.482 2.325 -7.738 1.00 . A A . 9 ARG O 1 1 5 1495 1 1 10 ASP C C 1.845 5.155 -5.736 1.00 . A A . 10 ASP C 1 1 5 1496 1 1 10 ASP CA C 1.656 4.035 -6.676 1.00 . A A . 10 ASP CA 1 1 5 1497 1 1 10 ASP CB C 0.367 4.019 -7.248 1.00 . A A . 10 ASP CB 1 1 5 1498 1 1 10 ASP CG C 0.166 5.010 -8.391 1.00 . A A . 10 ASP CG 1 1 5 1499 1 1 10 ASP H H 1.444 2.564 -5.295 1.00 . A A . 10 ASP H 1 1 5 1500 1 1 10 ASP HA H 2.367 4.123 -7.391 1.00 . A A . 10 ASP HA 1 1 5 1501 1 1 10 ASP HB2 H 0.273 2.978 -7.602 1.00 . A A . 10 ASP HB2 1 1 5 1502 1 1 10 ASP HB3 H -0.334 4.207 -6.434 1.00 . A A . 10 ASP HB3 1 1 5 1503 1 1 10 ASP N N 1.917 2.823 -6.169 1.00 . A A . 10 ASP N 1 1 5 1504 1 1 10 ASP O O 1.696 6.308 -6.147 1.00 . A A . 10 ASP O 1 1 5 1505 1 1 10 ASP OD1 O 0.955 4.950 -9.370 1.00 . A A . 10 ASP OD1 1 1 5 1506 1 1 10 ASP OD2 O -0.777 5.841 -8.297 1.00 . A A . 10 ASP OD2 1 1 5 1507 1 1 11 . C C 2.219 6.019 -2.160 1.00 . A A . 11 DPN C 1 1 5 1508 1 1 11 . CA C 2.359 6.107 -3.649 1.00 . A A . 11 DPN CA 1 1 5 1509 1 1 11 . CB C 3.765 6.596 -3.918 1.00 . A A . 11 DPN CB 1 1 5 1510 1 1 11 . CD1 C 4.368 5.648 -6.073 1.00 . A A . 11 DPN CD1 1 1 5 1511 1 1 11 . CD2 C 4.799 4.660 -4.013 1.00 . A A . 11 DPN CD2 1 1 5 1512 1 1 11 . CE1 C 4.655 4.484 -6.641 1.00 . A A . 11 DPN CE1 1 1 5 1513 1 1 11 . CE2 C 5.149 3.594 -4.553 1.00 . A A . 11 DPN CE2 1 1 5 1514 1 1 11 . CG C 4.427 5.683 -4.718 1.00 . A A . 11 DPN CG 1 1 5 1515 1 1 11 . CZ C 5.045 3.473 -5.822 1.00 . A A . 11 DPN CZ 1 1 5 1516 1 1 11 . H H 2.246 3.959 -4.049 1.00 . A A . 11 DPN H 1 1 5 1517 1 1 11 . HA H 1.688 6.815 -3.970 1.00 . A A . 11 DPN HA 1 1 5 1518 1 1 11 . HB2 H 4.305 6.571 -2.978 1.00 . A A . 11 DPN HB2 1 1 5 1519 1 1 11 . HB3 H 3.771 7.529 -4.409 1.00 . A A . 11 DPN HB3 1 1 5 1520 1 1 11 . HD1 H 4.058 6.507 -6.653 1.00 . A A . 11 DPN HD1 1 1 5 1521 1 1 11 . HD2 H 4.889 4.762 -2.986 1.00 . A A . 11 DPN HD2 1 1 5 1522 1 1 11 . HE1 H 4.593 4.347 -7.707 1.00 . A A . 11 DPN HE1 1 1 5 1523 1 1 11 . HE2 H 5.397 2.764 -3.959 1.00 . A A . 11 DPN HE2 1 1 5 1524 1 1 11 . HZ H 5.167 2.586 -6.157 1.00 . A A . 11 DPN HZ 1 1 5 1525 1 1 11 . N N 2.123 4.909 -4.440 1.00 . A A . 11 DPN N 1 1 5 1526 1 1 11 . O O 1.238 6.482 -1.583 1.00 . A A . 11 DPN O 1 1 5 1527 1 1 12 ILE C C 4.743 4.762 0.153 1.00 . A A . 12 ILE C 1 1 5 1528 1 1 12 ILE CA C 3.382 5.388 -0.103 1.00 . A A . 12 ILE CA 1 1 5 1529 1 1 12 ILE CB C 2.323 4.590 0.584 1.00 . A A . 12 ILE CB 1 1 5 1530 1 1 12 ILE CD1 C 2.818 2.831 -0.910 1.00 . A A . 12 ILE CD1 1 1 5 1531 1 1 12 ILE CG1 C 1.731 3.654 -0.420 1.00 . A A . 12 ILE CG1 1 1 5 1532 1 1 12 ILE CG2 C 1.291 5.535 1.223 1.00 . A A . 12 ILE CG2 1 1 5 1533 1 1 12 ILE H H 3.894 4.902 -2.028 1.00 . A A . 12 ILE H 1 1 5 1534 1 1 12 ILE HA H 3.395 6.365 0.249 1.00 . A A . 12 ILE HA 1 1 5 1535 1 1 12 ILE HB H 2.798 3.979 1.363 1.00 . A A . 12 ILE HB 1 1 5 1536 1 1 12 ILE HD11 H 3.705 3.037 -0.347 1.00 . A A . 12 ILE HD11 1 1 5 1537 1 1 12 ILE HD12 H 3.024 3.079 -1.990 1.00 . A A . 12 ILE HD12 1 1 5 1538 1 1 12 ILE HD13 H 2.581 1.788 -0.785 1.00 . A A . 12 ILE HD13 1 1 5 1539 1 1 12 ILE HG12 H 0.954 3.015 0.033 1.00 . A A . 12 ILE HG12 1 1 5 1540 1 1 12 ILE HG13 H 1.310 4.206 -1.286 1.00 . A A . 12 ILE HG13 1 1 5 1541 1 1 12 ILE HG21 H 0.264 5.145 1.066 1.00 . A A . 12 ILE HG21 1 1 5 1542 1 1 12 ILE HG22 H 1.357 6.547 0.766 1.00 . A A . 12 ILE HG22 1 1 5 1543 1 1 12 ILE HG23 H 1.473 5.625 2.315 1.00 . A A . 12 ILE HG23 1 1 5 1544 1 1 12 ILE N N 3.245 5.434 -1.529 1.00 . A A . 12 ILE N 1 1 5 1545 1 1 12 ILE O O 5.134 4.529 1.282 1.00 . A A . 12 ILE O 1 1 5 1546 1 1 13 LEU C C 7.741 4.579 -1.499 1.00 . A A . 13 LEU C 1 1 5 1547 1 1 13 LEU CA C 6.709 3.694 -0.938 1.00 . A A . 13 LEU CA 1 1 5 1548 1 1 13 LEU CB C 6.711 2.508 -1.881 1.00 . A A . 13 LEU CB 1 1 5 1549 1 1 13 LEU CD1 C 5.404 0.665 -2.848 1.00 . A A . 13 LEU CD1 1 1 5 1550 1 1 13 LEU CD2 C 5.197 1.351 -0.355 1.00 . A A . 13 LEU CD2 1 1 5 1551 1 1 13 LEU CG C 5.439 1.776 -1.802 1.00 . A A . 13 LEU CG 1 1 5 1552 1 1 13 LEU H H 4.998 4.415 -1.877 1.00 . A A . 13 LEU H 1 1 5 1553 1 1 13 LEU HA H 6.944 3.400 0.062 1.00 . A A . 13 LEU HA 1 1 5 1554 1 1 13 LEU HB2 H 6.819 2.868 -2.920 1.00 . A A . 13 LEU HB2 1 1 5 1555 1 1 13 LEU HB3 H 7.538 1.822 -1.643 1.00 . A A . 13 LEU HB3 1 1 5 1556 1 1 13 LEU HD11 H 4.714 0.963 -3.682 1.00 . A A . 13 LEU HD11 1 1 5 1557 1 1 13 LEU HD12 H 5.054 -0.286 -2.406 1.00 . A A . 13 LEU HD12 1 1 5 1558 1 1 13 LEU HD13 H 6.414 0.526 -3.278 1.00 . A A . 13 LEU HD13 1 1 5 1559 1 1 13 LEU HD21 H 5.993 0.670 -0.009 1.00 . A A . 13 LEU HD21 1 1 5 1560 1 1 13 LEU HD22 H 4.212 0.852 -0.258 1.00 . A A . 13 LEU HD22 1 1 5 1561 1 1 13 LEU HD23 H 5.202 2.277 0.297 1.00 . A A . 13 LEU HD23 1 1 5 1562 1 1 13 LEU HG H 4.655 2.505 -2.085 1.00 . A A . 13 LEU HG 1 1 5 1563 1 1 13 LEU N N 5.418 4.356 -0.968 1.00 . A A . 13 LEU N 1 1 5 1564 1 1 13 LEU O O 8.806 4.767 -0.937 1.00 . A A . 13 LEU O 1 1 5 1565 1 1 14 GLN C C 8.482 7.171 -2.487 1.00 . A A . 14 GLN C 1 1 5 1566 1 1 14 GLN CA C 8.405 5.986 -3.336 1.00 . A A . 14 GLN CA 1 1 5 1567 1 1 14 GLN CB C 7.990 6.488 -4.716 1.00 . A A . 14 GLN CB 1 1 5 1568 1 1 14 GLN CD C 8.647 4.266 -5.519 1.00 . A A . 14 GLN CD 1 1 5 1569 1 1 14 GLN CG C 7.623 5.363 -5.625 1.00 . A A . 14 GLN CG 1 1 5 1570 1 1 14 GLN H H 6.577 4.904 -3.175 1.00 . A A . 14 GLN H 1 1 5 1571 1 1 14 GLN HA H 9.357 5.490 -3.364 1.00 . A A . 14 GLN HA 1 1 5 1572 1 1 14 GLN HB2 H 7.101 7.145 -4.604 1.00 . A A . 14 GLN HB2 1 1 5 1573 1 1 14 GLN HB3 H 8.811 7.073 -5.167 1.00 . A A . 14 GLN HB3 1 1 5 1574 1 1 14 GLN HE21 H 7.287 3.229 -4.427 1.00 . A A . 14 GLN HE21 1 1 5 1575 1 1 14 GLN HE22 H 8.811 2.422 -4.673 1.00 . A A . 14 GLN HE22 1 1 5 1576 1 1 14 GLN HG2 H 6.658 4.975 -5.289 1.00 . A A . 14 GLN HG2 1 1 5 1577 1 1 14 GLN HG3 H 7.545 5.710 -6.669 1.00 . A A . 14 GLN HG3 1 1 5 1578 1 1 14 GLN N N 7.447 5.112 -2.692 1.00 . A A . 14 GLN N 1 1 5 1579 1 1 14 GLN NE2 N 8.220 3.206 -4.817 1.00 . A A . 14 GLN NE2 1 1 5 1580 1 1 14 GLN O O 9.437 7.944 -2.523 1.00 . A A . 14 GLN O 1 1 5 1581 1 1 14 GLN OE1 O 9.777 4.370 -5.982 1.00 . A A . 14 GLN OE1 1 1 5 1582 1 1 15 ARG C C 7.673 7.911 0.539 1.00 . A A . 15 ARG C 1 1 5 1583 1 1 15 ARG CA C 7.373 8.439 -0.826 1.00 . A A . 15 ARG CA 1 1 5 1584 1 1 15 ARG CB C 5.993 9.094 -0.739 1.00 . A A . 15 ARG CB 1 1 5 1585 1 1 15 ARG CD C 3.694 8.648 -1.598 1.00 . A A . 15 ARG CD 1 1 5 1586 1 1 15 ARG CG C 5.149 8.867 -1.979 1.00 . A A . 15 ARG CG 1 1 5 1587 1 1 15 ARG CZ C 2.657 10.911 -1.697 1.00 . A A . 15 ARG CZ 1 1 5 1588 1 1 15 ARG H H 6.668 6.646 -1.670 1.00 . A A . 15 ARG H 1 1 5 1589 1 1 15 ARG HA H 8.119 9.127 -1.158 1.00 . A A . 15 ARG HA 1 1 5 1590 1 1 15 ARG HB2 H 5.451 8.692 0.142 1.00 . A A . 15 ARG HB2 1 1 5 1591 1 1 15 ARG HB3 H 6.121 10.186 -0.590 1.00 . A A . 15 ARG HB3 1 1 5 1592 1 1 15 ARG HD2 H 3.079 8.424 -2.492 1.00 . A A . 15 ARG HD2 1 1 5 1593 1 1 15 ARG HD3 H 3.618 7.801 -0.871 1.00 . A A . 15 ARG HD3 1 1 5 1594 1 1 15 ARG HE H 3.194 9.967 0.054 1.00 . A A . 15 ARG HE 1 1 5 1595 1 1 15 ARG HG2 H 5.235 9.738 -2.659 1.00 . A A . 15 ARG HG2 1 1 5 1596 1 1 15 ARG HG3 H 5.516 7.964 -2.516 1.00 . A A . 15 ARG HG3 1 1 5 1597 1 1 15 ARG HH11 H 2.957 9.991 -3.510 1.00 . A A . 15 ARG HH11 1 1 5 1598 1 1 15 ARG HH12 H 2.240 11.564 -3.603 1.00 . A A . 15 ARG HH12 1 1 5 1599 1 1 15 ARG HH21 H 2.217 12.102 -0.082 1.00 . A A . 15 ARG HH21 1 1 5 1600 1 1 15 ARG HH22 H 1.813 12.783 -1.622 1.00 . A A . 15 ARG HH22 1 1 5 1601 1 1 15 ARG N N 7.431 7.321 -1.691 1.00 . A A . 15 ARG N 1 1 5 1602 1 1 15 ARG NE N 3.168 9.886 -0.947 1.00 . A A . 15 ARG NE 1 1 5 1603 1 1 15 ARG NH1 N 2.615 10.814 -3.058 1.00 . A A . 15 ARG NH1 1 1 5 1604 1 1 15 ARG NH2 N 2.187 12.032 -1.079 1.00 . A A . 15 ARG NH2 1 1 5 1605 1 1 15 ARG O O 8.183 8.617 1.405 1.00 . A A . 15 ARG O 1 1 5 1606 1 1 16 LYS C C 6.413 6.322 2.931 1.00 . A A . 16 LYS C 1 1 5 1607 1 1 16 LYS CA C 7.464 5.899 1.952 1.00 . A A . 16 LYS CA 1 1 5 1608 1 1 16 LYS CB C 8.820 6.078 2.619 1.00 . A A . 16 LYS CB 1 1 5 1609 1 1 16 LYS CD C 9.926 4.013 1.640 1.00 . A A . 16 LYS CD 1 1 5 1610 1 1 16 LYS CE C 11.144 3.447 0.907 1.00 . A A . 16 LYS CE 1 1 5 1611 1 1 16 LYS CG C 9.990 5.534 1.797 1.00 . A A . 16 LYS CG 1 1 5 1612 1 1 16 LYS H H 6.903 6.091 -0.011 1.00 . A A . 16 LYS H 1 1 5 1613 1 1 16 LYS HA H 7.292 4.861 1.701 1.00 . A A . 16 LYS HA 1 1 5 1614 1 1 16 LYS HB2 H 8.965 7.158 2.786 1.00 . A A . 16 LYS HB2 1 1 5 1615 1 1 16 LYS HB3 H 8.803 5.575 3.603 1.00 . A A . 16 LYS HB3 1 1 5 1616 1 1 16 LYS HD2 H 9.856 3.546 2.644 1.00 . A A . 16 LYS HD2 1 1 5 1617 1 1 16 LYS HD3 H 9.004 3.749 1.073 1.00 . A A . 16 LYS HD3 1 1 5 1618 1 1 16 LYS HE2 H 11.216 3.872 -0.117 1.00 . A A . 16 LYS HE2 1 1 5 1619 1 1 16 LYS HE3 H 12.077 3.672 1.466 1.00 . A A . 16 LYS HE3 1 1 5 1620 1 1 16 LYS HG2 H 9.980 6.006 0.791 1.00 . A A . 16 LYS HG2 1 1 5 1621 1 1 16 LYS HG3 H 10.944 5.810 2.297 1.00 . A A . 16 LYS HG3 1 1 5 1622 1 1 16 LYS HZ1 H 10.878 1.727 -0.217 1.00 . A A . 16 LYS HZ1 1 1 5 1623 1 1 16 LYS HZ2 H 10.227 1.642 1.350 1.00 . A A . 16 LYS HZ2 1 1 5 1624 1 1 16 LYS HZ3 H 11.906 1.531 1.119 1.00 . A A . 16 LYS HZ3 1 1 5 1625 1 1 16 LYS N N 7.299 6.619 0.723 1.00 . A A . 16 LYS N 1 1 5 1626 1 1 16 LYS NZ N 11.030 1.977 0.780 1.00 . A A . 16 LYS NZ 1 1 5 1627 1 1 16 LYS O O 6.474 5.980 4.112 1.00 . A A . 16 LYS O 1 1 5 1628 1 1 17 LYS C C 3.273 8.187 2.500 1.00 . A A . 17 LYS C 1 1 5 1629 1 1 17 LYS CA C 4.346 7.481 3.326 1.00 . A A . 17 LYS CA 1 1 5 1630 1 1 17 LYS CB C 4.789 8.444 4.449 1.00 . A A . 17 LYS CB 1 1 5 1631 1 1 17 LYS CD C 5.287 10.764 3.499 1.00 . A A . 17 LYS CD 1 1 5 1632 1 1 17 LYS CE C 6.212 11.453 2.498 1.00 . A A . 17 LYS CE 1 1 5 1633 1 1 17 LYS CG C 5.868 9.440 4.008 1.00 . A A . 17 LYS CG 1 1 5 1634 1 1 17 LYS H H 5.382 7.362 1.510 1.00 . A A . 17 LYS H 1 1 5 1635 1 1 17 LYS HA H 3.921 6.585 3.740 1.00 . A A . 17 LYS HA 1 1 5 1636 1 1 17 LYS HB2 H 3.904 9.005 4.813 1.00 . A A . 17 LYS HB2 1 1 5 1637 1 1 17 LYS HB3 H 5.184 7.844 5.291 1.00 . A A . 17 LYS HB3 1 1 5 1638 1 1 17 LYS HD2 H 4.307 10.572 3.013 1.00 . A A . 17 LYS HD2 1 1 5 1639 1 1 17 LYS HD3 H 5.115 11.442 4.363 1.00 . A A . 17 LYS HD3 1 1 5 1640 1 1 17 LYS HE2 H 7.191 11.687 2.968 1.00 . A A . 17 LYS HE2 1 1 5 1641 1 1 17 LYS HE3 H 6.374 10.802 1.611 1.00 . A A . 17 LYS HE3 1 1 5 1642 1 1 17 LYS HG2 H 6.536 9.649 4.870 1.00 . A A . 17 LYS HG2 1 1 5 1643 1 1 17 LYS HG3 H 6.483 8.983 3.208 1.00 . A A . 17 LYS HG3 1 1 5 1644 1 1 17 LYS HZ1 H 5.205 12.585 1.086 1.00 . A A . 17 LYS HZ1 1 1 5 1645 1 1 17 LYS HZ2 H 6.349 13.457 1.990 1.00 . A A . 17 LYS HZ2 1 1 5 1646 1 1 17 LYS HZ3 H 4.868 13.017 2.693 1.00 . A A . 17 LYS HZ3 1 1 5 1647 1 1 17 LYS N N 5.411 7.066 2.453 1.00 . A A . 17 LYS N 1 1 5 1648 1 1 17 LYS NZ N 5.613 12.722 2.032 1.00 . A A . 17 LYS NZ 1 1 5 1649 1 1 17 LYS O O 2.073 8.081 2.874 1.00 . A A . 17 LYS O 1 1 5 1650 1 1 17 LYS OXT O 3.636 8.847 1.501 1.00 . A A . 17 LYS OXT 1 1 6 1651 1 1 1 GLU C C -1.881 -8.653 -3.766 1.00 . A A . 1 GLU C 1 1 6 1652 1 1 1 GLU CA C -1.150 -9.636 -4.637 1.00 . A A . 1 GLU CA 1 1 6 1653 1 1 1 GLU CB C 0.358 -9.316 -4.588 1.00 . A A . 1 GLU CB 1 1 6 1654 1 1 1 GLU CD C 2.455 -9.194 -3.237 1.00 . A A . 1 GLU CD 1 1 6 1655 1 1 1 GLU CG C 0.957 -9.476 -3.179 1.00 . A A . 1 GLU CG 1 1 6 1656 1 1 1 GLU H1 H -0.957 -9.031 -6.620 1.00 . A A . 1 GLU H1 1 1 6 1657 1 1 1 GLU H2 H -2.563 -9.080 -6.063 1.00 . A A . 1 GLU H2 1 1 6 1658 1 1 1 GLU H3 H -1.743 -10.524 -6.424 1.00 . A A . 1 GLU H3 1 1 6 1659 1 1 1 GLU HA H -1.335 -10.637 -4.280 1.00 . A A . 1 GLU HA 1 1 6 1660 1 1 1 GLU HB2 H 0.892 -9.994 -5.291 1.00 . A A . 1 GLU HB2 1 1 6 1661 1 1 1 GLU HB3 H 0.519 -8.271 -4.932 1.00 . A A . 1 GLU HB3 1 1 6 1662 1 1 1 GLU HG2 H 0.474 -8.764 -2.474 1.00 . A A . 1 GLU HG2 1 1 6 1663 1 1 1 GLU HG3 H 0.798 -10.511 -2.811 1.00 . A A . 1 GLU HG3 1 1 6 1664 1 1 1 GLU N N -1.640 -9.562 -6.041 1.00 . A A . 1 GLU N 1 1 6 1665 1 1 1 GLU O O -2.230 -8.959 -2.627 1.00 . A A . 1 GLU O 1 1 6 1666 1 1 1 GLU OE1 O 2.961 -8.878 -4.347 1.00 . A A . 1 GLU OE1 1 1 6 1667 1 1 1 GLU OE2 O 3.111 -9.288 -2.167 1.00 . A A . 1 GLU OE2 1 1 6 1668 1 1 2 MET C C -3.841 -5.812 -4.418 1.00 . A A . 2 MET C 1 1 6 1669 1 1 2 MET CA C -2.821 -6.430 -3.535 1.00 . A A . 2 MET CA 1 1 6 1670 1 1 2 MET CB C -1.906 -5.332 -2.962 1.00 . A A . 2 MET CB 1 1 6 1671 1 1 2 MET CE C -4.117 -5.328 -0.908 1.00 . A A . 2 MET CE 1 1 6 1672 1 1 2 MET CG C -1.508 -5.535 -1.489 1.00 . A A . 2 MET CG 1 1 6 1673 1 1 2 MET H H -1.860 -7.190 -5.224 1.00 . A A . 2 MET H 1 1 6 1674 1 1 2 MET HA H -3.357 -6.909 -2.744 1.00 . A A . 2 MET HA 1 1 6 1675 1 1 2 MET HB2 H -0.979 -5.305 -3.571 1.00 . A A . 2 MET HB2 1 1 6 1676 1 1 2 MET HB3 H -2.403 -4.339 -3.056 1.00 . A A . 2 MET HB3 1 1 6 1677 1 1 2 MET HE1 H -4.559 -4.862 -0.004 1.00 . A A . 2 MET HE1 1 1 6 1678 1 1 2 MET HE2 H -4.919 -5.888 -1.437 1.00 . A A . 2 MET HE2 1 1 6 1679 1 1 2 MET HE3 H -3.770 -4.519 -1.581 1.00 . A A . 2 MET HE3 1 1 6 1680 1 1 2 MET HG2 H -0.542 -6.080 -1.458 1.00 . A A . 2 MET HG2 1 1 6 1681 1 1 2 MET HG3 H -1.336 -4.527 -1.055 1.00 . A A . 2 MET HG3 1 1 6 1682 1 1 2 MET N N -2.129 -7.436 -4.296 1.00 . A A . 2 MET N 1 1 6 1683 1 1 2 MET O O -4.002 -6.179 -5.580 1.00 . A A . 2 MET O 1 1 6 1684 1 1 2 MET SD S -2.739 -6.420 -0.473 1.00 . A A . 2 MET SD 1 1 6 1685 1 1 3 ARG C C -5.330 -2.783 -4.550 1.00 . A A . 3 ARG C 1 1 6 1686 1 1 3 ARG CA C -5.609 -4.199 -4.509 1.00 . A A . 3 ARG CA 1 1 6 1687 1 1 3 ARG CB C -6.859 -4.363 -3.687 1.00 . A A . 3 ARG CB 1 1 6 1688 1 1 3 ARG CD C -8.525 -2.654 -4.400 1.00 . A A . 3 ARG CD 1 1 6 1689 1 1 3 ARG CG C -8.129 -4.124 -4.474 1.00 . A A . 3 ARG CG 1 1 6 1690 1 1 3 ARG CZ C -10.304 -1.293 -3.335 1.00 . A A . 3 ARG CZ 1 1 6 1691 1 1 3 ARG H H -4.367 -4.486 -2.944 1.00 . A A . 3 ARG H 1 1 6 1692 1 1 3 ARG HA H -5.697 -4.566 -5.463 1.00 . A A . 3 ARG HA 1 1 6 1693 1 1 3 ARG HB2 H -6.861 -5.383 -3.250 1.00 . A A . 3 ARG HB2 1 1 6 1694 1 1 3 ARG HB3 H -6.801 -3.621 -2.848 1.00 . A A . 3 ARG HB3 1 1 6 1695 1 1 3 ARG HD2 H -7.704 -2.069 -3.918 1.00 . A A . 3 ARG HD2 1 1 6 1696 1 1 3 ARG HD3 H -8.737 -2.249 -5.411 1.00 . A A . 3 ARG HD3 1 1 6 1697 1 1 3 ARG HE H -10.183 -3.339 -3.175 1.00 . A A . 3 ARG HE 1 1 6 1698 1 1 3 ARG HG2 H -7.962 -4.413 -5.532 1.00 . A A . 3 ARG HG2 1 1 6 1699 1 1 3 ARG HG3 H -8.945 -4.752 -4.060 1.00 . A A . 3 ARG HG3 1 1 6 1700 1 1 3 ARG HH11 H -8.904 -0.263 -4.432 1.00 . A A . 3 ARG HH11 1 1 6 1701 1 1 3 ARG HH12 H -10.127 0.724 -3.702 1.00 . A A . 3 ARG HH12 1 1 6 1702 1 1 3 ARG HH21 H -11.848 -2.000 -2.180 1.00 . A A . 3 ARG HH21 1 1 6 1703 1 1 3 ARG HH22 H -11.830 -0.282 -2.399 1.00 . A A . 3 ARG HH22 1 1 6 1704 1 1 3 ARG N N -4.552 -4.833 -3.850 1.00 . A A . 3 ARG N 1 1 6 1705 1 1 3 ARG NE N -9.757 -2.522 -3.566 1.00 . A A . 3 ARG NE 1 1 6 1706 1 1 3 ARG NH1 N -9.728 -0.177 -3.870 1.00 . A A . 3 ARG NH1 1 1 6 1707 1 1 3 ARG NH2 N -11.427 -1.181 -2.570 1.00 . A A . 3 ARG NH2 1 1 6 1708 1 1 3 ARG O O -5.723 -2.054 -5.458 1.00 . A A . 3 ARG O 1 1 6 1709 1 1 4 LEU C C -3.398 -0.758 -4.463 1.00 . A A . 4 LEU C 1 1 6 1710 1 1 4 LEU CA C -4.294 -1.045 -3.366 1.00 . A A . 4 LEU CA 1 1 6 1711 1 1 4 LEU CB C -3.507 -0.804 -2.102 1.00 . A A . 4 LEU CB 1 1 6 1712 1 1 4 LEU CD1 C -2.485 -1.790 -0.110 1.00 . A A . 4 LEU CD1 1 1 6 1713 1 1 4 LEU CD2 C -4.985 -2.150 -0.593 1.00 . A A . 4 LEU CD2 1 1 6 1714 1 1 4 LEU CG C -3.577 -1.949 -1.153 1.00 . A A . 4 LEU CG 1 1 6 1715 1 1 4 LEU H H -4.227 -3.013 -2.878 1.00 . A A . 4 LEU H 1 1 6 1716 1 1 4 LEU HA H -5.121 -0.439 -3.419 1.00 . A A . 4 LEU HA 1 1 6 1717 1 1 4 LEU HB2 H -2.468 -0.601 -2.347 1.00 . A A . 4 LEU HB2 1 1 6 1718 1 1 4 LEU HB3 H -3.917 0.069 -1.586 1.00 . A A . 4 LEU HB3 1 1 6 1719 1 1 4 LEU HD11 H -2.898 -1.823 0.915 1.00 . A A . 4 LEU HD11 1 1 6 1720 1 1 4 LEU HD12 H -1.966 -0.813 -0.275 1.00 . A A . 4 LEU HD12 1 1 6 1721 1 1 4 LEU HD13 H -1.733 -2.602 -0.236 1.00 . A A . 4 LEU HD13 1 1 6 1722 1 1 4 LEU HD21 H -4.946 -2.676 0.382 1.00 . A A . 4 LEU HD21 1 1 6 1723 1 1 4 LEU HD22 H -5.588 -2.761 -1.311 1.00 . A A . 4 LEU HD22 1 1 6 1724 1 1 4 LEU HD23 H -5.486 -1.168 -0.455 1.00 . A A . 4 LEU HD23 1 1 6 1725 1 1 4 LEU HG H -3.313 -2.833 -1.743 1.00 . A A . 4 LEU HG 1 1 6 1726 1 1 4 LEU N N -4.609 -2.383 -3.537 1.00 . A A . 4 LEU N 1 1 6 1727 1 1 4 LEU O O -3.780 -0.025 -5.347 1.00 . A A . 4 LEU O 1 1 6 1728 1 1 5 SER C C -1.122 -1.006 -6.589 1.00 . A A . 5 SER C 1 1 6 1729 1 1 5 SER CA C -1.162 -1.698 -5.252 1.00 . A A . 5 SER CA 1 1 6 1730 1 1 5 SER CB C -0.717 -3.121 -5.328 1.00 . A A . 5 SER CB 1 1 6 1731 1 1 5 SER H H -2.449 -2.391 -3.828 1.00 . A A . 5 SER H 1 1 6 1732 1 1 5 SER HA H -0.451 -1.176 -4.621 1.00 . A A . 5 SER HA 1 1 6 1733 1 1 5 SER HB2 H 0.355 -3.157 -5.058 1.00 . A A . 5 SER HB2 1 1 6 1734 1 1 5 SER HB3 H -1.315 -3.674 -4.552 1.00 . A A . 5 SER HB3 1 1 6 1735 1 1 5 SER HG H -0.454 -3.157 -7.239 1.00 . A A . 5 SER HG 1 1 6 1736 1 1 5 SER N N -2.395 -1.654 -4.480 1.00 . A A . 5 SER N 1 1 6 1737 1 1 5 SER O O -0.107 -0.983 -7.272 1.00 . A A . 5 SER O 1 1 6 1738 1 1 5 SER OG O -0.929 -3.709 -6.608 1.00 . A A . 5 SER OG 1 1 6 1739 1 1 6 LYS C C -1.943 1.686 -7.241 1.00 . A A . 6 LYS C 1 1 6 1740 1 1 6 LYS CA C -2.241 0.436 -8.069 1.00 . A A . 6 LYS CA 1 1 6 1741 1 1 6 LYS CB C -3.597 0.607 -8.761 1.00 . A A . 6 LYS CB 1 1 6 1742 1 1 6 LYS CD C -5.518 -0.585 -9.923 1.00 . A A . 6 LYS CD 1 1 6 1743 1 1 6 LYS CE C -5.725 0.440 -11.040 1.00 . A A . 6 LYS CE 1 1 6 1744 1 1 6 LYS CG C -4.064 -0.671 -9.461 1.00 . A A . 6 LYS CG 1 1 6 1745 1 1 6 LYS H H -3.114 -0.672 -6.581 1.00 . A A . 6 LYS H 1 1 6 1746 1 1 6 LYS HA H -1.432 0.226 -8.758 1.00 . A A . 6 LYS HA 1 1 6 1747 1 1 6 LYS HB2 H -4.352 0.913 -8.006 1.00 . A A . 6 LYS HB2 1 1 6 1748 1 1 6 LYS HB3 H -3.511 1.421 -9.513 1.00 . A A . 6 LYS HB3 1 1 6 1749 1 1 6 LYS HD2 H -5.843 -1.584 -10.282 1.00 . A A . 6 LYS HD2 1 1 6 1750 1 1 6 LYS HD3 H -6.152 -0.310 -9.053 1.00 . A A . 6 LYS HD3 1 1 6 1751 1 1 6 LYS HE2 H -5.490 1.464 -10.681 1.00 . A A . 6 LYS HE2 1 1 6 1752 1 1 6 LYS HE3 H -5.084 0.200 -11.916 1.00 . A A . 6 LYS HE3 1 1 6 1753 1 1 6 LYS HG2 H -3.413 -0.862 -10.341 1.00 . A A . 6 LYS HG2 1 1 6 1754 1 1 6 LYS HG3 H -3.955 -1.529 -8.761 1.00 . A A . 6 LYS HG3 1 1 6 1755 1 1 6 LYS HZ1 H -7.182 0.096 -12.474 1.00 . A A . 6 LYS HZ1 1 1 6 1756 1 1 6 LYS HZ2 H -7.523 1.393 -11.431 1.00 . A A . 6 LYS HZ2 1 1 6 1757 1 1 6 LYS HZ3 H -7.687 -0.206 -10.882 1.00 . A A . 6 LYS HZ3 1 1 6 1758 1 1 6 LYS N N -2.229 -0.487 -7.012 1.00 . A A . 6 LYS N 1 1 6 1759 1 1 6 LYS NZ N -7.134 0.430 -11.491 1.00 . A A . 6 LYS NZ 1 1 6 1760 1 1 6 LYS O O -1.941 2.810 -7.729 1.00 . A A . 6 LYS O 1 1 6 1761 1 1 7 PHE C C -0.340 2.568 -4.267 1.00 . A A . 7 PHE C 1 1 6 1762 1 1 7 PHE CA C -1.613 2.313 -4.831 1.00 . A A . 7 PHE CA 1 1 6 1763 1 1 7 PHE CB C -2.217 1.681 -3.608 1.00 . A A . 7 PHE CB 1 1 6 1764 1 1 7 PHE CD1 C -3.851 2.207 -1.962 1.00 . A A . 7 PHE CD1 1 1 6 1765 1 1 7 PHE CD2 C -1.735 3.209 -1.921 1.00 . A A . 7 PHE CD2 1 1 6 1766 1 1 7 PHE CE1 C -4.101 2.744 -0.760 1.00 . A A . 7 PHE CE1 1 1 6 1767 1 1 7 PHE CE2 C -1.922 3.776 -0.790 1.00 . A A . 7 PHE CE2 1 1 6 1768 1 1 7 PHE CG C -2.688 2.447 -2.534 1.00 . A A . 7 PHE CG 1 1 6 1769 1 1 7 PHE CZ C -3.133 3.563 -0.133 1.00 . A A . 7 PHE CZ 1 1 6 1770 1 1 7 PHE H H -1.755 0.447 -5.505 1.00 . A A . 7 PHE H 1 1 6 1771 1 1 7 PHE HA H -2.139 3.205 -5.022 1.00 . A A . 7 PHE HA 1 1 6 1772 1 1 7 PHE HB2 H -3.147 1.274 -3.957 1.00 . A A . 7 PHE HB2 1 1 6 1773 1 1 7 PHE HB3 H -1.638 0.839 -3.201 1.00 . A A . 7 PHE HB3 1 1 6 1774 1 1 7 PHE HD1 H -4.582 1.565 -2.465 1.00 . A A . 7 PHE HD1 1 1 6 1775 1 1 7 PHE HD2 H -0.799 3.388 -2.385 1.00 . A A . 7 PHE HD2 1 1 6 1776 1 1 7 PHE HE1 H -5.016 2.494 -0.304 1.00 . A A . 7 PHE HE1 1 1 6 1777 1 1 7 PHE HE2 H -1.066 4.346 -0.408 1.00 . A A . 7 PHE HE2 1 1 6 1778 1 1 7 PHE HZ H -3.321 4.001 0.835 1.00 . A A . 7 PHE HZ 1 1 6 1779 1 1 7 PHE N N -1.833 1.416 -5.872 1.00 . A A . 7 PHE N 1 1 6 1780 1 1 7 PHE O O 0.113 3.672 -4.272 1.00 . A A . 7 PHE O 1 1 6 1781 1 1 8 PHE C C 2.251 1.546 -3.513 1.00 . A A . 8 PHE C 1 1 6 1782 1 1 8 PHE CA C 1.200 1.738 -2.691 1.00 . A A . 8 PHE CA 1 1 6 1783 1 1 8 PHE CB C 1.566 0.679 -1.707 1.00 . A A . 8 PHE CB 1 1 6 1784 1 1 8 PHE CD1 C 2.032 -1.429 -2.271 1.00 . A A . 8 PHE CD1 1 1 6 1785 1 1 8 PHE CD2 C -0.170 -0.807 -1.976 1.00 . A A . 8 PHE CD2 1 1 6 1786 1 1 8 PHE CE1 C 1.710 -2.604 -2.610 1.00 . A A . 8 PHE CE1 1 1 6 1787 1 1 8 PHE CE2 C -0.529 -2.013 -2.316 1.00 . A A . 8 PHE CE2 1 1 6 1788 1 1 8 PHE CG C 1.090 -0.542 -1.959 1.00 . A A . 8 PHE CG 1 1 6 1789 1 1 8 PHE CZ C 0.416 -2.925 -2.644 1.00 . A A . 8 PHE CZ 1 1 6 1790 1 1 8 PHE H H -0.179 0.618 -3.660 1.00 . A A . 8 PHE H 1 1 6 1791 1 1 8 PHE HA H 1.215 2.698 -2.347 1.00 . A A . 8 PHE HA 1 1 6 1792 1 1 8 PHE HB2 H 2.628 0.575 -1.574 1.00 . A A . 8 PHE HB2 1 1 6 1793 1 1 8 PHE HB3 H 1.080 0.937 -0.767 1.00 . A A . 8 PHE HB3 1 1 6 1794 1 1 8 PHE HD1 H 3.077 -1.146 -2.242 1.00 . A A . 8 PHE HD1 1 1 6 1795 1 1 8 PHE HD2 H -0.887 -0.057 -1.698 1.00 . A A . 8 PHE HD2 1 1 6 1796 1 1 8 PHE HE1 H 2.473 -3.265 -2.877 1.00 . A A . 8 PHE HE1 1 1 6 1797 1 1 8 PHE HE2 H -1.538 -2.233 -2.373 1.00 . A A . 8 PHE HE2 1 1 6 1798 1 1 8 PHE HZ H 0.143 -3.854 -2.918 1.00 . A A . 8 PHE HZ 1 1 6 1799 1 1 8 PHE N N 0.167 1.531 -3.587 1.00 . A A . 8 PHE N 1 1 6 1800 1 1 8 PHE O O 3.171 2.214 -3.483 1.00 . A A . 8 PHE O 1 1 6 1801 1 1 9 ARG C C 2.951 1.313 -6.195 1.00 . A A . 9 ARG C 1 1 6 1802 1 1 9 ARG CA C 2.917 0.212 -5.283 1.00 . A A . 9 ARG CA 1 1 6 1803 1 1 9 ARG CB C 2.438 -1.016 -5.982 1.00 . A A . 9 ARG CB 1 1 6 1804 1 1 9 ARG CD C 4.390 -2.615 -6.086 1.00 . A A . 9 ARG CD 1 1 6 1805 1 1 9 ARG CG C 3.045 -2.298 -5.441 1.00 . A A . 9 ARG CG 1 1 6 1806 1 1 9 ARG CZ C 5.200 -3.385 -8.302 1.00 . A A . 9 ARG CZ 1 1 6 1807 1 1 9 ARG H H 1.147 0.152 -4.367 1.00 . A A . 9 ARG H 1 1 6 1808 1 1 9 ARG HA H 3.822 0.099 -4.811 1.00 . A A . 9 ARG HA 1 1 6 1809 1 1 9 ARG HB2 H 1.330 -1.043 -5.799 1.00 . A A . 9 ARG HB2 1 1 6 1810 1 1 9 ARG HB3 H 2.624 -0.918 -7.067 1.00 . A A . 9 ARG HB3 1 1 6 1811 1 1 9 ARG HD2 H 5.012 -1.695 -6.152 1.00 . A A . 9 ARG HD2 1 1 6 1812 1 1 9 ARG HD3 H 4.930 -3.397 -5.513 1.00 . A A . 9 ARG HD3 1 1 6 1813 1 1 9 ARG HE H 3.212 -3.277 -7.786 1.00 . A A . 9 ARG HE 1 1 6 1814 1 1 9 ARG HG2 H 3.192 -2.191 -4.354 1.00 . A A . 9 ARG HG2 1 1 6 1815 1 1 9 ARG HG3 H 2.342 -3.139 -5.619 1.00 . A A . 9 ARG HG3 1 1 6 1816 1 1 9 ARG HH11 H 6.647 -2.843 -6.947 1.00 . A A . 9 ARG HH11 1 1 6 1817 1 1 9 ARG HH12 H 7.248 -3.371 -8.484 1.00 . A A . 9 ARG HH12 1 1 6 1818 1 1 9 ARG HH21 H 4.030 -3.995 -9.875 1.00 . A A . 9 ARG HH21 1 1 6 1819 1 1 9 ARG HH22 H 5.733 -4.037 -10.176 1.00 . A A . 9 ARG HH22 1 1 6 1820 1 1 9 ARG N N 2.023 0.588 -4.339 1.00 . A A . 9 ARG N 1 1 6 1821 1 1 9 ARG NE N 4.149 -3.126 -7.468 1.00 . A A . 9 ARG NE 1 1 6 1822 1 1 9 ARG NH1 N 6.479 -3.181 -7.874 1.00 . A A . 9 ARG NH1 1 1 6 1823 1 1 9 ARG NH2 N 4.967 -3.847 -9.563 1.00 . A A . 9 ARG NH2 1 1 6 1824 1 1 9 ARG O O 3.643 1.306 -7.212 1.00 . A A . 9 ARG O 1 1 6 1825 1 1 10 ASP C C 2.127 4.580 -5.907 1.00 . A A . 10 ASP C 1 1 6 1826 1 1 10 ASP CA C 1.906 3.322 -6.645 1.00 . A A . 10 ASP CA 1 1 6 1827 1 1 10 ASP CB C 0.668 3.296 -7.317 1.00 . A A . 10 ASP CB 1 1 6 1828 1 1 10 ASP CG C 0.641 4.069 -8.632 1.00 . A A . 10 ASP CG 1 1 6 1829 1 1 10 ASP H H 1.462 2.156 -5.045 1.00 . A A . 10 ASP H 1 1 6 1830 1 1 10 ASP HA H 2.673 3.219 -7.298 1.00 . A A . 10 ASP HA 1 1 6 1831 1 1 10 ASP HB2 H 0.504 2.218 -7.486 1.00 . A A . 10 ASP HB2 1 1 6 1832 1 1 10 ASP HB3 H -0.072 3.685 -6.616 1.00 . A A . 10 ASP HB3 1 1 6 1833 1 1 10 ASP N N 2.019 2.210 -5.906 1.00 . A A . 10 ASP N 1 1 6 1834 1 1 10 ASP O O 2.111 5.644 -6.529 1.00 . A A . 10 ASP O 1 1 6 1835 1 1 10 ASP OD1 O 1.489 3.765 -9.512 1.00 . A A . 10 ASP OD1 1 1 6 1836 1 1 10 ASP OD2 O -0.223 4.976 -8.771 1.00 . A A . 10 ASP OD2 1 1 6 1837 1 1 11 . C C 2.331 6.060 -2.520 1.00 . A A . 11 DPN C 1 1 6 1838 1 1 11 . CA C 2.575 5.861 -3.987 1.00 . A A . 11 DPN CA 1 1 6 1839 1 1 11 . CB C 4.032 6.192 -4.228 1.00 . A A . 11 DPN CB 1 1 6 1840 1 1 11 . CD1 C 4.700 4.809 -6.109 1.00 . A A . 11 DPN CD1 1 1 6 1841 1 1 11 . CD2 C 4.896 4.202 -3.871 1.00 . A A . 11 DPN CD2 1 1 6 1842 1 1 11 . CE1 C 4.922 3.539 -6.427 1.00 . A A . 11 DPN CE1 1 1 6 1843 1 1 11 . CE2 C 5.185 3.029 -4.175 1.00 . A A . 11 DPN CE2 1 1 6 1844 1 1 11 . CG C 4.668 5.097 -4.784 1.00 . A A . 11 DPN CG 1 1 6 1845 1 1 11 . CZ C 5.161 2.677 -5.406 1.00 . A A . 11 DPN CZ 1 1 6 1846 1 1 11 . H H 2.299 3.692 -4.005 1.00 . A A . 11 DPN H 1 1 6 1847 1 1 11 . HA H 1.990 6.543 -4.480 1.00 . A A . 11 DPN HA 1 1 6 1848 1 1 11 . HB2 H 4.499 6.312 -3.261 1.00 . A A . 11 DPN HB2 1 1 6 1849 1 1 11 . HB3 H 4.147 7.009 -4.884 1.00 . A A . 11 DPN HB3 1 1 6 1850 1 1 11 . HD1 H 4.511 5.561 -6.862 1.00 . A A . 11 DPN HD1 1 1 6 1851 1 1 11 . HD2 H 4.924 4.493 -2.878 1.00 . A A . 11 DPN HD2 1 1 6 1852 1 1 11 . HE1 H 4.923 3.207 -7.451 1.00 . A A . 11 DPN HE1 1 1 6 1853 1 1 11 . HE2 H 5.315 2.311 -3.421 1.00 . A A . 11 DPN HE2 1 1 6 1854 1 1 11 . HZ H 5.225 1.734 -5.561 1.00 . A A . 11 DPN HZ 1 1 6 1855 1 1 11 . N N 2.290 4.558 -4.569 1.00 . A A . 11 DPN N 1 1 6 1856 1 1 11 . O O 1.356 6.692 -2.119 1.00 . A A . 11 DPN O 1 1 6 1857 1 1 12 ILE C C 4.564 5.057 0.189 1.00 . A A . 12 ILE C 1 1 6 1858 1 1 12 ILE CA C 3.290 5.734 -0.291 1.00 . A A . 12 ILE CA 1 1 6 1859 1 1 12 ILE CB C 2.114 5.170 0.435 1.00 . A A . 12 ILE CB 1 1 6 1860 1 1 12 ILE CD1 C 2.544 3.128 -0.670 1.00 . A A . 12 ILE CD1 1 1 6 1861 1 1 12 ILE CG1 C 1.506 4.110 -0.429 1.00 . A A . 12 ILE CG1 1 1 6 1862 1 1 12 ILE CG2 C 1.135 6.299 0.799 1.00 . A A . 12 ILE CG2 1 1 6 1863 1 1 12 ILE H H 3.889 4.868 -2.049 1.00 . A A . 12 ILE H 1 1 6 1864 1 1 12 ILE HA H 3.373 6.755 -0.119 1.00 . A A . 12 ILE HA 1 1 6 1865 1 1 12 ILE HB H 2.472 4.680 1.351 1.00 . A A . 12 ILE HB 1 1 6 1866 1 1 12 ILE HD11 H 2.846 3.158 -1.759 1.00 . A A . 12 ILE HD11 1 1 6 1867 1 1 12 ILE HD12 H 2.208 2.149 -0.379 1.00 . A A . 12 ILE HD12 1 1 6 1868 1 1 12 ILE HD13 H 3.403 3.358 -0.082 1.00 . A A . 12 ILE HD13 1 1 6 1869 1 1 12 ILE HG12 H 0.644 3.631 0.065 1.00 . A A . 12 ILE HG12 1 1 6 1870 1 1 12 ILE HG13 H 1.197 4.523 -1.412 1.00 . A A . 12 ILE HG13 1 1 6 1871 1 1 12 ILE HG21 H 0.090 5.980 0.603 1.00 . A A . 12 ILE HG21 1 1 6 1872 1 1 12 ILE HG22 H 1.347 7.206 0.191 1.00 . A A . 12 ILE HG22 1 1 6 1873 1 1 12 ILE HG23 H 1.230 6.562 1.874 1.00 . A A . 12 ILE HG23 1 1 6 1874 1 1 12 ILE N N 3.255 5.526 -1.710 1.00 . A A . 12 ILE N 1 1 6 1875 1 1 12 ILE O O 4.854 5.011 1.372 1.00 . A A . 12 ILE O 1 1 6 1876 1 1 13 LEU C C 7.638 4.325 -1.116 1.00 . A A . 13 LEU C 1 1 6 1877 1 1 13 LEU CA C 6.486 3.646 -0.511 1.00 . A A . 13 LEU CA 1 1 6 1878 1 1 13 LEU CB C 6.446 2.316 -1.231 1.00 . A A . 13 LEU CB 1 1 6 1879 1 1 13 LEU CD1 C 5.045 0.440 -1.971 1.00 . A A . 13 LEU CD1 1 1 6 1880 1 1 13 LEU CD2 C 4.725 1.582 0.334 1.00 . A A . 13 LEU CD2 1 1 6 1881 1 1 13 LEU CG C 5.109 1.715 -1.137 1.00 . A A . 13 LEU CG 1 1 6 1882 1 1 13 LEU H H 4.926 4.318 -1.716 1.00 . A A . 13 LEU H 1 1 6 1883 1 1 13 LEU HA H 6.612 3.519 0.542 1.00 . A A . 13 LEU HA 1 1 6 1884 1 1 13 LEU HB2 H 6.660 2.474 -2.303 1.00 . A A . 13 LEU HB2 1 1 6 1885 1 1 13 LEU HB3 H 7.185 1.620 -0.807 1.00 . A A . 13 LEU HB3 1 1 6 1886 1 1 13 LEU HD11 H 4.456 0.639 -2.906 1.00 . A A . 13 LEU HD11 1 1 6 1887 1 1 13 LEU HD12 H 4.569 -0.382 -1.406 1.00 . A A . 13 LEU HD12 1 1 6 1888 1 1 13 LEU HD13 H 6.066 0.139 -2.273 1.00 . A A . 13 LEU HD13 1 1 6 1889 1 1 13 LEU HD21 H 4.770 2.609 0.811 1.00 . A A . 13 LEU HD21 1 1 6 1890 1 1 13 LEU HD22 H 5.428 0.912 0.862 1.00 . A A . 13 LEU HD22 1 1 6 1891 1 1 13 LEU HD23 H 3.695 1.192 0.434 1.00 . A A . 13 LEU HD23 1 1 6 1892 1 1 13 LEU HG H 4.418 2.441 -1.611 1.00 . A A . 13 LEU HG 1 1 6 1893 1 1 13 LEU N N 5.272 4.396 -0.776 1.00 . A A . 13 LEU N 1 1 6 1894 1 1 13 LEU O O 8.675 4.505 -0.497 1.00 . A A . 13 LEU O 1 1 6 1895 1 1 14 GLN C C 8.684 6.636 -2.481 1.00 . A A . 14 GLN C 1 1 6 1896 1 1 14 GLN CA C 8.562 5.325 -3.108 1.00 . A A . 14 GLN CA 1 1 6 1897 1 1 14 GLN CB C 8.295 5.595 -4.588 1.00 . A A . 14 GLN CB 1 1 6 1898 1 1 14 GLN CD C 8.794 3.217 -4.923 1.00 . A A . 14 GLN CD 1 1 6 1899 1 1 14 GLN CG C 7.895 4.356 -5.317 1.00 . A A . 14 GLN CG 1 1 6 1900 1 1 14 GLN H H 6.632 4.446 -2.918 1.00 . A A . 14 GLN H 1 1 6 1901 1 1 14 GLN HA H 9.463 4.760 -2.964 1.00 . A A . 14 GLN HA 1 1 6 1902 1 1 14 GLN HB2 H 7.465 6.327 -4.672 1.00 . A A . 14 GLN HB2 1 1 6 1903 1 1 14 GLN HB3 H 9.196 6.025 -5.060 1.00 . A A . 14 GLN HB3 1 1 6 1904 1 1 14 GLN HE21 H 7.254 2.514 -3.805 1.00 . A A . 14 GLN HE21 1 1 6 1905 1 1 14 GLN HE22 H 8.707 1.553 -3.756 1.00 . A A . 14 GLN HE22 1 1 6 1906 1 1 14 GLN HG2 H 6.871 4.116 -5.016 1.00 . A A . 14 GLN HG2 1 1 6 1907 1 1 14 GLN HG3 H 7.937 4.512 -6.408 1.00 . A A . 14 GLN HG3 1 1 6 1908 1 1 14 GLN N N 7.482 4.662 -2.405 1.00 . A A . 14 GLN N 1 1 6 1909 1 1 14 GLN NE2 N 8.209 2.343 -4.093 1.00 . A A . 14 GLN NE2 1 1 6 1910 1 1 14 GLN O O 9.715 7.302 -2.543 1.00 . A A . 14 GLN O 1 1 6 1911 1 1 14 GLN OE1 O 9.963 3.142 -5.284 1.00 . A A . 14 GLN OE1 1 1 6 1912 1 1 15 ARG C C 7.727 7.994 0.247 1.00 . A A . 15 ARG C 1 1 6 1913 1 1 15 ARG CA C 7.563 8.288 -1.205 1.00 . A A . 15 ARG CA 1 1 6 1914 1 1 15 ARG CB C 6.246 9.049 -1.348 1.00 . A A . 15 ARG CB 1 1 6 1915 1 1 15 ARG CD C 3.982 8.623 -2.299 1.00 . A A . 15 ARG CD 1 1 6 1916 1 1 15 ARG CG C 5.472 8.665 -2.593 1.00 . A A . 15 ARG CG 1 1 6 1917 1 1 15 ARG CZ C 3.165 10.917 -2.826 1.00 . A A . 15 ARG CZ 1 1 6 1918 1 1 15 ARG H H 6.756 6.431 -1.788 1.00 . A A . 15 ARG H 1 1 6 1919 1 1 15 ARG HA H 8.390 8.844 -1.592 1.00 . A A . 15 ARG HA 1 1 6 1920 1 1 15 ARG HB2 H 5.612 8.856 -0.459 1.00 . A A . 15 ARG HB2 1 1 6 1921 1 1 15 ARG HB3 H 6.460 10.138 -1.384 1.00 . A A . 15 ARG HB3 1 1 6 1922 1 1 15 ARG HD2 H 3.408 8.306 -3.192 1.00 . A A . 15 ARG HD2 1 1 6 1923 1 1 15 ARG HD3 H 3.787 7.913 -1.456 1.00 . A A . 15 ARG HD3 1 1 6 1924 1 1 15 ARG HE H 3.487 10.223 -0.913 1.00 . A A . 15 ARG HE 1 1 6 1925 1 1 15 ARG HG2 H 5.677 9.392 -3.404 1.00 . A A . 15 ARG HG2 1 1 6 1926 1 1 15 ARG HG3 H 5.797 7.656 -2.933 1.00 . A A . 15 ARG HG3 1 1 6 1927 1 1 15 ARG HH11 H 3.511 9.702 -4.446 1.00 . A A . 15 ARG HH11 1 1 6 1928 1 1 15 ARG HH12 H 2.946 11.292 -4.836 1.00 . A A . 15 ARG HH12 1 1 6 1929 1 1 15 ARG HH21 H 2.719 12.378 -1.453 1.00 . A A . 15 ARG HH21 1 1 6 1930 1 1 15 ARG HH22 H 2.490 12.838 -3.106 1.00 . A A . 15 ARG HH22 1 1 6 1931 1 1 15 ARG N N 7.583 7.025 -1.847 1.00 . A A . 15 ARG N 1 1 6 1932 1 1 15 ARG NE N 3.526 9.987 -1.888 1.00 . A A . 15 ARG NE 1 1 6 1933 1 1 15 ARG NH1 N 3.212 10.610 -4.155 1.00 . A A . 15 ARG NH1 1 1 6 1934 1 1 15 ARG NH2 N 2.755 12.154 -2.426 1.00 . A A . 15 ARG NH2 1 1 6 1935 1 1 15 ARG O O 8.185 8.825 1.027 1.00 . A A . 15 ARG O 1 1 6 1936 1 1 16 LYS C C 6.260 6.893 2.775 1.00 . A A . 16 LYS C 1 1 6 1937 1 1 16 LYS CA C 7.322 6.244 1.940 1.00 . A A . 16 LYS CA 1 1 6 1938 1 1 16 LYS CB C 8.671 6.429 2.633 1.00 . A A . 16 LYS CB 1 1 6 1939 1 1 16 LYS CD C 10.700 5.720 1.278 1.00 . A A . 16 LYS CD 1 1 6 1940 1 1 16 LYS CE C 11.836 6.549 1.881 1.00 . A A . 16 LYS CE 1 1 6 1941 1 1 16 LYS CG C 9.656 5.304 2.319 1.00 . A A . 16 LYS CG 1 1 6 1942 1 1 16 LYS H H 6.915 6.139 -0.070 1.00 . A A . 16 LYS H 1 1 6 1943 1 1 16 LYS HA H 7.080 5.194 1.845 1.00 . A A . 16 LYS HA 1 1 6 1944 1 1 16 LYS HB2 H 9.097 7.390 2.299 1.00 . A A . 16 LYS HB2 1 1 6 1945 1 1 16 LYS HB3 H 8.515 6.481 3.726 1.00 . A A . 16 LYS HB3 1 1 6 1946 1 1 16 LYS HD2 H 11.126 4.808 0.808 1.00 . A A . 16 LYS HD2 1 1 6 1947 1 1 16 LYS HD3 H 10.197 6.313 0.481 1.00 . A A . 16 LYS HD3 1 1 6 1948 1 1 16 LYS HE2 H 11.450 7.515 2.271 1.00 . A A . 16 LYS HE2 1 1 6 1949 1 1 16 LYS HE3 H 12.334 5.990 2.702 1.00 . A A . 16 LYS HE3 1 1 6 1950 1 1 16 LYS HG2 H 10.172 4.997 3.253 1.00 . A A . 16 LYS HG2 1 1 6 1951 1 1 16 LYS HG3 H 9.089 4.429 1.933 1.00 . A A . 16 LYS HG3 1 1 6 1952 1 1 16 LYS HZ1 H 13.287 7.774 1.050 1.00 . A A . 16 LYS HZ1 1 1 6 1953 1 1 16 LYS HZ2 H 12.401 6.874 -0.086 1.00 . A A . 16 LYS HZ2 1 1 6 1954 1 1 16 LYS HZ3 H 13.587 6.113 0.862 1.00 . A A . 16 LYS HZ3 1 1 6 1955 1 1 16 LYS N N 7.278 6.766 0.605 1.00 . A A . 16 LYS N 1 1 6 1956 1 1 16 LYS NZ N 12.854 6.850 0.850 1.00 . A A . 16 LYS NZ 1 1 6 1957 1 1 16 LYS O O 6.224 6.733 3.994 1.00 . A A . 16 LYS O 1 1 6 1958 1 1 17 LYS C C 3.297 8.866 1.854 1.00 . A A . 17 LYS C 1 1 6 1959 1 1 17 LYS CA C 4.280 8.251 2.850 1.00 . A A . 17 LYS CA 1 1 6 1960 1 1 17 LYS CB C 4.734 9.365 3.817 1.00 . A A . 17 LYS CB 1 1 6 1961 1 1 17 LYS CD C 5.411 11.445 2.496 1.00 . A A . 17 LYS CD 1 1 6 1962 1 1 17 LYS CE C 6.435 11.913 1.464 1.00 . A A . 17 LYS CE 1 1 6 1963 1 1 17 LYS CG C 5.888 10.212 3.270 1.00 . A A . 17 LYS CG 1 1 6 1964 1 1 17 LYS H H 5.401 7.774 1.146 1.00 . A A . 17 LYS H 1 1 6 1965 1 1 17 LYS HA H 3.775 7.468 3.383 1.00 . A A . 17 LYS HA 1 1 6 1966 1 1 17 LYS HB2 H 3.871 10.027 4.037 1.00 . A A . 17 LYS HB2 1 1 6 1967 1 1 17 LYS HB3 H 5.057 8.897 4.766 1.00 . A A . 17 LYS HB3 1 1 6 1968 1 1 17 LYS HD2 H 4.458 11.206 1.977 1.00 . A A . 17 LYS HD2 1 1 6 1969 1 1 17 LYS HD3 H 5.213 12.271 3.214 1.00 . A A . 17 LYS HD3 1 1 6 1970 1 1 17 LYS HE2 H 7.394 12.178 1.958 1.00 . A A . 17 LYS HE2 1 1 6 1971 1 1 17 LYS HE3 H 6.615 11.116 0.710 1.00 . A A . 17 LYS HE3 1 1 6 1972 1 1 17 LYS HG2 H 6.522 10.544 4.119 1.00 . A A . 17 LYS HG2 1 1 6 1973 1 1 17 LYS HG3 H 6.516 9.587 2.604 1.00 . A A . 17 LYS HG3 1 1 6 1974 1 1 17 LYS HZ1 H 6.693 13.830 0.722 1.00 . A A . 17 LYS HZ1 1 1 6 1975 1 1 17 LYS HZ2 H 5.116 13.497 1.257 1.00 . A A . 17 LYS HZ2 1 1 6 1976 1 1 17 LYS HZ3 H 5.667 12.854 -0.214 1.00 . A A . 17 LYS HZ3 1 1 6 1977 1 1 17 LYS N N 5.355 7.628 2.123 1.00 . A A . 17 LYS N 1 1 6 1978 1 1 17 LYS NZ N 5.941 13.112 0.755 1.00 . A A . 17 LYS NZ 1 1 6 1979 1 1 17 LYS O O 3.731 9.216 0.732 1.00 . A A . 17 LYS O 1 1 6 1980 1 1 17 LYS OXT O 2.096 8.999 2.215 1.00 . A A . 17 LYS OXT 1 1 7 1981 1 1 1 GLU C C -1.845 -8.708 -3.896 1.00 . A A . 1 GLU C 1 1 7 1982 1 1 1 GLU CA C -1.110 -9.675 -4.780 1.00 . A A . 1 GLU CA 1 1 7 1983 1 1 1 GLU CB C 0.392 -9.327 -4.748 1.00 . A A . 1 GLU CB 1 1 7 1984 1 1 1 GLU CD C 2.711 -9.942 -5.437 1.00 . A A . 1 GLU CD 1 1 7 1985 1 1 1 GLU CG C 1.265 -10.425 -5.379 1.00 . A A . 1 GLU CG 1 1 7 1986 1 1 1 GLU H1 H -0.953 -9.074 -6.767 1.00 . A A . 1 GLU H1 1 1 7 1987 1 1 1 GLU H2 H -2.549 -9.135 -6.187 1.00 . A A . 1 GLU H2 1 1 7 1988 1 1 1 GLU H3 H -1.723 -10.573 -6.556 1.00 . A A . 1 GLU H3 1 1 7 1989 1 1 1 GLU HA H -1.271 -10.679 -4.422 1.00 . A A . 1 GLU HA 1 1 7 1990 1 1 1 GLU HB2 H 0.552 -8.370 -5.295 1.00 . A A . 1 GLU HB2 1 1 7 1991 1 1 1 GLU HB3 H 0.708 -9.177 -3.693 1.00 . A A . 1 GLU HB3 1 1 7 1992 1 1 1 GLU HG2 H 1.209 -11.353 -4.770 1.00 . A A . 1 GLU HG2 1 1 7 1993 1 1 1 GLU HG3 H 0.917 -10.645 -6.408 1.00 . A A . 1 GLU HG3 1 1 7 1994 1 1 1 GLU N N -1.622 -9.609 -6.177 1.00 . A A . 1 GLU N 1 1 7 1995 1 1 1 GLU O O -2.180 -9.030 -2.757 1.00 . A A . 1 GLU O 1 1 7 1996 1 1 1 GLU OE1 O 2.947 -8.729 -5.194 1.00 . A A . 1 GLU OE1 1 1 7 1997 1 1 1 GLU OE2 O 3.599 -10.788 -5.724 1.00 . A A . 1 GLU OE2 1 1 7 1998 1 1 2 MET C C -3.834 -5.877 -4.508 1.00 . A A . 2 MET C 1 1 7 1999 1 1 2 MET CA C -2.809 -6.500 -3.635 1.00 . A A . 2 MET CA 1 1 7 2000 1 1 2 MET CB C -1.900 -5.403 -3.048 1.00 . A A . 2 MET CB 1 1 7 2001 1 1 2 MET CE C -4.110 -5.445 -0.991 1.00 . A A . 2 MET CE 1 1 7 2002 1 1 2 MET CG C -1.501 -5.624 -1.579 1.00 . A A . 2 MET CG 1 1 7 2003 1 1 2 MET H H -1.851 -7.231 -5.339 1.00 . A A . 2 MET H 1 1 7 2004 1 1 2 MET HA H -3.340 -6.994 -2.852 1.00 . A A . 2 MET HA 1 1 7 2005 1 1 2 MET HB2 H -0.975 -5.360 -3.657 1.00 . A A . 2 MET HB2 1 1 7 2006 1 1 2 MET HB3 H -2.406 -4.412 -3.127 1.00 . A A . 2 MET HB3 1 1 7 2007 1 1 2 MET HE1 H -3.770 -4.624 -1.653 1.00 . A A . 2 MET HE1 1 1 7 2008 1 1 2 MET HE2 H -4.553 -4.994 -0.080 1.00 . A A . 2 MET HE2 1 1 7 2009 1 1 2 MET HE3 H -4.910 -6.005 -1.527 1.00 . A A . 2 MET HE3 1 1 7 2010 1 1 2 MET HG2 H -0.531 -6.163 -1.557 1.00 . A A . 2 MET HG2 1 1 7 2011 1 1 2 MET HG3 H -1.335 -4.621 -1.130 1.00 . A A . 2 MET HG3 1 1 7 2012 1 1 2 MET N N -2.111 -7.490 -4.412 1.00 . A A . 2 MET N 1 1 7 2013 1 1 2 MET O O -3.996 -6.229 -5.675 1.00 . A A . 2 MET O 1 1 7 2014 1 1 2 MET SD S -2.724 -6.532 -0.573 1.00 . A A . 2 MET SD 1 1 7 2015 1 1 3 ARG C C -5.346 -2.858 -4.594 1.00 . A A . 3 ARG C 1 1 7 2016 1 1 3 ARG CA C -5.614 -4.275 -4.574 1.00 . A A . 3 ARG CA 1 1 7 2017 1 1 3 ARG CB C -6.862 -4.461 -3.752 1.00 . A A . 3 ARG CB 1 1 7 2018 1 1 3 ARG CD C -8.543 -2.753 -4.427 1.00 . A A . 3 ARG CD 1 1 7 2019 1 1 3 ARG CG C -8.136 -4.216 -4.531 1.00 . A A . 3 ARG CG 1 1 7 2020 1 1 3 ARG CZ C -10.309 -1.425 -3.297 1.00 . A A . 3 ARG CZ 1 1 7 2021 1 1 3 ARG H H -4.367 -4.575 -3.014 1.00 . A A . 3 ARG H 1 1 7 2022 1 1 3 ARG HA H -5.702 -4.628 -5.534 1.00 . A A . 3 ARG HA 1 1 7 2023 1 1 3 ARG HB2 H -6.856 -5.488 -3.332 1.00 . A A . 3 ARG HB2 1 1 7 2024 1 1 3 ARG HB3 H -6.807 -3.733 -2.901 1.00 . A A . 3 ARG HB3 1 1 7 2025 1 1 3 ARG HD2 H -7.721 -2.168 -3.945 1.00 . A A . 3 ARG HD2 1 1 7 2026 1 1 3 ARG HD3 H -8.772 -2.331 -5.427 1.00 . A A . 3 ARG HD3 1 1 7 2027 1 1 3 ARG HE H -10.185 -3.476 -3.202 1.00 . A A . 3 ARG HE 1 1 7 2028 1 1 3 ARG HG2 H -7.967 -4.481 -5.596 1.00 . A A . 3 ARG HG2 1 1 7 2029 1 1 3 ARG HG3 H -8.945 -4.861 -4.131 1.00 . A A . 3 ARG HG3 1 1 7 2030 1 1 3 ARG HH11 H -8.925 -0.361 -4.381 1.00 . A A . 3 ARG HH11 1 1 7 2031 1 1 3 ARG HH12 H -10.139 0.602 -3.604 1.00 . A A . 3 ARG HH12 1 1 7 2032 1 1 3 ARG HH21 H -11.838 -2.169 -2.145 1.00 . A A . 3 ARG HH21 1 1 7 2033 1 1 3 ARG HH22 H -11.823 -0.446 -2.311 1.00 . A A . 3 ARG HH22 1 1 7 2034 1 1 3 ARG N N -4.551 -4.910 -3.926 1.00 . A A . 3 ARG N 1 1 7 2035 1 1 3 ARG NE N -9.765 -2.647 -3.574 1.00 . A A . 3 ARG NE 1 1 7 2036 1 1 3 ARG NH1 N -9.741 -0.293 -3.805 1.00 . A A . 3 ARG NH1 1 1 7 2037 1 1 3 ARG NH2 N -11.423 -1.338 -2.514 1.00 . A A . 3 ARG NH2 1 1 7 2038 1 1 3 ARG O O -5.747 -2.118 -5.490 1.00 . A A . 3 ARG O 1 1 7 2039 1 1 4 LEU C C -3.430 -0.818 -4.477 1.00 . A A . 4 LEU C 1 1 7 2040 1 1 4 LEU CA C -4.324 -1.128 -3.386 1.00 . A A . 4 LEU CA 1 1 7 2041 1 1 4 LEU CB C -3.539 -0.899 -2.118 1.00 . A A . 4 LEU CB 1 1 7 2042 1 1 4 LEU CD1 C -2.508 -1.906 -0.142 1.00 . A A . 4 LEU CD1 1 1 7 2043 1 1 4 LEU CD2 C -5.005 -2.280 -0.628 1.00 . A A . 4 LEU CD2 1 1 7 2044 1 1 4 LEU CG C -3.599 -2.059 -1.187 1.00 . A A . 4 LEU CG 1 1 7 2045 1 1 4 LEU H H -4.240 -3.103 -2.927 1.00 . A A . 4 LEU H 1 1 7 2046 1 1 4 LEU HA H -5.156 -0.528 -3.430 1.00 . A A . 4 LEU HA 1 1 7 2047 1 1 4 LEU HB2 H -2.502 -0.684 -2.360 1.00 . A A . 4 LEU HB2 1 1 7 2048 1 1 4 LEU HB3 H -3.956 -0.038 -1.590 1.00 . A A . 4 LEU HB3 1 1 7 2049 1 1 4 LEU HD11 H -1.994 -0.924 -0.292 1.00 . A A . 4 LEU HD11 1 1 7 2050 1 1 4 LEU HD12 H -1.750 -2.712 -0.279 1.00 . A A . 4 LEU HD12 1 1 7 2051 1 1 4 LEU HD13 H -2.921 -1.951 0.884 1.00 . A A . 4 LEU HD13 1 1 7 2052 1 1 4 LEU HD21 H -4.960 -2.820 0.338 1.00 . A A . 4 LEU HD21 1 1 7 2053 1 1 4 LEU HD22 H -5.602 -2.887 -1.356 1.00 . A A . 4 LEU HD22 1 1 7 2054 1 1 4 LEU HD23 H -5.514 -1.305 -0.477 1.00 . A A . 4 LEU HD23 1 1 7 2055 1 1 4 LEU HG H -3.328 -2.932 -1.790 1.00 . A A . 4 LEU HG 1 1 7 2056 1 1 4 LEU N N -4.629 -2.466 -3.577 1.00 . A A . 4 LEU N 1 1 7 2057 1 1 4 LEU O O -3.817 -0.075 -5.351 1.00 . A A . 4 LEU O 1 1 7 2058 1 1 5 SER C C -1.153 -1.012 -6.608 1.00 . A A . 5 SER C 1 1 7 2059 1 1 5 SER CA C -1.186 -1.727 -5.282 1.00 . A A . 5 SER CA 1 1 7 2060 1 1 5 SER CB C -0.730 -3.145 -5.379 1.00 . A A . 5 SER CB 1 1 7 2061 1 1 5 SER H H -2.468 -2.453 -3.869 1.00 . A A . 5 SER H 1 1 7 2062 1 1 5 SER HA H -0.479 -1.208 -4.643 1.00 . A A . 5 SER HA 1 1 7 2063 1 1 5 SER HB2 H 0.342 -3.178 -5.108 1.00 . A A . 5 SER HB2 1 1 7 2064 1 1 5 SER HB3 H -1.324 -3.716 -4.613 1.00 . A A . 5 SER HB3 1 1 7 2065 1 1 5 SER HG H -0.464 -3.149 -7.290 1.00 . A A . 5 SER HG 1 1 7 2066 1 1 5 SER N N -2.420 -1.705 -4.510 1.00 . A A . 5 SER N 1 1 7 2067 1 1 5 SER O O -0.137 -0.967 -7.287 1.00 . A A . 5 SER O 1 1 7 2068 1 1 5 SER OG O -0.936 -3.715 -6.669 1.00 . A A . 5 SER OG 1 1 7 2069 1 1 6 LYS C C -1.997 1.680 -7.221 1.00 . A A . 6 LYS C 1 1 7 2070 1 1 6 LYS CA C -2.286 0.440 -8.067 1.00 . A A . 6 LYS CA 1 1 7 2071 1 1 6 LYS CB C -3.648 0.602 -8.741 1.00 . A A . 6 LYS CB 1 1 7 2072 1 1 6 LYS CD C -5.485 -0.520 -10.070 1.00 . A A . 6 LYS CD 1 1 7 2073 1 1 6 LYS CE C -5.948 -1.784 -10.797 1.00 . A A . 6 LYS CE 1 1 7 2074 1 1 6 LYS CG C -4.097 -0.669 -9.460 1.00 . A A . 6 LYS CG 1 1 7 2075 1 1 6 LYS H H -3.152 -0.703 -6.605 1.00 . A A . 6 LYS H 1 1 7 2076 1 1 6 LYS HA H -1.480 0.245 -8.764 1.00 . A A . 6 LYS HA 1 1 7 2077 1 1 6 LYS HB2 H -4.401 0.879 -7.974 1.00 . A A . 6 LYS HB2 1 1 7 2078 1 1 6 LYS HB3 H -3.583 1.432 -9.477 1.00 . A A . 6 LYS HB3 1 1 7 2079 1 1 6 LYS HD2 H -6.203 -0.285 -9.257 1.00 . A A . 6 LYS HD2 1 1 7 2080 1 1 6 LYS HD3 H -5.480 0.332 -10.782 1.00 . A A . 6 LYS HD3 1 1 7 2081 1 1 6 LYS HE2 H -5.263 -2.024 -11.637 1.00 . A A . 6 LYS HE2 1 1 7 2082 1 1 6 LYS HE3 H -5.989 -2.644 -10.095 1.00 . A A . 6 LYS HE3 1 1 7 2083 1 1 6 LYS HG2 H -3.369 -0.911 -10.263 1.00 . A A . 6 LYS HG2 1 1 7 2084 1 1 6 LYS HG3 H -4.105 -1.514 -8.737 1.00 . A A . 6 LYS HG3 1 1 7 2085 1 1 6 LYS HZ1 H -8.012 -1.919 -10.674 1.00 . A A . 6 LYS HZ1 1 1 7 2086 1 1 6 LYS HZ2 H -7.394 -2.125 -12.242 1.00 . A A . 6 LYS HZ2 1 1 7 2087 1 1 6 LYS HZ3 H -7.454 -0.576 -11.549 1.00 . A A . 6 LYS HZ3 1 1 7 2088 1 1 6 LYS N N -2.264 -0.498 -7.025 1.00 . A A . 6 LYS N 1 1 7 2089 1 1 6 LYS NZ N -7.303 -1.586 -11.357 1.00 . A A . 6 LYS NZ 1 1 7 2090 1 1 6 LYS O O -2.003 2.813 -7.691 1.00 . A A . 6 LYS O 1 1 7 2091 1 1 7 PHE C C -0.394 2.528 -4.236 1.00 . A A . 7 PHE C 1 1 7 2092 1 1 7 PHE CA C -1.666 2.271 -4.802 1.00 . A A . 7 PHE CA 1 1 7 2093 1 1 7 PHE CB C -2.266 1.617 -3.590 1.00 . A A . 7 PHE CB 1 1 7 2094 1 1 7 PHE CD1 C -3.901 2.106 -1.933 1.00 . A A . 7 PHE CD1 1 1 7 2095 1 1 7 PHE CD2 C -1.792 3.120 -1.878 1.00 . A A . 7 PHE CD2 1 1 7 2096 1 1 7 PHE CE1 C -4.152 2.620 -0.721 1.00 . A A . 7 PHE CE1 1 1 7 2097 1 1 7 PHE CE2 C -1.981 3.666 -0.739 1.00 . A A . 7 PHE CE2 1 1 7 2098 1 1 7 PHE CG C -2.740 2.363 -2.502 1.00 . A A . 7 PHE CG 1 1 7 2099 1 1 7 PHE CZ C -3.188 3.433 -0.083 1.00 . A A . 7 PHE CZ 1 1 7 2100 1 1 7 PHE H H -1.796 0.415 -5.505 1.00 . A A . 7 PHE H 1 1 7 2101 1 1 7 PHE HA H -2.199 3.163 -4.979 1.00 . A A . 7 PHE HA 1 1 7 2102 1 1 7 PHE HB2 H -3.194 1.209 -3.944 1.00 . A A . 7 PHE HB2 1 1 7 2103 1 1 7 PHE HB3 H -1.680 0.773 -3.197 1.00 . A A . 7 PHE HB3 1 1 7 2104 1 1 7 PHE HD1 H -4.629 1.468 -2.445 1.00 . A A . 7 PHE HD1 1 1 7 2105 1 1 7 PHE HD2 H -0.857 3.314 -2.341 1.00 . A A . 7 PHE HD2 1 1 7 2106 1 1 7 PHE HE1 H -5.066 2.357 -0.269 1.00 . A A . 7 PHE HE1 1 1 7 2107 1 1 7 PHE HE2 H -1.128 4.235 -0.347 1.00 . A A . 7 PHE HE2 1 1 7 2108 1 1 7 PHE HZ H -3.378 3.855 0.893 1.00 . A A . 7 PHE HZ 1 1 7 2109 1 1 7 PHE N N -1.882 1.390 -5.856 1.00 . A A . 7 PHE N 1 1 7 2110 1 1 7 PHE O O 0.053 3.634 -4.227 1.00 . A A . 7 PHE O 1 1 7 2111 1 1 8 PHE C C 2.205 1.507 -3.497 1.00 . A A . 8 PHE C 1 1 7 2112 1 1 8 PHE CA C 1.152 1.685 -2.673 1.00 . A A . 8 PHE CA 1 1 7 2113 1 1 8 PHE CB C 1.523 0.618 -1.699 1.00 . A A . 8 PHE CB 1 1 7 2114 1 1 8 PHE CD1 C 2.004 -1.479 -2.288 1.00 . A A . 8 PHE CD1 1 1 7 2115 1 1 8 PHE CD2 C -0.203 -0.877 -1.992 1.00 . A A . 8 PHE CD2 1 1 7 2116 1 1 8 PHE CE1 C 1.692 -2.651 -2.644 1.00 . A A . 8 PHE CE1 1 1 7 2117 1 1 8 PHE CE2 C -0.551 -2.081 -2.349 1.00 . A A . 8 PHE CE2 1 1 7 2118 1 1 8 PHE CG C 1.055 -0.603 -1.967 1.00 . A A . 8 PHE CG 1 1 7 2119 1 1 8 PHE CZ C 0.402 -2.982 -2.687 1.00 . A A . 8 PHE CZ 1 1 7 2120 1 1 8 PHE H H -0.220 0.569 -3.657 1.00 . A A . 8 PHE H 1 1 7 2121 1 1 8 PHE HA H 1.164 2.641 -2.319 1.00 . A A . 8 PHE HA 1 1 7 2122 1 1 8 PHE HB2 H 2.585 0.519 -1.568 1.00 . A A . 8 PHE HB2 1 1 7 2123 1 1 8 PHE HB3 H 1.037 0.865 -0.757 1.00 . A A . 8 PHE HB3 1 1 7 2124 1 1 8 PHE HD1 H 3.047 -1.190 -2.252 1.00 . A A . 8 PHE HD1 1 1 7 2125 1 1 8 PHE HD2 H -0.926 -0.136 -1.705 1.00 . A A . 8 PHE HD2 1 1 7 2126 1 1 8 PHE HE1 H 2.461 -3.302 -2.917 1.00 . A A . 8 PHE HE1 1 1 7 2127 1 1 8 PHE HE2 H -1.559 -2.309 -2.412 1.00 . A A . 8 PHE HE2 1 1 7 2128 1 1 8 PHE HZ H 0.137 -3.908 -2.975 1.00 . A A . 8 PHE HZ 1 1 7 2129 1 1 8 PHE N N 0.119 1.482 -3.572 1.00 . A A . 8 PHE N 1 1 7 2130 1 1 8 PHE O O 3.123 2.175 -3.456 1.00 . A A . 8 PHE O 1 1 7 2131 1 1 9 ARG C C 2.906 1.315 -6.180 1.00 . A A . 9 ARG C 1 1 7 2132 1 1 9 ARG CA C 2.879 0.201 -5.283 1.00 . A A . 9 ARG CA 1 1 7 2133 1 1 9 ARG CB C 2.411 -1.020 -5.999 1.00 . A A . 9 ARG CB 1 1 7 2134 1 1 9 ARG CD C 4.383 -2.595 -6.113 1.00 . A A . 9 ARG CD 1 1 7 2135 1 1 9 ARG CG C 3.028 -2.305 -5.476 1.00 . A A . 9 ARG CG 1 1 7 2136 1 1 9 ARG CZ C 5.224 -3.286 -8.343 1.00 . A A . 9 ARG CZ 1 1 7 2137 1 1 9 ARG H H 1.112 0.112 -4.363 1.00 . A A . 9 ARG H 1 1 7 2138 1 1 9 ARG HA H 3.786 0.089 -4.810 1.00 . A A . 9 ARG HA 1 1 7 2139 1 1 9 ARG HB2 H 1.303 -1.059 -5.816 1.00 . A A . 9 ARG HB2 1 1 7 2140 1 1 9 ARG HB3 H 2.595 -0.906 -7.081 1.00 . A A . 9 ARG HB3 1 1 7 2141 1 1 9 ARG HD2 H 5.000 -1.670 -6.144 1.00 . A A . 9 ARG HD2 1 1 7 2142 1 1 9 ARG HD3 H 4.920 -3.391 -5.557 1.00 . A A . 9 ARG HD3 1 1 7 2143 1 1 9 ARG HE H 3.230 -3.216 -7.845 1.00 . A A . 9 ARG HE 1 1 7 2144 1 1 9 ARG HG2 H 3.163 -2.215 -4.385 1.00 . A A . 9 ARG HG2 1 1 7 2145 1 1 9 ARG HG3 H 2.336 -3.150 -5.674 1.00 . A A . 9 ARG HG3 1 1 7 2146 1 1 9 ARG HH11 H 6.651 -2.773 -6.957 1.00 . A A . 9 ARG HH11 1 1 7 2147 1 1 9 ARG HH12 H 7.274 -3.245 -8.503 1.00 . A A . 9 ARG HH12 1 1 7 2148 1 1 9 ARG HH21 H 4.076 -3.858 -9.948 1.00 . A A . 9 ARG HH21 1 1 7 2149 1 1 9 ARG HH22 H 5.784 -3.872 -10.232 1.00 . A A . 9 ARG HH22 1 1 7 2150 1 1 9 ARG N N 1.983 0.558 -4.333 1.00 . A A . 9 ARG N 1 1 7 2151 1 1 9 ARG NE N 4.162 -3.065 -7.513 1.00 . A A . 9 ARG NE 1 1 7 2152 1 1 9 ARG NH1 N 6.497 -3.083 -7.895 1.00 . A A . 9 ARG NH1 1 1 7 2153 1 1 9 ARG NH2 N 5.009 -3.710 -9.622 1.00 . A A . 9 ARG NH2 1 1 7 2154 1 1 9 ARG O O 3.595 1.326 -7.200 1.00 . A A . 9 ARG O 1 1 7 2155 1 1 10 ASP C C 2.061 4.576 -5.852 1.00 . A A . 10 ASP C 1 1 7 2156 1 1 10 ASP CA C 1.846 3.322 -6.604 1.00 . A A . 10 ASP CA 1 1 7 2157 1 1 10 ASP CB C 0.600 3.284 -7.266 1.00 . A A . 10 ASP CB 1 1 7 2158 1 1 10 ASP CG C 0.577 3.967 -8.631 1.00 . A A . 10 ASP CG 1 1 7 2159 1 1 10 ASP H H 1.416 2.136 -5.016 1.00 . A A . 10 ASP H 1 1 7 2160 1 1 10 ASP HA H 2.609 3.233 -7.260 1.00 . A A . 10 ASP HA 1 1 7 2161 1 1 10 ASP HB2 H 0.415 2.201 -7.367 1.00 . A A . 10 ASP HB2 1 1 7 2162 1 1 10 ASP HB3 H -0.129 3.733 -6.589 1.00 . A A . 10 ASP HB3 1 1 7 2163 1 1 10 ASP N N 1.971 2.203 -5.878 1.00 . A A . 10 ASP N 1 1 7 2164 1 1 10 ASP O O 2.045 5.647 -6.462 1.00 . A A . 10 ASP O 1 1 7 2165 1 1 10 ASP OD1 O 0.864 3.272 -9.642 1.00 . A A . 10 ASP OD1 1 1 7 2166 1 1 10 ASP OD2 O 0.272 5.188 -8.680 1.00 . A A . 10 ASP OD2 1 1 7 2167 1 1 11 . C C 2.246 6.023 -2.454 1.00 . A A . 11 DPN C 1 1 7 2168 1 1 11 . CA C 2.503 5.843 -3.918 1.00 . A A . 11 DPN CA 1 1 7 2169 1 1 11 . CB C 3.963 6.178 -4.138 1.00 . A A . 11 DPN CB 1 1 7 2170 1 1 11 . CD1 C 4.632 4.823 -6.044 1.00 . A A . 11 DPN CD1 1 1 7 2171 1 1 11 . CD2 C 4.836 4.182 -3.816 1.00 . A A . 11 DPN CD2 1 1 7 2172 1 1 11 . CE1 C 4.857 3.559 -6.382 1.00 . A A . 11 DPN CE1 1 1 7 2173 1 1 11 . CE2 C 5.128 3.014 -4.139 1.00 . A A . 11 DPN CE2 1 1 7 2174 1 1 11 . CG C 4.602 5.092 -4.715 1.00 . A A . 11 DPN CG 1 1 7 2175 1 1 11 . CZ C 5.103 2.681 -5.376 1.00 . A A . 11 DPN CZ 1 1 7 2176 1 1 11 . H H 2.240 3.669 -3.959 1.00 . A A . 11 DPN H 1 1 7 2177 1 1 11 . HA H 1.920 6.528 -4.409 1.00 . A A . 11 DPN HA 1 1 7 2178 1 1 11 . HB2 H 4.428 6.276 -3.166 1.00 . A A . 11 DPN HB2 1 1 7 2179 1 1 11 . HB3 H 4.085 7.008 -4.777 1.00 . A A . 11 DPN HB3 1 1 7 2180 1 1 11 . HD1 H 4.439 5.586 -6.784 1.00 . A A . 11 DPN HD1 1 1 7 2181 1 1 11 . HD2 H 4.864 4.457 -2.818 1.00 . A A . 11 DPN HD2 1 1 7 2182 1 1 11 . HE1 H 4.856 3.243 -7.410 1.00 . A A . 11 DPN HE1 1 1 7 2183 1 1 11 . HE2 H 5.265 2.283 -3.394 1.00 . A A . 11 DPN HE2 1 1 7 2184 1 1 11 . HZ H 5.172 1.740 -5.547 1.00 . A A . 11 DPN HZ 1 1 7 2185 1 1 11 . N N 2.224 4.542 -4.513 1.00 . A A . 11 DPN N 1 1 7 2186 1 1 11 . O O 1.266 6.643 -2.046 1.00 . A A . 11 DPN O 1 1 7 2187 1 1 12 ILE C C 4.499 5.042 0.240 1.00 . A A . 12 ILE C 1 1 7 2188 1 1 12 ILE CA C 3.197 5.675 -0.232 1.00 . A A . 12 ILE CA 1 1 7 2189 1 1 12 ILE CB C 2.030 5.062 0.479 1.00 . A A . 12 ILE CB 1 1 7 2190 1 1 12 ILE CD1 C 2.508 3.052 -0.643 1.00 . A A . 12 ILE CD1 1 1 7 2191 1 1 12 ILE CG1 C 1.452 4.004 -0.399 1.00 . A A . 12 ILE CG1 1 1 7 2192 1 1 12 ILE CG2 C 1.005 6.148 0.838 1.00 . A A . 12 ILE CG2 1 1 7 2193 1 1 12 ILE H H 3.823 4.849 -2.007 1.00 . A A . 12 ILE H 1 1 7 2194 1 1 12 ILE HA H 3.243 6.695 -0.044 1.00 . A A . 12 ILE HA 1 1 7 2195 1 1 12 ILE HB H 2.393 4.574 1.393 1.00 . A A . 12 ILE HB 1 1 7 2196 1 1 12 ILE HD11 H 3.365 3.313 -0.056 1.00 . A A . 12 ILE HD11 1 1 7 2197 1 1 12 ILE HD12 H 2.803 3.090 -1.728 1.00 . A A . 12 ILE HD12 1 1 7 2198 1 1 12 ILE HD13 H 2.195 2.062 -0.356 1.00 . A A . 12 ILE HD13 1 1 7 2199 1 1 12 ILE HG12 H 0.597 3.501 0.084 1.00 . A A . 12 ILE HG12 1 1 7 2200 1 1 12 ILE HG13 H 1.141 4.425 -1.379 1.00 . A A . 12 ILE HG13 1 1 7 2201 1 1 12 ILE HG21 H 0.873 6.207 1.939 1.00 . A A . 12 ILE HG21 1 1 7 2202 1 1 12 ILE HG22 H 0.024 5.918 0.374 1.00 . A A . 12 ILE HG22 1 1 7 2203 1 1 12 ILE HG23 H 1.346 7.136 0.466 1.00 . A A . 12 ILE HG23 1 1 7 2204 1 1 12 ILE N N 3.172 5.490 -1.653 1.00 . A A . 12 ILE N 1 1 7 2205 1 1 12 ILE O O 4.841 5.093 1.410 1.00 . A A . 12 ILE O 1 1 7 2206 1 1 13 LEU C C 7.580 4.287 -1.104 1.00 . A A . 13 LEU C 1 1 7 2207 1 1 13 LEU CA C 6.431 3.620 -0.477 1.00 . A A . 13 LEU CA 1 1 7 2208 1 1 13 LEU CB C 6.396 2.285 -1.191 1.00 . A A . 13 LEU CB 1 1 7 2209 1 1 13 LEU CD1 C 5.000 0.406 -1.928 1.00 . A A . 13 LEU CD1 1 1 7 2210 1 1 13 LEU CD2 C 4.693 1.547 0.386 1.00 . A A . 13 LEU CD2 1 1 7 2211 1 1 13 LEU CG C 5.066 1.679 -1.091 1.00 . A A . 13 LEU CG 1 1 7 2212 1 1 13 LEU H H 4.835 4.257 -1.655 1.00 . A A . 13 LEU H 1 1 7 2213 1 1 13 LEU HA H 6.572 3.495 0.573 1.00 . A A . 13 LEU HA 1 1 7 2214 1 1 13 LEU HB2 H 6.607 2.438 -2.267 1.00 . A A . 13 LEU HB2 1 1 7 2215 1 1 13 LEU HB3 H 7.142 1.595 -0.767 1.00 . A A . 13 LEU HB3 1 1 7 2216 1 1 13 LEU HD11 H 4.425 0.614 -2.873 1.00 . A A . 13 LEU HD11 1 1 7 2217 1 1 13 LEU HD12 H 4.505 -0.410 -1.371 1.00 . A A . 13 LEU HD12 1 1 7 2218 1 1 13 LEU HD13 H 6.021 0.092 -2.217 1.00 . A A . 13 LEU HD13 1 1 7 2219 1 1 13 LEU HD21 H 5.404 0.887 0.912 1.00 . A A . 13 LEU HD21 1 1 7 2220 1 1 13 LEU HD22 H 3.666 1.145 0.492 1.00 . A A . 13 LEU HD22 1 1 7 2221 1 1 13 LEU HD23 H 4.734 2.577 0.864 1.00 . A A . 13 LEU HD23 1 1 7 2222 1 1 13 LEU HG H 4.375 2.404 -1.563 1.00 . A A . 13 LEU HG 1 1 7 2223 1 1 13 LEU N N 5.199 4.355 -0.726 1.00 . A A . 13 LEU N 1 1 7 2224 1 1 13 LEU O O 8.622 4.468 -0.502 1.00 . A A . 13 LEU O 1 1 7 2225 1 1 14 GLN C C 8.689 6.551 -2.457 1.00 . A A . 14 GLN C 1 1 7 2226 1 1 14 GLN CA C 8.523 5.253 -3.100 1.00 . A A . 14 GLN CA 1 1 7 2227 1 1 14 GLN CB C 8.261 5.548 -4.574 1.00 . A A . 14 GLN CB 1 1 7 2228 1 1 14 GLN CD C 8.707 3.167 -4.946 1.00 . A A . 14 GLN CD 1 1 7 2229 1 1 14 GLN CG C 7.820 4.326 -5.307 1.00 . A A . 14 GLN CG 1 1 7 2230 1 1 14 GLN H H 6.575 4.404 -2.907 1.00 . A A . 14 GLN H 1 1 7 2231 1 1 14 GLN HA H 9.408 4.660 -2.967 1.00 . A A . 14 GLN HA 1 1 7 2232 1 1 14 GLN HB2 H 7.453 6.307 -4.648 1.00 . A A . 14 GLN HB2 1 1 7 2233 1 1 14 GLN HB3 H 9.173 5.952 -5.046 1.00 . A A . 14 GLN HB3 1 1 7 2234 1 1 14 GLN HE21 H 7.188 2.479 -3.791 1.00 . A A . 14 GLN HE21 1 1 7 2235 1 1 14 GLN HE22 H 8.624 1.492 -3.793 1.00 . A A . 14 GLN HE22 1 1 7 2236 1 1 14 GLN HG2 H 6.801 4.105 -4.982 1.00 . A A . 14 GLN HG2 1 1 7 2237 1 1 14 GLN HG3 H 7.837 4.495 -6.397 1.00 . A A . 14 GLN HG3 1 1 7 2238 1 1 14 GLN N N 7.428 4.612 -2.396 1.00 . A A . 14 GLN N 1 1 7 2239 1 1 14 GLN NE2 N 8.130 2.294 -4.107 1.00 . A A . 14 GLN NE2 1 1 7 2240 1 1 14 GLN O O 9.723 7.210 -2.557 1.00 . A A . 14 GLN O 1 1 7 2241 1 1 14 GLN OE1 O 9.865 3.074 -5.339 1.00 . A A . 14 GLN OE1 1 1 7 2242 1 1 15 ARG C C 7.840 7.872 0.341 1.00 . A A . 15 ARG C 1 1 7 2243 1 1 15 ARG CA C 7.638 8.176 -1.107 1.00 . A A . 15 ARG CA 1 1 7 2244 1 1 15 ARG CB C 6.312 8.949 -1.192 1.00 . A A . 15 ARG CB 1 1 7 2245 1 1 15 ARG CD C 4.010 8.584 -2.082 1.00 . A A . 15 ARG CD 1 1 7 2246 1 1 15 ARG CG C 5.493 8.589 -2.415 1.00 . A A . 15 ARG CG 1 1 7 2247 1 1 15 ARG CZ C 3.351 10.973 -2.334 1.00 . A A . 15 ARG CZ 1 1 7 2248 1 1 15 ARG H H 6.794 6.346 -1.695 1.00 . A A . 15 ARG H 1 1 7 2249 1 1 15 ARG HA H 8.452 8.738 -1.513 1.00 . A A . 15 ARG HA 1 1 7 2250 1 1 15 ARG HB2 H 5.699 8.747 -0.283 1.00 . A A . 15 ARG HB2 1 1 7 2251 1 1 15 ARG HB3 H 6.531 10.038 -1.218 1.00 . A A . 15 ARG HB3 1 1 7 2252 1 1 15 ARG HD2 H 3.398 8.390 -2.986 1.00 . A A . 15 ARG HD2 1 1 7 2253 1 1 15 ARG HD3 H 3.803 7.803 -1.315 1.00 . A A . 15 ARG HD3 1 1 7 2254 1 1 15 ARG HE H 3.573 10.031 -0.516 1.00 . A A . 15 ARG HE 1 1 7 2255 1 1 15 ARG HG2 H 5.695 9.311 -3.230 1.00 . A A . 15 ARG HG2 1 1 7 2256 1 1 15 ARG HG3 H 5.781 7.572 -2.763 1.00 . A A . 15 ARG HG3 1 1 7 2257 1 1 15 ARG HH11 H 3.664 9.946 -4.085 1.00 . A A . 15 ARG HH11 1 1 7 2258 1 1 15 ARG HH12 H 3.211 11.604 -4.287 1.00 . A A . 15 ARG HH12 1 1 7 2259 1 1 15 ARG HH21 H 2.957 12.282 -0.801 1.00 . A A . 15 ARG HH21 1 1 7 2260 1 1 15 ARG HH22 H 2.803 12.954 -2.390 1.00 . A A . 15 ARG HH22 1 1 7 2261 1 1 15 ARG N N 7.624 6.933 -1.771 1.00 . A A . 15 ARG N 1 1 7 2262 1 1 15 ARG NE N 3.629 9.914 -1.512 1.00 . A A . 15 ARG NE 1 1 7 2263 1 1 15 ARG NH1 N 3.415 10.829 -3.690 1.00 . A A . 15 ARG NH1 1 1 7 2264 1 1 15 ARG NH2 N 3.006 12.177 -1.794 1.00 . A A . 15 ARG NH2 1 1 7 2265 1 1 15 ARG O O 8.440 8.650 1.080 1.00 . A A . 15 ARG O 1 1 7 2266 1 1 16 LYS C C 6.494 7.261 2.888 1.00 . A A . 16 LYS C 1 1 7 2267 1 1 16 LYS CA C 7.314 6.266 2.131 1.00 . A A . 16 LYS CA 1 1 7 2268 1 1 16 LYS CB C 8.690 6.239 2.778 1.00 . A A . 16 LYS CB 1 1 7 2269 1 1 16 LYS CD C 9.216 3.796 2.304 1.00 . A A . 16 LYS CD 1 1 7 2270 1 1 16 LYS CE C 10.248 2.796 1.777 1.00 . A A . 16 LYS CE 1 1 7 2271 1 1 16 LYS CG C 9.674 5.250 2.152 1.00 . A A . 16 LYS CG 1 1 7 2272 1 1 16 LYS H H 6.876 6.060 0.122 1.00 . A A . 16 LYS H 1 1 7 2273 1 1 16 LYS HA H 6.835 5.290 2.162 1.00 . A A . 16 LYS HA 1 1 7 2274 1 1 16 LYS HB2 H 9.104 7.257 2.690 1.00 . A A . 16 LYS HB2 1 1 7 2275 1 1 16 LYS HB3 H 8.572 6.008 3.851 1.00 . A A . 16 LYS HB3 1 1 7 2276 1 1 16 LYS HD2 H 9.021 3.586 3.376 1.00 . A A . 16 LYS HD2 1 1 7 2277 1 1 16 LYS HD3 H 8.262 3.660 1.748 1.00 . A A . 16 LYS HD3 1 1 7 2278 1 1 16 LYS HE2 H 10.436 2.963 0.696 1.00 . A A . 16 LYS HE2 1 1 7 2279 1 1 16 LYS HE3 H 11.203 2.890 2.337 1.00 . A A . 16 LYS HE3 1 1 7 2280 1 1 16 LYS HG2 H 9.795 5.487 1.076 1.00 . A A . 16 LYS HG2 1 1 7 2281 1 1 16 LYS HG3 H 10.665 5.369 2.641 1.00 . A A . 16 LYS HG3 1 1 7 2282 1 1 16 LYS HZ1 H 8.817 1.430 2.392 1.00 . A A . 16 LYS HZ1 1 1 7 2283 1 1 16 LYS HZ2 H 10.415 0.879 2.545 1.00 . A A . 16 LYS HZ2 1 1 7 2284 1 1 16 LYS HZ3 H 9.686 0.953 1.014 1.00 . A A . 16 LYS HZ3 1 1 7 2285 1 1 16 LYS N N 7.295 6.694 0.757 1.00 . A A . 16 LYS N 1 1 7 2286 1 1 16 LYS NZ N 9.754 1.412 1.945 1.00 . A A . 16 LYS NZ 1 1 7 2287 1 1 16 LYS O O 6.647 7.457 4.092 1.00 . A A . 16 LYS O 1 1 7 2288 1 1 17 LYS C C 5.590 10.022 3.291 1.00 . A A . 17 LYS C 1 1 7 2289 1 1 17 LYS CA C 4.725 8.913 2.657 1.00 . A A . 17 LYS CA 1 1 7 2290 1 1 17 LYS CB C 3.681 8.419 3.679 1.00 . A A . 17 LYS CB 1 1 7 2291 1 1 17 LYS CD C 1.935 9.864 2.525 1.00 . A A . 17 LYS CD 1 1 7 2292 1 1 17 LYS CE C 1.661 9.831 1.022 1.00 . A A . 17 LYS CE 1 1 7 2293 1 1 17 LYS CG C 2.275 8.479 3.092 1.00 . A A . 17 LYS CG 1 1 7 2294 1 1 17 LYS H H 5.455 7.641 1.194 1.00 . A A . 17 LYS H 1 1 7 2295 1 1 17 LYS HA H 4.225 9.326 1.793 1.00 . A A . 17 LYS HA 1 1 7 2296 1 1 17 LYS HB2 H 3.917 7.371 3.966 1.00 . A A . 17 LYS HB2 1 1 7 2297 1 1 17 LYS HB3 H 3.716 9.046 4.593 1.00 . A A . 17 LYS HB3 1 1 7 2298 1 1 17 LYS HD2 H 1.045 10.267 3.050 1.00 . A A . 17 LYS HD2 1 1 7 2299 1 1 17 LYS HD3 H 2.788 10.549 2.716 1.00 . A A . 17 LYS HD3 1 1 7 2300 1 1 17 LYS HE2 H 1.829 10.835 0.575 1.00 . A A . 17 LYS HE2 1 1 7 2301 1 1 17 LYS HE3 H 2.327 9.090 0.522 1.00 . A A . 17 LYS HE3 1 1 7 2302 1 1 17 LYS HG2 H 2.204 7.730 2.280 1.00 . A A . 17 LYS HG2 1 1 7 2303 1 1 17 LYS HG3 H 1.537 8.211 3.879 1.00 . A A . 17 LYS HG3 1 1 7 2304 1 1 17 LYS HZ1 H 0.208 8.910 -0.134 1.00 . A A . 17 LYS HZ1 1 1 7 2305 1 1 17 LYS HZ2 H -0.329 10.301 0.679 1.00 . A A . 17 LYS HZ2 1 1 7 2306 1 1 17 LYS HZ3 H -0.093 8.856 1.537 1.00 . A A . 17 LYS HZ3 1 1 7 2307 1 1 17 LYS N N 5.583 7.887 2.145 1.00 . A A . 17 LYS N 1 1 7 2308 1 1 17 LYS NZ N 0.258 9.446 0.757 1.00 . A A . 17 LYS NZ 1 1 7 2309 1 1 17 LYS O O 6.161 10.836 2.514 1.00 . A A . 17 LYS O 1 1 7 2310 1 1 17 LYS OXT O 5.676 10.081 4.550 1.00 . A A . 17 LYS OXT 1 1 8 2311 1 1 1 GLU C C -1.821 -8.616 -3.789 1.00 . A A . 1 GLU C 1 1 8 2312 1 1 1 GLU CA C -1.092 -9.577 -4.687 1.00 . A A . 1 GLU CA 1 1 8 2313 1 1 1 GLU CB C -2.126 -10.365 -5.519 1.00 . A A . 1 GLU CB 1 1 8 2314 1 1 1 GLU CD C -4.031 -11.979 -5.561 1.00 . A A . 1 GLU CD 1 1 8 2315 1 1 1 GLU CG C -3.099 -11.185 -4.652 1.00 . A A . 1 GLU CG 1 1 8 2316 1 1 1 GLU H1 H -0.339 -11.474 -4.281 1.00 . A A . 1 GLU H1 1 1 8 2317 1 1 1 GLU H2 H -0.584 -10.513 -2.900 1.00 . A A . 1 GLU H2 1 1 8 2318 1 1 1 GLU H3 H 0.739 -10.209 -3.924 1.00 . A A . 1 GLU H3 1 1 8 2319 1 1 1 GLU HA H -0.430 -9.027 -5.336 1.00 . A A . 1 GLU HA 1 1 8 2320 1 1 1 GLU HB2 H -2.708 -9.649 -6.142 1.00 . A A . 1 GLU HB2 1 1 8 2321 1 1 1 GLU HB3 H -1.586 -11.054 -6.203 1.00 . A A . 1 GLU HB3 1 1 8 2322 1 1 1 GLU HG2 H -2.532 -11.886 -4.002 1.00 . A A . 1 GLU HG2 1 1 8 2323 1 1 1 GLU HG3 H -3.706 -10.511 -4.012 1.00 . A A . 1 GLU HG3 1 1 8 2324 1 1 1 GLU N N -0.255 -10.514 -3.889 1.00 . A A . 1 GLU N 1 1 8 2325 1 1 1 GLU O O -2.116 -8.921 -2.633 1.00 . A A . 1 GLU O 1 1 8 2326 1 1 1 GLU OE1 O -3.897 -11.855 -6.808 1.00 . A A . 1 GLU OE1 1 1 8 2327 1 1 1 GLU OE2 O -4.891 -12.721 -5.017 1.00 . A A . 1 GLU OE2 1 1 8 2328 1 1 2 MET C C -3.855 -5.805 -4.418 1.00 . A A . 2 MET C 1 1 8 2329 1 1 2 MET CA C -2.831 -6.427 -3.543 1.00 . A A . 2 MET CA 1 1 8 2330 1 1 2 MET CB C -1.921 -5.332 -2.958 1.00 . A A . 2 MET CB 1 1 8 2331 1 1 2 MET CE C -4.138 -5.335 -0.908 1.00 . A A . 2 MET CE 1 1 8 2332 1 1 2 MET CG C -1.529 -5.547 -1.485 1.00 . A A . 2 MET CG 1 1 8 2333 1 1 2 MET H H -1.909 -7.168 -5.261 1.00 . A A . 2 MET H 1 1 8 2334 1 1 2 MET HA H -3.362 -6.922 -2.759 1.00 . A A . 2 MET HA 1 1 8 2335 1 1 2 MET HB2 H -0.993 -5.297 -3.562 1.00 . A A . 2 MET HB2 1 1 8 2336 1 1 2 MET HB3 H -2.420 -4.338 -3.045 1.00 . A A . 2 MET HB3 1 1 8 2337 1 1 2 MET HE1 H -4.941 -5.888 -1.446 1.00 . A A . 2 MET HE1 1 1 8 2338 1 1 2 MET HE2 H -3.786 -4.521 -1.570 1.00 . A A . 2 MET HE2 1 1 8 2339 1 1 2 MET HE3 H -4.582 -4.877 0.000 1.00 . A A . 2 MET HE3 1 1 8 2340 1 1 2 MET HG2 H -0.565 -6.095 -1.456 1.00 . A A . 2 MET HG2 1 1 8 2341 1 1 2 MET HG3 H -1.355 -4.542 -1.043 1.00 . A A . 2 MET HG3 1 1 8 2342 1 1 2 MET N N -2.134 -7.416 -4.322 1.00 . A A . 2 MET N 1 1 8 2343 1 1 2 MET O O -4.023 -6.167 -5.581 1.00 . A A . 2 MET O 1 1 8 2344 1 1 2 MET SD S -2.765 -6.435 -0.479 1.00 . A A . 2 MET SD 1 1 8 2345 1 1 3 ARG C C -5.343 -2.777 -4.532 1.00 . A A . 3 ARG C 1 1 8 2346 1 1 3 ARG CA C -5.624 -4.191 -4.494 1.00 . A A . 3 ARG CA 1 1 8 2347 1 1 3 ARG CB C -6.869 -4.357 -3.664 1.00 . A A . 3 ARG CB 1 1 8 2348 1 1 3 ARG CD C -8.539 -2.646 -4.365 1.00 . A A . 3 ARG CD 1 1 8 2349 1 1 3 ARG CG C -8.144 -4.115 -4.444 1.00 . A A . 3 ARG CG 1 1 8 2350 1 1 3 ARG CZ C -10.316 -1.285 -3.294 1.00 . A A . 3 ARG CZ 1 1 8 2351 1 1 3 ARG H H -4.374 -4.485 -2.936 1.00 . A A . 3 ARG H 1 1 8 2352 1 1 3 ARG HA H -5.718 -4.555 -5.449 1.00 . A A . 3 ARG HA 1 1 8 2353 1 1 3 ARG HB2 H -6.869 -5.378 -3.230 1.00 . A A . 3 ARG HB2 1 1 8 2354 1 1 3 ARG HB3 H -6.807 -3.617 -2.824 1.00 . A A . 3 ARG HB3 1 1 8 2355 1 1 3 ARG HD2 H -7.715 -2.062 -3.883 1.00 . A A . 3 ARG HD2 1 1 8 2356 1 1 3 ARG HD3 H -8.753 -2.236 -5.373 1.00 . A A . 3 ARG HD3 1 1 8 2357 1 1 3 ARG HE H -10.188 -3.331 -3.130 1.00 . A A . 3 ARG HE 1 1 8 2358 1 1 3 ARG HG2 H -7.983 -4.401 -5.503 1.00 . A A . 3 ARG HG2 1 1 8 2359 1 1 3 ARG HG3 H -8.957 -4.744 -4.027 1.00 . A A . 3 ARG HG3 1 1 8 2360 1 1 3 ARG HH11 H -8.925 -0.255 -4.398 1.00 . A A . 3 ARG HH11 1 1 8 2361 1 1 3 ARG HH12 H -10.148 0.730 -3.666 1.00 . A A . 3 ARG HH12 1 1 8 2362 1 1 3 ARG HH21 H -11.855 -1.995 -2.131 1.00 . A A . 3 ARG HH21 1 1 8 2363 1 1 3 ARG HH22 H -11.841 -0.278 -2.354 1.00 . A A . 3 ARG HH22 1 1 8 2364 1 1 3 ARG N N -4.564 -4.828 -3.842 1.00 . A A . 3 ARG N 1 1 8 2365 1 1 3 ARG NE N -9.768 -2.515 -3.525 1.00 . A A . 3 ARG NE 1 1 8 2366 1 1 3 ARG NH1 N -9.746 -0.170 -3.834 1.00 . A A . 3 ARG NH1 1 1 8 2367 1 1 3 ARG NH2 N -11.437 -1.176 -2.524 1.00 . A A . 3 ARG NH2 1 1 8 2368 1 1 3 ARG O O -5.740 -2.044 -5.436 1.00 . A A . 3 ARG O 1 1 8 2369 1 1 4 LEU C C -3.404 -0.757 -4.446 1.00 . A A . 4 LEU C 1 1 8 2370 1 1 4 LEU CA C -4.299 -1.043 -3.348 1.00 . A A . 4 LEU CA 1 1 8 2371 1 1 4 LEU CB C -3.508 -0.806 -2.086 1.00 . A A . 4 LEU CB 1 1 8 2372 1 1 4 LEU CD1 C -2.485 -1.797 -0.097 1.00 . A A . 4 LEU CD1 1 1 8 2373 1 1 4 LEU CD2 C -4.986 -2.152 -0.575 1.00 . A A . 4 LEU CD2 1 1 8 2374 1 1 4 LEU CG C -3.579 -1.953 -1.139 1.00 . A A . 4 LEU CG 1 1 8 2375 1 1 4 LEU H H -4.234 -3.014 -2.865 1.00 . A A . 4 LEU H 1 1 8 2376 1 1 4 LEU HA H -5.124 -0.435 -3.398 1.00 . A A . 4 LEU HA 1 1 8 2377 1 1 4 LEU HB2 H -2.471 -0.605 -2.333 1.00 . A A . 4 LEU HB2 1 1 8 2378 1 1 4 LEU HB3 H -3.915 0.066 -1.567 1.00 . A A . 4 LEU HB3 1 1 8 2379 1 1 4 LEU HD11 H -1.736 -2.613 -0.225 1.00 . A A . 4 LEU HD11 1 1 8 2380 1 1 4 LEU HD12 H -2.897 -1.827 0.929 1.00 . A A . 4 LEU HD12 1 1 8 2381 1 1 4 LEU HD13 H -1.961 -0.823 -0.264 1.00 . A A . 4 LEU HD13 1 1 8 2382 1 1 4 LEU HD21 H -5.485 -1.170 -0.434 1.00 . A A . 4 LEU HD21 1 1 8 2383 1 1 4 LEU HD22 H -4.945 -2.681 0.398 1.00 . A A . 4 LEU HD22 1 1 8 2384 1 1 4 LEU HD23 H -5.593 -2.759 -1.294 1.00 . A A . 4 LEU HD23 1 1 8 2385 1 1 4 LEU HG H -3.318 -2.837 -1.731 1.00 . A A . 4 LEU HG 1 1 8 2386 1 1 4 LEU N N -4.618 -2.380 -3.522 1.00 . A A . 4 LEU N 1 1 8 2387 1 1 4 LEU O O -3.785 -0.024 -5.329 1.00 . A A . 4 LEU O 1 1 8 2388 1 1 5 SER C C -1.134 -1.008 -6.579 1.00 . A A . 5 SER C 1 1 8 2389 1 1 5 SER CA C -1.171 -1.702 -5.242 1.00 . A A . 5 SER CA 1 1 8 2390 1 1 5 SER CB C -0.731 -3.125 -5.320 1.00 . A A . 5 SER CB 1 1 8 2391 1 1 5 SER H H -2.457 -2.393 -3.816 1.00 . A A . 5 SER H 1 1 8 2392 1 1 5 SER HA H -0.458 -1.181 -4.612 1.00 . A A . 5 SER HA 1 1 8 2393 1 1 5 SER HB2 H 0.342 -3.164 -5.049 1.00 . A A . 5 SER HB2 1 1 8 2394 1 1 5 SER HB3 H -1.330 -3.679 -4.546 1.00 . A A . 5 SER HB3 1 1 8 2395 1 1 5 SER HG H -0.471 -3.155 -7.232 1.00 . A A . 5 SER HG 1 1 8 2396 1 1 5 SER N N -2.403 -1.656 -4.467 1.00 . A A . 5 SER N 1 1 8 2397 1 1 5 SER O O -0.120 -0.987 -7.263 1.00 . A A . 5 SER O 1 1 8 2398 1 1 5 SER OG O -0.942 -3.712 -6.602 1.00 . A A . 5 SER OG 1 1 8 2399 1 1 6 LYS C C -1.950 1.685 -7.227 1.00 . A A . 6 LYS C 1 1 8 2400 1 1 6 LYS CA C -2.252 0.436 -8.055 1.00 . A A . 6 LYS CA 1 1 8 2401 1 1 6 LYS CB C -3.610 0.610 -8.744 1.00 . A A . 6 LYS CB 1 1 8 2402 1 1 6 LYS CD C -5.541 -0.583 -9.892 1.00 . A A . 6 LYS CD 1 1 8 2403 1 1 6 LYS CE C -5.758 0.408 -11.040 1.00 . A A . 6 LYS CE 1 1 8 2404 1 1 6 LYS CG C -4.081 -0.667 -9.441 1.00 . A A . 6 LYS CG 1 1 8 2405 1 1 6 LYS H H -3.124 -0.670 -6.563 1.00 . A A . 6 LYS H 1 1 8 2406 1 1 6 LYS HA H -1.445 0.225 -8.745 1.00 . A A . 6 LYS HA 1 1 8 2407 1 1 6 LYS HB2 H -4.363 0.918 -7.987 1.00 . A A . 6 LYS HB2 1 1 8 2408 1 1 6 LYS HB3 H -3.523 1.423 -9.496 1.00 . A A . 6 LYS HB3 1 1 8 2409 1 1 6 LYS HD2 H -5.879 -1.591 -10.215 1.00 . A A . 6 LYS HD2 1 1 8 2410 1 1 6 LYS HD3 H -6.163 -0.276 -9.025 1.00 . A A . 6 LYS HD3 1 1 8 2411 1 1 6 LYS HE2 H -6.842 0.527 -11.250 1.00 . A A . 6 LYS HE2 1 1 8 2412 1 1 6 LYS HE3 H -5.321 1.398 -10.791 1.00 . A A . 6 LYS HE3 1 1 8 2413 1 1 6 LYS HG2 H -3.438 -0.857 -10.326 1.00 . A A . 6 LYS HG2 1 1 8 2414 1 1 6 LYS HG3 H -3.966 -1.526 -8.744 1.00 . A A . 6 LYS HG3 1 1 8 2415 1 1 6 LYS HZ1 H -4.709 -1.027 -12.105 1.00 . A A . 6 LYS HZ1 1 1 8 2416 1 1 6 LYS HZ2 H -4.348 0.573 -12.550 1.00 . A A . 6 LYS HZ2 1 1 8 2417 1 1 6 LYS HZ3 H -5.811 -0.136 -13.040 1.00 . A A . 6 LYS HZ3 1 1 8 2418 1 1 6 LYS N N -2.240 -0.486 -6.998 1.00 . A A . 6 LYS N 1 1 8 2419 1 1 6 LYS NZ N -5.108 -0.082 -12.276 1.00 . A A . 6 LYS NZ 1 1 8 2420 1 1 6 LYS O O -1.946 2.810 -7.713 1.00 . A A . 6 LYS O 1 1 8 2421 1 1 7 PHE C C -0.337 2.561 -4.254 1.00 . A A . 7 PHE C 1 1 8 2422 1 1 7 PHE CA C -1.612 2.310 -4.816 1.00 . A A . 7 PHE CA 1 1 8 2423 1 1 7 PHE CB C -2.216 1.678 -3.593 1.00 . A A . 7 PHE CB 1 1 8 2424 1 1 7 PHE CD1 C -3.845 2.206 -1.942 1.00 . A A . 7 PHE CD1 1 1 8 2425 1 1 7 PHE CD2 C -1.727 3.206 -1.907 1.00 . A A . 7 PHE CD2 1 1 8 2426 1 1 7 PHE CE1 C -4.091 2.743 -0.740 1.00 . A A . 7 PHE CE1 1 1 8 2427 1 1 7 PHE CE2 C -1.911 3.773 -0.776 1.00 . A A . 7 PHE CE2 1 1 8 2428 1 1 7 PHE CG C -2.683 2.445 -2.517 1.00 . A A . 7 PHE CG 1 1 8 2429 1 1 7 PHE CZ C -3.120 3.560 -0.115 1.00 . A A . 7 PHE CZ 1 1 8 2430 1 1 7 PHE H H -1.761 0.444 -5.491 1.00 . A A . 7 PHE H 1 1 8 2431 1 1 7 PHE HA H -2.136 3.203 -5.006 1.00 . A A . 7 PHE HA 1 1 8 2432 1 1 7 PHE HB2 H -3.148 1.275 -3.940 1.00 . A A . 7 PHE HB2 1 1 8 2433 1 1 7 PHE HB3 H -1.638 0.835 -3.188 1.00 . A A . 7 PHE HB3 1 1 8 2434 1 1 7 PHE HD1 H -4.578 1.565 -2.445 1.00 . A A . 7 PHE HD1 1 1 8 2435 1 1 7 PHE HD2 H -0.792 3.383 -2.373 1.00 . A A . 7 PHE HD2 1 1 8 2436 1 1 7 PHE HE1 H -5.006 2.494 -0.283 1.00 . A A . 7 PHE HE1 1 1 8 2437 1 1 7 PHE HE2 H -1.053 4.341 -0.396 1.00 . A A . 7 PHE HE2 1 1 8 2438 1 1 7 PHE HZ H -3.306 3.999 0.854 1.00 . A A . 7 PHE HZ 1 1 8 2439 1 1 7 PHE N N -1.838 1.414 -5.857 1.00 . A A . 7 PHE N 1 1 8 2440 1 1 7 PHE O O 0.120 3.664 -4.261 1.00 . A A . 7 PHE O 1 1 8 2441 1 1 8 PHE C C 2.251 1.532 -3.505 1.00 . A A . 8 PHE C 1 1 8 2442 1 1 8 PHE CA C 1.202 1.725 -2.682 1.00 . A A . 8 PHE CA 1 1 8 2443 1 1 8 PHE CB C 1.568 0.665 -1.699 1.00 . A A . 8 PHE CB 1 1 8 2444 1 1 8 PHE CD1 C 2.030 -1.443 -2.262 1.00 . A A . 8 PHE CD1 1 1 8 2445 1 1 8 PHE CD2 C -0.171 -0.816 -1.967 1.00 . A A . 8 PHE CD2 1 1 8 2446 1 1 8 PHE CE1 C 1.705 -2.617 -2.602 1.00 . A A . 8 PHE CE1 1 1 8 2447 1 1 8 PHE CE2 C -0.533 -2.021 -2.306 1.00 . A A . 8 PHE CE2 1 1 8 2448 1 1 8 PHE CG C 1.090 -0.555 -1.950 1.00 . A A . 8 PHE CG 1 1 8 2449 1 1 8 PHE CZ C 0.410 -2.935 -2.635 1.00 . A A . 8 PHE CZ 1 1 8 2450 1 1 8 PHE H H -0.181 0.611 -3.649 1.00 . A A . 8 PHE H 1 1 8 2451 1 1 8 PHE HA H 1.221 2.684 -2.337 1.00 . A A . 8 PHE HA 1 1 8 2452 1 1 8 PHE HB2 H 2.630 0.559 -1.570 1.00 . A A . 8 PHE HB2 1 1 8 2453 1 1 8 PHE HB3 H 1.086 0.924 -0.757 1.00 . A A . 8 PHE HB3 1 1 8 2454 1 1 8 PHE HD1 H 3.074 -1.163 -2.232 1.00 . A A . 8 PHE HD1 1 1 8 2455 1 1 8 PHE HD2 H -0.886 -0.065 -1.689 1.00 . A A . 8 PHE HD2 1 1 8 2456 1 1 8 PHE HE1 H 2.466 -3.280 -2.869 1.00 . A A . 8 PHE HE1 1 1 8 2457 1 1 8 PHE HE2 H -1.542 -2.239 -2.364 1.00 . A A . 8 PHE HE2 1 1 8 2458 1 1 8 PHE HZ H 0.135 -3.863 -2.910 1.00 . A A . 8 PHE HZ 1 1 8 2459 1 1 8 PHE N N 0.166 1.522 -3.575 1.00 . A A . 8 PHE N 1 1 8 2460 1 1 8 PHE O O 3.171 2.199 -3.476 1.00 . A A . 8 PHE O 1 1 8 2461 1 1 9 ARG C C 2.945 1.295 -6.189 1.00 . A A . 9 ARG C 1 1 8 2462 1 1 9 ARG CA C 2.910 0.195 -5.277 1.00 . A A . 9 ARG CA 1 1 8 2463 1 1 9 ARG CB C 2.426 -1.031 -5.975 1.00 . A A . 9 ARG CB 1 1 8 2464 1 1 9 ARG CD C 4.368 -2.643 -6.089 1.00 . A A . 9 ARG CD 1 1 8 2465 1 1 9 ARG CG C 3.030 -2.315 -5.432 1.00 . A A . 9 ARG CG 1 1 8 2466 1 1 9 ARG CZ C 5.150 -3.439 -8.305 1.00 . A A . 9 ARG CZ 1 1 8 2467 1 1 9 ARG H H 1.142 0.140 -4.358 1.00 . A A . 9 ARG H 1 1 8 2468 1 1 9 ARG HA H 3.816 0.081 -4.807 1.00 . A A . 9 ARG HA 1 1 8 2469 1 1 9 ARG HB2 H 1.318 -1.055 -5.790 1.00 . A A . 9 ARG HB2 1 1 8 2470 1 1 9 ARG HB3 H 2.612 -0.935 -7.059 1.00 . A A . 9 ARG HB3 1 1 8 2471 1 1 9 ARG HD2 H 4.991 -1.727 -6.170 1.00 . A A . 9 ARG HD2 1 1 8 2472 1 1 9 ARG HD3 H 4.910 -3.423 -5.515 1.00 . A A . 9 ARG HD3 1 1 8 2473 1 1 9 ARG HE H 3.168 -3.312 -7.770 1.00 . A A . 9 ARG HE 1 1 8 2474 1 1 9 ARG HG2 H 3.189 -2.202 -4.346 1.00 . A A . 9 ARG HG2 1 1 8 2475 1 1 9 ARG HG3 H 2.320 -3.152 -5.598 1.00 . A A . 9 ARG HG3 1 1 8 2476 1 1 9 ARG HH11 H 6.614 -2.896 -6.971 1.00 . A A . 9 ARG HH11 1 1 8 2477 1 1 9 ARG HH12 H 7.196 -3.442 -8.508 1.00 . A A . 9 ARG HH12 1 1 8 2478 1 1 9 ARG HH21 H 3.959 -4.056 -9.861 1.00 . A A . 9 ARG HH21 1 1 8 2479 1 1 9 ARG HH22 H 5.660 -4.113 -10.179 1.00 . A A . 9 ARG HH22 1 1 8 2480 1 1 9 ARG N N 2.019 0.575 -4.331 1.00 . A A . 9 ARG N 1 1 8 2481 1 1 9 ARG NE N 4.109 -3.165 -7.464 1.00 . A A . 9 ARG NE 1 1 8 2482 1 1 9 ARG NH1 N 6.435 -3.242 -7.892 1.00 . A A . 9 ARG NH1 1 1 8 2483 1 1 9 ARG NH2 N 4.901 -3.911 -9.560 1.00 . A A . 9 ARG NH2 1 1 8 2484 1 1 9 ARG O O 3.633 1.286 -7.209 1.00 . A A . 9 ARG O 1 1 8 2485 1 1 10 ASP C C 2.135 4.566 -5.904 1.00 . A A . 10 ASP C 1 1 8 2486 1 1 10 ASP CA C 1.906 3.308 -6.639 1.00 . A A . 10 ASP CA 1 1 8 2487 1 1 10 ASP CB C 0.665 3.288 -7.306 1.00 . A A . 10 ASP CB 1 1 8 2488 1 1 10 ASP CG C 0.637 4.058 -8.622 1.00 . A A . 10 ASP CG 1 1 8 2489 1 1 10 ASP H H 1.461 2.146 -5.036 1.00 . A A . 10 ASP H 1 1 8 2490 1 1 10 ASP HA H 2.669 3.202 -7.295 1.00 . A A . 10 ASP HA 1 1 8 2491 1 1 10 ASP HB2 H 0.495 2.211 -7.472 1.00 . A A . 10 ASP HB2 1 1 8 2492 1 1 10 ASP HB3 H -0.070 3.683 -6.602 1.00 . A A . 10 ASP HB3 1 1 8 2493 1 1 10 ASP N N 2.017 2.197 -5.900 1.00 . A A . 10 ASP N 1 1 8 2494 1 1 10 ASP O O 2.122 5.630 -6.526 1.00 . A A . 10 ASP O 1 1 8 2495 1 1 10 ASP OD1 O 1.479 3.747 -9.507 1.00 . A A . 10 ASP OD1 1 1 8 2496 1 1 10 ASP OD2 O -0.221 4.971 -8.759 1.00 . A A . 10 ASP OD2 1 1 8 2497 1 1 11 . C C 2.343 6.046 -2.522 1.00 . A A . 11 DPN C 1 1 8 2498 1 1 11 . CA C 2.592 5.846 -3.985 1.00 . A A . 11 DPN CA 1 1 8 2499 1 1 11 . CB C 4.054 6.166 -4.218 1.00 . A A . 11 DPN CB 1 1 8 2500 1 1 11 . CD1 C 4.710 4.787 -6.107 1.00 . A A . 11 DPN CD1 1 1 8 2501 1 1 11 . CD2 C 4.904 4.170 -3.872 1.00 . A A . 11 DPN CD2 1 1 8 2502 1 1 11 . CE1 C 4.924 3.517 -6.430 1.00 . A A . 11 DPN CE1 1 1 8 2503 1 1 11 . CE2 C 5.186 2.998 -4.180 1.00 . A A . 11 DPN CE2 1 1 8 2504 1 1 11 . CG C 4.680 5.071 -4.781 1.00 . A A . 11 DPN CG 1 1 8 2505 1 1 11 . CZ C 5.160 2.651 -5.411 1.00 . A A . 11 DPN CZ 1 1 8 2506 1 1 11 . H H 2.306 3.679 -4.001 1.00 . A A . 11 DPN H 1 1 8 2507 1 1 11 . HA H 2.014 6.534 -4.482 1.00 . A A . 11 DPN HA 1 1 8 2508 1 1 11 . HB2 H 4.521 6.275 -3.248 1.00 . A A . 11 DPN HB2 1 1 8 2509 1 1 11 . HB3 H 4.179 6.988 -4.867 1.00 . A A . 11 DPN HB3 1 1 8 2510 1 1 11 . HD1 H 4.524 5.543 -6.857 1.00 . A A . 11 DPN HD1 1 1 8 2511 1 1 11 . HD2 H 4.932 4.457 -2.879 1.00 . A A . 11 DPN HD2 1 1 8 2512 1 1 11 . HE1 H 4.923 3.188 -7.454 1.00 . A A . 11 DPN HE1 1 1 8 2513 1 1 11 . HE2 H 5.314 2.277 -3.428 1.00 . A A . 11 DPN HE2 1 1 8 2514 1 1 11 . HZ H 5.220 1.709 -5.567 1.00 . A A . 11 DPN HZ 1 1 8 2515 1 1 11 . N N 2.300 4.545 -4.565 1.00 . A A . 11 DPN N 1 1 8 2516 1 1 11 . O O 1.363 6.670 -2.123 1.00 . A A . 11 DPN O 1 1 8 2517 1 1 12 ILE C C 4.576 5.049 0.185 1.00 . A A . 12 ILE C 1 1 8 2518 1 1 12 ILE CA C 3.302 5.726 -0.294 1.00 . A A . 12 ILE CA 1 1 8 2519 1 1 12 ILE CB C 2.126 5.163 0.435 1.00 . A A . 12 ILE CB 1 1 8 2520 1 1 12 ILE CD1 C 2.555 3.121 -0.667 1.00 . A A . 12 ILE CD1 1 1 8 2521 1 1 12 ILE CG1 C 1.516 4.104 -0.425 1.00 . A A . 12 ILE CG1 1 1 8 2522 1 1 12 ILE CG2 C 1.149 6.296 0.799 1.00 . A A . 12 ILE CG2 1 1 8 2523 1 1 12 ILE H H 3.902 4.858 -2.047 1.00 . A A . 12 ILE H 1 1 8 2524 1 1 12 ILE HA H 3.386 6.746 -0.126 1.00 . A A . 12 ILE HA 1 1 8 2525 1 1 12 ILE HB H 2.485 4.676 1.351 1.00 . A A . 12 ILE HB 1 1 8 2526 1 1 12 ILE HD11 H 2.222 2.142 -0.395 1.00 . A A . 12 ILE HD11 1 1 8 2527 1 1 12 ILE HD12 H 3.411 3.351 -0.065 1.00 . A A . 12 ILE HD12 1 1 8 2528 1 1 12 ILE HD13 H 2.859 3.149 -1.753 1.00 . A A . 12 ILE HD13 1 1 8 2529 1 1 12 ILE HG12 H 0.655 3.625 0.071 1.00 . A A . 12 ILE HG12 1 1 8 2530 1 1 12 ILE HG13 H 1.206 4.513 -1.409 1.00 . A A . 12 ILE HG13 1 1 8 2531 1 1 12 ILE HG21 H 0.102 5.974 0.617 1.00 . A A . 12 ILE HG21 1 1 8 2532 1 1 12 ILE HG22 H 1.353 7.196 0.181 1.00 . A A . 12 ILE HG22 1 1 8 2533 1 1 12 ILE HG23 H 1.254 6.568 1.871 1.00 . A A . 12 ILE HG23 1 1 8 2534 1 1 12 ILE N N 3.268 5.517 -1.710 1.00 . A A . 12 ILE N 1 1 8 2535 1 1 12 ILE O O 4.864 5.001 1.367 1.00 . A A . 12 ILE O 1 1 8 2536 1 1 13 LEU C C 7.646 4.315 -1.148 1.00 . A A . 13 LEU C 1 1 8 2537 1 1 13 LEU CA C 6.500 3.638 -0.525 1.00 . A A . 13 LEU CA 1 1 8 2538 1 1 13 LEU CB C 6.454 2.301 -1.236 1.00 . A A . 13 LEU CB 1 1 8 2539 1 1 13 LEU CD1 C 5.044 0.424 -1.963 1.00 . A A . 13 LEU CD1 1 1 8 2540 1 1 13 LEU CD2 C 4.735 1.575 0.338 1.00 . A A . 13 LEU CD2 1 1 8 2541 1 1 13 LEU CG C 5.115 1.703 -1.134 1.00 . A A . 13 LEU CG 1 1 8 2542 1 1 13 LEU H H 4.933 4.306 -1.719 1.00 . A A . 13 LEU H 1 1 8 2543 1 1 13 LEU HA H 6.637 3.518 0.528 1.00 . A A . 13 LEU HA 1 1 8 2544 1 1 13 LEU HB2 H 6.666 2.451 -2.310 1.00 . A A . 13 LEU HB2 1 1 8 2545 1 1 13 LEU HB3 H 7.194 1.606 -0.810 1.00 . A A . 13 LEU HB3 1 1 8 2546 1 1 13 LEU HD11 H 4.573 -0.395 -1.393 1.00 . A A . 13 LEU HD11 1 1 8 2547 1 1 13 LEU HD12 H 6.065 0.123 -2.273 1.00 . A A . 13 LEU HD12 1 1 8 2548 1 1 13 LEU HD13 H 4.448 0.616 -2.894 1.00 . A A . 13 LEU HD13 1 1 8 2549 1 1 13 LEU HD21 H 3.704 1.187 0.440 1.00 . A A . 13 LEU HD21 1 1 8 2550 1 1 13 LEU HD22 H 4.786 2.603 0.811 1.00 . A A . 13 LEU HD22 1 1 8 2551 1 1 13 LEU HD23 H 5.439 0.906 0.866 1.00 . A A . 13 LEU HD23 1 1 8 2552 1 1 13 LEU HG H 4.425 2.428 -1.608 1.00 . A A . 13 LEU HG 1 1 8 2553 1 1 13 LEU N N 5.283 4.387 -0.782 1.00 . A A . 13 LEU N 1 1 8 2554 1 1 13 LEU O O 8.686 4.513 -0.543 1.00 . A A . 13 LEU O 1 1 8 2555 1 1 14 GLN C C 8.693 6.612 -2.513 1.00 . A A . 14 GLN C 1 1 8 2556 1 1 14 GLN CA C 8.562 5.302 -3.143 1.00 . A A . 14 GLN CA 1 1 8 2557 1 1 14 GLN CB C 8.291 5.573 -4.621 1.00 . A A . 14 GLN CB 1 1 8 2558 1 1 14 GLN CD C 8.789 3.196 -4.957 1.00 . A A . 14 GLN CD 1 1 8 2559 1 1 14 GLN CG C 7.884 4.332 -5.343 1.00 . A A . 14 GLN CG 1 1 8 2560 1 1 14 GLN H H 6.631 4.424 -2.945 1.00 . A A . 14 GLN H 1 1 8 2561 1 1 14 GLN HA H 9.462 4.733 -3.004 1.00 . A A . 14 GLN HA 1 1 8 2562 1 1 14 GLN HB2 H 7.462 6.308 -4.701 1.00 . A A . 14 GLN HB2 1 1 8 2563 1 1 14 GLN HB3 H 9.192 5.998 -5.097 1.00 . A A . 14 GLN HB3 1 1 8 2564 1 1 14 GLN HE21 H 7.267 2.491 -3.815 1.00 . A A . 14 GLN HE21 1 1 8 2565 1 1 14 GLN HE22 H 8.722 1.533 -3.784 1.00 . A A . 14 GLN HE22 1 1 8 2566 1 1 14 GLN HG2 H 6.866 4.092 -5.025 1.00 . A A . 14 GLN HG2 1 1 8 2567 1 1 14 GLN HG3 H 7.911 4.486 -6.434 1.00 . A A . 14 GLN HG3 1 1 8 2568 1 1 14 GLN N N 7.483 4.643 -2.436 1.00 . A A . 14 GLN N 1 1 8 2569 1 1 14 GLN NE2 N 8.217 2.321 -4.116 1.00 . A A . 14 GLN NE2 1 1 8 2570 1 1 14 GLN O O 9.718 7.286 -2.605 1.00 . A A . 14 GLN O 1 1 8 2571 1 1 14 GLN OE1 O 9.955 3.121 -5.333 1.00 . A A . 14 GLN OE1 1 1 8 2572 1 1 15 ARG C C 7.763 7.952 0.258 1.00 . A A . 15 ARG C 1 1 8 2573 1 1 15 ARG CA C 7.601 8.246 -1.199 1.00 . A A . 15 ARG CA 1 1 8 2574 1 1 15 ARG CB C 6.286 9.014 -1.344 1.00 . A A . 15 ARG CB 1 1 8 2575 1 1 15 ARG CD C 4.021 8.632 -2.325 1.00 . A A . 15 ARG CD 1 1 8 2576 1 1 15 ARG CG C 5.516 8.637 -2.597 1.00 . A A . 15 ARG CG 1 1 8 2577 1 1 15 ARG CZ C 2.281 10.350 -1.833 1.00 . A A . 15 ARG CZ 1 1 8 2578 1 1 15 ARG H H 6.786 6.395 -1.771 1.00 . A A . 15 ARG H 1 1 8 2579 1 1 15 ARG HA H 8.429 8.799 -1.586 1.00 . A A . 15 ARG HA 1 1 8 2580 1 1 15 ARG HB2 H 5.646 8.822 -0.457 1.00 . A A . 15 ARG HB2 1 1 8 2581 1 1 15 ARG HB3 H 6.506 10.102 -1.376 1.00 . A A . 15 ARG HB3 1 1 8 2582 1 1 15 ARG HD2 H 3.457 8.308 -3.223 1.00 . A A . 15 ARG HD2 1 1 8 2583 1 1 15 ARG HD3 H 3.793 7.947 -1.468 1.00 . A A . 15 ARG HD3 1 1 8 2584 1 1 15 ARG HE H 4.302 10.724 -1.816 1.00 . A A . 15 ARG HE 1 1 8 2585 1 1 15 ARG HG2 H 5.748 9.351 -3.412 1.00 . A A . 15 ARG HG2 1 1 8 2586 1 1 15 ARG HG3 H 5.821 7.618 -2.923 1.00 . A A . 15 ARG HG3 1 1 8 2587 1 1 15 ARG HH11 H 1.571 8.461 -2.234 1.00 . A A . 15 ARG HH11 1 1 8 2588 1 1 15 ARG HH12 H 0.351 9.650 -1.910 1.00 . A A . 15 ARG HH12 1 1 8 2589 1 1 15 ARG HH21 H 2.637 12.321 -1.376 1.00 . A A . 15 ARG HH21 1 1 8 2590 1 1 15 ARG HH22 H 0.966 11.872 -1.414 1.00 . A A . 15 ARG HH22 1 1 8 2591 1 1 15 ARG N N 7.609 6.990 -1.846 1.00 . A A . 15 ARG N 1 1 8 2592 1 1 15 ARG NE N 3.603 10.023 -1.965 1.00 . A A . 15 ARG NE 1 1 8 2593 1 1 15 ARG NH1 N 1.314 9.405 -2.008 1.00 . A A . 15 ARG NH1 1 1 8 2594 1 1 15 ARG NH2 N 1.930 11.629 -1.512 1.00 . A A . 15 ARG NH2 1 1 8 2595 1 1 15 ARG O O 8.291 8.755 1.021 1.00 . A A . 15 ARG O 1 1 8 2596 1 1 16 LYS C C 6.209 6.936 2.785 1.00 . A A . 16 LYS C 1 1 8 2597 1 1 16 LYS CA C 7.271 6.257 1.979 1.00 . A A . 16 LYS CA 1 1 8 2598 1 1 16 LYS CB C 8.595 6.435 2.710 1.00 . A A . 16 LYS CB 1 1 8 2599 1 1 16 LYS CD C 9.543 4.134 2.206 1.00 . A A . 16 LYS CD 1 1 8 2600 1 1 16 LYS CE C 10.739 3.334 1.687 1.00 . A A . 16 LYS CE 1 1 8 2601 1 1 16 LYS CG C 9.753 5.646 2.095 1.00 . A A . 16 LYS CG 1 1 8 2602 1 1 16 LYS H H 6.853 6.137 -0.025 1.00 . A A . 16 LYS H 1 1 8 2603 1 1 16 LYS HA H 7.014 5.210 1.900 1.00 . A A . 16 LYS HA 1 1 8 2604 1 1 16 LYS HB2 H 8.838 7.509 2.692 1.00 . A A . 16 LYS HB2 1 1 8 2605 1 1 16 LYS HB3 H 8.466 6.127 3.763 1.00 . A A . 16 LYS HB3 1 1 8 2606 1 1 16 LYS HD2 H 9.361 3.870 3.269 1.00 . A A . 16 LYS HD2 1 1 8 2607 1 1 16 LYS HD3 H 8.636 3.854 1.622 1.00 . A A . 16 LYS HD3 1 1 8 2608 1 1 16 LYS HE2 H 10.920 3.554 0.614 1.00 . A A . 16 LYS HE2 1 1 8 2609 1 1 16 LYS HE3 H 11.653 3.575 2.273 1.00 . A A . 16 LYS HE3 1 1 8 2610 1 1 16 LYS HG2 H 9.854 5.923 1.023 1.00 . A A . 16 LYS HG2 1 1 8 2611 1 1 16 LYS HG3 H 10.696 5.922 2.612 1.00 . A A . 16 LYS HG3 1 1 8 2612 1 1 16 LYS HZ1 H 10.387 1.462 0.872 1.00 . A A . 16 LYS HZ1 1 1 8 2613 1 1 16 LYS HZ2 H 9.605 1.733 2.354 1.00 . A A . 16 LYS HZ2 1 1 8 2614 1 1 16 LYS HZ3 H 11.276 1.434 2.318 1.00 . A A . 16 LYS HZ3 1 1 8 2615 1 1 16 LYS N N 7.253 6.753 0.635 1.00 . A A . 16 LYS N 1 1 8 2616 1 1 16 LYS NZ N 10.483 1.883 1.817 1.00 . A A . 16 LYS NZ 1 1 8 2617 1 1 16 LYS O O 6.164 6.810 4.007 1.00 . A A . 16 LYS O 1 1 8 2618 1 1 17 LYS C C 3.227 8.838 1.811 1.00 . A A . 17 LYS C 1 1 8 2619 1 1 17 LYS CA C 4.246 8.314 2.819 1.00 . A A . 17 LYS CA 1 1 8 2620 1 1 17 LYS CB C 4.701 9.498 3.700 1.00 . A A . 17 LYS CB 1 1 8 2621 1 1 17 LYS CD C 5.496 11.310 2.077 1.00 . A A . 17 LYS CD 1 1 8 2622 1 1 17 LYS CE C 6.692 11.801 1.266 1.00 . A A . 17 LYS CE 1 1 8 2623 1 1 17 LYS CG C 5.898 10.262 3.123 1.00 . A A . 17 LYS CG 1 1 8 2624 1 1 17 LYS H H 5.376 7.796 1.130 1.00 . A A . 17 LYS H 1 1 8 2625 1 1 17 LYS HA H 3.772 7.557 3.413 1.00 . A A . 17 LYS HA 1 1 8 2626 1 1 17 LYS HB2 H 3.852 10.200 3.828 1.00 . A A . 17 LYS HB2 1 1 8 2627 1 1 17 LYS HB3 H 4.977 9.108 4.698 1.00 . A A . 17 LYS HB3 1 1 8 2628 1 1 17 LYS HD2 H 4.749 10.870 1.383 1.00 . A A . 17 LYS HD2 1 1 8 2629 1 1 17 LYS HD3 H 5.023 12.174 2.589 1.00 . A A . 17 LYS HD3 1 1 8 2630 1 1 17 LYS HE2 H 7.474 12.218 1.934 1.00 . A A . 17 LYS HE2 1 1 8 2631 1 1 17 LYS HE3 H 7.121 10.964 0.670 1.00 . A A . 17 LYS HE3 1 1 8 2632 1 1 17 LYS HG2 H 6.430 10.773 3.953 1.00 . A A . 17 LYS HG2 1 1 8 2633 1 1 17 LYS HG3 H 6.604 9.542 2.663 1.00 . A A . 17 LYS HG3 1 1 8 2634 1 1 17 LYS HZ1 H 5.536 12.502 -0.304 1.00 . A A . 17 LYS HZ1 1 1 8 2635 1 1 17 LYS HZ2 H 7.096 13.168 -0.239 1.00 . A A . 17 LYS HZ2 1 1 8 2636 1 1 17 LYS HZ3 H 5.908 13.676 0.863 1.00 . A A . 17 LYS HZ3 1 1 8 2637 1 1 17 LYS N N 5.318 7.666 2.110 1.00 . A A . 17 LYS N 1 1 8 2638 1 1 17 LYS NZ N 6.277 12.866 0.327 1.00 . A A . 17 LYS NZ 1 1 8 2639 1 1 17 LYS O O 3.582 8.944 0.619 1.00 . A A . 17 LYS O 1 1 8 2640 1 1 17 LYS OXT O 2.077 9.137 2.232 1.00 . A A . 17 LYS OXT 1 1 9 2641 1 1 1 GLU C C -2.538 -8.834 -4.006 1.00 . A A . 1 GLU C 1 1 9 2642 1 1 1 GLU CA C -1.806 -9.913 -4.751 1.00 . A A . 1 GLU CA 1 1 9 2643 1 1 1 GLU CB C -2.834 -10.778 -5.511 1.00 . A A . 1 GLU CB 1 1 9 2644 1 1 1 GLU CD C -2.753 -9.475 -7.651 1.00 . A A . 1 GLU CD 1 1 9 2645 1 1 1 GLU CG C -3.667 -9.984 -6.539 1.00 . A A . 1 GLU CG 1 1 9 2646 1 1 1 GLU H1 H -0.152 -10.272 -3.539 1.00 . A A . 1 GLU H1 1 1 9 2647 1 1 1 GLU H2 H -0.804 -11.667 -4.257 1.00 . A A . 1 GLU H2 1 1 9 2648 1 1 1 GLU H3 H -1.602 -10.932 -2.949 1.00 . A A . 1 GLU H3 1 1 9 2649 1 1 1 GLU HA H -1.104 -9.466 -5.437 1.00 . A A . 1 GLU HA 1 1 9 2650 1 1 1 GLU HB2 H -2.296 -11.598 -6.035 1.00 . A A . 1 GLU HB2 1 1 9 2651 1 1 1 GLU HB3 H -3.526 -11.244 -4.775 1.00 . A A . 1 GLU HB3 1 1 9 2652 1 1 1 GLU HG2 H -4.449 -10.639 -6.979 1.00 . A A . 1 GLU HG2 1 1 9 2653 1 1 1 GLU HG3 H -4.158 -9.118 -6.049 1.00 . A A . 1 GLU HG3 1 1 9 2654 1 1 1 GLU N N -1.033 -10.759 -3.803 1.00 . A A . 1 GLU N 1 1 9 2655 1 1 1 GLU O O -3.524 -9.094 -3.314 1.00 . A A . 1 GLU O 1 1 9 2656 1 1 1 GLU OE1 O -1.633 -10.034 -7.808 1.00 . A A . 1 GLU OE1 1 1 9 2657 1 1 1 GLU OE2 O -3.167 -8.523 -8.362 1.00 . A A . 1 GLU OE2 1 1 9 2658 1 1 2 MET C C -3.693 -5.880 -4.377 1.00 . A A . 2 MET C 1 1 9 2659 1 1 2 MET CA C -2.698 -6.479 -3.458 1.00 . A A . 2 MET CA 1 1 9 2660 1 1 2 MET CB C -1.731 -5.382 -2.979 1.00 . A A . 2 MET CB 1 1 9 2661 1 1 2 MET CE C -3.821 -5.338 -0.793 1.00 . A A . 2 MET CE 1 1 9 2662 1 1 2 MET CG C -1.251 -5.550 -1.528 1.00 . A A . 2 MET CG 1 1 9 2663 1 1 2 MET H H -1.266 -7.358 -4.695 1.00 . A A . 2 MET H 1 1 9 2664 1 1 2 MET HA H -3.256 -6.864 -2.629 1.00 . A A . 2 MET HA 1 1 9 2665 1 1 2 MET HB2 H -0.843 -5.385 -3.644 1.00 . A A . 2 MET HB2 1 1 9 2666 1 1 2 MET HB3 H -2.221 -4.385 -3.070 1.00 . A A . 2 MET HB3 1 1 9 2667 1 1 2 MET HE1 H -4.700 -5.927 -1.131 1.00 . A A . 2 MET HE1 1 1 9 2668 1 1 2 MET HE2 H -3.564 -4.624 -1.602 1.00 . A A . 2 MET HE2 1 1 9 2669 1 1 2 MET HE3 H -4.118 -4.754 0.103 1.00 . A A . 2 MET HE3 1 1 9 2670 1 1 2 MET HG2 H -0.280 -6.085 -1.537 1.00 . A A . 2 MET HG2 1 1 9 2671 1 1 2 MET HG3 H -1.065 -4.531 -1.124 1.00 . A A . 2 MET HG3 1 1 9 2672 1 1 2 MET N N -2.060 -7.577 -4.135 1.00 . A A . 2 MET N 1 1 9 2673 1 1 2 MET O O -3.823 -6.255 -5.541 1.00 . A A . 2 MET O 1 1 9 2674 1 1 2 MET SD S -2.415 -6.422 -0.427 1.00 . A A . 2 MET SD 1 1 9 2675 1 1 3 ARG C C -5.236 -2.860 -4.531 1.00 . A A . 3 ARG C 1 1 9 2676 1 1 3 ARG CA C -5.475 -4.279 -4.528 1.00 . A A . 3 ARG CA 1 1 9 2677 1 1 3 ARG CB C -6.759 -4.450 -3.767 1.00 . A A . 3 ARG CB 1 1 9 2678 1 1 3 ARG CD C -6.729 -6.894 -3.224 1.00 . A A . 3 ARG CD 1 1 9 2679 1 1 3 ARG CG C -7.437 -5.790 -4.005 1.00 . A A . 3 ARG CG 1 1 9 2680 1 1 3 ARG CZ C -7.424 -8.920 -1.967 1.00 . A A . 3 ARG CZ 1 1 9 2681 1 1 3 ARG H H -4.241 -4.552 -2.916 1.00 . A A . 3 ARG H 1 1 9 2682 1 1 3 ARG HA H -5.515 -4.636 -5.491 1.00 . A A . 3 ARG HA 1 1 9 2683 1 1 3 ARG HB2 H -6.486 -4.369 -2.689 1.00 . A A . 3 ARG HB2 1 1 9 2684 1 1 3 ARG HB3 H -7.449 -3.619 -4.016 1.00 . A A . 3 ARG HB3 1 1 9 2685 1 1 3 ARG HD2 H -6.150 -7.552 -3.909 1.00 . A A . 3 ARG HD2 1 1 9 2686 1 1 3 ARG HD3 H -6.049 -6.451 -2.460 1.00 . A A . 3 ARG HD3 1 1 9 2687 1 1 3 ARG HE H -8.694 -7.378 -2.456 1.00 . A A . 3 ARG HE 1 1 9 2688 1 1 3 ARG HG2 H -8.501 -5.726 -3.686 1.00 . A A . 3 ARG HG2 1 1 9 2689 1 1 3 ARG HG3 H -7.412 -6.030 -5.088 1.00 . A A . 3 ARG HG3 1 1 9 2690 1 1 3 ARG HH11 H -5.448 -8.854 -2.537 1.00 . A A . 3 ARG HH11 1 1 9 2691 1 1 3 ARG HH12 H -5.905 -10.270 -1.650 1.00 . A A . 3 ARG HH12 1 1 9 2692 1 1 3 ARG HH21 H -9.311 -9.308 -1.253 1.00 . A A . 3 ARG HH21 1 1 9 2693 1 1 3 ARG HH22 H -8.135 -10.532 -0.910 1.00 . A A . 3 ARG HH22 1 1 9 2694 1 1 3 ARG N N -4.418 -4.901 -3.829 1.00 . A A . 3 ARG N 1 1 9 2695 1 1 3 ARG NE N -7.757 -7.716 -2.523 1.00 . A A . 3 ARG NE 1 1 9 2696 1 1 3 ARG NH1 N -6.145 -9.391 -2.059 1.00 . A A . 3 ARG NH1 1 1 9 2697 1 1 3 ARG NH2 N -8.375 -9.652 -1.318 1.00 . A A . 3 ARG NH2 1 1 9 2698 1 1 3 ARG O O -5.722 -2.110 -5.373 1.00 . A A . 3 ARG O 1 1 9 2699 1 1 4 LEU C C -3.310 -0.814 -4.459 1.00 . A A . 4 LEU C 1 1 9 2700 1 1 4 LEU CA C -4.192 -1.128 -3.359 1.00 . A A . 4 LEU CA 1 1 9 2701 1 1 4 LEU CB C -3.407 -0.881 -2.098 1.00 . A A . 4 LEU CB 1 1 9 2702 1 1 4 LEU CD1 C -2.363 -1.865 -0.118 1.00 . A A . 4 LEU CD1 1 1 9 2703 1 1 4 LEU CD2 C -4.858 -2.277 -0.606 1.00 . A A . 4 LEU CD2 1 1 9 2704 1 1 4 LEU CG C -3.452 -2.037 -1.161 1.00 . A A . 4 LEU CG 1 1 9 2705 1 1 4 LEU H H -4.057 -3.116 -2.912 1.00 . A A . 4 LEU H 1 1 9 2706 1 1 4 LEU HA H -5.035 -0.541 -3.405 1.00 . A A . 4 LEU HA 1 1 9 2707 1 1 4 LEU HB2 H -2.374 -0.654 -2.344 1.00 . A A . 4 LEU HB2 1 1 9 2708 1 1 4 LEU HB3 H -3.835 -0.023 -1.572 1.00 . A A . 4 LEU HB3 1 1 9 2709 1 1 4 LEU HD11 H -1.598 -2.665 -0.249 1.00 . A A . 4 LEU HD11 1 1 9 2710 1 1 4 LEU HD12 H -2.777 -1.909 0.909 1.00 . A A . 4 LEU HD12 1 1 9 2711 1 1 4 LEU HD13 H -1.859 -0.879 -0.278 1.00 . A A . 4 LEU HD13 1 1 9 2712 1 1 4 LEU HD21 H -5.407 -1.316 -0.528 1.00 . A A . 4 LEU HD21 1 1 9 2713 1 1 4 LEU HD22 H -4.807 -2.748 0.396 1.00 . A A . 4 LEU HD22 1 1 9 2714 1 1 4 LEU HD23 H -5.422 -2.954 -1.299 1.00 . A A . 4 LEU HD23 1 1 9 2715 1 1 4 LEU HG H -3.168 -2.909 -1.761 1.00 . A A . 4 LEU HG 1 1 9 2716 1 1 4 LEU N N -4.479 -2.473 -3.546 1.00 . A A . 4 LEU N 1 1 9 2717 1 1 4 LEU O O -3.712 -0.083 -5.336 1.00 . A A . 4 LEU O 1 1 9 2718 1 1 5 SER C C -1.042 -1.009 -6.603 1.00 . A A . 5 SER C 1 1 9 2719 1 1 5 SER CA C -1.063 -1.711 -5.270 1.00 . A A . 5 SER CA 1 1 9 2720 1 1 5 SER CB C -0.605 -3.128 -5.358 1.00 . A A . 5 SER CB 1 1 9 2721 1 1 5 SER H H -2.329 -2.430 -3.842 1.00 . A A . 5 SER H 1 1 9 2722 1 1 5 SER HA H -0.354 -1.184 -4.640 1.00 . A A . 5 SER HA 1 1 9 2723 1 1 5 SER HB2 H 0.468 -3.155 -5.087 1.00 . A A . 5 SER HB2 1 1 9 2724 1 1 5 SER HB3 H -1.198 -3.697 -4.588 1.00 . A A . 5 SER HB3 1 1 9 2725 1 1 5 SER HG H -0.334 -3.147 -7.268 1.00 . A A . 5 SER HG 1 1 9 2726 1 1 5 SER N N -2.293 -1.690 -4.491 1.00 . A A . 5 SER N 1 1 9 2727 1 1 5 SER O O -0.034 -0.972 -7.295 1.00 . A A . 5 SER O 1 1 9 2728 1 1 5 SER OG O -0.808 -3.708 -6.645 1.00 . A A . 5 SER OG 1 1 9 2729 1 1 6 LYS C C -1.911 1.679 -7.224 1.00 . A A . 6 LYS C 1 1 9 2730 1 1 6 LYS CA C -2.190 0.431 -8.062 1.00 . A A . 6 LYS CA 1 1 9 2731 1 1 6 LYS CB C -3.548 0.592 -8.765 1.00 . A A . 6 LYS CB 1 1 9 2732 1 1 6 LYS CD C -3.142 -1.234 -10.500 1.00 . A A . 6 LYS CD 1 1 9 2733 1 1 6 LYS CE C -3.732 -2.442 -11.231 1.00 . A A . 6 LYS CE 1 1 9 2734 1 1 6 LYS CG C -4.058 -0.712 -9.387 1.00 . A A . 6 LYS CG 1 1 9 2735 1 1 6 LYS H H -3.033 -0.692 -6.564 1.00 . A A . 6 LYS H 1 1 9 2736 1 1 6 LYS HA H -1.375 0.241 -8.750 1.00 . A A . 6 LYS HA 1 1 9 2737 1 1 6 LYS HB2 H -4.293 0.963 -8.029 1.00 . A A . 6 LYS HB2 1 1 9 2738 1 1 6 LYS HB3 H -3.443 1.358 -9.563 1.00 . A A . 6 LYS HB3 1 1 9 2739 1 1 6 LYS HD2 H -2.965 -0.420 -11.235 1.00 . A A . 6 LYS HD2 1 1 9 2740 1 1 6 LYS HD3 H -2.162 -1.517 -10.061 1.00 . A A . 6 LYS HD3 1 1 9 2741 1 1 6 LYS HE2 H -4.750 -2.212 -11.610 1.00 . A A . 6 LYS HE2 1 1 9 2742 1 1 6 LYS HE3 H -3.080 -2.739 -12.081 1.00 . A A . 6 LYS HE3 1 1 9 2743 1 1 6 LYS HG2 H -4.142 -1.485 -8.594 1.00 . A A . 6 LYS HG2 1 1 9 2744 1 1 6 LYS HG3 H -5.075 -0.540 -9.804 1.00 . A A . 6 LYS HG3 1 1 9 2745 1 1 6 LYS HZ1 H -4.838 -3.757 -10.073 1.00 . A A . 6 LYS HZ1 1 1 9 2746 1 1 6 LYS HZ2 H -3.300 -3.402 -9.446 1.00 . A A . 6 LYS HZ2 1 1 9 2747 1 1 6 LYS HZ3 H -3.454 -4.446 -10.776 1.00 . A A . 6 LYS HZ3 1 1 9 2748 1 1 6 LYS N N -2.158 -0.499 -7.010 1.00 . A A . 6 LYS N 1 1 9 2749 1 1 6 LYS NZ N -3.838 -3.598 -10.313 1.00 . A A . 6 LYS NZ 1 1 9 2750 1 1 6 LYS O O -1.933 2.807 -7.701 1.00 . A A . 6 LYS O 1 1 9 2751 1 1 7 PHE C C -0.304 2.560 -4.252 1.00 . A A . 7 PHE C 1 1 9 2752 1 1 7 PHE CA C -1.575 2.289 -4.810 1.00 . A A . 7 PHE CA 1 1 9 2753 1 1 7 PHE CB C -2.163 1.636 -3.592 1.00 . A A . 7 PHE CB 1 1 9 2754 1 1 7 PHE CD1 C -3.798 2.123 -1.936 1.00 . A A . 7 PHE CD1 1 1 9 2755 1 1 7 PHE CD2 C -1.697 3.157 -1.894 1.00 . A A . 7 PHE CD2 1 1 9 2756 1 1 7 PHE CE1 C -4.051 2.647 -0.729 1.00 . A A . 7 PHE CE1 1 1 9 2757 1 1 7 PHE CE2 C -1.889 3.712 -0.759 1.00 . A A . 7 PHE CE2 1 1 9 2758 1 1 7 PHE CG C -2.640 2.385 -2.510 1.00 . A A . 7 PHE CG 1 1 9 2759 1 1 7 PHE CZ C -3.094 3.475 -0.100 1.00 . A A . 7 PHE CZ 1 1 9 2760 1 1 7 PHE H H -1.690 0.428 -5.502 1.00 . A A . 7 PHE H 1 1 9 2761 1 1 7 PHE HA H -2.117 3.175 -4.991 1.00 . A A . 7 PHE HA 1 1 9 2762 1 1 7 PHE HB2 H -3.088 1.216 -3.940 1.00 . A A . 7 PHE HB2 1 1 9 2763 1 1 7 PHE HB3 H -1.567 0.802 -3.195 1.00 . A A . 7 PHE HB3 1 1 9 2764 1 1 7 PHE HD1 H -4.521 1.475 -2.443 1.00 . A A . 7 PHE HD1 1 1 9 2765 1 1 7 PHE HD2 H -0.766 3.353 -2.359 1.00 . A A . 7 PHE HD2 1 1 9 2766 1 1 7 PHE HE1 H -4.962 2.380 -0.273 1.00 . A A . 7 PHE HE1 1 1 9 2767 1 1 7 PHE HE2 H -1.041 4.291 -0.375 1.00 . A A . 7 PHE HE2 1 1 9 2768 1 1 7 PHE HZ H -3.287 3.903 0.874 1.00 . A A . 7 PHE HZ 1 1 9 2769 1 1 7 PHE N N -1.788 1.398 -5.859 1.00 . A A . 7 PHE N 1 1 9 2770 1 1 7 PHE O O 0.131 3.671 -4.250 1.00 . A A . 7 PHE O 1 1 9 2771 1 1 8 PHE C C 2.308 1.573 -3.520 1.00 . A A . 8 PHE C 1 1 9 2772 1 1 8 PHE CA C 1.258 1.740 -2.692 1.00 . A A . 8 PHE CA 1 1 9 2773 1 1 8 PHE CB C 1.647 0.677 -1.720 1.00 . A A . 8 PHE CB 1 1 9 2774 1 1 8 PHE CD1 C 2.140 -1.418 -2.307 1.00 . A A . 8 PHE CD1 1 1 9 2775 1 1 8 PHE CD2 C -0.069 -0.833 -1.991 1.00 . A A . 8 PHE CD2 1 1 9 2776 1 1 8 PHE CE1 C 1.835 -2.595 -2.655 1.00 . A A . 8 PHE CE1 1 1 9 2777 1 1 8 PHE CE2 C -0.411 -2.039 -2.340 1.00 . A A . 8 PHE CE2 1 1 9 2778 1 1 8 PHE CG C 1.188 -0.549 -1.979 1.00 . A A . 8 PHE CG 1 1 9 2779 1 1 8 PHE CZ C 0.545 -2.934 -2.683 1.00 . A A . 8 PHE CZ 1 1 9 2780 1 1 8 PHE H H -0.109 0.607 -3.663 1.00 . A A . 8 PHE H 1 1 9 2781 1 1 8 PHE HA H 1.260 2.695 -2.338 1.00 . A A . 8 PHE HA 1 1 9 2782 1 1 8 PHE HB2 H 2.711 0.588 -1.596 1.00 . A A . 8 PHE HB2 1 1 9 2783 1 1 8 PHE HB3 H 1.164 0.919 -0.774 1.00 . A A . 8 PHE HB3 1 1 9 2784 1 1 8 PHE HD1 H 3.181 -1.120 -2.281 1.00 . A A . 8 PHE HD1 1 1 9 2785 1 1 8 PHE HD2 H -0.795 -0.096 -1.701 1.00 . A A . 8 PHE HD2 1 1 9 2786 1 1 8 PHE HE1 H 2.604 -3.240 -2.932 1.00 . A A . 8 PHE HE1 1 1 9 2787 1 1 8 PHE HE2 H -1.417 -2.274 -2.392 1.00 . A A . 8 PHE HE2 1 1 9 2788 1 1 8 PHE HZ H 0.284 -3.865 -2.965 1.00 . A A . 8 PHE HZ 1 1 9 2789 1 1 8 PHE N N 0.222 1.523 -3.585 1.00 . A A . 8 PHE N 1 1 9 2790 1 1 8 PHE O O 3.216 2.256 -3.489 1.00 . A A . 8 PHE O 1 1 9 2791 1 1 9 ARG C C 2.997 1.372 -6.209 1.00 . A A . 9 ARG C 1 1 9 2792 1 1 9 ARG CA C 2.986 0.264 -5.306 1.00 . A A . 9 ARG CA 1 1 9 2793 1 1 9 ARG CB C 2.523 -0.965 -6.013 1.00 . A A . 9 ARG CB 1 1 9 2794 1 1 9 ARG CD C 4.492 -2.542 -6.140 1.00 . A A . 9 ARG CD 1 1 9 2795 1 1 9 ARG CG C 3.149 -2.243 -5.484 1.00 . A A . 9 ARG CG 1 1 9 2796 1 1 9 ARG CZ C 5.295 -3.314 -8.356 1.00 . A A . 9 ARG CZ 1 1 9 2797 1 1 9 ARG H H 1.222 0.168 -4.382 1.00 . A A . 9 ARG H 1 1 9 2798 1 1 9 ARG HA H 3.895 0.162 -4.840 1.00 . A A . 9 ARG HA 1 1 9 2799 1 1 9 ARG HB2 H 1.415 -1.009 -5.828 1.00 . A A . 9 ARG HB2 1 1 9 2800 1 1 9 ARG HB3 H 2.704 -0.856 -7.098 1.00 . A A . 9 ARG HB3 1 1 9 2801 1 1 9 ARG HD2 H 5.102 -1.615 -6.210 1.00 . A A . 9 ARG HD2 1 1 9 2802 1 1 9 ARG HD3 H 5.047 -3.317 -5.572 1.00 . A A . 9 ARG HD3 1 1 9 2803 1 1 9 ARG HE H 3.310 -3.206 -7.834 1.00 . A A . 9 ARG HE 1 1 9 2804 1 1 9 ARG HG2 H 3.304 -2.138 -4.396 1.00 . A A . 9 ARG HG2 1 1 9 2805 1 1 9 ARG HG3 H 2.454 -3.091 -5.658 1.00 . A A . 9 ARG HG3 1 1 9 2806 1 1 9 ARG HH11 H 6.746 -2.773 -7.007 1.00 . A A . 9 ARG HH11 1 1 9 2807 1 1 9 ARG HH12 H 7.343 -3.302 -8.544 1.00 . A A . 9 ARG HH12 1 1 9 2808 1 1 9 ARG HH21 H 4.119 -3.925 -9.926 1.00 . A A . 9 ARG HH21 1 1 9 2809 1 1 9 ARG HH22 H 5.823 -3.968 -10.233 1.00 . A A . 9 ARG HH22 1 1 9 2810 1 1 9 ARG N N 2.091 0.618 -4.354 1.00 . A A . 9 ARG N 1 1 9 2811 1 1 9 ARG NE N 4.247 -3.054 -7.520 1.00 . A A . 9 ARG NE 1 1 9 2812 1 1 9 ARG NH1 N 6.576 -3.112 -7.933 1.00 . A A . 9 ARG NH1 1 1 9 2813 1 1 9 ARG NH2 N 5.059 -3.778 -9.618 1.00 . A A . 9 ARG NH2 1 1 9 2814 1 1 9 ARG O O 3.682 1.386 -7.230 1.00 . A A . 9 ARG O 1 1 9 2815 1 1 10 ASP C C 2.120 4.623 -5.892 1.00 . A A . 10 ASP C 1 1 9 2816 1 1 10 ASP CA C 1.916 3.367 -6.638 1.00 . A A . 10 ASP CA 1 1 9 2817 1 1 10 ASP CB C 0.674 3.325 -7.304 1.00 . A A . 10 ASP CB 1 1 9 2818 1 1 10 ASP CG C 0.627 4.109 -8.613 1.00 . A A . 10 ASP CG 1 1 9 2819 1 1 10 ASP H H 1.501 2.183 -5.044 1.00 . A A . 10 ASP H 1 1 9 2820 1 1 10 ASP HA H 2.681 3.282 -7.295 1.00 . A A . 10 ASP HA 1 1 9 2821 1 1 10 ASP HB2 H 0.529 2.246 -7.481 1.00 . A A . 10 ASP HB2 1 1 9 2822 1 1 10 ASP HB3 H -0.068 3.697 -6.596 1.00 . A A . 10 ASP HB3 1 1 9 2823 1 1 10 ASP N N 2.052 2.252 -5.909 1.00 . A A . 10 ASP N 1 1 9 2824 1 1 10 ASP O O 2.083 5.692 -6.506 1.00 . A A . 10 ASP O 1 1 9 2825 1 1 10 ASP OD1 O 1.478 3.829 -9.499 1.00 . A A . 10 ASP OD1 1 1 9 2826 1 1 10 ASP OD2 O -0.255 4.999 -8.740 1.00 . A A . 10 ASP OD2 1 1 9 2827 1 1 11 . C C 2.317 6.082 -2.496 1.00 . A A . 11 DPN C 1 1 9 2828 1 1 11 . CA C 2.557 5.898 -3.966 1.00 . A A . 11 DPN CA 1 1 9 2829 1 1 11 . CB C 4.007 6.253 -4.211 1.00 . A A . 11 DPN CB 1 1 9 2830 1 1 11 . CD1 C 4.689 4.895 -6.106 1.00 . A A . 11 DPN CD1 1 1 9 2831 1 1 11 . CD2 C 4.906 4.276 -3.873 1.00 . A A . 11 DPN CD2 1 1 9 2832 1 1 11 . CE1 C 4.929 3.632 -6.434 1.00 . A A . 11 DPN CE1 1 1 9 2833 1 1 11 . CE2 C 5.212 3.110 -4.187 1.00 . A A . 11 DPN CE2 1 1 9 2834 1 1 11 . CG C 4.657 5.174 -4.779 1.00 . A A . 11 DPN CG 1 1 9 2835 1 1 11 . CZ C 5.188 2.767 -5.420 1.00 . A A . 11 DPN CZ 1 1 9 2836 1 1 11 . H H 2.317 3.725 -3.997 1.00 . A A . 11 DPN H 1 1 9 2837 1 1 11 . HA H 1.957 6.574 -4.451 1.00 . A A . 11 DPN HA 1 1 9 2838 1 1 11 . HB2 H 4.476 6.375 -3.246 1.00 . A A . 11 DPN HB2 1 1 9 2839 1 1 11 . HB3 H 4.105 7.077 -4.863 1.00 . A A . 11 DPN HB3 1 1 9 2840 1 1 11 . HD1 H 4.484 5.650 -6.853 1.00 . A A . 11 DPN HD1 1 1 9 2841 1 1 11 . HD2 H 4.934 4.561 -2.878 1.00 . A A . 11 DPN HD2 1 1 9 2842 1 1 11 . HE1 H 4.932 3.307 -7.460 1.00 . A A . 11 DPN HE1 1 1 9 2843 1 1 11 . HE2 H 5.357 2.388 -3.439 1.00 . A A . 11 DPN HE2 1 1 9 2844 1 1 11 . HZ H 5.267 1.827 -5.582 1.00 . A A . 11 DPN HZ 1 1 9 2845 1 1 11 . N N 2.291 4.595 -4.554 1.00 . A A . 11 DPN N 1 1 9 2846 1 1 11 . O O 1.336 6.696 -2.085 1.00 . A A . 11 DPN O 1 1 9 2847 1 1 12 ILE C C 4.581 5.097 0.194 1.00 . A A . 12 ILE C 1 1 9 2848 1 1 12 ILE CA C 3.295 5.756 -0.275 1.00 . A A . 12 ILE CA 1 1 9 2849 1 1 12 ILE CB C 2.131 5.168 0.454 1.00 . A A . 12 ILE CB 1 1 9 2850 1 1 12 ILE CD1 C 2.590 3.142 -0.669 1.00 . A A . 12 ILE CD1 1 1 9 2851 1 1 12 ILE CG1 C 1.535 4.105 -0.414 1.00 . A A . 12 ILE CG1 1 1 9 2852 1 1 12 ILE CG2 C 1.135 6.279 0.831 1.00 . A A . 12 ILE CG2 1 1 9 2853 1 1 12 ILE H H 3.897 4.910 -2.043 1.00 . A A . 12 ILE H 1 1 9 2854 1 1 12 ILE HA H 3.362 6.776 -0.096 1.00 . A A . 12 ILE HA 1 1 9 2855 1 1 12 ILE HB H 2.501 4.679 1.365 1.00 . A A . 12 ILE HB 1 1 9 2856 1 1 12 ILE HD11 H 2.273 2.156 -0.405 1.00 . A A . 12 ILE HD11 1 1 9 2857 1 1 12 ILE HD12 H 3.444 3.381 -0.066 1.00 . A A . 12 ILE HD12 1 1 9 2858 1 1 12 ILE HD13 H 2.890 3.186 -1.756 1.00 . A A . 12 ILE HD13 1 1 9 2859 1 1 12 ILE HG12 H 0.685 3.608 0.082 1.00 . A A . 12 ILE HG12 1 1 9 2860 1 1 12 ILE HG13 H 1.214 4.520 -1.393 1.00 . A A . 12 ILE HG13 1 1 9 2861 1 1 12 ILE HG21 H 1.230 6.535 1.907 1.00 . A A . 12 ILE HG21 1 1 9 2862 1 1 12 ILE HG22 H 0.095 5.946 0.635 1.00 . A A . 12 ILE HG22 1 1 9 2863 1 1 12 ILE HG23 H 1.331 7.195 0.229 1.00 . A A . 12 ILE HG23 1 1 9 2864 1 1 12 ILE N N 3.255 5.558 -1.695 1.00 . A A . 12 ILE N 1 1 9 2865 1 1 12 ILE O O 4.880 5.049 1.374 1.00 . A A . 12 ILE O 1 1 9 2866 1 1 13 LEU C C 7.659 4.419 -1.131 1.00 . A A . 13 LEU C 1 1 9 2867 1 1 13 LEU CA C 6.520 3.720 -0.525 1.00 . A A . 13 LEU CA 1 1 9 2868 1 1 13 LEU CB C 6.498 2.394 -1.253 1.00 . A A . 13 LEU CB 1 1 9 2869 1 1 13 LEU CD1 C 5.124 0.501 -2.000 1.00 . A A . 13 LEU CD1 1 1 9 2870 1 1 13 LEU CD2 C 4.799 1.623 0.315 1.00 . A A . 13 LEU CD2 1 1 9 2871 1 1 13 LEU CG C 5.172 1.771 -1.158 1.00 . A A . 13 LEU CG 1 1 9 2872 1 1 13 LEU H H 4.944 4.374 -1.716 1.00 . A A . 13 LEU H 1 1 9 2873 1 1 13 LEU HA H 6.654 3.586 0.526 1.00 . A A . 13 LEU HA 1 1 9 2874 1 1 13 LEU HB2 H 6.705 2.562 -2.326 1.00 . A A . 13 LEU HB2 1 1 9 2875 1 1 13 LEU HB3 H 7.251 1.707 -0.839 1.00 . A A . 13 LEU HB3 1 1 9 2876 1 1 13 LEU HD11 H 6.149 0.214 -2.303 1.00 . A A . 13 LEU HD11 1 1 9 2877 1 1 13 LEU HD12 H 4.533 0.698 -2.934 1.00 . A A . 13 LEU HD12 1 1 9 2878 1 1 13 LEU HD13 H 4.657 -0.330 -1.440 1.00 . A A . 13 LEU HD13 1 1 9 2879 1 1 13 LEU HD21 H 3.773 1.219 0.416 1.00 . A A . 13 LEU HD21 1 1 9 2880 1 1 13 LEU HD22 H 4.836 2.647 0.799 1.00 . A A . 13 LEU HD22 1 1 9 2881 1 1 13 LEU HD23 H 5.513 0.958 0.833 1.00 . A A . 13 LEU HD23 1 1 9 2882 1 1 13 LEU HG H 4.468 2.490 -1.622 1.00 . A A . 13 LEU HG 1 1 9 2883 1 1 13 LEU N N 5.294 4.452 -0.779 1.00 . A A . 13 LEU N 1 1 9 2884 1 1 13 LEU O O 8.696 4.609 -0.516 1.00 . A A . 13 LEU O 1 1 9 2885 1 1 14 GLN C C 8.665 6.757 -2.482 1.00 . A A . 14 GLN C 1 1 9 2886 1 1 14 GLN CA C 8.558 5.448 -3.120 1.00 . A A . 14 GLN CA 1 1 9 2887 1 1 14 GLN CB C 8.280 5.725 -4.596 1.00 . A A . 14 GLN CB 1 1 9 2888 1 1 14 GLN CD C 8.813 3.359 -4.952 1.00 . A A . 14 GLN CD 1 1 9 2889 1 1 14 GLN CG C 7.894 4.487 -5.333 1.00 . A A . 14 GLN CG 1 1 9 2890 1 1 14 GLN H H 6.642 4.540 -2.927 1.00 . A A . 14 GLN H 1 1 9 2891 1 1 14 GLN HA H 9.469 4.895 -2.984 1.00 . A A . 14 GLN HA 1 1 9 2892 1 1 14 GLN HB2 H 7.439 6.447 -4.670 1.00 . A A . 14 GLN HB2 1 1 9 2893 1 1 14 GLN HB3 H 9.174 6.171 -5.069 1.00 . A A . 14 GLN HB3 1 1 9 2894 1 1 14 GLN HE21 H 7.291 2.624 -3.830 1.00 . A A . 14 GLN HE21 1 1 9 2895 1 1 14 GLN HE22 H 8.757 1.685 -3.796 1.00 . A A . 14 GLN HE22 1 1 9 2896 1 1 14 GLN HG2 H 6.876 4.230 -5.027 1.00 . A A . 14 GLN HG2 1 1 9 2897 1 1 14 GLN HG3 H 7.927 4.652 -6.422 1.00 . A A . 14 GLN HG3 1 1 9 2898 1 1 14 GLN N N 7.492 4.765 -2.416 1.00 . A A . 14 GLN N 1 1 9 2899 1 1 14 GLN NE2 N 8.247 2.469 -4.124 1.00 . A A . 14 GLN NE2 1 1 9 2900 1 1 14 GLN O O 9.686 7.438 -2.546 1.00 . A A . 14 GLN O 1 1 9 2901 1 1 14 GLN OE1 O 9.981 3.303 -5.321 1.00 . A A . 14 GLN OE1 1 1 9 2902 1 1 15 ARG C C 7.708 8.085 0.259 1.00 . A A . 15 ARG C 1 1 9 2903 1 1 15 ARG CA C 7.528 8.383 -1.191 1.00 . A A . 15 ARG CA 1 1 9 2904 1 1 15 ARG CB C 6.198 9.125 -1.320 1.00 . A A . 15 ARG CB 1 1 9 2905 1 1 15 ARG CD C 3.934 8.669 -2.260 1.00 . A A . 15 ARG CD 1 1 9 2906 1 1 15 ARG CG C 5.422 8.736 -2.564 1.00 . A A . 15 ARG CG 1 1 9 2907 1 1 15 ARG CZ C 3.072 10.948 -2.775 1.00 . A A . 15 ARG CZ 1 1 9 2908 1 1 15 ARG H H 6.744 6.519 -1.781 1.00 . A A . 15 ARG H 1 1 9 2909 1 1 15 ARG HA H 8.343 8.956 -1.581 1.00 . A A . 15 ARG HA 1 1 9 2910 1 1 15 ARG HB2 H 5.572 8.915 -0.427 1.00 . A A . 15 ARG HB2 1 1 9 2911 1 1 15 ARG HB3 H 6.394 10.217 -1.350 1.00 . A A . 15 ARG HB3 1 1 9 2912 1 1 15 ARG HD2 H 3.361 8.346 -3.149 1.00 . A A . 15 ARG HD2 1 1 9 2913 1 1 15 ARG HD3 H 3.756 7.954 -1.417 1.00 . A A . 15 ARG HD3 1 1 9 2914 1 1 15 ARG HE H 3.425 10.258 -0.867 1.00 . A A . 15 ARG HE 1 1 9 2915 1 1 15 ARG HG2 H 5.610 9.471 -3.371 1.00 . A A . 15 ARG HG2 1 1 9 2916 1 1 15 ARG HG3 H 5.759 7.734 -2.910 1.00 . A A . 15 ARG HG3 1 1 9 2917 1 1 15 ARG HH11 H 3.422 9.742 -4.400 1.00 . A A . 15 ARG HH11 1 1 9 2918 1 1 15 ARG HH12 H 2.826 11.322 -4.783 1.00 . A A . 15 ARG HH12 1 1 9 2919 1 1 15 ARG HH21 H 2.615 12.401 -1.396 1.00 . A A . 15 ARG HH21 1 1 9 2920 1 1 15 ARG HH22 H 2.361 12.857 -3.047 1.00 . A A . 15 ARG HH22 1 1 9 2921 1 1 15 ARG N N 7.563 7.125 -1.841 1.00 . A A . 15 ARG N 1 1 9 2922 1 1 15 ARG NE N 3.459 10.024 -1.842 1.00 . A A . 15 ARG NE 1 1 9 2923 1 1 15 ARG NH1 N 3.110 10.644 -4.105 1.00 . A A . 15 ARG NH1 1 1 9 2924 1 1 15 ARG NH2 N 2.645 12.179 -2.370 1.00 . A A . 15 ARG NH2 1 1 9 2925 1 1 15 ARG O O 8.163 8.918 1.038 1.00 . A A . 15 ARG O 1 1 9 2926 1 1 16 LYS C C 6.259 6.937 2.785 1.00 . A A . 16 LYS C 1 1 9 2927 1 1 16 LYS CA C 7.337 6.318 1.944 1.00 . A A . 16 LYS CA 1 1 9 2928 1 1 16 LYS CB C 8.676 6.538 2.646 1.00 . A A . 16 LYS CB 1 1 9 2929 1 1 16 LYS CD C 10.723 6.051 1.222 1.00 . A A . 16 LYS CD 1 1 9 2930 1 1 16 LYS CE C 11.875 5.085 0.944 1.00 . A A . 16 LYS CE 1 1 9 2931 1 1 16 LYS CG C 9.734 5.506 2.258 1.00 . A A . 16 LYS CG 1 1 9 2932 1 1 16 LYS H H 6.910 6.225 -0.061 1.00 . A A . 16 LYS H 1 1 9 2933 1 1 16 LYS HA H 7.121 5.263 1.842 1.00 . A A . 16 LYS HA 1 1 9 2934 1 1 16 LYS HB2 H 9.036 7.544 2.383 1.00 . A A . 16 LYS HB2 1 1 9 2935 1 1 16 LYS HB3 H 8.521 6.503 3.741 1.00 . A A . 16 LYS HB3 1 1 9 2936 1 1 16 LYS HD2 H 10.178 6.250 0.272 1.00 . A A . 16 LYS HD2 1 1 9 2937 1 1 16 LYS HD3 H 11.136 7.016 1.587 1.00 . A A . 16 LYS HD3 1 1 9 2938 1 1 16 LYS HE2 H 12.460 4.898 1.869 1.00 . A A . 16 LYS HE2 1 1 9 2939 1 1 16 LYS HE3 H 11.490 4.120 0.549 1.00 . A A . 16 LYS HE3 1 1 9 2940 1 1 16 LYS HG2 H 10.293 5.193 3.165 1.00 . A A . 16 LYS HG2 1 1 9 2941 1 1 16 LYS HG3 H 9.227 4.610 1.838 1.00 . A A . 16 LYS HG3 1 1 9 2942 1 1 16 LYS HZ1 H 12.252 6.251 -0.727 1.00 . A A . 16 LYS HZ1 1 1 9 2943 1 1 16 LYS HZ2 H 13.257 4.889 -0.588 1.00 . A A . 16 LYS HZ2 1 1 9 2944 1 1 16 LYS HZ3 H 13.512 6.239 0.411 1.00 . A A . 16 LYS HZ3 1 1 9 2945 1 1 16 LYS N N 7.276 6.850 0.614 1.00 . A A . 16 LYS N 1 1 9 2946 1 1 16 LYS NZ N 12.793 5.658 -0.065 1.00 . A A . 16 LYS NZ 1 1 9 2947 1 1 16 LYS O O 6.224 6.759 4.001 1.00 . A A . 16 LYS O 1 1 9 2948 1 1 17 LYS C C 3.262 8.868 1.887 1.00 . A A . 17 LYS C 1 1 9 2949 1 1 17 LYS CA C 4.257 8.260 2.876 1.00 . A A . 17 LYS CA 1 1 9 2950 1 1 17 LYS CB C 4.692 9.371 3.854 1.00 . A A . 17 LYS CB 1 1 9 2951 1 1 17 LYS CD C 5.343 11.473 2.556 1.00 . A A . 17 LYS CD 1 1 9 2952 1 1 17 LYS CE C 6.365 11.966 1.533 1.00 . A A . 17 LYS CE 1 1 9 2953 1 1 17 LYS CG C 5.837 10.239 3.319 1.00 . A A . 17 LYS CG 1 1 9 2954 1 1 17 LYS H H 5.384 7.821 1.166 1.00 . A A . 17 LYS H 1 1 9 2955 1 1 17 LYS HA H 3.765 7.462 3.401 1.00 . A A . 17 LYS HA 1 1 9 2956 1 1 17 LYS HB2 H 3.820 10.019 4.078 1.00 . A A . 17 LYS HB2 1 1 9 2957 1 1 17 LYS HB3 H 5.019 8.897 4.800 1.00 . A A . 17 LYS HB3 1 1 9 2958 1 1 17 LYS HD2 H 4.397 11.225 2.029 1.00 . A A . 17 LYS HD2 1 1 9 2959 1 1 17 LYS HD3 H 5.132 12.287 3.281 1.00 . A A . 17 LYS HD3 1 1 9 2960 1 1 17 LYS HE2 H 7.319 12.239 2.033 1.00 . A A . 17 LYS HE2 1 1 9 2961 1 1 17 LYS HE3 H 6.560 11.180 0.770 1.00 . A A . 17 LYS HE3 1 1 9 2962 1 1 17 LYS HG2 H 6.464 10.571 4.172 1.00 . A A . 17 LYS HG2 1 1 9 2963 1 1 17 LYS HG3 H 6.475 9.629 2.649 1.00 . A A . 17 LYS HG3 1 1 9 2964 1 1 17 LYS HZ1 H 6.607 13.886 0.792 1.00 . A A . 17 LYS HZ1 1 1 9 2965 1 1 17 LYS HZ2 H 5.039 13.548 1.351 1.00 . A A . 17 LYS HZ2 1 1 9 2966 1 1 17 LYS HZ3 H 5.568 12.910 -0.131 1.00 . A A . 17 LYS HZ3 1 1 9 2967 1 1 17 LYS N N 5.341 7.664 2.141 1.00 . A A . 17 LYS N 1 1 9 2968 1 1 17 LYS NZ N 5.857 13.166 0.834 1.00 . A A . 17 LYS NZ 1 1 9 2969 1 1 17 LYS O O 2.058 8.973 2.249 1.00 . A A . 17 LYS O 1 1 9 2970 1 1 17 LYS OXT O 3.690 9.243 0.773 1.00 . A A . 17 LYS OXT 1 1 10 2971 1 1 1 GLU C C -1.507 -7.485 -4.865 1.00 . A A . 1 GLU C 1 1 10 2972 1 1 1 GLU CA C -0.908 -8.742 -5.425 1.00 . A A . 1 GLU CA 1 1 10 2973 1 1 1 GLU CB C -2.010 -9.524 -6.169 1.00 . A A . 1 GLU CB 1 1 10 2974 1 1 1 GLU CD C -2.593 -11.494 -7.590 1.00 . A A . 1 GLU CD 1 1 10 2975 1 1 1 GLU CG C -1.442 -10.656 -7.042 1.00 . A A . 1 GLU CG 1 1 10 2976 1 1 1 GLU H1 H -0.226 -9.009 -3.476 1.00 . A A . 1 GLU H1 1 1 10 2977 1 1 1 GLU H2 H 0.604 -9.935 -4.634 1.00 . A A . 1 GLU H2 1 1 10 2978 1 1 1 GLU H3 H -0.959 -10.386 -4.149 1.00 . A A . 1 GLU H3 1 1 10 2979 1 1 1 GLU HA H -0.108 -8.486 -6.101 1.00 . A A . 1 GLU HA 1 1 10 2980 1 1 1 GLU HB2 H -2.714 -9.953 -5.422 1.00 . A A . 1 GLU HB2 1 1 10 2981 1 1 1 GLU HB3 H -2.581 -8.823 -6.816 1.00 . A A . 1 GLU HB3 1 1 10 2982 1 1 1 GLU HG2 H -0.860 -10.231 -7.888 1.00 . A A . 1 GLU HG2 1 1 10 2983 1 1 1 GLU HG3 H -0.778 -11.308 -6.438 1.00 . A A . 1 GLU HG3 1 1 10 2984 1 1 1 GLU N N -0.329 -9.581 -4.340 1.00 . A A . 1 GLU N 1 1 10 2985 1 1 1 GLU O O -1.262 -6.393 -5.377 1.00 . A A . 1 GLU O 1 1 10 2986 1 1 1 GLU OE1 O -3.734 -11.357 -7.070 1.00 . A A . 1 GLU OE1 1 1 10 2987 1 1 1 GLU OE2 O -2.345 -12.282 -8.540 1.00 . A A . 1 GLU OE2 1 1 10 2988 1 1 2 MET C C -3.982 -5.931 -4.088 1.00 . A A . 2 MET C 1 1 10 2989 1 1 2 MET CA C -2.964 -6.492 -3.161 1.00 . A A . 2 MET CA 1 1 10 2990 1 1 2 MET CB C -1.995 -5.375 -2.703 1.00 . A A . 2 MET CB 1 1 10 2991 1 1 2 MET CE C -4.131 -5.153 -0.551 1.00 . A A . 2 MET CE 1 1 10 2992 1 1 2 MET CG C -1.561 -5.481 -1.230 1.00 . A A . 2 MET CG 1 1 10 2993 1 1 2 MET H H -2.520 -8.521 -3.391 1.00 . A A . 2 MET H 1 1 10 2994 1 1 2 MET HA H -3.518 -6.848 -2.319 1.00 . A A . 2 MET HA 1 1 10 2995 1 1 2 MET HB2 H -1.087 -5.414 -3.336 1.00 . A A . 2 MET HB2 1 1 10 2996 1 1 2 MET HB3 H -2.470 -4.378 -2.854 1.00 . A A . 2 MET HB3 1 1 10 2997 1 1 2 MET HE1 H -3.840 -4.494 -1.396 1.00 . A A . 2 MET HE1 1 1 10 2998 1 1 2 MET HE2 H -4.402 -4.511 0.311 1.00 . A A . 2 MET HE2 1 1 10 2999 1 1 2 MET HE3 H -5.034 -5.721 -0.858 1.00 . A A . 2 MET HE3 1 1 10 3000 1 1 2 MET HG2 H -0.601 -6.036 -1.187 1.00 . A A . 2 MET HG2 1 1 10 3001 1 1 2 MET HG3 H -1.363 -4.448 -0.871 1.00 . A A . 2 MET HG3 1 1 10 3002 1 1 2 MET N N -2.325 -7.629 -3.791 1.00 . A A . 2 MET N 1 1 10 3003 1 1 2 MET O O -4.243 -6.448 -5.173 1.00 . A A . 2 MET O 1 1 10 3004 1 1 2 MET SD S -2.773 -6.273 -0.123 1.00 . A A . 2 MET SD 1 1 10 3005 1 1 3 ARG C C -5.384 -2.816 -4.415 1.00 . A A . 3 ARG C 1 1 10 3006 1 1 3 ARG CA C -5.649 -4.229 -4.346 1.00 . A A . 3 ARG CA 1 1 10 3007 1 1 3 ARG CB C -6.931 -4.345 -3.567 1.00 . A A . 3 ARG CB 1 1 10 3008 1 1 3 ARG CD C -7.092 -6.710 -2.764 1.00 . A A . 3 ARG CD 1 1 10 3009 1 1 3 ARG CG C -7.633 -5.681 -3.753 1.00 . A A . 3 ARG CG 1 1 10 3010 1 1 3 ARG CZ C -7.833 -7.751 -0.636 1.00 . A A . 3 ARG CZ 1 1 10 3011 1 1 3 ARG H H -4.336 -4.401 -2.781 1.00 . A A . 3 ARG H 1 1 10 3012 1 1 3 ARG HA H -5.705 -4.626 -5.292 1.00 . A A . 3 ARG HA 1 1 10 3013 1 1 3 ARG HB2 H -6.646 -4.227 -2.494 1.00 . A A . 3 ARG HB2 1 1 10 3014 1 1 3 ARG HB3 H -7.607 -3.511 -3.841 1.00 . A A . 3 ARG HB3 1 1 10 3015 1 1 3 ARG HD2 H -6.896 -7.682 -3.266 1.00 . A A . 3 ARG HD2 1 1 10 3016 1 1 3 ARG HD3 H -6.157 -6.326 -2.291 1.00 . A A . 3 ARG HD3 1 1 10 3017 1 1 3 ARG HE H -8.985 -6.448 -1.733 1.00 . A A . 3 ARG HE 1 1 10 3018 1 1 3 ARG HG2 H -8.727 -5.549 -3.600 1.00 . A A . 3 ARG HG2 1 1 10 3019 1 1 3 ARG HG3 H -7.466 -6.045 -4.789 1.00 . A A . 3 ARG HG3 1 1 10 3020 1 1 3 ARG HH11 H -5.960 -8.275 -1.294 1.00 . A A . 3 ARG HH11 1 1 10 3021 1 1 3 ARG HH12 H -6.439 -9.013 0.198 1.00 . A A . 3 ARG HH12 1 1 10 3022 1 1 3 ARG HH21 H -9.640 -7.453 0.295 1.00 . A A . 3 ARG HH21 1 1 10 3023 1 1 3 ARG HH22 H -8.568 -8.538 1.116 1.00 . A A . 3 ARG HH22 1 1 10 3024 1 1 3 ARG N N -4.594 -4.838 -3.632 1.00 . A A . 3 ARG N 1 1 10 3025 1 1 3 ARG NE N -8.105 -6.921 -1.687 1.00 . A A . 3 ARG NE 1 1 10 3026 1 1 3 ARG NH1 N -6.638 -8.406 -0.571 1.00 . A A . 3 ARG NH1 1 1 10 3027 1 1 3 ARG NH2 N -8.762 -7.930 0.346 1.00 . A A . 3 ARG NH2 1 1 10 3028 1 1 3 ARG O O -5.830 -2.100 -5.308 1.00 . A A . 3 ARG O 1 1 10 3029 1 1 4 LEU C C -3.421 -0.804 -4.385 1.00 . A A . 4 LEU C 1 1 10 3030 1 1 4 LEU CA C -4.334 -1.050 -3.292 1.00 . A A . 4 LEU CA 1 1 10 3031 1 1 4 LEU CB C -3.568 -0.768 -2.026 1.00 . A A . 4 LEU CB 1 1 10 3032 1 1 4 LEU CD1 C -2.587 -1.693 0.015 1.00 . A A . 4 LEU CD1 1 1 10 3033 1 1 4 LEU CD2 C -5.080 -2.071 -0.510 1.00 . A A . 4 LEU CD2 1 1 10 3034 1 1 4 LEU CG C -3.658 -1.885 -1.044 1.00 . A A . 4 LEU CG 1 1 10 3035 1 1 4 LEU H H -4.267 -3.014 -2.745 1.00 . A A . 4 LEU H 1 1 10 3036 1 1 4 LEU HA H -5.160 -0.443 -3.382 1.00 . A A . 4 LEU HA 1 1 10 3037 1 1 4 LEU HB2 H -2.524 -0.574 -2.259 1.00 . A A . 4 LEU HB2 1 1 10 3038 1 1 4 LEU HB3 H -3.986 0.122 -1.544 1.00 . A A . 4 LEU HB3 1 1 10 3039 1 1 4 LEU HD11 H -2.058 -0.727 -0.173 1.00 . A A . 4 LEU HD11 1 1 10 3040 1 1 4 LEU HD12 H -1.839 -2.516 -0.067 1.00 . A A . 4 LEU HD12 1 1 10 3041 1 1 4 LEU HD13 H -3.022 -1.684 1.033 1.00 . A A . 4 LEU HD13 1 1 10 3042 1 1 4 LEU HD21 H -5.637 -2.785 -1.174 1.00 . A A . 4 LEU HD21 1 1 10 3043 1 1 4 LEU HD22 H -5.617 -1.099 -0.505 1.00 . A A . 4 LEU HD22 1 1 10 3044 1 1 4 LEU HD23 H -5.062 -2.480 0.520 1.00 . A A . 4 LEU HD23 1 1 10 3045 1 1 4 LEU HG H -3.381 -2.786 -1.600 1.00 . A A . 4 LEU HG 1 1 10 3046 1 1 4 LEU N N -4.649 -2.394 -3.425 1.00 . A A . 4 LEU N 1 1 10 3047 1 1 4 LEU O O -3.785 -0.100 -5.299 1.00 . A A . 4 LEU O 1 1 10 3048 1 1 5 SER C C -1.117 -1.139 -6.469 1.00 . A A . 5 SER C 1 1 10 3049 1 1 5 SER CA C -1.183 -1.790 -5.111 1.00 . A A . 5 SER CA 1 1 10 3050 1 1 5 SER CB C -0.762 -3.221 -5.135 1.00 . A A . 5 SER CB 1 1 10 3051 1 1 5 SER H H -2.496 -2.422 -3.685 1.00 . A A . 5 SER H 1 1 10 3052 1 1 5 SER HA H -0.473 -1.259 -4.486 1.00 . A A . 5 SER HA 1 1 10 3053 1 1 5 SER HB2 H 0.317 -3.265 -4.899 1.00 . A A . 5 SER HB2 1 1 10 3054 1 1 5 SER HB3 H -1.345 -3.729 -4.315 1.00 . A A . 5 SER HB3 1 1 10 3055 1 1 5 SER HG H -1.128 -4.805 -6.177 1.00 . A A . 5 SER HG 1 1 10 3056 1 1 5 SER N N -2.427 -1.708 -4.360 1.00 . A A . 5 SER N 1 1 10 3057 1 1 5 SER O O -0.085 -1.116 -7.124 1.00 . A A . 5 SER O 1 1 10 3058 1 1 5 SER OG O -1.032 -3.862 -6.378 1.00 . A A . 5 SER OG 1 1 10 3059 1 1 6 LYS C C -1.898 1.530 -7.225 1.00 . A A . 6 LYS C 1 1 10 3060 1 1 6 LYS CA C -2.201 0.257 -8.015 1.00 . A A . 6 LYS CA 1 1 10 3061 1 1 6 LYS CB C -3.545 0.422 -8.730 1.00 . A A . 6 LYS CB 1 1 10 3062 1 1 6 LYS CD C -5.465 -0.785 -9.881 1.00 . A A . 6 LYS CD 1 1 10 3063 1 1 6 LYS CE C -5.644 0.206 -11.033 1.00 . A A . 6 LYS CE 1 1 10 3064 1 1 6 LYS CG C -4.018 -0.872 -9.395 1.00 . A A . 6 LYS CG 1 1 10 3065 1 1 6 LYS H H -3.108 -0.798 -6.507 1.00 . A A . 6 LYS H 1 1 10 3066 1 1 6 LYS HA H -1.386 0.014 -8.685 1.00 . A A . 6 LYS HA 1 1 10 3067 1 1 6 LYS HB2 H -4.308 0.760 -7.995 1.00 . A A . 6 LYS HB2 1 1 10 3068 1 1 6 LYS HB3 H -3.440 1.210 -9.505 1.00 . A A . 6 LYS HB3 1 1 10 3069 1 1 6 LYS HD2 H -5.797 -1.791 -10.213 1.00 . A A . 6 LYS HD2 1 1 10 3070 1 1 6 LYS HD3 H -6.108 -0.474 -9.030 1.00 . A A . 6 LYS HD3 1 1 10 3071 1 1 6 LYS HE2 H -5.404 1.239 -10.704 1.00 . A A . 6 LYS HE2 1 1 10 3072 1 1 6 LYS HE3 H -4.991 -0.069 -11.890 1.00 . A A . 6 LYS HE3 1 1 10 3073 1 1 6 LYS HG2 H -3.358 -1.098 -10.260 1.00 . A A . 6 LYS HG2 1 1 10 3074 1 1 6 LYS HG3 H -3.929 -1.708 -8.669 1.00 . A A . 6 LYS HG3 1 1 10 3075 1 1 6 LYS HZ1 H -7.680 0.007 -10.704 1.00 . A A . 6 LYS HZ1 1 1 10 3076 1 1 6 LYS HZ2 H -7.164 -0.547 -12.224 1.00 . A A . 6 LYS HZ2 1 1 10 3077 1 1 6 LYS HZ3 H -7.278 1.120 -11.922 1.00 . A A . 6 LYS HZ3 1 1 10 3078 1 1 6 LYS N N -2.215 -0.631 -6.928 1.00 . A A . 6 LYS N 1 1 10 3079 1 1 6 LYS NZ N -7.045 0.196 -11.506 1.00 . A A . 6 LYS NZ 1 1 10 3080 1 1 6 LYS O O -1.874 2.637 -7.748 1.00 . A A . 6 LYS O 1 1 10 3081 1 1 7 PHE C C -0.323 2.490 -4.258 1.00 . A A . 7 PHE C 1 1 10 3082 1 1 7 PHE CA C -1.592 2.233 -4.832 1.00 . A A . 7 PHE CA 1 1 10 3083 1 1 7 PHE CB C -2.221 1.648 -3.600 1.00 . A A . 7 PHE CB 1 1 10 3084 1 1 7 PHE CD1 C -3.871 2.247 -1.997 1.00 . A A . 7 PHE CD1 1 1 10 3085 1 1 7 PHE CD2 C -1.744 3.223 -1.954 1.00 . A A . 7 PHE CD2 1 1 10 3086 1 1 7 PHE CE1 C -4.132 2.825 -0.817 1.00 . A A . 7 PHE CE1 1 1 10 3087 1 1 7 PHE CE2 C -1.941 3.827 -0.846 1.00 . A A . 7 PHE CE2 1 1 10 3088 1 1 7 PHE CG C -2.697 2.454 -2.558 1.00 . A A . 7 PHE CG 1 1 10 3089 1 1 7 PHE CZ C -3.164 3.650 -0.202 1.00 . A A . 7 PHE CZ 1 1 10 3090 1 1 7 PHE H H -1.748 0.347 -5.446 1.00 . A A . 7 PHE H 1 1 10 3091 1 1 7 PHE HA H -2.104 3.125 -5.059 1.00 . A A . 7 PHE HA 1 1 10 3092 1 1 7 PHE HB2 H -3.152 1.241 -3.948 1.00 . A A . 7 PHE HB2 1 1 10 3093 1 1 7 PHE HB3 H -1.658 0.814 -3.156 1.00 . A A . 7 PHE HB3 1 1 10 3094 1 1 7 PHE HD1 H -4.603 1.600 -2.492 1.00 . A A . 7 PHE HD1 1 1 10 3095 1 1 7 PHE HD2 H -0.799 3.376 -2.410 1.00 . A A . 7 PHE HD2 1 1 10 3096 1 1 7 PHE HE1 H -5.058 2.600 -0.369 1.00 . A A . 7 PHE HE1 1 1 10 3097 1 1 7 PHE HE2 H -1.084 4.398 -0.468 1.00 . A A . 7 PHE HE2 1 1 10 3098 1 1 7 PHE HZ H -3.362 4.122 0.750 1.00 . A A . 7 PHE HZ 1 1 10 3099 1 1 7 PHE N N -1.810 1.306 -5.846 1.00 . A A . 7 PHE N 1 1 10 3100 1 1 7 PHE O O 0.145 3.587 -4.293 1.00 . A A . 7 PHE O 1 1 10 3101 1 1 8 PHE C C 2.244 1.460 -3.432 1.00 . A A . 8 PHE C 1 1 10 3102 1 1 8 PHE CA C 1.182 1.693 -2.632 1.00 . A A . 8 PHE CA 1 1 10 3103 1 1 8 PHE CB C 1.522 0.663 -1.609 1.00 . A A . 8 PHE CB 1 1 10 3104 1 1 8 PHE CD1 C 1.968 -1.467 -2.099 1.00 . A A . 8 PHE CD1 1 1 10 3105 1 1 8 PHE CD2 C -0.231 -0.809 -1.853 1.00 . A A . 8 PHE CD2 1 1 10 3106 1 1 8 PHE CE1 C 1.634 -2.650 -2.405 1.00 . A A . 8 PHE CE1 1 1 10 3107 1 1 8 PHE CE2 C -0.600 -2.020 -2.159 1.00 . A A . 8 PHE CE2 1 1 10 3108 1 1 8 PHE CG C 1.033 -0.560 -1.828 1.00 . A A . 8 PHE CG 1 1 10 3109 1 1 8 PHE CZ C 0.337 -2.954 -2.447 1.00 . A A . 8 PHE CZ 1 1 10 3110 1 1 8 PHE H H -0.196 0.558 -3.585 1.00 . A A . 8 PHE H 1 1 10 3111 1 1 8 PHE HA H 1.205 2.662 -2.320 1.00 . A A . 8 PHE HA 1 1 10 3112 1 1 8 PHE HB2 H 2.580 0.551 -1.458 1.00 . A A . 8 PHE HB2 1 1 10 3113 1 1 8 PHE HB3 H 1.026 0.959 -0.684 1.00 . A A . 8 PHE HB3 1 1 10 3114 1 1 8 PHE HD1 H 3.016 -1.198 -2.064 1.00 . A A . 8 PHE HD1 1 1 10 3115 1 1 8 PHE HD2 H -0.940 -0.041 -1.608 1.00 . A A . 8 PHE HD2 1 1 10 3116 1 1 8 PHE HE1 H 2.392 -3.327 -2.640 1.00 . A A . 8 PHE HE1 1 1 10 3117 1 1 8 PHE HE2 H -1.610 -2.229 -2.222 1.00 . A A . 8 PHE HE2 1 1 10 3118 1 1 8 PHE HZ H 0.055 -3.889 -2.696 1.00 . A A . 8 PHE HZ 1 1 10 3119 1 1 8 PHE N N 0.160 1.468 -3.537 1.00 . A A . 8 PHE N 1 1 10 3120 1 1 8 PHE O O 3.170 2.118 -3.409 1.00 . A A . 8 PHE O 1 1 10 3121 1 1 9 ARG C C 2.978 1.130 -6.095 1.00 . A A . 9 ARG C 1 1 10 3122 1 1 9 ARG CA C 2.919 0.062 -5.147 1.00 . A A . 9 ARG CA 1 1 10 3123 1 1 9 ARG CB C 2.439 -1.184 -5.811 1.00 . A A . 9 ARG CB 1 1 10 3124 1 1 9 ARG CD C 4.383 -2.797 -5.826 1.00 . A A . 9 ARG CD 1 1 10 3125 1 1 9 ARG CG C 3.026 -2.453 -5.220 1.00 . A A . 9 ARG CG 1 1 10 3126 1 1 9 ARG CZ C 5.234 -3.640 -8.000 1.00 . A A . 9 ARG CZ 1 1 10 3127 1 1 9 ARG H H 1.134 0.054 -4.258 1.00 . A A . 9 ARG H 1 1 10 3128 1 1 9 ARG HA H 3.815 -0.044 -4.658 1.00 . A A . 9 ARG HA 1 1 10 3129 1 1 9 ARG HB2 H 1.328 -1.196 -5.640 1.00 . A A . 9 ARG HB2 1 1 10 3130 1 1 9 ARG HB3 H 2.638 -1.124 -6.896 1.00 . A A . 9 ARG HB3 1 1 10 3131 1 1 9 ARG HD2 H 5.012 -1.883 -5.904 1.00 . A A . 9 ARG HD2 1 1 10 3132 1 1 9 ARG HD3 H 4.904 -3.566 -5.222 1.00 . A A . 9 ARG HD3 1 1 10 3133 1 1 9 ARG HE H 3.237 -3.487 -7.535 1.00 . A A . 9 ARG HE 1 1 10 3134 1 1 9 ARG HG2 H 3.152 -2.312 -4.132 1.00 . A A . 9 ARG HG2 1 1 10 3135 1 1 9 ARG HG3 H 2.322 -3.295 -5.385 1.00 . A A . 9 ARG HG3 1 1 10 3136 1 1 9 ARG HH11 H 6.656 -3.086 -6.625 1.00 . A A . 9 ARG HH11 1 1 10 3137 1 1 9 ARG HH12 H 7.286 -3.663 -8.132 1.00 . A A . 9 ARG HH12 1 1 10 3138 1 1 9 ARG HH21 H 4.092 -4.272 -9.585 1.00 . A A . 9 ARG HH21 1 1 10 3139 1 1 9 ARG HH22 H 5.802 -4.349 -9.843 1.00 . A A . 9 ARG HH22 1 1 10 3140 1 1 9 ARG N N 2.016 0.480 -4.230 1.00 . A A . 9 ARG N 1 1 10 3141 1 1 9 ARG NE N 4.167 -3.342 -7.199 1.00 . A A . 9 ARG NE 1 1 10 3142 1 1 9 ARG NH1 N 6.506 -3.445 -7.546 1.00 . A A . 9 ARG NH1 1 1 10 3143 1 1 9 ARG NH2 N 5.024 -4.131 -9.255 1.00 . A A . 9 ARG NH2 1 1 10 3144 1 1 9 ARG O O 3.683 1.082 -7.103 1.00 . A A . 9 ARG O 1 1 10 3145 1 1 10 ASP C C 2.194 4.417 -5.928 1.00 . A A . 10 ASP C 1 1 10 3146 1 1 10 ASP CA C 1.966 3.137 -6.627 1.00 . A A . 10 ASP CA 1 1 10 3147 1 1 10 ASP CB C 0.734 3.105 -7.312 1.00 . A A . 10 ASP CB 1 1 10 3148 1 1 10 ASP CG C 0.736 3.832 -8.654 1.00 . A A . 10 ASP CG 1 1 10 3149 1 1 10 ASP H H 1.485 2.031 -4.995 1.00 . A A . 10 ASP H 1 1 10 3150 1 1 10 ASP HA H 2.738 3.002 -7.265 1.00 . A A . 10 ASP HA 1 1 10 3151 1 1 10 ASP HB2 H 0.558 2.025 -7.445 1.00 . A A . 10 ASP HB2 1 1 10 3152 1 1 10 ASP HB3 H -0.007 3.530 -6.634 1.00 . A A . 10 ASP HB3 1 1 10 3153 1 1 10 ASP N N 2.054 2.050 -5.850 1.00 . A A . 10 ASP N 1 1 10 3154 1 1 10 ASP O O 2.203 5.460 -6.586 1.00 . A A . 10 ASP O 1 1 10 3155 1 1 10 ASP OD1 O 1.591 3.487 -9.512 1.00 . A A . 10 ASP OD1 1 1 10 3156 1 1 10 ASP OD2 O -0.114 4.744 -8.837 1.00 . A A . 10 ASP OD2 1 1 10 3157 1 1 11 . C C 2.364 6.010 -2.593 1.00 . A A . 11 DPN C 1 1 10 3158 1 1 11 . CA C 2.633 5.757 -4.047 1.00 . A A . 11 DPN CA 1 1 10 3159 1 1 11 . CB C 4.101 6.054 -4.266 1.00 . A A . 11 DPN CB 1 1 10 3160 1 1 11 . CD1 C 4.774 4.607 -6.098 1.00 . A A . 11 DPN CD1 1 1 10 3161 1 1 11 . CD2 C 4.927 4.063 -3.841 1.00 . A A . 11 DPN CD2 1 1 10 3162 1 1 11 . CE1 C 4.982 3.325 -6.375 1.00 . A A . 11 DPN CE1 1 1 10 3163 1 1 11 . CE2 C 5.203 2.879 -4.106 1.00 . A A . 11 DPN CE2 1 1 10 3164 1 1 11 . CG C 4.726 4.934 -4.782 1.00 . A A . 11 DPN CG 1 1 10 3165 1 1 11 . CZ C 5.193 2.490 -5.325 1.00 . A A . 11 DPN CZ 1 1 10 3166 1 1 11 . H H 2.325 3.593 -3.994 1.00 . A A . 11 DPN H 1 1 10 3167 1 1 11 . HA H 2.070 6.432 -4.575 1.00 . A A . 11 DPN HA 1 1 10 3168 1 1 11 . HB2 H 4.555 6.190 -3.292 1.00 . A A . 11 DPN HB2 1 1 10 3169 1 1 11 . HB3 H 4.246 6.852 -4.940 1.00 . A A . 11 DPN HB3 1 1 10 3170 1 1 11 . HD1 H 4.607 5.339 -6.875 1.00 . A A . 11 DPN HD1 1 1 10 3171 1 1 11 . HD2 H 4.943 4.381 -2.858 1.00 . A A . 11 DPN HD2 1 1 10 3172 1 1 11 . HE1 H 4.994 2.962 -7.388 1.00 . A A . 11 DPN HE1 1 1 10 3173 1 1 11 . HE2 H 5.312 2.182 -3.328 1.00 . A A . 11 DPN HE2 1 1 10 3174 1 1 11 . HZ H 5.247 1.544 -5.449 1.00 . A A . 11 DPN HZ 1 1 10 3175 1 1 11 . N N 2.337 4.439 -4.587 1.00 . A A . 11 DPN N 1 1 10 3176 1 1 11 . O O 1.393 6.669 -2.230 1.00 . A A . 11 DPN O 1 1 10 3177 1 1 12 ILE C C 4.542 5.073 0.181 1.00 . A A . 12 ILE C 1 1 10 3178 1 1 12 ILE CA C 3.282 5.746 -0.341 1.00 . A A . 12 ILE CA 1 1 10 3179 1 1 12 ILE CB C 2.089 5.216 0.386 1.00 . A A . 12 ILE CB 1 1 10 3180 1 1 12 ILE CD1 C 2.516 3.134 -0.643 1.00 . A A . 12 ILE CD1 1 1 10 3181 1 1 12 ILE CG1 C 1.484 4.135 -0.452 1.00 . A A . 12 ILE CG1 1 1 10 3182 1 1 12 ILE CG2 C 1.116 6.365 0.699 1.00 . A A . 12 ILE CG2 1 1 10 3183 1 1 12 ILE H H 3.896 4.811 -2.058 1.00 . A A . 12 ILE H 1 1 10 3184 1 1 12 ILE HA H 3.372 6.771 -0.202 1.00 . A A . 12 ILE HA 1 1 10 3185 1 1 12 ILE HB H 2.429 4.754 1.323 1.00 . A A . 12 ILE HB 1 1 10 3186 1 1 12 ILE HD11 H 2.834 3.124 -1.727 1.00 . A A . 12 ILE HD11 1 1 10 3187 1 1 12 ILE HD12 H 2.165 2.169 -0.324 1.00 . A A . 12 ILE HD12 1 1 10 3188 1 1 12 ILE HD13 H 3.368 3.377 -0.050 1.00 . A A . 12 ILE HD13 1 1 10 3189 1 1 12 ILE HG12 H 0.609 3.682 0.043 1.00 . A A . 12 ILE HG12 1 1 10 3190 1 1 12 ILE HG13 H 1.197 4.518 -1.453 1.00 . A A . 12 ILE HG13 1 1 10 3191 1 1 12 ILE HG21 H 0.069 6.043 0.519 1.00 . A A . 12 ILE HG21 1 1 10 3192 1 1 12 ILE HG22 H 1.331 7.242 0.050 1.00 . A A . 12 ILE HG22 1 1 10 3193 1 1 12 ILE HG23 H 1.213 6.676 1.760 1.00 . A A . 12 ILE HG23 1 1 10 3194 1 1 12 ILE N N 3.267 5.491 -1.751 1.00 . A A . 12 ILE N 1 1 10 3195 1 1 12 ILE O O 4.809 5.059 1.369 1.00 . A A . 12 ILE O 1 1 10 3196 1 1 13 LEU C C 7.628 4.271 -1.075 1.00 . A A . 13 LEU C 1 1 10 3197 1 1 13 LEU CA C 6.465 3.625 -0.451 1.00 . A A . 13 LEU CA 1 1 10 3198 1 1 13 LEU CB C 6.417 2.266 -1.119 1.00 . A A . 13 LEU CB 1 1 10 3199 1 1 13 LEU CD1 C 5.001 0.378 -1.807 1.00 . A A . 13 LEU CD1 1 1 10 3200 1 1 13 LEU CD2 C 4.667 1.607 0.451 1.00 . A A . 13 LEU CD2 1 1 10 3201 1 1 13 LEU CG C 5.071 1.682 -1.020 1.00 . A A . 13 LEU CG 1 1 10 3202 1 1 13 LEU H H 4.925 4.271 -1.694 1.00 . A A . 13 LEU H 1 1 10 3203 1 1 13 LEU HA H 6.582 3.537 0.607 1.00 . A A . 13 LEU HA 1 1 10 3204 1 1 13 LEU HB2 H 6.647 2.379 -2.194 1.00 . A A . 13 LEU HB2 1 1 10 3205 1 1 13 LEU HB3 H 7.143 1.578 -0.660 1.00 . A A . 13 LEU HB3 1 1 10 3206 1 1 13 LEU HD11 H 6.023 0.051 -2.082 1.00 . A A . 13 LEU HD11 1 1 10 3207 1 1 13 LEU HD12 H 4.429 0.550 -2.759 1.00 . A A . 13 LEU HD12 1 1 10 3208 1 1 13 LEU HD13 H 4.503 -0.414 -1.220 1.00 . A A . 13 LEU HD13 1 1 10 3209 1 1 13 LEU HD21 H 5.357 0.954 1.013 1.00 . A A . 13 LEU HD21 1 1 10 3210 1 1 13 LEU HD22 H 3.632 1.226 0.549 1.00 . A A . 13 LEU HD22 1 1 10 3211 1 1 13 LEU HD23 H 4.716 2.650 0.890 1.00 . A A . 13 LEU HD23 1 1 10 3212 1 1 13 LEU HG H 4.395 2.398 -1.528 1.00 . A A . 13 LEU HG 1 1 10 3213 1 1 13 LEU N N 5.260 4.376 -0.754 1.00 . A A . 13 LEU N 1 1 10 3214 1 1 13 LEU O O 8.662 4.478 -0.459 1.00 . A A . 13 LEU O 1 1 10 3215 1 1 14 GLN C C 8.722 6.511 -2.498 1.00 . A A . 14 GLN C 1 1 10 3216 1 1 14 GLN CA C 8.588 5.182 -3.087 1.00 . A A . 14 GLN CA 1 1 10 3217 1 1 14 GLN CB C 8.343 5.407 -4.576 1.00 . A A . 14 GLN CB 1 1 10 3218 1 1 14 GLN CD C 8.820 3.014 -4.826 1.00 . A A . 14 GLN CD 1 1 10 3219 1 1 14 GLN CG C 7.934 4.146 -5.264 1.00 . A A . 14 GLN CG 1 1 10 3220 1 1 14 GLN H H 6.646 4.327 -2.892 1.00 . A A . 14 GLN H 1 1 10 3221 1 1 14 GLN HA H 9.479 4.610 -2.914 1.00 . A A . 14 GLN HA 1 1 10 3222 1 1 14 GLN HB2 H 7.524 6.146 -4.694 1.00 . A A . 14 GLN HB2 1 1 10 3223 1 1 14 GLN HB3 H 9.256 5.806 -5.052 1.00 . A A . 14 GLN HB3 1 1 10 3224 1 1 14 GLN HE21 H 7.271 2.362 -3.689 1.00 . A A . 14 GLN HE21 1 1 10 3225 1 1 14 GLN HE22 H 8.715 1.390 -3.602 1.00 . A A . 14 GLN HE22 1 1 10 3226 1 1 14 GLN HG2 H 6.908 3.928 -4.956 1.00 . A A . 14 GLN HG2 1 1 10 3227 1 1 14 GLN HG3 H 7.980 4.265 -6.359 1.00 . A A . 14 GLN HG3 1 1 10 3228 1 1 14 GLN N N 7.491 4.556 -2.377 1.00 . A A . 14 GLN N 1 1 10 3229 1 1 14 GLN NE2 N 8.225 2.172 -3.967 1.00 . A A . 14 GLN NE2 1 1 10 3230 1 1 14 GLN O O 9.755 7.171 -2.595 1.00 . A A . 14 GLN O 1 1 10 3231 1 1 14 GLN OE1 O 9.990 2.915 -5.180 1.00 . A A . 14 GLN OE1 1 1 10 3232 1 1 15 ARG C C 7.750 7.959 0.208 1.00 . A A . 15 ARG C 1 1 10 3233 1 1 15 ARG CA C 7.623 8.201 -1.261 1.00 . A A . 15 ARG CA 1 1 10 3234 1 1 15 ARG CB C 6.319 8.977 -1.457 1.00 . A A . 15 ARG CB 1 1 10 3235 1 1 15 ARG CD C 4.065 8.558 -2.441 1.00 . A A . 15 ARG CD 1 1 10 3236 1 1 15 ARG CG C 5.562 8.561 -2.705 1.00 . A A . 15 ARG CG 1 1 10 3237 1 1 15 ARG CZ C 3.292 10.828 -3.118 1.00 . A A . 15 ARG CZ 1 1 10 3238 1 1 15 ARG H H 6.801 6.336 -1.782 1.00 . A A . 15 ARG H 1 1 10 3239 1 1 15 ARG HA H 8.464 8.733 -1.649 1.00 . A A . 15 ARG HA 1 1 10 3240 1 1 15 ARG HB2 H 5.665 8.824 -0.574 1.00 . A A . 15 ARG HB2 1 1 10 3241 1 1 15 ARG HB3 H 6.551 10.060 -1.526 1.00 . A A . 15 ARG HB3 1 1 10 3242 1 1 15 ARG HD2 H 3.506 8.201 -3.327 1.00 . A A . 15 ARG HD2 1 1 10 3243 1 1 15 ARG HD3 H 3.837 7.901 -1.564 1.00 . A A . 15 ARG HD3 1 1 10 3244 1 1 15 ARG HE H 3.575 10.246 -1.163 1.00 . A A . 15 ARG HE 1 1 10 3245 1 1 15 ARG HG2 H 5.799 9.252 -3.537 1.00 . A A . 15 ARG HG2 1 1 10 3246 1 1 15 ARG HG3 H 5.873 7.534 -2.999 1.00 . A A . 15 ARG HG3 1 1 10 3247 1 1 15 ARG HH11 H 3.642 9.512 -4.656 1.00 . A A . 15 ARG HH11 1 1 10 3248 1 1 15 ARG HH12 H 3.109 11.084 -5.150 1.00 . A A . 15 ARG HH12 1 1 10 3249 1 1 15 ARG HH21 H 2.850 12.377 -1.843 1.00 . A A . 15 ARG HH21 1 1 10 3250 1 1 15 ARG HH22 H 2.652 12.738 -3.524 1.00 . A A . 15 ARG HH22 1 1 10 3251 1 1 15 ARG N N 7.631 6.923 -1.864 1.00 . A A . 15 ARG N 1 1 10 3252 1 1 15 ARG NE N 3.624 9.951 -2.121 1.00 . A A . 15 ARG NE 1 1 10 3253 1 1 15 ARG NH1 N 3.352 10.441 -4.426 1.00 . A A . 15 ARG NH1 1 1 10 3254 1 1 15 ARG NH2 N 2.896 12.094 -2.800 1.00 . A A . 15 ARG NH2 1 1 10 3255 1 1 15 ARG O O 8.258 8.790 0.956 1.00 . A A . 15 ARG O 1 1 10 3256 1 1 16 LYS C C 6.131 7.046 2.735 1.00 . A A . 16 LYS C 1 1 10 3257 1 1 16 LYS CA C 7.207 6.329 1.981 1.00 . A A . 16 LYS CA 1 1 10 3258 1 1 16 LYS CB C 8.517 6.523 2.733 1.00 . A A . 16 LYS CB 1 1 10 3259 1 1 16 LYS CD C 9.407 4.173 2.379 1.00 . A A . 16 LYS CD 1 1 10 3260 1 1 16 LYS CE C 10.638 3.316 2.071 1.00 . A A . 16 LYS CE 1 1 10 3261 1 1 16 LYS CG C 9.667 5.672 2.196 1.00 . A A . 16 LYS CG 1 1 10 3262 1 1 16 LYS H H 6.837 6.138 -0.028 1.00 . A A . 16 LYS H 1 1 10 3263 1 1 16 LYS HA H 6.944 5.281 1.935 1.00 . A A . 16 LYS HA 1 1 10 3264 1 1 16 LYS HB2 H 8.786 7.588 2.656 1.00 . A A . 16 LYS HB2 1 1 10 3265 1 1 16 LYS HB3 H 8.354 6.284 3.800 1.00 . A A . 16 LYS HB3 1 1 10 3266 1 1 16 LYS HD2 H 9.088 3.986 3.425 1.00 . A A . 16 LYS HD2 1 1 10 3267 1 1 16 LYS HD3 H 8.572 3.870 1.707 1.00 . A A . 16 LYS HD3 1 1 10 3268 1 1 16 LYS HE2 H 11.506 3.647 2.679 1.00 . A A . 16 LYS HE2 1 1 10 3269 1 1 16 LYS HE3 H 10.428 2.245 2.279 1.00 . A A . 16 LYS HE3 1 1 10 3270 1 1 16 LYS HG2 H 9.809 5.891 1.117 1.00 . A A . 16 LYS HG2 1 1 10 3271 1 1 16 LYS HG3 H 10.603 5.947 2.728 1.00 . A A . 16 LYS HG3 1 1 10 3272 1 1 16 LYS HZ1 H 11.844 4.053 0.556 1.00 . A A . 16 LYS HZ1 1 1 10 3273 1 1 16 LYS HZ2 H 10.210 3.863 0.117 1.00 . A A . 16 LYS HZ2 1 1 10 3274 1 1 16 LYS HZ3 H 11.223 2.500 0.258 1.00 . A A . 16 LYS HZ3 1 1 10 3275 1 1 16 LYS N N 7.224 6.776 0.618 1.00 . A A . 16 LYS N 1 1 10 3276 1 1 16 LYS NZ N 11.009 3.441 0.645 1.00 . A A . 16 LYS NZ 1 1 10 3277 1 1 16 LYS O O 6.055 6.965 3.961 1.00 . A A . 16 LYS O 1 1 10 3278 1 1 17 LYS C C 3.262 9.046 1.597 1.00 . A A . 17 LYS C 1 1 10 3279 1 1 17 LYS CA C 4.178 8.443 2.661 1.00 . A A . 17 LYS CA 1 1 10 3280 1 1 17 LYS CB C 4.627 9.584 3.599 1.00 . A A . 17 LYS CB 1 1 10 3281 1 1 17 LYS CD C 5.462 11.584 2.245 1.00 . A A . 17 LYS CD 1 1 10 3282 1 1 17 LYS CE C 6.543 11.953 1.232 1.00 . A A . 17 LYS CE 1 1 10 3283 1 1 17 LYS CG C 5.845 10.357 3.080 1.00 . A A . 17 LYS CG 1 1 10 3284 1 1 17 LYS H H 5.343 7.840 1.028 1.00 . A A . 17 LYS H 1 1 10 3285 1 1 17 LYS HA H 3.624 7.700 3.205 1.00 . A A . 17 LYS HA 1 1 10 3286 1 1 17 LYS HB2 H 3.783 10.289 3.741 1.00 . A A . 17 LYS HB2 1 1 10 3287 1 1 17 LYS HB3 H 4.879 9.147 4.586 1.00 . A A . 17 LYS HB3 1 1 10 3288 1 1 17 LYS HD2 H 4.514 11.378 1.703 1.00 . A A . 17 LYS HD2 1 1 10 3289 1 1 17 LYS HD3 H 5.289 12.446 2.924 1.00 . A A . 17 LYS HD3 1 1 10 3290 1 1 17 LYS HE2 H 7.498 12.190 1.748 1.00 . A A . 17 LYS HE2 1 1 10 3291 1 1 17 LYS HE3 H 6.707 11.115 0.518 1.00 . A A . 17 LYS HE3 1 1 10 3292 1 1 17 LYS HG2 H 6.455 10.690 3.946 1.00 . A A . 17 LYS HG2 1 1 10 3293 1 1 17 LYS HG3 H 6.473 9.682 2.464 1.00 . A A . 17 LYS HG3 1 1 10 3294 1 1 17 LYS HZ1 H 6.945 13.792 0.366 1.00 . A A . 17 LYS HZ1 1 1 10 3295 1 1 17 LYS HZ2 H 5.357 13.628 0.945 1.00 . A A . 17 LYS HZ2 1 1 10 3296 1 1 17 LYS HZ3 H 5.823 12.849 -0.492 1.00 . A A . 17 LYS HZ3 1 1 10 3297 1 1 17 LYS N N 5.262 7.755 2.010 1.00 . A A . 17 LYS N 1 1 10 3298 1 1 17 LYS NZ N 6.138 13.144 0.455 1.00 . A A . 17 LYS NZ 1 1 10 3299 1 1 17 LYS O O 2.031 9.130 1.857 1.00 . A A . 17 LYS O 1 1 10 3300 1 1 17 LYS OXT O 3.777 9.438 0.527 1.00 . A A . 17 LYS OXT 1 1 11 3301 1 1 1 GLU C C -1.818 -8.622 -3.776 1.00 . A A . 1 GLU C 1 1 11 3302 1 1 1 GLU CA C -1.099 -9.596 -4.667 1.00 . A A . 1 GLU CA 1 1 11 3303 1 1 1 GLU CB C -0.937 -10.932 -3.910 1.00 . A A . 1 GLU CB 1 1 11 3304 1 1 1 GLU CD C -1.046 -12.399 -5.936 1.00 . A A . 1 GLU CD 1 1 11 3305 1 1 1 GLU CG C -0.198 -12.008 -4.729 1.00 . A A . 1 GLU CG 1 1 11 3306 1 1 1 GLU H1 H 0.280 -8.044 -4.838 1.00 . A A . 1 GLU H1 1 1 11 3307 1 1 1 GLU H2 H 0.388 -9.206 -6.072 1.00 . A A . 1 GLU H2 1 1 11 3308 1 1 1 GLU H3 H 0.977 -9.560 -4.518 1.00 . A A . 1 GLU H3 1 1 11 3309 1 1 1 GLU HA H -1.666 -9.739 -5.572 1.00 . A A . 1 GLU HA 1 1 11 3310 1 1 1 GLU HB2 H -0.375 -10.746 -2.968 1.00 . A A . 1 GLU HB2 1 1 11 3311 1 1 1 GLU HB3 H -1.944 -11.318 -3.636 1.00 . A A . 1 GLU HB3 1 1 11 3312 1 1 1 GLU HG2 H 0.780 -11.613 -5.079 1.00 . A A . 1 GLU HG2 1 1 11 3313 1 1 1 GLU HG3 H -0.021 -12.907 -4.104 1.00 . A A . 1 GLU HG3 1 1 11 3314 1 1 1 GLU N N 0.236 -9.061 -5.053 1.00 . A A . 1 GLU N 1 1 11 3315 1 1 1 GLU O O -2.098 -8.915 -2.615 1.00 . A A . 1 GLU O 1 1 11 3316 1 1 1 GLU OE1 O -2.288 -12.184 -5.890 1.00 . A A . 1 GLU OE1 1 1 11 3317 1 1 1 GLU OE2 O -0.460 -12.921 -6.919 1.00 . A A . 1 GLU OE2 1 1 11 3318 1 1 2 MET C C -3.855 -5.811 -4.420 1.00 . A A . 2 MET C 1 1 11 3319 1 1 2 MET CA C -2.830 -6.432 -3.546 1.00 . A A . 2 MET CA 1 1 11 3320 1 1 2 MET CB C -1.914 -5.336 -2.969 1.00 . A A . 2 MET CB 1 1 11 3321 1 1 2 MET CE C -4.124 -5.337 -0.911 1.00 . A A . 2 MET CE 1 1 11 3322 1 1 2 MET CG C -1.516 -5.548 -1.497 1.00 . A A . 2 MET CG 1 1 11 3323 1 1 2 MET H H -1.925 -7.194 -5.265 1.00 . A A . 2 MET H 1 1 11 3324 1 1 2 MET HA H -3.361 -6.920 -2.758 1.00 . A A . 2 MET HA 1 1 11 3325 1 1 2 MET HB2 H -0.989 -5.306 -3.578 1.00 . A A . 2 MET HB2 1 1 11 3326 1 1 2 MET HB3 H -2.412 -4.343 -3.057 1.00 . A A . 2 MET HB3 1 1 11 3327 1 1 2 MET HE1 H -3.775 -4.525 -1.578 1.00 . A A . 2 MET HE1 1 1 11 3328 1 1 2 MET HE2 H -4.565 -4.876 -0.004 1.00 . A A . 2 MET HE2 1 1 11 3329 1 1 2 MET HE3 H -4.927 -5.893 -1.443 1.00 . A A . 2 MET HE3 1 1 11 3330 1 1 2 MET HG2 H -0.552 -6.095 -1.470 1.00 . A A . 2 MET HG2 1 1 11 3331 1 1 2 MET HG3 H -1.340 -4.541 -1.058 1.00 . A A . 2 MET HG3 1 1 11 3332 1 1 2 MET N N -2.140 -7.429 -4.321 1.00 . A A . 2 MET N 1 1 11 3333 1 1 2 MET O O -4.025 -6.176 -5.582 1.00 . A A . 2 MET O 1 1 11 3334 1 1 2 MET SD S -2.747 -6.433 -0.482 1.00 . A A . 2 MET SD 1 1 11 3335 1 1 3 ARG C C -5.340 -2.780 -4.535 1.00 . A A . 3 ARG C 1 1 11 3336 1 1 3 ARG CA C -5.621 -4.194 -4.497 1.00 . A A . 3 ARG CA 1 1 11 3337 1 1 3 ARG CB C -6.866 -4.360 -3.667 1.00 . A A . 3 ARG CB 1 1 11 3338 1 1 3 ARG CD C -8.536 -2.647 -4.364 1.00 . A A . 3 ARG CD 1 1 11 3339 1 1 3 ARG CG C -8.142 -4.116 -4.445 1.00 . A A . 3 ARG CG 1 1 11 3340 1 1 3 ARG CZ C -10.303 -1.287 -3.277 1.00 . A A . 3 ARG CZ 1 1 11 3341 1 1 3 ARG H H -4.370 -4.486 -2.940 1.00 . A A . 3 ARG H 1 1 11 3342 1 1 3 ARG HA H -5.716 -4.558 -5.452 1.00 . A A . 3 ARG HA 1 1 11 3343 1 1 3 ARG HB2 H -6.866 -5.382 -3.234 1.00 . A A . 3 ARG HB2 1 1 11 3344 1 1 3 ARG HB3 H -6.803 -3.621 -2.827 1.00 . A A . 3 ARG HB3 1 1 11 3345 1 1 3 ARG HD2 H -7.710 -2.065 -3.886 1.00 . A A . 3 ARG HD2 1 1 11 3346 1 1 3 ARG HD3 H -8.755 -2.238 -5.371 1.00 . A A . 3 ARG HD3 1 1 11 3347 1 1 3 ARG HE H -10.185 -3.335 -3.130 1.00 . A A . 3 ARG HE 1 1 11 3348 1 1 3 ARG HG2 H -7.981 -4.402 -5.507 1.00 . A A . 3 ARG HG2 1 1 11 3349 1 1 3 ARG HG3 H -8.955 -4.747 -4.030 1.00 . A A . 3 ARG HG3 1 1 11 3350 1 1 3 ARG HH11 H -8.910 -0.254 -4.377 1.00 . A A . 3 ARG HH11 1 1 11 3351 1 1 3 ARG HH12 H -10.124 0.730 -3.633 1.00 . A A . 3 ARG HH12 1 1 11 3352 1 1 3 ARG HH21 H -11.840 -1.998 -2.115 1.00 . A A . 3 ARG HH21 1 1 11 3353 1 1 3 ARG HH22 H -11.819 -0.279 -2.323 1.00 . A A . 3 ARG HH22 1 1 11 3354 1 1 3 ARG N N -4.561 -4.831 -3.847 1.00 . A A . 3 ARG N 1 1 11 3355 1 1 3 ARG NE N -9.760 -2.517 -3.520 1.00 . A A . 3 ARG NE 1 1 11 3356 1 1 3 ARG NH1 N -9.728 -0.170 -3.809 1.00 . A A . 3 ARG NH1 1 1 11 3357 1 1 3 ARG NH2 N -11.421 -1.178 -2.503 1.00 . A A . 3 ARG NH2 1 1 11 3358 1 1 3 ARG O O -5.738 -2.047 -5.438 1.00 . A A . 3 ARG O 1 1 11 3359 1 1 4 LEU C C -3.403 -0.756 -4.450 1.00 . A A . 4 LEU C 1 1 11 3360 1 1 4 LEU CA C -4.297 -1.046 -3.352 1.00 . A A . 4 LEU CA 1 1 11 3361 1 1 4 LEU CB C -3.506 -0.808 -2.090 1.00 . A A . 4 LEU CB 1 1 11 3362 1 1 4 LEU CD1 C -2.480 -1.801 -0.103 1.00 . A A . 4 LEU CD1 1 1 11 3363 1 1 4 LEU CD2 C -4.982 -2.156 -0.578 1.00 . A A . 4 LEU CD2 1 1 11 3364 1 1 4 LEU CG C -3.575 -1.957 -1.143 1.00 . A A . 4 LEU CG 1 1 11 3365 1 1 4 LEU H H -4.231 -3.016 -2.869 1.00 . A A . 4 LEU H 1 1 11 3366 1 1 4 LEU HA H -5.124 -0.438 -3.401 1.00 . A A . 4 LEU HA 1 1 11 3367 1 1 4 LEU HB2 H -2.468 -0.606 -2.337 1.00 . A A . 4 LEU HB2 1 1 11 3368 1 1 4 LEU HB3 H -3.913 0.063 -1.570 1.00 . A A . 4 LEU HB3 1 1 11 3369 1 1 4 LEU HD11 H -1.730 -2.615 -0.234 1.00 . A A . 4 LEU HD11 1 1 11 3370 1 1 4 LEU HD12 H -2.891 -1.835 0.924 1.00 . A A . 4 LEU HD12 1 1 11 3371 1 1 4 LEU HD13 H -1.959 -0.825 -0.267 1.00 . A A . 4 LEU HD13 1 1 11 3372 1 1 4 LEU HD21 H -4.940 -2.686 0.395 1.00 . A A . 4 LEU HD21 1 1 11 3373 1 1 4 LEU HD22 H -5.588 -2.765 -1.297 1.00 . A A . 4 LEU HD22 1 1 11 3374 1 1 4 LEU HD23 H -5.480 -1.174 -0.437 1.00 . A A . 4 LEU HD23 1 1 11 3375 1 1 4 LEU HG H -3.314 -2.839 -1.736 1.00 . A A . 4 LEU HG 1 1 11 3376 1 1 4 LEU N N -4.615 -2.383 -3.525 1.00 . A A . 4 LEU N 1 1 11 3377 1 1 4 LEU O O -3.786 -0.022 -5.332 1.00 . A A . 4 LEU O 1 1 11 3378 1 1 5 SER C C -1.135 -1.001 -6.584 1.00 . A A . 5 SER C 1 1 11 3379 1 1 5 SER CA C -1.171 -1.697 -5.248 1.00 . A A . 5 SER CA 1 1 11 3380 1 1 5 SER CB C -0.728 -3.121 -5.330 1.00 . A A . 5 SER CB 1 1 11 3381 1 1 5 SER H H -2.456 -2.393 -3.823 1.00 . A A . 5 SER H 1 1 11 3382 1 1 5 SER HA H -0.458 -1.177 -4.618 1.00 . A A . 5 SER HA 1 1 11 3383 1 1 5 SER HB2 H 0.345 -3.158 -5.062 1.00 . A A . 5 SER HB2 1 1 11 3384 1 1 5 SER HB3 H -1.325 -3.676 -4.554 1.00 . A A . 5 SER HB3 1 1 11 3385 1 1 5 SER HG H -0.467 -3.153 -7.241 1.00 . A A . 5 SER HG 1 1 11 3386 1 1 5 SER N N -2.403 -1.654 -4.473 1.00 . A A . 5 SER N 1 1 11 3387 1 1 5 SER O O -0.121 -0.975 -7.267 1.00 . A A . 5 SER O 1 1 11 3388 1 1 5 SER OG O -0.945 -3.706 -6.611 1.00 . A A . 5 SER OG 1 1 11 3389 1 1 6 LYS C C -1.952 1.691 -7.227 1.00 . A A . 6 LYS C 1 1 11 3390 1 1 6 LYS CA C -2.255 0.444 -8.057 1.00 . A A . 6 LYS CA 1 1 11 3391 1 1 6 LYS CB C -3.616 0.613 -8.731 1.00 . A A . 6 LYS CB 1 1 11 3392 1 1 6 LYS CD C -5.467 -0.504 -10.045 1.00 . A A . 6 LYS CD 1 1 11 3393 1 1 6 LYS CE C -5.944 -1.770 -10.758 1.00 . A A . 6 LYS CE 1 1 11 3394 1 1 6 LYS CG C -4.079 -0.662 -9.434 1.00 . A A . 6 LYS CG 1 1 11 3395 1 1 6 LYS H H -3.130 -0.672 -6.579 1.00 . A A . 6 LYS H 1 1 11 3396 1 1 6 LYS HA H -1.453 0.234 -8.753 1.00 . A A . 6 LYS HA 1 1 11 3397 1 1 6 LYS HB2 H -4.367 0.905 -7.963 1.00 . A A . 6 LYS HB2 1 1 11 3398 1 1 6 LYS HB3 H -3.544 1.433 -9.476 1.00 . A A . 6 LYS HB3 1 1 11 3399 1 1 6 LYS HD2 H -6.181 -0.254 -9.232 1.00 . A A . 6 LYS HD2 1 1 11 3400 1 1 6 LYS HD3 H -5.453 0.341 -10.765 1.00 . A A . 6 LYS HD3 1 1 11 3401 1 1 6 LYS HE2 H -5.262 -2.027 -11.596 1.00 . A A . 6 LYS HE2 1 1 11 3402 1 1 6 LYS HE3 H -5.993 -2.623 -10.047 1.00 . A A . 6 LYS HE3 1 1 11 3403 1 1 6 LYS HG2 H -3.355 -0.920 -10.236 1.00 . A A . 6 LYS HG2 1 1 11 3404 1 1 6 LYS HG3 H -4.096 -1.498 -8.702 1.00 . A A . 6 LYS HG3 1 1 11 3405 1 1 6 LYS HZ1 H -7.616 -2.439 -11.782 1.00 . A A . 6 LYS HZ1 1 1 11 3406 1 1 6 LYS HZ2 H -7.270 -0.793 -12.016 1.00 . A A . 6 LYS HZ2 1 1 11 3407 1 1 6 LYS HZ3 H -7.956 -1.317 -10.554 1.00 . A A . 6 LYS HZ3 1 1 11 3408 1 1 6 LYS N N -2.242 -0.481 -7.004 1.00 . A A . 6 LYS N 1 1 11 3409 1 1 6 LYS NZ N -7.297 -1.565 -11.319 1.00 . A A . 6 LYS NZ 1 1 11 3410 1 1 6 LYS O O -1.948 2.816 -7.711 1.00 . A A . 6 LYS O 1 1 11 3411 1 1 7 PHE C C -0.339 2.563 -4.254 1.00 . A A . 7 PHE C 1 1 11 3412 1 1 7 PHE CA C -1.613 2.312 -4.816 1.00 . A A . 7 PHE CA 1 1 11 3413 1 1 7 PHE CB C -2.216 1.677 -3.593 1.00 . A A . 7 PHE CB 1 1 11 3414 1 1 7 PHE CD1 C -3.845 2.202 -1.941 1.00 . A A . 7 PHE CD1 1 1 11 3415 1 1 7 PHE CD2 C -1.727 3.201 -1.905 1.00 . A A . 7 PHE CD2 1 1 11 3416 1 1 7 PHE CE1 C -4.090 2.737 -0.737 1.00 . A A . 7 PHE CE1 1 1 11 3417 1 1 7 PHE CE2 C -1.910 3.766 -0.772 1.00 . A A . 7 PHE CE2 1 1 11 3418 1 1 7 PHE CG C -2.683 2.442 -2.516 1.00 . A A . 7 PHE CG 1 1 11 3419 1 1 7 PHE CZ C -3.119 3.552 -0.112 1.00 . A A . 7 PHE CZ 1 1 11 3420 1 1 7 PHE H H -1.762 0.448 -5.495 1.00 . A A . 7 PHE H 1 1 11 3421 1 1 7 PHE HA H -2.139 3.205 -5.003 1.00 . A A . 7 PHE HA 1 1 11 3422 1 1 7 PHE HB2 H -3.148 1.273 -3.940 1.00 . A A . 7 PHE HB2 1 1 11 3423 1 1 7 PHE HB3 H -1.637 0.834 -3.190 1.00 . A A . 7 PHE HB3 1 1 11 3424 1 1 7 PHE HD1 H -4.578 1.563 -2.444 1.00 . A A . 7 PHE HD1 1 1 11 3425 1 1 7 PHE HD2 H -0.792 3.381 -2.371 1.00 . A A . 7 PHE HD2 1 1 11 3426 1 1 7 PHE HE1 H -5.005 2.486 -0.280 1.00 . A A . 7 PHE HE1 1 1 11 3427 1 1 7 PHE HE2 H -1.053 4.334 -0.391 1.00 . A A . 7 PHE HE2 1 1 11 3428 1 1 7 PHE HZ H -3.305 3.989 0.858 1.00 . A A . 7 PHE HZ 1 1 11 3429 1 1 7 PHE N N -1.839 1.417 -5.858 1.00 . A A . 7 PHE N 1 1 11 3430 1 1 7 PHE O O 0.116 3.666 -4.260 1.00 . A A . 7 PHE O 1 1 11 3431 1 1 8 PHE C C 2.252 1.534 -3.510 1.00 . A A . 8 PHE C 1 1 11 3432 1 1 8 PHE CA C 1.203 1.727 -2.685 1.00 . A A . 8 PHE CA 1 1 11 3433 1 1 8 PHE CB C 1.571 0.666 -1.704 1.00 . A A . 8 PHE CB 1 1 11 3434 1 1 8 PHE CD1 C 2.032 -1.442 -2.272 1.00 . A A . 8 PHE CD1 1 1 11 3435 1 1 8 PHE CD2 C -0.169 -0.817 -1.973 1.00 . A A . 8 PHE CD2 1 1 11 3436 1 1 8 PHE CE1 C 1.707 -2.616 -2.613 1.00 . A A . 8 PHE CE1 1 1 11 3437 1 1 8 PHE CE2 C -0.530 -2.022 -2.314 1.00 . A A . 8 PHE CE2 1 1 11 3438 1 1 8 PHE CG C 1.092 -0.555 -1.956 1.00 . A A . 8 PHE CG 1 1 11 3439 1 1 8 PHE CZ C 0.413 -2.935 -2.645 1.00 . A A . 8 PHE CZ 1 1 11 3440 1 1 8 PHE H H -0.180 0.611 -3.653 1.00 . A A . 8 PHE H 1 1 11 3441 1 1 8 PHE HA H 1.220 2.686 -2.340 1.00 . A A . 8 PHE HA 1 1 11 3442 1 1 8 PHE HB2 H 2.632 0.561 -1.575 1.00 . A A . 8 PHE HB2 1 1 11 3443 1 1 8 PHE HB3 H 1.088 0.923 -0.761 1.00 . A A . 8 PHE HB3 1 1 11 3444 1 1 8 PHE HD1 H 3.077 -1.161 -2.243 1.00 . A A . 8 PHE HD1 1 1 11 3445 1 1 8 PHE HD2 H -0.884 -0.067 -1.691 1.00 . A A . 8 PHE HD2 1 1 11 3446 1 1 8 PHE HE1 H 2.469 -3.277 -2.882 1.00 . A A . 8 PHE HE1 1 1 11 3447 1 1 8 PHE HE2 H -1.539 -2.240 -2.370 1.00 . A A . 8 PHE HE2 1 1 11 3448 1 1 8 PHE HZ H 0.139 -3.863 -2.921 1.00 . A A . 8 PHE HZ 1 1 11 3449 1 1 8 PHE N N 0.167 1.522 -3.579 1.00 . A A . 8 PHE N 1 1 11 3450 1 1 8 PHE O O 3.172 2.200 -3.480 1.00 . A A . 8 PHE O 1 1 11 3451 1 1 9 ARG C C 2.943 1.306 -6.195 1.00 . A A . 9 ARG C 1 1 11 3452 1 1 9 ARG CA C 2.909 0.203 -5.285 1.00 . A A . 9 ARG CA 1 1 11 3453 1 1 9 ARG CB C 2.428 -1.023 -5.986 1.00 . A A . 9 ARG CB 1 1 11 3454 1 1 9 ARG CD C 4.386 -2.616 -6.088 1.00 . A A . 9 ARG CD 1 1 11 3455 1 1 9 ARG CG C 3.036 -2.306 -5.450 1.00 . A A . 9 ARG CG 1 1 11 3456 1 1 9 ARG CZ C 5.213 -3.369 -8.303 1.00 . A A . 9 ARG CZ 1 1 11 3457 1 1 9 ARG H H 1.142 0.145 -4.365 1.00 . A A . 9 ARG H 1 1 11 3458 1 1 9 ARG HA H 3.816 0.089 -4.816 1.00 . A A . 9 ARG HA 1 1 11 3459 1 1 9 ARG HB2 H 1.320 -1.049 -5.799 1.00 . A A . 9 ARG HB2 1 1 11 3460 1 1 9 ARG HB3 H 2.611 -0.922 -7.071 1.00 . A A . 9 ARG HB3 1 1 11 3461 1 1 9 ARG HD2 H 5.006 -1.695 -6.144 1.00 . A A . 9 ARG HD2 1 1 11 3462 1 1 9 ARG HD3 H 4.923 -3.401 -5.517 1.00 . A A . 9 ARG HD3 1 1 11 3463 1 1 9 ARG HE H 3.222 -3.266 -7.802 1.00 . A A . 9 ARG HE 1 1 11 3464 1 1 9 ARG HG2 H 3.175 -2.205 -4.360 1.00 . A A . 9 ARG HG2 1 1 11 3465 1 1 9 ARG HG3 H 2.335 -3.148 -5.637 1.00 . A A . 9 ARG HG3 1 1 11 3466 1 1 9 ARG HH11 H 6.649 -2.837 -6.934 1.00 . A A . 9 ARG HH11 1 1 11 3467 1 1 9 ARG HH12 H 7.262 -3.353 -8.468 1.00 . A A . 9 ARG HH12 1 1 11 3468 1 1 9 ARG HH21 H 4.054 -3.969 -9.890 1.00 . A A . 9 ARG HH21 1 1 11 3469 1 1 9 ARG HH22 H 5.761 -4.008 -10.178 1.00 . A A . 9 ARG HH22 1 1 11 3470 1 1 9 ARG N N 2.019 0.578 -4.338 1.00 . A A . 9 ARG N 1 1 11 3471 1 1 9 ARG NE N 4.155 -3.117 -7.476 1.00 . A A . 9 ARG NE 1 1 11 3472 1 1 9 ARG NH1 N 6.490 -3.169 -7.864 1.00 . A A . 9 ARG NH1 1 1 11 3473 1 1 9 ARG NH2 N 4.990 -3.822 -9.570 1.00 . A A . 9 ARG NH2 1 1 11 3474 1 1 9 ARG O O 3.631 1.301 -7.216 1.00 . A A . 9 ARG O 1 1 11 3475 1 1 10 ASP C C 2.129 4.575 -5.898 1.00 . A A . 10 ASP C 1 1 11 3476 1 1 10 ASP CA C 1.901 3.319 -6.637 1.00 . A A . 10 ASP CA 1 1 11 3477 1 1 10 ASP CB C 0.660 3.298 -7.305 1.00 . A A . 10 ASP CB 1 1 11 3478 1 1 10 ASP CG C 0.631 4.074 -8.618 1.00 . A A . 10 ASP CG 1 1 11 3479 1 1 10 ASP H H 1.459 2.151 -5.038 1.00 . A A . 10 ASP H 1 1 11 3480 1 1 10 ASP HA H 2.665 3.215 -7.293 1.00 . A A . 10 ASP HA 1 1 11 3481 1 1 10 ASP HB2 H 0.493 2.221 -7.474 1.00 . A A . 10 ASP HB2 1 1 11 3482 1 1 10 ASP HB3 H -0.075 3.690 -6.600 1.00 . A A . 10 ASP HB3 1 1 11 3483 1 1 10 ASP N N 2.015 2.205 -5.901 1.00 . A A . 10 ASP N 1 1 11 3484 1 1 10 ASP O O 2.115 5.641 -6.519 1.00 . A A . 10 ASP O 1 1 11 3485 1 1 10 ASP OD1 O 1.475 3.768 -9.502 1.00 . A A . 10 ASP OD1 1 1 11 3486 1 1 10 ASP OD2 O -0.231 4.983 -8.753 1.00 . A A . 10 ASP OD2 1 1 11 3487 1 1 11 . C C 2.342 6.051 -2.512 1.00 . A A . 11 DPN C 1 1 11 3488 1 1 11 . CA C 2.585 5.853 -3.978 1.00 . A A . 11 DPN CA 1 1 11 3489 1 1 11 . CB C 4.045 6.175 -4.215 1.00 . A A . 11 DPN CB 1 1 11 3490 1 1 11 . CD1 C 4.703 4.799 -6.106 1.00 . A A . 11 DPN CD1 1 1 11 3491 1 1 11 . CD2 C 4.901 4.181 -3.872 1.00 . A A . 11 DPN CD2 1 1 11 3492 1 1 11 . CE1 C 4.919 3.530 -6.430 1.00 . A A . 11 DPN CE1 1 1 11 3493 1 1 11 . CE2 C 5.185 3.009 -4.181 1.00 . A A . 11 DPN CE2 1 1 11 3494 1 1 11 . CG C 4.673 5.081 -4.779 1.00 . A A . 11 DPN CG 1 1 11 3495 1 1 11 . CZ C 5.158 2.662 -5.413 1.00 . A A . 11 DPN CZ 1 1 11 3496 1 1 11 . H H 2.303 3.685 -3.998 1.00 . A A . 11 DPN H 1 1 11 3497 1 1 11 . HA H 2.004 6.539 -4.472 1.00 . A A . 11 DPN HA 1 1 11 3498 1 1 11 . HB2 H 4.515 6.285 -3.246 1.00 . A A . 11 DPN HB2 1 1 11 3499 1 1 11 . HB3 H 4.167 6.996 -4.865 1.00 . A A . 11 DPN HB3 1 1 11 3500 1 1 11 . HD1 H 4.515 5.554 -6.855 1.00 . A A . 11 DPN HD1 1 1 11 3501 1 1 11 . HD2 H 4.931 4.465 -2.878 1.00 . A A . 11 DPN HD2 1 1 11 3502 1 1 11 . HE1 H 4.917 3.202 -7.455 1.00 . A A . 11 DPN HE1 1 1 11 3503 1 1 11 . HE2 H 5.316 2.286 -3.430 1.00 . A A . 11 DPN HE2 1 1 11 3504 1 1 11 . HZ H 5.220 1.720 -5.571 1.00 . A A . 11 DPN HZ 1 1 11 3505 1 1 11 . N N 2.295 4.551 -4.560 1.00 . A A . 11 DPN N 1 1 11 3506 1 1 11 . O O 1.371 6.687 -2.109 1.00 . A A . 11 DPN O 1 1 11 3507 1 1 12 ILE C C 4.577 5.041 0.190 1.00 . A A . 12 ILE C 1 1 11 3508 1 1 12 ILE CA C 3.302 5.718 -0.286 1.00 . A A . 12 ILE CA 1 1 11 3509 1 1 12 ILE CB C 2.128 5.150 0.442 1.00 . A A . 12 ILE CB 1 1 11 3510 1 1 12 ILE CD1 C 2.556 3.111 -0.668 1.00 . A A . 12 ILE CD1 1 1 11 3511 1 1 12 ILE CG1 C 1.519 4.093 -0.424 1.00 . A A . 12 ILE CG1 1 1 11 3512 1 1 12 ILE CG2 C 1.149 6.276 0.813 1.00 . A A . 12 ILE CG2 1 1 11 3513 1 1 12 ILE H H 3.895 4.852 -2.046 1.00 . A A . 12 ILE H 1 1 11 3514 1 1 12 ILE HA H 3.383 6.739 -0.112 1.00 . A A . 12 ILE HA 1 1 11 3515 1 1 12 ILE HB H 2.488 4.659 1.355 1.00 . A A . 12 ILE HB 1 1 11 3516 1 1 12 ILE HD11 H 2.855 3.142 -1.757 1.00 . A A . 12 ILE HD11 1 1 11 3517 1 1 12 ILE HD12 H 2.222 2.132 -0.377 1.00 . A A . 12 ILE HD12 1 1 11 3518 1 1 12 ILE HD13 H 3.417 3.341 -0.082 1.00 . A A . 12 ILE HD13 1 1 11 3519 1 1 12 ILE HG12 H 0.657 3.614 0.070 1.00 . A A . 12 ILE HG12 1 1 11 3520 1 1 12 ILE HG13 H 1.210 4.509 -1.406 1.00 . A A . 12 ILE HG13 1 1 11 3521 1 1 12 ILE HG21 H 1.347 7.180 0.197 1.00 . A A . 12 ILE HG21 1 1 11 3522 1 1 12 ILE HG22 H 1.256 6.546 1.884 1.00 . A A . 12 ILE HG22 1 1 11 3523 1 1 12 ILE HG23 H 0.102 5.952 0.633 1.00 . A A . 12 ILE HG23 1 1 11 3524 1 1 12 ILE N N 3.264 5.514 -1.704 1.00 . A A . 12 ILE N 1 1 11 3525 1 1 12 ILE O O 4.869 4.991 1.371 1.00 . A A . 12 ILE O 1 1 11 3526 1 1 13 LEU C C 7.650 4.313 -1.141 1.00 . A A . 13 LEU C 1 1 11 3527 1 1 13 LEU CA C 6.502 3.634 -0.523 1.00 . A A . 13 LEU CA 1 1 11 3528 1 1 13 LEU CB C 6.456 2.301 -1.240 1.00 . A A . 13 LEU CB 1 1 11 3529 1 1 13 LEU CD1 C 5.049 0.425 -1.972 1.00 . A A . 13 LEU CD1 1 1 11 3530 1 1 13 LEU CD2 C 4.742 1.569 0.334 1.00 . A A . 13 LEU CD2 1 1 11 3531 1 1 13 LEU CG C 5.118 1.700 -1.138 1.00 . A A . 13 LEU CG 1 1 11 3532 1 1 13 LEU H H 4.936 4.308 -1.718 1.00 . A A . 13 LEU H 1 1 11 3533 1 1 13 LEU HA H 6.636 3.510 0.529 1.00 . A A . 13 LEU HA 1 1 11 3534 1 1 13 LEU HB2 H 6.667 2.455 -2.313 1.00 . A A . 13 LEU HB2 1 1 11 3535 1 1 13 LEU HB3 H 7.197 1.604 -0.818 1.00 . A A . 13 LEU HB3 1 1 11 3536 1 1 13 LEU HD11 H 4.457 0.623 -2.905 1.00 . A A . 13 LEU HD11 1 1 11 3537 1 1 13 LEU HD12 H 4.572 -0.395 -1.403 1.00 . A A . 13 LEU HD12 1 1 11 3538 1 1 13 LEU HD13 H 6.068 0.120 -2.276 1.00 . A A . 13 LEU HD13 1 1 11 3539 1 1 13 LEU HD21 H 3.711 1.178 0.437 1.00 . A A . 13 LEU HD21 1 1 11 3540 1 1 13 LEU HD22 H 4.788 2.597 0.810 1.00 . A A . 13 LEU HD22 1 1 11 3541 1 1 13 LEU HD23 H 5.448 0.901 0.859 1.00 . A A . 13 LEU HD23 1 1 11 3542 1 1 13 LEU HG H 4.427 2.427 -1.610 1.00 . A A . 13 LEU HG 1 1 11 3543 1 1 13 LEU N N 5.286 4.384 -0.780 1.00 . A A . 13 LEU N 1 1 11 3544 1 1 13 LEU O O 8.692 4.502 -0.533 1.00 . A A . 13 LEU O 1 1 11 3545 1 1 14 GLN C C 8.701 6.612 -2.505 1.00 . A A . 14 GLN C 1 1 11 3546 1 1 14 GLN CA C 8.569 5.303 -3.136 1.00 . A A . 14 GLN CA 1 1 11 3547 1 1 14 GLN CB C 8.297 5.577 -4.613 1.00 . A A . 14 GLN CB 1 1 11 3548 1 1 14 GLN CD C 8.789 3.199 -4.954 1.00 . A A . 14 GLN CD 1 1 11 3549 1 1 14 GLN CG C 7.886 4.339 -5.338 1.00 . A A . 14 GLN CG 1 1 11 3550 1 1 14 GLN H H 6.637 4.426 -2.939 1.00 . A A . 14 GLN H 1 1 11 3551 1 1 14 GLN HA H 9.468 4.733 -2.996 1.00 . A A . 14 GLN HA 1 1 11 3552 1 1 14 GLN HB2 H 7.470 6.314 -4.691 1.00 . A A . 14 GLN HB2 1 1 11 3553 1 1 14 GLN HB3 H 9.199 6.000 -5.089 1.00 . A A . 14 GLN HB3 1 1 11 3554 1 1 14 GLN HE21 H 7.262 2.495 -3.818 1.00 . A A . 14 GLN HE21 1 1 11 3555 1 1 14 GLN HE22 H 8.715 1.533 -3.787 1.00 . A A . 14 GLN HE22 1 1 11 3556 1 1 14 GLN HG2 H 6.867 4.101 -5.023 1.00 . A A . 14 GLN HG2 1 1 11 3557 1 1 14 GLN HG3 H 7.915 4.495 -6.429 1.00 . A A . 14 GLN HG3 1 1 11 3558 1 1 14 GLN N N 7.489 4.644 -2.428 1.00 . A A . 14 GLN N 1 1 11 3559 1 1 14 GLN NE2 N 8.213 2.323 -4.117 1.00 . A A . 14 GLN NE2 1 1 11 3560 1 1 14 GLN O O 9.727 7.283 -2.592 1.00 . A A . 14 GLN O 1 1 11 3561 1 1 14 GLN OE1 O 9.954 3.122 -5.330 1.00 . A A . 14 GLN OE1 1 1 11 3562 1 1 15 ARG C C 7.767 7.959 0.258 1.00 . A A . 15 ARG C 1 1 11 3563 1 1 15 ARG CA C 7.605 8.252 -1.197 1.00 . A A . 15 ARG CA 1 1 11 3564 1 1 15 ARG CB C 6.290 9.018 -1.339 1.00 . A A . 15 ARG CB 1 1 11 3565 1 1 15 ARG CD C 4.021 8.613 -2.291 1.00 . A A . 15 ARG CD 1 1 11 3566 1 1 15 ARG CG C 5.512 8.637 -2.585 1.00 . A A . 15 ARG CG 1 1 11 3567 1 1 15 ARG CZ C 3.222 10.906 -2.849 1.00 . A A . 15 ARG CZ 1 1 11 3568 1 1 15 ARG H H 6.791 6.398 -1.770 1.00 . A A . 15 ARG H 1 1 11 3569 1 1 15 ARG HA H 8.433 8.806 -1.585 1.00 . A A . 15 ARG HA 1 1 11 3570 1 1 15 ARG HB2 H 5.656 8.828 -0.449 1.00 . A A . 15 ARG HB2 1 1 11 3571 1 1 15 ARG HB3 H 6.509 10.106 -1.375 1.00 . A A . 15 ARG HB3 1 1 11 3572 1 1 15 ARG HD2 H 3.445 8.290 -3.180 1.00 . A A . 15 ARG HD2 1 1 11 3573 1 1 15 ARG HD3 H 3.816 7.915 -1.440 1.00 . A A . 15 ARG HD3 1 1 11 3574 1 1 15 ARG HE H 3.553 10.240 -0.927 1.00 . A A . 15 ARG HE 1 1 11 3575 1 1 15 ARG HG2 H 5.726 9.359 -3.398 1.00 . A A . 15 ARG HG2 1 1 11 3576 1 1 15 ARG HG3 H 5.825 7.624 -2.920 1.00 . A A . 15 ARG HG3 1 1 11 3577 1 1 15 ARG HH11 H 3.534 9.659 -4.452 1.00 . A A . 15 ARG HH11 1 1 11 3578 1 1 15 ARG HH12 H 2.988 11.250 -4.863 1.00 . A A . 15 ARG HH12 1 1 11 3579 1 1 15 ARG HH21 H 2.812 12.396 -1.496 1.00 . A A . 15 ARG HH21 1 1 11 3580 1 1 15 ARG HH22 H 2.571 12.831 -3.155 1.00 . A A . 15 ARG HH22 1 1 11 3581 1 1 15 ARG N N 7.616 6.993 -1.843 1.00 . A A . 15 ARG N 1 1 11 3582 1 1 15 ARG NE N 3.580 9.987 -1.899 1.00 . A A . 15 ARG NE 1 1 11 3583 1 1 15 ARG NH1 N 3.251 10.576 -4.173 1.00 . A A . 15 ARG NH1 1 1 11 3584 1 1 15 ARG NH2 N 2.833 12.155 -2.466 1.00 . A A . 15 ARG NH2 1 1 11 3585 1 1 15 ARG O O 8.285 8.769 1.024 1.00 . A A . 15 ARG O 1 1 11 3586 1 1 16 LYS C C 6.216 6.937 2.785 1.00 . A A . 16 LYS C 1 1 11 3587 1 1 16 LYS CA C 7.280 6.258 1.980 1.00 . A A . 16 LYS CA 1 1 11 3588 1 1 16 LYS CB C 8.606 6.445 2.705 1.00 . A A . 16 LYS CB 1 1 11 3589 1 1 16 LYS CD C 9.557 4.138 2.175 1.00 . A A . 16 LYS CD 1 1 11 3590 1 1 16 LYS CE C 9.651 3.607 3.607 1.00 . A A . 16 LYS CE 1 1 11 3591 1 1 16 LYS CG C 9.764 5.655 2.089 1.00 . A A . 16 LYS CG 1 1 11 3592 1 1 16 LYS H H 6.859 6.142 -0.024 1.00 . A A . 16 LYS H 1 1 11 3593 1 1 16 LYS HA H 7.027 5.210 1.901 1.00 . A A . 16 LYS HA 1 1 11 3594 1 1 16 LYS HB2 H 8.845 7.520 2.680 1.00 . A A . 16 LYS HB2 1 1 11 3595 1 1 16 LYS HB3 H 8.481 6.145 3.761 1.00 . A A . 16 LYS HB3 1 1 11 3596 1 1 16 LYS HD2 H 8.558 3.887 1.758 1.00 . A A . 16 LYS HD2 1 1 11 3597 1 1 16 LYS HD3 H 10.324 3.635 1.548 1.00 . A A . 16 LYS HD3 1 1 11 3598 1 1 16 LYS HE2 H 10.625 3.883 4.064 1.00 . A A . 16 LYS HE2 1 1 11 3599 1 1 16 LYS HE3 H 8.824 4.012 4.230 1.00 . A A . 16 LYS HE3 1 1 11 3600 1 1 16 LYS HG2 H 9.876 5.947 1.024 1.00 . A A . 16 LYS HG2 1 1 11 3601 1 1 16 LYS HG3 H 10.705 5.924 2.617 1.00 . A A . 16 LYS HG3 1 1 11 3602 1 1 16 LYS HZ1 H 9.539 1.781 2.637 1.00 . A A . 16 LYS HZ1 1 1 11 3603 1 1 16 LYS HZ2 H 8.669 1.849 4.093 1.00 . A A . 16 LYS HZ2 1 1 11 3604 1 1 16 LYS HZ3 H 10.362 1.730 4.120 1.00 . A A . 16 LYS HZ3 1 1 11 3605 1 1 16 LYS N N 7.260 6.758 0.636 1.00 . A A . 16 LYS N 1 1 11 3606 1 1 16 LYS NZ N 9.547 2.131 3.615 1.00 . A A . 16 LYS NZ 1 1 11 3607 1 1 16 LYS O O 6.176 6.821 4.009 1.00 . A A . 16 LYS O 1 1 11 3608 1 1 17 LYS C C 3.293 8.930 1.779 1.00 . A A . 17 LYS C 1 1 11 3609 1 1 17 LYS CA C 4.240 8.306 2.801 1.00 . A A . 17 LYS CA 1 1 11 3610 1 1 17 LYS CB C 4.698 9.423 3.762 1.00 . A A . 17 LYS CB 1 1 11 3611 1 1 17 LYS CD C 5.448 11.493 2.464 1.00 . A A . 17 LYS CD 1 1 11 3612 1 1 17 LYS CE C 6.440 11.879 1.366 1.00 . A A . 17 LYS CE 1 1 11 3613 1 1 17 LYS CG C 5.883 10.238 3.231 1.00 . A A . 17 LYS CG 1 1 11 3614 1 1 17 LYS H H 5.367 7.761 1.122 1.00 . A A . 17 LYS H 1 1 11 3615 1 1 17 LYS HA H 3.707 7.540 3.333 1.00 . A A . 17 LYS HA 1 1 11 3616 1 1 17 LYS HB2 H 3.846 10.105 3.956 1.00 . A A . 17 LYS HB2 1 1 11 3617 1 1 17 LYS HB3 H 4.991 8.959 4.724 1.00 . A A . 17 LYS HB3 1 1 11 3618 1 1 17 LYS HD2 H 4.454 11.313 2.000 1.00 . A A . 17 LYS HD2 1 1 11 3619 1 1 17 LYS HD3 H 5.347 12.339 3.177 1.00 . A A . 17 LYS HD3 1 1 11 3620 1 1 17 LYS HE2 H 6.578 11.037 0.655 1.00 . A A . 17 LYS HE2 1 1 11 3621 1 1 17 LYS HE3 H 6.082 12.774 0.814 1.00 . A A . 17 LYS HE3 1 1 11 3622 1 1 17 LYS HG2 H 6.520 10.544 4.086 1.00 . A A . 17 LYS HG2 1 1 11 3623 1 1 17 LYS HG3 H 6.496 9.601 2.563 1.00 . A A . 17 LYS HG3 1 1 11 3624 1 1 17 LYS HZ1 H 8.390 11.375 1.853 1.00 . A A . 17 LYS HZ1 1 1 11 3625 1 1 17 LYS HZ2 H 7.645 12.427 2.959 1.00 . A A . 17 LYS HZ2 1 1 11 3626 1 1 17 LYS HZ3 H 8.172 13.013 1.454 1.00 . A A . 17 LYS HZ3 1 1 11 3627 1 1 17 LYS N N 5.315 7.651 2.103 1.00 . A A . 17 LYS N 1 1 11 3628 1 1 17 LYS NZ N 7.760 12.198 1.952 1.00 . A A . 17 LYS NZ 1 1 11 3629 1 1 17 LYS O O 3.781 9.376 0.717 1.00 . A A . 17 LYS O 1 1 11 3630 1 1 17 LYS OXT O 2.065 8.978 2.063 1.00 . A A . 17 LYS OXT 1 1 12 3631 1 1 1 GLU C C -2.123 -8.791 -3.691 1.00 . A A . 1 GLU C 1 1 12 3632 1 1 1 GLU CA C -1.443 -9.859 -4.500 1.00 . A A . 1 GLU CA 1 1 12 3633 1 1 1 GLU CB C -1.717 -11.228 -3.844 1.00 . A A . 1 GLU CB 1 1 12 3634 1 1 1 GLU CD C -1.468 -13.710 -3.967 1.00 . A A . 1 GLU CD 1 1 12 3635 1 1 1 GLU CG C -1.303 -12.407 -4.742 1.00 . A A . 1 GLU CG 1 1 12 3636 1 1 1 GLU H1 H 0.523 -10.337 -4.018 1.00 . A A . 1 GLU H1 1 1 12 3637 1 1 1 GLU H2 H 0.233 -8.671 -4.170 1.00 . A A . 1 GLU H2 1 1 12 3638 1 1 1 GLU H3 H 0.337 -9.645 -5.558 1.00 . A A . 1 GLU H3 1 1 12 3639 1 1 1 GLU HA H -1.824 -9.842 -5.509 1.00 . A A . 1 GLU HA 1 1 12 3640 1 1 1 GLU HB2 H -1.158 -11.284 -2.882 1.00 . A A . 1 GLU HB2 1 1 12 3641 1 1 1 GLU HB3 H -2.802 -11.314 -3.616 1.00 . A A . 1 GLU HB3 1 1 12 3642 1 1 1 GLU HG2 H -1.940 -12.434 -5.651 1.00 . A A . 1 GLU HG2 1 1 12 3643 1 1 1 GLU HG3 H -0.241 -12.299 -5.047 1.00 . A A . 1 GLU HG3 1 1 12 3644 1 1 1 GLU N N 0.022 -9.610 -4.566 1.00 . A A . 1 GLU N 1 1 12 3645 1 1 1 GLU O O -2.641 -9.048 -2.605 1.00 . A A . 1 GLU O 1 1 12 3646 1 1 1 GLU OE1 O -1.676 -13.647 -2.727 1.00 . A A . 1 GLU OE1 1 1 12 3647 1 1 1 GLU OE2 O -1.387 -14.789 -4.612 1.00 . A A . 1 GLU OE2 1 1 12 3648 1 1 2 MET C C -3.763 -5.848 -4.438 1.00 . A A . 2 MET C 1 1 12 3649 1 1 2 MET CA C -2.769 -6.459 -3.529 1.00 . A A . 2 MET CA 1 1 12 3650 1 1 2 MET CB C -1.794 -5.371 -3.045 1.00 . A A . 2 MET CB 1 1 12 3651 1 1 2 MET CE C -3.877 -5.317 -0.846 1.00 . A A . 2 MET CE 1 1 12 3652 1 1 2 MET CG C -1.312 -5.551 -1.595 1.00 . A A . 2 MET CG 1 1 12 3653 1 1 2 MET H H -1.737 -7.342 -5.113 1.00 . A A . 2 MET H 1 1 12 3654 1 1 2 MET HA H -3.328 -6.848 -2.702 1.00 . A A . 2 MET HA 1 1 12 3655 1 1 2 MET HB2 H -0.907 -5.375 -3.711 1.00 . A A . 2 MET HB2 1 1 12 3656 1 1 2 MET HB3 H -2.278 -4.370 -3.128 1.00 . A A . 2 MET HB3 1 1 12 3657 1 1 2 MET HE1 H -4.769 -5.896 -1.167 1.00 . A A . 2 MET HE1 1 1 12 3658 1 1 2 MET HE2 H -3.621 -4.610 -1.662 1.00 . A A . 2 MET HE2 1 1 12 3659 1 1 2 MET HE3 H -4.152 -4.726 0.051 1.00 . A A . 2 MET HE3 1 1 12 3660 1 1 2 MET HG2 H -0.345 -6.095 -1.611 1.00 . A A . 2 MET HG2 1 1 12 3661 1 1 2 MET HG3 H -1.115 -4.535 -1.187 1.00 . A A . 2 MET HG3 1 1 12 3662 1 1 2 MET N N -2.143 -7.551 -4.227 1.00 . A A . 2 MET N 1 1 12 3663 1 1 2 MET O O -3.899 -6.216 -5.603 1.00 . A A . 2 MET O 1 1 12 3664 1 1 2 MET SD S -2.480 -6.417 -0.495 1.00 . A A . 2 MET SD 1 1 12 3665 1 1 3 ARG C C -5.296 -2.819 -4.563 1.00 . A A . 3 ARG C 1 1 12 3666 1 1 3 ARG CA C -5.535 -4.236 -4.574 1.00 . A A . 3 ARG CA 1 1 12 3667 1 1 3 ARG CB C -6.817 -4.418 -3.811 1.00 . A A . 3 ARG CB 1 1 12 3668 1 1 3 ARG CD C -6.857 -6.833 -3.129 1.00 . A A . 3 ARG CD 1 1 12 3669 1 1 3 ARG CG C -7.474 -5.773 -4.041 1.00 . A A . 3 ARG CG 1 1 12 3670 1 1 3 ARG CZ C -7.483 -8.038 -1.053 1.00 . A A . 3 ARG CZ 1 1 12 3671 1 1 3 ARG H H -4.294 -4.522 -2.970 1.00 . A A . 3 ARG H 1 1 12 3672 1 1 3 ARG HA H -5.578 -4.585 -5.540 1.00 . A A . 3 ARG HA 1 1 12 3673 1 1 3 ARG HB2 H -6.543 -4.322 -2.733 1.00 . A A . 3 ARG HB2 1 1 12 3674 1 1 3 ARG HB3 H -7.518 -3.598 -4.067 1.00 . A A . 3 ARG HB3 1 1 12 3675 1 1 3 ARG HD2 H -6.625 -7.760 -3.696 1.00 . A A . 3 ARG HD2 1 1 12 3676 1 1 3 ARG HD3 H -5.931 -6.434 -2.652 1.00 . A A . 3 ARG HD3 1 1 12 3677 1 1 3 ARG HE H -8.737 -6.745 -2.045 1.00 . A A . 3 ARG HE 1 1 12 3678 1 1 3 ARG HG2 H -8.565 -5.693 -3.841 1.00 . A A . 3 ARG HG2 1 1 12 3679 1 1 3 ARG HG3 H -7.336 -6.074 -5.102 1.00 . A A . 3 ARG HG3 1 1 12 3680 1 1 3 ARG HH11 H -5.597 -8.406 -1.780 1.00 . A A . 3 ARG HH11 1 1 12 3681 1 1 3 ARG HH12 H -5.995 -9.258 -0.326 1.00 . A A . 3 ARG HH12 1 1 12 3682 1 1 3 ARG HH21 H -9.281 -7.905 -0.068 1.00 . A A . 3 ARG HH21 1 1 12 3683 1 1 3 ARG HH22 H -8.126 -8.968 0.663 1.00 . A A . 3 ARG HH22 1 1 12 3684 1 1 3 ARG N N -4.478 -4.867 -3.883 1.00 . A A . 3 ARG N 1 1 12 3685 1 1 3 ARG NE N -7.830 -7.166 -2.046 1.00 . A A . 3 ARG NE 1 1 12 3686 1 1 3 ARG NH1 N -6.249 -8.620 -1.053 1.00 . A A . 3 ARG NH1 1 1 12 3687 1 1 3 ARG NH2 N -8.376 -8.330 -0.064 1.00 . A A . 3 ARG NH2 1 1 12 3688 1 1 3 ARG O O -5.794 -2.058 -5.390 1.00 . A A . 3 ARG O 1 1 12 3689 1 1 4 LEU C C -3.355 -0.780 -4.487 1.00 . A A . 4 LEU C 1 1 12 3690 1 1 4 LEU CA C -4.237 -1.100 -3.388 1.00 . A A . 4 LEU CA 1 1 12 3691 1 1 4 LEU CB C -3.450 -0.864 -2.126 1.00 . A A . 4 LEU CB 1 1 12 3692 1 1 4 LEU CD1 C -2.408 -1.865 -0.154 1.00 . A A . 4 LEU CD1 1 1 12 3693 1 1 4 LEU CD2 C -4.903 -2.271 -0.648 1.00 . A A . 4 LEU CD2 1 1 12 3694 1 1 4 LEU CG C -3.497 -2.028 -1.200 1.00 . A A . 4 LEU CG 1 1 12 3695 1 1 4 LEU H H -4.095 -3.090 -2.962 1.00 . A A . 4 LEU H 1 1 12 3696 1 1 4 LEU HA H -5.078 -0.509 -3.430 1.00 . A A . 4 LEU HA 1 1 12 3697 1 1 4 LEU HB2 H -2.416 -0.637 -2.371 1.00 . A A . 4 LEU HB2 1 1 12 3698 1 1 4 LEU HB3 H -3.876 -0.009 -1.593 1.00 . A A . 4 LEU HB3 1 1 12 3699 1 1 4 LEU HD11 H -1.644 -2.666 -0.292 1.00 . A A . 4 LEU HD11 1 1 12 3700 1 1 4 LEU HD12 H -2.821 -1.916 0.871 1.00 . A A . 4 LEU HD12 1 1 12 3701 1 1 4 LEU HD13 H -1.901 -0.880 -0.308 1.00 . A A . 4 LEU HD13 1 1 12 3702 1 1 4 LEU HD21 H -5.460 -1.312 -0.582 1.00 . A A . 4 LEU HD21 1 1 12 3703 1 1 4 LEU HD22 H -4.853 -2.730 0.360 1.00 . A A . 4 LEU HD22 1 1 12 3704 1 1 4 LEU HD23 H -5.459 -2.961 -1.336 1.00 . A A . 4 LEU HD23 1 1 12 3705 1 1 4 LEU HG H -3.213 -2.894 -1.805 1.00 . A A . 4 LEU HG 1 1 12 3706 1 1 4 LEU N N -4.525 -2.441 -3.585 1.00 . A A . 4 LEU N 1 1 12 3707 1 1 4 LEU O O -3.755 -0.042 -5.359 1.00 . A A . 4 LEU O 1 1 12 3708 1 1 5 SER C C -1.092 -0.969 -6.635 1.00 . A A . 5 SER C 1 1 12 3709 1 1 5 SER CA C -1.113 -1.680 -5.308 1.00 . A A . 5 SER CA 1 1 12 3710 1 1 5 SER CB C -0.660 -3.100 -5.408 1.00 . A A . 5 SER CB 1 1 12 3711 1 1 5 SER H H -2.380 -2.406 -3.884 1.00 . A A . 5 SER H 1 1 12 3712 1 1 5 SER HA H -0.400 -1.162 -4.675 1.00 . A A . 5 SER HA 1 1 12 3713 1 1 5 SER HB2 H 0.412 -3.134 -5.141 1.00 . A A . 5 SER HB2 1 1 12 3714 1 1 5 SER HB3 H -1.255 -3.672 -4.641 1.00 . A A . 5 SER HB3 1 1 12 3715 1 1 5 SER HG H -0.401 -3.102 -7.321 1.00 . A A . 5 SER HG 1 1 12 3716 1 1 5 SER N N -2.341 -1.661 -4.526 1.00 . A A . 5 SER N 1 1 12 3717 1 1 5 SER O O -0.083 -0.924 -7.325 1.00 . A A . 5 SER O 1 1 12 3718 1 1 5 SER OG O -0.871 -3.668 -6.699 1.00 . A A . 5 SER OG 1 1 12 3719 1 1 6 LYS C C -1.946 1.721 -7.240 1.00 . A A . 6 LYS C 1 1 12 3720 1 1 6 LYS CA C -2.239 0.481 -8.083 1.00 . A A . 6 LYS CA 1 1 12 3721 1 1 6 LYS CB C -3.606 0.641 -8.748 1.00 . A A . 6 LYS CB 1 1 12 3722 1 1 6 LYS CD C -5.476 -0.501 -10.017 1.00 . A A . 6 LYS CD 1 1 12 3723 1 1 6 LYS CE C -5.962 -1.776 -10.711 1.00 . A A . 6 LYS CE 1 1 12 3724 1 1 6 LYS CG C -4.061 -0.630 -9.463 1.00 . A A . 6 LYS CG 1 1 12 3725 1 1 6 LYS H H -3.090 -0.661 -6.611 1.00 . A A . 6 LYS H 1 1 12 3726 1 1 6 LYS HA H -1.438 0.289 -8.786 1.00 . A A . 6 LYS HA 1 1 12 3727 1 1 6 LYS HB2 H -4.356 0.918 -7.974 1.00 . A A . 6 LYS HB2 1 1 12 3728 1 1 6 LYS HB3 H -3.547 1.470 -9.485 1.00 . A A . 6 LYS HB3 1 1 12 3729 1 1 6 LYS HD2 H -6.162 -0.265 -9.175 1.00 . A A . 6 LYS HD2 1 1 12 3730 1 1 6 LYS HD3 H -5.511 0.344 -10.736 1.00 . A A . 6 LYS HD3 1 1 12 3731 1 1 6 LYS HE2 H -5.860 -2.652 -10.036 1.00 . A A . 6 LYS HE2 1 1 12 3732 1 1 6 LYS HE3 H -7.024 -1.670 -11.019 1.00 . A A . 6 LYS HE3 1 1 12 3733 1 1 6 LYS HG2 H -3.361 -0.848 -10.298 1.00 . A A . 6 LYS HG2 1 1 12 3734 1 1 6 LYS HG3 H -4.024 -1.483 -8.751 1.00 . A A . 6 LYS HG3 1 1 12 3735 1 1 6 LYS HZ1 H -4.588 -2.898 -11.780 1.00 . A A . 6 LYS HZ1 1 1 12 3736 1 1 6 LYS HZ2 H -4.531 -1.233 -12.106 1.00 . A A . 6 LYS HZ2 1 1 12 3737 1 1 6 LYS HZ3 H -5.791 -2.180 -12.736 1.00 . A A . 6 LYS HZ3 1 1 12 3738 1 1 6 LYS N N -2.207 -0.456 -7.041 1.00 . A A . 6 LYS N 1 1 12 3739 1 1 6 LYS NZ N -5.158 -2.042 -11.924 1.00 . A A . 6 LYS NZ 1 1 12 3740 1 1 6 LYS O O -1.959 2.852 -7.711 1.00 . A A . 6 LYS O 1 1 12 3741 1 1 7 PHE C C -0.329 2.576 -4.264 1.00 . A A . 7 PHE C 1 1 12 3742 1 1 7 PHE CA C -1.604 2.316 -4.823 1.00 . A A . 7 PHE CA 1 1 12 3743 1 1 7 PHE CB C -2.193 1.657 -3.608 1.00 . A A . 7 PHE CB 1 1 12 3744 1 1 7 PHE CD1 C -3.822 2.139 -1.944 1.00 . A A . 7 PHE CD1 1 1 12 3745 1 1 7 PHE CD2 C -1.717 3.164 -1.899 1.00 . A A . 7 PHE CD2 1 1 12 3746 1 1 7 PHE CE1 C -4.070 2.654 -0.733 1.00 . A A . 7 PHE CE1 1 1 12 3747 1 1 7 PHE CE2 C -1.904 3.710 -0.759 1.00 . A A . 7 PHE CE2 1 1 12 3748 1 1 7 PHE CG C -2.665 2.402 -2.519 1.00 . A A . 7 PHE CG 1 1 12 3749 1 1 7 PHE CZ C -3.108 3.473 -0.099 1.00 . A A . 7 PHE CZ 1 1 12 3750 1 1 7 PHE H H -1.732 0.460 -5.524 1.00 . A A . 7 PHE H 1 1 12 3751 1 1 7 PHE HA H -2.141 3.205 -4.996 1.00 . A A . 7 PHE HA 1 1 12 3752 1 1 7 PHE HB2 H -3.121 1.246 -3.956 1.00 . A A . 7 PHE HB2 1 1 12 3753 1 1 7 PHE HB3 H -1.601 0.817 -3.218 1.00 . A A . 7 PHE HB3 1 1 12 3754 1 1 7 PHE HD1 H -4.549 1.498 -2.455 1.00 . A A . 7 PHE HD1 1 1 12 3755 1 1 7 PHE HD2 H -0.785 3.360 -2.366 1.00 . A A . 7 PHE HD2 1 1 12 3756 1 1 7 PHE HE1 H -4.981 2.387 -0.277 1.00 . A A . 7 PHE HE1 1 1 12 3757 1 1 7 PHE HE2 H -1.052 4.284 -0.373 1.00 . A A . 7 PHE HE2 1 1 12 3758 1 1 7 PHE HZ H -3.296 3.894 0.877 1.00 . A A . 7 PHE HZ 1 1 12 3759 1 1 7 PHE N N -1.824 1.433 -5.876 1.00 . A A . 7 PHE N 1 1 12 3760 1 1 7 PHE O O 0.111 3.684 -4.255 1.00 . A A . 7 PHE O 1 1 12 3761 1 1 8 PHE C C 2.278 1.571 -3.544 1.00 . A A . 8 PHE C 1 1 12 3762 1 1 8 PHE CA C 1.229 1.738 -2.712 1.00 . A A . 8 PHE CA 1 1 12 3763 1 1 8 PHE CB C 1.613 0.667 -1.747 1.00 . A A . 8 PHE CB 1 1 12 3764 1 1 8 PHE CD1 C 2.096 -1.425 -2.353 1.00 . A A . 8 PHE CD1 1 1 12 3765 1 1 8 PHE CD2 C -0.110 -0.833 -2.024 1.00 . A A . 8 PHE CD2 1 1 12 3766 1 1 8 PHE CE1 C 1.783 -2.598 -2.709 1.00 . A A . 8 PHE CE1 1 1 12 3767 1 1 8 PHE CE2 C -0.459 -2.035 -2.381 1.00 . A A . 8 PHE CE2 1 1 12 3768 1 1 8 PHE CG C 1.148 -0.554 -2.015 1.00 . A A . 8 PHE CG 1 1 12 3769 1 1 8 PHE CZ C 0.492 -2.931 -2.735 1.00 . A A . 8 PHE CZ 1 1 12 3770 1 1 8 PHE H H -0.144 0.618 -3.687 1.00 . A A . 8 PHE H 1 1 12 3771 1 1 8 PHE HA H 1.236 2.692 -2.352 1.00 . A A . 8 PHE HA 1 1 12 3772 1 1 8 PHE HB2 H 2.677 0.572 -1.623 1.00 . A A . 8 PHE HB2 1 1 12 3773 1 1 8 PHE HB3 H 1.132 0.905 -0.799 1.00 . A A . 8 PHE HB3 1 1 12 3774 1 1 8 PHE HD1 H 3.137 -1.132 -2.328 1.00 . A A . 8 PHE HD1 1 1 12 3775 1 1 8 PHE HD2 H -0.832 -0.095 -1.726 1.00 . A A . 8 PHE HD2 1 1 12 3776 1 1 8 PHE HE1 H 2.549 -3.246 -2.994 1.00 . A A . 8 PHE HE1 1 1 12 3777 1 1 8 PHE HE2 H -1.465 -2.265 -2.432 1.00 . A A . 8 PHE HE2 1 1 12 3778 1 1 8 PHE HZ H 0.226 -3.859 -3.023 1.00 . A A . 8 PHE HZ 1 1 12 3779 1 1 8 PHE N N 0.192 1.533 -3.603 1.00 . A A . 8 PHE N 1 1 12 3780 1 1 8 PHE O O 3.190 2.249 -3.508 1.00 . A A . 8 PHE O 1 1 12 3781 1 1 9 ARG C C 2.960 1.387 -6.234 1.00 . A A . 9 ARG C 1 1 12 3782 1 1 9 ARG CA C 2.945 0.272 -5.339 1.00 . A A . 9 ARG CA 1 1 12 3783 1 1 9 ARG CB C 2.474 -0.949 -6.053 1.00 . A A . 9 ARG CB 1 1 12 3784 1 1 9 ARG CD C 4.431 -2.538 -6.207 1.00 . A A . 9 ARG CD 1 1 12 3785 1 1 9 ARG CG C 3.096 -2.233 -5.534 1.00 . A A . 9 ARG CG 1 1 12 3786 1 1 9 ARG CZ C 5.199 -3.305 -8.439 1.00 . A A . 9 ARG CZ 1 1 12 3787 1 1 9 ARG H H 1.182 0.179 -4.413 1.00 . A A . 9 ARG H 1 1 12 3788 1 1 9 ARG HA H 3.855 0.163 -4.876 1.00 . A A . 9 ARG HA 1 1 12 3789 1 1 9 ARG HB2 H 1.367 -0.990 -5.864 1.00 . A A . 9 ARG HB2 1 1 12 3790 1 1 9 ARG HB3 H 2.652 -0.834 -7.138 1.00 . A A . 9 ARG HB3 1 1 12 3791 1 1 9 ARG HD2 H 5.043 -1.614 -6.285 1.00 . A A . 9 ARG HD2 1 1 12 3792 1 1 9 ARG HD3 H 4.988 -3.317 -5.647 1.00 . A A . 9 ARG HD3 1 1 12 3793 1 1 9 ARG HE H 3.221 -3.203 -7.883 1.00 . A A . 9 ARG HE 1 1 12 3794 1 1 9 ARG HG2 H 3.264 -2.133 -4.448 1.00 . A A . 9 ARG HG2 1 1 12 3795 1 1 9 ARG HG3 H 2.393 -3.076 -5.704 1.00 . A A . 9 ARG HG3 1 1 12 3796 1 1 9 ARG HH11 H 6.671 -2.759 -7.114 1.00 . A A . 9 ARG HH11 1 1 12 3797 1 1 9 ARG HH12 H 7.244 -3.285 -8.661 1.00 . A A . 9 ARG HH12 1 1 12 3798 1 1 9 ARG HH21 H 4.000 -3.920 -9.989 1.00 . A A . 9 ARG HH21 1 1 12 3799 1 1 9 ARG HH22 H 5.698 -3.956 -10.323 1.00 . A A . 9 ARG HH22 1 1 12 3800 1 1 9 ARG N N 2.054 0.624 -4.383 1.00 . A A . 9 ARG N 1 1 12 3801 1 1 9 ARG NE N 4.164 -3.050 -7.585 1.00 . A A . 9 ARG NE 1 1 12 3802 1 1 9 ARG NH1 N 6.486 -3.098 -8.036 1.00 . A A . 9 ARG NH1 1 1 12 3803 1 1 9 ARG NH2 N 4.943 -3.769 -9.696 1.00 . A A . 9 ARG NH2 1 1 12 3804 1 1 9 ARG O O 3.643 1.405 -7.257 1.00 . A A . 9 ARG O 1 1 12 3805 1 1 10 ASP C C 2.103 4.640 -5.890 1.00 . A A . 10 ASP C 1 1 12 3806 1 1 10 ASP CA C 1.889 3.391 -6.646 1.00 . A A . 10 ASP CA 1 1 12 3807 1 1 10 ASP CB C 0.645 3.362 -7.308 1.00 . A A . 10 ASP CB 1 1 12 3808 1 1 10 ASP CG C 0.600 4.157 -8.609 1.00 . A A . 10 ASP CG 1 1 12 3809 1 1 10 ASP H H 1.470 2.198 -5.060 1.00 . A A . 10 ASP H 1 1 12 3810 1 1 10 ASP HA H 2.652 3.307 -7.305 1.00 . A A . 10 ASP HA 1 1 12 3811 1 1 10 ASP HB2 H 0.493 2.286 -7.493 1.00 . A A . 10 ASP HB2 1 1 12 3812 1 1 10 ASP HB3 H -0.092 3.732 -6.595 1.00 . A A . 10 ASP HB3 1 1 12 3813 1 1 10 ASP N N 2.020 2.269 -5.925 1.00 . A A . 10 ASP N 1 1 12 3814 1 1 10 ASP O O 2.070 5.714 -6.496 1.00 . A A . 10 ASP O 1 1 12 3815 1 1 10 ASP OD1 O 1.444 3.876 -9.502 1.00 . A A . 10 ASP OD1 1 1 12 3816 1 1 10 ASP OD2 O -0.275 5.057 -8.727 1.00 . A A . 10 ASP OD2 1 1 12 3817 1 1 11 . C C 2.314 6.072 -2.484 1.00 . A A . 11 DPN C 1 1 12 3818 1 1 11 . CA C 2.551 5.898 -3.955 1.00 . A A . 11 DPN CA 1 1 12 3819 1 1 11 . CB C 4.002 6.247 -4.200 1.00 . A A . 11 DPN CB 1 1 12 3820 1 1 11 . CD1 C 4.672 4.900 -6.106 1.00 . A A . 11 DPN CD1 1 1 12 3821 1 1 11 . CD2 C 4.890 4.262 -3.880 1.00 . A A . 11 DPN CD2 1 1 12 3822 1 1 11 . CE1 C 4.904 3.637 -6.445 1.00 . A A . 11 DPN CE1 1 1 12 3823 1 1 11 . CE2 C 5.190 3.097 -4.203 1.00 . A A . 11 DPN CE2 1 1 12 3824 1 1 11 . CG C 4.646 5.168 -4.778 1.00 . A A . 11 DPN CG 1 1 12 3825 1 1 11 . CZ C 5.159 2.762 -5.439 1.00 . A A . 11 DPN CZ 1 1 12 3826 1 1 11 . H H 2.298 3.727 -4.002 1.00 . A A . 11 DPN H 1 1 12 3827 1 1 11 . HA H 1.954 6.580 -4.434 1.00 . A A . 11 DPN HA 1 1 12 3828 1 1 11 . HB2 H 4.474 6.357 -3.235 1.00 . A A . 11 DPN HB2 1 1 12 3829 1 1 11 . HB3 H 4.104 7.075 -4.844 1.00 . A A . 11 DPN HB3 1 1 12 3830 1 1 11 . HD1 H 4.470 5.661 -6.847 1.00 . A A . 11 DPN HD1 1 1 12 3831 1 1 11 . HD2 H 4.923 4.538 -2.882 1.00 . A A . 11 DPN HD2 1 1 12 3832 1 1 11 . HE1 H 4.901 3.321 -7.474 1.00 . A A . 11 DPN HE1 1 1 12 3833 1 1 11 . HE2 H 5.333 2.368 -3.461 1.00 . A A . 11 DPN HE2 1 1 12 3834 1 1 11 . HZ H 5.233 1.823 -5.608 1.00 . A A . 11 DPN HZ 1 1 12 3835 1 1 11 . N N 2.276 4.601 -4.553 1.00 . A A . 11 DPN N 1 1 12 3836 1 1 11 . O O 1.338 6.688 -2.066 1.00 . A A . 11 DPN O 1 1 12 3837 1 1 12 ILE C C 4.577 5.055 0.194 1.00 . A A . 12 ILE C 1 1 12 3838 1 1 12 ILE CA C 3.292 5.723 -0.267 1.00 . A A . 12 ILE CA 1 1 12 3839 1 1 12 ILE CB C 2.127 5.134 0.458 1.00 . A A . 12 ILE CB 1 1 12 3840 1 1 12 ILE CD1 C 2.571 3.114 -0.680 1.00 . A A . 12 ILE CD1 1 1 12 3841 1 1 12 ILE CG1 C 1.525 4.081 -0.417 1.00 . A A . 12 ILE CG1 1 1 12 3842 1 1 12 ILE CG2 C 1.136 6.246 0.845 1.00 . A A . 12 ILE CG2 1 1 12 3843 1 1 12 ILE H H 3.889 4.889 -2.038 1.00 . A A . 12 ILE H 1 1 12 3844 1 1 12 ILE HA H 3.362 6.741 -0.083 1.00 . A A . 12 ILE HA 1 1 12 3845 1 1 12 ILE HB H 2.496 4.636 1.364 1.00 . A A . 12 ILE HB 1 1 12 3846 1 1 12 ILE HD11 H 3.433 3.350 -0.091 1.00 . A A . 12 ILE HD11 1 1 12 3847 1 1 12 ILE HD12 H 2.867 3.162 -1.766 1.00 . A A . 12 ILE HD12 1 1 12 3848 1 1 12 ILE HD13 H 2.243 2.127 -0.405 1.00 . A A . 12 ILE HD13 1 1 12 3849 1 1 12 ILE HG12 H 0.672 3.585 0.075 1.00 . A A . 12 ILE HG12 1 1 12 3850 1 1 12 ILE HG13 H 1.206 4.505 -1.392 1.00 . A A . 12 ILE HG13 1 1 12 3851 1 1 12 ILE HG21 H 1.230 6.490 1.925 1.00 . A A . 12 ILE HG21 1 1 12 3852 1 1 12 ILE HG22 H 0.094 5.918 0.646 1.00 . A A . 12 ILE HG22 1 1 12 3853 1 1 12 ILE HG23 H 1.336 7.165 0.254 1.00 . A A . 12 ILE HG23 1 1 12 3854 1 1 12 ILE N N 3.251 5.536 -1.687 1.00 . A A . 12 ILE N 1 1 12 3855 1 1 12 ILE O O 4.879 5.001 1.373 1.00 . A A . 12 ILE O 1 1 12 3856 1 1 13 LEU C C 7.650 4.368 -1.144 1.00 . A A . 13 LEU C 1 1 12 3857 1 1 13 LEU CA C 6.509 3.673 -0.539 1.00 . A A . 13 LEU CA 1 1 12 3858 1 1 13 LEU CB C 6.477 2.352 -1.276 1.00 . A A . 13 LEU CB 1 1 12 3859 1 1 13 LEU CD1 C 5.089 0.472 -2.034 1.00 . A A . 13 LEU CD1 1 1 12 3860 1 1 13 LEU CD2 C 4.774 1.580 0.290 1.00 . A A . 13 LEU CD2 1 1 12 3861 1 1 13 LEU CG C 5.146 1.736 -1.183 1.00 . A A . 13 LEU CG 1 1 12 3862 1 1 13 LEU H H 4.933 4.344 -1.722 1.00 . A A . 13 LEU H 1 1 12 3863 1 1 13 LEU HA H 6.644 3.531 0.511 1.00 . A A . 13 LEU HA 1 1 12 3864 1 1 13 LEU HB2 H 6.683 2.526 -2.347 1.00 . A A . 13 LEU HB2 1 1 12 3865 1 1 13 LEU HB3 H 7.225 1.657 -0.867 1.00 . A A . 13 LEU HB3 1 1 12 3866 1 1 13 LEU HD11 H 4.502 0.681 -2.968 1.00 . A A . 13 LEU HD11 1 1 12 3867 1 1 13 LEU HD12 H 4.613 -0.357 -1.481 1.00 . A A . 13 LEU HD12 1 1 12 3868 1 1 13 LEU HD13 H 6.112 0.179 -2.336 1.00 . A A . 13 LEU HD13 1 1 12 3869 1 1 13 LEU HD21 H 4.815 2.601 0.780 1.00 . A A . 13 LEU HD21 1 1 12 3870 1 1 13 LEU HD22 H 5.487 0.908 0.802 1.00 . A A . 13 LEU HD22 1 1 12 3871 1 1 13 LEU HD23 H 3.747 1.180 0.391 1.00 . A A . 13 LEU HD23 1 1 12 3872 1 1 13 LEU HG H 4.446 2.463 -1.642 1.00 . A A . 13 LEU HG 1 1 12 3873 1 1 13 LEU N N 5.284 4.413 -0.785 1.00 . A A . 13 LEU N 1 1 12 3874 1 1 13 LEU O O 8.689 4.549 -0.530 1.00 . A A . 13 LEU O 1 1 12 3875 1 1 14 GLN C C 8.673 6.703 -2.485 1.00 . A A . 14 GLN C 1 1 12 3876 1 1 14 GLN CA C 8.555 5.400 -3.129 1.00 . A A . 14 GLN CA 1 1 12 3877 1 1 14 GLN CB C 8.278 5.690 -4.603 1.00 . A A . 14 GLN CB 1 1 12 3878 1 1 14 GLN CD C 8.787 3.321 -4.977 1.00 . A A . 14 GLN CD 1 1 12 3879 1 1 14 GLN CG C 7.878 4.459 -5.347 1.00 . A A . 14 GLN CG 1 1 12 3880 1 1 14 GLN H H 6.633 4.503 -2.940 1.00 . A A . 14 GLN H 1 1 12 3881 1 1 14 GLN HA H 9.461 4.839 -2.999 1.00 . A A . 14 GLN HA 1 1 12 3882 1 1 14 GLN HB2 H 7.443 6.418 -4.672 1.00 . A A . 14 GLN HB2 1 1 12 3883 1 1 14 GLN HB3 H 9.173 6.129 -5.076 1.00 . A A . 14 GLN HB3 1 1 12 3884 1 1 14 GLN HE21 H 7.262 2.591 -3.855 1.00 . A A . 14 GLN HE21 1 1 12 3885 1 1 14 GLN HE22 H 8.722 1.639 -3.832 1.00 . A A . 14 GLN HE22 1 1 12 3886 1 1 14 GLN HG2 H 6.859 4.209 -5.040 1.00 . A A . 14 GLN HG2 1 1 12 3887 1 1 14 GLN HG3 H 7.908 4.630 -6.436 1.00 . A A . 14 GLN HG3 1 1 12 3888 1 1 14 GLN N N 7.485 4.720 -2.428 1.00 . A A . 14 GLN N 1 1 12 3889 1 1 14 GLN NE2 N 8.216 2.430 -4.153 1.00 . A A . 14 GLN NE2 1 1 12 3890 1 1 14 GLN O O 9.701 7.376 -2.545 1.00 . A A . 14 GLN O 1 1 12 3891 1 1 14 GLN OE1 O 9.954 3.257 -5.350 1.00 . A A . 14 GLN OE1 1 1 12 3892 1 1 15 ARG C C 7.740 8.020 0.266 1.00 . A A . 15 ARG C 1 1 12 3893 1 1 15 ARG CA C 7.554 8.330 -1.179 1.00 . A A . 15 ARG CA 1 1 12 3894 1 1 15 ARG CB C 6.227 9.084 -1.302 1.00 . A A . 15 ARG CB 1 1 12 3895 1 1 15 ARG CD C 3.966 8.651 -2.254 1.00 . A A . 15 ARG CD 1 1 12 3896 1 1 15 ARG CG C 5.453 8.712 -2.552 1.00 . A A . 15 ARG CG 1 1 12 3897 1 1 15 ARG CZ C 3.128 10.964 -2.650 1.00 . A A . 15 ARG CZ 1 1 12 3898 1 1 15 ARG H H 6.753 6.477 -1.780 1.00 . A A . 15 ARG H 1 1 12 3899 1 1 15 ARG HA H 8.372 8.898 -1.569 1.00 . A A . 15 ARG HA 1 1 12 3900 1 1 15 ARG HB2 H 5.596 8.870 -0.412 1.00 . A A . 15 ARG HB2 1 1 12 3901 1 1 15 ARG HB3 H 6.431 10.175 -1.319 1.00 . A A . 15 ARG HB3 1 1 12 3902 1 1 15 ARG HD2 H 3.388 8.382 -3.159 1.00 . A A . 15 ARG HD2 1 1 12 3903 1 1 15 ARG HD3 H 3.776 7.897 -1.449 1.00 . A A . 15 ARG HD3 1 1 12 3904 1 1 15 ARG HE H 3.498 10.178 -0.783 1.00 . A A . 15 ARG HE 1 1 12 3905 1 1 15 ARG HG2 H 5.648 9.454 -3.352 1.00 . A A . 15 ARG HG2 1 1 12 3906 1 1 15 ARG HG3 H 5.786 7.711 -2.909 1.00 . A A . 15 ARG HG3 1 1 12 3907 1 1 15 ARG HH11 H 3.448 9.834 -4.335 1.00 . A A . 15 ARG HH11 1 1 12 3908 1 1 15 ARG HH12 H 2.864 11.437 -4.634 1.00 . A A . 15 ARG HH12 1 1 12 3909 1 1 15 ARG HH21 H 2.701 12.351 -1.196 1.00 . A A . 15 ARG HH21 1 1 12 3910 1 1 15 ARG HH22 H 2.434 12.891 -2.820 1.00 . A A . 15 ARG HH22 1 1 12 3911 1 1 15 ARG N N 7.576 7.076 -1.837 1.00 . A A . 15 ARG N 1 1 12 3912 1 1 15 ARG NE N 3.515 9.991 -1.767 1.00 . A A . 15 ARG NE 1 1 12 3913 1 1 15 ARG NH1 N 3.148 10.725 -3.993 1.00 . A A . 15 ARG NH1 1 1 12 3914 1 1 15 ARG NH2 N 2.718 12.177 -2.180 1.00 . A A . 15 ARG NH2 1 1 12 3915 1 1 15 ARG O O 8.230 8.833 1.043 1.00 . A A . 15 ARG O 1 1 12 3916 1 1 16 LYS C C 6.270 6.874 2.789 1.00 . A A . 16 LYS C 1 1 12 3917 1 1 16 LYS CA C 7.339 6.249 1.944 1.00 . A A . 16 LYS CA 1 1 12 3918 1 1 16 LYS CB C 8.681 6.448 2.649 1.00 . A A . 16 LYS CB 1 1 12 3919 1 1 16 LYS CD C 10.721 5.954 1.218 1.00 . A A . 16 LYS CD 1 1 12 3920 1 1 16 LYS CE C 11.863 4.978 0.930 1.00 . A A . 16 LYS CE 1 1 12 3921 1 1 16 LYS CG C 9.728 5.409 2.249 1.00 . A A . 16 LYS CG 1 1 12 3922 1 1 16 LYS H H 6.899 6.179 -0.057 1.00 . A A . 16 LYS H 1 1 12 3923 1 1 16 LYS HA H 7.111 5.198 1.834 1.00 . A A . 16 LYS HA 1 1 12 3924 1 1 16 LYS HB2 H 9.052 7.453 2.397 1.00 . A A . 16 LYS HB2 1 1 12 3925 1 1 16 LYS HB3 H 8.525 6.403 3.742 1.00 . A A . 16 LYS HB3 1 1 12 3926 1 1 16 LYS HD2 H 10.179 6.170 0.271 1.00 . A A . 16 LYS HD2 1 1 12 3927 1 1 16 LYS HD3 H 11.146 6.909 1.594 1.00 . A A . 16 LYS HD3 1 1 12 3928 1 1 16 LYS HE2 H 12.446 4.774 1.852 1.00 . A A . 16 LYS HE2 1 1 12 3929 1 1 16 LYS HE3 H 11.466 4.022 0.525 1.00 . A A . 16 LYS HE3 1 1 12 3930 1 1 16 LYS HG2 H 10.283 5.082 3.154 1.00 . A A . 16 LYS HG2 1 1 12 3931 1 1 16 LYS HG3 H 9.211 4.524 1.821 1.00 . A A . 16 LYS HG3 1 1 12 3932 1 1 16 LYS HZ1 H 13.253 4.782 -0.595 1.00 . A A . 16 LYS HZ1 1 1 12 3933 1 1 16 LYS HZ2 H 13.503 6.131 0.406 1.00 . A A . 16 LYS HZ2 1 1 12 3934 1 1 16 LYS HZ3 H 12.249 6.144 -0.739 1.00 . A A . 16 LYS HZ3 1 1 12 3935 1 1 16 LYS N N 7.282 6.793 0.617 1.00 . A A . 16 LYS N 1 1 12 3936 1 1 16 LYS NZ N 12.786 5.551 -0.074 1.00 . A A . 16 LYS NZ 1 1 12 3937 1 1 16 LYS O O 6.230 6.682 4.005 1.00 . A A . 16 LYS O 1 1 12 3938 1 1 17 LYS C C 3.225 8.713 1.917 1.00 . A A . 17 LYS C 1 1 12 3939 1 1 17 LYS CA C 4.290 8.226 2.898 1.00 . A A . 17 LYS CA 1 1 12 3940 1 1 17 LYS CB C 4.702 9.426 3.784 1.00 . A A . 17 LYS CB 1 1 12 3941 1 1 17 LYS CD C 6.057 10.761 2.042 1.00 . A A . 17 LYS CD 1 1 12 3942 1 1 17 LYS CE C 4.875 11.706 1.842 1.00 . A A . 17 LYS CE 1 1 12 3943 1 1 17 LYS CG C 6.053 10.056 3.409 1.00 . A A . 17 LYS CG 1 1 12 3944 1 1 17 LYS H H 5.405 7.794 1.182 1.00 . A A . 17 LYS H 1 1 12 3945 1 1 17 LYS HA H 3.859 7.444 3.496 1.00 . A A . 17 LYS HA 1 1 12 3946 1 1 17 LYS HB2 H 3.915 10.204 3.727 1.00 . A A . 17 LYS HB2 1 1 12 3947 1 1 17 LYS HB3 H 4.757 9.080 4.837 1.00 . A A . 17 LYS HB3 1 1 12 3948 1 1 17 LYS HD2 H 7.000 11.338 1.938 1.00 . A A . 17 LYS HD2 1 1 12 3949 1 1 17 LYS HD3 H 6.041 9.994 1.241 1.00 . A A . 17 LYS HD3 1 1 12 3950 1 1 17 LYS HE2 H 3.956 11.125 1.621 1.00 . A A . 17 LYS HE2 1 1 12 3951 1 1 17 LYS HE3 H 4.712 12.331 2.745 1.00 . A A . 17 LYS HE3 1 1 12 3952 1 1 17 LYS HG2 H 6.330 10.796 4.189 1.00 . A A . 17 LYS HG2 1 1 12 3953 1 1 17 LYS HG3 H 6.831 9.263 3.408 1.00 . A A . 17 LYS HG3 1 1 12 3954 1 1 17 LYS HZ1 H 6.106 12.944 0.728 1.00 . A A . 17 LYS HZ1 1 1 12 3955 1 1 17 LYS HZ2 H 4.475 13.415 0.742 1.00 . A A . 17 LYS HZ2 1 1 12 3956 1 1 17 LYS HZ3 H 4.966 12.085 -0.193 1.00 . A A . 17 LYS HZ3 1 1 12 3957 1 1 17 LYS N N 5.365 7.626 2.157 1.00 . A A . 17 LYS N 1 1 12 3958 1 1 17 LYS NZ N 5.123 12.605 0.695 1.00 . A A . 17 LYS NZ 1 1 12 3959 1 1 17 LYS O O 2.064 8.925 2.362 1.00 . A A . 17 LYS O 1 1 12 3960 1 1 17 LYS OXT O 3.556 8.881 0.724 1.00 . A A . 17 LYS OXT 1 1 13 3961 1 1 1 GLU C C -1.717 -8.555 -3.798 1.00 . A A . 1 GLU C 1 1 13 3962 1 1 1 GLU CA C -0.998 -9.512 -4.707 1.00 . A A . 1 GLU CA 1 1 13 3963 1 1 1 GLU CB C 0.341 -8.876 -5.135 1.00 . A A . 1 GLU CB 1 1 13 3964 1 1 1 GLU CD C 2.499 -9.155 -6.365 1.00 . A A . 1 GLU CD 1 1 13 3965 1 1 1 GLU CG C 1.285 -9.890 -5.804 1.00 . A A . 1 GLU CG 1 1 13 3966 1 1 1 GLU H1 H -2.780 -9.421 -5.783 1.00 . A A . 1 GLU H1 1 1 13 3967 1 1 1 GLU H2 H -1.893 -10.849 -6.028 1.00 . A A . 1 GLU H2 1 1 13 3968 1 1 1 GLU H3 H -1.382 -9.399 -6.750 1.00 . A A . 1 GLU H3 1 1 13 3969 1 1 1 GLU HA H -0.827 -10.439 -4.185 1.00 . A A . 1 GLU HA 1 1 13 3970 1 1 1 GLU HB2 H 0.135 -8.042 -5.842 1.00 . A A . 1 GLU HB2 1 1 13 3971 1 1 1 GLU HB3 H 0.845 -8.452 -4.240 1.00 . A A . 1 GLU HB3 1 1 13 3972 1 1 1 GLU HG2 H 1.622 -10.645 -5.062 1.00 . A A . 1 GLU HG2 1 1 13 3973 1 1 1 GLU HG3 H 0.761 -10.409 -6.634 1.00 . A A . 1 GLU HG3 1 1 13 3974 1 1 1 GLU N N -1.825 -9.818 -5.907 1.00 . A A . 1 GLU N 1 1 13 3975 1 1 1 GLU O O -1.891 -8.825 -2.612 1.00 . A A . 1 GLU O 1 1 13 3976 1 1 1 GLU OE1 O 2.443 -7.900 -6.471 1.00 . A A . 1 GLU OE1 1 1 13 3977 1 1 1 GLU OE2 O 3.499 -9.843 -6.695 1.00 . A A . 1 GLU OE2 1 1 13 3978 1 1 2 MET C C -3.882 -5.801 -4.424 1.00 . A A . 2 MET C 1 1 13 3979 1 1 2 MET CA C -2.851 -6.427 -3.557 1.00 . A A . 2 MET CA 1 1 13 3980 1 1 2 MET CB C -1.944 -5.333 -2.962 1.00 . A A . 2 MET CB 1 1 13 3981 1 1 2 MET CE C -4.169 -5.338 -0.916 1.00 . A A . 2 MET CE 1 1 13 3982 1 1 2 MET CG C -1.560 -5.556 -1.488 1.00 . A A . 2 MET CG 1 1 13 3983 1 1 2 MET H H -2.023 -7.187 -5.315 1.00 . A A . 2 MET H 1 1 13 3984 1 1 2 MET HA H -3.378 -6.933 -2.779 1.00 . A A . 2 MET HA 1 1 13 3985 1 1 2 MET HB2 H -1.013 -5.297 -3.560 1.00 . A A . 2 MET HB2 1 1 13 3986 1 1 2 MET HB3 H -2.442 -4.340 -3.047 1.00 . A A . 2 MET HB3 1 1 13 3987 1 1 2 MET HE1 H -3.810 -4.517 -1.567 1.00 . A A . 2 MET HE1 1 1 13 3988 1 1 2 MET HE2 H -4.618 -4.889 -0.007 1.00 . A A . 2 MET HE2 1 1 13 3989 1 1 2 MET HE3 H -4.968 -5.884 -1.465 1.00 . A A . 2 MET HE3 1 1 13 3990 1 1 2 MET HG2 H -0.597 -6.107 -1.457 1.00 . A A . 2 MET HG2 1 1 13 3991 1 1 2 MET HG3 H -1.385 -4.554 -1.040 1.00 . A A . 2 MET HG3 1 1 13 3992 1 1 2 MET N N -2.154 -7.403 -4.350 1.00 . A A . 2 MET N 1 1 13 3993 1 1 2 MET O O -4.061 -6.163 -5.584 1.00 . A A . 2 MET O 1 1 13 3994 1 1 2 MET SD S -2.802 -6.446 -0.490 1.00 . A A . 2 MET SD 1 1 13 3995 1 1 3 ARG C C -5.363 -2.769 -4.524 1.00 . A A . 3 ARG C 1 1 13 3996 1 1 3 ARG CA C -5.645 -4.183 -4.488 1.00 . A A . 3 ARG CA 1 1 13 3997 1 1 3 ARG CB C -6.886 -4.350 -3.653 1.00 . A A . 3 ARG CB 1 1 13 3998 1 1 3 ARG CD C -8.560 -2.637 -4.341 1.00 . A A . 3 ARG CD 1 1 13 3999 1 1 3 ARG CG C -8.166 -4.106 -4.425 1.00 . A A . 3 ARG CG 1 1 13 4000 1 1 3 ARG CZ C -10.312 -1.276 -3.230 1.00 . A A . 3 ARG CZ 1 1 13 4001 1 1 3 ARG H H -4.385 -4.478 -2.939 1.00 . A A . 3 ARG H 1 1 13 4002 1 1 3 ARG HA H -5.745 -4.545 -5.444 1.00 . A A . 3 ARG HA 1 1 13 4003 1 1 3 ARG HB2 H -6.884 -5.372 -3.220 1.00 . A A . 3 ARG HB2 1 1 13 4004 1 1 3 ARG HB3 H -6.820 -3.613 -2.812 1.00 . A A . 3 ARG HB3 1 1 13 4005 1 1 3 ARG HD2 H -7.730 -2.054 -3.869 1.00 . A A . 3 ARG HD2 1 1 13 4006 1 1 3 ARG HD3 H -8.787 -2.228 -5.347 1.00 . A A . 3 ARG HD3 1 1 13 4007 1 1 3 ARG HE H -10.202 -3.326 -3.098 1.00 . A A . 3 ARG HE 1 1 13 4008 1 1 3 ARG HG2 H -8.010 -4.390 -5.487 1.00 . A A . 3 ARG HG2 1 1 13 4009 1 1 3 ARG HG3 H -8.976 -4.737 -4.006 1.00 . A A . 3 ARG HG3 1 1 13 4010 1 1 3 ARG HH11 H -8.923 -0.242 -4.336 1.00 . A A . 3 ARG HH11 1 1 13 4011 1 1 3 ARG HH12 H -10.126 0.743 -3.573 1.00 . A A . 3 ARG HH12 1 1 13 4012 1 1 3 ARG HH21 H -11.842 -1.989 -2.059 1.00 . A A . 3 ARG HH21 1 1 13 4013 1 1 3 ARG HH22 H -11.815 -0.269 -2.256 1.00 . A A . 3 ARG HH22 1 1 13 4014 1 1 3 ARG N N -4.582 -4.822 -3.844 1.00 . A A . 3 ARG N 1 1 13 4015 1 1 3 ARG NE N -9.777 -2.508 -3.486 1.00 . A A . 3 ARG NE 1 1 13 4016 1 1 3 ARG NH1 N -9.737 -0.158 -3.759 1.00 . A A . 3 ARG NH1 1 1 13 4017 1 1 3 ARG NH2 N -11.422 -1.168 -2.446 1.00 . A A . 3 ARG NH2 1 1 13 4018 1 1 3 ARG O O -5.762 -2.035 -5.426 1.00 . A A . 3 ARG O 1 1 13 4019 1 1 4 LEU C C -3.418 -0.754 -4.440 1.00 . A A . 4 LEU C 1 1 13 4020 1 1 4 LEU CA C -4.314 -1.039 -3.342 1.00 . A A . 4 LEU CA 1 1 13 4021 1 1 4 LEU CB C -3.526 -0.802 -2.079 1.00 . A A . 4 LEU CB 1 1 13 4022 1 1 4 LEU CD1 C -2.504 -1.793 -0.090 1.00 . A A . 4 LEU CD1 1 1 13 4023 1 1 4 LEU CD2 C -5.006 -2.147 -0.569 1.00 . A A . 4 LEU CD2 1 1 13 4024 1 1 4 LEU CG C -3.598 -1.949 -1.131 1.00 . A A . 4 LEU CG 1 1 13 4025 1 1 4 LEU H H -4.251 -3.010 -2.862 1.00 . A A . 4 LEU H 1 1 13 4026 1 1 4 LEU HA H -5.140 -0.430 -3.395 1.00 . A A . 4 LEU HA 1 1 13 4027 1 1 4 LEU HB2 H -2.487 -0.601 -2.325 1.00 . A A . 4 LEU HB2 1 1 13 4028 1 1 4 LEU HB3 H -3.933 0.071 -1.560 1.00 . A A . 4 LEU HB3 1 1 13 4029 1 1 4 LEU HD11 H -1.974 -0.825 -0.260 1.00 . A A . 4 LEU HD11 1 1 13 4030 1 1 4 LEU HD12 H -1.760 -2.616 -0.211 1.00 . A A . 4 LEU HD12 1 1 13 4031 1 1 4 LEU HD13 H -2.918 -1.812 0.936 1.00 . A A . 4 LEU HD13 1 1 13 4032 1 1 4 LEU HD21 H -5.613 -2.752 -1.290 1.00 . A A . 4 LEU HD21 1 1 13 4033 1 1 4 LEU HD22 H -5.502 -1.163 -0.423 1.00 . A A . 4 LEU HD22 1 1 13 4034 1 1 4 LEU HD23 H -4.967 -2.680 0.401 1.00 . A A . 4 LEU HD23 1 1 13 4035 1 1 4 LEU HG H -3.338 -2.833 -1.724 1.00 . A A . 4 LEU HG 1 1 13 4036 1 1 4 LEU N N -4.636 -2.375 -3.516 1.00 . A A . 4 LEU N 1 1 13 4037 1 1 4 LEU O O -3.798 -0.019 -5.323 1.00 . A A . 4 LEU O 1 1 13 4038 1 1 5 SER C C -1.145 -1.011 -6.572 1.00 . A A . 5 SER C 1 1 13 4039 1 1 5 SER CA C -1.186 -1.703 -5.234 1.00 . A A . 5 SER CA 1 1 13 4040 1 1 5 SER CB C -0.744 -3.126 -5.309 1.00 . A A . 5 SER CB 1 1 13 4041 1 1 5 SER H H -2.474 -2.393 -3.809 1.00 . A A . 5 SER H 1 1 13 4042 1 1 5 SER HA H -0.473 -1.182 -4.605 1.00 . A A . 5 SER HA 1 1 13 4043 1 1 5 SER HB2 H 0.327 -3.166 -5.033 1.00 . A A . 5 SER HB2 1 1 13 4044 1 1 5 SER HB3 H -1.347 -3.680 -4.537 1.00 . A A . 5 SER HB3 1 1 13 4045 1 1 5 SER HG H -0.478 -3.157 -7.220 1.00 . A A . 5 SER HG 1 1 13 4046 1 1 5 SER N N -2.419 -1.654 -4.460 1.00 . A A . 5 SER N 1 1 13 4047 1 1 5 SER O O -0.133 -0.996 -7.258 1.00 . A A . 5 SER O 1 1 13 4048 1 1 5 SER OG O -0.951 -3.714 -6.591 1.00 . A A . 5 SER OG 1 1 13 4049 1 1 6 LYS C C -1.957 1.686 -7.220 1.00 . A A . 6 LYS C 1 1 13 4050 1 1 6 LYS CA C -2.260 0.438 -8.049 1.00 . A A . 6 LYS CA 1 1 13 4051 1 1 6 LYS CB C -3.612 0.623 -8.757 1.00 . A A . 6 LYS CB 1 1 13 4052 1 1 6 LYS CD C -3.250 -1.222 -10.482 1.00 . A A . 6 LYS CD 1 1 13 4053 1 1 6 LYS CE C -3.820 -2.488 -11.124 1.00 . A A . 6 LYS CE 1 1 13 4054 1 1 6 LYS CG C -4.150 -0.674 -9.370 1.00 . A A . 6 LYS CG 1 1 13 4055 1 1 6 LYS H H -3.132 -0.659 -6.548 1.00 . A A . 6 LYS H 1 1 13 4056 1 1 6 LYS HA H -1.446 0.225 -8.732 1.00 . A A . 6 LYS HA 1 1 13 4057 1 1 6 LYS HB2 H -4.350 1.017 -8.026 1.00 . A A . 6 LYS HB2 1 1 13 4058 1 1 6 LYS HB3 H -3.488 1.379 -9.562 1.00 . A A . 6 LYS HB3 1 1 13 4059 1 1 6 LYS HD2 H -3.125 -0.444 -11.264 1.00 . A A . 6 LYS HD2 1 1 13 4060 1 1 6 LYS HD3 H -2.248 -1.450 -10.059 1.00 . A A . 6 LYS HD3 1 1 13 4061 1 1 6 LYS HE2 H -3.933 -3.294 -10.367 1.00 . A A . 6 LYS HE2 1 1 13 4062 1 1 6 LYS HE3 H -4.807 -2.279 -11.590 1.00 . A A . 6 LYS HE3 1 1 13 4063 1 1 6 LYS HG2 H -4.247 -1.440 -8.571 1.00 . A A . 6 LYS HG2 1 1 13 4064 1 1 6 LYS HG3 H -5.165 -0.483 -9.785 1.00 . A A . 6 LYS HG3 1 1 13 4065 1 1 6 LYS HZ1 H -2.152 -2.288 -12.337 1.00 . A A . 6 LYS HZ1 1 1 13 4066 1 1 6 LYS HZ2 H -3.445 -3.115 -13.062 1.00 . A A . 6 LYS HZ2 1 1 13 4067 1 1 6 LYS HZ3 H -2.496 -3.888 -11.885 1.00 . A A . 6 LYS HZ3 1 1 13 4068 1 1 6 LYS N N -2.251 -0.484 -6.989 1.00 . A A . 6 LYS N 1 1 13 4069 1 1 6 LYS NZ N -2.911 -2.982 -12.181 1.00 . A A . 6 LYS NZ 1 1 13 4070 1 1 6 LYS O O -1.951 2.810 -7.707 1.00 . A A . 6 LYS O 1 1 13 4071 1 1 7 PHE C C -0.344 2.559 -4.248 1.00 . A A . 7 PHE C 1 1 13 4072 1 1 7 PHE CA C -1.619 2.310 -4.810 1.00 . A A . 7 PHE CA 1 1 13 4073 1 1 7 PHE CB C -2.225 1.681 -3.588 1.00 . A A . 7 PHE CB 1 1 13 4074 1 1 7 PHE CD1 C -3.852 2.211 -1.936 1.00 . A A . 7 PHE CD1 1 1 13 4075 1 1 7 PHE CD2 C -1.733 3.207 -1.901 1.00 . A A . 7 PHE CD2 1 1 13 4076 1 1 7 PHE CE1 C -4.096 2.747 -0.733 1.00 . A A . 7 PHE CE1 1 1 13 4077 1 1 7 PHE CE2 C -1.915 3.773 -0.770 1.00 . A A . 7 PHE CE2 1 1 13 4078 1 1 7 PHE CG C -2.691 2.448 -2.512 1.00 . A A . 7 PHE CG 1 1 13 4079 1 1 7 PHE CZ C -3.124 3.563 -0.110 1.00 . A A . 7 PHE CZ 1 1 13 4080 1 1 7 PHE H H -1.772 0.445 -5.485 1.00 . A A . 7 PHE H 1 1 13 4081 1 1 7 PHE HA H -2.140 3.206 -5.000 1.00 . A A . 7 PHE HA 1 1 13 4082 1 1 7 PHE HB2 H -3.159 1.279 -3.935 1.00 . A A . 7 PHE HB2 1 1 13 4083 1 1 7 PHE HB3 H -1.649 0.836 -3.183 1.00 . A A . 7 PHE HB3 1 1 13 4084 1 1 7 PHE HD1 H -4.587 1.572 -2.437 1.00 . A A . 7 PHE HD1 1 1 13 4085 1 1 7 PHE HD2 H -0.798 3.384 -2.368 1.00 . A A . 7 PHE HD2 1 1 13 4086 1 1 7 PHE HE1 H -5.011 2.499 -0.275 1.00 . A A . 7 PHE HE1 1 1 13 4087 1 1 7 PHE HE2 H -1.056 4.341 -0.390 1.00 . A A . 7 PHE HE2 1 1 13 4088 1 1 7 PHE HZ H -3.309 4.000 0.861 1.00 . A A . 7 PHE HZ 1 1 13 4089 1 1 7 PHE N N -1.846 1.415 -5.852 1.00 . A A . 7 PHE N 1 1 13 4090 1 1 7 PHE O O 0.117 3.660 -4.256 1.00 . A A . 7 PHE O 1 1 13 4091 1 1 8 PHE C C 2.242 1.521 -3.497 1.00 . A A . 8 PHE C 1 1 13 4092 1 1 8 PHE CA C 1.193 1.721 -2.673 1.00 . A A . 8 PHE CA 1 1 13 4093 1 1 8 PHE CB C 1.556 0.662 -1.688 1.00 . A A . 8 PHE CB 1 1 13 4094 1 1 8 PHE CD1 C 2.012 -1.451 -2.237 1.00 . A A . 8 PHE CD1 1 1 13 4095 1 1 8 PHE CD2 C -0.188 -0.815 -1.959 1.00 . A A . 8 PHE CD2 1 1 13 4096 1 1 8 PHE CE1 C 1.685 -2.625 -2.573 1.00 . A A . 8 PHE CE1 1 1 13 4097 1 1 8 PHE CE2 C -0.552 -2.020 -2.295 1.00 . A A . 8 PHE CE2 1 1 13 4098 1 1 8 PHE CG C 1.074 -0.558 -1.935 1.00 . A A . 8 PHE CG 1 1 13 4099 1 1 8 PHE CZ C 0.389 -2.939 -2.614 1.00 . A A . 8 PHE CZ 1 1 13 4100 1 1 8 PHE H H -0.192 0.607 -3.641 1.00 . A A . 8 PHE H 1 1 13 4101 1 1 8 PHE HA H 1.214 2.680 -2.332 1.00 . A A . 8 PHE HA 1 1 13 4102 1 1 8 PHE HB2 H 2.617 0.555 -1.555 1.00 . A A . 8 PHE HB2 1 1 13 4103 1 1 8 PHE HB3 H 1.071 0.926 -0.748 1.00 . A A . 8 PHE HB3 1 1 13 4104 1 1 8 PHE HD1 H 3.058 -1.174 -2.201 1.00 . A A . 8 PHE HD1 1 1 13 4105 1 1 8 PHE HD2 H -0.902 -0.059 -1.689 1.00 . A A . 8 PHE HD2 1 1 13 4106 1 1 8 PHE HE1 H 2.444 -3.293 -2.831 1.00 . A A . 8 PHE HE1 1 1 13 4107 1 1 8 PHE HE2 H -1.562 -2.234 -2.358 1.00 . A A . 8 PHE HE2 1 1 13 4108 1 1 8 PHE HZ H 0.112 -3.866 -2.887 1.00 . A A . 8 PHE HZ 1 1 13 4109 1 1 8 PHE N N 0.158 1.518 -3.569 1.00 . A A . 8 PHE N 1 1 13 4110 1 1 8 PHE O O 3.165 2.183 -3.468 1.00 . A A . 8 PHE O 1 1 13 4111 1 1 9 ARG C C 2.937 1.281 -6.181 1.00 . A A . 9 ARG C 1 1 13 4112 1 1 9 ARG CA C 2.898 0.180 -5.268 1.00 . A A . 9 ARG CA 1 1 13 4113 1 1 9 ARG CB C 2.411 -1.045 -5.965 1.00 . A A . 9 ARG CB 1 1 13 4114 1 1 9 ARG CD C 4.390 -2.623 -6.005 1.00 . A A . 9 ARG CD 1 1 13 4115 1 1 9 ARG CG C 3.010 -2.331 -5.422 1.00 . A A . 9 ARG CG 1 1 13 4116 1 1 9 ARG CZ C 3.911 -4.258 -7.819 1.00 . A A . 9 ARG CZ 1 1 13 4117 1 1 9 ARG H H 1.128 0.134 -4.348 1.00 . A A . 9 ARG H 1 1 13 4118 1 1 9 ARG HA H 3.803 0.064 -4.797 1.00 . A A . 9 ARG HA 1 1 13 4119 1 1 9 ARG HB2 H 1.302 -1.064 -5.781 1.00 . A A . 9 ARG HB2 1 1 13 4120 1 1 9 ARG HB3 H 2.596 -0.950 -7.050 1.00 . A A . 9 ARG HB3 1 1 13 4121 1 1 9 ARG HD2 H 5.035 -1.721 -5.935 1.00 . A A . 9 ARG HD2 1 1 13 4122 1 1 9 ARG HD3 H 4.873 -3.473 -5.480 1.00 . A A . 9 ARG HD3 1 1 13 4123 1 1 9 ARG HE H 4.378 -2.282 -8.149 1.00 . A A . 9 ARG HE 1 1 13 4124 1 1 9 ARG HG2 H 3.104 -2.241 -4.328 1.00 . A A . 9 ARG HG2 1 1 13 4125 1 1 9 ARG HG3 H 2.324 -3.175 -5.646 1.00 . A A . 9 ARG HG3 1 1 13 4126 1 1 9 ARG HH11 H 3.823 -4.997 -5.904 1.00 . A A . 9 ARG HH11 1 1 13 4127 1 1 9 ARG HH12 H 3.477 -6.156 -7.146 1.00 . A A . 9 ARG HH12 1 1 13 4128 1 1 9 ARG HH21 H 3.916 -3.859 -9.835 1.00 . A A . 9 ARG HH21 1 1 13 4129 1 1 9 ARG HH22 H 3.537 -5.496 -9.417 1.00 . A A . 9 ARG HH22 1 1 13 4130 1 1 9 ARG N N 2.007 0.563 -4.322 1.00 . A A . 9 ARG N 1 1 13 4131 1 1 9 ARG NE N 4.240 -2.982 -7.448 1.00 . A A . 9 ARG NE 1 1 13 4132 1 1 9 ARG NH1 N 3.721 -5.224 -6.873 1.00 . A A . 9 ARG NH1 1 1 13 4133 1 1 9 ARG NH2 N 3.776 -4.565 -9.142 1.00 . A A . 9 ARG NH2 1 1 13 4134 1 1 9 ARG O O 3.626 1.270 -7.201 1.00 . A A . 9 ARG O 1 1 13 4135 1 1 10 ASP C C 2.137 4.555 -5.896 1.00 . A A . 10 ASP C 1 1 13 4136 1 1 10 ASP CA C 1.905 3.297 -6.631 1.00 . A A . 10 ASP CA 1 1 13 4137 1 1 10 ASP CB C 0.664 3.280 -7.299 1.00 . A A . 10 ASP CB 1 1 13 4138 1 1 10 ASP CG C 0.640 4.051 -8.616 1.00 . A A . 10 ASP CG 1 1 13 4139 1 1 10 ASP H H 1.456 2.136 -5.028 1.00 . A A . 10 ASP H 1 1 13 4140 1 1 10 ASP HA H 2.670 3.189 -7.285 1.00 . A A . 10 ASP HA 1 1 13 4141 1 1 10 ASP HB2 H 0.492 2.202 -7.465 1.00 . A A . 10 ASP HB2 1 1 13 4142 1 1 10 ASP HB3 H -0.070 3.677 -6.596 1.00 . A A . 10 ASP HB3 1 1 13 4143 1 1 10 ASP N N 2.012 2.186 -5.891 1.00 . A A . 10 ASP N 1 1 13 4144 1 1 10 ASP O O 2.129 5.619 -6.520 1.00 . A A . 10 ASP O 1 1 13 4145 1 1 10 ASP OD1 O 1.485 3.739 -9.497 1.00 . A A . 10 ASP OD1 1 1 13 4146 1 1 10 ASP OD2 O -0.219 4.962 -8.755 1.00 . A A . 10 ASP OD2 1 1 13 4147 1 1 11 . C C 2.349 6.043 -2.516 1.00 . A A . 11 DPN C 1 1 13 4148 1 1 11 . CA C 2.597 5.837 -3.979 1.00 . A A . 11 DPN CA 1 1 13 4149 1 1 11 . CB C 4.059 6.150 -4.212 1.00 . A A . 11 DPN CB 1 1 13 4150 1 1 11 . CD1 C 4.712 4.766 -6.100 1.00 . A A . 11 DPN CD1 1 1 13 4151 1 1 11 . CD2 C 4.903 4.151 -3.864 1.00 . A A . 11 DPN CD2 1 1 13 4152 1 1 11 . CE1 C 4.923 3.496 -6.421 1.00 . A A . 11 DPN CE1 1 1 13 4153 1 1 11 . CE2 C 5.183 2.977 -4.171 1.00 . A A . 11 DPN CE2 1 1 13 4154 1 1 11 . CG C 4.683 5.051 -4.773 1.00 . A A . 11 DPN CG 1 1 13 4155 1 1 11 . CZ C 5.156 2.629 -5.401 1.00 . A A . 11 DPN CZ 1 1 13 4156 1 1 11 . H H 2.303 3.671 -3.991 1.00 . A A . 11 DPN H 1 1 13 4157 1 1 11 . HA H 2.021 6.525 -4.478 1.00 . A A . 11 DPN HA 1 1 13 4158 1 1 11 . HB2 H 4.527 6.258 -3.242 1.00 . A A . 11 DPN HB2 1 1 13 4159 1 1 11 . HB3 H 4.188 6.970 -4.863 1.00 . A A . 11 DPN HB3 1 1 13 4160 1 1 11 . HD1 H 4.529 5.521 -6.850 1.00 . A A . 11 DPN HD1 1 1 13 4161 1 1 11 . HD2 H 4.933 4.439 -2.871 1.00 . A A . 11 DPN HD2 1 1 13 4162 1 1 11 . HE1 H 4.921 3.165 -7.444 1.00 . A A . 11 DPN HE1 1 1 13 4163 1 1 11 . HE2 H 5.308 2.256 -3.417 1.00 . A A . 11 DPN HE2 1 1 13 4164 1 1 11 . HZ H 5.214 1.687 -5.557 1.00 . A A . 11 DPN HZ 1 1 13 4165 1 1 11 . N N 2.300 4.536 -4.557 1.00 . A A . 11 DPN N 1 1 13 4166 1 1 11 . O O 1.380 6.684 -2.116 1.00 . A A . 11 DPN O 1 1 13 4167 1 1 12 ILE C C 4.577 5.039 0.192 1.00 . A A . 12 ILE C 1 1 13 4168 1 1 12 ILE CA C 3.303 5.716 -0.287 1.00 . A A . 12 ILE CA 1 1 13 4169 1 1 12 ILE CB C 2.128 5.152 0.442 1.00 . A A . 12 ILE CB 1 1 13 4170 1 1 12 ILE CD1 C 2.549 3.109 -0.661 1.00 . A A . 12 ILE CD1 1 1 13 4171 1 1 12 ILE CG1 C 1.517 4.095 -0.421 1.00 . A A . 12 ILE CG1 1 1 13 4172 1 1 12 ILE CG2 C 1.151 6.282 0.809 1.00 . A A . 12 ILE CG2 1 1 13 4173 1 1 12 ILE H H 3.896 4.838 -2.042 1.00 . A A . 12 ILE H 1 1 13 4174 1 1 12 ILE HA H 3.386 6.738 -0.118 1.00 . A A . 12 ILE HA 1 1 13 4175 1 1 12 ILE HB H 2.487 4.662 1.357 1.00 . A A . 12 ILE HB 1 1 13 4176 1 1 12 ILE HD11 H 3.414 3.344 -0.076 1.00 . A A . 12 ILE HD11 1 1 13 4177 1 1 12 ILE HD12 H 2.848 3.127 -1.747 1.00 . A A . 12 ILE HD12 1 1 13 4178 1 1 12 ILE HD13 H 2.207 2.131 -0.365 1.00 . A A . 12 ILE HD13 1 1 13 4179 1 1 12 ILE HG12 H 0.652 3.620 0.073 1.00 . A A . 12 ILE HG12 1 1 13 4180 1 1 12 ILE HG13 H 1.211 4.508 -1.406 1.00 . A A . 12 ILE HG13 1 1 13 4181 1 1 12 ILE HG21 H 0.103 5.954 0.641 1.00 . A A . 12 ILE HG21 1 1 13 4182 1 1 12 ILE HG22 H 1.344 7.179 0.182 1.00 . A A . 12 ILE HG22 1 1 13 4183 1 1 12 ILE HG23 H 1.267 6.563 1.877 1.00 . A A . 12 ILE HG23 1 1 13 4184 1 1 12 ILE N N 3.268 5.505 -1.704 1.00 . A A . 12 ILE N 1 1 13 4185 1 1 12 ILE O O 4.867 4.994 1.375 1.00 . A A . 12 ILE O 1 1 13 4186 1 1 13 LEU C C 7.647 4.298 -1.138 1.00 . A A . 13 LEU C 1 1 13 4187 1 1 13 LEU CA C 6.499 3.624 -0.514 1.00 . A A . 13 LEU CA 1 1 13 4188 1 1 13 LEU CB C 6.449 2.286 -1.223 1.00 . A A . 13 LEU CB 1 1 13 4189 1 1 13 LEU CD1 C 5.034 0.410 -1.946 1.00 . A A . 13 LEU CD1 1 1 13 4190 1 1 13 LEU CD2 C 4.729 1.568 0.353 1.00 . A A . 13 LEU CD2 1 1 13 4191 1 1 13 LEU CG C 5.109 1.691 -1.120 1.00 . A A . 13 LEU CG 1 1 13 4192 1 1 13 LEU H H 4.934 4.296 -1.711 1.00 . A A . 13 LEU H 1 1 13 4193 1 1 13 LEU HA H 6.635 3.506 0.538 1.00 . A A . 13 LEU HA 1 1 13 4194 1 1 13 LEU HB2 H 6.661 2.433 -2.298 1.00 . A A . 13 LEU HB2 1 1 13 4195 1 1 13 LEU HB3 H 7.187 1.590 -0.796 1.00 . A A . 13 LEU HB3 1 1 13 4196 1 1 13 LEU HD11 H 6.053 0.106 -2.256 1.00 . A A . 13 LEU HD11 1 1 13 4197 1 1 13 LEU HD12 H 4.437 0.604 -2.878 1.00 . A A . 13 LEU HD12 1 1 13 4198 1 1 13 LEU HD13 H 4.562 -0.407 -1.371 1.00 . A A . 13 LEU HD13 1 1 13 4199 1 1 13 LEU HD21 H 4.780 2.598 0.824 1.00 . A A . 13 LEU HD21 1 1 13 4200 1 1 13 LEU HD22 H 5.432 0.898 0.882 1.00 . A A . 13 LEU HD22 1 1 13 4201 1 1 13 LEU HD23 H 3.698 1.183 0.459 1.00 . A A . 13 LEU HD23 1 1 13 4202 1 1 13 LEU HG H 4.421 2.417 -1.596 1.00 . A A . 13 LEU HG 1 1 13 4203 1 1 13 LEU N N 5.284 4.375 -0.775 1.00 . A A . 13 LEU N 1 1 13 4204 1 1 13 LEU O O 8.686 4.497 -0.532 1.00 . A A . 13 LEU O 1 1 13 4205 1 1 14 GLN C C 8.706 6.585 -2.512 1.00 . A A . 14 GLN C 1 1 13 4206 1 1 14 GLN CA C 8.570 5.273 -3.137 1.00 . A A . 14 GLN CA 1 1 13 4207 1 1 14 GLN CB C 8.301 5.539 -4.615 1.00 . A A . 14 GLN CB 1 1 13 4208 1 1 14 GLN CD C 8.788 3.159 -4.944 1.00 . A A . 14 GLN CD 1 1 13 4209 1 1 14 GLN CG C 7.887 4.298 -5.333 1.00 . A A . 14 GLN CG 1 1 13 4210 1 1 14 GLN H H 6.637 4.399 -2.938 1.00 . A A . 14 GLN H 1 1 13 4211 1 1 14 GLN HA H 9.467 4.701 -2.995 1.00 . A A . 14 GLN HA 1 1 13 4212 1 1 14 GLN HB2 H 7.476 6.279 -4.699 1.00 . A A . 14 GLN HB2 1 1 13 4213 1 1 14 GLN HB3 H 9.203 5.958 -5.094 1.00 . A A . 14 GLN HB3 1 1 13 4214 1 1 14 GLN HE21 H 7.262 2.464 -3.801 1.00 . A A . 14 GLN HE21 1 1 13 4215 1 1 14 GLN HE22 H 8.713 1.500 -3.768 1.00 . A A . 14 GLN HE22 1 1 13 4216 1 1 14 GLN HG2 H 6.868 4.064 -5.014 1.00 . A A . 14 GLN HG2 1 1 13 4217 1 1 14 GLN HG3 H 7.913 4.448 -6.425 1.00 . A A . 14 GLN HG3 1 1 13 4218 1 1 14 GLN N N 7.488 4.620 -2.428 1.00 . A A . 14 GLN N 1 1 13 4219 1 1 14 GLN NE2 N 8.212 2.289 -4.100 1.00 . A A . 14 GLN NE2 1 1 13 4220 1 1 14 GLN O O 9.733 7.255 -2.608 1.00 . A A . 14 GLN O 1 1 13 4221 1 1 14 GLN OE1 O 9.952 3.078 -5.321 1.00 . A A . 14 GLN OE1 1 1 13 4222 1 1 15 ARG C C 7.772 7.948 0.251 1.00 . A A . 15 ARG C 1 1 13 4223 1 1 15 ARG CA C 7.618 8.232 -1.209 1.00 . A A . 15 ARG CA 1 1 13 4224 1 1 15 ARG CB C 6.306 9.003 -1.360 1.00 . A A . 15 ARG CB 1 1 13 4225 1 1 15 ARG CD C 4.037 8.601 -2.312 1.00 . A A . 15 ARG CD 1 1 13 4226 1 1 15 ARG CG C 5.529 8.618 -2.603 1.00 . A A . 15 ARG CG 1 1 13 4227 1 1 15 ARG CZ C 3.246 10.891 -2.890 1.00 . A A . 15 ARG CZ 1 1 13 4228 1 1 15 ARG H H 6.799 6.377 -1.770 1.00 . A A . 15 ARG H 1 1 13 4229 1 1 15 ARG HA H 8.449 8.781 -1.596 1.00 . A A . 15 ARG HA 1 1 13 4230 1 1 15 ARG HB2 H 5.668 8.822 -0.469 1.00 . A A . 15 ARG HB2 1 1 13 4231 1 1 15 ARG HB3 H 6.530 10.090 -1.402 1.00 . A A . 15 ARG HB3 1 1 13 4232 1 1 15 ARG HD2 H 3.462 8.273 -3.201 1.00 . A A . 15 ARG HD2 1 1 13 4233 1 1 15 ARG HD3 H 3.828 7.910 -1.456 1.00 . A A . 15 ARG HD3 1 1 13 4234 1 1 15 ARG HE H 3.573 10.240 -0.963 1.00 . A A . 15 ARG HE 1 1 13 4235 1 1 15 ARG HG2 H 5.747 9.333 -3.421 1.00 . A A . 15 ARG HG2 1 1 13 4236 1 1 15 ARG HG3 H 5.840 7.601 -2.932 1.00 . A A . 15 ARG HG3 1 1 13 4237 1 1 15 ARG HH11 H 3.556 9.631 -4.482 1.00 . A A . 15 ARG HH11 1 1 13 4238 1 1 15 ARG HH12 H 3.015 11.220 -4.907 1.00 . A A . 15 ARG HH12 1 1 13 4239 1 1 15 ARG HH21 H 2.839 12.393 -1.549 1.00 . A A . 15 ARG HH21 1 1 13 4240 1 1 15 ARG HH22 H 2.602 12.816 -3.213 1.00 . A A . 15 ARG HH22 1 1 13 4241 1 1 15 ARG N N 7.624 6.971 -1.848 1.00 . A A . 15 ARG N 1 1 13 4242 1 1 15 ARG NE N 3.599 9.979 -1.932 1.00 . A A . 15 ARG NE 1 1 13 4243 1 1 15 ARG NH1 N 3.274 10.550 -4.212 1.00 . A A . 15 ARG NH1 1 1 13 4244 1 1 15 ARG NH2 N 2.861 12.145 -2.518 1.00 . A A . 15 ARG NH2 1 1 13 4245 1 1 15 ARG O O 8.291 8.759 1.013 1.00 . A A . 15 ARG O 1 1 13 4246 1 1 16 LYS C C 6.203 6.956 2.776 1.00 . A A . 16 LYS C 1 1 13 4247 1 1 16 LYS CA C 7.268 6.263 1.983 1.00 . A A . 16 LYS CA 1 1 13 4248 1 1 16 LYS CB C 8.589 6.444 2.716 1.00 . A A . 16 LYS CB 1 1 13 4249 1 1 16 LYS CD C 9.539 4.141 2.226 1.00 . A A . 16 LYS CD 1 1 13 4250 1 1 16 LYS CE C 10.740 3.334 1.730 1.00 . A A . 16 LYS CE 1 1 13 4251 1 1 16 LYS CG C 9.747 5.654 2.105 1.00 . A A . 16 LYS CG 1 1 13 4252 1 1 16 LYS H H 6.863 6.129 -0.023 1.00 . A A . 16 LYS H 1 1 13 4253 1 1 16 LYS HA H 7.009 5.216 1.911 1.00 . A A . 16 LYS HA 1 1 13 4254 1 1 16 LYS HB2 H 8.831 7.519 2.696 1.00 . A A . 16 LYS HB2 1 1 13 4255 1 1 16 LYS HB3 H 8.456 6.139 3.770 1.00 . A A . 16 LYS HB3 1 1 13 4256 1 1 16 LYS HD2 H 9.342 3.885 3.287 1.00 . A A . 16 LYS HD2 1 1 13 4257 1 1 16 LYS HD3 H 8.639 3.856 1.634 1.00 . A A . 16 LYS HD3 1 1 13 4258 1 1 16 LYS HE2 H 10.519 2.246 1.762 1.00 . A A . 16 LYS HE2 1 1 13 4259 1 1 16 LYS HE3 H 11.003 3.625 0.689 1.00 . A A . 16 LYS HE3 1 1 13 4260 1 1 16 LYS HG2 H 9.847 5.924 1.032 1.00 . A A . 16 LYS HG2 1 1 13 4261 1 1 16 LYS HG3 H 10.689 5.935 2.621 1.00 . A A . 16 LYS HG3 1 1 13 4262 1 1 16 LYS HZ1 H 11.635 4.144 3.413 1.00 . A A . 16 LYS HZ1 1 1 13 4263 1 1 16 LYS HZ2 H 12.638 4.105 2.043 1.00 . A A . 16 LYS HZ2 1 1 13 4264 1 1 16 LYS HZ3 H 12.317 2.676 2.903 1.00 . A A . 16 LYS HZ3 1 1 13 4265 1 1 16 LYS N N 7.259 6.751 0.634 1.00 . A A . 16 LYS N 1 1 13 4266 1 1 16 LYS NZ N 11.921 3.583 2.586 1.00 . A A . 16 LYS NZ 1 1 13 4267 1 1 16 LYS O O 6.159 6.851 4.002 1.00 . A A . 16 LYS O 1 1 13 4268 1 1 17 LYS C C 3.295 8.955 1.743 1.00 . A A . 17 LYS C 1 1 13 4269 1 1 17 LYS CA C 4.235 8.333 2.774 1.00 . A A . 17 LYS CA 1 1 13 4270 1 1 17 LYS CB C 4.695 9.455 3.728 1.00 . A A . 17 LYS CB 1 1 13 4271 1 1 17 LYS CD C 5.455 11.517 2.421 1.00 . A A . 17 LYS CD 1 1 13 4272 1 1 17 LYS CE C 6.447 11.890 1.318 1.00 . A A . 17 LYS CE 1 1 13 4273 1 1 17 LYS CG C 5.884 10.263 3.193 1.00 . A A . 17 LYS CG 1 1 13 4274 1 1 17 LYS H H 5.365 7.769 1.104 1.00 . A A . 17 LYS H 1 1 13 4275 1 1 17 LYS HA H 3.697 7.575 3.310 1.00 . A A . 17 LYS HA 1 1 13 4276 1 1 17 LYS HB2 H 3.845 10.142 3.915 1.00 . A A . 17 LYS HB2 1 1 13 4277 1 1 17 LYS HB3 H 4.985 8.997 4.693 1.00 . A A . 17 LYS HB3 1 1 13 4278 1 1 17 LYS HD2 H 4.458 11.341 1.961 1.00 . A A . 17 LYS HD2 1 1 13 4279 1 1 17 LYS HD3 H 5.360 12.367 3.129 1.00 . A A . 17 LYS HD3 1 1 13 4280 1 1 17 LYS HE2 H 6.587 11.038 0.619 1.00 . A A . 17 LYS HE2 1 1 13 4281 1 1 17 LYS HE3 H 6.086 12.777 0.753 1.00 . A A . 17 LYS HE3 1 1 13 4282 1 1 17 LYS HG2 H 6.524 10.569 4.048 1.00 . A A . 17 LYS HG2 1 1 13 4283 1 1 17 LYS HG3 H 6.494 9.619 2.528 1.00 . A A . 17 LYS HG3 1 1 13 4284 1 1 17 LYS HZ1 H 8.398 11.400 1.811 1.00 . A A . 17 LYS HZ1 1 1 13 4285 1 1 17 LYS HZ2 H 7.649 12.463 2.905 1.00 . A A . 17 LYS HZ2 1 1 13 4286 1 1 17 LYS HZ3 H 8.175 13.031 1.393 1.00 . A A . 17 LYS HZ3 1 1 13 4287 1 1 17 LYS N N 5.309 7.667 2.086 1.00 . A A . 17 LYS N 1 1 13 4288 1 1 17 LYS NZ N 7.765 12.222 1.900 1.00 . A A . 17 LYS NZ 1 1 13 4289 1 1 17 LYS O O 3.792 9.403 0.686 1.00 . A A . 17 LYS O 1 1 13 4290 1 1 17 LYS OXT O 2.065 8.999 2.015 1.00 . A A . 17 LYS OXT 1 1 14 4291 1 1 1 GLU C C -2.450 -8.846 -3.944 1.00 . A A . 1 GLU C 1 1 14 4292 1 1 1 GLU CA C -1.728 -9.915 -4.715 1.00 . A A . 1 GLU CA 1 1 14 4293 1 1 1 GLU CB C -2.446 -11.261 -4.486 1.00 . A A . 1 GLU CB 1 1 14 4294 1 1 1 GLU CD C -1.811 -12.165 -6.727 1.00 . A A . 1 GLU CD 1 1 14 4295 1 1 1 GLU CG C -1.781 -12.436 -5.228 1.00 . A A . 1 GLU CG 1 1 14 4296 1 1 1 GLU H1 H 0.312 -10.082 -5.102 1.00 . A A . 1 GLU H1 1 1 14 4297 1 1 1 GLU H2 H -0.189 -10.851 -3.673 1.00 . A A . 1 GLU H2 1 1 14 4298 1 1 1 GLU H3 H -0.059 -9.159 -3.725 1.00 . A A . 1 GLU H3 1 1 14 4299 1 1 1 GLU HA H -1.725 -9.659 -5.762 1.00 . A A . 1 GLU HA 1 1 14 4300 1 1 1 GLU HB2 H -2.457 -11.483 -3.395 1.00 . A A . 1 GLU HB2 1 1 14 4301 1 1 1 GLU HB3 H -3.501 -11.172 -4.826 1.00 . A A . 1 GLU HB3 1 1 14 4302 1 1 1 GLU HG2 H -0.727 -12.550 -4.894 1.00 . A A . 1 GLU HG2 1 1 14 4303 1 1 1 GLU HG3 H -2.329 -13.378 -5.020 1.00 . A A . 1 GLU HG3 1 1 14 4304 1 1 1 GLU N N -0.310 -10.008 -4.270 1.00 . A A . 1 GLU N 1 1 14 4305 1 1 1 GLU O O -3.341 -9.132 -3.143 1.00 . A A . 1 GLU O 1 1 14 4306 1 1 1 GLU OE1 O -2.827 -11.595 -7.208 1.00 . A A . 1 GLU OE1 1 1 14 4307 1 1 1 GLU OE2 O -0.817 -12.525 -7.411 1.00 . A A . 1 GLU OE2 1 1 14 4308 1 1 2 MET C C -3.705 -5.871 -4.402 1.00 . A A . 2 MET C 1 1 14 4309 1 1 2 MET CA C -2.708 -6.478 -3.492 1.00 . A A . 2 MET CA 1 1 14 4310 1 1 2 MET CB C -1.736 -5.386 -3.007 1.00 . A A . 2 MET CB 1 1 14 4311 1 1 2 MET CE C -3.820 -5.352 -0.813 1.00 . A A . 2 MET CE 1 1 14 4312 1 1 2 MET CG C -1.253 -5.565 -1.559 1.00 . A A . 2 MET CG 1 1 14 4313 1 1 2 MET H H -1.360 -7.335 -4.835 1.00 . A A . 2 MET H 1 1 14 4314 1 1 2 MET HA H -3.264 -6.868 -2.663 1.00 . A A . 2 MET HA 1 1 14 4315 1 1 2 MET HB2 H -0.851 -5.386 -3.676 1.00 . A A . 2 MET HB2 1 1 14 4316 1 1 2 MET HB3 H -2.226 -4.387 -3.091 1.00 . A A . 2 MET HB3 1 1 14 4317 1 1 2 MET HE1 H -4.112 -4.776 0.087 1.00 . A A . 2 MET HE1 1 1 14 4318 1 1 2 MET HE2 H -4.701 -5.936 -1.153 1.00 . A A . 2 MET HE2 1 1 14 4319 1 1 2 MET HE3 H -3.563 -4.633 -1.617 1.00 . A A . 2 MET HE3 1 1 14 4320 1 1 2 MET HG2 H -0.282 -6.101 -1.575 1.00 . A A . 2 MET HG2 1 1 14 4321 1 1 2 MET HG3 H -1.066 -4.548 -1.149 1.00 . A A . 2 MET HG3 1 1 14 4322 1 1 2 MET N N -2.073 -7.571 -4.182 1.00 . A A . 2 MET N 1 1 14 4323 1 1 2 MET O O -3.837 -6.233 -5.569 1.00 . A A . 2 MET O 1 1 14 4324 1 1 2 MET SD S -2.415 -6.442 -0.461 1.00 . A A . 2 MET SD 1 1 14 4325 1 1 3 ARG C C -5.247 -2.849 -4.528 1.00 . A A . 3 ARG C 1 1 14 4326 1 1 3 ARG CA C -5.486 -4.267 -4.534 1.00 . A A . 3 ARG CA 1 1 14 4327 1 1 3 ARG CB C -6.768 -4.444 -3.770 1.00 . A A . 3 ARG CB 1 1 14 4328 1 1 3 ARG CD C -6.727 -6.891 -3.247 1.00 . A A . 3 ARG CD 1 1 14 4329 1 1 3 ARG CG C -7.445 -5.782 -4.011 1.00 . A A . 3 ARG CG 1 1 14 4330 1 1 3 ARG CZ C -7.399 -8.929 -2.000 1.00 . A A . 3 ARG CZ 1 1 14 4331 1 1 3 ARG H H -4.246 -4.553 -2.928 1.00 . A A . 3 ARG H 1 1 14 4332 1 1 3 ARG HA H -5.530 -4.618 -5.499 1.00 . A A . 3 ARG HA 1 1 14 4333 1 1 3 ARG HB2 H -6.491 -4.368 -2.692 1.00 . A A . 3 ARG HB2 1 1 14 4334 1 1 3 ARG HB3 H -7.459 -3.612 -4.010 1.00 . A A . 3 ARG HB3 1 1 14 4335 1 1 3 ARG HD2 H -6.148 -7.537 -3.942 1.00 . A A . 3 ARG HD2 1 1 14 4336 1 1 3 ARG HD3 H -6.045 -6.452 -2.480 1.00 . A A . 3 ARG HD3 1 1 14 4337 1 1 3 ARG HE H -8.687 -7.400 -2.483 1.00 . A A . 3 ARG HE 1 1 14 4338 1 1 3 ARG HG2 H -8.505 -5.723 -3.681 1.00 . A A . 3 ARG HG2 1 1 14 4339 1 1 3 ARG HG3 H -7.430 -6.014 -5.097 1.00 . A A . 3 ARG HG3 1 1 14 4340 1 1 3 ARG HH11 H -5.422 -8.832 -2.560 1.00 . A A . 3 ARG HH11 1 1 14 4341 1 1 3 ARG HH12 H -5.863 -10.261 -1.684 1.00 . A A . 3 ARG HH12 1 1 14 4342 1 1 3 ARG HH21 H -9.283 -9.345 -1.293 1.00 . A A . 3 ARG HH21 1 1 14 4343 1 1 3 ARG HH22 H -8.094 -10.555 -0.953 1.00 . A A . 3 ARG HH22 1 1 14 4344 1 1 3 ARG N N -4.427 -4.895 -3.843 1.00 . A A . 3 ARG N 1 1 14 4345 1 1 3 ARG NE N -7.746 -7.727 -2.551 1.00 . A A . 3 ARG NE 1 1 14 4346 1 1 3 ARG NH1 N -6.115 -9.381 -2.088 1.00 . A A . 3 ARG NH1 1 1 14 4347 1 1 3 ARG NH2 N -8.342 -9.676 -1.358 1.00 . A A . 3 ARG NH2 1 1 14 4348 1 1 3 ARG O O -5.737 -2.092 -5.361 1.00 . A A . 3 ARG O 1 1 14 4349 1 1 4 LEU C C -3.318 -0.804 -4.450 1.00 . A A . 4 LEU C 1 1 14 4350 1 1 4 LEU CA C -4.197 -1.126 -3.350 1.00 . A A . 4 LEU CA 1 1 14 4351 1 1 4 LEU CB C -3.408 -0.886 -2.089 1.00 . A A . 4 LEU CB 1 1 14 4352 1 1 4 LEU CD1 C -2.356 -1.880 -0.119 1.00 . A A . 4 LEU CD1 1 1 14 4353 1 1 4 LEU CD2 C -4.852 -2.291 -0.601 1.00 . A A . 4 LEU CD2 1 1 14 4354 1 1 4 LEU CG C -3.449 -2.048 -1.160 1.00 . A A . 4 LEU CG 1 1 14 4355 1 1 4 LEU H H -4.059 -3.117 -2.916 1.00 . A A . 4 LEU H 1 1 14 4356 1 1 4 LEU HA H -5.039 -0.537 -3.390 1.00 . A A . 4 LEU HA 1 1 14 4357 1 1 4 LEU HB2 H -2.376 -0.655 -2.338 1.00 . A A . 4 LEU HB2 1 1 14 4358 1 1 4 LEU HB3 H -3.835 -0.030 -1.556 1.00 . A A . 4 LEU HB3 1 1 14 4359 1 1 4 LEU HD11 H -1.847 -0.898 -0.282 1.00 . A A . 4 LEU HD11 1 1 14 4360 1 1 4 LEU HD12 H -1.596 -2.685 -0.252 1.00 . A A . 4 LEU HD12 1 1 14 4361 1 1 4 LEU HD13 H -2.767 -1.918 0.907 1.00 . A A . 4 LEU HD13 1 1 14 4362 1 1 4 LEU HD21 H -5.418 -2.964 -1.298 1.00 . A A . 4 LEU HD21 1 1 14 4363 1 1 4 LEU HD22 H -5.400 -1.329 -0.514 1.00 . A A . 4 LEU HD22 1 1 14 4364 1 1 4 LEU HD23 H -4.798 -2.770 0.396 1.00 . A A . 4 LEU HD23 1 1 14 4365 1 1 4 LEU HG H -3.167 -2.915 -1.766 1.00 . A A . 4 LEU HG 1 1 14 4366 1 1 4 LEU N N -4.485 -2.469 -3.543 1.00 . A A . 4 LEU N 1 1 14 4367 1 1 4 LEU O O -3.723 -0.067 -5.321 1.00 . A A . 4 LEU O 1 1 14 4368 1 1 5 SER C C -1.061 -0.987 -6.604 1.00 . A A . 5 SER C 1 1 14 4369 1 1 5 SER CA C -1.075 -1.698 -5.276 1.00 . A A . 5 SER CA 1 1 14 4370 1 1 5 SER CB C -0.614 -3.115 -5.374 1.00 . A A . 5 SER CB 1 1 14 4371 1 1 5 SER H H -2.336 -2.426 -3.848 1.00 . A A . 5 SER H 1 1 14 4372 1 1 5 SER HA H -0.365 -1.174 -4.645 1.00 . A A . 5 SER HA 1 1 14 4373 1 1 5 SER HB2 H 0.458 -3.143 -5.103 1.00 . A A . 5 SER HB2 1 1 14 4374 1 1 5 SER HB3 H -1.207 -3.689 -4.606 1.00 . A A . 5 SER HB3 1 1 14 4375 1 1 5 SER HG H -0.364 -3.107 -7.287 1.00 . A A . 5 SER HG 1 1 14 4376 1 1 5 SER N N -2.302 -1.681 -4.491 1.00 . A A . 5 SER N 1 1 14 4377 1 1 5 SER O O -0.054 -0.940 -7.298 1.00 . A A . 5 SER O 1 1 14 4378 1 1 5 SER OG O -0.817 -3.686 -6.664 1.00 . A A . 5 SER OG 1 1 14 4379 1 1 6 LYS C C -1.930 1.702 -7.211 1.00 . A A . 6 LYS C 1 1 14 4380 1 1 6 LYS CA C -2.219 0.458 -8.052 1.00 . A A . 6 LYS CA 1 1 14 4381 1 1 6 LYS CB C -3.585 0.617 -8.726 1.00 . A A . 6 LYS CB 1 1 14 4382 1 1 6 LYS CD C -5.502 -0.591 -9.879 1.00 . A A . 6 LYS CD 1 1 14 4383 1 1 6 LYS CE C -5.740 0.445 -10.980 1.00 . A A . 6 LYS CE 1 1 14 4384 1 1 6 LYS CG C -4.041 -0.660 -9.436 1.00 . A A . 6 LYS CG 1 1 14 4385 1 1 6 LYS H H -3.057 -0.683 -6.568 1.00 . A A . 6 LYS H 1 1 14 4386 1 1 6 LYS HA H -1.415 0.269 -8.753 1.00 . A A . 6 LYS HA 1 1 14 4387 1 1 6 LYS HB2 H -4.336 0.900 -7.958 1.00 . A A . 6 LYS HB2 1 1 14 4388 1 1 6 LYS HB3 H -3.521 1.441 -9.467 1.00 . A A . 6 LYS HB3 1 1 14 4389 1 1 6 LYS HD2 H -5.815 -1.591 -10.247 1.00 . A A . 6 LYS HD2 1 1 14 4390 1 1 6 LYS HD3 H -6.130 -0.337 -8.998 1.00 . A A . 6 LYS HD3 1 1 14 4391 1 1 6 LYS HE2 H -5.518 1.468 -10.610 1.00 . A A . 6 LYS HE2 1 1 14 4392 1 1 6 LYS HE3 H -5.103 0.226 -11.866 1.00 . A A . 6 LYS HE3 1 1 14 4393 1 1 6 LYS HG2 H -3.399 -0.829 -10.327 1.00 . A A . 6 LYS HG2 1 1 14 4394 1 1 6 LYS HG3 H -3.909 -1.524 -8.750 1.00 . A A . 6 LYS HG3 1 1 14 4395 1 1 6 LYS HZ1 H -7.482 1.387 -11.590 1.00 . A A . 6 LYS HZ1 1 1 14 4396 1 1 6 LYS HZ2 H -7.736 -0.018 -10.671 1.00 . A A . 6 LYS HZ2 1 1 14 4397 1 1 6 LYS HZ3 H -7.236 -0.141 -12.289 1.00 . A A . 6 LYS HZ3 1 1 14 4398 1 1 6 LYS N N -2.180 -0.478 -7.007 1.00 . A A . 6 LYS N 1 1 14 4399 1 1 6 LYS NZ N -7.153 0.416 -11.415 1.00 . A A . 6 LYS NZ 1 1 14 4400 1 1 6 LYS O O -1.951 2.833 -7.682 1.00 . A A . 6 LYS O 1 1 14 4401 1 1 7 PHE C C -0.304 2.562 -4.241 1.00 . A A . 7 PHE C 1 1 14 4402 1 1 7 PHE CA C -1.580 2.298 -4.796 1.00 . A A . 7 PHE CA 1 1 14 4403 1 1 7 PHE CB C -2.163 1.639 -3.579 1.00 . A A . 7 PHE CB 1 1 14 4404 1 1 7 PHE CD1 C -3.789 2.118 -1.911 1.00 . A A . 7 PHE CD1 1 1 14 4405 1 1 7 PHE CD2 C -1.687 3.148 -1.873 1.00 . A A . 7 PHE CD2 1 1 14 4406 1 1 7 PHE CE1 C -4.035 2.633 -0.699 1.00 . A A . 7 PHE CE1 1 1 14 4407 1 1 7 PHE CE2 C -1.872 3.695 -0.733 1.00 . A A . 7 PHE CE2 1 1 14 4408 1 1 7 PHE CG C -2.634 2.382 -2.489 1.00 . A A . 7 PHE CG 1 1 14 4409 1 1 7 PHE CZ C -3.073 3.456 -0.069 1.00 . A A . 7 PHE CZ 1 1 14 4410 1 1 7 PHE H H -1.702 0.440 -5.495 1.00 . A A . 7 PHE H 1 1 14 4411 1 1 7 PHE HA H -2.120 3.186 -4.967 1.00 . A A . 7 PHE HA 1 1 14 4412 1 1 7 PHE HB2 H -3.092 1.224 -3.924 1.00 . A A . 7 PHE HB2 1 1 14 4413 1 1 7 PHE HB3 H -1.569 0.800 -3.190 1.00 . A A . 7 PHE HB3 1 1 14 4414 1 1 7 PHE HD1 H -4.515 1.474 -2.419 1.00 . A A . 7 PHE HD1 1 1 14 4415 1 1 7 PHE HD2 H -0.757 3.347 -2.343 1.00 . A A . 7 PHE HD2 1 1 14 4416 1 1 7 PHE HE1 H -4.944 2.364 -0.240 1.00 . A A . 7 PHE HE1 1 1 14 4417 1 1 7 PHE HE2 H -1.020 4.272 -0.350 1.00 . A A . 7 PHE HE2 1 1 14 4418 1 1 7 PHE HZ H -3.259 3.877 0.908 1.00 . A A . 7 PHE HZ 1 1 14 4419 1 1 7 PHE N N -1.800 1.414 -5.847 1.00 . A A . 7 PHE N 1 1 14 4420 1 1 7 PHE O O 0.133 3.672 -4.236 1.00 . A A . 7 PHE O 1 1 14 4421 1 1 8 PHE C C 2.308 1.565 -3.526 1.00 . A A . 8 PHE C 1 1 14 4422 1 1 8 PHE CA C 1.262 1.731 -2.690 1.00 . A A . 8 PHE CA 1 1 14 4423 1 1 8 PHE CB C 1.653 0.666 -1.723 1.00 . A A . 8 PHE CB 1 1 14 4424 1 1 8 PHE CD1 C 2.141 -1.431 -2.307 1.00 . A A . 8 PHE CD1 1 1 14 4425 1 1 8 PHE CD2 C -0.067 -0.838 -1.998 1.00 . A A . 8 PHE CD2 1 1 14 4426 1 1 8 PHE CE1 C 1.831 -2.606 -2.657 1.00 . A A . 8 PHE CE1 1 1 14 4427 1 1 8 PHE CE2 C -0.414 -2.044 -2.348 1.00 . A A . 8 PHE CE2 1 1 14 4428 1 1 8 PHE CG C 1.191 -0.559 -1.982 1.00 . A A . 8 PHE CG 1 1 14 4429 1 1 8 PHE CZ C 0.540 -2.941 -2.691 1.00 . A A . 8 PHE CZ 1 1 14 4430 1 1 8 PHE H H -0.111 0.606 -3.662 1.00 . A A . 8 PHE H 1 1 14 4431 1 1 8 PHE HA H 1.266 2.686 -2.335 1.00 . A A . 8 PHE HA 1 1 14 4432 1 1 8 PHE HB2 H 2.716 0.575 -1.603 1.00 . A A . 8 PHE HB2 1 1 14 4433 1 1 8 PHE HB3 H 1.174 0.907 -0.774 1.00 . A A . 8 PHE HB3 1 1 14 4434 1 1 8 PHE HD1 H 3.182 -1.136 -2.278 1.00 . A A . 8 PHE HD1 1 1 14 4435 1 1 8 PHE HD2 H -0.792 -0.100 -1.708 1.00 . A A . 8 PHE HD2 1 1 14 4436 1 1 8 PHE HE1 H 2.599 -3.256 -2.933 1.00 . A A . 8 PHE HE1 1 1 14 4437 1 1 8 PHE HE2 H -1.420 -2.275 -2.403 1.00 . A A . 8 PHE HE2 1 1 14 4438 1 1 8 PHE HZ H 0.277 -3.871 -2.975 1.00 . A A . 8 PHE HZ 1 1 14 4439 1 1 8 PHE N N 0.222 1.521 -3.580 1.00 . A A . 8 PHE N 1 1 14 4440 1 1 8 PHE O O 3.216 2.247 -3.497 1.00 . A A . 8 PHE O 1 1 14 4441 1 1 9 ARG C C 2.985 1.376 -6.218 1.00 . A A . 9 ARG C 1 1 14 4442 1 1 9 ARG CA C 2.975 0.261 -5.322 1.00 . A A . 9 ARG CA 1 1 14 4443 1 1 9 ARG CB C 2.506 -0.961 -6.038 1.00 . A A . 9 ARG CB 1 1 14 4444 1 1 9 ARG CD C 4.543 -2.464 -6.091 1.00 . A A . 9 ARG CD 1 1 14 4445 1 1 9 ARG CG C 3.137 -2.246 -5.533 1.00 . A A . 9 ARG CG 1 1 14 4446 1 1 9 ARG CZ C 4.175 -3.908 -8.086 1.00 . A A . 9 ARG CZ 1 1 14 4447 1 1 9 ARG H H 1.219 0.158 -4.378 1.00 . A A . 9 ARG H 1 1 14 4448 1 1 9 ARG HA H 3.887 0.153 -4.861 1.00 . A A . 9 ARG HA 1 1 14 4449 1 1 9 ARG HB2 H 1.401 -1.008 -5.840 1.00 . A A . 9 ARG HB2 1 1 14 4450 1 1 9 ARG HB3 H 2.673 -0.838 -7.124 1.00 . A A . 9 ARG HB3 1 1 14 4451 1 1 9 ARG HD2 H 5.174 -1.568 -5.902 1.00 . A A . 9 ARG HD2 1 1 14 4452 1 1 9 ARG HD3 H 5.018 -3.359 -5.637 1.00 . A A . 9 ARG HD3 1 1 14 4453 1 1 9 ARG HE H 4.594 -1.897 -8.186 1.00 . A A . 9 ARG HE 1 1 14 4454 1 1 9 ARG HG2 H 3.199 -2.201 -4.435 1.00 . A A . 9 ARG HG2 1 1 14 4455 1 1 9 ARG HG3 H 2.491 -3.105 -5.812 1.00 . A A . 9 ARG HG3 1 1 14 4456 1 1 9 ARG HH11 H 4.054 -4.856 -6.268 1.00 . A A . 9 ARG HH11 1 1 14 4457 1 1 9 ARG HH12 H 3.784 -5.878 -7.640 1.00 . A A . 9 ARG HH12 1 1 14 4458 1 1 9 ARG HH21 H 4.225 -3.289 -10.044 1.00 . A A . 9 ARG HH21 1 1 14 4459 1 1 9 ARG HH22 H 3.883 -4.972 -9.821 1.00 . A A . 9 ARG HH22 1 1 14 4460 1 1 9 ARG N N 2.086 0.611 -4.359 1.00 . A A . 9 ARG N 1 1 14 4461 1 1 9 ARG NE N 4.453 -2.672 -7.569 1.00 . A A . 9 ARG NE 1 1 14 4462 1 1 9 ARG NH1 N 3.987 -4.977 -7.257 1.00 . A A . 9 ARG NH1 1 1 14 4463 1 1 9 ARG NH2 N 4.086 -4.071 -9.438 1.00 . A A . 9 ARG NH2 1 1 14 4464 1 1 9 ARG O O 3.664 1.393 -7.245 1.00 . A A . 9 ARG O 1 1 14 4465 1 1 10 ASP C C 2.119 4.629 -5.879 1.00 . A A . 10 ASP C 1 1 14 4466 1 1 10 ASP CA C 1.904 3.376 -6.631 1.00 . A A . 10 ASP CA 1 1 14 4467 1 1 10 ASP CB C 0.652 3.330 -7.280 1.00 . A A . 10 ASP CB 1 1 14 4468 1 1 10 ASP CG C 0.608 4.015 -8.642 1.00 . A A . 10 ASP CG 1 1 14 4469 1 1 10 ASP H H 1.499 2.184 -5.040 1.00 . A A . 10 ASP H 1 1 14 4470 1 1 10 ASP HA H 2.661 3.293 -7.297 1.00 . A A . 10 ASP HA 1 1 14 4471 1 1 10 ASP HB2 H 0.474 2.245 -7.380 1.00 . A A . 10 ASP HB2 1 1 14 4472 1 1 10 ASP HB3 H -0.072 3.771 -6.593 1.00 . A A . 10 ASP HB3 1 1 14 4473 1 1 10 ASP N N 2.046 2.256 -5.908 1.00 . A A . 10 ASP N 1 1 14 4474 1 1 10 ASP O O 2.091 5.701 -6.487 1.00 . A A . 10 ASP O 1 1 14 4475 1 1 10 ASP OD1 O 0.890 3.323 -9.658 1.00 . A A . 10 ASP OD1 1 1 14 4476 1 1 10 ASP OD2 O 0.294 5.233 -8.687 1.00 . A A . 10 ASP OD2 1 1 14 4477 1 1 11 . C C 2.333 6.071 -2.478 1.00 . A A . 11 DPN C 1 1 14 4478 1 1 11 . CA C 2.572 5.892 -3.948 1.00 . A A . 11 DPN CA 1 1 14 4479 1 1 11 . CB C 4.026 6.237 -4.188 1.00 . A A . 11 DPN CB 1 1 14 4480 1 1 11 . CD1 C 4.688 4.895 -6.101 1.00 . A A . 11 DPN CD1 1 1 14 4481 1 1 11 . CD2 C 4.914 4.252 -3.876 1.00 . A A . 11 DPN CD2 1 1 14 4482 1 1 11 . CE1 C 4.921 3.633 -6.442 1.00 . A A . 11 DPN CE1 1 1 14 4483 1 1 11 . CE2 C 5.213 3.088 -4.202 1.00 . A A . 11 DPN CE2 1 1 14 4484 1 1 11 . CG C 4.666 5.159 -4.771 1.00 . A A . 11 DPN CG 1 1 14 4485 1 1 11 . CZ C 5.180 2.757 -5.437 1.00 . A A . 11 DPN CZ 1 1 14 4486 1 1 11 . H H 2.321 3.720 -3.990 1.00 . A A . 11 DPN H 1 1 14 4487 1 1 11 . HA H 1.980 6.576 -4.430 1.00 . A A . 11 DPN HA 1 1 14 4488 1 1 11 . HB2 H 4.501 6.339 -3.219 1.00 . A A . 11 DPN HB2 1 1 14 4489 1 1 11 . HB3 H 4.134 7.070 -4.827 1.00 . A A . 11 DPN HB3 1 1 14 4490 1 1 11 . HD1 H 4.483 5.657 -6.837 1.00 . A A . 11 DPN HD1 1 1 14 4491 1 1 11 . HD2 H 4.946 4.525 -2.880 1.00 . A A . 11 DPN HD2 1 1 14 4492 1 1 11 . HE1 H 4.915 3.318 -7.470 1.00 . A A . 11 DPN HE1 1 1 14 4493 1 1 11 . HE2 H 5.360 2.358 -3.461 1.00 . A A . 11 DPN HE2 1 1 14 4494 1 1 11 . HZ H 5.255 1.818 -5.608 1.00 . A A . 11 DPN HZ 1 1 14 4495 1 1 11 . N N 2.296 4.593 -4.542 1.00 . A A . 11 DPN N 1 1 14 4496 1 1 11 . O O 1.355 6.687 -2.062 1.00 . A A . 11 DPN O 1 1 14 4497 1 1 12 ILE C C 4.603 5.068 0.196 1.00 . A A . 12 ILE C 1 1 14 4498 1 1 12 ILE CA C 3.314 5.729 -0.263 1.00 . A A . 12 ILE CA 1 1 14 4499 1 1 12 ILE CB C 2.154 5.134 0.467 1.00 . A A . 12 ILE CB 1 1 14 4500 1 1 12 ILE CD1 C 2.607 3.114 -0.668 1.00 . A A . 12 ILE CD1 1 1 14 4501 1 1 12 ILE CG1 C 1.556 4.078 -0.406 1.00 . A A . 12 ILE CG1 1 1 14 4502 1 1 12 ILE CG2 C 1.159 6.241 0.856 1.00 . A A . 12 ILE CG2 1 1 14 4503 1 1 12 ILE H H 3.907 4.890 -2.036 1.00 . A A . 12 ILE H 1 1 14 4504 1 1 12 ILE HA H 3.379 6.749 -0.079 1.00 . A A . 12 ILE HA 1 1 14 4505 1 1 12 ILE HB H 2.529 4.638 1.372 1.00 . A A . 12 ILE HB 1 1 14 4506 1 1 12 ILE HD11 H 2.898 3.161 -1.758 1.00 . A A . 12 ILE HD11 1 1 14 4507 1 1 12 ILE HD12 H 2.292 2.127 -0.384 1.00 . A A . 12 ILE HD12 1 1 14 4508 1 1 12 ILE HD13 H 3.469 3.353 -0.086 1.00 . A A . 12 ILE HD13 1 1 14 4509 1 1 12 ILE HG12 H 0.706 3.578 0.088 1.00 . A A . 12 ILE HG12 1 1 14 4510 1 1 12 ILE HG13 H 1.234 4.498 -1.382 1.00 . A A . 12 ILE HG13 1 1 14 4511 1 1 12 ILE HG21 H 1.276 6.505 1.929 1.00 . A A . 12 ILE HG21 1 1 14 4512 1 1 12 ILE HG22 H 0.117 5.898 0.686 1.00 . A A . 12 ILE HG22 1 1 14 4513 1 1 12 ILE HG23 H 1.335 7.152 0.244 1.00 . A A . 12 ILE HG23 1 1 14 4514 1 1 12 ILE N N 3.269 5.539 -1.683 1.00 . A A . 12 ILE N 1 1 14 4515 1 1 12 ILE O O 4.900 5.007 1.376 1.00 . A A . 12 ILE O 1 1 14 4516 1 1 13 LEU C C 7.677 4.406 -1.170 1.00 . A A . 13 LEU C 1 1 14 4517 1 1 13 LEU CA C 6.546 3.702 -0.548 1.00 . A A . 13 LEU CA 1 1 14 4518 1 1 13 LEU CB C 6.516 2.374 -1.278 1.00 . A A . 13 LEU CB 1 1 14 4519 1 1 13 LEU CD1 C 5.132 0.482 -2.020 1.00 . A A . 13 LEU CD1 1 1 14 4520 1 1 13 LEU CD2 C 4.824 1.596 0.301 1.00 . A A . 13 LEU CD2 1 1 14 4521 1 1 13 LEU CG C 5.188 1.751 -1.173 1.00 . A A . 13 LEU CG 1 1 14 4522 1 1 13 LEU H H 4.959 4.362 -1.723 1.00 . A A . 13 LEU H 1 1 14 4523 1 1 13 LEU HA H 6.692 3.569 0.502 1.00 . A A . 13 LEU HA 1 1 14 4524 1 1 13 LEU HB2 H 6.716 2.542 -2.352 1.00 . A A . 13 LEU HB2 1 1 14 4525 1 1 13 LEU HB3 H 7.270 1.686 -0.868 1.00 . A A . 13 LEU HB3 1 1 14 4526 1 1 13 LEU HD11 H 4.681 -0.353 -1.456 1.00 . A A . 13 LEU HD11 1 1 14 4527 1 1 13 LEU HD12 H 6.154 0.205 -2.344 1.00 . A A . 13 LEU HD12 1 1 14 4528 1 1 13 LEU HD13 H 4.523 0.678 -2.941 1.00 . A A . 13 LEU HD13 1 1 14 4529 1 1 13 LEU HD21 H 4.858 2.619 0.788 1.00 . A A . 13 LEU HD21 1 1 14 4530 1 1 13 LEU HD22 H 5.544 0.933 0.813 1.00 . A A . 13 LEU HD22 1 1 14 4531 1 1 13 LEU HD23 H 3.801 1.189 0.409 1.00 . A A . 13 LEU HD23 1 1 14 4532 1 1 13 LEU HG H 4.482 2.472 -1.631 1.00 . A A . 13 LEU HG 1 1 14 4533 1 1 13 LEU N N 5.314 4.433 -0.787 1.00 . A A . 13 LEU N 1 1 14 4534 1 1 13 LEU O O 8.719 4.612 -0.570 1.00 . A A . 13 LEU O 1 1 14 4535 1 1 14 GLN C C 8.678 6.736 -2.515 1.00 . A A . 14 GLN C 1 1 14 4536 1 1 14 GLN CA C 8.562 5.432 -3.160 1.00 . A A . 14 GLN CA 1 1 14 4537 1 1 14 GLN CB C 8.275 5.717 -4.631 1.00 . A A . 14 GLN CB 1 1 14 4538 1 1 14 GLN CD C 8.806 3.351 -5.002 1.00 . A A . 14 GLN CD 1 1 14 4539 1 1 14 GLN CG C 7.880 4.480 -5.366 1.00 . A A . 14 GLN CG 1 1 14 4540 1 1 14 GLN H H 6.649 4.518 -2.959 1.00 . A A . 14 GLN H 1 1 14 4541 1 1 14 GLN HA H 9.472 4.875 -3.035 1.00 . A A . 14 GLN HA 1 1 14 4542 1 1 14 GLN HB2 H 7.435 6.440 -4.696 1.00 . A A . 14 GLN HB2 1 1 14 4543 1 1 14 GLN HB3 H 9.165 6.162 -5.110 1.00 . A A . 14 GLN HB3 1 1 14 4544 1 1 14 GLN HE21 H 7.301 2.609 -3.860 1.00 . A A . 14 GLN HE21 1 1 14 4545 1 1 14 GLN HE22 H 8.770 1.672 -3.852 1.00 . A A . 14 GLN HE22 1 1 14 4546 1 1 14 GLN HG2 H 6.868 4.220 -5.045 1.00 . A A . 14 GLN HG2 1 1 14 4547 1 1 14 GLN HG3 H 7.896 4.648 -6.456 1.00 . A A . 14 GLN HG3 1 1 14 4548 1 1 14 GLN N N 7.500 4.746 -2.453 1.00 . A A . 14 GLN N 1 1 14 4549 1 1 14 GLN NE2 N 8.253 2.456 -4.169 1.00 . A A . 14 GLN NE2 1 1 14 4550 1 1 14 GLN O O 9.692 7.426 -2.605 1.00 . A A . 14 GLN O 1 1 14 4551 1 1 14 GLN OE1 O 9.968 3.300 -5.387 1.00 . A A . 14 GLN OE1 1 1 14 4552 1 1 15 ARG C C 7.739 8.033 0.278 1.00 . A A . 15 ARG C 1 1 14 4553 1 1 15 ARG CA C 7.568 8.338 -1.175 1.00 . A A . 15 ARG CA 1 1 14 4554 1 1 15 ARG CB C 6.241 9.088 -1.303 1.00 . A A . 15 ARG CB 1 1 14 4555 1 1 15 ARG CD C 3.974 8.655 -2.249 1.00 . A A . 15 ARG CD 1 1 14 4556 1 1 15 ARG CG C 5.463 8.709 -2.549 1.00 . A A . 15 ARG CG 1 1 14 4557 1 1 15 ARG CZ C 3.127 10.933 -2.799 1.00 . A A . 15 ARG CZ 1 1 14 4558 1 1 15 ARG H H 6.781 6.478 -1.762 1.00 . A A . 15 ARG H 1 1 14 4559 1 1 15 ARG HA H 8.386 8.910 -1.559 1.00 . A A . 15 ARG HA 1 1 14 4560 1 1 15 ARG HB2 H 5.614 8.878 -0.412 1.00 . A A . 15 ARG HB2 1 1 14 4561 1 1 15 ARG HB3 H 6.443 10.179 -1.327 1.00 . A A . 15 ARG HB3 1 1 14 4562 1 1 15 ARG HD2 H 3.400 8.324 -3.137 1.00 . A A . 15 ARG HD2 1 1 14 4563 1 1 15 ARG HD3 H 3.785 7.952 -1.398 1.00 . A A . 15 ARG HD3 1 1 14 4564 1 1 15 ARG HE H 3.475 10.268 -0.880 1.00 . A A . 15 ARG HE 1 1 14 4565 1 1 15 ARG HG2 H 5.661 9.443 -3.355 1.00 . A A . 15 ARG HG2 1 1 14 4566 1 1 15 ARG HG3 H 5.791 7.704 -2.898 1.00 . A A . 15 ARG HG3 1 1 14 4567 1 1 15 ARG HH11 H 3.471 9.700 -4.406 1.00 . A A . 15 ARG HH11 1 1 14 4568 1 1 15 ARG HH12 H 2.885 11.278 -4.812 1.00 . A A . 15 ARG HH12 1 1 14 4569 1 1 15 ARG HH21 H 2.680 12.408 -1.442 1.00 . A A . 15 ARG HH21 1 1 14 4570 1 1 15 ARG HH22 H 2.429 12.842 -3.099 1.00 . A A . 15 ARG HH22 1 1 14 4571 1 1 15 ARG N N 7.593 7.089 -1.835 1.00 . A A . 15 ARG N 1 1 14 4572 1 1 15 ARG NE N 3.507 10.020 -1.852 1.00 . A A . 15 ARG NE 1 1 14 4573 1 1 15 ARG NH1 N 3.165 10.609 -4.124 1.00 . A A . 15 ARG NH1 1 1 14 4574 1 1 15 ARG NH2 N 2.708 12.172 -2.413 1.00 . A A . 15 ARG NH2 1 1 14 4575 1 1 15 ARG O O 8.246 8.842 1.050 1.00 . A A . 15 ARG O 1 1 14 4576 1 1 16 LYS C C 6.207 6.968 2.798 1.00 . A A . 16 LYS C 1 1 14 4577 1 1 16 LYS CA C 7.280 6.311 1.986 1.00 . A A . 16 LYS CA 1 1 14 4578 1 1 16 LYS CB C 8.603 6.505 2.716 1.00 . A A . 16 LYS CB 1 1 14 4579 1 1 16 LYS CD C 9.544 4.198 2.232 1.00 . A A . 16 LYS CD 1 1 14 4580 1 1 16 LYS CE C 10.788 3.388 1.856 1.00 . A A . 16 LYS CE 1 1 14 4581 1 1 16 LYS CG C 9.761 5.709 2.113 1.00 . A A . 16 LYS CG 1 1 14 4582 1 1 16 LYS H H 6.865 6.201 -0.020 1.00 . A A . 16 LYS H 1 1 14 4583 1 1 16 LYS HA H 7.042 5.260 1.899 1.00 . A A . 16 LYS HA 1 1 14 4584 1 1 16 LYS HB2 H 8.844 7.579 2.682 1.00 . A A . 16 LYS HB2 1 1 14 4585 1 1 16 LYS HB3 H 8.474 6.213 3.774 1.00 . A A . 16 LYS HB3 1 1 14 4586 1 1 16 LYS HD2 H 9.256 3.954 3.275 1.00 . A A . 16 LYS HD2 1 1 14 4587 1 1 16 LYS HD3 H 8.701 3.902 1.567 1.00 . A A . 16 LYS HD3 1 1 14 4588 1 1 16 LYS HE2 H 11.663 3.715 2.455 1.00 . A A . 16 LYS HE2 1 1 14 4589 1 1 16 LYS HE3 H 10.612 2.303 2.021 1.00 . A A . 16 LYS HE3 1 1 14 4590 1 1 16 LYS HG2 H 9.871 5.980 1.041 1.00 . A A . 16 LYS HG2 1 1 14 4591 1 1 16 LYS HG3 H 10.703 5.985 2.635 1.00 . A A . 16 LYS HG3 1 1 14 4592 1 1 16 LYS HZ1 H 11.342 2.669 -0.007 1.00 . A A . 16 LYS HZ1 1 1 14 4593 1 1 16 LYS HZ2 H 11.936 4.221 0.345 1.00 . A A . 16 LYS HZ2 1 1 14 4594 1 1 16 LYS HZ3 H 10.295 4.010 -0.061 1.00 . A A . 16 LYS HZ3 1 1 14 4595 1 1 16 LYS N N 7.253 6.820 0.646 1.00 . A A . 16 LYS N 1 1 14 4596 1 1 16 LYS NZ N 11.118 3.585 0.427 1.00 . A A . 16 LYS NZ 1 1 14 4597 1 1 16 LYS O O 6.163 6.828 4.020 1.00 . A A . 16 LYS O 1 1 14 4598 1 1 17 LYS C C 3.265 8.944 1.819 1.00 . A A . 17 LYS C 1 1 14 4599 1 1 17 LYS CA C 4.221 8.317 2.833 1.00 . A A . 17 LYS CA 1 1 14 4600 1 1 17 LYS CB C 4.666 9.425 3.811 1.00 . A A . 17 LYS CB 1 1 14 4601 1 1 17 LYS CD C 5.422 11.507 2.534 1.00 . A A . 17 LYS CD 1 1 14 4602 1 1 17 LYS CE C 6.467 11.945 1.511 1.00 . A A . 17 LYS CE 1 1 14 4603 1 1 17 LYS CG C 5.853 10.251 3.299 1.00 . A A . 17 LYS CG 1 1 14 4604 1 1 17 LYS H H 5.358 7.816 1.148 1.00 . A A . 17 LYS H 1 1 14 4605 1 1 17 LYS HA H 3.698 7.538 3.355 1.00 . A A . 17 LYS HA 1 1 14 4606 1 1 17 LYS HB2 H 3.809 10.104 4.004 1.00 . A A . 17 LYS HB2 1 1 14 4607 1 1 17 LYS HB3 H 4.951 8.953 4.771 1.00 . A A . 17 LYS HB3 1 1 14 4608 1 1 17 LYS HD2 H 4.463 11.306 2.007 1.00 . A A . 17 LYS HD2 1 1 14 4609 1 1 17 LYS HD3 H 5.250 12.332 3.257 1.00 . A A . 17 LYS HD3 1 1 14 4610 1 1 17 LYS HE2 H 7.430 12.181 2.012 1.00 . A A . 17 LYS HE2 1 1 14 4611 1 1 17 LYS HE3 H 6.629 11.145 0.755 1.00 . A A . 17 LYS HE3 1 1 14 4612 1 1 17 LYS HG2 H 6.478 10.556 4.165 1.00 . A A . 17 LYS HG2 1 1 14 4613 1 1 17 LYS HG3 H 6.479 9.620 2.636 1.00 . A A . 17 LYS HG3 1 1 14 4614 1 1 17 LYS HZ1 H 5.247 13.612 1.339 1.00 . A A . 17 LYS HZ1 1 1 14 4615 1 1 17 LYS HZ2 H 5.670 12.902 -0.146 1.00 . A A . 17 LYS HZ2 1 1 14 4616 1 1 17 LYS HZ3 H 6.810 13.826 0.709 1.00 . A A . 17 LYS HZ3 1 1 14 4617 1 1 17 LYS N N 5.303 7.686 2.126 1.00 . A A . 17 LYS N 1 1 14 4618 1 1 17 LYS NZ N 6.015 13.162 0.801 1.00 . A A . 17 LYS NZ 1 1 14 4619 1 1 17 LYS O O 3.746 9.414 0.765 1.00 . A A . 17 LYS O 1 1 14 4620 1 1 17 LYS OXT O 2.036 8.969 2.103 1.00 . A A . 17 LYS OXT 1 1 15 4621 1 1 1 GLU C C -2.081 -8.845 -3.792 1.00 . A A . 1 GLU C 1 1 15 4622 1 1 1 GLU CA C -1.399 -9.909 -4.606 1.00 . A A . 1 GLU CA 1 1 15 4623 1 1 1 GLU CB C 0.129 -9.724 -4.473 1.00 . A A . 1 GLU CB 1 1 15 4624 1 1 1 GLU CD C 0.608 -12.161 -4.747 1.00 . A A . 1 GLU CD 1 1 15 4625 1 1 1 GLU CG C 0.935 -10.767 -5.270 1.00 . A A . 1 GLU CG 1 1 15 4626 1 1 1 GLU H1 H -1.044 -9.369 -6.586 1.00 . A A . 1 GLU H1 1 1 15 4627 1 1 1 GLU H2 H -2.673 -9.251 -6.117 1.00 . A A . 1 GLU H2 1 1 15 4628 1 1 1 GLU H3 H -1.980 -10.774 -6.408 1.00 . A A . 1 GLU H3 1 1 15 4629 1 1 1 GLU HA H -1.695 -10.879 -4.243 1.00 . A A . 1 GLU HA 1 1 15 4630 1 1 1 GLU HB2 H 0.402 -8.706 -4.831 1.00 . A A . 1 GLU HB2 1 1 15 4631 1 1 1 GLU HB3 H 0.410 -9.795 -3.400 1.00 . A A . 1 GLU HB3 1 1 15 4632 1 1 1 GLU HG2 H 0.675 -10.706 -6.349 1.00 . A A . 1 GLU HG2 1 1 15 4633 1 1 1 GLU HG3 H 2.022 -10.580 -5.150 1.00 . A A . 1 GLU HG3 1 1 15 4634 1 1 1 GLU N N -1.804 -9.818 -6.036 1.00 . A A . 1 GLU N 1 1 15 4635 1 1 1 GLU O O -2.566 -9.109 -2.694 1.00 . A A . 1 GLU O 1 1 15 4636 1 1 1 GLU OE1 O 0.433 -12.305 -3.508 1.00 . A A . 1 GLU OE1 1 1 15 4637 1 1 1 GLU OE2 O 0.532 -13.099 -5.583 1.00 . A A . 1 GLU OE2 1 1 15 4638 1 1 2 MET C C -3.759 -5.908 -4.522 1.00 . A A . 2 MET C 1 1 15 4639 1 1 2 MET CA C -2.762 -6.523 -3.621 1.00 . A A . 2 MET CA 1 1 15 4640 1 1 2 MET CB C -1.790 -5.436 -3.127 1.00 . A A . 2 MET CB 1 1 15 4641 1 1 2 MET CE C -3.870 -5.422 -0.923 1.00 . A A . 2 MET CE 1 1 15 4642 1 1 2 MET CG C -1.304 -5.628 -1.680 1.00 . A A . 2 MET CG 1 1 15 4643 1 1 2 MET H H -1.755 -7.395 -5.228 1.00 . A A . 2 MET H 1 1 15 4644 1 1 2 MET HA H -3.319 -6.924 -2.797 1.00 . A A . 2 MET HA 1 1 15 4645 1 1 2 MET HB2 H -0.906 -5.429 -3.796 1.00 . A A . 2 MET HB2 1 1 15 4646 1 1 2 MET HB3 H -2.280 -4.437 -3.199 1.00 . A A . 2 MET HB3 1 1 15 4647 1 1 2 MET HE1 H -4.146 -4.840 -0.021 1.00 . A A . 2 MET HE1 1 1 15 4648 1 1 2 MET HE2 H -4.759 -6.003 -1.247 1.00 . A A . 2 MET HE2 1 1 15 4649 1 1 2 MET HE3 H -3.621 -4.705 -1.733 1.00 . A A . 2 MET HE3 1 1 15 4650 1 1 2 MET HG2 H -0.333 -6.165 -1.704 1.00 . A A . 2 MET HG2 1 1 15 4651 1 1 2 MET HG3 H -1.114 -4.617 -1.262 1.00 . A A . 2 MET HG3 1 1 15 4652 1 1 2 MET N N -2.132 -7.606 -4.329 1.00 . A A . 2 MET N 1 1 15 4653 1 1 2 MET O O -3.892 -6.262 -5.693 1.00 . A A . 2 MET O 1 1 15 4654 1 1 2 MET SD S -2.464 -6.515 -0.587 1.00 . A A . 2 MET SD 1 1 15 4655 1 1 3 ARG C C -5.310 -2.887 -4.613 1.00 . A A . 3 ARG C 1 1 15 4656 1 1 3 ARG CA C -5.541 -4.306 -4.639 1.00 . A A . 3 ARG CA 1 1 15 4657 1 1 3 ARG CB C -6.822 -4.502 -3.878 1.00 . A A . 3 ARG CB 1 1 15 4658 1 1 3 ARG CD C -6.854 -6.923 -3.216 1.00 . A A . 3 ARG CD 1 1 15 4659 1 1 3 ARG CG C -7.472 -5.858 -4.122 1.00 . A A . 3 ARG CG 1 1 15 4660 1 1 3 ARG CZ C -7.476 -8.133 -1.141 1.00 . A A . 3 ARG CZ 1 1 15 4661 1 1 3 ARG H H -4.299 -4.604 -3.038 1.00 . A A . 3 ARG H 1 1 15 4662 1 1 3 ARG HA H -5.583 -4.643 -5.609 1.00 . A A . 3 ARG HA 1 1 15 4663 1 1 3 ARG HB2 H -6.548 -4.416 -2.799 1.00 . A A . 3 ARG HB2 1 1 15 4664 1 1 3 ARG HB3 H -7.527 -3.684 -4.124 1.00 . A A . 3 ARG HB3 1 1 15 4665 1 1 3 ARG HD2 H -6.625 -7.848 -3.787 1.00 . A A . 3 ARG HD2 1 1 15 4666 1 1 3 ARG HD3 H -5.926 -6.527 -2.740 1.00 . A A . 3 ARG HD3 1 1 15 4667 1 1 3 ARG HE H -8.732 -6.837 -2.129 1.00 . A A . 3 ARG HE 1 1 15 4668 1 1 3 ARG HG2 H -8.563 -5.785 -3.926 1.00 . A A . 3 ARG HG2 1 1 15 4669 1 1 3 ARG HG3 H -7.327 -6.150 -5.183 1.00 . A A . 3 ARG HG3 1 1 15 4670 1 1 3 ARG HH11 H -5.591 -8.500 -1.873 1.00 . A A . 3 ARG HH11 1 1 15 4671 1 1 3 ARG HH12 H -5.986 -9.355 -0.420 1.00 . A A . 3 ARG HH12 1 1 15 4672 1 1 3 ARG HH21 H -9.272 -8.001 -0.151 1.00 . A A . 3 ARG HH21 1 1 15 4673 1 1 3 ARG HH22 H -8.115 -9.066 0.575 1.00 . A A . 3 ARG HH22 1 1 15 4674 1 1 3 ARG N N -4.481 -4.938 -3.955 1.00 . A A . 3 ARG N 1 1 15 4675 1 1 3 ARG NE N -7.824 -7.258 -2.131 1.00 . A A . 3 ARG NE 1 1 15 4676 1 1 3 ARG NH1 N -6.240 -8.715 -1.145 1.00 . A A . 3 ARG NH1 1 1 15 4677 1 1 3 ARG NH2 N -8.366 -8.426 -0.150 1.00 . A A . 3 ARG NH2 1 1 15 4678 1 1 3 ARG O O -5.807 -2.120 -5.433 1.00 . A A . 3 ARG O 1 1 15 4679 1 1 4 LEU C C -3.385 -0.835 -4.508 1.00 . A A . 4 LEU C 1 1 15 4680 1 1 4 LEU CA C -4.264 -1.175 -3.413 1.00 . A A . 4 LEU CA 1 1 15 4681 1 1 4 LEU CB C -3.478 -0.952 -2.147 1.00 . A A . 4 LEU CB 1 1 15 4682 1 1 4 LEU CD1 C -2.427 -1.973 -0.190 1.00 . A A . 4 LEU CD1 1 1 15 4683 1 1 4 LEU CD2 C -4.920 -2.386 -0.686 1.00 . A A . 4 LEU CD2 1 1 15 4684 1 1 4 LEU CG C -3.516 -2.127 -1.237 1.00 . A A . 4 LEU CG 1 1 15 4685 1 1 4 LEU H H -4.112 -3.169 -3.011 1.00 . A A . 4 LEU H 1 1 15 4686 1 1 4 LEU HA H -5.109 -0.590 -3.445 1.00 . A A . 4 LEU HA 1 1 15 4687 1 1 4 LEU HB2 H -2.446 -0.714 -2.391 1.00 . A A . 4 LEU HB2 1 1 15 4688 1 1 4 LEU HB3 H -3.908 -0.106 -1.603 1.00 . A A . 4 LEU HB3 1 1 15 4689 1 1 4 LEU HD11 H -2.838 -2.041 0.835 1.00 . A A . 4 LEU HD11 1 1 15 4690 1 1 4 LEU HD12 H -1.929 -0.981 -0.330 1.00 . A A . 4 LEU HD12 1 1 15 4691 1 1 4 LEU HD13 H -1.658 -2.765 -0.340 1.00 . A A . 4 LEU HD13 1 1 15 4692 1 1 4 LEU HD21 H -4.865 -2.861 0.314 1.00 . A A . 4 LEU HD21 1 1 15 4693 1 1 4 LEU HD22 H -5.473 -3.069 -1.383 1.00 . A A . 4 LEU HD22 1 1 15 4694 1 1 4 LEU HD23 H -5.481 -1.431 -0.606 1.00 . A A . 4 LEU HD23 1 1 15 4695 1 1 4 LEU HG H -3.228 -2.985 -1.854 1.00 . A A . 4 LEU HG 1 1 15 4696 1 1 4 LEU N N -4.545 -2.516 -3.626 1.00 . A A . 4 LEU N 1 1 15 4697 1 1 4 LEU O O -3.791 -0.086 -5.369 1.00 . A A . 4 LEU O 1 1 15 4698 1 1 5 SER C C -1.123 -0.977 -6.659 1.00 . A A . 5 SER C 1 1 15 4699 1 1 5 SER CA C -1.138 -1.709 -5.342 1.00 . A A . 5 SER CA 1 1 15 4700 1 1 5 SER CB C -0.676 -3.123 -5.463 1.00 . A A . 5 SER CB 1 1 15 4701 1 1 5 SER H H -2.398 -2.462 -3.927 1.00 . A A . 5 SER H 1 1 15 4702 1 1 5 SER HA H -0.429 -1.194 -4.703 1.00 . A A . 5 SER HA 1 1 15 4703 1 1 5 SER HB2 H 0.398 -3.153 -5.197 1.00 . A A . 5 SER HB2 1 1 15 4704 1 1 5 SER HB3 H -1.265 -3.710 -4.701 1.00 . A A . 5 SER HB3 1 1 15 4705 1 1 5 SER HG H -0.417 -3.098 -7.374 1.00 . A A . 5 SER HG 1 1 15 4706 1 1 5 SER N N -2.365 -1.708 -4.559 1.00 . A A . 5 SER N 1 1 15 4707 1 1 5 SER O O -0.115 -0.917 -7.349 1.00 . A A . 5 SER O 1 1 15 4708 1 1 5 SER OG O -0.884 -3.675 -6.760 1.00 . A A . 5 SER OG 1 1 15 4709 1 1 6 LYS C C -1.994 1.716 -7.226 1.00 . A A . 6 LYS C 1 1 15 4710 1 1 6 LYS CA C -2.280 0.485 -8.086 1.00 . A A . 6 LYS CA 1 1 15 4711 1 1 6 LYS CB C -3.650 0.647 -8.746 1.00 . A A . 6 LYS CB 1 1 15 4712 1 1 6 LYS CD C -5.503 -0.474 -10.056 1.00 . A A . 6 LYS CD 1 1 15 4713 1 1 6 LYS CE C -5.952 -1.708 -10.842 1.00 . A A . 6 LYS CE 1 1 15 4714 1 1 6 LYS CG C -4.096 -0.614 -9.483 1.00 . A A . 6 LYS CG 1 1 15 4715 1 1 6 LYS H H -3.122 -0.683 -6.630 1.00 . A A . 6 LYS H 1 1 15 4716 1 1 6 LYS HA H -1.480 0.307 -8.793 1.00 . A A . 6 LYS HA 1 1 15 4717 1 1 6 LYS HB2 H -4.399 0.904 -7.965 1.00 . A A . 6 LYS HB2 1 1 15 4718 1 1 6 LYS HB3 H -3.599 1.491 -9.467 1.00 . A A . 6 LYS HB3 1 1 15 4719 1 1 6 LYS HD2 H -6.209 -0.303 -9.215 1.00 . A A . 6 LYS HD2 1 1 15 4720 1 1 6 LYS HD3 H -5.537 0.415 -10.720 1.00 . A A . 6 LYS HD3 1 1 15 4721 1 1 6 LYS HE2 H -6.959 -1.546 -11.280 1.00 . A A . 6 LYS HE2 1 1 15 4722 1 1 6 LYS HE3 H -5.229 -1.937 -11.654 1.00 . A A . 6 LYS HE3 1 1 15 4723 1 1 6 LYS HG2 H -3.385 -0.824 -10.310 1.00 . A A . 6 LYS HG2 1 1 15 4724 1 1 6 LYS HG3 H -4.071 -1.475 -8.781 1.00 . A A . 6 LYS HG3 1 1 15 4725 1 1 6 LYS HZ1 H -6.916 -3.398 -10.129 1.00 . A A . 6 LYS HZ1 1 1 15 4726 1 1 6 LYS HZ2 H -6.000 -2.575 -8.960 1.00 . A A . 6 LYS HZ2 1 1 15 4727 1 1 6 LYS HZ3 H -5.222 -3.517 -10.140 1.00 . A A . 6 LYS HZ3 1 1 15 4728 1 1 6 LYS N N -2.243 -0.467 -7.057 1.00 . A A . 6 LYS N 1 1 15 4729 1 1 6 LYS NZ N -6.029 -2.888 -9.952 1.00 . A A . 6 LYS NZ 1 1 15 4730 1 1 6 LYS O O -2.013 2.852 -7.680 1.00 . A A . 6 LYS O 1 1 15 4731 1 1 7 PHE C C -0.380 2.537 -4.240 1.00 . A A . 7 PHE C 1 1 15 4732 1 1 7 PHE CA C -1.653 2.277 -4.801 1.00 . A A . 7 PHE CA 1 1 15 4733 1 1 7 PHE CB C -2.237 1.598 -3.594 1.00 . A A . 7 PHE CB 1 1 15 4734 1 1 7 PHE CD1 C -3.868 2.046 -1.924 1.00 . A A . 7 PHE CD1 1 1 15 4735 1 1 7 PHE CD2 C -1.767 3.078 -1.863 1.00 . A A . 7 PHE CD2 1 1 15 4736 1 1 7 PHE CE1 C -4.118 2.540 -0.703 1.00 . A A . 7 PHE CE1 1 1 15 4737 1 1 7 PHE CE2 C -1.955 3.605 -0.714 1.00 . A A . 7 PHE CE2 1 1 15 4738 1 1 7 PHE CG C -2.712 2.322 -2.494 1.00 . A A . 7 PHE CG 1 1 15 4739 1 1 7 PHE CZ C -3.157 3.351 -0.056 1.00 . A A . 7 PHE CZ 1 1 15 4740 1 1 7 PHE H H -1.771 0.430 -5.529 1.00 . A A . 7 PHE H 1 1 15 4741 1 1 7 PHE HA H -2.197 3.166 -4.961 1.00 . A A . 7 PHE HA 1 1 15 4742 1 1 7 PHE HB2 H -3.163 1.185 -3.949 1.00 . A A . 7 PHE HB2 1 1 15 4743 1 1 7 PHE HB3 H -1.640 0.754 -3.218 1.00 . A A . 7 PHE HB3 1 1 15 4744 1 1 7 PHE HD1 H -4.592 1.411 -2.443 1.00 . A A . 7 PHE HD1 1 1 15 4745 1 1 7 PHE HD2 H -0.837 3.286 -2.327 1.00 . A A . 7 PHE HD2 1 1 15 4746 1 1 7 PHE HE1 H -5.027 2.262 -0.251 1.00 . A A . 7 PHE HE1 1 1 15 4747 1 1 7 PHE HE2 H -1.104 4.175 -0.319 1.00 . A A . 7 PHE HE2 1 1 15 4748 1 1 7 PHE HZ H -3.347 3.756 0.927 1.00 . A A . 7 PHE HZ 1 1 15 4749 1 1 7 PHE N N -1.869 1.408 -5.866 1.00 . A A . 7 PHE N 1 1 15 4750 1 1 7 PHE O O 0.055 3.648 -4.215 1.00 . A A . 7 PHE O 1 1 15 4751 1 1 8 PHE C C 2.235 1.533 -3.537 1.00 . A A . 8 PHE C 1 1 15 4752 1 1 8 PHE CA C 1.187 1.688 -2.703 1.00 . A A . 8 PHE CA 1 1 15 4753 1 1 8 PHE CB C 1.576 0.609 -1.750 1.00 . A A . 8 PHE CB 1 1 15 4754 1 1 8 PHE CD1 C 2.070 -1.471 -2.383 1.00 . A A . 8 PHE CD1 1 1 15 4755 1 1 8 PHE CD2 C -0.139 -0.899 -2.046 1.00 . A A . 8 PHE CD2 1 1 15 4756 1 1 8 PHE CE1 C 1.766 -2.641 -2.755 1.00 . A A . 8 PHE CE1 1 1 15 4757 1 1 8 PHE CE2 C -0.481 -2.099 -2.419 1.00 . A A . 8 PHE CE2 1 1 15 4758 1 1 8 PHE CG C 1.117 -0.612 -2.033 1.00 . A A . 8 PHE CG 1 1 15 4759 1 1 8 PHE CZ C 0.478 -2.984 -2.786 1.00 . A A . 8 PHE CZ 1 1 15 4760 1 1 8 PHE H H -0.183 0.573 -3.692 1.00 . A A . 8 PHE H 1 1 15 4761 1 1 8 PHE HA H 1.191 2.637 -2.334 1.00 . A A . 8 PHE HA 1 1 15 4762 1 1 8 PHE HB2 H 2.639 0.517 -1.630 1.00 . A A . 8 PHE HB2 1 1 15 4763 1 1 8 PHE HB3 H 1.096 0.836 -0.798 1.00 . A A . 8 PHE HB3 1 1 15 4764 1 1 8 PHE HD1 H 3.109 -1.172 -2.354 1.00 . A A . 8 PHE HD1 1 1 15 4765 1 1 8 PHE HD2 H -0.867 -0.170 -1.737 1.00 . A A . 8 PHE HD2 1 1 15 4766 1 1 8 PHE HE1 H 2.538 -3.279 -3.049 1.00 . A A . 8 PHE HE1 1 1 15 4767 1 1 8 PHE HE2 H -1.485 -2.337 -2.474 1.00 . A A . 8 PHE HE2 1 1 15 4768 1 1 8 PHE HZ H 0.218 -3.909 -3.088 1.00 . A A . 8 PHE HZ 1 1 15 4769 1 1 8 PHE N N 0.148 1.487 -3.596 1.00 . A A . 8 PHE N 1 1 15 4770 1 1 8 PHE O O 3.149 2.205 -3.490 1.00 . A A . 8 PHE O 1 1 15 4771 1 1 9 ARG C C 2.912 1.398 -6.229 1.00 . A A . 9 ARG C 1 1 15 4772 1 1 9 ARG CA C 2.906 0.268 -5.352 1.00 . A A . 9 ARG CA 1 1 15 4773 1 1 9 ARG CB C 2.445 -0.945 -6.084 1.00 . A A . 9 ARG CB 1 1 15 4774 1 1 9 ARG CD C 4.423 -2.508 -6.245 1.00 . A A . 9 ARG CD 1 1 15 4775 1 1 9 ARG CG C 3.077 -2.233 -5.584 1.00 . A A . 9 ARG CG 1 1 15 4776 1 1 9 ARG CZ C 5.230 -3.225 -8.481 1.00 . A A . 9 ARG CZ 1 1 15 4777 1 1 9 ARG H H 1.143 0.154 -4.430 1.00 . A A . 9 ARG H 1 1 15 4778 1 1 9 ARG HA H 3.816 0.160 -4.889 1.00 . A A . 9 ARG HA 1 1 15 4779 1 1 9 ARG HB2 H 1.338 -0.997 -5.895 1.00 . A A . 9 ARG HB2 1 1 15 4780 1 1 9 ARG HB3 H 2.621 -0.813 -7.166 1.00 . A A . 9 ARG HB3 1 1 15 4781 1 1 9 ARG HD2 H 5.024 -1.575 -6.299 1.00 . A A . 9 ARG HD2 1 1 15 4782 1 1 9 ARG HD3 H 4.984 -3.290 -5.693 1.00 . A A . 9 ARG HD3 1 1 15 4783 1 1 9 ARG HE H 3.244 -3.157 -7.950 1.00 . A A . 9 ARG HE 1 1 15 4784 1 1 9 ARG HG2 H 3.230 -2.152 -4.494 1.00 . A A . 9 ARG HG2 1 1 15 4785 1 1 9 ARG HG3 H 2.387 -3.079 -5.779 1.00 . A A . 9 ARG HG3 1 1 15 4786 1 1 9 ARG HH11 H 6.677 -2.683 -7.127 1.00 . A A . 9 ARG HH11 1 1 15 4787 1 1 9 ARG HH12 H 7.276 -3.175 -8.675 1.00 . A A . 9 ARG HH12 1 1 15 4788 1 1 9 ARG HH21 H 4.058 -3.827 -10.056 1.00 . A A . 9 ARG HH21 1 1 15 4789 1 1 9 ARG HH22 H 5.760 -3.836 -10.370 1.00 . A A . 9 ARG HH22 1 1 15 4790 1 1 9 ARG N N 2.012 0.601 -4.392 1.00 . A A . 9 ARG N 1 1 15 4791 1 1 9 ARG NE N 4.180 -2.997 -7.635 1.00 . A A . 9 ARG NE 1 1 15 4792 1 1 9 ARG NH1 N 6.509 -3.009 -8.057 1.00 . A A . 9 ARG NH1 1 1 15 4793 1 1 9 ARG NH2 N 4.996 -3.669 -9.749 1.00 . A A . 9 ARG NH2 1 1 15 4794 1 1 9 ARG O O 3.594 1.435 -7.254 1.00 . A A . 9 ARG O 1 1 15 4795 1 1 10 ASP C C 2.038 4.645 -5.839 1.00 . A A . 10 ASP C 1 1 15 4796 1 1 10 ASP CA C 1.831 3.403 -6.610 1.00 . A A . 10 ASP CA 1 1 15 4797 1 1 10 ASP CB C 0.587 3.377 -7.272 1.00 . A A . 10 ASP CB 1 1 15 4798 1 1 10 ASP CG C 0.537 4.185 -8.565 1.00 . A A . 10 ASP CG 1 1 15 4799 1 1 10 ASP H H 1.422 2.184 -5.040 1.00 . A A . 10 ASP H 1 1 15 4800 1 1 10 ASP HA H 2.594 3.332 -7.271 1.00 . A A . 10 ASP HA 1 1 15 4801 1 1 10 ASP HB2 H 0.438 2.302 -7.469 1.00 . A A . 10 ASP HB2 1 1 15 4802 1 1 10 ASP HB3 H -0.152 3.736 -6.554 1.00 . A A . 10 ASP HB3 1 1 15 4803 1 1 10 ASP N N 1.970 2.272 -5.906 1.00 . A A . 10 ASP N 1 1 15 4804 1 1 10 ASP O O 1.999 5.725 -6.432 1.00 . A A . 10 ASP O 1 1 15 4805 1 1 10 ASP OD1 O 1.386 3.923 -9.458 1.00 . A A . 10 ASP OD1 1 1 15 4806 1 1 10 ASP OD2 O -0.344 5.078 -8.674 1.00 . A A . 10 ASP OD2 1 1 15 4807 1 1 11 . C C 2.233 6.036 -2.420 1.00 . A A . 11 DPN C 1 1 15 4808 1 1 11 . CA C 2.480 5.883 -3.889 1.00 . A A . 11 DPN CA 1 1 15 4809 1 1 11 . CB C 3.934 6.238 -4.117 1.00 . A A . 11 DPN CB 1 1 15 4810 1 1 11 . CD1 C 4.604 4.923 -6.050 1.00 . A A . 11 DPN CD1 1 1 15 4811 1 1 11 . CD2 C 4.831 4.248 -3.833 1.00 . A A . 11 DPN CD2 1 1 15 4812 1 1 11 . CE1 C 4.842 3.667 -6.410 1.00 . A A . 11 DPN CE1 1 1 15 4813 1 1 11 . CE2 C 5.134 3.088 -4.179 1.00 . A A . 11 DPN CE2 1 1 15 4814 1 1 11 . CG C 4.580 5.169 -4.716 1.00 . A A . 11 DPN CG 1 1 15 4815 1 1 11 . CZ C 5.104 2.775 -5.421 1.00 . A A . 11 DPN CZ 1 1 15 4816 1 1 11 . H H 2.241 3.708 -3.963 1.00 . A A . 11 DPN H 1 1 15 4817 1 1 11 . HA H 1.885 6.570 -4.364 1.00 . A A . 11 DPN HA 1 1 15 4818 1 1 11 . HB2 H 4.405 6.327 -3.148 1.00 . A A . 11 DPN HB2 1 1 15 4819 1 1 11 . HB3 H 4.041 7.079 -4.743 1.00 . A A . 11 DPN HB3 1 1 15 4820 1 1 11 . HD1 H 4.397 5.696 -6.776 1.00 . A A . 11 DPN HD1 1 1 15 4821 1 1 11 . HD2 H 4.863 4.506 -2.832 1.00 . A A . 11 DPN HD2 1 1 15 4822 1 1 11 . HE1 H 4.839 3.368 -7.445 1.00 . A A . 11 DPN HE1 1 1 15 4823 1 1 11 . HE2 H 5.285 2.347 -3.447 1.00 . A A . 11 DPN HE2 1 1 15 4824 1 1 11 . HZ H 5.182 1.838 -5.608 1.00 . A A . 11 DPN HZ 1 1 15 4825 1 1 11 . N N 2.212 4.590 -4.503 1.00 . A A . 11 DPN N 1 1 15 4826 1 1 11 . O O 1.250 6.640 -1.994 1.00 . A A . 11 DPN O 1 1 15 4827 1 1 12 ILE C C 4.517 5.034 0.239 1.00 . A A . 12 ILE C 1 1 15 4828 1 1 12 ILE CA C 3.206 5.661 -0.212 1.00 . A A . 12 ILE CA 1 1 15 4829 1 1 12 ILE CB C 2.050 5.024 0.497 1.00 . A A . 12 ILE CB 1 1 15 4830 1 1 12 ILE CD1 C 2.545 3.041 -0.665 1.00 . A A . 12 ILE CD1 1 1 15 4831 1 1 12 ILE CG1 C 1.477 3.976 -0.393 1.00 . A A . 12 ILE CG1 1 1 15 4832 1 1 12 ILE CG2 C 1.017 6.094 0.881 1.00 . A A . 12 ILE CG2 1 1 15 4833 1 1 12 ILE H H 3.827 4.872 -2.006 1.00 . A A . 12 ILE H 1 1 15 4834 1 1 12 ILE HA H 3.243 6.677 -0.006 1.00 . A A . 12 ILE HA 1 1 15 4835 1 1 12 ILE HB H 2.424 4.525 1.401 1.00 . A A . 12 ILE HB 1 1 15 4836 1 1 12 ILE HD11 H 2.254 2.043 -0.407 1.00 . A A . 12 ILE HD11 1 1 15 4837 1 1 12 ILE HD12 H 3.398 3.295 -0.064 1.00 . A A . 12 ILE HD12 1 1 15 4838 1 1 12 ILE HD13 H 2.834 3.103 -1.749 1.00 . A A . 12 ILE HD13 1 1 15 4839 1 1 12 ILE HG12 H 0.632 3.453 0.087 1.00 . A A . 12 ILE HG12 1 1 15 4840 1 1 12 ILE HG13 H 1.152 4.408 -1.364 1.00 . A A . 12 ILE HG13 1 1 15 4841 1 1 12 ILE HG21 H 0.035 5.863 0.416 1.00 . A A . 12 ILE HG21 1 1 15 4842 1 1 12 ILE HG22 H 1.346 7.092 0.525 1.00 . A A . 12 ILE HG22 1 1 15 4843 1 1 12 ILE HG23 H 0.887 6.130 1.983 1.00 . A A . 12 ILE HG23 1 1 15 4844 1 1 12 ILE N N 3.172 5.500 -1.635 1.00 . A A . 12 ILE N 1 1 15 4845 1 1 12 ILE O O 4.869 5.069 1.406 1.00 . A A . 12 ILE O 1 1 15 4846 1 1 13 LEU C C 7.597 4.333 -1.140 1.00 . A A . 13 LEU C 1 1 15 4847 1 1 13 LEU CA C 6.459 3.643 -0.517 1.00 . A A . 13 LEU CA 1 1 15 4848 1 1 13 LEU CB C 6.434 2.320 -1.253 1.00 . A A . 13 LEU CB 1 1 15 4849 1 1 13 LEU CD1 C 5.053 0.438 -2.012 1.00 . A A . 13 LEU CD1 1 1 15 4850 1 1 13 LEU CD2 C 4.751 1.537 0.324 1.00 . A A . 13 LEU CD2 1 1 15 4851 1 1 13 LEU CG C 5.111 1.698 -1.153 1.00 . A A . 13 LEU CG 1 1 15 4852 1 1 13 LEU H H 4.847 4.282 -1.672 1.00 . A A . 13 LEU H 1 1 15 4853 1 1 13 LEU HA H 6.609 3.501 0.531 1.00 . A A . 13 LEU HA 1 1 15 4854 1 1 13 LEU HB2 H 6.633 2.494 -2.327 1.00 . A A . 13 LEU HB2 1 1 15 4855 1 1 13 LEU HB3 H 7.190 1.631 -0.847 1.00 . A A . 13 LEU HB3 1 1 15 4856 1 1 13 LEU HD11 H 6.076 0.135 -2.304 1.00 . A A . 13 LEU HD11 1 1 15 4857 1 1 13 LEU HD12 H 4.477 0.657 -2.953 1.00 . A A . 13 LEU HD12 1 1 15 4858 1 1 13 LEU HD13 H 4.563 -0.390 -1.468 1.00 . A A . 13 LEU HD13 1 1 15 4859 1 1 13 LEU HD21 H 5.472 0.873 0.832 1.00 . A A . 13 LEU HD21 1 1 15 4860 1 1 13 LEU HD22 H 3.729 1.124 0.431 1.00 . A A . 13 LEU HD22 1 1 15 4861 1 1 13 LEU HD23 H 4.787 2.558 0.819 1.00 . A A . 13 LEU HD23 1 1 15 4862 1 1 13 LEU HG H 4.409 2.422 -1.607 1.00 . A A . 13 LEU HG 1 1 15 4863 1 1 13 LEU N N 5.217 4.370 -0.743 1.00 . A A . 13 LEU N 1 1 15 4864 1 1 13 LEU O O 8.645 4.508 -0.543 1.00 . A A . 13 LEU O 1 1 15 4865 1 1 14 GLN C C 8.671 6.633 -2.460 1.00 . A A . 14 GLN C 1 1 15 4866 1 1 14 GLN CA C 8.513 5.346 -3.125 1.00 . A A . 14 GLN CA 1 1 15 4867 1 1 14 GLN CB C 8.235 5.664 -4.591 1.00 . A A . 14 GLN CB 1 1 15 4868 1 1 14 GLN CD C 8.705 3.295 -5.011 1.00 . A A . 14 GLN CD 1 1 15 4869 1 1 14 GLN CG C 7.802 4.452 -5.344 1.00 . A A . 14 GLN CG 1 1 15 4870 1 1 14 GLN H H 6.576 4.473 -2.933 1.00 . A A . 14 GLN H 1 1 15 4871 1 1 14 GLN HA H 9.405 4.759 -3.010 1.00 . A A . 14 GLN HA 1 1 15 4872 1 1 14 GLN HB2 H 7.419 6.415 -4.644 1.00 . A A . 14 GLN HB2 1 1 15 4873 1 1 14 GLN HB3 H 9.139 6.087 -5.063 1.00 . A A . 14 GLN HB3 1 1 15 4874 1 1 14 GLN HE21 H 7.202 2.568 -3.858 1.00 . A A . 14 GLN HE21 1 1 15 4875 1 1 14 GLN HE22 H 8.648 1.598 -3.888 1.00 . A A . 14 GLN HE22 1 1 15 4876 1 1 14 GLN HG2 H 6.789 4.212 -5.015 1.00 . A A . 14 GLN HG2 1 1 15 4877 1 1 14 GLN HG3 H 7.809 4.639 -6.430 1.00 . A A . 14 GLN HG3 1 1 15 4878 1 1 14 GLN N N 7.431 4.680 -2.424 1.00 . A A . 14 GLN N 1 1 15 4879 1 1 14 GLN NE2 N 8.144 2.400 -4.183 1.00 . A A . 14 GLN NE2 1 1 15 4880 1 1 14 GLN O O 9.697 7.303 -2.553 1.00 . A A . 14 GLN O 1 1 15 4881 1 1 14 GLN OE1 O 9.861 3.223 -5.413 1.00 . A A . 14 GLN OE1 1 1 15 4882 1 1 15 ARG C C 7.829 7.895 0.367 1.00 . A A . 15 ARG C 1 1 15 4883 1 1 15 ARG CA C 7.613 8.221 -1.073 1.00 . A A . 15 ARG CA 1 1 15 4884 1 1 15 ARG CB C 6.278 8.982 -1.134 1.00 . A A . 15 ARG CB 1 1 15 4885 1 1 15 ARG CD C 3.973 8.609 -2.014 1.00 . A A . 15 ARG CD 1 1 15 4886 1 1 15 ARG CG C 5.454 8.635 -2.358 1.00 . A A . 15 ARG CG 1 1 15 4887 1 1 15 ARG CZ C 3.288 10.995 -2.219 1.00 . A A . 15 ARG CZ 1 1 15 4888 1 1 15 ARG H H 6.783 6.395 -1.688 1.00 . A A . 15 ARG H 1 1 15 4889 1 1 15 ARG HA H 8.417 8.799 -1.475 1.00 . A A . 15 ARG HA 1 1 15 4890 1 1 15 ARG HB2 H 5.674 8.757 -0.225 1.00 . A A . 15 ARG HB2 1 1 15 4891 1 1 15 ARG HB3 H 6.484 10.072 -1.143 1.00 . A A . 15 ARG HB3 1 1 15 4892 1 1 15 ARG HD2 H 3.356 8.424 -2.917 1.00 . A A . 15 ARG HD2 1 1 15 4893 1 1 15 ARG HD3 H 3.780 7.812 -1.260 1.00 . A A . 15 ARG HD3 1 1 15 4894 1 1 15 ARG HE H 3.534 10.024 -0.419 1.00 . A A . 15 ARG HE 1 1 15 4895 1 1 15 ARG HG2 H 5.643 9.374 -3.163 1.00 . A A . 15 ARG HG2 1 1 15 4896 1 1 15 ARG HG3 H 5.750 7.628 -2.726 1.00 . A A . 15 ARG HG3 1 1 15 4897 1 1 15 ARG HH11 H 3.598 10.002 -3.991 1.00 . A A . 15 ARG HH11 1 1 15 4898 1 1 15 ARG HH12 H 3.125 11.658 -4.159 1.00 . A A . 15 ARG HH12 1 1 15 4899 1 1 15 ARG HH21 H 2.892 12.273 -0.660 1.00 . A A . 15 ARG HH21 1 1 15 4900 1 1 15 ARG HH22 H 2.718 12.970 -2.236 1.00 . A A . 15 ARG HH22 1 1 15 4901 1 1 15 ARG N N 7.606 6.991 -1.759 1.00 . A A . 15 ARG N 1 1 15 4902 1 1 15 ARG NE N 3.583 9.926 -1.418 1.00 . A A . 15 ARG NE 1 1 15 4903 1 1 15 ARG NH1 N 3.341 10.876 -3.578 1.00 . A A . 15 ARG NH1 1 1 15 4904 1 1 15 ARG NH2 N 2.935 12.186 -1.655 1.00 . A A . 15 ARG NH2 1 1 15 4905 1 1 15 ARG O O 8.425 8.667 1.115 1.00 . A A . 15 ARG O 1 1 15 4906 1 1 16 LYS C C 6.508 7.220 2.914 1.00 . A A . 16 LYS C 1 1 15 4907 1 1 16 LYS CA C 7.336 6.249 2.133 1.00 . A A . 16 LYS CA 1 1 15 4908 1 1 16 LYS CB C 8.718 6.231 2.770 1.00 . A A . 16 LYS CB 1 1 15 4909 1 1 16 LYS CD C 9.226 3.784 2.289 1.00 . A A . 16 LYS CD 1 1 15 4910 1 1 16 LYS CE C 10.312 2.769 1.919 1.00 . A A . 16 LYS CE 1 1 15 4911 1 1 16 LYS CG C 9.696 5.236 2.145 1.00 . A A . 16 LYS CG 1 1 15 4912 1 1 16 LYS H H 6.882 6.076 0.124 1.00 . A A . 16 LYS H 1 1 15 4913 1 1 16 LYS HA H 6.869 5.268 2.150 1.00 . A A . 16 LYS HA 1 1 15 4914 1 1 16 LYS HB2 H 9.130 7.247 2.669 1.00 . A A . 16 LYS HB2 1 1 15 4915 1 1 16 LYS HB3 H 8.608 6.007 3.846 1.00 . A A . 16 LYS HB3 1 1 15 4916 1 1 16 LYS HD2 H 8.908 3.607 3.338 1.00 . A A . 16 LYS HD2 1 1 15 4917 1 1 16 LYS HD3 H 8.341 3.625 1.634 1.00 . A A . 16 LYS HD3 1 1 15 4918 1 1 16 LYS HE2 H 11.227 2.941 2.523 1.00 . A A . 16 LYS HE2 1 1 15 4919 1 1 16 LYS HE3 H 9.948 1.732 2.085 1.00 . A A . 16 LYS HE3 1 1 15 4920 1 1 16 LYS HG2 H 9.825 5.476 1.070 1.00 . A A . 16 LYS HG2 1 1 15 4921 1 1 16 LYS HG3 H 10.686 5.345 2.638 1.00 . A A . 16 LYS HG3 1 1 15 4922 1 1 16 LYS HZ1 H 11.632 3.308 0.416 1.00 . A A . 16 LYS HZ1 1 1 15 4923 1 1 16 LYS HZ2 H 9.992 3.535 0.019 1.00 . A A . 16 LYS HZ2 1 1 15 4924 1 1 16 LYS HZ3 H 10.658 1.968 0.040 1.00 . A A . 16 LYS HZ3 1 1 15 4925 1 1 16 LYS N N 7.301 6.703 0.768 1.00 . A A . 16 LYS N 1 1 15 4926 1 1 16 LYS NZ N 10.677 2.903 0.493 1.00 . A A . 16 LYS NZ 1 1 15 4927 1 1 16 LYS O O 6.666 7.394 4.121 1.00 . A A . 16 LYS O 1 1 15 4928 1 1 17 LYS C C 5.578 9.965 3.377 1.00 . A A . 17 LYS C 1 1 15 4929 1 1 17 LYS CA C 4.721 8.860 2.726 1.00 . A A . 17 LYS CA 1 1 15 4930 1 1 17 LYS CB C 3.689 8.334 3.744 1.00 . A A . 17 LYS CB 1 1 15 4931 1 1 17 LYS CD C 1.921 9.781 2.631 1.00 . A A . 17 LYS CD 1 1 15 4932 1 1 17 LYS CE C 1.635 9.777 1.129 1.00 . A A . 17 LYS CE 1 1 15 4933 1 1 17 LYS CG C 2.279 8.390 3.167 1.00 . A A . 17 LYS CG 1 1 15 4934 1 1 17 LYS H H 5.456 7.625 1.234 1.00 . A A . 17 LYS H 1 1 15 4935 1 1 17 LYS HA H 4.211 9.283 1.873 1.00 . A A . 17 LYS HA 1 1 15 4936 1 1 17 LYS HB2 H 3.939 7.282 4.009 1.00 . A A . 17 LYS HB2 1 1 15 4937 1 1 17 LYS HB3 H 3.723 8.943 4.671 1.00 . A A . 17 LYS HB3 1 1 15 4938 1 1 17 LYS HD2 H 1.031 10.165 3.169 1.00 . A A . 17 LYS HD2 1 1 15 4939 1 1 17 LYS HD3 H 2.767 10.473 2.828 1.00 . A A . 17 LYS HD3 1 1 15 4940 1 1 17 LYS HE2 H 1.791 10.791 0.702 1.00 . A A . 17 LYS HE2 1 1 15 4941 1 1 17 LYS HE3 H 2.305 9.053 0.609 1.00 . A A . 17 LYS HE3 1 1 15 4942 1 1 17 LYS HG2 H 2.211 7.657 2.340 1.00 . A A . 17 LYS HG2 1 1 15 4943 1 1 17 LYS HG3 H 1.549 8.098 3.953 1.00 . A A . 17 LYS HG3 1 1 15 4944 1 1 17 LYS HZ1 H -0.104 8.774 1.638 1.00 . A A . 17 LYS HZ1 1 1 15 4945 1 1 17 LYS HZ2 H 0.184 8.862 -0.034 1.00 . A A . 17 LYS HZ2 1 1 15 4946 1 1 17 LYS HZ3 H -0.360 10.232 0.809 1.00 . A A . 17 LYS HZ3 1 1 15 4947 1 1 17 LYS N N 5.587 7.853 2.188 1.00 . A A . 17 LYS N 1 1 15 4948 1 1 17 LYS NZ N 0.234 9.383 0.866 1.00 . A A . 17 LYS NZ 1 1 15 4949 1 1 17 LYS O O 6.137 10.800 2.614 1.00 . A A . 17 LYS O 1 1 15 4950 1 1 17 LYS OXT O 5.672 9.999 4.636 1.00 . A A . 17 LYS OXT 1 1 16 4951 1 1 1 GLU C C -1.814 -8.679 -3.892 1.00 . A A . 1 GLU C 1 1 16 4952 1 1 1 GLU CA C -1.070 -9.627 -4.790 1.00 . A A . 1 GLU CA 1 1 16 4953 1 1 1 GLU CB C -1.653 -11.044 -4.611 1.00 . A A . 1 GLU CB 1 1 16 4954 1 1 1 GLU CD C -3.604 -12.580 -4.871 1.00 . A A . 1 GLU CD 1 1 16 4955 1 1 1 GLU CG C -3.132 -11.138 -5.026 1.00 . A A . 1 GLU CG 1 1 16 4956 1 1 1 GLU H1 H 0.497 -9.626 -3.421 1.00 . A A . 1 GLU H1 1 1 16 4957 1 1 1 GLU H2 H 0.830 -8.782 -4.858 1.00 . A A . 1 GLU H2 1 1 16 4958 1 1 1 GLU H3 H 0.826 -10.480 -4.853 1.00 . A A . 1 GLU H3 1 1 16 4959 1 1 1 GLU HA H -1.169 -9.304 -5.814 1.00 . A A . 1 GLU HA 1 1 16 4960 1 1 1 GLU HB2 H -1.055 -11.756 -5.223 1.00 . A A . 1 GLU HB2 1 1 16 4961 1 1 1 GLU HB3 H -1.557 -11.344 -3.545 1.00 . A A . 1 GLU HB3 1 1 16 4962 1 1 1 GLU HG2 H -3.752 -10.477 -4.384 1.00 . A A . 1 GLU HG2 1 1 16 4963 1 1 1 GLU HG3 H -3.254 -10.830 -6.085 1.00 . A A . 1 GLU HG3 1 1 16 4964 1 1 1 GLU N N 0.379 -9.629 -4.456 1.00 . A A . 1 GLU N 1 1 16 4965 1 1 1 GLU O O -2.136 -9.006 -2.750 1.00 . A A . 1 GLU O 1 1 16 4966 1 1 1 GLU OE1 O -2.780 -13.437 -4.452 1.00 . A A . 1 GLU OE1 1 1 16 4967 1 1 1 GLU OE2 O -4.797 -12.843 -5.172 1.00 . A A . 1 GLU OE2 1 1 16 4968 1 1 2 MET C C -3.844 -5.870 -4.503 1.00 . A A . 2 MET C 1 1 16 4969 1 1 2 MET CA C -2.819 -6.490 -3.626 1.00 . A A . 2 MET CA 1 1 16 4970 1 1 2 MET CB C -1.923 -5.391 -3.025 1.00 . A A . 2 MET CB 1 1 16 4971 1 1 2 MET CE C -4.154 -5.433 -0.992 1.00 . A A . 2 MET CE 1 1 16 4972 1 1 2 MET CG C -1.539 -5.616 -1.552 1.00 . A A . 2 MET CG 1 1 16 4973 1 1 2 MET H H -1.859 -7.201 -5.336 1.00 . A A . 2 MET H 1 1 16 4974 1 1 2 MET HA H -3.352 -6.994 -2.850 1.00 . A A . 2 MET HA 1 1 16 4975 1 1 2 MET HB2 H -0.989 -5.344 -3.623 1.00 . A A . 2 MET HB2 1 1 16 4976 1 1 2 MET HB3 H -2.429 -4.403 -3.109 1.00 . A A . 2 MET HB3 1 1 16 4977 1 1 2 MET HE1 H -3.804 -4.608 -1.643 1.00 . A A . 2 MET HE1 1 1 16 4978 1 1 2 MET HE2 H -4.609 -4.986 -0.083 1.00 . A A . 2 MET HE2 1 1 16 4979 1 1 2 MET HE3 H -4.947 -5.987 -1.541 1.00 . A A . 2 MET HE3 1 1 16 4980 1 1 2 MET HG2 H -0.570 -6.155 -1.519 1.00 . A A . 2 MET HG2 1 1 16 4981 1 1 2 MET HG3 H -1.378 -4.613 -1.100 1.00 . A A . 2 MET HG3 1 1 16 4982 1 1 2 MET N N -2.109 -7.467 -4.408 1.00 . A A . 2 MET N 1 1 16 4983 1 1 2 MET O O -4.002 -6.224 -5.669 1.00 . A A . 2 MET O 1 1 16 4984 1 1 2 MET SD S -2.774 -6.524 -0.562 1.00 . A A . 2 MET SD 1 1 16 4985 1 1 3 ARG C C -5.356 -2.852 -4.601 1.00 . A A . 3 ARG C 1 1 16 4986 1 1 3 ARG CA C -5.624 -4.270 -4.577 1.00 . A A . 3 ARG CA 1 1 16 4987 1 1 3 ARG CB C -6.874 -4.454 -3.758 1.00 . A A . 3 ARG CB 1 1 16 4988 1 1 3 ARG CD C -8.556 -2.755 -4.457 1.00 . A A . 3 ARG CD 1 1 16 4989 1 1 3 ARG CG C -8.146 -4.219 -4.544 1.00 . A A . 3 ARG CG 1 1 16 4990 1 1 3 ARG CZ C -10.353 -1.422 -3.385 1.00 . A A . 3 ARG CZ 1 1 16 4991 1 1 3 ARG H H -4.382 -4.564 -3.014 1.00 . A A . 3 ARG H 1 1 16 4992 1 1 3 ARG HA H -5.709 -4.625 -5.536 1.00 . A A . 3 ARG HA 1 1 16 4993 1 1 3 ARG HB2 H -6.866 -5.478 -3.331 1.00 . A A . 3 ARG HB2 1 1 16 4994 1 1 3 ARG HB3 H -6.825 -3.720 -2.912 1.00 . A A . 3 ARG HB3 1 1 16 4995 1 1 3 ARG HD2 H -7.741 -2.167 -3.965 1.00 . A A . 3 ARG HD2 1 1 16 4996 1 1 3 ARG HD3 H -8.767 -2.340 -5.464 1.00 . A A . 3 ARG HD3 1 1 16 4997 1 1 3 ARG HE H -10.209 -3.468 -3.241 1.00 . A A . 3 ARG HE 1 1 16 4998 1 1 3 ARG HG2 H -7.974 -4.496 -5.605 1.00 . A A . 3 ARG HG2 1 1 16 4999 1 1 3 ARG HG3 H -8.955 -4.860 -4.138 1.00 . A A . 3 ARG HG3 1 1 16 5000 1 1 3 ARG HH11 H -8.963 -0.367 -4.468 1.00 . A A . 3 ARG HH11 1 1 16 5001 1 1 3 ARG HH12 H -10.199 0.599 -3.735 1.00 . A A . 3 ARG HH12 1 1 16 5002 1 1 3 ARG HH21 H -11.893 -2.158 -2.241 1.00 . A A . 3 ARG HH21 1 1 16 5003 1 1 3 ARG HH22 H -11.894 -0.438 -2.445 1.00 . A A . 3 ARG HH22 1 1 16 5004 1 1 3 ARG N N -4.563 -4.902 -3.924 1.00 . A A . 3 ARG N 1 1 16 5005 1 1 3 ARG NE N -9.791 -2.644 -3.625 1.00 . A A . 3 ARG NE 1 1 16 5006 1 1 3 ARG NH1 N -9.788 -0.296 -3.909 1.00 . A A . 3 ARG NH1 1 1 16 5007 1 1 3 ARG NH2 N -11.480 -1.330 -2.623 1.00 . A A . 3 ARG NH2 1 1 16 5008 1 1 3 ARG O O -5.753 -2.115 -5.501 1.00 . A A . 3 ARG O 1 1 16 5009 1 1 4 LEU C C -3.437 -0.815 -4.482 1.00 . A A . 4 LEU C 1 1 16 5010 1 1 4 LEU CA C -4.337 -1.120 -3.394 1.00 . A A . 4 LEU CA 1 1 16 5011 1 1 4 LEU CB C -3.558 -0.886 -2.124 1.00 . A A . 4 LEU CB 1 1 16 5012 1 1 4 LEU CD1 C -2.540 -1.884 -0.137 1.00 . A A . 4 LEU CD1 1 1 16 5013 1 1 4 LEU CD2 C -5.035 -2.259 -0.636 1.00 . A A . 4 LEU CD2 1 1 16 5014 1 1 4 LEU CG C -3.625 -2.042 -1.188 1.00 . A A . 4 LEU CG 1 1 16 5015 1 1 4 LEU H H -4.259 -3.094 -2.927 1.00 . A A . 4 LEU H 1 1 16 5016 1 1 4 LEU HA H -5.168 -0.518 -3.446 1.00 . A A . 4 LEU HA 1 1 16 5017 1 1 4 LEU HB2 H -2.521 -0.673 -2.361 1.00 . A A . 4 LEU HB2 1 1 16 5018 1 1 4 LEU HB3 H -3.979 -0.022 -1.601 1.00 . A A . 4 LEU HB3 1 1 16 5019 1 1 4 LEU HD11 H -1.783 -2.692 -0.264 1.00 . A A . 4 LEU HD11 1 1 16 5020 1 1 4 LEU HD12 H -2.960 -1.924 0.886 1.00 . A A . 4 LEU HD12 1 1 16 5021 1 1 4 LEU HD13 H -2.023 -0.904 -0.292 1.00 . A A . 4 LEU HD13 1 1 16 5022 1 1 4 LEU HD21 H -5.630 -2.865 -1.365 1.00 . A A . 4 LEU HD21 1 1 16 5023 1 1 4 LEU HD22 H -5.542 -1.282 -0.487 1.00 . A A . 4 LEU HD22 1 1 16 5024 1 1 4 LEU HD23 H -4.997 -2.798 0.331 1.00 . A A . 4 LEU HD23 1 1 16 5025 1 1 4 LEU HG H -3.352 -2.917 -1.785 1.00 . A A . 4 LEU HG 1 1 16 5026 1 1 4 LEU N N -4.643 -2.457 -3.582 1.00 . A A . 4 LEU N 1 1 16 5027 1 1 4 LEU O O -3.818 -0.076 -5.362 1.00 . A A . 4 LEU O 1 1 16 5028 1 1 5 SER C C -1.149 -1.026 -6.601 1.00 . A A . 5 SER C 1 1 16 5029 1 1 5 SER CA C -1.189 -1.733 -5.270 1.00 . A A . 5 SER CA 1 1 16 5030 1 1 5 SER CB C -0.735 -3.151 -5.358 1.00 . A A . 5 SER CB 1 1 16 5031 1 1 5 SER H H -2.480 -2.450 -3.861 1.00 . A A . 5 SER H 1 1 16 5032 1 1 5 SER HA H -0.487 -1.211 -4.631 1.00 . A A . 5 SER HA 1 1 16 5033 1 1 5 SER HB2 H 0.335 -3.184 -5.079 1.00 . A A . 5 SER HB2 1 1 16 5034 1 1 5 SER HB3 H -1.336 -3.718 -4.594 1.00 . A A . 5 SER HB3 1 1 16 5035 1 1 5 SER HG H -0.459 -3.165 -7.267 1.00 . A A . 5 SER HG 1 1 16 5036 1 1 5 SER N N -2.428 -1.705 -4.505 1.00 . A A . 5 SER N 1 1 16 5037 1 1 5 SER O O -0.130 -0.987 -7.276 1.00 . A A . 5 SER O 1 1 16 5038 1 1 5 SER OG O -0.934 -3.728 -6.647 1.00 . A A . 5 SER OG 1 1 16 5039 1 1 6 LYS C C -1.987 1.665 -7.233 1.00 . A A . 6 LYS C 1 1 16 5040 1 1 6 LYS CA C -2.273 0.420 -8.074 1.00 . A A . 6 LYS CA 1 1 16 5041 1 1 6 LYS CB C -3.628 0.588 -8.769 1.00 . A A . 6 LYS CB 1 1 16 5042 1 1 6 LYS CD C -5.537 -0.608 -9.949 1.00 . A A . 6 LYS CD 1 1 16 5043 1 1 6 LYS CE C -5.747 0.426 -11.058 1.00 . A A . 6 LYS CE 1 1 16 5044 1 1 6 LYS CG C -4.082 -0.687 -9.482 1.00 . A A . 6 LYS CG 1 1 16 5045 1 1 6 LYS H H -3.144 -0.708 -6.599 1.00 . A A . 6 LYS H 1 1 16 5046 1 1 6 LYS HA H -1.460 0.222 -8.762 1.00 . A A . 6 LYS HA 1 1 16 5047 1 1 6 LYS HB2 H -4.389 0.881 -8.014 1.00 . A A . 6 LYS HB2 1 1 16 5048 1 1 6 LYS HB3 H -3.545 1.409 -9.513 1.00 . A A . 6 LYS HB3 1 1 16 5049 1 1 6 LYS HD2 H -5.852 -1.606 -10.318 1.00 . A A . 6 LYS HD2 1 1 16 5050 1 1 6 LYS HD3 H -6.176 -0.345 -9.079 1.00 . A A . 6 LYS HD3 1 1 16 5051 1 1 6 LYS HE2 H -5.521 1.448 -10.688 1.00 . A A . 6 LYS HE2 1 1 16 5052 1 1 6 LYS HE3 H -5.100 0.198 -11.932 1.00 . A A . 6 LYS HE3 1 1 16 5053 1 1 6 LYS HG2 H -3.428 -0.866 -10.361 1.00 . A A . 6 LYS HG2 1 1 16 5054 1 1 6 LYS HG3 H -3.970 -1.550 -8.790 1.00 . A A . 6 LYS HG3 1 1 16 5055 1 1 6 LYS HZ1 H -7.496 1.385 -11.619 1.00 . A A . 6 LYS HZ1 1 1 16 5056 1 1 6 LYS HZ2 H -7.739 -0.091 -10.813 1.00 . A A . 6 LYS HZ2 1 1 16 5057 1 1 6 LYS HZ3 H -7.216 -0.080 -12.428 1.00 . A A . 6 LYS HZ3 1 1 16 5058 1 1 6 LYS N N -2.259 -0.512 -7.025 1.00 . A A . 6 LYS N 1 1 16 5059 1 1 6 LYS NZ N -7.154 0.409 -11.513 1.00 . A A . 6 LYS NZ 1 1 16 5060 1 1 6 LYS O O -1.990 2.796 -7.711 1.00 . A A . 6 LYS O 1 1 16 5061 1 1 7 PHE C C -0.397 2.527 -4.245 1.00 . A A . 7 PHE C 1 1 16 5062 1 1 7 PHE CA C -1.668 2.270 -4.816 1.00 . A A . 7 PHE CA 1 1 16 5063 1 1 7 PHE CB C -2.273 1.622 -3.603 1.00 . A A . 7 PHE CB 1 1 16 5064 1 1 7 PHE CD1 C -3.916 2.121 -1.955 1.00 . A A . 7 PHE CD1 1 1 16 5065 1 1 7 PHE CD2 C -1.805 3.133 -1.898 1.00 . A A . 7 PHE CD2 1 1 16 5066 1 1 7 PHE CE1 C -4.171 2.641 -0.748 1.00 . A A . 7 PHE CE1 1 1 16 5067 1 1 7 PHE CE2 C -1.998 3.686 -0.761 1.00 . A A . 7 PHE CE2 1 1 16 5068 1 1 7 PHE CG C -2.752 2.374 -2.522 1.00 . A A . 7 PHE CG 1 1 16 5069 1 1 7 PHE CZ C -3.209 3.457 -0.110 1.00 . A A . 7 PHE CZ 1 1 16 5070 1 1 7 PHE H H -1.796 0.410 -5.509 1.00 . A A . 7 PHE H 1 1 16 5071 1 1 7 PHE HA H -2.199 3.161 -5.000 1.00 . A A . 7 PHE HA 1 1 16 5072 1 1 7 PHE HB2 H -3.201 1.214 -3.959 1.00 . A A . 7 PHE HB2 1 1 16 5073 1 1 7 PHE HB3 H -1.691 0.780 -3.203 1.00 . A A . 7 PHE HB3 1 1 16 5074 1 1 7 PHE HD1 H -4.642 1.481 -2.468 1.00 . A A . 7 PHE HD1 1 1 16 5075 1 1 7 PHE HD2 H -0.869 3.324 -2.357 1.00 . A A . 7 PHE HD2 1 1 16 5076 1 1 7 PHE HE1 H -5.087 2.382 -0.297 1.00 . A A . 7 PHE HE1 1 1 16 5077 1 1 7 PHE HE2 H -1.146 4.254 -0.369 1.00 . A A . 7 PHE HE2 1 1 16 5078 1 1 7 PHE HZ H -3.403 3.883 0.864 1.00 . A A . 7 PHE HZ 1 1 16 5079 1 1 7 PHE N N -1.880 1.383 -5.867 1.00 . A A . 7 PHE N 1 1 16 5080 1 1 7 PHE O O 0.049 3.633 -4.240 1.00 . A A . 7 PHE O 1 1 16 5081 1 1 8 PHE C C 2.196 1.506 -3.487 1.00 . A A . 8 PHE C 1 1 16 5082 1 1 8 PHE CA C 1.140 1.692 -2.670 1.00 . A A . 8 PHE CA 1 1 16 5083 1 1 8 PHE CB C 1.504 0.630 -1.689 1.00 . A A . 8 PHE CB 1 1 16 5084 1 1 8 PHE CD1 C 1.984 -1.471 -2.262 1.00 . A A . 8 PHE CD1 1 1 16 5085 1 1 8 PHE CD2 C -0.223 -0.865 -1.980 1.00 . A A . 8 PHE CD2 1 1 16 5086 1 1 8 PHE CE1 C 1.673 -2.645 -2.613 1.00 . A A . 8 PHE CE1 1 1 16 5087 1 1 8 PHE CE2 C -0.571 -2.071 -2.332 1.00 . A A . 8 PHE CE2 1 1 16 5088 1 1 8 PHE CG C 1.035 -0.592 -1.951 1.00 . A A . 8 PHE CG 1 1 16 5089 1 1 8 PHE CZ C 0.382 -2.974 -2.660 1.00 . A A . 8 PHE CZ 1 1 16 5090 1 1 8 PHE H H -0.229 0.572 -3.655 1.00 . A A . 8 PHE H 1 1 16 5091 1 1 8 PHE HA H 1.151 2.649 -2.323 1.00 . A A . 8 PHE HA 1 1 16 5092 1 1 8 PHE HB2 H 2.565 0.530 -1.551 1.00 . A A . 8 PHE HB2 1 1 16 5093 1 1 8 PHE HB3 H 1.012 0.883 -0.750 1.00 . A A . 8 PHE HB3 1 1 16 5094 1 1 8 PHE HD1 H 3.027 -1.182 -2.222 1.00 . A A . 8 PHE HD1 1 1 16 5095 1 1 8 PHE HD2 H -0.947 -0.121 -1.702 1.00 . A A . 8 PHE HD2 1 1 16 5096 1 1 8 PHE HE1 H 2.442 -3.298 -2.878 1.00 . A A . 8 PHE HE1 1 1 16 5097 1 1 8 PHE HE2 H -1.578 -2.298 -2.399 1.00 . A A . 8 PHE HE2 1 1 16 5098 1 1 8 PHE HZ H 0.118 -3.903 -2.943 1.00 . A A . 8 PHE HZ 1 1 16 5099 1 1 8 PHE N N 0.110 1.485 -3.572 1.00 . A A . 8 PHE N 1 1 16 5100 1 1 8 PHE O O 3.116 2.172 -3.446 1.00 . A A . 8 PHE O 1 1 16 5101 1 1 9 ARG C C 2.912 1.296 -6.165 1.00 . A A . 9 ARG C 1 1 16 5102 1 1 9 ARG CA C 2.879 0.188 -5.261 1.00 . A A . 9 ARG CA 1 1 16 5103 1 1 9 ARG CB C 2.411 -1.038 -5.970 1.00 . A A . 9 ARG CB 1 1 16 5104 1 1 9 ARG CD C 4.368 -2.631 -6.075 1.00 . A A . 9 ARG CD 1 1 16 5105 1 1 9 ARG CG C 3.021 -2.320 -5.432 1.00 . A A . 9 ARG CG 1 1 16 5106 1 1 9 ARG CZ C 5.183 -3.406 -8.287 1.00 . A A . 9 ARG CZ 1 1 16 5107 1 1 9 ARG H H 1.105 0.108 -4.351 1.00 . A A . 9 ARG H 1 1 16 5108 1 1 9 ARG HA H 3.782 0.079 -4.783 1.00 . A A . 9 ARG HA 1 1 16 5109 1 1 9 ARG HB2 H 1.302 -1.070 -5.795 1.00 . A A . 9 ARG HB2 1 1 16 5110 1 1 9 ARG HB3 H 2.605 -0.932 -7.053 1.00 . A A . 9 ARG HB3 1 1 16 5111 1 1 9 ARG HD2 H 4.984 -1.708 -6.142 1.00 . A A . 9 ARG HD2 1 1 16 5112 1 1 9 ARG HD3 H 4.910 -3.409 -5.500 1.00 . A A . 9 ARG HD3 1 1 16 5113 1 1 9 ARG HE H 3.194 -3.297 -7.776 1.00 . A A . 9 ARG HE 1 1 16 5114 1 1 9 ARG HG2 H 3.165 -2.214 -4.344 1.00 . A A . 9 ARG HG2 1 1 16 5115 1 1 9 ARG HG3 H 2.319 -3.162 -5.613 1.00 . A A . 9 ARG HG3 1 1 16 5116 1 1 9 ARG HH11 H 6.627 -2.861 -6.931 1.00 . A A . 9 ARG HH11 1 1 16 5117 1 1 9 ARG HH12 H 7.233 -3.393 -8.464 1.00 . A A . 9 ARG HH12 1 1 16 5118 1 1 9 ARG HH21 H 4.016 -4.021 -9.862 1.00 . A A . 9 ARG HH21 1 1 16 5119 1 1 9 ARG HH22 H 5.721 -4.064 -10.159 1.00 . A A . 9 ARG HH22 1 1 16 5120 1 1 9 ARG N N 1.978 0.553 -4.319 1.00 . A A . 9 ARG N 1 1 16 5121 1 1 9 ARG NE N 4.131 -3.145 -7.456 1.00 . A A . 9 ARG NE 1 1 16 5122 1 1 9 ARG NH1 N 6.462 -3.202 -7.856 1.00 . A A . 9 ARG NH1 1 1 16 5123 1 1 9 ARG NH2 N 4.953 -3.872 -9.549 1.00 . A A . 9 ARG NH2 1 1 16 5124 1 1 9 ARG O O 3.607 1.300 -7.181 1.00 . A A . 9 ARG O 1 1 16 5125 1 1 10 ASP C C 2.067 4.560 -5.861 1.00 . A A . 10 ASP C 1 1 16 5126 1 1 10 ASP CA C 1.855 3.303 -6.607 1.00 . A A . 10 ASP CA 1 1 16 5127 1 1 10 ASP CB C 0.613 3.261 -7.278 1.00 . A A . 10 ASP CB 1 1 16 5128 1 1 10 ASP CG C 0.599 3.936 -8.646 1.00 . A A . 10 ASP CG 1 1 16 5129 1 1 10 ASP H H 1.416 2.126 -5.015 1.00 . A A . 10 ASP H 1 1 16 5130 1 1 10 ASP HA H 2.623 3.209 -7.259 1.00 . A A . 10 ASP HA 1 1 16 5131 1 1 10 ASP HB2 H 0.428 2.177 -7.374 1.00 . A A . 10 ASP HB2 1 1 16 5132 1 1 10 ASP HB3 H -0.119 3.714 -6.607 1.00 . A A . 10 ASP HB3 1 1 16 5133 1 1 10 ASP N N 1.975 2.188 -5.875 1.00 . A A . 10 ASP N 1 1 16 5134 1 1 10 ASP O O 2.054 5.628 -6.477 1.00 . A A . 10 ASP O 1 1 16 5135 1 1 10 ASP OD1 O 0.893 3.235 -9.650 1.00 . A A . 10 ASP OD1 1 1 16 5136 1 1 10 ASP OD2 O 0.296 5.157 -8.705 1.00 . A A . 10 ASP OD2 1 1 16 5137 1 1 11 . C C 2.237 6.023 -2.468 1.00 . A A . 11 DPN C 1 1 16 5138 1 1 11 . CA C 2.500 5.836 -3.931 1.00 . A A . 11 DPN CA 1 1 16 5139 1 1 11 . CB C 3.960 6.173 -4.152 1.00 . A A . 11 DPN CB 1 1 16 5140 1 1 11 . CD1 C 4.639 4.804 -6.041 1.00 . A A . 11 DPN CD1 1 1 16 5141 1 1 11 . CD2 C 4.832 4.181 -3.807 1.00 . A A . 11 DPN CD2 1 1 16 5142 1 1 11 . CE1 C 4.864 3.537 -6.369 1.00 . A A . 11 DPN CE1 1 1 16 5143 1 1 11 . CE2 C 5.127 3.009 -4.120 1.00 . A A . 11 DPN CE2 1 1 16 5144 1 1 11 . CG C 4.602 5.082 -4.715 1.00 . A A . 11 DPN CG 1 1 16 5145 1 1 11 . CZ C 5.106 2.666 -5.355 1.00 . A A . 11 DPN CZ 1 1 16 5146 1 1 11 . H H 2.237 3.665 -3.962 1.00 . A A . 11 DPN H 1 1 16 5147 1 1 11 . HA H 1.917 6.518 -4.427 1.00 . A A . 11 DPN HA 1 1 16 5148 1 1 11 . HB2 H 4.420 6.283 -3.180 1.00 . A A . 11 DPN HB2 1 1 16 5149 1 1 11 . HB3 H 4.082 6.997 -4.798 1.00 . A A . 11 DPN HB3 1 1 16 5150 1 1 11 . HD1 H 4.449 5.561 -6.789 1.00 . A A . 11 DPN HD1 1 1 16 5151 1 1 11 . HD2 H 4.858 4.464 -2.811 1.00 . A A . 11 DPN HD2 1 1 16 5152 1 1 11 . HE1 H 4.869 3.213 -7.395 1.00 . A A . 11 DPN HE1 1 1 16 5153 1 1 11 . HE2 H 5.259 2.284 -3.370 1.00 . A A . 11 DPN HE2 1 1 16 5154 1 1 11 . HZ H 5.174 1.723 -5.520 1.00 . A A . 11 DPN HZ 1 1 16 5155 1 1 11 . N N 2.225 4.533 -4.521 1.00 . A A . 11 DPN N 1 1 16 5156 1 1 11 . O O 1.253 6.642 -2.069 1.00 . A A . 11 DPN O 1 1 16 5157 1 1 12 ILE C C 4.480 5.060 0.244 1.00 . A A . 12 ILE C 1 1 16 5158 1 1 12 ILE CA C 3.180 5.690 -0.238 1.00 . A A . 12 ILE CA 1 1 16 5159 1 1 12 ILE CB C 2.008 5.080 0.470 1.00 . A A . 12 ILE CB 1 1 16 5160 1 1 12 ILE CD1 C 2.491 3.067 -0.641 1.00 . A A . 12 ILE CD1 1 1 16 5161 1 1 12 ILE CG1 C 1.434 4.019 -0.405 1.00 . A A . 12 ILE CG1 1 1 16 5162 1 1 12 ILE CG2 C 0.981 6.169 0.815 1.00 . A A . 12 ILE CG2 1 1 16 5163 1 1 12 ILE H H 3.816 4.858 -2.008 1.00 . A A . 12 ILE H 1 1 16 5164 1 1 12 ILE HA H 3.225 6.709 -0.054 1.00 . A A . 12 ILE HA 1 1 16 5165 1 1 12 ILE HB H 2.366 4.597 1.389 1.00 . A A . 12 ILE HB 1 1 16 5166 1 1 12 ILE HD11 H 3.345 3.330 -0.051 1.00 . A A . 12 ILE HD11 1 1 16 5167 1 1 12 ILE HD12 H 2.790 3.099 -1.725 1.00 . A A . 12 ILE HD12 1 1 16 5168 1 1 12 ILE HD13 H 2.178 2.077 -0.350 1.00 . A A . 12 ILE HD13 1 1 16 5169 1 1 12 ILE HG12 H 0.577 3.517 0.077 1.00 . A A . 12 ILE HG12 1 1 16 5170 1 1 12 ILE HG13 H 1.126 4.434 -1.387 1.00 . A A . 12 ILE HG13 1 1 16 5171 1 1 12 ILE HG21 H 1.305 7.145 0.402 1.00 . A A . 12 ILE HG21 1 1 16 5172 1 1 12 ILE HG22 H 0.872 6.263 1.916 1.00 . A A . 12 ILE HG22 1 1 16 5173 1 1 12 ILE HG23 H -0.008 5.914 0.381 1.00 . A A . 12 ILE HG23 1 1 16 5174 1 1 12 ILE N N 3.162 5.497 -1.659 1.00 . A A . 12 ILE N 1 1 16 5175 1 1 12 ILE O O 4.827 5.129 1.412 1.00 . A A . 12 ILE O 1 1 16 5176 1 1 13 LEU C C 7.561 4.287 -1.073 1.00 . A A . 13 LEU C 1 1 16 5177 1 1 13 LEU CA C 6.408 3.624 -0.454 1.00 . A A . 13 LEU CA 1 1 16 5178 1 1 13 LEU CB C 6.378 2.288 -1.164 1.00 . A A . 13 LEU CB 1 1 16 5179 1 1 13 LEU CD1 C 4.984 0.408 -1.906 1.00 . A A . 13 LEU CD1 1 1 16 5180 1 1 13 LEU CD2 C 4.664 1.558 0.403 1.00 . A A . 13 LEU CD2 1 1 16 5181 1 1 13 LEU CG C 5.046 1.684 -1.072 1.00 . A A . 13 LEU CG 1 1 16 5182 1 1 13 LEU H H 4.817 4.254 -1.643 1.00 . A A . 13 LEU H 1 1 16 5183 1 1 13 LEU HA H 6.543 3.502 0.599 1.00 . A A . 13 LEU HA 1 1 16 5184 1 1 13 LEU HB2 H 6.595 2.439 -2.239 1.00 . A A . 13 LEU HB2 1 1 16 5185 1 1 13 LEU HB3 H 7.119 1.598 -0.734 1.00 . A A . 13 LEU HB3 1 1 16 5186 1 1 13 LEU HD11 H 4.490 -0.407 -1.349 1.00 . A A . 13 LEU HD11 1 1 16 5187 1 1 13 LEU HD12 H 6.010 0.097 -2.190 1.00 . A A . 13 LEU HD12 1 1 16 5188 1 1 13 LEU HD13 H 4.412 0.610 -2.851 1.00 . A A . 13 LEU HD13 1 1 16 5189 1 1 13 LEU HD21 H 3.636 1.158 0.505 1.00 . A A . 13 LEU HD21 1 1 16 5190 1 1 13 LEU HD22 H 4.702 2.590 0.876 1.00 . A A . 13 LEU HD22 1 1 16 5191 1 1 13 LEU HD23 H 5.374 0.899 0.934 1.00 . A A . 13 LEU HD23 1 1 16 5192 1 1 13 LEU HG H 4.359 2.407 -1.550 1.00 . A A . 13 LEU HG 1 1 16 5193 1 1 13 LEU N N 5.179 4.361 -0.713 1.00 . A A . 13 LEU N 1 1 16 5194 1 1 13 LEU O O 8.599 4.461 -0.462 1.00 . A A . 13 LEU O 1 1 16 5195 1 1 14 GLN C C 8.673 6.550 -2.438 1.00 . A A . 14 GLN C 1 1 16 5196 1 1 14 GLN CA C 8.515 5.248 -3.071 1.00 . A A . 14 GLN CA 1 1 16 5197 1 1 14 GLN CB C 8.260 5.531 -4.551 1.00 . A A . 14 GLN CB 1 1 16 5198 1 1 14 GLN CD C 8.714 3.148 -4.900 1.00 . A A . 14 GLN CD 1 1 16 5199 1 1 14 GLN CG C 7.831 4.304 -5.282 1.00 . A A . 14 GLN CG 1 1 16 5200 1 1 14 GLN H H 6.565 4.405 -2.883 1.00 . A A . 14 GLN H 1 1 16 5201 1 1 14 GLN HA H 9.400 4.658 -2.929 1.00 . A A . 14 GLN HA 1 1 16 5202 1 1 14 GLN HB2 H 7.450 6.286 -4.635 1.00 . A A . 14 GLN HB2 1 1 16 5203 1 1 14 GLN HB3 H 9.175 5.938 -5.019 1.00 . A A . 14 GLN HB3 1 1 16 5204 1 1 14 GLN HE21 H 7.178 2.468 -3.762 1.00 . A A . 14 GLN HE21 1 1 16 5205 1 1 14 GLN HE22 H 8.614 1.482 -3.736 1.00 . A A . 14 GLN HE22 1 1 16 5206 1 1 14 GLN HG2 H 6.807 4.083 -4.971 1.00 . A A . 14 GLN HG2 1 1 16 5207 1 1 14 GLN HG3 H 7.865 4.465 -6.373 1.00 . A A . 14 GLN HG3 1 1 16 5208 1 1 14 GLN N N 7.416 4.610 -2.369 1.00 . A A . 14 GLN N 1 1 16 5209 1 1 14 GLN NE2 N 8.125 2.281 -4.063 1.00 . A A . 14 GLN NE2 1 1 16 5210 1 1 14 GLN O O 9.713 7.199 -2.515 1.00 . A A . 14 GLN O 1 1 16 5211 1 1 14 GLN OE1 O 9.878 3.052 -5.275 1.00 . A A . 14 GLN OE1 1 1 16 5212 1 1 15 ARG C C 7.816 7.896 0.311 1.00 . A A . 15 ARG C 1 1 16 5213 1 1 15 ARG CA C 7.599 8.196 -1.132 1.00 . A A . 15 ARG CA 1 1 16 5214 1 1 15 ARG CB C 6.270 8.963 -1.209 1.00 . A A . 15 ARG CB 1 1 16 5215 1 1 15 ARG CD C 3.968 8.596 -2.086 1.00 . A A . 15 ARG CD 1 1 16 5216 1 1 15 ARG CG C 5.448 8.595 -2.427 1.00 . A A . 15 ARG CG 1 1 16 5217 1 1 15 ARG CZ C 3.331 10.987 -2.376 1.00 . A A . 15 ARG CZ 1 1 16 5218 1 1 15 ARG H H 6.756 6.367 -1.725 1.00 . A A . 15 ARG H 1 1 16 5219 1 1 15 ARG HA H 8.408 8.760 -1.545 1.00 . A A . 15 ARG HA 1 1 16 5220 1 1 15 ARG HB2 H 5.663 8.759 -0.296 1.00 . A A . 15 ARG HB2 1 1 16 5221 1 1 15 ARG HB3 H 6.484 10.052 -1.239 1.00 . A A . 15 ARG HB3 1 1 16 5222 1 1 15 ARG HD2 H 3.351 8.387 -2.985 1.00 . A A . 15 ARG HD2 1 1 16 5223 1 1 15 ARG HD3 H 3.766 7.827 -1.307 1.00 . A A . 15 ARG HD3 1 1 16 5224 1 1 15 ARG HE H 3.544 10.071 -0.541 1.00 . A A . 15 ARG HE 1 1 16 5225 1 1 15 ARG HG2 H 5.649 9.312 -3.248 1.00 . A A . 15 ARG HG2 1 1 16 5226 1 1 15 ARG HG3 H 5.734 7.576 -2.769 1.00 . A A . 15 ARG HG3 1 1 16 5227 1 1 15 ARG HH11 H 3.592 9.916 -4.110 1.00 . A A . 15 ARG HH11 1 1 16 5228 1 1 15 ARG HH12 H 3.177 11.581 -4.339 1.00 . A A . 15 ARG HH12 1 1 16 5229 1 1 15 ARG HH21 H 2.990 12.338 -0.866 1.00 . A A . 15 ARG HH21 1 1 16 5230 1 1 15 ARG HH22 H 2.831 12.979 -2.466 1.00 . A A . 15 ARG HH22 1 1 16 5231 1 1 15 ARG N N 7.591 6.947 -1.785 1.00 . A A . 15 ARG N 1 1 16 5232 1 1 15 ARG NE N 3.593 9.937 -1.536 1.00 . A A . 15 ARG NE 1 1 16 5233 1 1 15 ARG NH1 N 3.370 10.814 -3.729 1.00 . A A . 15 ARG NH1 1 1 16 5234 1 1 15 ARG NH2 N 3.023 12.210 -1.856 1.00 . A A . 15 ARG NH2 1 1 16 5235 1 1 15 ARG O O 8.390 8.690 1.053 1.00 . A A . 15 ARG O 1 1 16 5236 1 1 16 LYS C C 6.527 7.216 2.878 1.00 . A A . 16 LYS C 1 1 16 5237 1 1 16 LYS CA C 7.352 6.250 2.087 1.00 . A A . 16 LYS CA 1 1 16 5238 1 1 16 LYS CB C 8.759 6.239 2.679 1.00 . A A . 16 LYS CB 1 1 16 5239 1 1 16 LYS CD C 10.644 5.219 1.325 1.00 . A A . 16 LYS CD 1 1 16 5240 1 1 16 LYS CE C 11.908 5.827 1.937 1.00 . A A . 16 LYS CE 1 1 16 5241 1 1 16 LYS CG C 9.547 4.969 2.362 1.00 . A A . 16 LYS CG 1 1 16 5242 1 1 16 LYS H H 6.887 6.065 0.078 1.00 . A A . 16 LYS H 1 1 16 5243 1 1 16 LYS HA H 6.894 5.264 2.109 1.00 . A A . 16 LYS HA 1 1 16 5244 1 1 16 LYS HB2 H 9.297 7.111 2.272 1.00 . A A . 16 LYS HB2 1 1 16 5245 1 1 16 LYS HB3 H 8.689 6.358 3.777 1.00 . A A . 16 LYS HB3 1 1 16 5246 1 1 16 LYS HD2 H 10.904 4.258 0.833 1.00 . A A . 16 LYS HD2 1 1 16 5247 1 1 16 LYS HD3 H 10.248 5.907 0.543 1.00 . A A . 16 LYS HD3 1 1 16 5248 1 1 16 LYS HE2 H 11.695 6.835 2.353 1.00 . A A . 16 LYS HE2 1 1 16 5249 1 1 16 LYS HE3 H 12.307 5.173 2.741 1.00 . A A . 16 LYS HE3 1 1 16 5250 1 1 16 LYS HG2 H 10.007 4.581 3.296 1.00 . A A . 16 LYS HG2 1 1 16 5251 1 1 16 LYS HG3 H 8.849 4.195 1.974 1.00 . A A . 16 LYS HG3 1 1 16 5252 1 1 16 LYS HZ1 H 13.531 6.817 1.111 1.00 . A A . 16 LYS HZ1 1 1 16 5253 1 1 16 LYS HZ2 H 12.512 6.079 -0.029 1.00 . A A . 16 LYS HZ2 1 1 16 5254 1 1 16 LYS HZ3 H 13.567 5.131 0.907 1.00 . A A . 16 LYS HZ3 1 1 16 5255 1 1 16 LYS N N 7.300 6.702 0.721 1.00 . A A . 16 LYS N 1 1 16 5256 1 1 16 LYS NZ N 12.958 5.975 0.904 1.00 . A A . 16 LYS NZ 1 1 16 5257 1 1 16 LYS O O 6.666 7.363 4.091 1.00 . A A . 16 LYS O 1 1 16 5258 1 1 17 LYS C C 5.630 9.999 3.311 1.00 . A A . 17 LYS C 1 1 16 5259 1 1 17 LYS CA C 4.764 8.882 2.695 1.00 . A A . 17 LYS CA 1 1 16 5260 1 1 17 LYS CB C 3.761 8.368 3.746 1.00 . A A . 17 LYS CB 1 1 16 5261 1 1 17 LYS CD C 1.923 9.709 2.615 1.00 . A A . 17 LYS CD 1 1 16 5262 1 1 17 LYS CE C 1.553 9.628 1.137 1.00 . A A . 17 LYS CE 1 1 16 5263 1 1 17 LYS CG C 2.345 8.348 3.186 1.00 . A A . 17 LYS CG 1 1 16 5264 1 1 17 LYS H H 5.501 7.664 1.190 1.00 . A A . 17 LYS H 1 1 16 5265 1 1 17 LYS HA H 4.231 9.293 1.849 1.00 . A A . 17 LYS HA 1 1 16 5266 1 1 17 LYS HB2 H 4.049 7.339 4.056 1.00 . A A . 17 LYS HB2 1 1 16 5267 1 1 17 LYS HB3 H 3.783 9.020 4.644 1.00 . A A . 17 LYS HB3 1 1 16 5268 1 1 17 LYS HD2 H 1.053 10.093 3.186 1.00 . A A . 17 LYS HD2 1 1 16 5269 1 1 17 LYS HD3 H 2.760 10.429 2.733 1.00 . A A . 17 LYS HD3 1 1 16 5270 1 1 17 LYS HE2 H 2.419 9.255 0.541 1.00 . A A . 17 LYS HE2 1 1 16 5271 1 1 17 LYS HE3 H 0.682 8.954 0.988 1.00 . A A . 17 LYS HE3 1 1 16 5272 1 1 17 LYS HG2 H 2.298 7.590 2.379 1.00 . A A . 17 LYS HG2 1 1 16 5273 1 1 17 LYS HG3 H 1.636 8.049 3.987 1.00 . A A . 17 LYS HG3 1 1 16 5274 1 1 17 LYS HZ1 H 1.731 11.692 1.131 1.00 . A A . 17 LYS HZ1 1 1 16 5275 1 1 17 LYS HZ2 H 0.171 11.127 0.772 1.00 . A A . 17 LYS HZ2 1 1 16 5276 1 1 17 LYS HZ3 H 1.402 11.016 -0.393 1.00 . A A . 17 LYS HZ3 1 1 16 5277 1 1 17 LYS N N 5.624 7.875 2.151 1.00 . A A . 17 LYS N 1 1 16 5278 1 1 17 LYS NZ N 1.187 10.966 0.624 1.00 . A A . 17 LYS NZ 1 1 16 5279 1 1 17 LYS O O 6.130 10.853 2.527 1.00 . A A . 17 LYS O 1 1 16 5280 1 1 17 LYS OXT O 5.789 10.023 4.564 1.00 . A A . 17 LYS OXT 1 1 17 5281 1 1 1 GLU C C -2.150 -8.799 -3.732 1.00 . A A . 1 GLU C 1 1 17 5282 1 1 1 GLU CA C -1.465 -9.858 -4.548 1.00 . A A . 1 GLU CA 1 1 17 5283 1 1 1 GLU CB C -2.268 -11.170 -4.441 1.00 . A A . 1 GLU CB 1 1 17 5284 1 1 1 GLU CD C -4.354 -12.423 -4.964 1.00 . A A . 1 GLU CD 1 1 17 5285 1 1 1 GLU CG C -3.668 -11.067 -5.072 1.00 . A A . 1 GLU CG 1 1 17 5286 1 1 1 GLU H1 H 0.291 -10.967 -4.440 1.00 . A A . 1 GLU H1 1 1 17 5287 1 1 1 GLU H2 H -0.078 -10.113 -3.020 1.00 . A A . 1 GLU H2 1 1 17 5288 1 1 1 GLU H3 H 0.529 -9.287 -4.375 1.00 . A A . 1 GLU H3 1 1 17 5289 1 1 1 GLU HA H -1.403 -9.537 -5.576 1.00 . A A . 1 GLU HA 1 1 17 5290 1 1 1 GLU HB2 H -1.699 -11.982 -4.946 1.00 . A A . 1 GLU HB2 1 1 17 5291 1 1 1 GLU HB3 H -2.375 -11.445 -3.368 1.00 . A A . 1 GLU HB3 1 1 17 5292 1 1 1 GLU HG2 H -4.273 -10.303 -4.538 1.00 . A A . 1 GLU HG2 1 1 17 5293 1 1 1 GLU HG3 H -3.588 -10.785 -6.142 1.00 . A A . 1 GLU HG3 1 1 17 5294 1 1 1 GLU N N -0.076 -10.072 -4.060 1.00 . A A . 1 GLU N 1 1 17 5295 1 1 1 GLU O O -2.695 -9.072 -2.663 1.00 . A A . 1 GLU O 1 1 17 5296 1 1 1 GLU OE1 O -4.584 -12.880 -3.813 1.00 . A A . 1 GLU OE1 1 1 17 5297 1 1 1 GLU OE2 O -4.656 -13.017 -6.032 1.00 . A A . 1 GLU OE2 1 1 17 5298 1 1 2 MET C C -3.766 -5.848 -4.435 1.00 . A A . 2 MET C 1 1 17 5299 1 1 2 MET CA C -2.766 -6.461 -3.534 1.00 . A A . 2 MET CA 1 1 17 5300 1 1 2 MET CB C -1.790 -5.375 -3.048 1.00 . A A . 2 MET CB 1 1 17 5301 1 1 2 MET CE C -3.861 -5.332 -0.839 1.00 . A A . 2 MET CE 1 1 17 5302 1 1 2 MET CG C -1.300 -5.562 -1.602 1.00 . A A . 2 MET CG 1 1 17 5303 1 1 2 MET H H -1.710 -7.324 -5.113 1.00 . A A . 2 MET H 1 1 17 5304 1 1 2 MET HA H -3.319 -6.857 -2.706 1.00 . A A . 2 MET HA 1 1 17 5305 1 1 2 MET HB2 H -0.906 -5.374 -3.719 1.00 . A A . 2 MET HB2 1 1 17 5306 1 1 2 MET HB3 H -2.275 -4.374 -3.125 1.00 . A A . 2 MET HB3 1 1 17 5307 1 1 2 MET HE1 H -4.755 -5.907 -1.159 1.00 . A A . 2 MET HE1 1 1 17 5308 1 1 2 MET HE2 H -3.609 -4.620 -1.653 1.00 . A A . 2 MET HE2 1 1 17 5309 1 1 2 MET HE3 H -4.132 -4.745 0.062 1.00 . A A . 2 MET HE3 1 1 17 5310 1 1 2 MET HG2 H -0.334 -6.105 -1.625 1.00 . A A . 2 MET HG2 1 1 17 5311 1 1 2 MET HG3 H -1.101 -4.548 -1.190 1.00 . A A . 2 MET HG3 1 1 17 5312 1 1 2 MET N N -2.139 -7.547 -4.240 1.00 . A A . 2 MET N 1 1 17 5313 1 1 2 MET O O -3.911 -6.214 -5.600 1.00 . A A . 2 MET O 1 1 17 5314 1 1 2 MET SD S -2.463 -6.434 -0.500 1.00 . A A . 2 MET SD 1 1 17 5315 1 1 3 ARG C C -5.295 -2.816 -4.543 1.00 . A A . 3 ARG C 1 1 17 5316 1 1 3 ARG CA C -5.536 -4.234 -4.555 1.00 . A A . 3 ARG CA 1 1 17 5317 1 1 3 ARG CB C -6.814 -4.414 -3.783 1.00 . A A . 3 ARG CB 1 1 17 5318 1 1 3 ARG CD C -6.864 -6.828 -3.102 1.00 . A A . 3 ARG CD 1 1 17 5319 1 1 3 ARG CG C -7.476 -5.766 -4.014 1.00 . A A . 3 ARG CG 1 1 17 5320 1 1 3 ARG CZ C -7.488 -8.017 -1.016 1.00 . A A . 3 ARG CZ 1 1 17 5321 1 1 3 ARG H H -4.285 -4.525 -2.960 1.00 . A A . 3 ARG H 1 1 17 5322 1 1 3 ARG HA H -5.586 -4.579 -5.521 1.00 . A A . 3 ARG HA 1 1 17 5323 1 1 3 ARG HB2 H -6.532 -4.323 -2.707 1.00 . A A . 3 ARG HB2 1 1 17 5324 1 1 3 ARG HB3 H -7.514 -3.592 -4.031 1.00 . A A . 3 ARG HB3 1 1 17 5325 1 1 3 ARG HD2 H -6.644 -7.760 -3.666 1.00 . A A . 3 ARG HD2 1 1 17 5326 1 1 3 ARG HD3 H -5.930 -6.436 -2.633 1.00 . A A . 3 ARG HD3 1 1 17 5327 1 1 3 ARG HE H -8.735 -6.717 -2.007 1.00 . A A . 3 ARG HE 1 1 17 5328 1 1 3 ARG HG2 H -8.567 -5.682 -3.814 1.00 . A A . 3 ARG HG2 1 1 17 5329 1 1 3 ARG HG3 H -7.338 -6.068 -5.074 1.00 . A A . 3 ARG HG3 1 1 17 5330 1 1 3 ARG HH11 H -5.609 -8.405 -1.752 1.00 . A A . 3 ARG HH11 1 1 17 5331 1 1 3 ARG HH12 H -6.007 -9.247 -0.292 1.00 . A A . 3 ARG HH12 1 1 17 5332 1 1 3 ARG HH21 H -9.279 -7.863 -0.020 1.00 . A A . 3 ARG HH21 1 1 17 5333 1 1 3 ARG HH22 H -8.130 -8.934 0.708 1.00 . A A . 3 ARG HH22 1 1 17 5334 1 1 3 ARG N N -4.476 -4.867 -3.873 1.00 . A A . 3 ARG N 1 1 17 5335 1 1 3 ARG NE N -7.833 -7.146 -2.011 1.00 . A A . 3 ARG NE 1 1 17 5336 1 1 3 ARG NH1 N -6.259 -8.611 -1.019 1.00 . A A . 3 ARG NH1 1 1 17 5337 1 1 3 ARG NH2 N -8.378 -8.297 -0.020 1.00 . A A . 3 ARG NH2 1 1 17 5338 1 1 3 ARG O O -5.795 -2.052 -5.365 1.00 . A A . 3 ARG O 1 1 17 5339 1 1 4 LEU C C -3.349 -0.780 -4.471 1.00 . A A . 4 LEU C 1 1 17 5340 1 1 4 LEU CA C -4.226 -1.103 -3.369 1.00 . A A . 4 LEU CA 1 1 17 5341 1 1 4 LEU CB C -3.431 -0.872 -2.110 1.00 . A A . 4 LEU CB 1 1 17 5342 1 1 4 LEU CD1 C -2.381 -1.883 -0.146 1.00 . A A . 4 LEU CD1 1 1 17 5343 1 1 4 LEU CD2 C -4.880 -2.279 -0.627 1.00 . A A . 4 LEU CD2 1 1 17 5344 1 1 4 LEU CG C -3.477 -2.039 -1.186 1.00 . A A . 4 LEU CG 1 1 17 5345 1 1 4 LEU H H -4.087 -3.094 -2.948 1.00 . A A . 4 LEU H 1 1 17 5346 1 1 4 LEU HA H -5.065 -0.510 -3.403 1.00 . A A . 4 LEU HA 1 1 17 5347 1 1 4 LEU HB2 H -2.398 -0.649 -2.360 1.00 . A A . 4 LEU HB2 1 1 17 5348 1 1 4 LEU HB3 H -3.851 -0.018 -1.571 1.00 . A A . 4 LEU HB3 1 1 17 5349 1 1 4 LEU HD11 H -1.872 -0.900 -0.300 1.00 . A A . 4 LEU HD11 1 1 17 5350 1 1 4 LEU HD12 H -1.622 -2.688 -0.290 1.00 . A A . 4 LEU HD12 1 1 17 5351 1 1 4 LEU HD13 H -2.789 -1.931 0.881 1.00 . A A . 4 LEU HD13 1 1 17 5352 1 1 4 LEU HD21 H -5.441 -2.967 -1.312 1.00 . A A . 4 LEU HD21 1 1 17 5353 1 1 4 LEU HD22 H -5.433 -1.318 -0.556 1.00 . A A . 4 LEU HD22 1 1 17 5354 1 1 4 LEU HD23 H -4.827 -2.741 0.379 1.00 . A A . 4 LEU HD23 1 1 17 5355 1 1 4 LEU HG H -3.199 -2.904 -1.796 1.00 . A A . 4 LEU HG 1 1 17 5356 1 1 4 LEU N N -4.519 -2.443 -3.566 1.00 . A A . 4 LEU N 1 1 17 5357 1 1 4 LEU O O -3.753 -0.039 -5.338 1.00 . A A . 4 LEU O 1 1 17 5358 1 1 5 SER C C -1.096 -0.966 -6.632 1.00 . A A . 5 SER C 1 1 17 5359 1 1 5 SER CA C -1.113 -1.682 -5.306 1.00 . A A . 5 SER CA 1 1 17 5360 1 1 5 SER CB C -0.664 -3.102 -5.412 1.00 . A A . 5 SER CB 1 1 17 5361 1 1 5 SER H H -2.374 -2.410 -3.877 1.00 . A A . 5 SER H 1 1 17 5362 1 1 5 SER HA H -0.396 -1.167 -4.675 1.00 . A A . 5 SER HA 1 1 17 5363 1 1 5 SER HB2 H 0.410 -3.139 -5.148 1.00 . A A . 5 SER HB2 1 1 17 5364 1 1 5 SER HB3 H -1.257 -3.675 -4.643 1.00 . A A . 5 SER HB3 1 1 17 5365 1 1 5 SER HG H -0.432 -3.084 -7.328 1.00 . A A . 5 SER HG 1 1 17 5366 1 1 5 SER N N -2.337 -1.663 -4.518 1.00 . A A . 5 SER N 1 1 17 5367 1 1 5 SER O O -0.091 -0.925 -7.328 1.00 . A A . 5 SER O 1 1 17 5368 1 1 5 SER OG O -0.880 -3.667 -6.703 1.00 . A A . 5 SER OG 1 1 17 5369 1 1 6 LYS C C -1.955 1.734 -7.220 1.00 . A A . 6 LYS C 1 1 17 5370 1 1 6 LYS CA C -2.245 0.497 -8.069 1.00 . A A . 6 LYS CA 1 1 17 5371 1 1 6 LYS CB C -3.605 0.674 -8.763 1.00 . A A . 6 LYS CB 1 1 17 5372 1 1 6 LYS CD C -3.226 -1.136 -10.520 1.00 . A A . 6 LYS CD 1 1 17 5373 1 1 6 LYS CE C -3.782 -2.400 -11.181 1.00 . A A . 6 LYS CE 1 1 17 5374 1 1 6 LYS CG C -4.130 -0.619 -9.396 1.00 . A A . 6 LYS CG 1 1 17 5375 1 1 6 LYS H H -3.086 -0.639 -6.579 1.00 . A A . 6 LYS H 1 1 17 5376 1 1 6 LYS HA H -1.435 0.310 -8.764 1.00 . A A . 6 LYS HA 1 1 17 5377 1 1 6 LYS HB2 H -4.344 1.044 -8.019 1.00 . A A . 6 LYS HB2 1 1 17 5378 1 1 6 LYS HB3 H -3.500 1.447 -9.556 1.00 . A A . 6 LYS HB3 1 1 17 5379 1 1 6 LYS HD2 H -3.114 -0.344 -11.290 1.00 . A A . 6 LYS HD2 1 1 17 5380 1 1 6 LYS HD3 H -2.219 -1.357 -10.105 1.00 . A A . 6 LYS HD3 1 1 17 5381 1 1 6 LYS HE2 H -3.882 -3.218 -10.438 1.00 . A A . 6 LYS HE2 1 1 17 5382 1 1 6 LYS HE3 H -4.772 -2.195 -11.641 1.00 . A A . 6 LYS HE3 1 1 17 5383 1 1 6 LYS HG2 H -4.211 -1.400 -8.610 1.00 . A A . 6 LYS HG2 1 1 17 5384 1 1 6 LYS HG3 H -5.147 -0.436 -9.803 1.00 . A A . 6 LYS HG3 1 1 17 5385 1 1 6 LYS HZ1 H -3.139 -3.824 -12.543 1.00 . A A . 6 LYS HZ1 1 1 17 5386 1 1 6 LYS HZ2 H -1.893 -2.874 -11.889 1.00 . A A . 6 LYS HZ2 1 1 17 5387 1 1 6 LYS HZ3 H -2.932 -2.221 -13.063 1.00 . A A . 6 LYS HZ3 1 1 17 5388 1 1 6 LYS N N -2.212 -0.445 -7.027 1.00 . A A . 6 LYS N 1 1 17 5389 1 1 6 LYS NZ N -2.869 -2.864 -12.249 1.00 . A A . 6 LYS NZ 1 1 17 5390 1 1 6 LYS O O -1.972 2.869 -7.684 1.00 . A A . 6 LYS O 1 1 17 5391 1 1 7 PHE C C -0.321 2.571 -4.248 1.00 . A A . 7 PHE C 1 1 17 5392 1 1 7 PHE CA C -1.599 2.315 -4.802 1.00 . A A . 7 PHE CA 1 1 17 5393 1 1 7 PHE CB C -2.183 1.653 -3.588 1.00 . A A . 7 PHE CB 1 1 17 5394 1 1 7 PHE CD1 C -3.805 2.131 -1.916 1.00 . A A . 7 PHE CD1 1 1 17 5395 1 1 7 PHE CD2 C -1.698 3.152 -1.876 1.00 . A A . 7 PHE CD2 1 1 17 5396 1 1 7 PHE CE1 C -4.048 2.643 -0.703 1.00 . A A . 7 PHE CE1 1 1 17 5397 1 1 7 PHE CE2 C -1.879 3.695 -0.733 1.00 . A A . 7 PHE CE2 1 1 17 5398 1 1 7 PHE CG C -2.650 2.392 -2.494 1.00 . A A . 7 PHE CG 1 1 17 5399 1 1 7 PHE CZ C -3.082 3.458 -0.070 1.00 . A A . 7 PHE CZ 1 1 17 5400 1 1 7 PHE H H -1.729 0.462 -5.513 1.00 . A A . 7 PHE H 1 1 17 5401 1 1 7 PHE HA H -2.135 3.206 -4.969 1.00 . A A . 7 PHE HA 1 1 17 5402 1 1 7 PHE HB2 H -3.113 1.242 -3.934 1.00 . A A . 7 PHE HB2 1 1 17 5403 1 1 7 PHE HB3 H -1.589 0.809 -3.203 1.00 . A A . 7 PHE HB3 1 1 17 5404 1 1 7 PHE HD1 H -4.534 1.493 -2.426 1.00 . A A . 7 PHE HD1 1 1 17 5405 1 1 7 PHE HD2 H -0.768 3.347 -2.345 1.00 . A A . 7 PHE HD2 1 1 17 5406 1 1 7 PHE HE1 H -4.958 2.376 -0.244 1.00 . A A . 7 PHE HE1 1 1 17 5407 1 1 7 PHE HE2 H -1.025 4.266 -0.349 1.00 . A A . 7 PHE HE2 1 1 17 5408 1 1 7 PHE HZ H -3.266 3.877 0.909 1.00 . A A . 7 PHE HZ 1 1 17 5409 1 1 7 PHE N N -1.823 1.437 -5.859 1.00 . A A . 7 PHE N 1 1 17 5410 1 1 7 PHE O O 0.121 3.679 -4.238 1.00 . A A . 7 PHE O 1 1 17 5411 1 1 8 PHE C C 2.289 1.561 -3.542 1.00 . A A . 8 PHE C 1 1 17 5412 1 1 8 PHE CA C 1.244 1.725 -2.705 1.00 . A A . 8 PHE CA 1 1 17 5413 1 1 8 PHE CB C 1.632 0.651 -1.746 1.00 . A A . 8 PHE CB 1 1 17 5414 1 1 8 PHE CD1 C 2.112 -1.441 -2.357 1.00 . A A . 8 PHE CD1 1 1 17 5415 1 1 8 PHE CD2 C -0.093 -0.846 -2.024 1.00 . A A . 8 PHE CD2 1 1 17 5416 1 1 8 PHE CE1 C 1.797 -2.612 -2.716 1.00 . A A . 8 PHE CE1 1 1 17 5417 1 1 8 PHE CE2 C -0.444 -2.048 -2.383 1.00 . A A . 8 PHE CE2 1 1 17 5418 1 1 8 PHE CG C 1.166 -0.570 -2.016 1.00 . A A . 8 PHE CG 1 1 17 5419 1 1 8 PHE CZ C 0.506 -2.944 -2.741 1.00 . A A . 8 PHE CZ 1 1 17 5420 1 1 8 PHE H H -0.134 0.611 -3.682 1.00 . A A . 8 PHE H 1 1 17 5421 1 1 8 PHE HA H 1.252 2.677 -2.343 1.00 . A A . 8 PHE HA 1 1 17 5422 1 1 8 PHE HB2 H 2.695 0.556 -1.627 1.00 . A A . 8 PHE HB2 1 1 17 5423 1 1 8 PHE HB3 H 1.154 0.886 -0.795 1.00 . A A . 8 PHE HB3 1 1 17 5424 1 1 8 PHE HD1 H 3.155 -1.148 -2.333 1.00 . A A . 8 PHE HD1 1 1 17 5425 1 1 8 PHE HD2 H -0.813 -0.109 -1.723 1.00 . A A . 8 PHE HD2 1 1 17 5426 1 1 8 PHE HE1 H 2.563 -3.260 -3.004 1.00 . A A . 8 PHE HE1 1 1 17 5427 1 1 8 PHE HE2 H -1.451 -2.276 -2.433 1.00 . A A . 8 PHE HE2 1 1 17 5428 1 1 8 PHE HZ H 0.238 -3.870 -3.031 1.00 . A A . 8 PHE HZ 1 1 17 5429 1 1 8 PHE N N 0.203 1.523 -3.595 1.00 . A A . 8 PHE N 1 1 17 5430 1 1 8 PHE O O 3.199 2.241 -3.510 1.00 . A A . 8 PHE O 1 1 17 5431 1 1 9 ARG C C 2.963 1.381 -6.235 1.00 . A A . 9 ARG C 1 1 17 5432 1 1 9 ARG CA C 2.951 0.263 -5.343 1.00 . A A . 9 ARG CA 1 1 17 5433 1 1 9 ARG CB C 2.475 -0.955 -6.058 1.00 . A A . 9 ARG CB 1 1 17 5434 1 1 9 ARG CD C 4.429 -2.547 -6.222 1.00 . A A . 9 ARG CD 1 1 17 5435 1 1 9 ARG CG C 3.096 -2.242 -5.546 1.00 . A A . 9 ARG CG 1 1 17 5436 1 1 9 ARG CZ C 5.193 -3.320 -8.453 1.00 . A A . 9 ARG CZ 1 1 17 5437 1 1 9 ARG H H 1.196 0.162 -4.402 1.00 . A A . 9 ARG H 1 1 17 5438 1 1 9 ARG HA H 3.863 0.151 -4.883 1.00 . A A . 9 ARG HA 1 1 17 5439 1 1 9 ARG HB2 H 1.367 -0.994 -5.867 1.00 . A A . 9 ARG HB2 1 1 17 5440 1 1 9 ARG HB3 H 2.650 -0.836 -7.143 1.00 . A A . 9 ARG HB3 1 1 17 5441 1 1 9 ARG HD2 H 5.043 -1.623 -6.299 1.00 . A A . 9 ARG HD2 1 1 17 5442 1 1 9 ARG HD3 H 4.986 -3.328 -5.664 1.00 . A A . 9 ARG HD3 1 1 17 5443 1 1 9 ARG HE H 3.217 -3.200 -7.900 1.00 . A A . 9 ARG HE 1 1 17 5444 1 1 9 ARG HG2 H 3.267 -2.145 -4.460 1.00 . A A . 9 ARG HG2 1 1 17 5445 1 1 9 ARG HG3 H 2.392 -3.083 -5.717 1.00 . A A . 9 ARG HG3 1 1 17 5446 1 1 9 ARG HH11 H 6.668 -2.789 -7.125 1.00 . A A . 9 ARG HH11 1 1 17 5447 1 1 9 ARG HH12 H 7.238 -3.320 -8.673 1.00 . A A . 9 ARG HH12 1 1 17 5448 1 1 9 ARG HH21 H 3.990 -3.921 -10.005 1.00 . A A . 9 ARG HH21 1 1 17 5449 1 1 9 ARG HH22 H 5.688 -3.974 -10.338 1.00 . A A . 9 ARG HH22 1 1 17 5450 1 1 9 ARG N N 2.065 0.613 -4.380 1.00 . A A . 9 ARG N 1 1 17 5451 1 1 9 ARG NE N 4.159 -3.055 -7.600 1.00 . A A . 9 ARG NE 1 1 17 5452 1 1 9 ARG NH1 N 6.482 -3.126 -8.048 1.00 . A A . 9 ARG NH1 1 1 17 5453 1 1 9 ARG NH2 N 4.935 -3.779 -9.711 1.00 . A A . 9 ARG NH2 1 1 17 5454 1 1 9 ARG O O 3.642 1.401 -7.262 1.00 . A A . 9 ARG O 1 1 17 5455 1 1 10 ASP C C 2.109 4.636 -5.880 1.00 . A A . 10 ASP C 1 1 17 5456 1 1 10 ASP CA C 1.889 3.387 -6.637 1.00 . A A . 10 ASP CA 1 1 17 5457 1 1 10 ASP CB C 0.637 3.348 -7.286 1.00 . A A . 10 ASP CB 1 1 17 5458 1 1 10 ASP CG C 0.593 4.039 -8.646 1.00 . A A . 10 ASP CG 1 1 17 5459 1 1 10 ASP H H 1.481 2.189 -5.053 1.00 . A A . 10 ASP H 1 1 17 5460 1 1 10 ASP HA H 2.646 3.305 -7.305 1.00 . A A . 10 ASP HA 1 1 17 5461 1 1 10 ASP HB2 H 0.454 2.265 -7.392 1.00 . A A . 10 ASP HB2 1 1 17 5462 1 1 10 ASP HB3 H -0.086 3.789 -6.597 1.00 . A A . 10 ASP HB3 1 1 17 5463 1 1 10 ASP N N 2.027 2.263 -5.920 1.00 . A A . 10 ASP N 1 1 17 5464 1 1 10 ASP O O 2.085 5.711 -6.482 1.00 . A A . 10 ASP O 1 1 17 5465 1 1 10 ASP OD1 O 0.872 3.352 -9.664 1.00 . A A . 10 ASP OD1 1 1 17 5466 1 1 10 ASP OD2 O 0.284 5.259 -8.683 1.00 . A A . 10 ASP OD2 1 1 17 5467 1 1 11 . C C 2.330 6.060 -2.471 1.00 . A A . 11 DPN C 1 1 17 5468 1 1 11 . CA C 2.569 5.888 -3.942 1.00 . A A . 11 DPN CA 1 1 17 5469 1 1 11 . CB C 4.023 6.230 -4.181 1.00 . A A . 11 DPN CB 1 1 17 5470 1 1 11 . CD1 C 4.679 4.895 -6.102 1.00 . A A . 11 DPN CD1 1 1 17 5471 1 1 11 . CD2 C 4.904 4.240 -3.880 1.00 . A A . 11 DPN CD2 1 1 17 5472 1 1 11 . CE1 C 4.906 3.634 -6.449 1.00 . A A . 11 DPN CE1 1 1 17 5473 1 1 11 . CE2 C 5.199 3.077 -4.213 1.00 . A A . 11 DPN CE2 1 1 17 5474 1 1 11 . CG C 4.659 5.154 -4.770 1.00 . A A . 11 DPN CG 1 1 17 5475 1 1 11 . CZ C 5.164 2.752 -5.451 1.00 . A A . 11 DPN CZ 1 1 17 5476 1 1 11 . H H 2.309 3.717 -3.995 1.00 . A A . 11 DPN H 1 1 17 5477 1 1 11 . HA H 1.976 6.577 -4.420 1.00 . A A . 11 DPN HA 1 1 17 5478 1 1 11 . HB2 H 4.499 6.325 -3.212 1.00 . A A . 11 DPN HB2 1 1 17 5479 1 1 11 . HB3 H 4.134 7.066 -4.815 1.00 . A A . 11 DPN HB3 1 1 17 5480 1 1 11 . HD1 H 4.475 5.662 -6.835 1.00 . A A . 11 DPN HD1 1 1 17 5481 1 1 11 . HD2 H 4.940 4.508 -2.883 1.00 . A A . 11 DPN HD2 1 1 17 5482 1 1 11 . HE1 H 4.897 3.324 -7.480 1.00 . A A . 11 DPN HE1 1 1 17 5483 1 1 11 . HE2 H 5.344 2.344 -3.476 1.00 . A A . 11 DPN HE2 1 1 17 5484 1 1 11 . HZ H 5.235 1.814 -5.625 1.00 . A A . 11 DPN HZ 1 1 17 5485 1 1 11 . N N 2.286 4.593 -4.543 1.00 . A A . 11 DPN N 1 1 17 5486 1 1 11 . O O 1.354 6.677 -2.052 1.00 . A A . 11 DPN O 1 1 17 5487 1 1 12 ILE C C 4.600 5.038 0.195 1.00 . A A . 12 ILE C 1 1 17 5488 1 1 12 ILE CA C 3.312 5.704 -0.258 1.00 . A A . 12 ILE CA 1 1 17 5489 1 1 12 ILE CB C 2.153 5.107 0.470 1.00 . A A . 12 ILE CB 1 1 17 5490 1 1 12 ILE CD1 C 2.595 3.093 -0.676 1.00 . A A . 12 ILE CD1 1 1 17 5491 1 1 12 ILE CG1 C 1.550 4.058 -0.408 1.00 . A A . 12 ILE CG1 1 1 17 5492 1 1 12 ILE CG2 C 1.161 6.214 0.869 1.00 . A A . 12 ILE CG2 1 1 17 5493 1 1 12 ILE H H 3.902 4.872 -2.036 1.00 . A A . 12 ILE H 1 1 17 5494 1 1 12 ILE HA H 3.381 6.724 -0.069 1.00 . A A . 12 ILE HA 1 1 17 5495 1 1 12 ILE HB H 2.528 4.605 1.372 1.00 . A A . 12 ILE HB 1 1 17 5496 1 1 12 ILE HD11 H 3.459 3.330 -0.092 1.00 . A A . 12 ILE HD11 1 1 17 5497 1 1 12 ILE HD12 H 2.886 3.141 -1.763 1.00 . A A . 12 ILE HD12 1 1 17 5498 1 1 12 ILE HD13 H 2.271 2.105 -0.400 1.00 . A A . 12 ILE HD13 1 1 17 5499 1 1 12 ILE HG12 H 0.698 3.559 0.083 1.00 . A A . 12 ILE HG12 1 1 17 5500 1 1 12 ILE HG13 H 1.228 4.484 -1.381 1.00 . A A . 12 ILE HG13 1 1 17 5501 1 1 12 ILE HG21 H 1.291 6.482 1.938 1.00 . A A . 12 ILE HG21 1 1 17 5502 1 1 12 ILE HG22 H 0.117 5.870 0.713 1.00 . A A . 12 ILE HG22 1 1 17 5503 1 1 12 ILE HG23 H 1.328 7.124 0.252 1.00 . A A . 12 ILE HG23 1 1 17 5504 1 1 12 ILE N N 3.266 5.521 -1.679 1.00 . A A . 12 ILE N 1 1 17 5505 1 1 12 ILE O O 4.902 4.973 1.374 1.00 . A A . 12 ILE O 1 1 17 5506 1 1 13 LEU C C 7.670 4.371 -1.177 1.00 . A A . 13 LEU C 1 1 17 5507 1 1 13 LEU CA C 6.537 3.668 -0.558 1.00 . A A . 13 LEU CA 1 1 17 5508 1 1 13 LEU CB C 6.502 2.344 -1.294 1.00 . A A . 13 LEU CB 1 1 17 5509 1 1 13 LEU CD1 C 5.109 0.460 -2.042 1.00 . A A . 13 LEU CD1 1 1 17 5510 1 1 13 LEU CD2 C 4.809 1.566 0.284 1.00 . A A . 13 LEU CD2 1 1 17 5511 1 1 13 LEU CG C 5.172 1.725 -1.190 1.00 . A A . 13 LEU CG 1 1 17 5512 1 1 13 LEU H H 4.951 4.338 -1.726 1.00 . A A . 13 LEU H 1 1 17 5513 1 1 13 LEU HA H 6.685 3.529 0.491 1.00 . A A . 13 LEU HA 1 1 17 5514 1 1 13 LEU HB2 H 6.702 2.516 -2.366 1.00 . A A . 13 LEU HB2 1 1 17 5515 1 1 13 LEU HB3 H 7.255 1.651 -0.887 1.00 . A A . 13 LEU HB3 1 1 17 5516 1 1 13 LEU HD11 H 4.509 0.667 -2.968 1.00 . A A . 13 LEU HD11 1 1 17 5517 1 1 13 LEU HD12 H 4.645 -0.372 -1.483 1.00 . A A . 13 LEU HD12 1 1 17 5518 1 1 13 LEU HD13 H 6.130 0.171 -2.358 1.00 . A A . 13 LEU HD13 1 1 17 5519 1 1 13 LEU HD21 H 4.848 2.586 0.776 1.00 . A A . 13 LEU HD21 1 1 17 5520 1 1 13 LEU HD22 H 5.527 0.897 0.792 1.00 . A A . 13 LEU HD22 1 1 17 5521 1 1 13 LEU HD23 H 3.784 1.163 0.391 1.00 . A A . 13 LEU HD23 1 1 17 5522 1 1 13 LEU HG H 4.468 2.450 -1.644 1.00 . A A . 13 LEU HG 1 1 17 5523 1 1 13 LEU N N 5.308 4.405 -0.791 1.00 . A A . 13 LEU N 1 1 17 5524 1 1 13 LEU O O 8.711 4.575 -0.576 1.00 . A A . 13 LEU O 1 1 17 5525 1 1 14 GLN C C 8.681 6.703 -2.515 1.00 . A A . 14 GLN C 1 1 17 5526 1 1 14 GLN CA C 8.558 5.402 -3.164 1.00 . A A . 14 GLN CA 1 1 17 5527 1 1 14 GLN CB C 8.272 5.693 -4.635 1.00 . A A . 14 GLN CB 1 1 17 5528 1 1 14 GLN CD C 8.791 3.327 -5.018 1.00 . A A . 14 GLN CD 1 1 17 5529 1 1 14 GLN CG C 7.869 4.461 -5.375 1.00 . A A . 14 GLN CG 1 1 17 5530 1 1 14 GLN H H 6.641 4.494 -2.966 1.00 . A A . 14 GLN H 1 1 17 5531 1 1 14 GLN HA H 9.466 4.841 -3.042 1.00 . A A . 14 GLN HA 1 1 17 5532 1 1 14 GLN HB2 H 7.435 6.421 -4.695 1.00 . A A . 14 GLN HB2 1 1 17 5533 1 1 14 GLN HB3 H 9.163 6.135 -5.112 1.00 . A A . 14 GLN HB3 1 1 17 5534 1 1 14 GLN HE21 H 7.287 2.588 -3.874 1.00 . A A . 14 GLN HE21 1 1 17 5535 1 1 14 GLN HE22 H 8.752 1.644 -3.875 1.00 . A A . 14 GLN HE22 1 1 17 5536 1 1 14 GLN HG2 H 6.857 4.205 -5.052 1.00 . A A . 14 GLN HG2 1 1 17 5537 1 1 14 GLN HG3 H 7.884 4.635 -6.463 1.00 . A A . 14 GLN HG3 1 1 17 5538 1 1 14 GLN N N 7.494 4.717 -2.459 1.00 . A A . 14 GLN N 1 1 17 5539 1 1 14 GLN NE2 N 8.236 2.432 -4.187 1.00 . A A . 14 GLN NE2 1 1 17 5540 1 1 14 GLN O O 9.696 7.390 -2.606 1.00 . A A . 14 GLN O 1 1 17 5541 1 1 14 GLN OE1 O 9.952 3.271 -5.407 1.00 . A A . 14 GLN OE1 1 1 17 5542 1 1 15 ARG C C 7.752 7.994 0.284 1.00 . A A . 15 ARG C 1 1 17 5543 1 1 15 ARG CA C 7.579 8.305 -1.168 1.00 . A A . 15 ARG CA 1 1 17 5544 1 1 15 ARG CB C 6.255 9.059 -1.289 1.00 . A A . 15 ARG CB 1 1 17 5545 1 1 15 ARG CD C 3.982 8.638 -2.226 1.00 . A A . 15 ARG CD 1 1 17 5546 1 1 15 ARG CG C 5.470 8.687 -2.533 1.00 . A A . 15 ARG CG 1 1 17 5547 1 1 15 ARG CZ C 3.138 10.924 -2.747 1.00 . A A . 15 ARG CZ 1 1 17 5548 1 1 15 ARG H H 6.784 6.450 -1.759 1.00 . A A . 15 ARG H 1 1 17 5549 1 1 15 ARG HA H 8.398 8.874 -1.551 1.00 . A A . 15 ARG HA 1 1 17 5550 1 1 15 ARG HB2 H 5.630 8.851 -0.397 1.00 . A A . 15 ARG HB2 1 1 17 5551 1 1 15 ARG HB3 H 6.462 10.150 -1.313 1.00 . A A . 15 ARG HB3 1 1 17 5552 1 1 15 ARG HD2 H 3.402 8.321 -3.115 1.00 . A A . 15 ARG HD2 1 1 17 5553 1 1 15 ARG HD3 H 3.794 7.928 -1.382 1.00 . A A . 15 ARG HD3 1 1 17 5554 1 1 15 ARG HE H 3.512 10.244 -0.838 1.00 . A A . 15 ARG HE 1 1 17 5555 1 1 15 ARG HG2 H 5.667 9.423 -3.338 1.00 . A A . 15 ARG HG2 1 1 17 5556 1 1 15 ARG HG3 H 5.793 7.682 -2.886 1.00 . A A . 15 ARG HG3 1 1 17 5557 1 1 15 ARG HH11 H 3.444 9.701 -4.368 1.00 . A A . 15 ARG HH11 1 1 17 5558 1 1 15 ARG HH12 H 2.865 11.286 -4.753 1.00 . A A . 15 ARG HH12 1 1 17 5559 1 1 15 ARG HH21 H 2.725 12.393 -1.372 1.00 . A A . 15 ARG HH21 1 1 17 5560 1 1 15 ARG HH22 H 2.450 12.842 -3.021 1.00 . A A . 15 ARG HH22 1 1 17 5561 1 1 15 ARG N N 7.599 7.057 -1.833 1.00 . A A . 15 ARG N 1 1 17 5562 1 1 15 ARG NE N 3.526 10.002 -1.813 1.00 . A A . 15 ARG NE 1 1 17 5563 1 1 15 ARG NH1 N 3.150 10.610 -4.074 1.00 . A A . 15 ARG NH1 1 1 17 5564 1 1 15 ARG NH2 N 2.734 12.163 -2.345 1.00 . A A . 15 ARG NH2 1 1 17 5565 1 1 15 ARG O O 8.267 8.797 1.059 1.00 . A A . 15 ARG O 1 1 17 5566 1 1 16 LYS C C 6.221 6.929 2.802 1.00 . A A . 16 LYS C 1 1 17 5567 1 1 16 LYS CA C 7.288 6.268 1.986 1.00 . A A . 16 LYS CA 1 1 17 5568 1 1 16 LYS CB C 8.612 6.452 2.713 1.00 . A A . 16 LYS CB 1 1 17 5569 1 1 16 LYS CD C 9.586 4.170 2.170 1.00 . A A . 16 LYS CD 1 1 17 5570 1 1 16 LYS CE C 10.795 3.387 1.654 1.00 . A A . 16 LYS CE 1 1 17 5571 1 1 16 LYS CG C 9.775 5.688 2.077 1.00 . A A . 16 LYS CG 1 1 17 5572 1 1 16 LYS H H 6.867 6.167 -0.019 1.00 . A A . 16 LYS H 1 1 17 5573 1 1 16 LYS HA H 7.043 5.218 1.896 1.00 . A A . 16 LYS HA 1 1 17 5574 1 1 16 LYS HB2 H 8.842 7.529 2.709 1.00 . A A . 16 LYS HB2 1 1 17 5575 1 1 16 LYS HB3 H 8.494 6.127 3.761 1.00 . A A . 16 LYS HB3 1 1 17 5576 1 1 16 LYS HD2 H 9.396 3.892 3.228 1.00 . A A . 16 LYS HD2 1 1 17 5577 1 1 16 LYS HD3 H 8.687 3.886 1.576 1.00 . A A . 16 LYS HD3 1 1 17 5578 1 1 16 LYS HE2 H 10.585 2.296 1.664 1.00 . A A . 16 LYS HE2 1 1 17 5579 1 1 16 LYS HE3 H 11.052 3.703 0.620 1.00 . A A . 16 LYS HE3 1 1 17 5580 1 1 16 LYS HG2 H 9.865 5.980 1.009 1.00 . A A . 16 LYS HG2 1 1 17 5581 1 1 16 LYS HG3 H 10.718 5.970 2.590 1.00 . A A . 16 LYS HG3 1 1 17 5582 1 1 16 LYS HZ1 H 12.691 4.158 1.975 1.00 . A A . 16 LYS HZ1 1 1 17 5583 1 1 16 LYS HZ2 H 12.372 2.721 2.823 1.00 . A A . 16 LYS HZ2 1 1 17 5584 1 1 16 LYS HZ3 H 11.688 4.185 3.344 1.00 . A A . 16 LYS HZ3 1 1 17 5585 1 1 16 LYS N N 7.260 6.782 0.647 1.00 . A A . 16 LYS N 1 1 17 5586 1 1 16 LYS NZ N 11.975 3.630 2.513 1.00 . A A . 16 LYS NZ 1 1 17 5587 1 1 16 LYS O O 6.188 6.798 4.026 1.00 . A A . 16 LYS O 1 1 17 5588 1 1 17 LYS C C 3.281 8.915 1.831 1.00 . A A . 17 LYS C 1 1 17 5589 1 1 17 LYS CA C 4.234 8.279 2.843 1.00 . A A . 17 LYS CA 1 1 17 5590 1 1 17 LYS CB C 4.688 9.384 3.820 1.00 . A A . 17 LYS CB 1 1 17 5591 1 1 17 LYS CD C 5.428 11.481 2.557 1.00 . A A . 17 LYS CD 1 1 17 5592 1 1 17 LYS CE C 6.412 11.883 1.458 1.00 . A A . 17 LYS CE 1 1 17 5593 1 1 17 LYS CG C 5.868 10.214 3.302 1.00 . A A . 17 LYS CG 1 1 17 5594 1 1 17 LYS H H 5.358 7.763 1.153 1.00 . A A . 17 LYS H 1 1 17 5595 1 1 17 LYS HA H 3.707 7.503 3.364 1.00 . A A . 17 LYS HA 1 1 17 5596 1 1 17 LYS HB2 H 3.831 10.060 4.024 1.00 . A A . 17 LYS HB2 1 1 17 5597 1 1 17 LYS HB3 H 4.982 8.907 4.775 1.00 . A A . 17 LYS HB3 1 1 17 5598 1 1 17 LYS HD2 H 4.430 11.308 2.099 1.00 . A A . 17 LYS HD2 1 1 17 5599 1 1 17 LYS HD3 H 5.332 12.316 3.284 1.00 . A A . 17 LYS HD3 1 1 17 5600 1 1 17 LYS HE2 H 6.532 11.057 0.725 1.00 . A A . 17 LYS HE2 1 1 17 5601 1 1 17 LYS HE3 H 6.058 12.796 0.933 1.00 . A A . 17 LYS HE3 1 1 17 5602 1 1 17 LYS HG2 H 6.506 10.506 4.161 1.00 . A A . 17 LYS HG2 1 1 17 5603 1 1 17 LYS HG3 H 6.482 9.590 2.622 1.00 . A A . 17 LYS HG3 1 1 17 5604 1 1 17 LYS HZ1 H 7.640 12.394 3.047 1.00 . A A . 17 LYS HZ1 1 1 17 5605 1 1 17 LYS HZ2 H 8.166 12.985 1.545 1.00 . A A . 17 LYS HZ2 1 1 17 5606 1 1 17 LYS HZ3 H 8.355 11.340 1.926 1.00 . A A . 17 LYS HZ3 1 1 17 5607 1 1 17 LYS N N 5.312 7.642 2.133 1.00 . A A . 17 LYS N 1 1 17 5608 1 1 17 LYS NZ N 7.742 12.173 2.037 1.00 . A A . 17 LYS NZ 1 1 17 5609 1 1 17 LYS O O 3.769 9.413 0.792 1.00 . A A . 17 LYS O 1 1 17 5610 1 1 17 LYS OXT O 2.050 8.921 2.103 1.00 . A A . 17 LYS OXT 1 1 18 5611 1 1 1 GLU C C -1.833 -8.633 -3.768 1.00 . A A . 1 GLU C 1 1 18 5612 1 1 1 GLU CA C -1.112 -9.618 -4.650 1.00 . A A . 1 GLU CA 1 1 18 5613 1 1 1 GLU CB C -0.101 -10.407 -3.793 1.00 . A A . 1 GLU CB 1 1 18 5614 1 1 1 GLU CD C 1.953 -10.384 -2.373 1.00 . A A . 1 GLU CD 1 1 18 5615 1 1 1 GLU CG C 0.967 -9.510 -3.140 1.00 . A A . 1 GLU CG 1 1 18 5616 1 1 1 GLU H1 H 0.373 -9.526 -6.107 1.00 . A A . 1 GLU H1 1 1 18 5617 1 1 1 GLU H2 H -0.015 -8.022 -5.419 1.00 . A A . 1 GLU H2 1 1 18 5618 1 1 1 GLU H3 H -1.070 -8.741 -6.541 1.00 . A A . 1 GLU H3 1 1 18 5619 1 1 1 GLU HA H -1.831 -10.289 -5.095 1.00 . A A . 1 GLU HA 1 1 18 5620 1 1 1 GLU HB2 H -0.653 -10.955 -2.997 1.00 . A A . 1 GLU HB2 1 1 18 5621 1 1 1 GLU HB3 H 0.405 -11.160 -4.436 1.00 . A A . 1 GLU HB3 1 1 18 5622 1 1 1 GLU HG2 H 1.512 -8.936 -3.920 1.00 . A A . 1 GLU HG2 1 1 18 5623 1 1 1 GLU HG3 H 0.491 -8.798 -2.435 1.00 . A A . 1 GLU HG3 1 1 18 5624 1 1 1 GLU N N -0.404 -8.923 -5.763 1.00 . A A . 1 GLU N 1 1 18 5625 1 1 1 GLU O O -2.132 -8.925 -2.611 1.00 . A A . 1 GLU O 1 1 18 5626 1 1 1 GLU OE1 O 1.771 -11.630 -2.370 1.00 . A A . 1 GLU OE1 1 1 18 5627 1 1 1 GLU OE2 O 2.904 -9.811 -1.778 1.00 . A A . 1 GLU OE2 1 1 18 5628 1 1 2 MET C C -3.853 -5.813 -4.419 1.00 . A A . 2 MET C 1 1 18 5629 1 1 2 MET CA C -2.829 -6.434 -3.543 1.00 . A A . 2 MET CA 1 1 18 5630 1 1 2 MET CB C -1.911 -5.338 -2.971 1.00 . A A . 2 MET CB 1 1 18 5631 1 1 2 MET CE C -4.115 -5.335 -0.908 1.00 . A A . 2 MET CE 1 1 18 5632 1 1 2 MET CG C -1.508 -5.545 -1.500 1.00 . A A . 2 MET CG 1 1 18 5633 1 1 2 MET H H -1.915 -7.202 -5.256 1.00 . A A . 2 MET H 1 1 18 5634 1 1 2 MET HA H -3.361 -6.917 -2.752 1.00 . A A . 2 MET HA 1 1 18 5635 1 1 2 MET HB2 H -0.987 -5.309 -3.583 1.00 . A A . 2 MET HB2 1 1 18 5636 1 1 2 MET HB3 H -2.408 -4.344 -3.060 1.00 . A A . 2 MET HB3 1 1 18 5637 1 1 2 MET HE1 H -4.552 -4.869 -0.001 1.00 . A A . 2 MET HE1 1 1 18 5638 1 1 2 MET HE2 H -4.920 -5.893 -1.435 1.00 . A A . 2 MET HE2 1 1 18 5639 1 1 2 MET HE3 H -3.769 -4.526 -1.580 1.00 . A A . 2 MET HE3 1 1 18 5640 1 1 2 MET HG2 H -0.544 -6.093 -1.474 1.00 . A A . 2 MET HG2 1 1 18 5641 1 1 2 MET HG3 H -1.332 -4.538 -1.063 1.00 . A A . 2 MET HG3 1 1 18 5642 1 1 2 MET N N -2.141 -7.437 -4.313 1.00 . A A . 2 MET N 1 1 18 5643 1 1 2 MET O O -4.024 -6.179 -5.580 1.00 . A A . 2 MET O 1 1 18 5644 1 1 2 MET SD S -2.736 -6.430 -0.480 1.00 . A A . 2 MET SD 1 1 18 5645 1 1 3 ARG C C -5.337 -2.780 -4.536 1.00 . A A . 3 ARG C 1 1 18 5646 1 1 3 ARG CA C -5.618 -4.195 -4.498 1.00 . A A . 3 ARG CA 1 1 18 5647 1 1 3 ARG CB C -6.864 -4.361 -3.669 1.00 . A A . 3 ARG CB 1 1 18 5648 1 1 3 ARG CD C -8.533 -2.650 -4.369 1.00 . A A . 3 ARG CD 1 1 18 5649 1 1 3 ARG CG C -8.139 -4.118 -4.449 1.00 . A A . 3 ARG CG 1 1 18 5650 1 1 3 ARG CZ C -10.304 -1.290 -3.286 1.00 . A A . 3 ARG CZ 1 1 18 5651 1 1 3 ARG H H -4.367 -4.486 -2.940 1.00 . A A . 3 ARG H 1 1 18 5652 1 1 3 ARG HA H -5.712 -4.559 -5.453 1.00 . A A . 3 ARG HA 1 1 18 5653 1 1 3 ARG HB2 H -6.864 -5.381 -3.235 1.00 . A A . 3 ARG HB2 1 1 18 5654 1 1 3 ARG HB3 H -6.801 -3.622 -2.829 1.00 . A A . 3 ARG HB3 1 1 18 5655 1 1 3 ARG HD2 H -7.708 -2.066 -3.889 1.00 . A A . 3 ARG HD2 1 1 18 5656 1 1 3 ARG HD3 H -8.751 -2.240 -5.377 1.00 . A A . 3 ARG HD3 1 1 18 5657 1 1 3 ARG HE H -10.183 -3.337 -3.135 1.00 . A A . 3 ARG HE 1 1 18 5658 1 1 3 ARG HG2 H -7.976 -4.405 -5.509 1.00 . A A . 3 ARG HG2 1 1 18 5659 1 1 3 ARG HG3 H -8.951 -4.748 -4.034 1.00 . A A . 3 ARG HG3 1 1 18 5660 1 1 3 ARG HH11 H -8.910 -0.257 -4.387 1.00 . A A . 3 ARG HH11 1 1 18 5661 1 1 3 ARG HH12 H -10.128 0.727 -3.645 1.00 . A A . 3 ARG HH12 1 1 18 5662 1 1 3 ARG HH21 H -11.841 -2.001 -2.124 1.00 . A A . 3 ARG HH21 1 1 18 5663 1 1 3 ARG HH22 H -11.823 -0.283 -2.336 1.00 . A A . 3 ARG HH22 1 1 18 5664 1 1 3 ARG N N -4.558 -4.832 -3.846 1.00 . A A . 3 ARG N 1 1 18 5665 1 1 3 ARG NE N -9.759 -2.520 -3.525 1.00 . A A . 3 ARG NE 1 1 18 5666 1 1 3 ARG NH1 N -9.730 -0.173 -3.820 1.00 . A A . 3 ARG NH1 1 1 18 5667 1 1 3 ARG NH2 N -11.423 -1.182 -2.514 1.00 . A A . 3 ARG NH2 1 1 18 5668 1 1 3 ARG O O -5.734 -2.048 -5.440 1.00 . A A . 3 ARG O 1 1 18 5669 1 1 4 LEU C C -3.401 -0.757 -4.453 1.00 . A A . 4 LEU C 1 1 18 5670 1 1 4 LEU CA C -4.292 -1.046 -3.353 1.00 . A A . 4 LEU CA 1 1 18 5671 1 1 4 LEU CB C -3.498 -0.810 -2.092 1.00 . A A . 4 LEU CB 1 1 18 5672 1 1 4 LEU CD1 C -2.471 -1.804 -0.107 1.00 . A A . 4 LEU CD1 1 1 18 5673 1 1 4 LEU CD2 C -4.974 -2.155 -0.580 1.00 . A A . 4 LEU CD2 1 1 18 5674 1 1 4 LEU CG C -3.568 -1.957 -1.146 1.00 . A A . 4 LEU CG 1 1 18 5675 1 1 4 LEU H H -4.227 -3.016 -2.870 1.00 . A A . 4 LEU H 1 1 18 5676 1 1 4 LEU HA H -5.119 -0.439 -3.400 1.00 . A A . 4 LEU HA 1 1 18 5677 1 1 4 LEU HB2 H -2.461 -0.609 -2.342 1.00 . A A . 4 LEU HB2 1 1 18 5678 1 1 4 LEU HB3 H -3.904 0.063 -1.573 1.00 . A A . 4 LEU HB3 1 1 18 5679 1 1 4 LEU HD11 H -1.719 -2.615 -0.243 1.00 . A A . 4 LEU HD11 1 1 18 5680 1 1 4 LEU HD12 H -2.881 -1.842 0.921 1.00 . A A . 4 LEU HD12 1 1 18 5681 1 1 4 LEU HD13 H -1.953 -0.826 -0.267 1.00 . A A . 4 LEU HD13 1 1 18 5682 1 1 4 LEU HD21 H -5.472 -1.174 -0.439 1.00 . A A . 4 LEU HD21 1 1 18 5683 1 1 4 LEU HD22 H -4.931 -2.684 0.395 1.00 . A A . 4 LEU HD22 1 1 18 5684 1 1 4 LEU HD23 H -5.582 -2.764 -1.297 1.00 . A A . 4 LEU HD23 1 1 18 5685 1 1 4 LEU HG H -3.309 -2.840 -1.739 1.00 . A A . 4 LEU HG 1 1 18 5686 1 1 4 LEU N N -4.611 -2.383 -3.526 1.00 . A A . 4 LEU N 1 1 18 5687 1 1 4 LEU O O -3.786 -0.022 -5.334 1.00 . A A . 4 LEU O 1 1 18 5688 1 1 5 SER C C -1.134 -1.005 -6.593 1.00 . A A . 5 SER C 1 1 18 5689 1 1 5 SER CA C -1.170 -1.701 -5.256 1.00 . A A . 5 SER CA 1 1 18 5690 1 1 5 SER CB C -0.729 -3.124 -5.337 1.00 . A A . 5 SER CB 1 1 18 5691 1 1 5 SER H H -2.452 -2.394 -3.827 1.00 . A A . 5 SER H 1 1 18 5692 1 1 5 SER HA H -0.456 -1.181 -4.627 1.00 . A A . 5 SER HA 1 1 18 5693 1 1 5 SER HB2 H 0.345 -3.161 -5.073 1.00 . A A . 5 SER HB2 1 1 18 5694 1 1 5 SER HB3 H -1.324 -3.678 -4.558 1.00 . A A . 5 SER HB3 1 1 18 5695 1 1 5 SER HG H -0.482 -3.155 -7.250 1.00 . A A . 5 SER HG 1 1 18 5696 1 1 5 SER N N -2.400 -1.655 -4.479 1.00 . A A . 5 SER N 1 1 18 5697 1 1 5 SER O O -0.125 -0.990 -7.282 1.00 . A A . 5 SER O 1 1 18 5698 1 1 5 SER OG O -0.950 -3.710 -6.617 1.00 . A A . 5 SER OG 1 1 18 5699 1 1 6 LYS C C -1.954 1.695 -7.229 1.00 . A A . 6 LYS C 1 1 18 5700 1 1 6 LYS CA C -2.253 0.448 -8.061 1.00 . A A . 6 LYS CA 1 1 18 5701 1 1 6 LYS CB C -3.607 0.629 -8.767 1.00 . A A . 6 LYS CB 1 1 18 5702 1 1 6 LYS CD C -3.242 -1.233 -10.484 1.00 . A A . 6 LYS CD 1 1 18 5703 1 1 6 LYS CE C -3.223 -0.354 -11.736 1.00 . A A . 6 LYS CE 1 1 18 5704 1 1 6 LYS CG C -4.144 -0.670 -9.379 1.00 . A A . 6 LYS CG 1 1 18 5705 1 1 6 LYS H H -3.119 -0.653 -6.560 1.00 . A A . 6 LYS H 1 1 18 5706 1 1 6 LYS HA H -1.439 0.240 -8.746 1.00 . A A . 6 LYS HA 1 1 18 5707 1 1 6 LYS HB2 H -4.345 1.021 -8.034 1.00 . A A . 6 LYS HB2 1 1 18 5708 1 1 6 LYS HB3 H -3.487 1.386 -9.571 1.00 . A A . 6 LYS HB3 1 1 18 5709 1 1 6 LYS HD2 H -2.206 -1.330 -10.095 1.00 . A A . 6 LYS HD2 1 1 18 5710 1 1 6 LYS HD3 H -3.599 -2.249 -10.759 1.00 . A A . 6 LYS HD3 1 1 18 5711 1 1 6 LYS HE2 H -4.252 -0.208 -12.127 1.00 . A A . 6 LYS HE2 1 1 18 5712 1 1 6 LYS HE3 H -2.768 0.635 -11.514 1.00 . A A . 6 LYS HE3 1 1 18 5713 1 1 6 LYS HG2 H -4.249 -1.432 -8.576 1.00 . A A . 6 LYS HG2 1 1 18 5714 1 1 6 LYS HG3 H -5.156 -0.479 -9.799 1.00 . A A . 6 LYS HG3 1 1 18 5715 1 1 6 LYS HZ1 H -3.054 -1.372 -13.534 1.00 . A A . 6 LYS HZ1 1 1 18 5716 1 1 6 LYS HZ2 H -1.861 -1.772 -12.393 1.00 . A A . 6 LYS HZ2 1 1 18 5717 1 1 6 LYS HZ3 H -1.780 -0.293 -13.224 1.00 . A A . 6 LYS HZ3 1 1 18 5718 1 1 6 LYS N N -2.240 -0.477 -7.004 1.00 . A A . 6 LYS N 1 1 18 5719 1 1 6 LYS NZ N -2.419 -0.995 -12.801 1.00 . A A . 6 LYS NZ 1 1 18 5720 1 1 6 LYS O O -1.953 2.820 -7.712 1.00 . A A . 6 LYS O 1 1 18 5721 1 1 7 PHE C C -0.338 2.564 -4.256 1.00 . A A . 7 PHE C 1 1 18 5722 1 1 7 PHE CA C -1.613 2.312 -4.816 1.00 . A A . 7 PHE CA 1 1 18 5723 1 1 7 PHE CB C -2.215 1.677 -3.594 1.00 . A A . 7 PHE CB 1 1 18 5724 1 1 7 PHE CD1 C -3.844 2.201 -1.942 1.00 . A A . 7 PHE CD1 1 1 18 5725 1 1 7 PHE CD2 C -1.726 3.201 -1.904 1.00 . A A . 7 PHE CD2 1 1 18 5726 1 1 7 PHE CE1 C -4.089 2.736 -0.739 1.00 . A A . 7 PHE CE1 1 1 18 5727 1 1 7 PHE CE2 C -1.911 3.765 -0.773 1.00 . A A . 7 PHE CE2 1 1 18 5728 1 1 7 PHE CG C -2.682 2.441 -2.516 1.00 . A A . 7 PHE CG 1 1 18 5729 1 1 7 PHE CZ C -3.119 3.551 -0.114 1.00 . A A . 7 PHE CZ 1 1 18 5730 1 1 7 PHE H H -1.761 0.449 -5.498 1.00 . A A . 7 PHE H 1 1 18 5731 1 1 7 PHE HA H -2.139 3.207 -5.002 1.00 . A A . 7 PHE HA 1 1 18 5732 1 1 7 PHE HB2 H -3.147 1.272 -3.941 1.00 . A A . 7 PHE HB2 1 1 18 5733 1 1 7 PHE HB3 H -1.635 0.835 -3.191 1.00 . A A . 7 PHE HB3 1 1 18 5734 1 1 7 PHE HD1 H -4.577 1.562 -2.445 1.00 . A A . 7 PHE HD1 1 1 18 5735 1 1 7 PHE HD2 H -0.791 3.378 -2.371 1.00 . A A . 7 PHE HD2 1 1 18 5736 1 1 7 PHE HE1 H -5.005 2.487 -0.282 1.00 . A A . 7 PHE HE1 1 1 18 5737 1 1 7 PHE HE2 H -1.052 4.333 -0.391 1.00 . A A . 7 PHE HE2 1 1 18 5738 1 1 7 PHE HZ H -3.305 3.988 0.857 1.00 . A A . 7 PHE HZ 1 1 18 5739 1 1 7 PHE N N -1.839 1.419 -5.861 1.00 . A A . 7 PHE N 1 1 18 5740 1 1 7 PHE O O 0.117 3.667 -4.261 1.00 . A A . 7 PHE O 1 1 18 5741 1 1 8 PHE C C 2.253 1.538 -3.517 1.00 . A A . 8 PHE C 1 1 18 5742 1 1 8 PHE CA C 1.205 1.726 -2.690 1.00 . A A . 8 PHE CA 1 1 18 5743 1 1 8 PHE CB C 1.576 0.661 -1.712 1.00 . A A . 8 PHE CB 1 1 18 5744 1 1 8 PHE CD1 C 2.038 -1.443 -2.289 1.00 . A A . 8 PHE CD1 1 1 18 5745 1 1 8 PHE CD2 C -0.163 -0.822 -1.979 1.00 . A A . 8 PHE CD2 1 1 18 5746 1 1 8 PHE CE1 C 1.713 -2.616 -2.632 1.00 . A A . 8 PHE CE1 1 1 18 5747 1 1 8 PHE CE2 C -0.524 -2.025 -2.323 1.00 . A A . 8 PHE CE2 1 1 18 5748 1 1 8 PHE CG C 1.098 -0.558 -1.968 1.00 . A A . 8 PHE CG 1 1 18 5749 1 1 8 PHE CZ C 0.418 -2.936 -2.660 1.00 . A A . 8 PHE CZ 1 1 18 5750 1 1 8 PHE H H -0.178 0.612 -3.658 1.00 . A A . 8 PHE H 1 1 18 5751 1 1 8 PHE HA H 1.222 2.683 -2.340 1.00 . A A . 8 PHE HA 1 1 18 5752 1 1 8 PHE HB2 H 2.637 0.556 -1.586 1.00 . A A . 8 PHE HB2 1 1 18 5753 1 1 8 PHE HB3 H 1.096 0.915 -0.768 1.00 . A A . 8 PHE HB3 1 1 18 5754 1 1 8 PHE HD1 H 3.082 -1.162 -2.263 1.00 . A A . 8 PHE HD1 1 1 18 5755 1 1 8 PHE HD2 H -0.878 -0.072 -1.693 1.00 . A A . 8 PHE HD2 1 1 18 5756 1 1 8 PHE HE1 H 2.473 -3.277 -2.906 1.00 . A A . 8 PHE HE1 1 1 18 5757 1 1 8 PHE HE2 H -1.533 -2.244 -2.375 1.00 . A A . 8 PHE HE2 1 1 18 5758 1 1 8 PHE HZ H 0.143 -3.864 -2.937 1.00 . A A . 8 PHE HZ 1 1 18 5759 1 1 8 PHE N N 0.168 1.522 -3.582 1.00 . A A . 8 PHE N 1 1 18 5760 1 1 8 PHE O O 3.172 2.205 -3.485 1.00 . A A . 8 PHE O 1 1 18 5761 1 1 9 ARG C C 2.942 1.316 -6.202 1.00 . A A . 9 ARG C 1 1 18 5762 1 1 9 ARG CA C 2.910 0.211 -5.296 1.00 . A A . 9 ARG CA 1 1 18 5763 1 1 9 ARG CB C 2.427 -1.012 -5.999 1.00 . A A . 9 ARG CB 1 1 18 5764 1 1 9 ARG CD C 4.372 -2.617 -6.126 1.00 . A A . 9 ARG CD 1 1 18 5765 1 1 9 ARG CG C 3.033 -2.299 -5.468 1.00 . A A . 9 ARG CG 1 1 18 5766 1 1 9 ARG CZ C 5.159 -3.385 -8.351 1.00 . A A . 9 ARG CZ 1 1 18 5767 1 1 9 ARG H H 1.144 0.149 -4.373 1.00 . A A . 9 ARG H 1 1 18 5768 1 1 9 ARG HA H 3.817 0.095 -4.828 1.00 . A A . 9 ARG HA 1 1 18 5769 1 1 9 ARG HB2 H 1.319 -1.037 -5.812 1.00 . A A . 9 ARG HB2 1 1 18 5770 1 1 9 ARG HB3 H 2.607 -0.908 -7.084 1.00 . A A . 9 ARG HB3 1 1 18 5771 1 1 9 ARG HD2 H 4.995 -1.699 -6.196 1.00 . A A . 9 ARG HD2 1 1 18 5772 1 1 9 ARG HD3 H 4.915 -3.402 -5.560 1.00 . A A . 9 ARG HD3 1 1 18 5773 1 1 9 ARG HE H 3.177 -3.271 -7.816 1.00 . A A . 9 ARG HE 1 1 18 5774 1 1 9 ARG HG2 H 3.191 -2.193 -4.381 1.00 . A A . 9 ARG HG2 1 1 18 5775 1 1 9 ARG HG3 H 2.326 -3.136 -5.642 1.00 . A A . 9 ARG HG3 1 1 18 5776 1 1 9 ARG HH11 H 6.620 -2.852 -7.010 1.00 . A A . 9 ARG HH11 1 1 18 5777 1 1 9 ARG HH12 H 7.205 -3.379 -8.552 1.00 . A A . 9 ARG HH12 1 1 18 5778 1 1 9 ARG HH21 H 3.971 -3.989 -9.914 1.00 . A A . 9 ARG HH21 1 1 18 5779 1 1 9 ARG HH22 H 5.672 -4.036 -10.232 1.00 . A A . 9 ARG HH22 1 1 18 5780 1 1 9 ARG N N 2.021 0.583 -4.347 1.00 . A A . 9 ARG N 1 1 18 5781 1 1 9 ARG NE N 4.116 -3.125 -7.506 1.00 . A A . 9 ARG NE 1 1 18 5782 1 1 9 ARG NH1 N 6.443 -3.188 -7.934 1.00 . A A . 9 ARG NH1 1 1 18 5783 1 1 9 ARG NH2 N 4.913 -3.845 -9.611 1.00 . A A . 9 ARG NH2 1 1 18 5784 1 1 9 ARG O O 3.629 1.314 -7.223 1.00 . A A . 9 ARG O 1 1 18 5785 1 1 10 ASP C C 2.127 4.585 -5.898 1.00 . A A . 10 ASP C 1 1 18 5786 1 1 10 ASP CA C 1.900 3.330 -6.640 1.00 . A A . 10 ASP CA 1 1 18 5787 1 1 10 ASP CB C 0.657 3.309 -7.306 1.00 . A A . 10 ASP CB 1 1 18 5788 1 1 10 ASP CG C 0.626 4.091 -8.616 1.00 . A A . 10 ASP CG 1 1 18 5789 1 1 10 ASP H H 1.460 2.159 -5.042 1.00 . A A . 10 ASP H 1 1 18 5790 1 1 10 ASP HA H 2.662 3.228 -7.296 1.00 . A A . 10 ASP HA 1 1 18 5791 1 1 10 ASP HB2 H 0.492 2.232 -7.480 1.00 . A A . 10 ASP HB2 1 1 18 5792 1 1 10 ASP HB3 H -0.078 3.696 -6.598 1.00 . A A . 10 ASP HB3 1 1 18 5793 1 1 10 ASP N N 2.013 2.215 -5.905 1.00 . A A . 10 ASP N 1 1 18 5794 1 1 10 ASP O O 2.111 5.652 -6.517 1.00 . A A . 10 ASP O 1 1 18 5795 1 1 10 ASP OD1 O 1.469 3.792 -9.501 1.00 . A A . 10 ASP OD1 1 1 18 5796 1 1 10 ASP OD2 O -0.238 4.999 -8.745 1.00 . A A . 10 ASP OD2 1 1 18 5797 1 1 11 . C C 2.341 6.056 -2.511 1.00 . A A . 11 DPN C 1 1 18 5798 1 1 11 . CA C 2.585 5.860 -3.977 1.00 . A A . 11 DPN CA 1 1 18 5799 1 1 11 . CB C 4.044 6.182 -4.214 1.00 . A A . 11 DPN CB 1 1 18 5800 1 1 11 . CD1 C 4.701 4.808 -6.108 1.00 . A A . 11 DPN CD1 1 1 18 5801 1 1 11 . CD2 C 4.900 4.188 -3.874 1.00 . A A . 11 DPN CD2 1 1 18 5802 1 1 11 . CE1 C 4.918 3.540 -6.433 1.00 . A A . 11 DPN CE1 1 1 18 5803 1 1 11 . CE2 C 5.185 3.015 -4.186 1.00 . A A . 11 DPN CE2 1 1 18 5804 1 1 11 . CG C 4.673 5.089 -4.780 1.00 . A A . 11 DPN CG 1 1 18 5805 1 1 11 . CZ C 5.157 2.671 -5.418 1.00 . A A . 11 DPN CZ 1 1 18 5806 1 1 11 . H H 2.302 3.692 -3.999 1.00 . A A . 11 DPN H 1 1 18 5807 1 1 11 . HA H 2.003 6.546 -4.469 1.00 . A A . 11 DPN HA 1 1 18 5808 1 1 11 . HB2 H 4.514 6.290 -3.245 1.00 . A A . 11 DPN HB2 1 1 18 5809 1 1 11 . HB3 H 4.165 7.005 -4.863 1.00 . A A . 11 DPN HB3 1 1 18 5810 1 1 11 . HD1 H 4.511 5.566 -6.855 1.00 . A A . 11 DPN HD1 1 1 18 5811 1 1 11 . HD2 H 4.931 4.471 -2.880 1.00 . A A . 11 DPN HD2 1 1 18 5812 1 1 11 . HE1 H 4.915 3.214 -7.459 1.00 . A A . 11 DPN HE1 1 1 18 5813 1 1 11 . HE2 H 5.316 2.292 -3.435 1.00 . A A . 11 DPN HE2 1 1 18 5814 1 1 11 . HZ H 5.219 1.729 -5.577 1.00 . A A . 11 DPN HZ 1 1 18 5815 1 1 11 . N N 2.293 4.559 -4.560 1.00 . A A . 11 DPN N 1 1 18 5816 1 1 11 . O O 1.371 6.692 -2.106 1.00 . A A . 11 DPN O 1 1 18 5817 1 1 12 ILE C C 4.577 5.042 0.188 1.00 . A A . 12 ILE C 1 1 18 5818 1 1 12 ILE CA C 3.302 5.720 -0.286 1.00 . A A . 12 ILE CA 1 1 18 5819 1 1 12 ILE CB C 2.128 5.152 0.442 1.00 . A A . 12 ILE CB 1 1 18 5820 1 1 12 ILE CD1 C 2.558 3.115 -0.673 1.00 . A A . 12 ILE CD1 1 1 18 5821 1 1 12 ILE CG1 C 1.518 4.097 -0.426 1.00 . A A . 12 ILE CG1 1 1 18 5822 1 1 12 ILE CG2 C 1.149 6.278 0.813 1.00 . A A . 12 ILE CG2 1 1 18 5823 1 1 12 ILE H H 3.894 4.855 -2.046 1.00 . A A . 12 ILE H 1 1 18 5824 1 1 12 ILE HA H 3.384 6.741 -0.111 1.00 . A A . 12 ILE HA 1 1 18 5825 1 1 12 ILE HB H 2.489 4.659 1.355 1.00 . A A . 12 ILE HB 1 1 18 5826 1 1 12 ILE HD11 H 2.225 2.136 -0.402 1.00 . A A . 12 ILE HD11 1 1 18 5827 1 1 12 ILE HD12 H 3.415 3.343 -0.070 1.00 . A A . 12 ILE HD12 1 1 18 5828 1 1 12 ILE HD13 H 2.859 3.147 -1.758 1.00 . A A . 12 ILE HD13 1 1 18 5829 1 1 12 ILE HG12 H 0.658 3.615 0.068 1.00 . A A . 12 ILE HG12 1 1 18 5830 1 1 12 ILE HG13 H 1.208 4.512 -1.407 1.00 . A A . 12 ILE HG13 1 1 18 5831 1 1 12 ILE HG21 H 1.257 6.548 1.885 1.00 . A A . 12 ILE HG21 1 1 18 5832 1 1 12 ILE HG22 H 0.102 5.954 0.634 1.00 . A A . 12 ILE HG22 1 1 18 5833 1 1 12 ILE HG23 H 1.347 7.183 0.198 1.00 . A A . 12 ILE HG23 1 1 18 5834 1 1 12 ILE N N 3.264 5.517 -1.704 1.00 . A A . 12 ILE N 1 1 18 5835 1 1 12 ILE O O 4.869 4.992 1.370 1.00 . A A . 12 ILE O 1 1 18 5836 1 1 13 LEU C C 7.650 4.314 -1.142 1.00 . A A . 13 LEU C 1 1 18 5837 1 1 13 LEU CA C 6.501 3.636 -0.526 1.00 . A A . 13 LEU CA 1 1 18 5838 1 1 13 LEU CB C 6.456 2.303 -1.245 1.00 . A A . 13 LEU CB 1 1 18 5839 1 1 13 LEU CD1 C 5.049 0.427 -1.980 1.00 . A A . 13 LEU CD1 1 1 18 5840 1 1 13 LEU CD2 C 4.741 1.568 0.327 1.00 . A A . 13 LEU CD2 1 1 18 5841 1 1 13 LEU CG C 5.119 1.703 -1.145 1.00 . A A . 13 LEU CG 1 1 18 5842 1 1 13 LEU H H 4.935 4.310 -1.720 1.00 . A A . 13 LEU H 1 1 18 5843 1 1 13 LEU HA H 6.635 3.508 0.526 1.00 . A A . 13 LEU HA 1 1 18 5844 1 1 13 LEU HB2 H 6.666 2.460 -2.318 1.00 . A A . 13 LEU HB2 1 1 18 5845 1 1 13 LEU HB3 H 7.197 1.606 -0.824 1.00 . A A . 13 LEU HB3 1 1 18 5846 1 1 13 LEU HD11 H 6.069 0.123 -2.283 1.00 . A A . 13 LEU HD11 1 1 18 5847 1 1 13 LEU HD12 H 4.460 0.628 -2.915 1.00 . A A . 13 LEU HD12 1 1 18 5848 1 1 13 LEU HD13 H 4.571 -0.393 -1.415 1.00 . A A . 13 LEU HD13 1 1 18 5849 1 1 13 LEU HD21 H 5.443 0.898 0.852 1.00 . A A . 13 LEU HD21 1 1 18 5850 1 1 13 LEU HD22 H 3.709 1.177 0.428 1.00 . A A . 13 LEU HD22 1 1 18 5851 1 1 13 LEU HD23 H 4.792 2.594 0.806 1.00 . A A . 13 LEU HD23 1 1 18 5852 1 1 13 LEU HG H 4.428 2.430 -1.616 1.00 . A A . 13 LEU HG 1 1 18 5853 1 1 13 LEU N N 5.285 4.385 -0.782 1.00 . A A . 13 LEU N 1 1 18 5854 1 1 13 LEU O O 8.691 4.503 -0.534 1.00 . A A . 13 LEU O 1 1 18 5855 1 1 14 GLN C C 8.701 6.616 -2.503 1.00 . A A . 14 GLN C 1 1 18 5856 1 1 14 GLN CA C 8.568 5.309 -3.136 1.00 . A A . 14 GLN CA 1 1 18 5857 1 1 14 GLN CB C 8.297 5.584 -4.612 1.00 . A A . 14 GLN CB 1 1 18 5858 1 1 14 GLN CD C 8.787 3.207 -4.958 1.00 . A A . 14 GLN CD 1 1 18 5859 1 1 14 GLN CG C 7.886 4.348 -5.340 1.00 . A A . 14 GLN CG 1 1 18 5860 1 1 14 GLN H H 6.637 4.431 -2.940 1.00 . A A . 14 GLN H 1 1 18 5861 1 1 14 GLN HA H 9.468 4.738 -2.998 1.00 . A A . 14 GLN HA 1 1 18 5862 1 1 14 GLN HB2 H 7.470 6.322 -4.689 1.00 . A A . 14 GLN HB2 1 1 18 5863 1 1 14 GLN HB3 H 9.199 6.009 -5.087 1.00 . A A . 14 GLN HB3 1 1 18 5864 1 1 14 GLN HE21 H 7.261 2.501 -3.823 1.00 . A A . 14 GLN HE21 1 1 18 5865 1 1 14 GLN HE22 H 8.713 1.539 -3.795 1.00 . A A . 14 GLN HE22 1 1 18 5866 1 1 14 GLN HG2 H 6.866 4.109 -5.025 1.00 . A A . 14 GLN HG2 1 1 18 5867 1 1 14 GLN HG3 H 7.914 4.507 -6.431 1.00 . A A . 14 GLN HG3 1 1 18 5868 1 1 14 GLN N N 7.489 4.647 -2.429 1.00 . A A . 14 GLN N 1 1 18 5869 1 1 14 GLN NE2 N 8.212 2.329 -4.123 1.00 . A A . 14 GLN NE2 1 1 18 5870 1 1 14 GLN O O 9.728 7.287 -2.588 1.00 . A A . 14 GLN O 1 1 18 5871 1 1 14 GLN OE1 O 9.952 3.131 -5.334 1.00 . A A . 14 GLN OE1 1 1 18 5872 1 1 15 ARG C C 7.767 7.959 0.264 1.00 . A A . 15 ARG C 1 1 18 5873 1 1 15 ARG CA C 7.606 8.253 -1.192 1.00 . A A . 15 ARG CA 1 1 18 5874 1 1 15 ARG CB C 6.290 9.020 -1.334 1.00 . A A . 15 ARG CB 1 1 18 5875 1 1 15 ARG CD C 4.021 8.617 -2.288 1.00 . A A . 15 ARG CD 1 1 18 5876 1 1 15 ARG CG C 5.513 8.641 -2.581 1.00 . A A . 15 ARG CG 1 1 18 5877 1 1 15 ARG CZ C 3.229 10.912 -2.843 1.00 . A A . 15 ARG CZ 1 1 18 5878 1 1 15 ARG H H 6.791 6.401 -1.769 1.00 . A A . 15 ARG H 1 1 18 5879 1 1 15 ARG HA H 8.433 8.809 -1.579 1.00 . A A . 15 ARG HA 1 1 18 5880 1 1 15 ARG HB2 H 5.656 8.828 -0.444 1.00 . A A . 15 ARG HB2 1 1 18 5881 1 1 15 ARG HB3 H 6.509 10.109 -1.369 1.00 . A A . 15 ARG HB3 1 1 18 5882 1 1 15 ARG HD2 H 3.446 8.297 -3.178 1.00 . A A . 15 ARG HD2 1 1 18 5883 1 1 15 ARG HD3 H 3.817 7.918 -1.439 1.00 . A A . 15 ARG HD3 1 1 18 5884 1 1 15 ARG HE H 3.549 10.240 -0.922 1.00 . A A . 15 ARG HE 1 1 18 5885 1 1 15 ARG HG2 H 5.728 9.364 -3.393 1.00 . A A . 15 ARG HG2 1 1 18 5886 1 1 15 ARG HG3 H 5.827 7.628 -2.918 1.00 . A A . 15 ARG HG3 1 1 18 5887 1 1 15 ARG HH11 H 3.548 9.671 -4.448 1.00 . A A . 15 ARG HH11 1 1 18 5888 1 1 15 ARG HH12 H 3.006 11.264 -4.857 1.00 . A A . 15 ARG HH12 1 1 18 5889 1 1 15 ARG HH21 H 2.813 12.399 -1.487 1.00 . A A . 15 ARG HH21 1 1 18 5890 1 1 15 ARG HH22 H 2.582 12.839 -3.146 1.00 . A A . 15 ARG HH22 1 1 18 5891 1 1 15 ARG N N 7.616 6.996 -1.840 1.00 . A A . 15 ARG N 1 1 18 5892 1 1 15 ARG NE N 3.581 9.990 -1.894 1.00 . A A . 15 ARG NE 1 1 18 5893 1 1 15 ARG NH1 N 3.264 10.587 -4.168 1.00 . A A . 15 ARG NH1 1 1 18 5894 1 1 15 ARG NH2 N 2.840 12.162 -2.458 1.00 . A A . 15 ARG NH2 1 1 18 5895 1 1 15 ARG O O 8.283 8.768 1.030 1.00 . A A . 15 ARG O 1 1 18 5896 1 1 16 LYS C C 6.218 6.932 2.788 1.00 . A A . 16 LYS C 1 1 18 5897 1 1 16 LYS CA C 7.281 6.253 1.981 1.00 . A A . 16 LYS CA 1 1 18 5898 1 1 16 LYS CB C 8.608 6.435 2.706 1.00 . A A . 16 LYS CB 1 1 18 5899 1 1 16 LYS CD C 9.531 4.114 2.190 1.00 . A A . 16 LYS CD 1 1 18 5900 1 1 16 LYS CE C 9.600 3.589 3.625 1.00 . A A . 16 LYS CE 1 1 18 5901 1 1 16 LYS CG C 9.758 5.628 2.100 1.00 . A A . 16 LYS CG 1 1 18 5902 1 1 16 LYS H H 6.861 6.141 -0.024 1.00 . A A . 16 LYS H 1 1 18 5903 1 1 16 LYS HA H 7.025 5.206 1.900 1.00 . A A . 16 LYS HA 1 1 18 5904 1 1 16 LYS HB2 H 8.857 7.507 2.669 1.00 . A A . 16 LYS HB2 1 1 18 5905 1 1 16 LYS HB3 H 8.478 6.147 3.764 1.00 . A A . 16 LYS HB3 1 1 18 5906 1 1 16 LYS HD2 H 8.533 3.873 1.761 1.00 . A A . 16 LYS HD2 1 1 18 5907 1 1 16 LYS HD3 H 10.299 3.598 1.575 1.00 . A A . 16 LYS HD3 1 1 18 5908 1 1 16 LYS HE2 H 10.572 3.852 4.092 1.00 . A A . 16 LYS HE2 1 1 18 5909 1 1 16 LYS HE3 H 8.771 4.008 4.235 1.00 . A A . 16 LYS HE3 1 1 18 5910 1 1 16 LYS HG2 H 9.880 5.914 1.033 1.00 . A A . 16 LYS HG2 1 1 18 5911 1 1 16 LYS HG3 H 10.700 5.885 2.632 1.00 . A A . 16 LYS HG3 1 1 18 5912 1 1 16 LYS HZ1 H 9.487 1.757 2.663 1.00 . A A . 16 LYS HZ1 1 1 18 5913 1 1 16 LYS HZ2 H 8.579 1.848 4.095 1.00 . A A . 16 LYS HZ2 1 1 18 5914 1 1 16 LYS HZ3 H 10.269 1.704 4.168 1.00 . A A . 16 LYS HZ3 1 1 18 5915 1 1 16 LYS N N 7.260 6.756 0.638 1.00 . A A . 16 LYS N 1 1 18 5916 1 1 16 LYS NZ N 9.475 2.115 3.639 1.00 . A A . 16 LYS NZ 1 1 18 5917 1 1 16 LYS O O 6.179 6.814 4.011 1.00 . A A . 16 LYS O 1 1 18 5918 1 1 17 LYS C C 3.291 8.922 1.788 1.00 . A A . 17 LYS C 1 1 18 5919 1 1 17 LYS CA C 4.242 8.300 2.809 1.00 . A A . 17 LYS CA 1 1 18 5920 1 1 17 LYS CB C 4.701 9.418 3.767 1.00 . A A . 17 LYS CB 1 1 18 5921 1 1 17 LYS CD C 5.434 11.493 2.465 1.00 . A A . 17 LYS CD 1 1 18 5922 1 1 17 LYS CE C 6.418 11.885 1.363 1.00 . A A . 17 LYS CE 1 1 18 5923 1 1 17 LYS CG C 5.879 10.240 3.229 1.00 . A A . 17 LYS CG 1 1 18 5924 1 1 17 LYS H H 5.367 7.759 1.127 1.00 . A A . 17 LYS H 1 1 18 5925 1 1 17 LYS HA H 3.712 7.534 3.343 1.00 . A A . 17 LYS HA 1 1 18 5926 1 1 17 LYS HB2 H 3.847 10.097 3.966 1.00 . A A . 17 LYS HB2 1 1 18 5927 1 1 17 LYS HB3 H 5.002 8.956 4.728 1.00 . A A . 17 LYS HB3 1 1 18 5928 1 1 17 LYS HD2 H 4.438 11.308 2.007 1.00 . A A . 17 LYS HD2 1 1 18 5929 1 1 17 LYS HD3 H 5.331 12.337 3.180 1.00 . A A . 17 LYS HD3 1 1 18 5930 1 1 17 LYS HE2 H 6.568 11.039 0.659 1.00 . A A . 17 LYS HE2 1 1 18 5931 1 1 17 LYS HE3 H 6.046 12.770 0.805 1.00 . A A . 17 LYS HE3 1 1 18 5932 1 1 17 LYS HG2 H 6.521 10.547 4.081 1.00 . A A . 17 LYS HG2 1 1 18 5933 1 1 17 LYS HG3 H 6.490 9.604 2.557 1.00 . A A . 17 LYS HG3 1 1 18 5934 1 1 17 LYS HZ1 H 8.136 13.043 1.438 1.00 . A A . 17 LYS HZ1 1 1 18 5935 1 1 17 LYS HZ2 H 8.374 11.413 1.855 1.00 . A A . 17 LYS HZ2 1 1 18 5936 1 1 17 LYS HZ3 H 7.617 12.469 2.949 1.00 . A A . 17 LYS HZ3 1 1 18 5937 1 1 17 LYS N N 5.316 7.646 2.108 1.00 . A A . 17 LYS N 1 1 18 5938 1 1 17 LYS NZ N 7.734 12.228 1.945 1.00 . A A . 17 LYS NZ 1 1 18 5939 1 1 17 LYS O O 3.774 9.356 0.719 1.00 . A A . 17 LYS O 1 1 18 5940 1 1 17 LYS OXT O 2.066 8.979 2.081 1.00 . A A . 17 LYS OXT 1 1 19 5941 1 1 1 GLU C C -2.099 -8.847 -3.780 1.00 . A A . 1 GLU C 1 1 19 5942 1 1 1 GLU CA C -1.414 -9.914 -4.586 1.00 . A A . 1 GLU CA 1 1 19 5943 1 1 1 GLU CB C 0.110 -9.763 -4.411 1.00 . A A . 1 GLU CB 1 1 19 5944 1 1 1 GLU CD C 2.103 -10.038 -2.951 1.00 . A A . 1 GLU CD 1 1 19 5945 1 1 1 GLU CG C 0.585 -10.139 -2.998 1.00 . A A . 1 GLU CG 1 1 19 5946 1 1 1 GLU H1 H -2.624 -9.209 -6.128 1.00 . A A . 1 GLU H1 1 1 19 5947 1 1 1 GLU H2 H -1.970 -10.751 -6.409 1.00 . A A . 1 GLU H2 1 1 19 5948 1 1 1 GLU H3 H -0.986 -9.374 -6.550 1.00 . A A . 1 GLU H3 1 1 19 5949 1 1 1 GLU HA H -1.739 -10.884 -4.243 1.00 . A A . 1 GLU HA 1 1 19 5950 1 1 1 GLU HB2 H 0.624 -10.415 -5.154 1.00 . A A . 1 GLU HB2 1 1 19 5951 1 1 1 GLU HB3 H 0.399 -8.711 -4.621 1.00 . A A . 1 GLU HB3 1 1 19 5952 1 1 1 GLU HG2 H 0.144 -9.447 -2.249 1.00 . A A . 1 GLU HG2 1 1 19 5953 1 1 1 GLU HG3 H 0.282 -11.179 -2.755 1.00 . A A . 1 GLU HG3 1 1 19 5954 1 1 1 GLU N N -1.776 -9.804 -6.027 1.00 . A A . 1 GLU N 1 1 19 5955 1 1 1 GLU O O -2.599 -9.108 -2.686 1.00 . A A . 1 GLU O 1 1 19 5956 1 1 1 GLU OE1 O 2.774 -11.002 -3.408 1.00 . A A . 1 GLU OE1 1 1 19 5957 1 1 1 GLU OE2 O 2.611 -8.996 -2.458 1.00 . A A . 1 GLU OE2 1 1 19 5958 1 1 2 MET C C -3.761 -5.908 -4.522 1.00 . A A . 2 MET C 1 1 19 5959 1 1 2 MET CA C -2.768 -6.521 -3.616 1.00 . A A . 2 MET CA 1 1 19 5960 1 1 2 MET CB C -1.795 -5.433 -3.124 1.00 . A A . 2 MET CB 1 1 19 5961 1 1 2 MET CE C -3.878 -5.413 -0.924 1.00 . A A . 2 MET CE 1 1 19 5962 1 1 2 MET CG C -1.311 -5.622 -1.675 1.00 . A A . 2 MET CG 1 1 19 5963 1 1 2 MET H H -1.748 -7.399 -5.211 1.00 . A A . 2 MET H 1 1 19 5964 1 1 2 MET HA H -3.326 -6.917 -2.792 1.00 . A A . 2 MET HA 1 1 19 5965 1 1 2 MET HB2 H -0.909 -5.427 -3.791 1.00 . A A . 2 MET HB2 1 1 19 5966 1 1 2 MET HB3 H -2.284 -4.434 -3.199 1.00 . A A . 2 MET HB3 1 1 19 5967 1 1 2 MET HE1 H -4.156 -4.829 -0.024 1.00 . A A . 2 MET HE1 1 1 19 5968 1 1 2 MET HE2 H -4.766 -5.995 -1.249 1.00 . A A . 2 MET HE2 1 1 19 5969 1 1 2 MET HE3 H -3.628 -4.699 -1.736 1.00 . A A . 2 MET HE3 1 1 19 5970 1 1 2 MET HG2 H -0.341 -6.159 -1.697 1.00 . A A . 2 MET HG2 1 1 19 5971 1 1 2 MET HG3 H -1.121 -4.609 -1.259 1.00 . A A . 2 MET HG3 1 1 19 5972 1 1 2 MET N N -2.137 -7.608 -4.318 1.00 . A A . 2 MET N 1 1 19 5973 1 1 2 MET O O -3.891 -6.264 -5.692 1.00 . A A . 2 MET O 1 1 19 5974 1 1 2 MET SD S -2.473 -6.505 -0.582 1.00 . A A . 2 MET SD 1 1 19 5975 1 1 3 ARG C C -5.311 -2.884 -4.624 1.00 . A A . 3 ARG C 1 1 19 5976 1 1 3 ARG CA C -5.541 -4.305 -4.649 1.00 . A A . 3 ARG CA 1 1 19 5977 1 1 3 ARG CB C -6.826 -4.498 -3.893 1.00 . A A . 3 ARG CB 1 1 19 5978 1 1 3 ARG CD C -6.863 -6.916 -3.221 1.00 . A A . 3 ARG CD 1 1 19 5979 1 1 3 ARG CG C -7.473 -5.854 -4.136 1.00 . A A . 3 ARG CG 1 1 19 5980 1 1 3 ARG CZ C -7.499 -8.113 -1.142 1.00 . A A . 3 ARG CZ 1 1 19 5981 1 1 3 ARG H H -4.304 -4.599 -3.043 1.00 . A A . 3 ARG H 1 1 19 5982 1 1 3 ARG HA H -5.579 -4.643 -5.618 1.00 . A A . 3 ARG HA 1 1 19 5983 1 1 3 ARG HB2 H -6.557 -4.409 -2.813 1.00 . A A . 3 ARG HB2 1 1 19 5984 1 1 3 ARG HB3 H -7.529 -3.681 -4.145 1.00 . A A . 3 ARG HB3 1 1 19 5985 1 1 3 ARG HD2 H -6.635 -7.846 -3.785 1.00 . A A . 3 ARG HD2 1 1 19 5986 1 1 3 ARG HD3 H -5.935 -6.521 -2.744 1.00 . A A . 3 ARG HD3 1 1 19 5987 1 1 3 ARG HE H -8.743 -6.812 -2.138 1.00 . A A . 3 ARG HE 1 1 19 5988 1 1 3 ARG HG2 H -8.567 -5.781 -3.949 1.00 . A A . 3 ARG HG2 1 1 19 5989 1 1 3 ARG HG3 H -7.320 -6.152 -5.195 1.00 . A A . 3 ARG HG3 1 1 19 5990 1 1 3 ARG HH11 H -5.616 -8.498 -1.869 1.00 . A A . 3 ARG HH11 1 1 19 5991 1 1 3 ARG HH12 H -6.021 -9.343 -0.412 1.00 . A A . 3 ARG HH12 1 1 19 5992 1 1 3 ARG HH21 H -9.295 -7.963 -0.158 1.00 . A A . 3 ARG HH21 1 1 19 5993 1 1 3 ARG HH22 H -8.149 -9.034 0.576 1.00 . A A . 3 ARG HH22 1 1 19 5994 1 1 3 ARG N N -4.484 -4.935 -3.960 1.00 . A A . 3 ARG N 1 1 19 5995 1 1 3 ARG NE N -7.839 -7.239 -2.137 1.00 . A A . 3 ARG NE 1 1 19 5996 1 1 3 ARG NH1 N -6.268 -8.704 -1.140 1.00 . A A . 3 ARG NH1 1 1 19 5997 1 1 3 ARG NH2 N -8.394 -8.395 -0.153 1.00 . A A . 3 ARG NH2 1 1 19 5998 1 1 3 ARG O O -5.807 -2.118 -5.445 1.00 . A A . 3 ARG O 1 1 19 5999 1 1 4 LEU C C -3.383 -0.834 -4.519 1.00 . A A . 4 LEU C 1 1 19 6000 1 1 4 LEU CA C -4.266 -1.172 -3.427 1.00 . A A . 4 LEU CA 1 1 19 6001 1 1 4 LEU CB C -3.484 -0.945 -2.159 1.00 . A A . 4 LEU CB 1 1 19 6002 1 1 4 LEU CD1 C -2.440 -1.962 -0.196 1.00 . A A . 4 LEU CD1 1 1 19 6003 1 1 4 LEU CD2 C -4.932 -2.377 -0.698 1.00 . A A . 4 LEU CD2 1 1 19 6004 1 1 4 LEU CG C -3.525 -2.120 -1.246 1.00 . A A . 4 LEU CG 1 1 19 6005 1 1 4 LEU H H -4.114 -3.165 -3.021 1.00 . A A . 4 LEU H 1 1 19 6006 1 1 4 LEU HA H -5.110 -0.586 -3.463 1.00 . A A . 4 LEU HA 1 1 19 6007 1 1 4 LEU HB2 H -2.451 -0.709 -2.400 1.00 . A A . 4 LEU HB2 1 1 19 6008 1 1 4 LEU HB3 H -3.917 -0.098 -1.617 1.00 . A A . 4 LEU HB3 1 1 19 6009 1 1 4 LEU HD11 H -2.854 -2.028 0.827 1.00 . A A . 4 LEU HD11 1 1 19 6010 1 1 4 LEU HD12 H -1.941 -0.970 -0.336 1.00 . A A . 4 LEU HD12 1 1 19 6011 1 1 4 LEU HD13 H -1.670 -2.755 -0.341 1.00 . A A . 4 LEU HD13 1 1 19 6012 1 1 4 LEU HD21 H -5.493 -1.422 -0.623 1.00 . A A . 4 LEU HD21 1 1 19 6013 1 1 4 LEU HD22 H -4.880 -2.848 0.303 1.00 . A A . 4 LEU HD22 1 1 19 6014 1 1 4 LEU HD23 H -5.483 -3.060 -1.397 1.00 . A A . 4 LEU HD23 1 1 19 6015 1 1 4 LEU HG H -3.235 -2.978 -1.861 1.00 . A A . 4 LEU HG 1 1 19 6016 1 1 4 LEU N N -4.546 -2.513 -3.638 1.00 . A A . 4 LEU N 1 1 19 6017 1 1 4 LEU O O -3.786 -0.088 -5.384 1.00 . A A . 4 LEU O 1 1 19 6018 1 1 5 SER C C -1.114 -0.981 -6.663 1.00 . A A . 5 SER C 1 1 19 6019 1 1 5 SER CA C -1.133 -1.710 -5.344 1.00 . A A . 5 SER CA 1 1 19 6020 1 1 5 SER CB C -0.671 -3.125 -5.460 1.00 . A A . 5 SER CB 1 1 19 6021 1 1 5 SER H H -2.399 -2.460 -3.932 1.00 . A A . 5 SER H 1 1 19 6022 1 1 5 SER HA H -0.427 -1.194 -4.704 1.00 . A A . 5 SER HA 1 1 19 6023 1 1 5 SER HB2 H 0.401 -3.154 -5.190 1.00 . A A . 5 SER HB2 1 1 19 6024 1 1 5 SER HB3 H -1.263 -3.709 -4.699 1.00 . A A . 5 SER HB3 1 1 19 6025 1 1 5 SER HG H -0.408 -3.104 -7.371 1.00 . A A . 5 SER HG 1 1 19 6026 1 1 5 SER N N -2.363 -1.707 -4.566 1.00 . A A . 5 SER N 1 1 19 6027 1 1 5 SER O O -0.104 -0.923 -7.349 1.00 . A A . 5 SER O 1 1 19 6028 1 1 5 SER OG O -0.875 -3.680 -6.757 1.00 . A A . 5 SER OG 1 1 19 6029 1 1 6 LYS C C -1.982 1.710 -7.239 1.00 . A A . 6 LYS C 1 1 19 6030 1 1 6 LYS CA C -2.265 0.478 -8.097 1.00 . A A . 6 LYS CA 1 1 19 6031 1 1 6 LYS CB C -3.631 0.639 -8.762 1.00 . A A . 6 LYS CB 1 1 19 6032 1 1 6 LYS CD C -5.471 -0.482 -10.090 1.00 . A A . 6 LYS CD 1 1 19 6033 1 1 6 LYS CE C -5.931 -1.741 -10.826 1.00 . A A . 6 LYS CE 1 1 19 6034 1 1 6 LYS CG C -4.078 -0.628 -9.490 1.00 . A A . 6 LYS CG 1 1 19 6035 1 1 6 LYS H H -3.114 -0.687 -6.643 1.00 . A A . 6 LYS H 1 1 19 6036 1 1 6 LYS HA H -1.462 0.299 -8.801 1.00 . A A . 6 LYS HA 1 1 19 6037 1 1 6 LYS HB2 H -4.383 0.904 -7.987 1.00 . A A . 6 LYS HB2 1 1 19 6038 1 1 6 LYS HB3 H -3.576 1.475 -9.491 1.00 . A A . 6 LYS HB3 1 1 19 6039 1 1 6 LYS HD2 H -6.184 -0.260 -9.269 1.00 . A A . 6 LYS HD2 1 1 19 6040 1 1 6 LYS HD3 H -5.474 0.377 -10.793 1.00 . A A . 6 LYS HD3 1 1 19 6041 1 1 6 LYS HE2 H -5.250 -1.969 -11.673 1.00 . A A . 6 LYS HE2 1 1 19 6042 1 1 6 LYS HE3 H -5.960 -2.609 -10.132 1.00 . A A . 6 LYS HE3 1 1 19 6043 1 1 6 LYS HG2 H -3.353 -0.858 -10.302 1.00 . A A . 6 LYS HG2 1 1 19 6044 1 1 6 LYS HG3 H -4.075 -1.481 -8.776 1.00 . A A . 6 LYS HG3 1 1 19 6045 1 1 6 LYS HZ1 H -7.443 -2.207 -12.163 1.00 . A A . 6 LYS HZ1 1 1 19 6046 1 1 6 LYS HZ2 H -7.390 -0.570 -11.716 1.00 . A A . 6 LYS HZ2 1 1 19 6047 1 1 6 LYS HZ3 H -7.994 -1.728 -10.630 1.00 . A A . 6 LYS HZ3 1 1 19 6048 1 1 6 LYS N N -2.231 -0.471 -7.067 1.00 . A A . 6 LYS N 1 1 19 6049 1 1 6 LYS NZ N -7.290 -1.548 -11.375 1.00 . A A . 6 LYS NZ 1 1 19 6050 1 1 6 LYS O O -1.999 2.846 -7.696 1.00 . A A . 6 LYS O 1 1 19 6051 1 1 7 PHE C C -0.380 2.539 -4.248 1.00 . A A . 7 PHE C 1 1 19 6052 1 1 7 PHE CA C -1.651 2.278 -4.813 1.00 . A A . 7 PHE CA 1 1 19 6053 1 1 7 PHE CB C -2.238 1.601 -3.608 1.00 . A A . 7 PHE CB 1 1 19 6054 1 1 7 PHE CD1 C -3.875 2.052 -1.943 1.00 . A A . 7 PHE CD1 1 1 19 6055 1 1 7 PHE CD2 C -1.774 3.084 -1.878 1.00 . A A . 7 PHE CD2 1 1 19 6056 1 1 7 PHE CE1 C -4.129 2.548 -0.725 1.00 . A A . 7 PHE CE1 1 1 19 6057 1 1 7 PHE CE2 C -1.966 3.612 -0.731 1.00 . A A . 7 PHE CE2 1 1 19 6058 1 1 7 PHE CG C -2.718 2.327 -2.511 1.00 . A A . 7 PHE CG 1 1 19 6059 1 1 7 PHE CZ C -3.171 3.361 -0.076 1.00 . A A . 7 PHE CZ 1 1 19 6060 1 1 7 PHE H H -1.766 0.429 -5.538 1.00 . A A . 7 PHE H 1 1 19 6061 1 1 7 PHE HA H -2.193 3.165 -4.977 1.00 . A A . 7 PHE HA 1 1 19 6062 1 1 7 PHE HB2 H -3.164 1.188 -3.965 1.00 . A A . 7 PHE HB2 1 1 19 6063 1 1 7 PHE HB3 H -1.643 0.758 -3.228 1.00 . A A . 7 PHE HB3 1 1 19 6064 1 1 7 PHE HD1 H -4.599 1.416 -2.465 1.00 . A A . 7 PHE HD1 1 1 19 6065 1 1 7 PHE HD2 H -0.842 3.292 -2.339 1.00 . A A . 7 PHE HD2 1 1 19 6066 1 1 7 PHE HE1 H -5.039 2.271 -0.274 1.00 . A A . 7 PHE HE1 1 1 19 6067 1 1 7 PHE HE2 H -1.117 4.182 -0.333 1.00 . A A . 7 PHE HE2 1 1 19 6068 1 1 7 PHE HZ H -3.363 3.767 0.907 1.00 . A A . 7 PHE HZ 1 1 19 6069 1 1 7 PHE N N -1.862 1.406 -5.878 1.00 . A A . 7 PHE N 1 1 19 6070 1 1 7 PHE O O 0.055 3.650 -4.225 1.00 . A A . 7 PHE O 1 1 19 6071 1 1 8 PHE C C 2.233 1.535 -3.534 1.00 . A A . 8 PHE C 1 1 19 6072 1 1 8 PHE CA C 1.182 1.692 -2.703 1.00 . A A . 8 PHE CA 1 1 19 6073 1 1 8 PHE CB C 1.567 0.617 -1.747 1.00 . A A . 8 PHE CB 1 1 19 6074 1 1 8 PHE CD1 C 2.064 -1.465 -2.373 1.00 . A A . 8 PHE CD1 1 1 19 6075 1 1 8 PHE CD2 C -0.147 -0.892 -2.046 1.00 . A A . 8 PHE CD2 1 1 19 6076 1 1 8 PHE CE1 C 1.761 -2.635 -2.744 1.00 . A A . 8 PHE CE1 1 1 19 6077 1 1 8 PHE CE2 C -0.486 -2.094 -2.418 1.00 . A A . 8 PHE CE2 1 1 19 6078 1 1 8 PHE CG C 1.109 -0.606 -2.029 1.00 . A A . 8 PHE CG 1 1 19 6079 1 1 8 PHE CZ C 0.474 -2.978 -2.779 1.00 . A A . 8 PHE CZ 1 1 19 6080 1 1 8 PHE H H -0.184 0.575 -3.695 1.00 . A A . 8 PHE H 1 1 19 6081 1 1 8 PHE HA H 1.185 2.644 -2.337 1.00 . A A . 8 PHE HA 1 1 19 6082 1 1 8 PHE HB2 H 2.630 0.526 -1.622 1.00 . A A . 8 PHE HB2 1 1 19 6083 1 1 8 PHE HB3 H 1.082 0.845 -0.798 1.00 . A A . 8 PHE HB3 1 1 19 6084 1 1 8 PHE HD1 H 3.104 -1.165 -2.341 1.00 . A A . 8 PHE HD1 1 1 19 6085 1 1 8 PHE HD2 H -0.875 -0.163 -1.742 1.00 . A A . 8 PHE HD2 1 1 19 6086 1 1 8 PHE HE1 H 2.534 -3.274 -3.034 1.00 . A A . 8 PHE HE1 1 1 19 6087 1 1 8 PHE HE2 H -1.490 -2.331 -2.477 1.00 . A A . 8 PHE HE2 1 1 19 6088 1 1 8 PHE HZ H 0.215 -3.905 -3.080 1.00 . A A . 8 PHE HZ 1 1 19 6089 1 1 8 PHE N N 0.147 1.491 -3.600 1.00 . A A . 8 PHE N 1 1 19 6090 1 1 8 PHE O O 3.148 2.207 -3.485 1.00 . A A . 8 PHE O 1 1 19 6091 1 1 9 ARG C C 2.921 1.395 -6.223 1.00 . A A . 9 ARG C 1 1 19 6092 1 1 9 ARG CA C 2.910 0.267 -5.344 1.00 . A A . 9 ARG CA 1 1 19 6093 1 1 9 ARG CB C 2.452 -0.948 -6.076 1.00 . A A . 9 ARG CB 1 1 19 6094 1 1 9 ARG CD C 4.429 -2.510 -6.229 1.00 . A A . 9 ARG CD 1 1 19 6095 1 1 9 ARG CG C 3.082 -2.234 -5.571 1.00 . A A . 9 ARG CG 1 1 19 6096 1 1 9 ARG CZ C 5.242 -3.208 -8.468 1.00 . A A . 9 ARG CZ 1 1 19 6097 1 1 9 ARG H H 1.143 0.156 -4.428 1.00 . A A . 9 ARG H 1 1 19 6098 1 1 9 ARG HA H 3.819 0.160 -4.877 1.00 . A A . 9 ARG HA 1 1 19 6099 1 1 9 ARG HB2 H 1.344 -0.999 -5.890 1.00 . A A . 9 ARG HB2 1 1 19 6100 1 1 9 ARG HB3 H 2.633 -0.816 -7.157 1.00 . A A . 9 ARG HB3 1 1 19 6101 1 1 9 ARG HD2 H 5.035 -1.580 -6.272 1.00 . A A . 9 ARG HD2 1 1 19 6102 1 1 9 ARG HD3 H 4.984 -3.299 -5.680 1.00 . A A . 9 ARG HD3 1 1 19 6103 1 1 9 ARG HE H 3.256 -3.143 -7.943 1.00 . A A . 9 ARG HE 1 1 19 6104 1 1 9 ARG HG2 H 3.231 -2.153 -4.482 1.00 . A A . 9 ARG HG2 1 1 19 6105 1 1 9 ARG HG3 H 2.391 -3.081 -5.768 1.00 . A A . 9 ARG HG3 1 1 19 6106 1 1 9 ARG HH11 H 6.686 -2.683 -7.104 1.00 . A A . 9 ARG HH11 1 1 19 6107 1 1 9 ARG HH12 H 7.290 -3.159 -8.655 1.00 . A A . 9 ARG HH12 1 1 19 6108 1 1 9 ARG HH21 H 4.075 -3.791 -10.054 1.00 . A A . 9 ARG HH21 1 1 19 6109 1 1 9 ARG HH22 H 5.779 -3.799 -10.362 1.00 . A A . 9 ARG HH22 1 1 19 6110 1 1 9 ARG N N 2.014 0.602 -4.388 1.00 . A A . 9 ARG N 1 1 19 6111 1 1 9 ARG NE N 4.190 -2.987 -7.624 1.00 . A A . 9 ARG NE 1 1 19 6112 1 1 9 ARG NH1 N 6.521 -2.998 -8.038 1.00 . A A . 9 ARG NH1 1 1 19 6113 1 1 9 ARG NH2 N 5.012 -3.638 -9.741 1.00 . A A . 9 ARG NH2 1 1 19 6114 1 1 9 ARG O O 3.607 1.430 -7.245 1.00 . A A . 9 ARG O 1 1 19 6115 1 1 10 ASP C C 2.045 4.642 -5.840 1.00 . A A . 10 ASP C 1 1 19 6116 1 1 10 ASP CA C 1.841 3.399 -6.611 1.00 . A A . 10 ASP CA 1 1 19 6117 1 1 10 ASP CB C 0.601 3.372 -7.278 1.00 . A A . 10 ASP CB 1 1 19 6118 1 1 10 ASP CG C 0.556 4.179 -8.573 1.00 . A A . 10 ASP CG 1 1 19 6119 1 1 10 ASP H H 1.426 2.183 -5.042 1.00 . A A . 10 ASP H 1 1 19 6120 1 1 10 ASP HA H 2.606 3.328 -7.268 1.00 . A A . 10 ASP HA 1 1 19 6121 1 1 10 ASP HB2 H 0.452 2.297 -7.474 1.00 . A A . 10 ASP HB2 1 1 19 6122 1 1 10 ASP HB3 H -0.142 3.733 -6.564 1.00 . A A . 10 ASP HB3 1 1 19 6123 1 1 10 ASP N N 1.976 2.270 -5.904 1.00 . A A . 10 ASP N 1 1 19 6124 1 1 10 ASP O O 2.008 5.723 -6.434 1.00 . A A . 10 ASP O 1 1 19 6125 1 1 10 ASP OD1 O 1.409 3.913 -9.462 1.00 . A A . 10 ASP OD1 1 1 19 6126 1 1 10 ASP OD2 O -0.325 5.072 -8.688 1.00 . A A . 10 ASP OD2 1 1 19 6127 1 1 11 . C C 2.228 6.036 -2.422 1.00 . A A . 11 DPN C 1 1 19 6128 1 1 11 . CA C 2.480 5.882 -3.890 1.00 . A A . 11 DPN CA 1 1 19 6129 1 1 11 . CB C 3.934 6.240 -4.115 1.00 . A A . 11 DPN CB 1 1 19 6130 1 1 11 . CD1 C 4.612 4.920 -6.041 1.00 . A A . 11 DPN CD1 1 1 19 6131 1 1 11 . CD2 C 4.831 4.251 -3.822 1.00 . A A . 11 DPN CD2 1 1 19 6132 1 1 11 . CE1 C 4.850 3.664 -6.399 1.00 . A A . 11 DPN CE1 1 1 19 6133 1 1 11 . CE2 C 5.136 3.090 -4.164 1.00 . A A . 11 DPN CE2 1 1 19 6134 1 1 11 . CG C 4.583 5.170 -4.708 1.00 . A A . 11 DPN CG 1 1 19 6135 1 1 11 . CZ C 5.109 2.773 -5.405 1.00 . A A . 11 DPN CZ 1 1 19 6136 1 1 11 . H H 2.242 3.708 -3.964 1.00 . A A . 11 DPN H 1 1 19 6137 1 1 11 . HA H 1.885 6.568 -4.367 1.00 . A A . 11 DPN HA 1 1 19 6138 1 1 11 . HB2 H 4.402 6.334 -3.146 1.00 . A A . 11 DPN HB2 1 1 19 6139 1 1 11 . HB3 H 4.041 7.078 -4.746 1.00 . A A . 11 DPN HB3 1 1 19 6140 1 1 11 . HD1 H 4.407 5.691 -6.771 1.00 . A A . 11 DPN HD1 1 1 19 6141 1 1 11 . HD2 H 4.861 4.512 -2.821 1.00 . A A . 11 DPN HD2 1 1 19 6142 1 1 11 . HE1 H 4.850 3.362 -7.432 1.00 . A A . 11 DPN HE1 1 1 19 6143 1 1 11 . HE2 H 5.284 2.350 -3.430 1.00 . A A . 11 DPN HE2 1 1 19 6144 1 1 11 . HZ H 5.188 1.835 -5.591 1.00 . A A . 11 DPN HZ 1 1 19 6145 1 1 11 . N N 2.215 4.589 -4.504 1.00 . A A . 11 DPN N 1 1 19 6146 1 1 11 . O O 1.239 6.634 -2.001 1.00 . A A . 11 DPN O 1 1 19 6147 1 1 12 ILE C C 4.506 5.044 0.249 1.00 . A A . 12 ILE C 1 1 19 6148 1 1 12 ILE CA C 3.193 5.667 -0.208 1.00 . A A . 12 ILE CA 1 1 19 6149 1 1 12 ILE CB C 2.035 5.027 0.498 1.00 . A A . 12 ILE CB 1 1 19 6150 1 1 12 ILE CD1 C 2.533 3.044 -0.660 1.00 . A A . 12 ILE CD1 1 1 19 6151 1 1 12 ILE CG1 C 1.467 3.976 -0.394 1.00 . A A . 12 ILE CG1 1 1 19 6152 1 1 12 ILE CG2 C 0.997 6.094 0.874 1.00 . A A . 12 ILE CG2 1 1 19 6153 1 1 12 ILE H H 3.822 4.879 -1.999 1.00 . A A . 12 ILE H 1 1 19 6154 1 1 12 ILE HA H 3.225 6.683 -0.002 1.00 . A A . 12 ILE HA 1 1 19 6155 1 1 12 ILE HB H 2.406 4.529 1.403 1.00 . A A . 12 ILE HB 1 1 19 6156 1 1 12 ILE HD11 H 3.390 3.307 -0.073 1.00 . A A . 12 ILE HD11 1 1 19 6157 1 1 12 ILE HD12 H 2.821 3.102 -1.746 1.00 . A A . 12 ILE HD12 1 1 19 6158 1 1 12 ILE HD13 H 2.236 2.044 -0.386 1.00 . A A . 12 ILE HD13 1 1 19 6159 1 1 12 ILE HG12 H 0.620 3.454 0.083 1.00 . A A . 12 ILE HG12 1 1 19 6160 1 1 12 ILE HG13 H 1.145 4.409 -1.366 1.00 . A A . 12 ILE HG13 1 1 19 6161 1 1 12 ILE HG21 H 0.884 6.154 1.977 1.00 . A A . 12 ILE HG21 1 1 19 6162 1 1 12 ILE HG22 H 0.010 5.843 0.430 1.00 . A A . 12 ILE HG22 1 1 19 6163 1 1 12 ILE HG23 H 1.311 7.086 0.491 1.00 . A A . 12 ILE HG23 1 1 19 6164 1 1 12 ILE N N 3.164 5.503 -1.632 1.00 . A A . 12 ILE N 1 1 19 6165 1 1 12 ILE O O 4.864 5.096 1.415 1.00 . A A . 12 ILE O 1 1 19 6166 1 1 13 LEU C C 7.581 4.339 -1.115 1.00 . A A . 13 LEU C 1 1 19 6167 1 1 13 LEU CA C 6.444 3.649 -0.497 1.00 . A A . 13 LEU CA 1 1 19 6168 1 1 13 LEU CB C 6.424 2.326 -1.234 1.00 . A A . 13 LEU CB 1 1 19 6169 1 1 13 LEU CD1 C 5.047 0.443 -1.997 1.00 . A A . 13 LEU CD1 1 1 19 6170 1 1 13 LEU CD2 C 4.735 1.545 0.336 1.00 . A A . 13 LEU CD2 1 1 19 6171 1 1 13 LEU CG C 5.101 1.703 -1.140 1.00 . A A . 13 LEU CG 1 1 19 6172 1 1 13 LEU H H 4.833 4.280 -1.656 1.00 . A A . 13 LEU H 1 1 19 6173 1 1 13 LEU HA H 6.592 3.507 0.551 1.00 . A A . 13 LEU HA 1 1 19 6174 1 1 13 LEU HB2 H 6.629 2.500 -2.307 1.00 . A A . 13 LEU HB2 1 1 19 6175 1 1 13 LEU HB3 H 7.178 1.636 -0.824 1.00 . A A . 13 LEU HB3 1 1 19 6176 1 1 13 LEU HD11 H 4.556 -0.385 -1.455 1.00 . A A . 13 LEU HD11 1 1 19 6177 1 1 13 LEU HD12 H 6.073 0.143 -2.287 1.00 . A A . 13 LEU HD12 1 1 19 6178 1 1 13 LEU HD13 H 4.472 0.658 -2.938 1.00 . A A . 13 LEU HD13 1 1 19 6179 1 1 13 LEU HD21 H 5.456 0.885 0.849 1.00 . A A . 13 LEU HD21 1 1 19 6180 1 1 13 LEU HD22 H 3.713 1.130 0.440 1.00 . A A . 13 LEU HD22 1 1 19 6181 1 1 13 LEU HD23 H 4.766 2.569 0.828 1.00 . A A . 13 LEU HD23 1 1 19 6182 1 1 13 LEU HG H 4.401 2.427 -1.598 1.00 . A A . 13 LEU HG 1 1 19 6183 1 1 13 LEU N N 5.203 4.373 -0.728 1.00 . A A . 13 LEU N 1 1 19 6184 1 1 13 LEU O O 8.622 4.511 -0.510 1.00 . A A . 13 LEU O 1 1 19 6185 1 1 14 GLN C C 8.646 6.648 -2.445 1.00 . A A . 14 GLN C 1 1 19 6186 1 1 14 GLN CA C 8.502 5.355 -3.100 1.00 . A A . 14 GLN CA 1 1 19 6187 1 1 14 GLN CB C 8.232 5.662 -4.571 1.00 . A A . 14 GLN CB 1 1 19 6188 1 1 14 GLN CD C 8.717 3.293 -4.971 1.00 . A A . 14 GLN CD 1 1 19 6189 1 1 14 GLN CG C 7.814 4.442 -5.322 1.00 . A A . 14 GLN CG 1 1 19 6190 1 1 14 GLN H H 6.565 4.482 -2.912 1.00 . A A . 14 GLN H 1 1 19 6191 1 1 14 GLN HA H 9.397 4.776 -2.974 1.00 . A A . 14 GLN HA 1 1 19 6192 1 1 14 GLN HB2 H 7.411 6.407 -4.636 1.00 . A A . 14 GLN HB2 1 1 19 6193 1 1 14 GLN HB3 H 9.137 6.089 -5.039 1.00 . A A . 14 GLN HB3 1 1 19 6194 1 1 14 GLN HE21 H 7.203 2.571 -3.830 1.00 . A A . 14 GLN HE21 1 1 19 6195 1 1 14 GLN HE22 H 8.652 1.604 -3.836 1.00 . A A . 14 GLN HE22 1 1 19 6196 1 1 14 GLN HG2 H 6.796 4.201 -5.006 1.00 . A A . 14 GLN HG2 1 1 19 6197 1 1 14 GLN HG3 H 7.835 4.624 -6.410 1.00 . A A . 14 GLN HG3 1 1 19 6198 1 1 14 GLN N N 7.419 4.688 -2.400 1.00 . A A . 14 GLN N 1 1 19 6199 1 1 14 GLN NE2 N 8.149 2.401 -4.144 1.00 . A A . 14 GLN NE2 1 1 19 6200 1 1 14 GLN O O 9.677 7.314 -2.519 1.00 . A A . 14 GLN O 1 1 19 6201 1 1 14 GLN OE1 O 9.878 3.221 -5.359 1.00 . A A . 14 GLN OE1 1 1 19 6202 1 1 15 ARG C C 7.800 7.934 0.335 1.00 . A A . 15 ARG C 1 1 19 6203 1 1 15 ARG CA C 7.564 8.257 -1.099 1.00 . A A . 15 ARG CA 1 1 19 6204 1 1 15 ARG CB C 6.223 9.006 -1.148 1.00 . A A . 15 ARG CB 1 1 19 6205 1 1 15 ARG CD C 3.917 8.621 -2.005 1.00 . A A . 15 ARG CD 1 1 19 6206 1 1 15 ARG CG C 5.393 8.650 -2.363 1.00 . A A . 15 ARG CG 1 1 19 6207 1 1 15 ARG CZ C 3.239 11.006 -2.238 1.00 . A A . 15 ARG CZ 1 1 19 6208 1 1 15 ARG H H 6.738 6.425 -1.717 1.00 . A A . 15 ARG H 1 1 19 6209 1 1 15 ARG HA H 8.360 8.838 -1.511 1.00 . A A . 15 ARG HA 1 1 19 6210 1 1 15 ARG HB2 H 5.628 8.779 -0.233 1.00 . A A . 15 ARG HB2 1 1 19 6211 1 1 15 ARG HB3 H 6.422 10.098 -1.161 1.00 . A A . 15 ARG HB3 1 1 19 6212 1 1 15 ARG HD2 H 3.292 8.420 -2.900 1.00 . A A . 15 ARG HD2 1 1 19 6213 1 1 15 ARG HD3 H 3.737 7.834 -1.239 1.00 . A A . 15 ARG HD3 1 1 19 6214 1 1 15 ARG HE H 3.489 10.057 -0.425 1.00 . A A . 15 ARG HE 1 1 19 6215 1 1 15 ARG HG2 H 5.572 9.387 -3.172 1.00 . A A . 15 ARG HG2 1 1 19 6216 1 1 15 ARG HG3 H 5.692 7.643 -2.729 1.00 . A A . 15 ARG HG3 1 1 19 6217 1 1 15 ARG HH11 H 3.496 9.975 -3.996 1.00 . A A . 15 ARG HH11 1 1 19 6218 1 1 15 ARG HH12 H 3.053 11.638 -4.187 1.00 . A A . 15 ARG HH12 1 1 19 6219 1 1 15 ARG HH21 H 2.895 12.321 -0.696 1.00 . A A . 15 ARG HH21 1 1 19 6220 1 1 15 ARG HH22 H 2.706 12.991 -2.282 1.00 . A A . 15 ARG HH22 1 1 19 6221 1 1 15 ARG N N 7.565 7.018 -1.775 1.00 . A A . 15 ARG N 1 1 19 6222 1 1 15 ARG NE N 3.529 9.945 -1.422 1.00 . A A . 15 ARG NE 1 1 19 6223 1 1 15 ARG NH1 N 3.265 10.861 -3.595 1.00 . A A . 15 ARG NH1 1 1 19 6224 1 1 15 ARG NH2 N 2.918 12.214 -1.691 1.00 . A A . 15 ARG NH2 1 1 19 6225 1 1 15 ARG O O 8.366 8.725 1.085 1.00 . A A . 15 ARG O 1 1 19 6226 1 1 16 LYS C C 6.543 7.177 2.901 1.00 . A A . 16 LYS C 1 1 19 6227 1 1 16 LYS CA C 7.383 6.244 2.083 1.00 . A A . 16 LYS CA 1 1 19 6228 1 1 16 LYS CB C 8.792 6.263 2.667 1.00 . A A . 16 LYS CB 1 1 19 6229 1 1 16 LYS CD C 10.727 5.426 1.260 1.00 . A A . 16 LYS CD 1 1 19 6230 1 1 16 LYS CE C 11.632 4.246 0.903 1.00 . A A . 16 LYS CE 1 1 19 6231 1 1 16 LYS CG C 9.641 5.055 2.274 1.00 . A A . 16 LYS CG 1 1 19 6232 1 1 16 LYS H H 6.899 6.094 0.076 1.00 . A A . 16 LYS H 1 1 19 6233 1 1 16 LYS HA H 6.950 5.247 2.089 1.00 . A A . 16 LYS HA 1 1 19 6234 1 1 16 LYS HB2 H 9.287 7.182 2.311 1.00 . A A . 16 LYS HB2 1 1 19 6235 1 1 16 LYS HB3 H 8.723 6.314 3.769 1.00 . A A . 16 LYS HB3 1 1 19 6236 1 1 16 LYS HD2 H 10.238 5.803 0.333 1.00 . A A . 16 LYS HD2 1 1 19 6237 1 1 16 LYS HD3 H 11.345 6.249 1.677 1.00 . A A . 16 LYS HD3 1 1 19 6238 1 1 16 LYS HE2 H 11.030 3.329 0.728 1.00 . A A . 16 LYS HE2 1 1 19 6239 1 1 16 LYS HE3 H 12.230 4.474 -0.006 1.00 . A A . 16 LYS HE3 1 1 19 6240 1 1 16 LYS HG2 H 10.118 4.632 3.184 1.00 . A A . 16 LYS HG2 1 1 19 6241 1 1 16 LYS HG3 H 8.984 4.273 1.835 1.00 . A A . 16 LYS HG3 1 1 19 6242 1 1 16 LYS HZ1 H 13.547 4.156 1.695 1.00 . A A . 16 LYS HZ1 1 1 19 6243 1 1 16 LYS HZ2 H 12.490 2.968 2.293 1.00 . A A . 16 LYS HZ2 1 1 19 6244 1 1 16 LYS HZ3 H 12.347 4.576 2.820 1.00 . A A . 16 LYS HZ3 1 1 19 6245 1 1 16 LYS N N 7.309 6.724 0.726 1.00 . A A . 16 LYS N 1 1 19 6246 1 1 16 LYS NZ N 12.575 3.966 2.010 1.00 . A A . 16 LYS NZ 1 1 19 6247 1 1 16 LYS O O 6.687 7.296 4.115 1.00 . A A . 16 LYS O 1 1 19 6248 1 1 17 LYS C C 5.601 9.932 3.406 1.00 . A A . 17 LYS C 1 1 19 6249 1 1 17 LYS CA C 4.749 8.815 2.770 1.00 . A A . 17 LYS CA 1 1 19 6250 1 1 17 LYS CB C 3.765 8.256 3.817 1.00 . A A . 17 LYS CB 1 1 19 6251 1 1 17 LYS CD C 1.899 9.604 2.738 1.00 . A A . 17 LYS CD 1 1 19 6252 1 1 17 LYS CE C 1.518 9.558 1.262 1.00 . A A . 17 LYS CE 1 1 19 6253 1 1 17 LYS CG C 2.344 8.235 3.270 1.00 . A A . 17 LYS CG 1 1 19 6254 1 1 17 LYS H H 5.495 7.646 1.230 1.00 . A A . 17 LYS H 1 1 19 6255 1 1 17 LYS HA H 4.203 9.236 1.939 1.00 . A A . 17 LYS HA 1 1 19 6256 1 1 17 LYS HB2 H 4.070 7.223 4.094 1.00 . A A . 17 LYS HB2 1 1 19 6257 1 1 17 LYS HB3 H 3.789 8.883 4.733 1.00 . A A . 17 LYS HB3 1 1 19 6258 1 1 17 LYS HD2 H 1.030 9.962 3.328 1.00 . A A . 17 LYS HD2 1 1 19 6259 1 1 17 LYS HD3 H 2.728 10.331 2.870 1.00 . A A . 17 LYS HD3 1 1 19 6260 1 1 17 LYS HE2 H 2.386 9.216 0.649 1.00 . A A . 17 LYS HE2 1 1 19 6261 1 1 17 LYS HE3 H 0.657 8.875 1.102 1.00 . A A . 17 LYS HE3 1 1 19 6262 1 1 17 LYS HG2 H 2.299 7.496 2.444 1.00 . A A . 17 LYS HG2 1 1 19 6263 1 1 17 LYS HG3 H 1.646 7.906 4.069 1.00 . A A . 17 LYS HG3 1 1 19 6264 1 1 17 LYS HZ1 H 1.676 11.624 1.302 1.00 . A A . 17 LYS HZ1 1 1 19 6265 1 1 17 LYS HZ2 H 0.113 11.051 0.962 1.00 . A A . 17 LYS HZ2 1 1 19 6266 1 1 17 LYS HZ3 H 1.321 10.981 -0.230 1.00 . A A . 17 LYS HZ3 1 1 19 6267 1 1 17 LYS N N 5.623 7.836 2.195 1.00 . A A . 17 LYS N 1 1 19 6268 1 1 17 LYS NZ N 1.129 10.904 0.789 1.00 . A A . 17 LYS NZ 1 1 19 6269 1 1 17 LYS O O 6.081 10.812 2.640 1.00 . A A . 17 LYS O 1 1 19 6270 1 1 17 LYS OXT O 5.769 9.928 4.658 1.00 . A A . 17 LYS OXT 1 1 20 6271 1 1 1 GLU C C -1.824 -8.686 -3.887 1.00 . A A . 1 GLU C 1 1 20 6272 1 1 1 GLU CA C -1.083 -9.639 -4.784 1.00 . A A . 1 GLU CA 1 1 20 6273 1 1 1 GLU CB C -1.657 -11.056 -4.586 1.00 . A A . 1 GLU CB 1 1 20 6274 1 1 1 GLU CD C -3.602 -12.606 -4.813 1.00 . A A . 1 GLU CD 1 1 20 6275 1 1 1 GLU CG C -3.139 -11.163 -4.986 1.00 . A A . 1 GLU CG 1 1 20 6276 1 1 1 GLU H1 H 0.818 -10.479 -4.864 1.00 . A A . 1 GLU H1 1 1 20 6277 1 1 1 GLU H2 H 0.496 -9.624 -3.431 1.00 . A A . 1 GLU H2 1 1 20 6278 1 1 1 GLU H3 H 0.810 -8.780 -4.871 1.00 . A A . 1 GLU H3 1 1 20 6279 1 1 1 GLU HA H -1.193 -9.326 -5.810 1.00 . A A . 1 GLU HA 1 1 20 6280 1 1 1 GLU HB2 H -1.062 -11.772 -5.198 1.00 . A A . 1 GLU HB2 1 1 20 6281 1 1 1 GLU HB3 H -1.549 -11.346 -3.519 1.00 . A A . 1 GLU HB3 1 1 20 6282 1 1 1 GLU HG2 H -3.758 -10.500 -4.343 1.00 . A A . 1 GLU HG2 1 1 20 6283 1 1 1 GLU HG3 H -3.274 -10.865 -6.046 1.00 . A A . 1 GLU HG3 1 1 20 6284 1 1 1 GLU N N 0.369 -9.630 -4.464 1.00 . A A . 1 GLU N 1 1 20 6285 1 1 1 GLU O O -2.147 -9.010 -2.745 1.00 . A A . 1 GLU O 1 1 20 6286 1 1 1 GLU OE1 O -2.769 -13.454 -4.394 1.00 . A A . 1 GLU OE1 1 1 20 6287 1 1 1 GLU OE2 O -4.798 -12.877 -5.098 1.00 . A A . 1 GLU OE2 1 1 20 6288 1 1 2 MET C C -3.843 -5.871 -4.499 1.00 . A A . 2 MET C 1 1 20 6289 1 1 2 MET CA C -2.818 -6.493 -3.623 1.00 . A A . 2 MET CA 1 1 20 6290 1 1 2 MET CB C -1.918 -5.394 -3.028 1.00 . A A . 2 MET CB 1 1 20 6291 1 1 2 MET CE C -4.144 -5.432 -0.987 1.00 . A A . 2 MET CE 1 1 20 6292 1 1 2 MET CG C -1.531 -5.617 -1.555 1.00 . A A . 2 MET CG 1 1 20 6293 1 1 2 MET H H -1.861 -7.209 -5.332 1.00 . A A . 2 MET H 1 1 20 6294 1 1 2 MET HA H -3.350 -6.994 -2.845 1.00 . A A . 2 MET HA 1 1 20 6295 1 1 2 MET HB2 H -0.988 -5.350 -3.628 1.00 . A A . 2 MET HB2 1 1 20 6296 1 1 2 MET HB3 H -2.424 -4.405 -3.110 1.00 . A A . 2 MET HB3 1 1 20 6297 1 1 2 MET HE1 H -3.796 -4.610 -1.642 1.00 . A A . 2 MET HE1 1 1 20 6298 1 1 2 MET HE2 H -4.595 -4.984 -0.078 1.00 . A A . 2 MET HE2 1 1 20 6299 1 1 2 MET HE3 H -4.939 -5.988 -1.532 1.00 . A A . 2 MET HE3 1 1 20 6300 1 1 2 MET HG2 H -0.562 -6.157 -1.526 1.00 . A A . 2 MET HG2 1 1 20 6301 1 1 2 MET HG3 H -1.366 -4.614 -1.104 1.00 . A A . 2 MET HG3 1 1 20 6302 1 1 2 MET N N -2.112 -7.473 -4.404 1.00 . A A . 2 MET N 1 1 20 6303 1 1 2 MET O O -4.005 -6.227 -5.665 1.00 . A A . 2 MET O 1 1 20 6304 1 1 2 MET SD S -2.762 -6.524 -0.560 1.00 . A A . 2 MET SD 1 1 20 6305 1 1 3 ARG C C -5.354 -2.853 -4.597 1.00 . A A . 3 ARG C 1 1 20 6306 1 1 3 ARG CA C -5.622 -4.269 -4.573 1.00 . A A . 3 ARG CA 1 1 20 6307 1 1 3 ARG CB C -6.871 -4.452 -3.751 1.00 . A A . 3 ARG CB 1 1 20 6308 1 1 3 ARG CD C -8.550 -2.747 -4.442 1.00 . A A . 3 ARG CD 1 1 20 6309 1 1 3 ARG CG C -8.144 -4.211 -4.535 1.00 . A A . 3 ARG CG 1 1 20 6310 1 1 3 ARG CZ C -10.327 -1.410 -3.342 1.00 . A A . 3 ARG CZ 1 1 20 6311 1 1 3 ARG H H -4.379 -4.565 -3.011 1.00 . A A . 3 ARG H 1 1 20 6312 1 1 3 ARG HA H -5.709 -4.626 -5.531 1.00 . A A . 3 ARG HA 1 1 20 6313 1 1 3 ARG HB2 H -6.866 -5.478 -3.328 1.00 . A A . 3 ARG HB2 1 1 20 6314 1 1 3 ARG HB3 H -6.818 -3.721 -2.904 1.00 . A A . 3 ARG HB3 1 1 20 6315 1 1 3 ARG HD2 H -7.730 -2.161 -3.958 1.00 . A A . 3 ARG HD2 1 1 20 6316 1 1 3 ARG HD3 H -8.771 -2.330 -5.446 1.00 . A A . 3 ARG HD3 1 1 20 6317 1 1 3 ARG HE H -10.197 -3.458 -3.217 1.00 . A A . 3 ARG HE 1 1 20 6318 1 1 3 ARG HG2 H -7.975 -4.485 -5.597 1.00 . A A . 3 ARG HG2 1 1 20 6319 1 1 3 ARG HG3 H -8.954 -4.852 -4.131 1.00 . A A . 3 ARG HG3 1 1 20 6320 1 1 3 ARG HH11 H -8.940 -0.357 -4.431 1.00 . A A . 3 ARG HH11 1 1 20 6321 1 1 3 ARG HH12 H -10.161 0.613 -3.676 1.00 . A A . 3 ARG HH12 1 1 20 6322 1 1 3 ARG HH21 H -11.861 -2.144 -2.189 1.00 . A A . 3 ARG HH21 1 1 20 6323 1 1 3 ARG HH22 H -11.851 -0.423 -2.379 1.00 . A A . 3 ARG HH22 1 1 20 6324 1 1 3 ARG N N -4.561 -4.903 -3.921 1.00 . A A . 3 ARG N 1 1 20 6325 1 1 3 ARG NE N -9.777 -2.635 -3.598 1.00 . A A . 3 ARG NE 1 1 20 6326 1 1 3 ARG NH1 N -9.760 -0.283 -3.862 1.00 . A A . 3 ARG NH1 1 1 20 6327 1 1 3 ARG NH2 N -11.446 -1.317 -2.568 1.00 . A A . 3 ARG NH2 1 1 20 6328 1 1 3 ARG O O -5.751 -2.115 -5.496 1.00 . A A . 3 ARG O 1 1 20 6329 1 1 4 LEU C C -3.432 -0.817 -4.482 1.00 . A A . 4 LEU C 1 1 20 6330 1 1 4 LEU CA C -4.331 -1.121 -3.393 1.00 . A A . 4 LEU CA 1 1 20 6331 1 1 4 LEU CB C -3.550 -0.887 -2.124 1.00 . A A . 4 LEU CB 1 1 20 6332 1 1 4 LEU CD1 C -2.529 -1.887 -0.138 1.00 . A A . 4 LEU CD1 1 1 20 6333 1 1 4 LEU CD2 C -5.026 -2.259 -0.633 1.00 . A A . 4 LEU CD2 1 1 20 6334 1 1 4 LEU CG C -3.617 -2.043 -1.186 1.00 . A A . 4 LEU CG 1 1 20 6335 1 1 4 LEU H H -4.252 -3.094 -2.926 1.00 . A A . 4 LEU H 1 1 20 6336 1 1 4 LEU HA H -5.162 -0.520 -3.442 1.00 . A A . 4 LEU HA 1 1 20 6337 1 1 4 LEU HB2 H -2.513 -0.675 -2.363 1.00 . A A . 4 LEU HB2 1 1 20 6338 1 1 4 LEU HB3 H -3.968 -0.023 -1.600 1.00 . A A . 4 LEU HB3 1 1 20 6339 1 1 4 LEU HD11 H -2.947 -1.932 0.886 1.00 . A A . 4 LEU HD11 1 1 20 6340 1 1 4 LEU HD12 H -2.015 -0.905 -0.291 1.00 . A A . 4 LEU HD12 1 1 20 6341 1 1 4 LEU HD13 H -1.772 -2.694 -0.269 1.00 . A A . 4 LEU HD13 1 1 20 6342 1 1 4 LEU HD21 H -4.986 -2.797 0.335 1.00 . A A . 4 LEU HD21 1 1 20 6343 1 1 4 LEU HD22 H -5.622 -2.866 -1.361 1.00 . A A . 4 LEU HD22 1 1 20 6344 1 1 4 LEU HD23 H -5.533 -1.283 -0.486 1.00 . A A . 4 LEU HD23 1 1 20 6345 1 1 4 LEU HG H -3.345 -2.919 -1.785 1.00 . A A . 4 LEU HG 1 1 20 6346 1 1 4 LEU N N -4.637 -2.458 -3.579 1.00 . A A . 4 LEU N 1 1 20 6347 1 1 4 LEU O O -3.816 -0.077 -5.360 1.00 . A A . 4 LEU O 1 1 20 6348 1 1 5 SER C C -1.148 -1.031 -6.606 1.00 . A A . 5 SER C 1 1 20 6349 1 1 5 SER CA C -1.187 -1.736 -5.275 1.00 . A A . 5 SER CA 1 1 20 6350 1 1 5 SER CB C -0.734 -3.155 -5.362 1.00 . A A . 5 SER CB 1 1 20 6351 1 1 5 SER H H -2.475 -2.451 -3.861 1.00 . A A . 5 SER H 1 1 20 6352 1 1 5 SER HA H -0.483 -1.215 -4.637 1.00 . A A . 5 SER HA 1 1 20 6353 1 1 5 SER HB2 H 0.337 -3.187 -5.085 1.00 . A A . 5 SER HB2 1 1 20 6354 1 1 5 SER HB3 H -1.332 -3.720 -4.595 1.00 . A A . 5 SER HB3 1 1 20 6355 1 1 5 SER HG H -0.473 -3.162 -7.274 1.00 . A A . 5 SER HG 1 1 20 6356 1 1 5 SER N N -2.424 -1.706 -4.506 1.00 . A A . 5 SER N 1 1 20 6357 1 1 5 SER O O -0.133 -1.001 -7.288 1.00 . A A . 5 SER O 1 1 20 6358 1 1 5 SER OG O -0.935 -3.733 -6.649 1.00 . A A . 5 SER OG 1 1 20 6359 1 1 6 LYS C C -1.984 1.666 -7.232 1.00 . A A . 6 LYS C 1 1 20 6360 1 1 6 LYS CA C -2.268 0.422 -8.074 1.00 . A A . 6 LYS CA 1 1 20 6361 1 1 6 LYS CB C -3.617 0.598 -8.789 1.00 . A A . 6 LYS CB 1 1 20 6362 1 1 6 LYS CD C -3.224 -1.236 -10.519 1.00 . A A . 6 LYS CD 1 1 20 6363 1 1 6 LYS CE C -3.776 -2.505 -11.171 1.00 . A A . 6 LYS CE 1 1 20 6364 1 1 6 LYS CG C -4.139 -0.700 -9.413 1.00 . A A . 6 LYS CG 1 1 20 6365 1 1 6 LYS H H -3.137 -0.698 -6.587 1.00 . A A . 6 LYS H 1 1 20 6366 1 1 6 LYS HA H -1.448 0.225 -8.754 1.00 . A A . 6 LYS HA 1 1 20 6367 1 1 6 LYS HB2 H -4.364 0.980 -8.060 1.00 . A A . 6 LYS HB2 1 1 20 6368 1 1 6 LYS HB3 H -3.496 1.360 -9.589 1.00 . A A . 6 LYS HB3 1 1 20 6369 1 1 6 LYS HD2 H -3.098 -0.454 -11.297 1.00 . A A . 6 LYS HD2 1 1 20 6370 1 1 6 LYS HD3 H -2.224 -1.456 -10.087 1.00 . A A . 6 LYS HD3 1 1 20 6371 1 1 6 LYS HE2 H -3.889 -3.313 -10.418 1.00 . A A . 6 LYS HE2 1 1 20 6372 1 1 6 LYS HE3 H -4.760 -2.303 -11.645 1.00 . A A . 6 LYS HE3 1 1 20 6373 1 1 6 LYS HG2 H -4.237 -1.472 -8.619 1.00 . A A . 6 LYS HG2 1 1 20 6374 1 1 6 LYS HG3 H -5.151 -0.517 -9.836 1.00 . A A . 6 LYS HG3 1 1 20 6375 1 1 6 LYS HZ1 H -3.366 -3.080 -13.119 1.00 . A A . 6 LYS HZ1 1 1 20 6376 1 1 6 LYS HZ2 H -2.467 -3.913 -11.943 1.00 . A A . 6 LYS HZ2 1 1 20 6377 1 1 6 LYS HZ3 H -2.073 -2.308 -12.335 1.00 . A A . 6 LYS HZ3 1 1 20 6378 1 1 6 LYS N N -2.255 -0.511 -7.023 1.00 . A A . 6 LYS N 1 1 20 6379 1 1 6 LYS NZ N -2.852 -2.987 -12.220 1.00 . A A . 6 LYS NZ 1 1 20 6380 1 1 6 LYS O O -1.987 2.794 -7.707 1.00 . A A . 6 LYS O 1 1 20 6381 1 1 7 PHE C C -0.395 2.527 -4.243 1.00 . A A . 7 PHE C 1 1 20 6382 1 1 7 PHE CA C -1.665 2.270 -4.813 1.00 . A A . 7 PHE CA 1 1 20 6383 1 1 7 PHE CB C -2.270 1.620 -3.601 1.00 . A A . 7 PHE CB 1 1 20 6384 1 1 7 PHE CD1 C -3.911 2.119 -1.952 1.00 . A A . 7 PHE CD1 1 1 20 6385 1 1 7 PHE CD2 C -1.801 3.131 -1.894 1.00 . A A . 7 PHE CD2 1 1 20 6386 1 1 7 PHE CE1 C -4.167 2.640 -0.744 1.00 . A A . 7 PHE CE1 1 1 20 6387 1 1 7 PHE CE2 C -1.994 3.683 -0.757 1.00 . A A . 7 PHE CE2 1 1 20 6388 1 1 7 PHE CG C -2.748 2.372 -2.518 1.00 . A A . 7 PHE CG 1 1 20 6389 1 1 7 PHE CZ C -3.204 3.455 -0.106 1.00 . A A . 7 PHE CZ 1 1 20 6390 1 1 7 PHE H H -1.793 0.409 -5.508 1.00 . A A . 7 PHE H 1 1 20 6391 1 1 7 PHE HA H -2.196 3.162 -4.997 1.00 . A A . 7 PHE HA 1 1 20 6392 1 1 7 PHE HB2 H -3.196 1.212 -3.956 1.00 . A A . 7 PHE HB2 1 1 20 6393 1 1 7 PHE HB3 H -1.686 0.778 -3.201 1.00 . A A . 7 PHE HB3 1 1 20 6394 1 1 7 PHE HD1 H -4.638 1.480 -2.465 1.00 . A A . 7 PHE HD1 1 1 20 6395 1 1 7 PHE HD2 H -0.864 3.322 -2.354 1.00 . A A . 7 PHE HD2 1 1 20 6396 1 1 7 PHE HE1 H -5.083 2.380 -0.295 1.00 . A A . 7 PHE HE1 1 1 20 6397 1 1 7 PHE HE2 H -1.141 4.252 -0.366 1.00 . A A . 7 PHE HE2 1 1 20 6398 1 1 7 PHE HZ H -3.398 3.881 0.867 1.00 . A A . 7 PHE HZ 1 1 20 6399 1 1 7 PHE N N -1.877 1.383 -5.865 1.00 . A A . 7 PHE N 1 1 20 6400 1 1 7 PHE O O 0.052 3.633 -4.238 1.00 . A A . 7 PHE O 1 1 20 6401 1 1 8 PHE C C 2.199 1.506 -3.492 1.00 . A A . 8 PHE C 1 1 20 6402 1 1 8 PHE CA C 1.144 1.690 -2.672 1.00 . A A . 8 PHE CA 1 1 20 6403 1 1 8 PHE CB C 1.512 0.627 -1.694 1.00 . A A . 8 PHE CB 1 1 20 6404 1 1 8 PHE CD1 C 1.992 -1.472 -2.275 1.00 . A A . 8 PHE CD1 1 1 20 6405 1 1 8 PHE CD2 C -0.216 -0.869 -1.983 1.00 . A A . 8 PHE CD2 1 1 20 6406 1 1 8 PHE CE1 C 1.680 -2.647 -2.628 1.00 . A A . 8 PHE CE1 1 1 20 6407 1 1 8 PHE CE2 C -0.564 -2.074 -2.336 1.00 . A A . 8 PHE CE2 1 1 20 6408 1 1 8 PHE CG C 1.043 -0.596 -1.958 1.00 . A A . 8 PHE CG 1 1 20 6409 1 1 8 PHE CZ C 0.389 -2.976 -2.669 1.00 . A A . 8 PHE CZ 1 1 20 6410 1 1 8 PHE H H -0.226 0.571 -3.655 1.00 . A A . 8 PHE H 1 1 20 6411 1 1 8 PHE HA H 1.157 2.647 -2.322 1.00 . A A . 8 PHE HA 1 1 20 6412 1 1 8 PHE HB2 H 2.573 0.526 -1.561 1.00 . A A . 8 PHE HB2 1 1 20 6413 1 1 8 PHE HB3 H 1.023 0.876 -0.754 1.00 . A A . 8 PHE HB3 1 1 20 6414 1 1 8 PHE HD1 H 3.033 -1.184 -2.239 1.00 . A A . 8 PHE HD1 1 1 20 6415 1 1 8 PHE HD2 H -0.939 -0.127 -1.701 1.00 . A A . 8 PHE HD2 1 1 20 6416 1 1 8 PHE HE1 H 2.448 -3.298 -2.897 1.00 . A A . 8 PHE HE1 1 1 20 6417 1 1 8 PHE HE2 H -1.572 -2.302 -2.401 1.00 . A A . 8 PHE HE2 1 1 20 6418 1 1 8 PHE HZ H 0.124 -3.905 -2.954 1.00 . A A . 8 PHE HZ 1 1 20 6419 1 1 8 PHE N N 0.114 1.485 -3.573 1.00 . A A . 8 PHE N 1 1 20 6420 1 1 8 PHE O O 3.121 2.168 -3.448 1.00 . A A . 8 PHE O 1 1 20 6421 1 1 9 ARG C C 2.908 1.307 -6.172 1.00 . A A . 9 ARG C 1 1 20 6422 1 1 9 ARG CA C 2.877 0.196 -5.272 1.00 . A A . 9 ARG CA 1 1 20 6423 1 1 9 ARG CB C 2.409 -1.027 -5.986 1.00 . A A . 9 ARG CB 1 1 20 6424 1 1 9 ARG CD C 4.368 -2.616 -6.097 1.00 . A A . 9 ARG CD 1 1 20 6425 1 1 9 ARG CG C 3.021 -2.311 -5.454 1.00 . A A . 9 ARG CG 1 1 20 6426 1 1 9 ARG CZ C 5.187 -3.357 -8.319 1.00 . A A . 9 ARG CZ 1 1 20 6427 1 1 9 ARG H H 1.101 0.121 -4.368 1.00 . A A . 9 ARG H 1 1 20 6428 1 1 9 ARG HA H 3.781 0.087 -4.796 1.00 . A A . 9 ARG HA 1 1 20 6429 1 1 9 ARG HB2 H 1.300 -1.061 -5.809 1.00 . A A . 9 ARG HB2 1 1 20 6430 1 1 9 ARG HB3 H 2.600 -0.916 -7.068 1.00 . A A . 9 ARG HB3 1 1 20 6431 1 1 9 ARG HD2 H 4.987 -1.693 -6.151 1.00 . A A . 9 ARG HD2 1 1 20 6432 1 1 9 ARG HD3 H 4.909 -3.402 -5.531 1.00 . A A . 9 ARG HD3 1 1 20 6433 1 1 9 ARG HE H 3.199 -3.264 -7.806 1.00 . A A . 9 ARG HE 1 1 20 6434 1 1 9 ARG HG2 H 3.164 -2.210 -4.364 1.00 . A A . 9 ARG HG2 1 1 20 6435 1 1 9 ARG HG3 H 2.321 -3.153 -5.639 1.00 . A A . 9 ARG HG3 1 1 20 6436 1 1 9 ARG HH11 H 6.629 -2.825 -6.955 1.00 . A A . 9 ARG HH11 1 1 20 6437 1 1 9 ARG HH12 H 7.237 -3.333 -8.496 1.00 . A A . 9 ARG HH12 1 1 20 6438 1 1 9 ARG HH21 H 4.023 -3.955 -9.902 1.00 . A A . 9 ARG HH21 1 1 20 6439 1 1 9 ARG HH22 H 5.728 -3.986 -10.200 1.00 . A A . 9 ARG HH22 1 1 20 6440 1 1 9 ARG N N 1.976 0.558 -4.329 1.00 . A A . 9 ARG N 1 1 20 6441 1 1 9 ARG NE N 4.134 -3.112 -7.485 1.00 . A A . 9 ARG NE 1 1 20 6442 1 1 9 ARG NH1 N 6.466 -3.154 -7.885 1.00 . A A . 9 ARG NH1 1 1 20 6443 1 1 9 ARG NH2 N 4.960 -3.806 -9.586 1.00 . A A . 9 ARG NH2 1 1 20 6444 1 1 9 ARG O O 3.603 1.315 -7.188 1.00 . A A . 9 ARG O 1 1 20 6445 1 1 10 ASP C C 2.068 4.571 -5.856 1.00 . A A . 10 ASP C 1 1 20 6446 1 1 10 ASP CA C 1.856 3.317 -6.605 1.00 . A A . 10 ASP CA 1 1 20 6447 1 1 10 ASP CB C 0.620 3.292 -7.283 1.00 . A A . 10 ASP CB 1 1 20 6448 1 1 10 ASP CG C 0.597 4.074 -8.593 1.00 . A A . 10 ASP CG 1 1 20 6449 1 1 10 ASP H H 1.413 2.136 -5.017 1.00 . A A . 10 ASP H 1 1 20 6450 1 1 10 ASP HA H 2.626 3.224 -7.255 1.00 . A A . 10 ASP HA 1 1 20 6451 1 1 10 ASP HB2 H 0.461 2.214 -7.459 1.00 . A A . 10 ASP HB2 1 1 20 6452 1 1 10 ASP HB3 H -0.124 3.674 -6.582 1.00 . A A . 10 ASP HB3 1 1 20 6453 1 1 10 ASP N N 1.972 2.199 -5.877 1.00 . A A . 10 ASP N 1 1 20 6454 1 1 10 ASP O O 2.047 5.641 -6.471 1.00 . A A . 10 ASP O 1 1 20 6455 1 1 10 ASP OD1 O 1.453 3.782 -9.469 1.00 . A A . 10 ASP OD1 1 1 20 6456 1 1 10 ASP OD2 O -0.273 4.974 -8.731 1.00 . A A . 10 ASP OD2 1 1 20 6457 1 1 11 . C C 2.240 6.026 -2.463 1.00 . A A . 11 DPN C 1 1 20 6458 1 1 11 . CA C 2.502 5.842 -3.926 1.00 . A A . 11 DPN CA 1 1 20 6459 1 1 11 . CB C 3.961 6.178 -4.147 1.00 . A A . 11 DPN CB 1 1 20 6460 1 1 11 . CD1 C 4.640 4.814 -6.041 1.00 . A A . 11 DPN CD1 1 1 20 6461 1 1 11 . CD2 C 4.833 4.185 -3.808 1.00 . A A . 11 DPN CD2 1 1 20 6462 1 1 11 . CE1 C 4.866 3.548 -6.372 1.00 . A A . 11 DPN CE1 1 1 20 6463 1 1 11 . CE2 C 5.127 3.014 -4.124 1.00 . A A . 11 DPN CE2 1 1 20 6464 1 1 11 . CG C 4.604 5.089 -4.714 1.00 . A A . 11 DPN CG 1 1 20 6465 1 1 11 . CZ C 5.107 2.674 -5.360 1.00 . A A . 11 DPN CZ 1 1 20 6466 1 1 11 . H H 2.238 3.670 -3.961 1.00 . A A . 11 DPN H 1 1 20 6467 1 1 11 . HA H 1.919 6.525 -4.420 1.00 . A A . 11 DPN HA 1 1 20 6468 1 1 11 . HB2 H 4.423 6.286 -3.176 1.00 . A A . 11 DPN HB2 1 1 20 6469 1 1 11 . HB3 H 4.083 7.002 -4.792 1.00 . A A . 11 DPN HB3 1 1 20 6470 1 1 11 . HD1 H 4.449 5.572 -6.786 1.00 . A A . 11 DPN HD1 1 1 20 6471 1 1 11 . HD2 H 4.858 4.466 -2.811 1.00 . A A . 11 DPN HD2 1 1 20 6472 1 1 11 . HE1 H 4.871 3.226 -7.399 1.00 . A A . 11 DPN HE1 1 1 20 6473 1 1 11 . HE2 H 5.260 2.287 -3.375 1.00 . A A . 11 DPN HE2 1 1 20 6474 1 1 11 . HZ H 5.176 1.732 -5.527 1.00 . A A . 11 DPN HZ 1 1 20 6475 1 1 11 . N N 2.226 4.541 -4.518 1.00 . A A . 11 DPN N 1 1 20 6476 1 1 11 . O O 1.257 6.646 -2.061 1.00 . A A . 11 DPN O 1 1 20 6477 1 1 12 ILE C C 4.482 5.055 0.246 1.00 . A A . 12 ILE C 1 1 20 6478 1 1 12 ILE CA C 3.182 5.688 -0.235 1.00 . A A . 12 ILE CA 1 1 20 6479 1 1 12 ILE CB C 2.010 5.077 0.472 1.00 . A A . 12 ILE CB 1 1 20 6480 1 1 12 ILE CD1 C 2.497 3.066 -0.644 1.00 . A A . 12 ILE CD1 1 1 20 6481 1 1 12 ILE CG1 C 1.436 4.017 -0.404 1.00 . A A . 12 ILE CG1 1 1 20 6482 1 1 12 ILE CG2 C 0.984 6.165 0.821 1.00 . A A . 12 ILE CG2 1 1 20 6483 1 1 12 ILE H H 3.819 4.859 -2.005 1.00 . A A . 12 ILE H 1 1 20 6484 1 1 12 ILE HA H 3.229 6.706 -0.048 1.00 . A A . 12 ILE HA 1 1 20 6485 1 1 12 ILE HB H 2.367 4.592 1.391 1.00 . A A . 12 ILE HB 1 1 20 6486 1 1 12 ILE HD11 H 2.192 2.077 -0.372 1.00 . A A . 12 ILE HD11 1 1 20 6487 1 1 12 ILE HD12 H 3.347 3.323 -0.039 1.00 . A A . 12 ILE HD12 1 1 20 6488 1 1 12 ILE HD13 H 2.799 3.105 -1.727 1.00 . A A . 12 ILE HD13 1 1 20 6489 1 1 12 ILE HG12 H 0.581 3.513 0.077 1.00 . A A . 12 ILE HG12 1 1 20 6490 1 1 12 ILE HG13 H 1.127 4.434 -1.387 1.00 . A A . 12 ILE HG13 1 1 20 6491 1 1 12 ILE HG21 H 0.845 6.230 1.921 1.00 . A A . 12 ILE HG21 1 1 20 6492 1 1 12 ILE HG22 H 0.005 5.933 0.352 1.00 . A A . 12 ILE HG22 1 1 20 6493 1 1 12 ILE HG23 H 1.326 7.151 0.446 1.00 . A A . 12 ILE HG23 1 1 20 6494 1 1 12 ILE N N 3.164 5.498 -1.656 1.00 . A A . 12 ILE N 1 1 20 6495 1 1 12 ILE O O 4.826 5.117 1.415 1.00 . A A . 12 ILE O 1 1 20 6496 1 1 13 LEU C C 7.564 4.287 -1.075 1.00 . A A . 13 LEU C 1 1 20 6497 1 1 13 LEU CA C 6.411 3.622 -0.456 1.00 . A A . 13 LEU CA 1 1 20 6498 1 1 13 LEU CB C 6.382 2.287 -1.170 1.00 . A A . 13 LEU CB 1 1 20 6499 1 1 13 LEU CD1 C 4.991 0.407 -1.914 1.00 . A A . 13 LEU CD1 1 1 20 6500 1 1 13 LEU CD2 C 4.669 1.551 0.396 1.00 . A A . 13 LEU CD2 1 1 20 6501 1 1 13 LEU CG C 5.051 1.681 -1.078 1.00 . A A . 13 LEU CG 1 1 20 6502 1 1 13 LEU H H 4.820 4.255 -1.644 1.00 . A A . 13 LEU H 1 1 20 6503 1 1 13 LEU HA H 6.547 3.497 0.596 1.00 . A A . 13 LEU HA 1 1 20 6504 1 1 13 LEU HB2 H 6.598 2.440 -2.244 1.00 . A A . 13 LEU HB2 1 1 20 6505 1 1 13 LEU HB3 H 7.124 1.597 -0.741 1.00 . A A . 13 LEU HB3 1 1 20 6506 1 1 13 LEU HD11 H 4.422 0.613 -2.862 1.00 . A A . 13 LEU HD11 1 1 20 6507 1 1 13 LEU HD12 H 4.494 -0.409 -1.360 1.00 . A A . 13 LEU HD12 1 1 20 6508 1 1 13 LEU HD13 H 6.014 0.095 -2.197 1.00 . A A . 13 LEU HD13 1 1 20 6509 1 1 13 LEU HD21 H 3.640 1.153 0.497 1.00 . A A . 13 LEU HD21 1 1 20 6510 1 1 13 LEU HD22 H 4.710 2.581 0.871 1.00 . A A . 13 LEU HD22 1 1 20 6511 1 1 13 LEU HD23 H 5.378 0.888 0.924 1.00 . A A . 13 LEU HD23 1 1 20 6512 1 1 13 LEU HG H 4.363 2.404 -1.555 1.00 . A A . 13 LEU HG 1 1 20 6513 1 1 13 LEU N N 5.182 4.359 -0.713 1.00 . A A . 13 LEU N 1 1 20 6514 1 1 13 LEU O O 8.601 4.462 -0.463 1.00 . A A . 13 LEU O 1 1 20 6515 1 1 14 GLN C C 8.675 6.551 -2.437 1.00 . A A . 14 GLN C 1 1 20 6516 1 1 14 GLN CA C 8.517 5.251 -3.073 1.00 . A A . 14 GLN CA 1 1 20 6517 1 1 14 GLN CB C 8.262 5.536 -4.551 1.00 . A A . 14 GLN CB 1 1 20 6518 1 1 14 GLN CD C 8.715 3.153 -4.905 1.00 . A A . 14 GLN CD 1 1 20 6519 1 1 14 GLN CG C 7.833 4.311 -5.285 1.00 . A A . 14 GLN CG 1 1 20 6520 1 1 14 GLN H H 6.569 4.404 -2.886 1.00 . A A . 14 GLN H 1 1 20 6521 1 1 14 GLN HA H 9.403 4.661 -2.930 1.00 . A A . 14 GLN HA 1 1 20 6522 1 1 14 GLN HB2 H 7.452 6.291 -4.634 1.00 . A A . 14 GLN HB2 1 1 20 6523 1 1 14 GLN HB3 H 9.176 5.943 -5.019 1.00 . A A . 14 GLN HB3 1 1 20 6524 1 1 14 GLN HE21 H 7.179 2.471 -3.769 1.00 . A A . 14 GLN HE21 1 1 20 6525 1 1 14 GLN HE22 H 8.615 1.485 -3.745 1.00 . A A . 14 GLN HE22 1 1 20 6526 1 1 14 GLN HG2 H 6.809 4.090 -4.973 1.00 . A A . 14 GLN HG2 1 1 20 6527 1 1 14 GLN HG3 H 7.866 4.473 -6.375 1.00 . A A . 14 GLN HG3 1 1 20 6528 1 1 14 GLN N N 7.419 4.610 -2.370 1.00 . A A . 14 GLN N 1 1 20 6529 1 1 14 GLN NE2 N 8.127 2.285 -4.070 1.00 . A A . 14 GLN NE2 1 1 20 6530 1 1 14 GLN O O 9.716 7.201 -2.512 1.00 . A A . 14 GLN O 1 1 20 6531 1 1 14 GLN OE1 O 9.879 3.059 -5.281 1.00 . A A . 14 GLN OE1 1 1 20 6532 1 1 15 ARG C C 7.815 7.893 0.313 1.00 . A A . 15 ARG C 1 1 20 6533 1 1 15 ARG CA C 7.602 8.197 -1.129 1.00 . A A . 15 ARG CA 1 1 20 6534 1 1 15 ARG CB C 6.275 8.966 -1.209 1.00 . A A . 15 ARG CB 1 1 20 6535 1 1 15 ARG CD C 3.973 8.589 -2.088 1.00 . A A . 15 ARG CD 1 1 20 6536 1 1 15 ARG CG C 5.454 8.604 -2.429 1.00 . A A . 15 ARG CG 1 1 20 6537 1 1 15 ARG CZ C 3.298 10.975 -2.330 1.00 . A A . 15 ARG CZ 1 1 20 6538 1 1 15 ARG H H 6.759 6.367 -1.725 1.00 . A A . 15 ARG H 1 1 20 6539 1 1 15 ARG HA H 8.414 8.759 -1.539 1.00 . A A . 15 ARG HA 1 1 20 6540 1 1 15 ARG HB2 H 5.666 8.762 -0.297 1.00 . A A . 15 ARG HB2 1 1 20 6541 1 1 15 ARG HB3 H 6.491 10.056 -1.235 1.00 . A A . 15 ARG HB3 1 1 20 6542 1 1 15 ARG HD2 H 3.358 8.392 -2.989 1.00 . A A . 15 ARG HD2 1 1 20 6543 1 1 15 ARG HD3 H 3.776 7.805 -1.323 1.00 . A A . 15 ARG HD3 1 1 20 6544 1 1 15 ARG HE H 3.533 10.028 -0.514 1.00 . A A . 15 ARG HE 1 1 20 6545 1 1 15 ARG HG2 H 5.649 9.330 -3.243 1.00 . A A . 15 ARG HG2 1 1 20 6546 1 1 15 ARG HG3 H 5.749 7.590 -2.780 1.00 . A A . 15 ARG HG3 1 1 20 6547 1 1 15 ARG HH11 H 3.611 9.954 -4.085 1.00 . A A . 15 ARG HH11 1 1 20 6548 1 1 15 ARG HH12 H 3.146 11.611 -4.279 1.00 . A A . 15 ARG HH12 1 1 20 6549 1 1 15 ARG HH21 H 2.901 12.276 -0.790 1.00 . A A . 15 ARG HH21 1 1 20 6550 1 1 15 ARG HH22 H 2.737 12.951 -2.376 1.00 . A A . 15 ARG HH22 1 1 20 6551 1 1 15 ARG N N 7.593 6.948 -1.785 1.00 . A A . 15 ARG N 1 1 20 6552 1 1 15 ARG NE N 3.586 9.915 -1.512 1.00 . A A . 15 ARG NE 1 1 20 6553 1 1 15 ARG NH1 N 3.357 10.835 -3.686 1.00 . A A . 15 ARG NH1 1 1 20 6554 1 1 15 ARG NH2 N 2.946 12.175 -1.784 1.00 . A A . 15 ARG NH2 1 1 20 6555 1 1 15 ARG O O 8.388 8.686 1.059 1.00 . A A . 15 ARG O 1 1 20 6556 1 1 16 LYS C C 6.512 7.207 2.876 1.00 . A A . 16 LYS C 1 1 20 6557 1 1 16 LYS CA C 7.343 6.245 2.086 1.00 . A A . 16 LYS CA 1 1 20 6558 1 1 16 LYS CB C 8.747 6.235 2.684 1.00 . A A . 16 LYS CB 1 1 20 6559 1 1 16 LYS CD C 10.638 5.211 1.340 1.00 . A A . 16 LYS CD 1 1 20 6560 1 1 16 LYS CE C 11.900 5.818 1.957 1.00 . A A . 16 LYS CE 1 1 20 6561 1 1 16 LYS CG C 9.535 4.964 2.371 1.00 . A A . 16 LYS CG 1 1 20 6562 1 1 16 LYS H H 6.884 6.065 0.076 1.00 . A A . 16 LYS H 1 1 20 6563 1 1 16 LYS HA H 6.888 5.258 2.104 1.00 . A A . 16 LYS HA 1 1 20 6564 1 1 16 LYS HB2 H 9.288 7.107 2.277 1.00 . A A . 16 LYS HB2 1 1 20 6565 1 1 16 LYS HB3 H 8.673 6.357 3.780 1.00 . A A . 16 LYS HB3 1 1 20 6566 1 1 16 LYS HD2 H 10.897 4.250 0.849 1.00 . A A . 16 LYS HD2 1 1 20 6567 1 1 16 LYS HD3 H 10.246 5.901 0.556 1.00 . A A . 16 LYS HD3 1 1 20 6568 1 1 16 LYS HE2 H 11.689 6.829 2.364 1.00 . A A . 16 LYS HE2 1 1 20 6569 1 1 16 LYS HE3 H 12.289 5.166 2.768 1.00 . A A . 16 LYS HE3 1 1 20 6570 1 1 16 LYS HG2 H 9.990 4.577 3.308 1.00 . A A . 16 LYS HG2 1 1 20 6571 1 1 16 LYS HG3 H 8.839 4.191 1.982 1.00 . A A . 16 LYS HG3 1 1 20 6572 1 1 16 LYS HZ1 H 13.533 6.794 1.136 1.00 . A A . 16 LYS HZ1 1 1 20 6573 1 1 16 LYS HZ2 H 12.519 6.052 -0.007 1.00 . A A . 16 LYS HZ2 1 1 20 6574 1 1 16 LYS HZ3 H 13.563 5.108 0.945 1.00 . A A . 16 LYS HZ3 1 1 20 6575 1 1 16 LYS N N 7.296 6.699 0.720 1.00 . A A . 16 LYS N 1 1 20 6576 1 1 16 LYS NZ N 12.957 5.953 0.932 1.00 . A A . 16 LYS NZ 1 1 20 6577 1 1 16 LYS O O 6.638 7.342 4.092 1.00 . A A . 16 LYS O 1 1 20 6578 1 1 17 LYS C C 5.614 9.968 3.363 1.00 . A A . 17 LYS C 1 1 20 6579 1 1 17 LYS CA C 4.753 8.880 2.687 1.00 . A A . 17 LYS CA 1 1 20 6580 1 1 17 LYS CB C 3.705 8.351 3.685 1.00 . A A . 17 LYS CB 1 1 20 6581 1 1 17 LYS CD C 1.956 9.813 2.560 1.00 . A A . 17 LYS CD 1 1 20 6582 1 1 17 LYS CE C 1.674 9.818 1.058 1.00 . A A . 17 LYS CE 1 1 20 6583 1 1 17 LYS CG C 2.304 8.416 3.089 1.00 . A A . 17 LYS CG 1 1 20 6584 1 1 17 LYS H H 5.502 7.670 1.182 1.00 . A A . 17 LYS H 1 1 20 6585 1 1 17 LYS HA H 4.258 9.320 1.834 1.00 . A A . 17 LYS HA 1 1 20 6586 1 1 17 LYS HB2 H 3.947 7.297 3.948 1.00 . A A . 17 LYS HB2 1 1 20 6587 1 1 17 LYS HB3 H 3.728 8.955 4.617 1.00 . A A . 17 LYS HB3 1 1 20 6588 1 1 17 LYS HD2 H 1.068 10.199 3.100 1.00 . A A . 17 LYS HD2 1 1 20 6589 1 1 17 LYS HD3 H 2.807 10.498 2.762 1.00 . A A . 17 LYS HD3 1 1 20 6590 1 1 17 LYS HE2 H 1.855 10.828 0.632 1.00 . A A . 17 LYS HE2 1 1 20 6591 1 1 17 LYS HE3 H 2.325 9.078 0.537 1.00 . A A . 17 LYS HE3 1 1 20 6592 1 1 17 LYS HG2 H 2.247 7.690 2.255 1.00 . A A . 17 LYS HG2 1 1 20 6593 1 1 17 LYS HG3 H 1.561 8.117 3.860 1.00 . A A . 17 LYS HG3 1 1 20 6594 1 1 17 LYS HZ1 H -0.089 8.850 1.556 1.00 . A A . 17 LYS HZ1 1 1 20 6595 1 1 17 LYS HZ2 H 0.198 8.956 -0.115 1.00 . A A . 17 LYS HZ2 1 1 20 6596 1 1 17 LYS HZ3 H -0.312 10.326 0.747 1.00 . A A . 17 LYS HZ3 1 1 20 6597 1 1 17 LYS N N 5.617 7.874 2.146 1.00 . A A . 17 LYS N 1 1 20 6598 1 1 17 LYS NZ N 0.263 9.461 0.793 1.00 . A A . 17 LYS NZ 1 1 20 6599 1 1 17 LYS O O 6.169 10.822 2.620 1.00 . A A . 17 LYS O 1 1 20 6600 1 1 17 LYS OXT O 5.710 9.969 4.623 1.00 . A A . 17 LYS OXT 1 1 stop_ save_
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