NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
497632 | 2kv4 | 16768 | cing | 4-filtered-FRED | STAR | entry | full | 417 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2kv4 # This FRED archive file contains, for PDB entry <2kv4>: # # - 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_2kv4 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2kv4 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 6213.90 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 $Epidermal_growth_factor A . 1 1 stop_ save_ save_Epidermal_growth_factor _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Epidermal growth factor" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code NSDSECPLSHDGYCLHDGVCMYIEALDKYACNCVVGYIGERCQYRDLKWWELR _Entity.Number_of_monomers 53 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ASN . 1 1 2 SER . 1 1 3 ASP . 1 1 4 SER . 1 1 5 GLU . 1 1 6 CYS . 1 1 7 PRO . 1 1 8 LEU . 1 1 9 SER . 1 1 10 HIS . 1 1 11 ASP . 1 1 12 GLY . 1 1 13 TYR . 1 1 14 CYS . 1 1 15 LEU . 1 1 16 HIS . 1 1 17 ASP . 1 1 18 GLY . 1 1 19 VAL . 1 1 20 CYS . 1 1 21 MET . 1 1 22 TYR . 1 1 23 ILE . 1 1 24 GLU . 1 1 25 ALA . 1 1 26 LEU . 1 1 27 ASP . 1 1 28 LYS . 1 1 29 TYR . 1 1 30 ALA . 1 1 31 CYS . 1 1 32 ASN . 1 1 33 CYS . 1 1 34 VAL . 1 1 35 VAL . 1 1 36 GLY . 1 1 37 TYR . 1 1 38 ILE . 1 1 39 GLY . 1 1 40 GLU . 1 1 41 ARG . 1 1 42 CYS . 1 1 43 GLN . 1 1 44 TYR . 1 1 45 ARG . 1 1 46 ASP . 1 1 47 LEU . 1 1 48 LYS . 1 1 49 TRP . 1 1 50 TRP . 1 1 51 GLU . 1 1 52 LEU . 1 1 53 ARG . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ASN 1 1 1 1 SER 2 2 1 1 ASP 3 3 1 1 SER 4 4 1 1 GLU 5 5 1 1 CYS 6 6 1 1 PRO 7 7 1 1 LEU 8 8 1 1 SER 9 9 1 1 HIS 10 10 1 1 ASP 11 11 1 1 GLY 12 12 1 1 TYR 13 13 1 1 CYS 14 14 1 1 LEU 15 15 1 1 HIS 16 16 1 1 ASP 17 17 1 1 GLY 18 18 1 1 VAL 19 19 1 1 CYS 20 20 1 1 MET 21 21 1 1 TYR 22 22 1 1 ILE 23 23 1 1 GLU 24 24 1 1 ALA 25 25 1 1 LEU 26 26 1 1 ASP 27 27 1 1 LYS 28 28 1 1 TYR 29 29 1 1 ALA 30 30 1 1 CYS 31 31 1 1 ASN 32 32 1 1 CYS 33 33 1 1 VAL 34 34 1 1 VAL 35 35 1 1 GLY 36 36 1 1 TYR 37 37 1 1 ILE 38 38 1 1 GLY 39 39 1 1 GLU 40 40 1 1 ARG 41 41 1 1 CYS 42 42 1 1 GLN 43 43 1 1 TYR 44 44 1 1 ARG 45 45 1 1 ASP 46 46 1 1 LEU 47 47 1 1 LYS 48 48 1 1 TRP 49 49 1 1 TRP 50 50 1 1 GLU 51 51 1 1 LEU 52 52 1 1 ARG 53 53 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_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 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 SER HA . 2 . HA 1 1 1 1 2 1 1 3 ASP H . 3 . HN 1 1 2 1 1 1 1 3 ASP H . 3 . HN 1 1 2 1 2 1 1 3 ASP HA . 3 . HA 1 1 3 1 1 1 1 3 ASP H . 3 . HN 1 1 3 1 2 1 1 3 ASP HB3 . 3 . HB2 1 1 4 1 1 1 1 3 ASP H . 3 . HN 1 1 4 1 2 1 1 22 TYR HA . 22 . HA 1 1 5 1 1 1 1 3 ASP H . 3 . HN 1 1 5 1 2 1 1 23 ILE QG . 23 . HG12 1 1 6 1 1 1 1 3 ASP H . 3 . HN 1 1 6 1 2 1 1 24 GLU QG . 24 . HG2 1 1 7 1 1 1 1 3 ASP HA . 3 . HA 1 1 7 1 2 1 1 4 SER H . 4 . HN 1 1 8 1 1 1 1 3 ASP HB3 . 3 . HB2 1 1 8 1 2 1 1 4 SER H . 4 . HN 1 1 9 1 1 1 1 7 PRO HA . 7 . HA 1 1 9 1 2 1 1 8 LEU H . 8 . HN 1 1 10 1 1 1 1 7 PRO HB3 . 7 . HB2 1 1 10 1 2 1 1 9 SER H . 9 . HN 1 1 11 1 1 1 1 8 LEU H . 8 . HN 1 1 11 1 2 1 1 8 LEU HB3 . 8 . HB2 1 1 12 1 1 1 1 8 LEU H . 8 . HN 1 1 12 1 2 1 1 9 SER H . 9 . HN 1 1 13 1 1 1 1 8 LEU HA . 8 . HA 1 1 13 1 2 1 1 8 LEU HB3 . 8 . HB2 1 1 14 1 1 1 1 8 LEU HA . 8 . HA 1 1 14 1 2 1 1 9 SER H . 9 . HN 1 1 15 1 1 1 1 8 LEU HB3 . 8 . HB2 1 1 15 1 2 1 1 9 SER H . 9 . HN 1 1 16 1 1 1 1 9 SER H . 9 . HN 1 1 16 1 2 1 1 10 HIS HA . 10 . HA 1 1 17 1 1 1 1 9 SER H . 9 . HN 1 1 17 1 2 1 1 11 ASP QB . 11 . HB2 1 1 18 1 1 1 1 9 SER H . 9 . HN 1 1 18 1 2 1 1 12 GLY HA3 . 12 . HA1 1 1 19 1 1 1 1 10 HIS HA . 10 . HA 1 1 19 1 2 1 1 10 HIS HB3 . 10 . HB2 1 1 20 1 1 1 1 10 HIS HA . 10 . HA 1 1 20 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 21 1 1 1 1 11 ASP HA . 11 . HA 1 1 21 1 2 1 1 11 ASP QB . 11 . HB2 1 1 22 1 1 1 1 11 ASP QB . 11 . HB2 1 1 22 1 2 1 1 19 VAL H . 19 . HN 1 1 23 1 1 1 1 12 GLY H . 12 . HN 1 1 23 1 2 1 1 12 GLY HA3 . 12 . HA1 1 1 24 1 1 1 1 12 GLY H . 12 . HN 1 1 24 1 2 1 1 13 TYR H . 13 . HN 1 1 25 1 1 1 1 12 GLY H . 12 . HN 1 1 25 1 2 1 1 14 CYS HB2 . 14 . HB2 1 1 26 1 1 1 1 12 GLY HA3 . 12 . HA1 1 1 26 1 2 1 1 13 TYR H . 13 . HN 1 1 27 1 1 1 1 13 TYR H . 13 . HN 1 1 27 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 28 1 1 1 1 13 TYR H . 13 . HN 1 1 28 1 2 1 1 14 CYS H . 14 . HN 1 1 29 1 1 1 1 13 TYR H . 13 . HN 1 1 29 1 2 1 1 14 CYS HB2 . 14 . HB2 1 1 30 1 1 1 1 13 TYR HA . 13 . HA 1 1 30 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 31 1 1 1 1 13 TYR HA . 13 . HA 1 1 31 1 2 1 1 14 CYS H . 14 . HN 1 1 32 1 1 1 1 13 TYR HB2 . 13 . HB2 1 1 32 1 2 1 1 14 CYS H . 14 . HN 1 1 33 1 1 1 1 14 CYS H . 14 . HN 1 1 33 1 2 1 1 14 CYS HA . 14 . HA 1 1 34 1 1 1 1 14 CYS H . 14 . HN 1 1 34 1 2 1 1 14 CYS HB2 . 14 . HB2 1 1 35 1 1 1 1 14 CYS HA . 14 . HA 1 1 35 1 2 1 1 14 CYS HB2 . 14 . HB2 1 1 36 1 1 1 1 14 CYS HA . 14 . HA 1 1 36 1 2 1 1 15 LEU H . 15 . HN 1 1 37 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 37 1 2 1 1 15 LEU H . 15 . HN 1 1 38 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 38 1 2 1 1 18 GLY H . 18 . HN 1 1 39 1 1 1 1 15 LEU H . 15 . HN 1 1 39 1 2 1 1 15 LEU HA . 15 . HA 1 1 40 1 1 1 1 15 LEU H . 15 . HN 1 1 40 1 2 1 1 15 LEU HB2 . 15 . HB2 1 1 41 1 1 1 1 15 LEU H . 15 . HN 1 1 41 1 2 1 1 15 LEU HG . 15 . HG 1 1 42 1 1 1 1 15 LEU H . 15 . HN 1 1 42 1 2 1 1 16 HIS HB2 . 16 . HB2 1 1 43 1 1 1 1 15 LEU H . 15 . HN 1 1 43 1 2 1 1 17 ASP H . 17 . HN 1 1 44 1 1 1 1 15 LEU H . 15 . HN 1 1 44 1 2 1 1 42 CYS HB3 . 42 . HB2 1 1 45 1 1 1 1 15 LEU HA . 15 . HA 1 1 45 1 2 1 1 16 HIS H . 16 . HN 1 1 46 1 1 1 1 15 LEU HB2 . 15 . HB2 1 1 46 1 2 1 1 16 HIS H . 16 . HN 1 1 47 1 1 1 1 15 LEU HB2 . 15 . HB2 1 1 47 1 2 1 1 17 ASP H . 17 . HN 1 1 48 1 1 1 1 15 LEU HB2 . 15 . HB2 1 1 48 1 2 1 1 18 GLY H . 18 . HN 1 1 49 1 1 1 1 16 HIS H . 16 . HN 1 1 49 1 2 1 1 16 HIS HA . 16 . HA 1 1 50 1 1 1 1 16 HIS H . 16 . HN 1 1 50 1 2 1 1 16 HIS HB2 . 16 . HB2 1 1 51 1 1 1 1 16 HIS H . 16 . HN 1 1 51 1 2 1 1 17 ASP H . 17 . HN 1 1 52 1 1 1 1 16 HIS H . 16 . HN 1 1 52 1 2 1 1 17 ASP HA . 17 . HA 1 1 53 1 1 1 1 16 HIS H . 16 . HN 1 1 53 1 2 1 1 33 CYS H . 33 . HN 1 1 54 1 1 1 1 16 HIS H . 16 . HN 1 1 54 1 2 1 1 33 CYS HA . 33 . HA 1 1 55 1 1 1 1 16 HIS H . 16 . HN 1 1 55 1 2 1 1 34 VAL HB . 34 . HB 1 1 56 1 1 1 1 16 HIS HA . 16 . HA 1 1 56 1 2 1 1 16 HIS HB2 . 16 . HB2 1 1 57 1 1 1 1 16 HIS HA . 16 . HA 1 1 57 1 2 1 1 17 ASP H . 17 . HN 1 1 58 1 1 1 1 16 HIS HA . 16 . HA 1 1 58 1 2 1 1 18 GLY H . 18 . HN 1 1 59 1 1 1 1 16 HIS HA . 16 . HA 1 1 59 1 2 1 1 34 VAL HB . 34 . HB 1 1 60 1 1 1 1 16 HIS HB2 . 16 . HB2 1 1 60 1 2 1 1 17 ASP H . 17 . HN 1 1 61 1 1 1 1 16 HIS HB2 . 16 . HB2 1 1 61 1 2 1 1 18 GLY H . 18 . HN 1 1 62 1 1 1 1 17 ASP H . 17 . HN 1 1 62 1 2 1 1 17 ASP HA . 17 . HA 1 1 63 1 1 1 1 17 ASP H . 17 . HN 1 1 63 1 2 1 1 17 ASP HB3 . 17 . HB2 1 1 64 1 1 1 1 17 ASP H . 17 . HN 1 1 64 1 2 1 1 18 GLY H . 18 . HN 1 1 65 1 1 1 1 17 ASP H . 17 . HN 1 1 65 1 2 1 1 33 CYS HA . 33 . HA 1 1 66 1 1 1 1 17 ASP H . 17 . HN 1 1 66 1 2 1 1 34 VAL HB . 34 . HB 1 1 67 1 1 1 1 17 ASP HA . 17 . HA 1 1 67 1 2 1 1 17 ASP HB3 . 17 . HB2 1 1 68 1 1 1 1 17 ASP HA . 17 . HA 1 1 68 1 2 1 1 18 GLY H . 18 . HN 1 1 69 1 1 1 1 17 ASP HB3 . 17 . HB2 1 1 69 1 2 1 1 18 GLY H . 18 . HN 1 1 70 1 1 1 1 17 ASP HB3 . 17 . HB2 1 1 70 1 2 1 1 34 VAL H . 34 . HN 1 1 71 1 1 1 1 18 GLY H . 18 . HN 1 1 71 1 2 1 1 19 VAL H . 19 . HN 1 1 72 1 1 1 1 18 GLY H . 18 . HN 1 1 72 1 2 1 1 32 ASN HA . 32 . HA 1 1 73 1 1 1 1 18 GLY H . 18 . HN 1 1 73 1 2 1 1 33 CYS HA . 33 . HA 1 1 74 1 1 1 1 18 GLY HA2 . 18 . HA1 1 1 74 1 2 1 1 19 VAL H . 19 . HN 1 1 75 1 1 1 1 18 GLY HA2 . 18 . HA1 1 1 75 1 2 1 1 33 CYS H . 33 . HN 1 1 76 1 1 1 1 19 VAL H . 19 . HN 1 1 76 1 2 1 1 19 VAL HA . 19 . HA 1 1 77 1 1 1 1 19 VAL H . 19 . HN 1 1 77 1 2 1 1 19 VAL HB . 19 . HB 1 1 78 1 1 1 1 19 VAL H . 19 . HN 1 1 78 1 2 1 1 20 CYS H . 20 . HN 1 1 79 1 1 1 1 19 VAL H . 19 . HN 1 1 79 1 2 1 1 32 ASN H . 32 . HN 1 1 80 1 1 1 1 19 VAL H . 19 . HN 1 1 80 1 2 1 1 32 ASN HB3 . 32 . HB2 1 1 81 1 1 1 1 19 VAL HA . 19 . HA 1 1 81 1 2 1 1 20 CYS H . 20 . HN 1 1 82 1 1 1 1 19 VAL HB . 19 . HB 1 1 82 1 2 1 1 20 CYS H . 20 . HN 1 1 83 1 1 1 1 19 VAL HB . 19 . HB 1 1 83 1 2 1 1 32 ASN H . 32 . HN 1 1 84 1 1 1 1 19 VAL HB . 19 . HB 1 1 84 1 2 1 1 32 ASN HB3 . 32 . HB2 1 1 85 1 1 1 1 19 VAL HB . 19 . HB 1 1 85 1 2 1 1 33 CYS H . 33 . HN 1 1 86 1 1 1 1 20 CYS H . 20 . HN 1 1 86 1 2 1 1 20 CYS HB3 . 20 . HB2 1 1 87 1 1 1 1 20 CYS H . 20 . HN 1 1 87 1 2 1 1 21 MET H . 21 . HN 1 1 88 1 1 1 1 20 CYS HA . 20 . HA 1 1 88 1 2 1 1 21 MET H . 21 . HN 1 1 89 1 1 1 1 20 CYS HA . 20 . HA 1 1 89 1 2 1 1 31 CYS H . 31 . HN 1 1 90 1 1 1 1 21 MET H . 21 . HN 1 1 90 1 2 1 1 21 MET HB3 . 21 . HB2 1 1 91 1 1 1 1 21 MET H . 21 . HN 1 1 91 1 2 1 1 21 MET QG . 21 . HG2 1 1 92 1 1 1 1 21 MET HA . 21 . HA 1 1 92 1 2 1 1 21 MET HB3 . 21 . HB2 1 1 93 1 1 1 1 21 MET HA . 21 . HA 1 1 93 1 2 1 1 22 TYR H . 22 . HN 1 1 94 1 1 1 1 21 MET HB3 . 21 . HB2 1 1 94 1 2 1 1 22 TYR H . 22 . HN 1 1 95 1 1 1 1 21 MET HB3 . 21 . HB2 1 1 95 1 2 1 1 30 ALA H . 30 . HN 1 1 96 1 1 1 1 22 TYR H . 22 . HN 1 1 96 1 2 1 1 22 TYR QB . 22 . HB2 1 1 97 1 1 1 1 22 TYR H . 22 . HN 1 1 97 1 2 1 1 23 ILE H . 23 . HN 1 1 98 1 1 1 1 22 TYR H . 22 . HN 1 1 98 1 2 1 1 23 ILE HA . 23 . HA 1 1 99 1 1 1 1 22 TYR H . 22 . HN 1 1 99 1 2 1 1 23 ILE QG . 23 . HG12 1 1 100 1 1 1 1 22 TYR H . 22 . HN 1 1 100 1 2 1 1 28 LYS HB2 . 28 . HB2 1 1 101 1 1 1 1 22 TYR HA . 22 . HA 1 1 101 1 2 1 1 22 TYR QB . 22 . HB2 1 1 102 1 1 1 1 22 TYR HA . 22 . HA 1 1 102 1 2 1 1 23 ILE H . 23 . HN 1 1 103 1 1 1 1 22 TYR HA . 22 . HA 1 1 103 1 2 1 1 24 GLU HB2 . 24 . HB2 1 1 104 1 1 1 1 22 TYR HA . 22 . HA 1 1 104 1 2 1 1 24 GLU QG . 24 . HG2 1 1 105 1 1 1 1 22 TYR HA . 22 . HA 1 1 105 1 2 1 1 30 ALA H . 30 . HN 1 1 106 1 1 1 1 22 TYR QB . 22 . HB2 1 1 106 1 2 1 1 23 ILE H . 23 . HN 1 1 107 1 1 1 1 22 TYR QB . 22 . HB2 1 1 107 1 2 1 1 28 LYS H . 28 . HN 1 1 108 1 1 1 1 22 TYR QB . 22 . HB2 1 1 108 1 2 1 1 29 TYR H . 29 . HN 1 1 109 1 1 1 1 22 TYR QB . 22 . HB2 1 1 109 1 2 1 1 29 TYR HA . 29 . HA 1 1 110 1 1 1 1 23 ILE H . 23 . HN 1 1 110 1 2 1 1 23 ILE QG . 23 . HG12 1 1 111 1 1 1 1 23 ILE HA . 23 . HA 1 1 111 1 2 1 1 24 GLU H . 24 . HN 1 1 112 1 1 1 1 23 ILE HB . 23 . HB 1 1 112 1 2 1 1 28 LYS H . 28 . HN 1 1 113 1 1 1 1 24 GLU H . 24 . HN 1 1 113 1 2 1 1 24 GLU HA . 24 . HA 1 1 114 1 1 1 1 24 GLU H . 24 . HN 1 1 114 1 2 1 1 24 GLU HB2 . 24 . HB2 1 1 115 1 1 1 1 24 GLU H . 24 . HN 1 1 115 1 2 1 1 24 GLU QG . 24 . HG2 1 1 116 1 1 1 1 24 GLU H . 24 . HN 1 1 116 1 2 1 1 25 ALA H . 25 . HN 1 1 117 1 1 1 1 24 GLU H . 24 . HN 1 1 117 1 2 1 1 26 LEU H . 26 . HN 1 1 118 1 1 1 1 24 GLU H . 24 . HN 1 1 118 1 2 1 1 27 ASP H . 27 . HN 1 1 119 1 1 1 1 24 GLU H . 24 . HN 1 1 119 1 2 1 1 28 LYS H . 28 . HN 1 1 120 1 1 1 1 24 GLU HA . 24 . HA 1 1 120 1 2 1 1 24 GLU HB2 . 24 . HB2 1 1 121 1 1 1 1 24 GLU HA . 24 . HA 1 1 121 1 2 1 1 24 GLU QG . 24 . HG2 1 1 122 1 1 1 1 24 GLU HA . 24 . HA 1 1 122 1 2 1 1 25 ALA H . 25 . HN 1 1 123 1 1 1 1 24 GLU HA . 24 . HA 1 1 123 1 2 1 1 26 LEU H . 26 . HN 1 1 124 1 1 1 1 24 GLU HA . 24 . HA 1 1 124 1 2 1 1 27 ASP H . 27 . HN 1 1 125 1 1 1 1 24 GLU HA . 24 . HA 1 1 125 1 2 1 1 28 LYS H . 28 . HN 1 1 126 1 1 1 1 24 GLU HB2 . 24 . HB2 1 1 126 1 2 1 1 25 ALA H . 25 . HN 1 1 127 1 1 1 1 24 GLU HB2 . 24 . HB2 1 1 127 1 2 1 1 26 LEU H . 26 . HN 1 1 128 1 1 1 1 24 GLU HB2 . 24 . HB2 1 1 128 1 2 1 1 28 LYS H . 28 . HN 1 1 129 1 1 1 1 24 GLU QG . 24 . HG2 1 1 129 1 2 1 1 25 ALA H . 25 . HN 1 1 130 1 1 1 1 24 GLU QG . 24 . HG2 1 1 130 1 2 1 1 26 LEU H . 26 . HN 1 1 131 1 1 1 1 24 GLU QG . 24 . HG2 1 1 131 1 2 1 1 27 ASP H . 27 . HN 1 1 132 1 1 1 1 24 GLU QG . 24 . HG2 1 1 132 1 2 1 1 28 LYS H . 28 . HN 1 1 133 1 1 1 1 25 ALA H . 25 . HN 1 1 133 1 2 1 1 25 ALA HA . 25 . HA 1 1 134 1 1 1 1 25 ALA H . 25 . HN 1 1 134 1 2 1 1 26 LEU H . 26 . HN 1 1 135 1 1 1 1 25 ALA H . 25 . HN 1 1 135 1 2 1 1 26 LEU HA . 26 . HA 1 1 136 1 1 1 1 25 ALA H . 25 . HN 1 1 136 1 2 1 1 27 ASP H . 27 . HN 1 1 137 1 1 1 1 26 LEU H . 26 . HN 1 1 137 1 2 1 1 26 LEU HA . 26 . HA 1 1 138 1 1 1 1 26 LEU H . 26 . HN 1 1 138 1 2 1 1 26 LEU HB2 . 26 . HB2 1 1 139 1 1 1 1 26 LEU H . 26 . HN 1 1 139 1 2 1 1 27 ASP H . 27 . HN 1 1 140 1 1 1 1 26 LEU H . 26 . HN 1 1 140 1 2 1 1 27 ASP HB3 . 27 . HB2 1 1 141 1 1 1 1 26 LEU H . 26 . HN 1 1 141 1 2 1 1 28 LYS H . 28 . HN 1 1 142 1 1 1 1 26 LEU H . 26 . HN 1 1 142 1 2 1 1 28 LYS QG . 28 . HG2 1 1 143 1 1 1 1 26 LEU HA . 26 . HA 1 1 143 1 2 1 1 26 LEU HG . 26 . HG 1 1 144 1 1 1 1 26 LEU HA . 26 . HA 1 1 144 1 2 1 1 27 ASP H . 27 . HN 1 1 145 1 1 1 1 26 LEU HA . 26 . HA 1 1 145 1 2 1 1 28 LYS H . 28 . HN 1 1 146 1 1 1 1 26 LEU HA . 26 . HA 1 1 146 1 2 1 1 28 LYS QG . 28 . HG2 1 1 147 1 1 1 1 26 LEU HB2 . 26 . HB2 1 1 147 1 2 1 1 27 ASP H . 27 . HN 1 1 148 1 1 1 1 26 LEU HB2 . 26 . HB2 1 1 148 1 2 1 1 28 LYS QG . 28 . HG2 1 1 149 1 1 1 1 27 ASP H . 27 . HN 1 1 149 1 2 1 1 27 ASP HA . 27 . HA 1 1 150 1 1 1 1 27 ASP H . 27 . HN 1 1 150 1 2 1 1 27 ASP HB3 . 27 . HB2 1 1 151 1 1 1 1 27 ASP H . 27 . HN 1 1 151 1 2 1 1 28 LYS H . 28 . HN 1 1 152 1 1 1 1 27 ASP H . 27 . HN 1 1 152 1 2 1 1 28 LYS HA . 28 . HA 1 1 153 1 1 1 1 27 ASP H . 27 . HN 1 1 153 1 2 1 1 28 LYS QG . 28 . HG2 1 1 154 1 1 1 1 27 ASP HA . 27 . HA 1 1 154 1 2 1 1 27 ASP HB3 . 27 . HB2 1 1 155 1 1 1 1 27 ASP HA . 27 . HA 1 1 155 1 2 1 1 28 LYS H . 28 . HN 1 1 156 1 1 1 1 27 ASP HB3 . 27 . HB2 1 1 156 1 2 1 1 28 LYS H . 28 . HN 1 1 157 1 1 1 1 28 LYS H . 28 . HN 1 1 157 1 2 1 1 28 LYS HB2 . 28 . HB2 1 1 158 1 1 1 1 28 LYS H . 28 . HN 1 1 158 1 2 1 1 28 LYS QG . 28 . HG2 1 1 159 1 1 1 1 28 LYS H . 28 . HN 1 1 159 1 2 1 1 29 TYR H . 29 . HN 1 1 160 1 1 1 1 28 LYS H . 28 . HN 1 1 160 1 2 1 1 29 TYR HA . 29 . HA 1 1 161 1 1 1 1 28 LYS HA . 28 . HA 1 1 161 1 2 1 1 28 LYS HB2 . 28 . HB2 1 1 161 1 2 1 1 28 LYS HD3 . 28 . HD2 1 1 162 1 1 1 1 28 LYS HA . 28 . HA 1 1 162 1 2 1 1 28 LYS QG . 28 . HG2 1 1 163 1 1 1 1 28 LYS HA . 28 . HA 1 1 163 1 2 1 1 29 TYR H . 29 . HN 1 1 164 1 1 1 1 28 LYS HB2 . 28 . HB2 1 1 164 1 2 1 1 28 LYS QG . 28 . HG2 1 1 165 1 1 1 1 28 LYS HB2 . 28 . HB2 1 1 165 1 2 1 1 29 TYR H . 29 . HN 1 1 166 1 1 1 1 28 LYS HD3 . 28 . HD2 1 1 166 1 2 1 1 28 LYS QG . 28 . HG2 1 1 167 1 1 1 1 28 LYS QG . 28 . HG2 1 1 167 1 2 1 1 29 TYR H . 29 . HN 1 1 168 1 1 1 1 29 TYR H . 29 . HN 1 1 168 1 2 1 1 29 TYR QB . 29 . HB2 1 1 169 1 1 1 1 29 TYR H . 29 . HN 1 1 169 1 2 1 1 30 ALA H . 30 . HN 1 1 170 1 1 1 1 29 TYR HA . 29 . HA 1 1 170 1 2 1 1 29 TYR QB . 29 . HB2 1 1 171 1 1 1 1 29 TYR HA . 29 . HA 1 1 171 1 2 1 1 30 ALA H . 30 . HN 1 1 172 1 1 1 1 29 TYR QB . 29 . HB2 1 1 172 1 2 1 1 41 ARG QB . 41 . HB2 1 1 173 1 1 1 1 30 ALA H . 30 . HN 1 1 173 1 2 1 1 30 ALA HA . 30 . HA 1 1 174 1 1 1 1 30 ALA H . 30 . HN 1 1 174 1 2 1 1 31 CYS H . 31 . HN 1 1 175 1 1 1 1 30 ALA HA . 30 . HA 1 1 175 1 2 1 1 31 CYS H . 31 . HN 1 1 176 1 1 1 1 31 CYS H . 31 . HN 1 1 176 1 2 1 1 31 CYS HA . 31 . HA 1 1 177 1 1 1 1 31 CYS H . 31 . HN 1 1 177 1 2 1 1 31 CYS HB3 . 31 . HB2 1 1 178 1 1 1 1 31 CYS H . 31 . HN 1 1 178 1 2 1 1 32 ASN H . 32 . HN 1 1 179 1 1 1 1 31 CYS H . 31 . HN 1 1 179 1 2 1 1 38 ILE HG12 . 38 . HG12 1 1 180 1 1 1 1 31 CYS HA . 31 . HA 1 1 180 1 2 1 1 32 ASN H . 32 . HN 1 1 181 1 1 1 1 32 ASN H . 32 . HN 1 1 181 1 2 1 1 32 ASN HA . 32 . HA 1 1 182 1 1 1 1 32 ASN H . 32 . HN 1 1 182 1 2 1 1 32 ASN HB3 . 32 . HB2 1 1 183 1 1 1 1 32 ASN H . 32 . HN 1 1 183 1 2 1 1 33 CYS H . 33 . HN 1 1 184 1 1 1 1 32 ASN H . 32 . HN 1 1 184 1 2 1 1 33 CYS QB . 33 . HB2 1 1 185 1 1 1 1 32 ASN HA . 32 . HA 1 1 185 1 2 1 1 32 ASN HB3 . 32 . HB2 1 1 186 1 1 1 1 32 ASN HA . 32 . HA 1 1 186 1 2 1 1 33 CYS H . 33 . HN 1 1 187 1 1 1 1 32 ASN HB3 . 32 . HB2 1 1 187 1 2 1 1 33 CYS H . 33 . HN 1 1 188 1 1 1 1 33 CYS H . 33 . HN 1 1 188 1 2 1 1 33 CYS QB . 33 . HB2 1 1 189 1 1 1 1 33 CYS H . 33 . HN 1 1 189 1 2 1 1 34 VAL H . 34 . HN 1 1 190 1 1 1 1 33 CYS H . 33 . HN 1 1 190 1 2 1 1 38 ILE HG12 . 38 . HG12 1 1 191 1 1 1 1 33 CYS H . 33 . HN 1 1 191 1 2 1 1 48 LYS QE . 48 . HE2 1 1 192 1 1 1 1 33 CYS HA . 33 . HA 1 1 192 1 2 1 1 33 CYS QB . 33 . HB2 1 1 193 1 1 1 1 33 CYS HA . 33 . HA 1 1 193 1 2 1 1 34 VAL H . 34 . HN 1 1 194 1 1 1 1 33 CYS QB . 33 . HB2 1 1 194 1 2 1 1 34 VAL H . 34 . HN 1 1 195 1 1 1 1 33 CYS QB . 33 . HB2 1 1 195 1 2 1 1 37 TYR H . 37 . HN 1 1 196 1 1 1 1 34 VAL H . 34 . HN 1 1 196 1 2 1 1 34 VAL HA . 34 . HA 1 1 197 1 1 1 1 34 VAL H . 34 . HN 1 1 197 1 2 1 1 34 VAL HB . 34 . HB 1 1 198 1 1 1 1 34 VAL H . 34 . HN 1 1 198 1 2 1 1 35 VAL H . 35 . HN 1 1 199 1 1 1 1 34 VAL HA . 34 . HA 1 1 199 1 2 1 1 34 VAL HB . 34 . HB 1 1 200 1 1 1 1 34 VAL HA . 34 . HA 1 1 200 1 2 1 1 35 VAL H . 35 . HN 1 1 201 1 1 1 1 34 VAL HA . 34 . HA 1 1 201 1 2 1 1 35 VAL HA . 35 . HA 1 1 202 1 1 1 1 34 VAL HA . 34 . HA 1 1 202 1 2 1 1 35 VAL HB . 35 . HB 1 1 203 1 1 1 1 34 VAL HB . 34 . HB 1 1 203 1 2 1 1 35 VAL H . 35 . HN 1 1 204 1 1 1 1 34 VAL HB . 34 . HB 1 1 204 1 2 1 1 37 TYR H . 37 . HN 1 1 205 1 1 1 1 35 VAL H . 35 . HN 1 1 205 1 2 1 1 35 VAL HA . 35 . HA 1 1 206 1 1 1 1 35 VAL H . 35 . HN 1 1 206 1 2 1 1 35 VAL HB . 35 . HB 1 1 207 1 1 1 1 35 VAL HA . 35 . HA 1 1 207 1 2 1 1 35 VAL HB . 35 . HB 1 1 208 1 1 1 1 35 VAL HA . 35 . HA 1 1 208 1 2 1 1 36 GLY H . 36 . HN 1 1 209 1 1 1 1 35 VAL HA . 35 . HA 1 1 209 1 2 1 1 37 TYR H . 37 . HN 1 1 210 1 1 1 1 35 VAL HB . 35 . HB 1 1 210 1 2 1 1 36 GLY H . 36 . HN 1 1 211 1 1 1 1 35 VAL HB . 35 . HB 1 1 211 1 2 1 1 37 TYR H . 37 . HN 1 1 212 1 1 1 1 35 VAL HB . 35 . HB 1 1 212 1 2 1 1 48 LYS H . 48 . HN 1 1 213 1 1 1 1 35 VAL HB . 35 . HB 1 1 213 1 2 1 1 48 LYS HA . 48 . HA 1 1 214 1 1 1 1 35 VAL HB . 35 . HB 1 1 214 1 2 1 1 49 TRP H . 49 . HN 1 1 215 1 1 1 1 35 VAL HB . 35 . HB 1 1 215 1 2 1 1 50 TRP H . 50 . HN 1 1 216 1 1 1 1 36 GLY HA2 . 36 . HA1 1 1 216 1 2 1 1 37 TYR H . 37 . HN 1 1 217 1 1 1 1 37 TYR H . 37 . HN 1 1 217 1 2 1 1 38 ILE H . 38 . HN 1 1 218 1 1 1 1 37 TYR H . 37 . HN 1 1 218 1 2 1 1 45 ARG HA . 45 . HA 1 1 219 1 1 1 1 37 TYR HA . 37 . HA 1 1 219 1 2 1 1 38 ILE H . 38 . HN 1 1 220 1 1 1 1 37 TYR HA . 37 . HA 1 1 220 1 2 1 1 45 ARG HA . 45 . HA 1 1 221 1 1 1 1 37 TYR HA . 37 . HA 1 1 221 1 2 1 1 46 ASP H . 46 . HN 1 1 222 1 1 1 1 37 TYR HB3 . 37 . HB2 1 1 222 1 2 1 1 38 ILE H . 38 . HN 1 1 223 1 1 1 1 37 TYR HB3 . 37 . HB2 1 1 223 1 2 1 1 42 CYS H . 42 . HN 1 1 224 1 1 1 1 38 ILE H . 38 . HN 1 1 224 1 2 1 1 38 ILE HA . 38 . HA 1 1 225 1 1 1 1 38 ILE H . 38 . HN 1 1 225 1 2 1 1 38 ILE HB . 38 . HB 1 1 226 1 1 1 1 38 ILE H . 38 . HN 1 1 226 1 2 1 1 38 ILE HG12 . 38 . HG12 1 1 227 1 1 1 1 38 ILE H . 38 . HN 1 1 227 1 2 1 1 39 GLY H . 39 . HN 1 1 228 1 1 1 1 38 ILE H . 38 . HN 1 1 228 1 2 1 1 42 CYS HA . 42 . HA 1 1 229 1 1 1 1 38 ILE H . 38 . HN 1 1 229 1 2 1 1 44 TYR H . 44 . HN 1 1 230 1 1 1 1 38 ILE H . 38 . HN 1 1 230 1 2 1 1 44 TYR HB2 . 44 . HB2 1 1 231 1 1 1 1 38 ILE H . 38 . HN 1 1 231 1 2 1 1 45 ARG HA . 45 . HA 1 1 232 1 1 1 1 38 ILE H . 38 . HN 1 1 232 1 2 1 1 48 LYS QE . 48 . HE2 1 1 233 1 1 1 1 38 ILE HA . 38 . HA 1 1 233 1 2 1 1 38 ILE HB . 38 . HB 1 1 234 1 1 1 1 38 ILE HA . 38 . HA 1 1 234 1 2 1 1 39 GLY H . 39 . HN 1 1 235 1 1 1 1 38 ILE HA . 38 . HA 1 1 235 1 2 1 1 42 CYS HA . 42 . HA 1 1 236 1 1 1 1 38 ILE HB . 38 . HB 1 1 236 1 2 1 1 38 ILE HG12 . 38 . HG12 1 1 237 1 1 1 1 38 ILE HB . 38 . HB 1 1 237 1 2 1 1 39 GLY H . 39 . HN 1 1 238 1 1 1 1 38 ILE HG12 . 38 . HG12 1 1 238 1 2 1 1 39 GLY H . 39 . HN 1 1 239 1 1 1 1 38 ILE HG12 . 38 . HG12 1 1 239 1 2 1 1 42 CYS H . 42 . HN 1 1 240 1 1 1 1 38 ILE HG12 . 38 . HG12 1 1 240 1 2 1 1 43 GLN H . 43 . HN 1 1 241 1 1 1 1 38 ILE HG12 . 38 . HG12 1 1 241 1 2 1 1 44 TYR H . 44 . HN 1 1 242 1 1 1 1 39 GLY H . 39 . HN 1 1 242 1 2 1 1 40 GLU H . 40 . HN 1 1 243 1 1 1 1 39 GLY H . 39 . HN 1 1 243 1 2 1 1 41 ARG H . 41 . HN 1 1 244 1 1 1 1 39 GLY H . 39 . HN 1 1 244 1 2 1 1 42 CYS H . 42 . HN 1 1 245 1 1 1 1 39 GLY H . 39 . HN 1 1 245 1 2 1 1 42 CYS HA . 42 . HA 1 1 246 1 1 1 1 39 GLY H . 39 . HN 1 1 246 1 2 1 1 42 CYS HB3 . 42 . HB2 1 1 247 1 1 1 1 39 GLY H . 39 . HN 1 1 247 1 2 1 1 43 GLN H . 43 . HN 1 1 248 1 1 1 1 39 GLY H . 39 . HN 1 1 248 1 2 1 1 44 TYR H . 44 . HN 1 1 249 1 1 1 1 39 GLY H . 39 . HN 1 1 249 1 2 1 1 44 TYR HB2 . 44 . HB2 1 1 250 1 1 1 1 39 GLY HA2 . 39 . HA1 1 1 250 1 2 1 1 40 GLU H . 40 . HN 1 1 251 1 1 1 1 39 GLY HA2 . 39 . HA1 1 1 251 1 2 1 1 42 CYS H . 42 . HN 1 1 252 1 1 1 1 39 GLY HA2 . 39 . HA1 1 1 252 1 2 1 1 42 CYS HA . 42 . HA 1 1 253 1 1 1 1 39 GLY HA2 . 39 . HA1 1 1 253 1 2 1 1 43 GLN H . 43 . HN 1 1 254 1 1 1 1 39 GLY HA2 . 39 . HA1 1 1 254 1 2 1 1 44 TYR H . 44 . HN 1 1 255 1 1 1 1 40 GLU H . 40 . HN 1 1 255 1 2 1 1 40 GLU HB3 . 40 . HB2 1 1 256 1 1 1 1 40 GLU H . 40 . HN 1 1 256 1 2 1 1 40 GLU QG . 40 . HG2 1 1 257 1 1 1 1 40 GLU H . 40 . HN 1 1 257 1 2 1 1 41 ARG QB . 41 . HB2 1 1 258 1 1 1 1 40 GLU H . 40 . HN 1 1 258 1 2 1 1 42 CYS HA . 42 . HA 1 1 259 1 1 1 1 40 GLU HA . 40 . HA 1 1 259 1 2 1 1 40 GLU HB3 . 40 . HB2 1 1 260 1 1 1 1 40 GLU HA . 40 . HA 1 1 260 1 2 1 1 40 GLU QG . 40 . HG2 1 1 261 1 1 1 1 40 GLU HA . 40 . HA 1 1 261 1 2 1 1 41 ARG H . 41 . HN 1 1 262 1 1 1 1 40 GLU HA . 40 . HA 1 1 262 1 2 1 1 41 ARG QB . 41 . HB2 1 1 263 1 1 1 1 40 GLU HA . 40 . HA 1 1 263 1 2 1 1 42 CYS H . 42 . HN 1 1 264 1 1 1 1 40 GLU HB3 . 40 . HB2 1 1 264 1 2 1 1 40 GLU QG . 40 . HG2 1 1 265 1 1 1 1 40 GLU QG . 40 . HG2 1 1 265 1 2 1 1 41 ARG H . 41 . HN 1 1 266 1 1 1 1 40 GLU QG . 40 . HG2 1 1 266 1 2 1 1 41 ARG QB . 41 . HB2 1 1 267 1 1 1 1 40 GLU QG . 40 . HG2 1 1 267 1 2 1 1 42 CYS H . 42 . HN 1 1 268 1 1 1 1 41 ARG H . 41 . HN 1 1 268 1 2 1 1 41 ARG QB . 41 . HB2 1 1 269 1 1 1 1 41 ARG H . 41 . HN 1 1 269 1 2 1 1 41 ARG HD2 . 41 . HD2 1 1 270 1 1 1 1 41 ARG H . 41 . HN 1 1 270 1 2 1 1 42 CYS H . 42 . HN 1 1 271 1 1 1 1 41 ARG H . 41 . HN 1 1 271 1 2 1 1 42 CYS HA . 42 . HA 1 1 272 1 1 1 1 41 ARG H . 41 . HN 1 1 272 1 2 1 1 43 GLN H . 43 . HN 1 1 273 1 1 1 1 41 ARG HA . 41 . HA 1 1 273 1 2 1 1 41 ARG QB . 41 . HB2 1 1 274 1 1 1 1 41 ARG HA . 41 . HA 1 1 274 1 2 1 1 42 CYS H . 42 . HN 1 1 275 1 1 1 1 41 ARG HA . 41 . HA 1 1 275 1 2 1 1 43 GLN H . 43 . HN 1 1 276 1 1 1 1 41 ARG QB . 41 . HB2 1 1 276 1 2 1 1 41 ARG HG3 . 41 . HG2 1 1 277 1 1 1 1 41 ARG QB . 41 . HB2 1 1 277 1 2 1 1 42 CYS H . 42 . HN 1 1 278 1 1 1 1 41 ARG HD2 . 41 . HD2 1 1 278 1 2 1 1 42 CYS H . 42 . HN 1 1 279 1 1 1 1 41 ARG HG3 . 41 . HG2 1 1 279 1 2 1 1 42 CYS HA . 42 . HA 1 1 280 1 1 1 1 42 CYS H . 42 . HN 1 1 280 1 2 1 1 42 CYS HA . 42 . HA 1 1 281 1 1 1 1 42 CYS H . 42 . HN 1 1 281 1 2 1 1 42 CYS HB3 . 42 . HB2 1 1 282 1 1 1 1 42 CYS H . 42 . HN 1 1 282 1 2 1 1 43 GLN H . 43 . HN 1 1 283 1 1 1 1 42 CYS H . 42 . HN 1 1 283 1 2 1 1 43 GLN HB3 . 43 . HB2 1 1 284 1 1 1 1 42 CYS H . 42 . HN 1 1 284 1 2 1 1 44 TYR H . 44 . HN 1 1 285 1 1 1 1 42 CYS H . 42 . HN 1 1 285 1 2 1 1 44 TYR HB2 . 44 . HB2 1 1 286 1 1 1 1 42 CYS HA . 42 . HA 1 1 286 1 2 1 1 42 CYS HB3 . 42 . HB2 1 1 287 1 1 1 1 42 CYS HA . 42 . HA 1 1 287 1 2 1 1 43 GLN H . 43 . HN 1 1 288 1 1 1 1 42 CYS HA . 42 . HA 1 1 288 1 2 1 1 44 TYR H . 44 . HN 1 1 289 1 1 1 1 43 GLN H . 43 . HN 1 1 289 1 2 1 1 43 GLN HA . 43 . HA 1 1 290 1 1 1 1 43 GLN H . 43 . HN 1 1 290 1 2 1 1 43 GLN HB3 . 43 . HB2 1 1 291 1 1 1 1 43 GLN H . 43 . HN 1 1 291 1 2 1 1 44 TYR H . 44 . HN 1 1 292 1 1 1 1 43 GLN H . 43 . HN 1 1 292 1 2 1 1 44 TYR HB2 . 44 . HB2 1 1 293 1 1 1 1 44 TYR H . 44 . HN 1 1 293 1 2 1 1 48 LYS QE . 48 . HE2 1 1 294 1 1 1 1 44 TYR HA . 44 . HA 1 1 294 1 2 1 1 45 ARG H . 45 . HN 1 1 295 1 1 1 1 45 ARG H . 45 . HN 1 1 295 1 2 1 1 45 ARG HA . 45 . HA 1 1 296 1 1 1 1 45 ARG H . 45 . HN 1 1 296 1 2 1 1 45 ARG HG3 . 45 . HG2 1 1 297 1 1 1 1 45 ARG HA . 45 . HA 1 1 297 1 2 1 1 45 ARG HB3 . 45 . HB2 1 1 298 1 1 1 1 45 ARG HA . 45 . HA 1 1 298 1 2 1 1 45 ARG HG3 . 45 . HG2 1 1 299 1 1 1 1 45 ARG HA . 45 . HA 1 1 299 1 2 1 1 46 ASP H . 46 . HN 1 1 300 1 1 1 1 45 ARG HD3 . 45 . HD2 1 1 300 1 2 1 1 45 ARG HG3 . 45 . HG2 1 1 301 1 1 1 1 46 ASP H . 46 . HN 1 1 301 1 2 1 1 51 GLU HG3 . 51 . HG2 1 1 302 1 1 1 1 46 ASP HA . 46 . HA 1 1 302 1 2 1 1 47 LEU H . 47 . HN 1 1 303 1 1 1 1 46 ASP HA . 46 . HA 1 1 303 1 2 1 1 48 LYS H . 48 . HN 1 1 304 1 1 1 1 47 LEU H . 47 . HN 1 1 304 1 2 1 1 47 LEU HB2 . 47 . HB2 1 1 305 1 1 1 1 47 LEU H . 47 . HN 1 1 305 1 2 1 1 47 LEU HB2 . 47 . HB2 1 1 305 1 2 1 1 47 LEU HG . 47 . HG 1 1 306 1 1 1 1 47 LEU H . 47 . HN 1 1 306 1 2 1 1 47 LEU HG . 47 . HG 1 1 307 1 1 1 1 47 LEU HA . 47 . HA 1 1 307 1 2 1 1 52 LEU HB2 . 52 . HB2 1 1 308 1 1 1 1 47 LEU HB2 . 47 . HB2 1 1 308 1 2 1 1 48 LYS H . 48 . HN 1 1 309 1 1 1 1 48 LYS H . 48 . HN 1 1 309 1 2 1 1 48 LYS HA . 48 . HA 1 1 310 1 1 1 1 48 LYS H . 48 . HN 1 1 310 1 2 1 1 48 LYS QG . 48 . HG2 1 1 311 1 1 1 1 48 LYS H . 48 . HN 1 1 311 1 2 1 1 49 TRP H . 49 . HN 1 1 312 1 1 1 1 48 LYS H . 48 . HN 1 1 312 1 2 1 1 49 TRP HB3 . 49 . HB2 1 1 313 1 1 1 1 48 LYS H . 48 . HN 1 1 313 1 2 1 1 51 GLU HB2 . 51 . HB2 1 1 314 1 1 1 1 48 LYS H . 48 . HN 1 1 314 1 2 1 1 51 GLU HG3 . 51 . HG2 1 1 315 1 1 1 1 48 LYS HA . 48 . HA 1 1 315 1 2 1 1 48 LYS HD3 . 48 . HD2 1 1 316 1 1 1 1 48 LYS HA . 48 . HA 1 1 316 1 2 1 1 48 LYS QG . 48 . HG2 1 1 317 1 1 1 1 48 LYS HA . 48 . HA 1 1 317 1 2 1 1 53 ARG H . 53 . HN 1 1 318 1 1 1 1 48 LYS QG . 48 . HG2 1 1 318 1 2 1 1 49 TRP H . 49 . HN 1 1 319 1 1 1 1 48 LYS QG . 48 . HG2 1 1 319 1 2 1 1 51 GLU H . 51 . HN 1 1 320 1 1 1 1 48 LYS QG . 48 . HG2 1 1 320 1 2 1 1 53 ARG H . 53 . HN 1 1 321 1 1 1 1 49 TRP H . 49 . HN 1 1 321 1 2 1 1 49 TRP HA . 49 . HA 1 1 322 1 1 1 1 49 TRP H . 49 . HN 1 1 322 1 2 1 1 49 TRP HB3 . 49 . HB2 1 1 323 1 1 1 1 49 TRP HA . 49 . HA 1 1 323 1 2 1 1 49 TRP HB3 . 49 . HB2 1 1 324 1 1 1 1 49 TRP HB3 . 49 . HB2 1 1 324 1 2 1 1 50 TRP H . 50 . HN 1 1 325 1 1 1 1 49 TRP HB3 . 49 . HB2 1 1 325 1 2 1 1 50 TRP HA . 50 . HA 1 1 326 1 1 1 1 49 TRP HB3 . 49 . HB2 1 1 326 1 2 1 1 51 GLU H . 51 . HN 1 1 327 1 1 1 1 50 TRP H . 50 . HN 1 1 327 1 2 1 1 50 TRP HA . 50 . HA 1 1 328 1 1 1 1 50 TRP HA . 50 . HA 1 1 328 1 2 1 1 50 TRP HB3 . 50 . HB2 1 1 329 1 1 1 1 50 TRP HA . 50 . HA 1 1 329 1 2 1 1 51 GLU H . 51 . HN 1 1 330 1 1 1 1 51 GLU H . 51 . HN 1 1 330 1 2 1 1 51 GLU HB2 . 51 . HB2 1 1 331 1 1 1 1 51 GLU H . 51 . HN 1 1 331 1 2 1 1 51 GLU HG3 . 51 . HG2 1 1 332 1 1 1 1 51 GLU HA . 51 . HA 1 1 332 1 2 1 1 51 GLU HB2 . 51 . HB2 1 1 333 1 1 1 1 51 GLU HA . 51 . HA 1 1 333 1 2 1 1 51 GLU HG3 . 51 . HG2 1 1 334 1 1 1 1 51 GLU HB2 . 51 . HB2 1 1 334 1 2 1 1 52 LEU H . 52 . HN 1 1 335 1 1 1 1 51 GLU HG3 . 51 . HG2 1 1 335 1 2 1 1 52 LEU H . 52 . HN 1 1 336 1 1 1 1 52 LEU H . 52 . HN 1 1 336 1 2 1 1 52 LEU HB2 . 52 . HB2 1 1 337 1 1 1 1 52 LEU HA . 52 . HA 1 1 337 1 2 1 1 52 LEU HB2 . 52 . HB2 1 1 338 1 1 1 1 52 LEU HA . 52 . HA 1 1 338 1 2 1 1 53 ARG H . 53 . HN 1 1 339 1 1 1 1 52 LEU HB2 . 52 . HB2 1 1 339 1 2 1 1 53 ARG H . 53 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.0 1.5 2.5 1 1 2 1 . . . . . 2.3 1.6 3.0 1 1 3 1 . . . . . 2.7 1.8 3.6 1 1 4 1 . . . . . 3.5 0.0 6.0 1 1 5 1 . . . . . 3.2 1.9 4.5 1 1 6 1 . . . . . 2.3 1.6 3.0 1 1 7 1 . . . . . 2.4 1.7 3.1 1 1 8 1 . . . . . 3.4 1.9 4.9 1 1 9 1 . . . . . 2.8 1.8 3.8 1 1 10 1 . . . . . 3.4 2.0 4.8 1 1 11 1 . . . . . 3.0 1.9 4.1 1 1 12 1 . . . . . 3.6 2.0 5.2 1 1 13 1 . . . . . 2.0 1.5 2.5 1 1 14 1 . . . . . 3.3 1.9 4.7 1 1 15 1 . . . . . 3.3 2.0 4.6 1 1 16 1 . . . . . 3.4 2.0 4.8 1 1 17 1 . . . . . 3.1 0.0 6.0 1 1 18 1 . . . . . 3.9 2.0 5.8 1 1 19 1 . . . . . 2.7 1.8 3.6 1 1 20 1 . . . . . 2.5 1.7 3.3 1 1 21 1 . . . . . 3.9 2.0 5.8 1 1 22 1 . . . . . 2.9 0.0 6.0 1 1 23 1 . . . . . 3.0 1.9 4.1 1 1 24 1 . . . . . 3.2 1.9 4.5 1 1 25 1 . . . . . 3.5 1.9 5.1 1 1 26 1 . . . . . 3.5 2.0 5.0 1 1 27 1 . . . . . 2.5 1.7 3.3 1 1 28 1 . . . . . 3.1 1.9 4.3 1 1 29 1 . . . . . 3.7 2.0 5.4 1 1 30 1 . . . . . 2.2 1.6 2.8 1 1 31 1 . . . . . 2.1 0.0 6.0 1 1 32 1 . . . . . 6.0 0.0 6.0 1 1 33 1 . . . . . 2.7 1.8 3.6 1 1 34 1 . . . . . 2.8 1.8 3.8 1 1 35 1 . . . . . 2.4 1.7 3.1 1 1 36 1 . . . . . 3.0 1.8 4.2 1 1 37 1 . . . . . 4.1 2.0 6.0 1 1 38 1 . . . . . 3.3 1.9 4.7 1 1 39 1 . . . . . 2.9 1.9 3.9 1 1 40 1 . . . . . 2.6 1.8 3.4 1 1 41 1 . . . . . 2.7 1.8 3.6 1 1 42 1 . . . . . 3.6 2.0 5.2 1 1 43 1 . . . . . 3.4 2.0 4.8 1 1 44 1 . . . . . 3.6 2.0 5.2 1 1 45 1 . . . . . 2.5 0.0 6.0 1 1 46 1 . . . . . 2.1 1.6 2.6 1 1 47 1 . . . . . 3.6 1.9 5.3 1 1 48 1 . . . . . 3.8 2.0 5.6 1 1 49 1 . . . . . 2.3 1.6 3.0 1 1 50 1 . . . . . 2.3 1.7 2.9 1 1 51 1 . . . . . 3.4 1.9 4.9 1 1 52 1 . . . . . 2.2 0.0 6.0 1 1 53 1 . . . . . 2.1 0.0 6.0 1 1 54 1 . . . . . 2.3 0.0 6.0 1 1 55 1 . . . . . 6.0 0.0 6.0 1 1 56 1 . . . . . 3.0 1.9 4.1 1 1 57 1 . . . . . 2.2 1.6 2.8 1 1 58 1 . . . . . 6.0 0.0 6.0 1 1 59 1 . . . . . 2.7 0.0 6.0 1 1 60 1 . . . . . 4.1 2.0 6.0 1 1 61 1 . . . . . 2.9 0.0 6.0 1 1 62 1 . . . . . 2.5 1.7 3.3 1 1 63 1 . . . . . 3.0 1.9 4.1 1 1 64 1 . . . . . 2.8 1.8 3.8 1 1 65 1 . . . . . 4.0 2.0 6.0 1 1 66 1 . . . . . 3.8 2.0 5.6 1 1 67 1 . . . . . 2.7 1.8 3.6 1 1 68 1 . . . . . 2.9 1.9 3.9 1 1 69 1 . . . . . 3.0 1.8 4.2 1 1 70 1 . . . . . 2.3 0.0 6.0 1 1 71 1 . . . . . 4.3 2.0 6.0 1 1 72 1 . . . . . 3.0 0.0 6.0 1 1 73 1 . . . . . 3.6 2.0 5.2 1 1 74 1 . . . . . 2.8 1.8 3.8 1 1 75 1 . . . . . 3.2 1.9 4.5 1 1 76 1 . . . . . 3.0 1.9 4.1 1 1 77 1 . . . . . 3.0 1.9 4.1 1 1 78 1 . . . . . 3.3 2.0 4.6 1 1 79 1 . . . . . 3.0 1.9 4.1 1 1 80 1 . . . . . 3.8 2.0 5.6 1 1 81 1 . . . . . 2.6 1.7 3.5 1 1 82 1 . . . . . 3.9 2.0 5.8 1 1 83 1 . . . . . 3.2 1.9 4.5 1 1 84 1 . . . . . 3.7 2.0 5.4 1 1 85 1 . . . . . 2.7 0.0 6.0 1 1 86 1 . . . . . 3.1 1.9 4.3 1 1 87 1 . . . . . 4.4 2.0 6.0 1 1 88 1 . . . . . 3.1 1.9 4.3 1 1 89 1 . . . . . 1.7 0.0 6.0 1 1 90 1 . . . . . 3.4 2.0 4.8 1 1 91 1 . . . . . 2.4 1.7 3.1 1 1 92 1 . . . . . 2.4 1.7 3.1 1 1 93 1 . . . . . 2.5 1.7 3.3 1 1 94 1 . . . . . 3.0 1.9 4.1 1 1 95 1 . . . . . 3.3 0.0 6.0 1 1 96 1 . . . . . 2.6 1.7 3.5 1 1 97 1 . . . . . 3.2 1.9 4.5 1 1 98 1 . . . . . 3.9 2.0 5.8 1 1 99 1 . . . . . 3.8 2.0 5.6 1 1 100 1 . . . . . 3.0 1.8 4.2 1 1 101 1 . . . . . 2.3 1.6 3.0 1 1 102 1 . . . . . 2.5 1.7 3.3 1 1 103 1 . . . . . 3.1 0.0 6.0 1 1 104 1 . . . . . 3.2 1.9 4.5 1 1 105 1 . . . . . 3.3 1.9 4.7 1 1 106 1 . . . . . 3.1 1.9 4.3 1 1 107 1 . . . . . 4.2 2.0 6.0 1 1 108 1 . . . . . 2.9 1.8 4.0 1 1 109 1 . . . . . 2.9 1.9 3.9 1 1 110 1 . . . . . 2.2 1.6 2.8 1 1 111 1 . . . . . 2.5 1.7 3.3 1 1 112 1 . . . . . 6.0 1.2 6.0 1 1 113 1 . . . . . 3.0 1.9 4.1 1 1 114 1 . . . . . 2.6 1.7 3.5 1 1 115 1 . . . . . 2.4 1.7 3.1 1 1 116 1 . . . . . 3.3 2.0 4.6 1 1 117 1 . . . . . 3.8 2.0 5.6 1 1 118 1 . . . . . 3.7 2.0 5.4 1 1 119 1 . . . . . 3.0 1.9 4.1 1 1 120 1 . . . . . 3.0 1.9 4.1 1 1 121 1 . . . . . 3.1 1.9 4.3 1 1 122 1 . . . . . 3.6 2.0 5.2 1 1 123 1 . . . . . 3.4 2.0 4.8 1 1 124 1 . . . . . 4.1 2.0 6.0 1 1 125 1 . . . . . 3.0 0.0 6.0 1 1 126 1 . . . . . 6.0 0.0 6.0 1 1 127 1 . . . . . 3.1 1.9 4.3 1 1 128 1 . . . . . 3.9 2.0 5.8 1 1 129 1 . . . . . 3.7 2.0 5.4 1 1 130 1 . . . . . 3.0 0.0 6.0 1 1 131 1 . . . . . 3.8 0.0 6.0 1 1 132 1 . . . . . 3.8 2.0 5.6 1 1 133 1 . . . . . 2.5 1.7 3.3 1 1 134 1 . . . . . 3.0 1.9 4.1 1 1 135 1 . . . . . 4.7 1.9 6.0 1 1 136 1 . . . . . 4.1 2.0 6.0 1 1 137 1 . . . . . 3.0 1.9 4.1 1 1 138 1 . . . . . 2.9 1.8 4.0 1 1 139 1 . . . . . 2.4 1.7 3.1 1 1 140 1 . . . . . 4.3 2.0 6.0 1 1 141 1 . . . . . 3.9 2.0 5.8 1 1 142 1 . . . . . 2.6 1.7 3.5 1 1 143 1 . . . . . 2.6 1.8 3.4 1 1 144 1 . . . . . 3.0 1.8 4.2 1 1 145 1 . . . . . 3.6 2.0 5.2 1 1 146 1 . . . . . 3.7 2.0 5.4 1 1 147 1 . . . . . 3.1 1.9 4.3 1 1 148 1 . . . . . 2.0 1.5 2.5 1 1 149 1 . . . . . 2.3 1.6 3.0 1 1 150 1 . . . . . 3.2 1.9 4.5 1 1 151 1 . . . . . 2.9 1.8 4.0 1 1 152 1 . . . . . 4.2 2.0 6.0 1 1 153 1 . . . . . 2.9 1.8 4.0 1 1 154 1 . . . . . 2.7 1.8 3.6 1 1 155 1 . . . . . 2.9 1.8 4.0 1 1 156 1 . . . . . 3.7 2.0 5.4 1 1 157 1 . . . . . 2.7 1.8 3.6 1 1 158 1 . . . . . 2.4 1.7 3.1 1 1 159 1 . . . . . 3.6 2.0 5.2 1 1 160 1 . . . . . 3.8 2.0 5.6 1 1 161 1 . . . . . 3.1 1.9 4.3 1 1 162 1 . . . . . 3.1 1.9 4.3 1 1 163 1 . . . . . 2.7 1.8 3.6 1 1 164 1 . . . . . 2.3 1.6 3.0 1 1 165 1 . . . . . 4.2 2.0 6.0 1 1 166 1 . . . . . 2.3 1.6 3.0 1 1 167 1 . . . . . 3.5 1.9 5.1 1 1 168 1 . . . . . 2.2 0.0 6.0 1 1 169 1 . . . . . 3.6 2.0 5.2 1 1 170 1 . . . . . 2.4 1.7 3.1 1 1 171 1 . . . . . 2.0 1.5 2.5 1 1 172 1 . . . . . 2.3 0.0 6.0 1 1 173 1 . . . . . 2.4 1.7 3.1 1 1 174 1 . . . . . 4.1 2.0 6.0 1 1 175 1 . . . . . 2.5 1.7 3.3 1 1 176 1 . . . . . 2.9 1.8 4.0 1 1 177 1 . . . . . 3.3 2.0 4.6 1 1 178 1 . . . . . 4.1 2.0 6.0 1 1 179 1 . . . . . 2.9 0.0 6.0 1 1 180 1 . . . . . 2.4 1.7 3.1 1 1 181 1 . . . . . 3.0 1.9 4.1 1 1 182 1 . . . . . 3.1 1.9 4.3 1 1 183 1 . . . . . 3.9 2.0 5.8 1 1 184 1 . . . . . 3.4 0.0 6.0 1 1 185 1 . . . . . 2.8 1.8 3.8 1 1 186 1 . . . . . 2.3 1.6 3.0 1 1 187 1 . . . . . 4.2 2.0 6.0 1 1 188 1 . . . . . 2.9 1.9 3.9 1 1 189 1 . . . . . 3.6 2.0 5.2 1 1 190 1 . . . . . 3.1 1.9 4.3 1 1 191 1 . . . . . 2.8 0.0 6.0 1 1 192 1 . . . . . 3.0 1.9 4.1 1 1 193 1 . . . . . 3.2 1.9 4.5 1 1 194 1 . . . . . 3.5 2.0 5.0 1 1 195 1 . . . . . 3.3 1.9 4.7 1 1 196 1 . . . . . 3.0 1.9 4.1 1 1 197 1 . . . . . 3.0 1.8 4.2 1 1 198 1 . . . . . 1.9 0.0 6.0 1 1 199 1 . . . . . 2.7 1.8 3.6 1 1 200 1 . . . . . 2.4 1.7 3.1 1 1 201 1 . . . . . 3.8 2.0 5.6 1 1 202 1 . . . . . 3.9 2.0 5.8 1 1 203 1 . . . . . 3.9 2.0 5.8 1 1 204 1 . . . . . 3.4 0.0 6.0 1 1 205 1 . . . . . 2.8 1.9 3.7 1 1 206 1 . . . . . 3.1 1.9 4.3 1 1 207 1 . . . . . 2.7 1.8 3.6 1 1 208 1 . . . . . 2.6 1.7 3.5 1 1 209 1 . . . . . 4.2 1.9 6.0 1 1 210 1 . . . . . 3.8 2.0 5.6 1 1 211 1 . . . . . 3.8 2.0 5.6 1 1 212 1 . . . . . 3.3 2.0 4.6 1 1 213 1 . . . . . 3.1 0.0 6.0 1 1 214 1 . . . . . 2.2 1.6 2.8 1 1 215 1 . . . . . 2.8 1.9 3.7 1 1 216 1 . . . . . 3.3 1.9 4.7 1 1 217 1 . . . . . 3.2 1.9 4.5 1 1 218 1 . . . . . 4.0 2.0 6.0 1 1 219 1 . . . . . 2.6 1.8 3.4 1 1 220 1 . . . . . 3.4 2.0 4.8 1 1 221 1 . . . . . 3.2 0.0 6.0 1 1 222 1 . . . . . 3.9 2.0 5.8 1 1 223 1 . . . . . 4.6 1.9 6.0 1 1 224 1 . . . . . 3.0 1.9 4.1 1 1 225 1 . . . . . 2.9 1.9 3.9 1 1 226 1 . . . . . 3.6 2.0 5.2 1 1 227 1 . . . . . 3.9 2.0 5.8 1 1 228 1 . . . . . 4.5 2.0 6.0 1 1 229 1 . . . . . 2.4 1.7 3.1 1 1 230 1 . . . . . 2.3 0.0 6.0 1 1 231 1 . . . . . 3.5 2.0 5.0 1 1 232 1 . . . . . 3.2 1.9 4.5 1 1 233 1 . . . . . 2.5 1.7 3.3 1 1 234 1 . . . . . 2.3 1.6 3.0 1 1 235 1 . . . . . 1.6 1.3 2.2 1 1 236 1 . . . . . 2.6 1.8 3.4 1 1 237 1 . . . . . 3.6 2.0 5.2 1 1 238 1 . . . . . 3.3 1.9 4.7 1 1 239 1 . . . . . 3.6 1.9 5.3 1 1 240 1 . . . . . 3.8 2.0 5.6 1 1 241 1 . . . . . 4.2 1.9 6.0 1 1 242 1 . . . . . 3.4 1.9 4.9 1 1 243 1 . . . . . 3.9 1.9 5.9 1 1 244 1 . . . . . 2.5 1.7 3.3 1 1 245 1 . . . . . 2.7 1.8 3.6 1 1 246 1 . . . . . 4.8 1.9 6.0 1 1 247 1 . . . . . 2.8 1.8 3.8 1 1 248 1 . . . . . 2.9 1.9 3.9 1 1 249 1 . . . . . 4.0 2.0 6.0 1 1 250 1 . . . . . 3.7 2.0 5.4 1 1 251 1 . . . . . 4.3 2.0 6.0 1 1 252 1 . . . . . 3.3 0.0 6.0 1 1 253 1 . . . . . 4.5 2.0 6.0 1 1 254 1 . . . . . 2.0 0.0 6.0 1 1 255 1 . . . . . 2.9 1.8 4.0 1 1 256 1 . . . . . 3.9 2.0 5.8 1 1 257 1 . . . . . 3.0 0.0 6.0 1 1 258 1 . . . . . 4.1 2.0 6.0 1 1 259 1 . . . . . 2.6 1.8 3.4 1 1 260 1 . . . . . 3.8 2.0 5.6 1 1 261 1 . . . . . 3.4 1.9 4.9 1 1 262 1 . . . . . 2.5 0.0 6.0 1 1 263 1 . . . . . 3.4 1.9 4.9 1 1 264 1 . . . . . 2.5 1.7 3.3 1 1 265 1 . . . . . 3.1 1.9 4.3 1 1 266 1 . . . . . 2.5 1.7 3.3 1 1 267 1 . . . . . 2.5 0.0 6.0 1 1 268 1 . . . . . 3.0 1.8 4.2 1 1 269 1 . . . . . 3.7 2.0 5.4 1 1 270 1 . . . . . 2.9 1.9 3.9 1 1 271 1 . . . . . 4.1 2.0 6.0 1 1 272 1 . . . . . 4.4 2.0 6.0 1 1 273 1 . . . . . 3.3 2.0 4.6 1 1 274 1 . . . . . 3.4 2.0 4.8 1 1 275 1 . . . . . 3.2 0.0 6.0 1 1 276 1 . . . . . 2.4 1.7 3.1 1 1 277 1 . . . . . 3.2 1.9 4.5 1 1 278 1 . . . . . 3.0 1.9 4.1 1 1 279 1 . . . . . 2.6 0.0 6.0 1 1 280 1 . . . . . 2.8 1.9 3.7 1 1 281 1 . . . . . 4.1 2.0 6.0 1 1 282 1 . . . . . 3.6 1.9 5.3 1 1 283 1 . . . . . 4.4 2.0 6.0 1 1 284 1 . . . . . 5.0 1.9 6.0 1 1 285 1 . . . . . 4.1 2.0 6.0 1 1 286 1 . . . . . 2.2 1.6 2.8 1 1 287 1 . . . . . 2.7 1.8 3.6 1 1 288 1 . . . . . 3.0 1.9 4.1 1 1 289 1 . . . . . 3.0 1.8 4.2 1 1 290 1 . . . . . 3.3 1.9 4.7 1 1 291 1 . . . . . 2.5 1.7 3.3 1 1 292 1 . . . . . 3.8 2.0 5.6 1 1 293 1 . . . . . 4.0 2.0 6.0 1 1 294 1 . . . . . 1.9 1.5 2.3 1 1 295 1 . . . . . 1.9 1.5 2.3 1 1 296 1 . . . . . 4.0 2.0 6.0 1 1 297 1 . . . . . 2.6 1.8 3.4 1 1 298 1 . . . . . 3.3 1.9 4.7 1 1 299 1 . . . . . 2.5 1.7 3.3 1 1 300 1 . . . . . 2.4 1.7 3.1 1 1 301 1 . . . . . 2.2 1.6 2.8 1 1 302 1 . . . . . 2.6 1.8 3.4 1 1 303 1 . . . . . 3.4 1.9 4.9 1 1 304 1 . . . . . 2.4 1.7 3.1 1 1 305 1 . . . . . 2.6 1.8 3.4 1 1 306 1 . . . . . 2.6 1.8 3.4 1 1 307 1 . . . . . 2.3 0.0 6.0 1 1 308 1 . . . . . 4.3 2.0 6.0 1 1 309 1 . . . . . 2.8 1.8 3.8 1 1 310 1 . . . . . 2.4 1.7 3.1 1 1 311 1 . . . . . 3.3 1.9 4.7 1 1 312 1 . . . . . 5.0 1.8 6.0 1 1 313 1 . . . . . 3.5 2.0 5.0 1 1 314 1 . . . . . 3.8 2.0 5.6 1 1 315 1 . . . . . 3.3 1.9 4.7 1 1 316 1 . . . . . 3.6 1.9 5.3 1 1 317 1 . . . . . 2.8 0.0 6.0 1 1 318 1 . . . . . 1.8 1.4 2.2 1 1 319 1 . . . . . 2.8 0.0 6.0 1 1 320 1 . . . . . 2.2 0.0 6.0 1 1 321 1 . . . . . 2.5 1.7 3.3 1 1 322 1 . . . . . 2.3 1.6 3.0 1 1 323 1 . . . . . 2.4 1.7 3.1 1 1 324 1 . . . . . 3.2 1.9 4.5 1 1 325 1 . . . . . 3.2 1.9 4.5 1 1 326 1 . . . . . 2.5 0.0 6.0 1 1 327 1 . . . . . 3.0 1.9 4.1 1 1 328 1 . . . . . 2.5 1.7 3.3 1 1 329 1 . . . . . 3.2 1.9 4.5 1 1 330 1 . . . . . 2.4 1.7 3.1 1 1 331 1 . . . . . 2.7 1.8 3.6 1 1 332 1 . . . . . 2.2 0.0 6.0 1 1 333 1 . . . . . 3.0 1.9 4.1 1 1 334 1 . . . . . 2.6 1.8 3.4 1 1 335 1 . . . . . 4.0 2.0 6.0 1 1 336 1 . . . . . 2.4 1.7 3.1 1 1 337 1 . . . . . 2.6 1.8 3.4 1 1 338 1 . . . . . 2.6 1.8 3.4 1 1 339 1 . . . . . 2.3 1.6 3.0 1 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 ASN C 1 1 2 SER N 1 1 2 SER CA 1 1 2 SER C -124.3 -66.04 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 6 CYS C 1 1 7 PRO N 1 1 7 PRO CA 1 1 7 PRO C -66.38 -55.4 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 3 . 1 1 7 PRO C 1 1 8 LEU N 1 1 8 LEU CA 1 1 8 LEU C -68.57 -56.85 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 4 . 1 1 8 LEU C 1 1 9 SER N 1 1 9 SER CA 1 1 9 SER C -80.7 -61.119995 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 5 . 1 1 10 HIS C 1 1 11 ASP N 1 1 11 ASP CA 1 1 11 ASP C -77.64 -49.08 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 6 . 1 1 13 TYR C 1 1 14 CYS N 1 1 14 CYS CA 1 1 14 CYS C -154.41998 -120.700005 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 7 . 1 1 14 CYS C 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C -116.28999 -71.59 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 8 . 1 1 16 HIS C 1 1 17 ASP N 1 1 17 ASP CA 1 1 17 ASP C -87.22 -57.16 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 9 . 1 1 18 GLY C 1 1 19 VAL N 1 1 19 VAL CA 1 1 19 VAL C -138.8 -107.98 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 10 . 1 1 19 VAL C 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS C -122.42999 -106.11 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 11 . 1 1 20 CYS C 1 1 21 MET N 1 1 21 MET CA 1 1 21 MET C -137.87 -109.51 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 12 . 1 1 21 MET C 1 1 22 TYR N 1 1 22 TYR CA 1 1 22 TYR C -121.25 -85.93 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 13 . 1 1 22 TYR C 1 1 23 ILE N 1 1 23 ILE CA 1 1 23 ILE C -118.16999 -80.89 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 14 . 1 1 23 ILE C 1 1 24 GLU N 1 1 24 GLU CA 1 1 24 GLU C -65.95 -51.529995 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 15 . 1 1 24 GLU C 1 1 25 ALA N 1 1 25 ALA CA 1 1 25 ALA C -78.25 -61.909996 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 16 . 1 1 25 ALA C 1 1 26 LEU N 1 1 26 LEU CA 1 1 26 LEU C -110.84 -80.26 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 17 . 1 1 27 ASP C 1 1 28 LYS N 1 1 28 LYS CA 1 1 28 LYS C -146.84 -108.18 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 18 . 1 1 28 LYS C 1 1 29 TYR N 1 1 29 TYR CA 1 1 29 TYR C -132.48 -80.68 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 19 . 1 1 29 TYR C 1 1 30 ALA N 1 1 30 ALA CA 1 1 30 ALA C -131.4 -107.34 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 20 . 1 1 30 ALA C 1 1 31 CYS N 1 1 31 CYS CA 1 1 31 CYS C -136.04 -111.4 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 21 . 1 1 31 CYS C 1 1 32 ASN N 1 1 32 ASN CA 1 1 32 ASN C -120.62001 -86.46 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 22 . 1 1 32 ASN C 1 1 33 CYS N 1 1 33 CYS CA 1 1 33 CYS C -136.17 -109.41 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 23 . 1 1 33 CYS C 1 1 34 VAL N 1 1 34 VAL CA 1 1 34 VAL C -113.07999 -62.199997 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 24 . 1 1 34 VAL C 1 1 35 VAL N 1 1 35 VAL CA 1 1 35 VAL C -104.05 -67.13 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 25 . 1 1 36 GLY C 1 1 37 TYR N 1 1 37 TYR CA 1 1 37 TYR C -132.91 -88.49 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 26 . 1 1 37 TYR C 1 1 38 ILE N 1 1 38 ILE CA 1 1 38 ILE C -150.83 -119.15 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 27 . 1 1 38 ILE C 1 1 39 GLY N 1 1 39 GLY CA 1 1 39 GLY C -132.02 -72.06 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 28 . 1 1 39 GLY C 1 1 40 GLU N 1 1 40 GLU CA 1 1 40 GLU C -79.38 -61.14 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 29 . 1 1 40 GLU C 1 1 41 ARG N 1 1 41 ARG CA 1 1 41 ARG C -116.62 -83.96 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 30 . 1 1 41 ARG C 1 1 42 CYS N 1 1 42 CYS CA 1 1 42 CYS C -148.07 -111.81 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 31 . 1 1 42 CYS C 1 1 43 GLN N 1 1 43 GLN CA 1 1 43 GLN C -96.74 -68.62 . 42 . C . 43 . N . 43 . CA . 43 . C 1 1 32 . 1 1 43 GLN C 1 1 44 TYR N 1 1 44 TYR CA 1 1 44 TYR C -125.56 -75.36 . 43 . C . 44 . N . 44 . CA . 44 . C 1 1 33 . 1 1 44 TYR C 1 1 45 ARG N 1 1 45 ARG CA 1 1 45 ARG C -125.23 -73.02999 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1 34 . 1 1 45 ARG C 1 1 46 ASP N 1 1 46 ASP CA 1 1 46 ASP C -97.55 -58.469997 . 45 . C . 46 . N . 46 . CA . 46 . C 1 1 35 . 1 1 46 ASP C 1 1 47 LEU N 1 1 47 LEU CA 1 1 47 LEU C -64.83 -55.11 . 46 . C . 47 . N . 47 . CA . 47 . C 1 1 36 . 1 1 47 LEU C 1 1 48 LYS N 1 1 48 LYS CA 1 1 48 LYS C -76.69 -53.87 . 47 . C . 48 . N . 48 . CA . 48 . C 1 1 37 . 1 1 48 LYS C 1 1 49 TRP N 1 1 49 TRP CA 1 1 49 TRP C -66.42 -55.72 . 48 . C . 49 . N . 49 . CA . 49 . C 1 1 38 . 1 1 49 TRP C 1 1 50 TRP N 1 1 50 TRP CA 1 1 50 TRP C -81.76 -57.599995 . 49 . C . 50 . N . 50 . CA . 50 . C 1 1 39 . 1 1 50 TRP C 1 1 51 GLU N 1 1 51 GLU CA 1 1 51 GLU C -79.46 -59.639996 . 50 . C . 51 . N . 51 . CA . 51 . C 1 1 40 . 1 1 2 SER N 1 1 2 SER CA 1 1 2 SER C 1 1 3 ASP N 121.62 157.5 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1 41 . 1 1 7 PRO N 1 1 7 PRO CA 1 1 7 PRO C 1 1 8 LEU N 136.05 150.55 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 42 . 1 1 8 LEU N 1 1 8 LEU CA 1 1 8 LEU C 1 1 9 SER N -38.67 -21.01 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 43 . 1 1 9 SER N 1 1 9 SER CA 1 1 9 SER C 1 1 10 HIS N -40.13 -5.3499994 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 44 . 1 1 11 ASP N 1 1 11 ASP CA 1 1 11 ASP C 1 1 12 GLY N 126.45 138.41 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1 45 . 1 1 14 CYS N 1 1 14 CYS CA 1 1 14 CYS C 1 1 15 LEU N 128.09 155.03 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1 46 . 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C 1 1 16 HIS N 103.11 160.89 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1 47 . 1 1 17 ASP N 1 1 17 ASP CA 1 1 17 ASP C 1 1 18 GLY N -30.259998 8.4 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 48 . 1 1 19 VAL N 1 1 19 VAL CA 1 1 19 VAL C 1 1 20 CYS N 115.72 133.96 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 49 . 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS C 1 1 21 MET N 116.52999 127.87001 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 50 . 1 1 21 MET N 1 1 21 MET CA 1 1 21 MET C 1 1 22 TYR N 114.17 140.07 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 51 . 1 1 22 TYR N 1 1 22 TYR CA 1 1 22 TYR C 1 1 23 ILE N 112.09 129.77 . 22 . N . 22 . CA . 22 . C . 23 . N 1 1 52 . 1 1 23 ILE N 1 1 23 ILE CA 1 1 23 ILE C 1 1 24 GLU N 90.8 131.36 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 53 . 1 1 24 GLU N 1 1 24 GLU CA 1 1 24 GLU C 1 1 25 ALA N -45.28 -20.38 . 24 . N . 24 . CA . 24 . C . 25 . N 1 1 54 . 1 1 25 ALA N 1 1 25 ALA CA 1 1 25 ALA C 1 1 26 LEU N -38.62 -10.54 . 25 . N . 25 . CA . 25 . C . 26 . N 1 1 55 . 1 1 26 LEU N 1 1 26 LEU CA 1 1 26 LEU C 1 1 27 ASP N -18.19 13.129999 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 56 . 1 1 28 LYS N 1 1 28 LYS CA 1 1 28 LYS C 1 1 29 TYR N 127.69 163.49 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 57 . 1 1 29 TYR N 1 1 29 TYR CA 1 1 29 TYR C 1 1 30 ALA N 114.29 135.97 . 29 . N . 29 . CA . 29 . C . 30 . N 1 1 58 . 1 1 30 ALA N 1 1 30 ALA CA 1 1 30 ALA C 1 1 31 CYS N 131.61 153.49 . 30 . N . 30 . CA . 30 . C . 31 . N 1 1 59 . 1 1 31 CYS N 1 1 31 CYS CA 1 1 31 CYS C 1 1 32 ASN N 119.38 138.54 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 60 . 1 1 32 ASN N 1 1 32 ASN CA 1 1 32 ASN C 1 1 33 CYS N 113.45 129.67 . 32 . N . 32 . CA . 32 . C . 33 . N 1 1 61 . 1 1 33 CYS N 1 1 33 CYS CA 1 1 33 CYS C 1 1 34 VAL N 120.71 146.23 . 33 . N . 33 . CA . 33 . C . 34 . N 1 1 62 . 1 1 34 VAL N 1 1 34 VAL CA 1 1 34 VAL C 1 1 35 VAL N 128.28 146.37999 . 34 . N . 34 . CA . 34 . C . 35 . N 1 1 63 . 1 1 35 VAL N 1 1 35 VAL CA 1 1 35 VAL C 1 1 36 GLY N 112.2 139.08 . 35 . N . 35 . CA . 35 . C . 36 . N 1 1 64 . 1 1 37 TYR N 1 1 37 TYR CA 1 1 37 TYR C 1 1 38 ILE N 128.2 146.24 . 37 . N . 37 . CA . 37 . C . 38 . N 1 1 65 . 1 1 38 ILE N 1 1 38 ILE CA 1 1 38 ILE C 1 1 39 GLY N 140.68 166.98 . 38 . N . 38 . CA . 38 . C . 39 . N 1 1 66 . 1 1 39 GLY N 1 1 39 GLY CA 1 1 39 GLY C 1 1 40 GLU N 108.96 141.62 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 67 . 1 1 40 GLU N 1 1 40 GLU CA 1 1 40 GLU C 1 1 41 ARG N -32.88 -14.2 . 40 . N . 40 . CA . 40 . C . 41 . N 1 1 68 . 1 1 41 ARG N 1 1 41 ARG CA 1 1 41 ARG C 1 1 42 CYS N -41.34 17.58 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 69 . 1 1 42 CYS N 1 1 42 CYS CA 1 1 42 CYS C 1 1 43 GLN N 150.03 173.15 . 42 . N . 42 . CA . 42 . C . 43 . N 1 1 70 . 1 1 43 GLN N 1 1 43 GLN CA 1 1 43 GLN C 1 1 44 TYR N 121.98 148.22 . 43 . N . 43 . CA . 43 . C . 44 . N 1 1 71 . 1 1 44 TYR N 1 1 44 TYR CA 1 1 44 TYR C 1 1 45 ARG N 116.28999 150.43 . 44 . N . 44 . CA . 44 . C . 45 . N 1 1 72 . 1 1 45 ARG N 1 1 45 ARG CA 1 1 45 ARG C 1 1 46 ASP N 111.84 138.02 . 45 . N . 45 . CA . 45 . C . 46 . N 1 1 73 . 1 1 46 ASP N 1 1 46 ASP CA 1 1 46 ASP C 1 1 47 LEU N 95.48 135.64 . 46 . N . 46 . CA . 46 . C . 47 . N 1 1 74 . 1 1 47 LEU N 1 1 47 LEU CA 1 1 47 LEU C 1 1 48 LYS N -44.049995 -23.79 . 47 . N . 47 . CA . 47 . C . 48 . N 1 1 75 . 1 1 48 LYS N 1 1 48 LYS CA 1 1 48 LYS C 1 1 49 TRP N -53.54 -10.54 . 48 . N . 48 . CA . 48 . C . 49 . N 1 1 76 . 1 1 49 TRP N 1 1 49 TRP CA 1 1 49 TRP C 1 1 50 TRP N -48.8 -36.3 . 49 . N . 49 . CA . 49 . C . 50 . N 1 1 77 . 1 1 50 TRP N 1 1 50 TRP CA 1 1 50 TRP C 1 1 51 GLU N -43.51 -24.67 . 50 . N . 50 . CA . 50 . C . 51 . N 1 1 78 . 1 1 51 GLU N 1 1 51 GLU CA 1 1 51 GLU C 1 1 52 LEU N -47.19 -26.33 . 51 . N . 51 . CA . 51 . C . 52 . N 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ASN C C 13.690 -6.954 6.663 1.00 . A A . 1 ASN C 1 1 1 2 1 1 1 ASN CA C 14.797 -7.813 6.068 1.00 . A A . 1 ASN CA 1 1 1 3 1 1 1 ASN CB C 15.520 -7.005 4.984 1.00 . A A . 1 ASN CB 1 1 1 4 1 1 1 ASN CG C 16.662 -7.760 4.325 1.00 . A A . 1 ASN CG 1 1 1 5 1 1 1 ASN H1 H 13.519 -8.867 4.793 1.00 . A A . 1 ASN H1 1 1 1 6 1 1 1 ASN H2 H 13.811 -9.635 6.281 1.00 . A A . 1 ASN H2 1 1 1 7 1 1 1 ASN H3 H 15.007 -9.634 5.081 1.00 . A A . 1 ASN H3 1 1 1 8 1 1 1 ASN HA H 15.500 -8.064 6.849 1.00 . A A . 1 ASN HA 1 1 1 9 1 1 1 ASN HB2 H 14.808 -6.735 4.219 1.00 . A A . 1 ASN HB2 1 1 1 10 1 1 1 ASN HB3 H 15.918 -6.103 5.427 1.00 . A A . 1 ASN HB3 1 1 1 11 1 1 1 ASN HD21 H 17.662 -6.067 4.037 1.00 . A A . 1 ASN HD21 1 1 1 12 1 1 1 ASN HD22 H 18.436 -7.502 3.460 1.00 . A A . 1 ASN HD22 1 1 1 13 1 1 1 ASN N N 14.245 -9.075 5.517 1.00 . A A . 1 ASN N 1 1 1 14 1 1 1 ASN ND2 N 17.689 -7.038 3.903 1.00 . A A . 1 ASN ND2 1 1 1 15 1 1 1 ASN O O 13.944 -6.153 7.563 1.00 . A A . 1 ASN O 1 1 1 16 1 1 1 ASN OD1 O 16.620 -8.983 4.192 1.00 . A A . 1 ASN OD1 1 1 1 17 1 1 2 SER C C 11.604 -4.852 6.343 1.00 . A A . 2 SER C 1 1 1 18 1 1 2 SER CA C 11.302 -6.329 6.532 1.00 . A A . 2 SER CA 1 1 1 19 1 1 2 SER CB C 10.833 -6.652 7.968 1.00 . A A . 2 SER CB 1 1 1 20 1 1 2 SER H H 12.363 -7.739 5.377 1.00 . A A . 2 SER H 1 1 1 21 1 1 2 SER HA H 10.506 -6.587 5.847 1.00 . A A . 2 SER HA 1 1 1 22 1 1 2 SER HB2 H 9.981 -6.036 8.207 1.00 . A A . 2 SER HB2 1 1 1 23 1 1 2 SER HB3 H 10.539 -7.691 8.014 1.00 . A A . 2 SER HB3 1 1 1 24 1 1 2 SER HG H 12.683 -6.271 8.501 1.00 . A A . 2 SER HG 1 1 1 25 1 1 2 SER N N 12.469 -7.113 6.130 1.00 . A A . 2 SER N 1 1 1 26 1 1 2 SER O O 11.443 -4.031 7.248 1.00 . A A . 2 SER O 1 1 1 27 1 1 2 SER OG O 11.835 -6.422 8.943 1.00 . A A . 2 SER OG 1 1 1 28 1 1 3 ASP C C 11.318 -2.347 4.396 1.00 . A A . 3 ASP C 1 1 1 29 1 1 3 ASP CA C 12.506 -3.202 4.804 1.00 . A A . 3 ASP CA 1 1 1 30 1 1 3 ASP CB C 13.545 -3.266 3.679 1.00 . A A . 3 ASP CB 1 1 1 31 1 1 3 ASP CG C 14.272 -1.954 3.464 1.00 . A A . 3 ASP CG 1 1 1 32 1 1 3 ASP H H 12.096 -5.245 4.431 1.00 . A A . 3 ASP H 1 1 1 33 1 1 3 ASP HA H 12.961 -2.775 5.685 1.00 . A A . 3 ASP HA 1 1 1 34 1 1 3 ASP HB2 H 14.276 -4.023 3.916 1.00 . A A . 3 ASP HB2 1 1 1 35 1 1 3 ASP HB3 H 13.047 -3.533 2.758 1.00 . A A . 3 ASP HB3 1 1 1 36 1 1 3 ASP N N 12.061 -4.540 5.136 1.00 . A A . 3 ASP N 1 1 1 37 1 1 3 ASP O O 10.728 -2.540 3.332 1.00 . A A . 3 ASP O 1 1 1 38 1 1 3 ASP OD1 O 14.321 -1.129 4.401 1.00 . A A . 3 ASP OD1 1 1 1 39 1 1 3 ASP OD2 O 14.830 -1.753 2.364 1.00 . A A . 3 ASP OD2 1 1 1 40 1 1 4 SER C C 10.230 0.876 5.432 1.00 . A A . 4 SER C 1 1 1 41 1 1 4 SER CA C 9.831 -0.535 5.025 1.00 . A A . 4 SER CA 1 1 1 42 1 1 4 SER CB C 8.600 -0.979 5.821 1.00 . A A . 4 SER CB 1 1 1 43 1 1 4 SER H H 11.403 -1.390 6.143 1.00 . A A . 4 SER H 1 1 1 44 1 1 4 SER HA H 9.603 -0.553 3.969 1.00 . A A . 4 SER HA 1 1 1 45 1 1 4 SER HB2 H 8.786 -0.838 6.875 1.00 . A A . 4 SER HB2 1 1 1 46 1 1 4 SER HB3 H 7.748 -0.388 5.523 1.00 . A A . 4 SER HB3 1 1 1 47 1 1 4 SER HG H 9.001 -2.720 5.026 1.00 . A A . 4 SER HG 1 1 1 48 1 1 4 SER N N 10.933 -1.443 5.278 1.00 . A A . 4 SER N 1 1 1 49 1 1 4 SER O O 9.391 1.688 5.836 1.00 . A A . 4 SER O 1 1 1 50 1 1 4 SER OG O 8.312 -2.347 5.589 1.00 . A A . 4 SER OG 1 1 1 51 1 1 5 GLU C C 12.169 3.447 4.698 1.00 . A A . 5 GLU C 1 1 1 52 1 1 5 GLU CA C 12.042 2.423 5.820 1.00 . A A . 5 GLU CA 1 1 1 53 1 1 5 GLU CB C 13.399 2.228 6.505 1.00 . A A . 5 GLU CB 1 1 1 54 1 1 5 GLU CD C 15.228 3.312 7.887 1.00 . A A . 5 GLU CD 1 1 1 55 1 1 5 GLU CG C 13.829 3.434 7.322 1.00 . A A . 5 GLU CG 1 1 1 56 1 1 5 GLU H H 12.130 0.508 4.931 1.00 . A A . 5 GLU H 1 1 1 57 1 1 5 GLU HA H 11.343 2.804 6.548 1.00 . A A . 5 GLU HA 1 1 1 58 1 1 5 GLU HB2 H 13.341 1.372 7.164 1.00 . A A . 5 GLU HB2 1 1 1 59 1 1 5 GLU HB3 H 14.150 2.042 5.751 1.00 . A A . 5 GLU HB3 1 1 1 60 1 1 5 GLU HG2 H 13.792 4.308 6.690 1.00 . A A . 5 GLU HG2 1 1 1 61 1 1 5 GLU HG3 H 13.138 3.558 8.143 1.00 . A A . 5 GLU HG3 1 1 1 62 1 1 5 GLU N N 11.521 1.160 5.337 1.00 . A A . 5 GLU N 1 1 1 63 1 1 5 GLU O O 13.218 3.573 4.068 1.00 . A A . 5 GLU O 1 1 1 64 1 1 5 GLU OE1 O 15.464 2.424 8.733 1.00 . A A . 5 GLU OE1 1 1 1 65 1 1 5 GLU OE2 O 16.095 4.125 7.507 1.00 . A A . 5 GLU OE2 1 1 1 66 1 1 6 CYS C C 10.243 6.413 4.212 1.00 . A A . 6 CYS C 1 1 1 67 1 1 6 CYS CA C 11.143 5.338 3.594 1.00 . A A . 6 CYS CA 1 1 1 68 1 1 6 CYS CB C 10.769 5.007 2.129 1.00 . A A . 6 CYS CB 1 1 1 69 1 1 6 CYS H H 10.226 3.879 4.817 1.00 . A A . 6 CYS H 1 1 1 70 1 1 6 CYS HA H 12.163 5.699 3.620 1.00 . A A . 6 CYS HA 1 1 1 71 1 1 6 CYS HB2 H 11.063 5.835 1.504 1.00 . A A . 6 CYS HB2 1 1 1 72 1 1 6 CYS HB3 H 11.321 4.128 1.823 1.00 . A A . 6 CYS HB3 1 1 1 73 1 1 6 CYS N N 11.086 4.157 4.437 1.00 . A A . 6 CYS N 1 1 1 74 1 1 6 CYS O O 9.166 6.702 3.710 1.00 . A A . 6 CYS O 1 1 1 75 1 1 6 CYS SG S 8.999 4.688 1.787 1.00 . A A . 6 CYS SG 1 1 1 76 1 1 7 PRO C C 8.780 8.658 5.573 1.00 . A A . 7 PRO C 1 1 1 77 1 1 7 PRO CA C 9.903 7.853 6.234 1.00 . A A . 7 PRO CA 1 1 1 78 1 1 7 PRO CB C 10.942 8.790 6.836 1.00 . A A . 7 PRO CB 1 1 1 79 1 1 7 PRO CD C 12.113 6.959 5.784 1.00 . A A . 7 PRO CD 1 1 1 80 1 1 7 PRO CG C 12.190 7.980 6.897 1.00 . A A . 7 PRO CG 1 1 1 81 1 1 7 PRO HA H 9.479 7.252 7.021 1.00 . A A . 7 PRO HA 1 1 1 82 1 1 7 PRO HB2 H 11.060 9.654 6.200 1.00 . A A . 7 PRO HB2 1 1 1 83 1 1 7 PRO HB3 H 10.622 9.098 7.819 1.00 . A A . 7 PRO HB3 1 1 1 84 1 1 7 PRO HD2 H 12.790 7.223 4.985 1.00 . A A . 7 PRO HD2 1 1 1 85 1 1 7 PRO HD3 H 12.347 5.975 6.164 1.00 . A A . 7 PRO HD3 1 1 1 86 1 1 7 PRO HG2 H 13.049 8.621 6.754 1.00 . A A . 7 PRO HG2 1 1 1 87 1 1 7 PRO HG3 H 12.254 7.482 7.853 1.00 . A A . 7 PRO HG3 1 1 1 88 1 1 7 PRO N N 10.711 7.021 5.323 1.00 . A A . 7 PRO N 1 1 1 89 1 1 7 PRO O O 7.681 8.154 5.363 1.00 . A A . 7 PRO O 1 1 1 90 1 1 8 LEU C C 7.717 10.509 3.261 1.00 . A A . 8 LEU C 1 1 1 91 1 1 8 LEU CA C 8.068 10.819 4.709 1.00 . A A . 8 LEU CA 1 1 1 92 1 1 8 LEU CB C 8.573 12.249 4.840 1.00 . A A . 8 LEU CB 1 1 1 93 1 1 8 LEU CD1 C 9.440 14.106 6.289 1.00 . A A . 8 LEU CD1 1 1 1 94 1 1 8 LEU CD2 C 7.676 12.568 7.163 1.00 . A A . 8 LEU CD2 1 1 1 95 1 1 8 LEU CG C 8.904 12.685 6.271 1.00 . A A . 8 LEU CG 1 1 1 96 1 1 8 LEU H H 10.009 10.198 5.280 1.00 . A A . 8 LEU H 1 1 1 97 1 1 8 LEU HA H 7.181 10.706 5.313 1.00 . A A . 8 LEU HA 1 1 1 98 1 1 8 LEU HB2 H 9.465 12.352 4.238 1.00 . A A . 8 LEU HB2 1 1 1 99 1 1 8 LEU HB3 H 7.819 12.906 4.448 1.00 . A A . 8 LEU HB3 1 1 1 100 1 1 8 LEU HD11 H 9.658 14.395 7.305 1.00 . A A . 8 LEU HD11 1 1 1 101 1 1 8 LEU HD12 H 10.344 14.157 5.698 1.00 . A A . 8 LEU HD12 1 1 1 102 1 1 8 LEU HD13 H 8.700 14.774 5.874 1.00 . A A . 8 LEU HD13 1 1 1 103 1 1 8 LEU HD21 H 7.336 11.542 7.175 1.00 . A A . 8 LEU HD21 1 1 1 104 1 1 8 LEU HD22 H 7.926 12.877 8.167 1.00 . A A . 8 LEU HD22 1 1 1 105 1 1 8 LEU HD23 H 6.889 13.201 6.777 1.00 . A A . 8 LEU HD23 1 1 1 106 1 1 8 LEU HG H 9.670 12.034 6.669 1.00 . A A . 8 LEU HG 1 1 1 107 1 1 8 LEU N N 9.076 9.893 5.214 1.00 . A A . 8 LEU N 1 1 1 108 1 1 8 LEU O O 6.870 11.154 2.648 1.00 . A A . 8 LEU O 1 1 1 109 1 1 9 SER C C 7.265 8.028 1.167 1.00 . A A . 9 SER C 1 1 1 110 1 1 9 SER CA C 8.269 9.157 1.340 1.00 . A A . 9 SER CA 1 1 1 111 1 1 9 SER CB C 9.633 8.740 0.791 1.00 . A A . 9 SER CB 1 1 1 112 1 1 9 SER H H 8.947 8.978 3.310 1.00 . A A . 9 SER H 1 1 1 113 1 1 9 SER HA H 7.922 10.024 0.798 1.00 . A A . 9 SER HA 1 1 1 114 1 1 9 SER HB2 H 9.951 7.828 1.276 1.00 . A A . 9 SER HB2 1 1 1 115 1 1 9 SER HB3 H 9.554 8.573 -0.273 1.00 . A A . 9 SER HB3 1 1 1 116 1 1 9 SER HG H 10.286 10.590 0.654 1.00 . A A . 9 SER HG 1 1 1 117 1 1 9 SER N N 8.388 9.516 2.731 1.00 . A A . 9 SER N 1 1 1 118 1 1 9 SER O O 6.665 7.887 0.109 1.00 . A A . 9 SER O 1 1 1 119 1 1 9 SER OG O 10.603 9.749 1.027 1.00 . A A . 9 SER OG 1 1 1 120 1 1 10 HIS C C 4.740 6.621 1.923 1.00 . A A . 10 HIS C 1 1 1 121 1 1 10 HIS CA C 6.146 6.103 2.135 1.00 . A A . 10 HIS CA 1 1 1 122 1 1 10 HIS CB C 6.253 5.201 3.394 1.00 . A A . 10 HIS CB 1 1 1 123 1 1 10 HIS CD2 C 4.539 4.869 5.318 1.00 . A A . 10 HIS CD2 1 1 1 124 1 1 10 HIS CE1 C 4.628 6.851 6.224 1.00 . A A . 10 HIS CE1 1 1 1 125 1 1 10 HIS CG C 5.425 5.595 4.599 1.00 . A A . 10 HIS CG 1 1 1 126 1 1 10 HIS H H 7.548 7.410 3.060 1.00 . A A . 10 HIS H 1 1 1 127 1 1 10 HIS HA H 6.425 5.524 1.262 1.00 . A A . 10 HIS HA 1 1 1 128 1 1 10 HIS HB2 H 5.959 4.199 3.122 1.00 . A A . 10 HIS HB2 1 1 1 129 1 1 10 HIS HB3 H 7.288 5.181 3.706 1.00 . A A . 10 HIS HB3 1 1 1 130 1 1 10 HIS HD1 H 6.029 7.595 4.933 1.00 . A A . 10 HIS HD1 1 1 1 131 1 1 10 HIS HD2 H 4.256 3.844 5.133 1.00 . A A . 10 HIS HD2 1 1 1 132 1 1 10 HIS HE1 H 4.451 7.694 6.876 1.00 . A A . 10 HIS HE1 1 1 1 133 1 1 10 HIS HE2 H 3.226 5.493 6.824 1.00 . A A . 10 HIS HE2 1 1 1 134 1 1 10 HIS N N 7.063 7.236 2.217 1.00 . A A . 10 HIS N 1 1 1 135 1 1 10 HIS ND1 N 5.458 6.836 5.199 1.00 . A A . 10 HIS ND1 1 1 1 136 1 1 10 HIS NE2 N 4.055 5.671 6.320 1.00 . A A . 10 HIS NE2 1 1 1 137 1 1 10 HIS O O 3.951 6.046 1.184 1.00 . A A . 10 HIS O 1 1 1 138 1 1 11 ASP C C 3.201 9.447 1.341 1.00 . A A . 11 ASP C 1 1 1 139 1 1 11 ASP CA C 3.196 8.411 2.451 1.00 . A A . 11 ASP CA 1 1 1 140 1 1 11 ASP CB C 2.919 9.057 3.797 1.00 . A A . 11 ASP CB 1 1 1 141 1 1 11 ASP CG C 3.932 10.130 4.145 1.00 . A A . 11 ASP CG 1 1 1 142 1 1 11 ASP H H 5.196 8.193 3.041 1.00 . A A . 11 ASP H 1 1 1 143 1 1 11 ASP HA H 2.443 7.664 2.247 1.00 . A A . 11 ASP HA 1 1 1 144 1 1 11 ASP HB2 H 1.931 9.493 3.797 1.00 . A A . 11 ASP HB2 1 1 1 145 1 1 11 ASP HB3 H 2.978 8.283 4.549 1.00 . A A . 11 ASP HB3 1 1 1 146 1 1 11 ASP N N 4.484 7.761 2.523 1.00 . A A . 11 ASP N 1 1 1 147 1 1 11 ASP O O 2.180 10.061 1.034 1.00 . A A . 11 ASP O 1 1 1 148 1 1 11 ASP OD1 O 4.986 9.777 4.716 1.00 . A A . 11 ASP OD1 1 1 1 149 1 1 11 ASP OD2 O 3.683 11.319 3.858 1.00 . A A . 11 ASP OD2 1 1 1 150 1 1 12 GLY C C 4.417 9.943 -1.673 1.00 . A A . 12 GLY C 1 1 1 151 1 1 12 GLY CA C 4.535 10.590 -0.317 1.00 . A A . 12 GLY CA 1 1 1 152 1 1 12 GLY H H 5.121 9.057 1.007 1.00 . A A . 12 GLY H 1 1 1 153 1 1 12 GLY HA2 H 3.773 11.351 -0.222 1.00 . A A . 12 GLY HA2 1 1 1 154 1 1 12 GLY HA3 H 5.508 11.050 -0.231 1.00 . A A . 12 GLY HA3 1 1 1 155 1 1 12 GLY N N 4.369 9.623 0.745 1.00 . A A . 12 GLY N 1 1 1 156 1 1 12 GLY O O 3.765 10.476 -2.569 1.00 . A A . 12 GLY O 1 1 1 157 1 1 13 TYR C C 3.536 7.647 -3.396 1.00 . A A . 13 TYR C 1 1 1 158 1 1 13 TYR CA C 4.977 7.997 -3.045 1.00 . A A . 13 TYR CA 1 1 1 159 1 1 13 TYR CB C 5.784 6.710 -2.917 1.00 . A A . 13 TYR CB 1 1 1 160 1 1 13 TYR CD1 C 7.711 6.847 -4.554 1.00 . A A . 13 TYR CD1 1 1 1 161 1 1 13 TYR CD2 C 8.206 6.925 -2.224 1.00 . A A . 13 TYR CD2 1 1 1 162 1 1 13 TYR CE1 C 9.061 6.945 -4.846 1.00 . A A . 13 TYR CE1 1 1 1 163 1 1 13 TYR CE2 C 9.555 7.018 -2.509 1.00 . A A . 13 TYR CE2 1 1 1 164 1 1 13 TYR CG C 7.260 6.837 -3.238 1.00 . A A . 13 TYR CG 1 1 1 165 1 1 13 TYR CZ C 9.979 7.029 -3.819 1.00 . A A . 13 TYR CZ 1 1 1 166 1 1 13 TYR H H 5.579 8.429 -1.054 1.00 . A A . 13 TYR H 1 1 1 167 1 1 13 TYR HA H 5.398 8.585 -3.831 1.00 . A A . 13 TYR HA 1 1 1 168 1 1 13 TYR HB2 H 5.704 6.370 -1.907 1.00 . A A . 13 TYR HB2 1 1 1 169 1 1 13 TYR HB3 H 5.363 5.964 -3.577 1.00 . A A . 13 TYR HB3 1 1 1 170 1 1 13 TYR HD1 H 6.991 6.783 -5.357 1.00 . A A . 13 TYR HD1 1 1 1 171 1 1 13 TYR HD2 H 7.875 6.917 -1.196 1.00 . A A . 13 TYR HD2 1 1 1 172 1 1 13 TYR HE1 H 9.392 6.952 -5.874 1.00 . A A . 13 TYR HE1 1 1 1 173 1 1 13 TYR HE2 H 10.272 7.086 -1.704 1.00 . A A . 13 TYR HE2 1 1 1 174 1 1 13 TYR HH H 11.469 7.792 -4.783 1.00 . A A . 13 TYR HH 1 1 1 175 1 1 13 TYR N N 5.046 8.777 -1.811 1.00 . A A . 13 TYR N 1 1 1 176 1 1 13 TYR O O 3.201 7.446 -4.566 1.00 . A A . 13 TYR O 1 1 1 177 1 1 13 TYR OH O 11.325 7.115 -4.100 1.00 . A A . 13 TYR OH 1 1 1 178 1 1 14 CYS C C 0.297 8.188 -2.101 1.00 . A A . 14 CYS C 1 1 1 179 1 1 14 CYS CA C 1.316 7.144 -2.567 1.00 . A A . 14 CYS CA 1 1 1 180 1 1 14 CYS CB C 1.121 5.807 -1.867 1.00 . A A . 14 CYS CB 1 1 1 181 1 1 14 CYS H H 2.986 7.857 -1.491 1.00 . A A . 14 CYS H 1 1 1 182 1 1 14 CYS HA H 1.175 6.992 -3.625 1.00 . A A . 14 CYS HA 1 1 1 183 1 1 14 CYS HB2 H 1.579 5.857 -0.885 1.00 . A A . 14 CYS HB2 1 1 1 184 1 1 14 CYS HB3 H 0.065 5.604 -1.764 1.00 . A A . 14 CYS HB3 1 1 1 185 1 1 14 CYS N N 2.687 7.587 -2.382 1.00 . A A . 14 CYS N 1 1 1 186 1 1 14 CYS O O 0.604 9.380 -2.076 1.00 . A A . 14 CYS O 1 1 1 187 1 1 14 CYS SG S 1.878 4.417 -2.774 1.00 . A A . 14 CYS SG 1 1 1 188 1 1 15 LEU C C -2.551 8.894 -0.221 1.00 . A A . 15 LEU C 1 1 1 189 1 1 15 LEU CA C -2.034 8.677 -1.639 1.00 . A A . 15 LEU CA 1 1 1 190 1 1 15 LEU CB C -3.183 8.183 -2.523 1.00 . A A . 15 LEU CB 1 1 1 191 1 1 15 LEU CD1 C -4.026 7.434 -4.755 1.00 . A A . 15 LEU CD1 1 1 1 192 1 1 15 LEU CD2 C -2.218 9.157 -4.622 1.00 . A A . 15 LEU CD2 1 1 1 193 1 1 15 LEU CG C -2.809 7.911 -3.978 1.00 . A A . 15 LEU CG 1 1 1 194 1 1 15 LEU H H -1.032 6.812 -1.483 1.00 . A A . 15 LEU H 1 1 1 195 1 1 15 LEU HA H -1.702 9.625 -2.022 1.00 . A A . 15 LEU HA 1 1 1 196 1 1 15 LEU HB2 H -3.570 7.267 -2.096 1.00 . A A . 15 LEU HB2 1 1 1 197 1 1 15 LEU HB3 H -3.966 8.926 -2.508 1.00 . A A . 15 LEU HB3 1 1 1 198 1 1 15 LEU HD11 H -4.396 6.519 -4.315 1.00 . A A . 15 LEU HD11 1 1 1 199 1 1 15 LEU HD12 H -4.796 8.189 -4.717 1.00 . A A . 15 LEU HD12 1 1 1 200 1 1 15 LEU HD13 H -3.750 7.252 -5.784 1.00 . A A . 15 LEU HD13 1 1 1 201 1 1 15 LEU HD21 H -1.339 9.464 -4.073 1.00 . A A . 15 LEU HD21 1 1 1 202 1 1 15 LEU HD22 H -1.945 8.939 -5.644 1.00 . A A . 15 LEU HD22 1 1 1 203 1 1 15 LEU HD23 H -2.947 9.953 -4.606 1.00 . A A . 15 LEU HD23 1 1 1 204 1 1 15 LEU HG H -2.064 7.128 -4.007 1.00 . A A . 15 LEU HG 1 1 1 205 1 1 15 LEU N N -0.906 7.753 -1.726 1.00 . A A . 15 LEU N 1 1 1 206 1 1 15 LEU O O -2.144 9.830 0.462 1.00 . A A . 15 LEU O 1 1 1 207 1 1 16 HIS C C -3.781 7.522 2.611 1.00 . A A . 16 HIS C 1 1 1 208 1 1 16 HIS CA C -4.258 8.279 1.397 1.00 . A A . 16 HIS CA 1 1 1 209 1 1 16 HIS CB C -5.729 7.981 1.107 1.00 . A A . 16 HIS CB 1 1 1 210 1 1 16 HIS CD2 C -6.330 9.579 -0.852 1.00 . A A . 16 HIS CD2 1 1 1 211 1 1 16 HIS CE1 C -7.800 10.814 0.191 1.00 . A A . 16 HIS CE1 1 1 1 212 1 1 16 HIS CG C -6.433 9.108 0.414 1.00 . A A . 16 HIS CG 1 1 1 213 1 1 16 HIS H H -3.470 7.122 -0.204 1.00 . A A . 16 HIS H 1 1 1 214 1 1 16 HIS HA H -4.162 9.327 1.611 1.00 . A A . 16 HIS HA 1 1 1 215 1 1 16 HIS HB2 H -5.797 7.107 0.476 1.00 . A A . 16 HIS HB2 1 1 1 216 1 1 16 HIS HB3 H -6.243 7.791 2.038 1.00 . A A . 16 HIS HB3 1 1 1 217 1 1 16 HIS HD1 H -7.653 9.824 1.976 1.00 . A A . 16 HIS HD1 1 1 1 218 1 1 16 HIS HD2 H -5.689 9.188 -1.630 1.00 . A A . 16 HIS HD2 1 1 1 219 1 1 16 HIS HE1 H -8.534 11.578 0.409 1.00 . A A . 16 HIS HE1 1 1 1 220 1 1 16 HIS HE2 H -7.138 11.333 -1.673 1.00 . A A . 16 HIS HE2 1 1 1 221 1 1 16 HIS N N -3.424 8.002 0.227 1.00 . A A . 16 HIS N 1 1 1 222 1 1 16 HIS ND1 N -7.361 9.906 1.037 1.00 . A A . 16 HIS ND1 1 1 1 223 1 1 16 HIS NE2 N -7.191 10.641 -0.967 1.00 . A A . 16 HIS NE2 1 1 1 224 1 1 16 HIS O O -4.569 7.115 3.460 1.00 . A A . 16 HIS O 1 1 1 225 1 1 17 ASP C C -0.341 6.529 3.346 1.00 . A A . 17 ASP C 1 1 1 226 1 1 17 ASP CA C -1.753 6.817 3.789 1.00 . A A . 17 ASP CA 1 1 1 227 1 1 17 ASP CB C -2.378 5.545 4.364 1.00 . A A . 17 ASP CB 1 1 1 228 1 1 17 ASP CG C -1.829 5.207 5.740 1.00 . A A . 17 ASP CG 1 1 1 229 1 1 17 ASP H H -1.961 7.582 1.851 1.00 . A A . 17 ASP H 1 1 1 230 1 1 17 ASP HA H -1.731 7.585 4.543 1.00 . A A . 17 ASP HA 1 1 1 231 1 1 17 ASP HB2 H -3.447 5.686 4.448 1.00 . A A . 17 ASP HB2 1 1 1 232 1 1 17 ASP HB3 H -2.178 4.717 3.699 1.00 . A A . 17 ASP HB3 1 1 1 233 1 1 17 ASP N N -2.476 7.338 2.644 1.00 . A A . 17 ASP N 1 1 1 234 1 1 17 ASP O O 0.612 7.038 3.927 1.00 . A A . 17 ASP O 1 1 1 235 1 1 17 ASP OD1 O -0.736 4.609 5.828 1.00 . A A . 17 ASP OD1 1 1 1 236 1 1 17 ASP OD2 O -2.489 5.555 6.746 1.00 . A A . 17 ASP OD2 1 1 1 237 1 1 18 GLY C C 1.944 4.608 2.660 1.00 . A A . 18 GLY C 1 1 1 238 1 1 18 GLY CA C 1.061 5.403 1.702 1.00 . A A . 18 GLY CA 1 1 1 239 1 1 18 GLY H H -1.054 5.513 1.773 1.00 . A A . 18 GLY H 1 1 1 240 1 1 18 GLY HA2 H 0.894 4.803 0.819 1.00 . A A . 18 GLY HA2 1 1 1 241 1 1 18 GLY HA3 H 1.586 6.301 1.411 1.00 . A A . 18 GLY HA3 1 1 1 242 1 1 18 GLY N N -0.233 5.783 2.247 1.00 . A A . 18 GLY N 1 1 1 243 1 1 18 GLY O O 2.229 5.046 3.768 1.00 . A A . 18 GLY O 1 1 1 244 1 1 19 VAL C C 4.216 1.826 1.968 1.00 . A A . 19 VAL C 1 1 1 245 1 1 19 VAL CA C 3.332 2.598 2.951 1.00 . A A . 19 VAL CA 1 1 1 246 1 1 19 VAL CB C 2.589 1.580 3.860 1.00 . A A . 19 VAL CB 1 1 1 247 1 1 19 VAL CG1 C 3.571 0.612 4.505 1.00 . A A . 19 VAL CG1 1 1 1 248 1 1 19 VAL CG2 C 1.778 2.287 4.937 1.00 . A A . 19 VAL CG2 1 1 1 249 1 1 19 VAL H H 2.134 3.173 1.309 1.00 . A A . 19 VAL H 1 1 1 250 1 1 19 VAL HA H 3.954 3.230 3.567 1.00 . A A . 19 VAL HA 1 1 1 251 1 1 19 VAL HB H 1.909 1.009 3.246 1.00 . A A . 19 VAL HB 1 1 1 252 1 1 19 VAL HG11 H 3.029 -0.096 5.114 1.00 . A A . 19 VAL HG11 1 1 1 253 1 1 19 VAL HG12 H 4.114 0.085 3.735 1.00 . A A . 19 VAL HG12 1 1 1 254 1 1 19 VAL HG13 H 4.265 1.161 5.123 1.00 . A A . 19 VAL HG13 1 1 1 255 1 1 19 VAL HG21 H 1.031 2.913 4.472 1.00 . A A . 19 VAL HG21 1 1 1 256 1 1 19 VAL HG22 H 1.294 1.552 5.563 1.00 . A A . 19 VAL HG22 1 1 1 257 1 1 19 VAL HG23 H 2.433 2.898 5.540 1.00 . A A . 19 VAL HG23 1 1 1 258 1 1 19 VAL N N 2.407 3.454 2.198 1.00 . A A . 19 VAL N 1 1 1 259 1 1 19 VAL O O 3.699 1.206 1.041 1.00 . A A . 19 VAL O 1 1 1 260 1 1 20 CYS C C 7.029 -0.063 1.863 1.00 . A A . 20 CYS C 1 1 1 261 1 1 20 CYS CA C 6.458 1.205 1.241 1.00 . A A . 20 CYS CA 1 1 1 262 1 1 20 CYS CB C 7.592 2.164 0.831 1.00 . A A . 20 CYS CB 1 1 1 263 1 1 20 CYS H H 5.891 2.290 2.966 1.00 . A A . 20 CYS H 1 1 1 264 1 1 20 CYS HA H 5.898 0.931 0.360 1.00 . A A . 20 CYS HA 1 1 1 265 1 1 20 CYS HB2 H 8.215 1.675 0.101 1.00 . A A . 20 CYS HB2 1 1 1 266 1 1 20 CYS HB3 H 7.154 3.046 0.384 1.00 . A A . 20 CYS HB3 1 1 1 267 1 1 20 CYS N N 5.534 1.854 2.167 1.00 . A A . 20 CYS N 1 1 1 268 1 1 20 CYS O O 7.798 -0.001 2.817 1.00 . A A . 20 CYS O 1 1 1 269 1 1 20 CYS SG S 8.684 2.723 2.194 1.00 . A A . 20 CYS SG 1 1 1 270 1 1 21 MET C C 6.987 -3.648 0.940 1.00 . A A . 21 MET C 1 1 1 271 1 1 21 MET CA C 7.082 -2.480 1.925 1.00 . A A . 21 MET CA 1 1 1 272 1 1 21 MET CB C 6.264 -2.780 3.189 1.00 . A A . 21 MET CB 1 1 1 273 1 1 21 MET CE C 4.296 -4.994 4.487 1.00 . A A . 21 MET CE 1 1 1 274 1 1 21 MET CG C 4.757 -2.720 2.984 1.00 . A A . 21 MET CG 1 1 1 275 1 1 21 MET H H 6.020 -1.229 0.578 1.00 . A A . 21 MET H 1 1 1 276 1 1 21 MET HA H 8.117 -2.357 2.208 1.00 . A A . 21 MET HA 1 1 1 277 1 1 21 MET HB2 H 6.518 -3.762 3.541 1.00 . A A . 21 MET HB2 1 1 1 278 1 1 21 MET HB3 H 6.527 -2.061 3.951 1.00 . A A . 21 MET HB3 1 1 1 279 1 1 21 MET HE1 H 3.801 -5.476 5.320 1.00 . A A . 21 MET HE1 1 1 1 280 1 1 21 MET HE2 H 4.002 -5.474 3.566 1.00 . A A . 21 MET HE2 1 1 1 281 1 1 21 MET HE3 H 5.366 -5.079 4.610 1.00 . A A . 21 MET HE3 1 1 1 282 1 1 21 MET HG2 H 4.477 -1.702 2.756 1.00 . A A . 21 MET HG2 1 1 1 283 1 1 21 MET HG3 H 4.498 -3.357 2.150 1.00 . A A . 21 MET HG3 1 1 1 284 1 1 21 MET N N 6.635 -1.221 1.344 1.00 . A A . 21 MET N 1 1 1 285 1 1 21 MET O O 5.894 -4.124 0.639 1.00 . A A . 21 MET O 1 1 1 286 1 1 21 MET SD S 3.835 -3.265 4.435 1.00 . A A . 21 MET SD 1 1 1 287 1 1 22 TYR C C 9.673 -5.526 -0.859 1.00 . A A . 22 TYR C 1 1 1 288 1 1 22 TYR CA C 8.243 -5.316 -0.360 1.00 . A A . 22 TYR CA 1 1 1 289 1 1 22 TYR CB C 7.261 -5.314 -1.534 1.00 . A A . 22 TYR CB 1 1 1 290 1 1 22 TYR CD1 C 7.188 -7.841 -1.361 1.00 . A A . 22 TYR CD1 1 1 1 291 1 1 22 TYR CD2 C 6.444 -6.827 -3.386 1.00 . A A . 22 TYR CD2 1 1 1 292 1 1 22 TYR CE1 C 6.917 -9.092 -1.884 1.00 . A A . 22 TYR CE1 1 1 1 293 1 1 22 TYR CE2 C 6.169 -8.075 -3.914 1.00 . A A . 22 TYR CE2 1 1 1 294 1 1 22 TYR CG C 6.960 -6.688 -2.104 1.00 . A A . 22 TYR CG 1 1 1 295 1 1 22 TYR CZ C 6.409 -9.203 -3.159 1.00 . A A . 22 TYR CZ 1 1 1 296 1 1 22 TYR H H 8.950 -3.576 0.596 1.00 . A A . 22 TYR H 1 1 1 297 1 1 22 TYR HA H 8.001 -6.124 0.285 1.00 . A A . 22 TYR HA 1 1 1 298 1 1 22 TYR HB2 H 6.329 -4.880 -1.210 1.00 . A A . 22 TYR HB2 1 1 1 299 1 1 22 TYR HB3 H 7.677 -4.713 -2.320 1.00 . A A . 22 TYR HB3 1 1 1 300 1 1 22 TYR HD1 H 7.591 -7.752 -0.362 1.00 . A A . 22 TYR HD1 1 1 1 301 1 1 22 TYR HD2 H 6.257 -5.942 -3.976 1.00 . A A . 22 TYR HD2 1 1 1 302 1 1 22 TYR HE1 H 7.101 -9.976 -1.290 1.00 . A A . 22 TYR HE1 1 1 1 303 1 1 22 TYR HE2 H 5.770 -8.162 -4.914 1.00 . A A . 22 TYR HE2 1 1 1 304 1 1 22 TYR HH H 5.709 -10.994 -3.017 1.00 . A A . 22 TYR HH 1 1 1 305 1 1 22 TYR N N 8.142 -4.086 0.430 1.00 . A A . 22 TYR N 1 1 1 306 1 1 22 TYR O O 10.102 -6.662 -1.030 1.00 . A A . 22 TYR O 1 1 1 307 1 1 22 TYR OH O 6.143 -10.446 -3.687 1.00 . A A . 22 TYR OH 1 1 1 308 1 1 23 ILE C C 12.583 -5.583 -1.143 1.00 . A A . 23 ILE C 1 1 1 309 1 1 23 ILE CA C 11.780 -4.357 -1.534 1.00 . A A . 23 ILE CA 1 1 1 310 1 1 23 ILE CB C 12.465 -3.079 -0.986 1.00 . A A . 23 ILE CB 1 1 1 311 1 1 23 ILE CD1 C 12.221 -1.263 0.796 1.00 . A A . 23 ILE CD1 1 1 1 312 1 1 23 ILE CG1 C 11.734 -2.599 0.277 1.00 . A A . 23 ILE CG1 1 1 1 313 1 1 23 ILE CG2 C 12.503 -1.987 -2.044 1.00 . A A . 23 ILE CG2 1 1 1 314 1 1 23 ILE H H 9.901 -3.564 -1.011 1.00 . A A . 23 ILE H 1 1 1 315 1 1 23 ILE HA H 11.789 -4.288 -2.600 1.00 . A A . 23 ILE HA 1 1 1 316 1 1 23 ILE HB H 13.484 -3.321 -0.735 1.00 . A A . 23 ILE HB 1 1 1 317 1 1 23 ILE HD11 H 13.274 -1.330 1.029 1.00 . A A . 23 ILE HD11 1 1 1 318 1 1 23 ILE HD12 H 12.067 -0.505 0.043 1.00 . A A . 23 ILE HD12 1 1 1 319 1 1 23 ILE HD13 H 11.671 -1.001 1.688 1.00 . A A . 23 ILE HD13 1 1 1 320 1 1 23 ILE HG12 H 10.681 -2.499 0.053 1.00 . A A . 23 ILE HG12 1 1 1 321 1 1 23 ILE HG13 H 11.860 -3.337 1.063 1.00 . A A . 23 ILE HG13 1 1 1 322 1 1 23 ILE HG21 H 11.496 -1.747 -2.352 1.00 . A A . 23 ILE HG21 1 1 1 323 1 1 23 ILE HG22 H 12.975 -1.105 -1.637 1.00 . A A . 23 ILE HG22 1 1 1 324 1 1 23 ILE HG23 H 13.067 -2.335 -2.899 1.00 . A A . 23 ILE HG23 1 1 1 325 1 1 23 ILE N N 10.368 -4.407 -1.100 1.00 . A A . 23 ILE N 1 1 1 326 1 1 23 ILE O O 12.648 -6.545 -1.897 1.00 . A A . 23 ILE O 1 1 1 327 1 1 24 GLU C C 15.099 -7.057 -0.146 1.00 . A A . 24 GLU C 1 1 1 328 1 1 24 GLU CA C 13.879 -6.632 0.630 1.00 . A A . 24 GLU CA 1 1 1 329 1 1 24 GLU CB C 12.877 -7.740 0.696 1.00 . A A . 24 GLU CB 1 1 1 330 1 1 24 GLU CD C 12.362 -7.516 3.121 1.00 . A A . 24 GLU CD 1 1 1 331 1 1 24 GLU CG C 11.805 -7.491 1.729 1.00 . A A . 24 GLU CG 1 1 1 332 1 1 24 GLU H H 13.285 -4.657 0.384 1.00 . A A . 24 GLU H 1 1 1 333 1 1 24 GLU HA H 14.165 -6.346 1.630 1.00 . A A . 24 GLU HA 1 1 1 334 1 1 24 GLU HB2 H 12.416 -7.774 -0.272 1.00 . A A . 24 GLU HB2 1 1 1 335 1 1 24 GLU HB3 H 13.371 -8.676 0.909 1.00 . A A . 24 GLU HB3 1 1 1 336 1 1 24 GLU HG2 H 11.389 -6.506 1.551 1.00 . A A . 24 GLU HG2 1 1 1 337 1 1 24 GLU HG3 H 11.037 -8.242 1.639 1.00 . A A . 24 GLU HG3 1 1 1 338 1 1 24 GLU N N 13.228 -5.499 -0.010 1.00 . A A . 24 GLU N 1 1 1 339 1 1 24 GLU O O 15.402 -8.248 -0.273 1.00 . A A . 24 GLU O 1 1 1 340 1 1 24 GLU OE1 O 12.891 -6.485 3.554 1.00 . A A . 24 GLU OE1 1 1 1 341 1 1 24 GLU OE2 O 12.284 -8.568 3.793 1.00 . A A . 24 GLU OE2 1 1 1 342 1 1 25 ALA C C 16.421 -6.902 -2.851 1.00 . A A . 25 ALA C 1 1 1 343 1 1 25 ALA CA C 16.897 -6.237 -1.574 1.00 . A A . 25 ALA CA 1 1 1 344 1 1 25 ALA CB C 18.012 -7.042 -0.919 1.00 . A A . 25 ALA CB 1 1 1 345 1 1 25 ALA H H 15.464 -5.143 -0.482 1.00 . A A . 25 ALA H 1 1 1 346 1 1 25 ALA HA H 17.286 -5.258 -1.817 1.00 . A A . 25 ALA HA 1 1 1 347 1 1 25 ALA HB1 H 18.832 -7.155 -1.613 1.00 . A A . 25 ALA HB1 1 1 1 348 1 1 25 ALA HB2 H 18.357 -6.528 -0.034 1.00 . A A . 25 ALA HB2 1 1 1 349 1 1 25 ALA HB3 H 17.638 -8.017 -0.643 1.00 . A A . 25 ALA HB3 1 1 1 350 1 1 25 ALA N N 15.766 -6.052 -0.683 1.00 . A A . 25 ALA N 1 1 1 351 1 1 25 ALA O O 17.216 -7.410 -3.639 1.00 . A A . 25 ALA O 1 1 1 352 1 1 26 LEU C C 13.993 -6.309 -5.081 1.00 . A A . 26 LEU C 1 1 1 353 1 1 26 LEU CA C 14.528 -7.436 -4.246 1.00 . A A . 26 LEU CA 1 1 1 354 1 1 26 LEU CB C 13.437 -8.466 -3.941 1.00 . A A . 26 LEU CB 1 1 1 355 1 1 26 LEU CD1 C 12.693 -10.552 -2.774 1.00 . A A . 26 LEU CD1 1 1 1 356 1 1 26 LEU CD2 C 15.019 -10.392 -3.674 1.00 . A A . 26 LEU CD2 1 1 1 357 1 1 26 LEU CG C 13.868 -9.627 -3.042 1.00 . A A . 26 LEU CG 1 1 1 358 1 1 26 LEU H H 14.507 -6.503 -2.378 1.00 . A A . 26 LEU H 1 1 1 359 1 1 26 LEU HA H 15.304 -7.895 -4.774 1.00 . A A . 26 LEU HA 1 1 1 360 1 1 26 LEU HB2 H 12.613 -7.955 -3.462 1.00 . A A . 26 LEU HB2 1 1 1 361 1 1 26 LEU HB3 H 13.088 -8.876 -4.875 1.00 . A A . 26 LEU HB3 1 1 1 362 1 1 26 LEU HD11 H 13.009 -11.355 -2.125 1.00 . A A . 26 LEU HD11 1 1 1 363 1 1 26 LEU HD12 H 11.899 -9.995 -2.298 1.00 . A A . 26 LEU HD12 1 1 1 364 1 1 26 LEU HD13 H 12.336 -10.962 -3.708 1.00 . A A . 26 LEU HD13 1 1 1 365 1 1 26 LEU HD21 H 14.699 -10.814 -4.614 1.00 . A A . 26 LEU HD21 1 1 1 366 1 1 26 LEU HD22 H 15.847 -9.718 -3.844 1.00 . A A . 26 LEU HD22 1 1 1 367 1 1 26 LEU HD23 H 15.331 -11.185 -3.009 1.00 . A A . 26 LEU HD23 1 1 1 368 1 1 26 LEU HG H 14.206 -9.231 -2.094 1.00 . A A . 26 LEU HG 1 1 1 369 1 1 26 LEU N N 15.104 -6.897 -3.050 1.00 . A A . 26 LEU N 1 1 1 370 1 1 26 LEU O O 13.518 -6.509 -6.202 1.00 . A A . 26 LEU O 1 1 1 371 1 1 27 ASP C C 12.243 -3.930 -5.496 1.00 . A A . 27 ASP C 1 1 1 372 1 1 27 ASP CA C 13.721 -3.888 -5.191 1.00 . A A . 27 ASP CA 1 1 1 373 1 1 27 ASP CB C 14.550 -3.715 -6.467 1.00 . A A . 27 ASP CB 1 1 1 374 1 1 27 ASP CG C 14.388 -2.342 -7.091 1.00 . A A . 27 ASP CG 1 1 1 375 1 1 27 ASP H H 14.363 -5.068 -3.548 1.00 . A A . 27 ASP H 1 1 1 376 1 1 27 ASP HA H 13.917 -3.060 -4.523 1.00 . A A . 27 ASP HA 1 1 1 377 1 1 27 ASP HB2 H 15.593 -3.865 -6.227 1.00 . A A . 27 ASP HB2 1 1 1 378 1 1 27 ASP HB3 H 14.243 -4.458 -7.188 1.00 . A A . 27 ASP HB3 1 1 1 379 1 1 27 ASP N N 14.078 -5.116 -4.498 1.00 . A A . 27 ASP N 1 1 1 380 1 1 27 ASP O O 11.775 -3.527 -6.560 1.00 . A A . 27 ASP O 1 1 1 381 1 1 27 ASP OD1 O 14.891 -1.358 -6.510 1.00 . A A . 27 ASP OD1 1 1 1 382 1 1 27 ASP OD2 O 13.772 -2.243 -8.176 1.00 . A A . 27 ASP OD2 1 1 1 383 1 1 28 LYS C C 9.358 -3.440 -3.979 1.00 . A A . 28 LYS C 1 1 1 384 1 1 28 LYS CA C 10.079 -4.589 -4.668 1.00 . A A . 28 LYS CA 1 1 1 385 1 1 28 LYS CB C 9.632 -5.907 -4.048 1.00 . A A . 28 LYS CB 1 1 1 386 1 1 28 LYS CD C 10.188 -7.267 -6.078 1.00 . A A . 28 LYS CD 1 1 1 387 1 1 28 LYS CE C 8.715 -7.330 -6.451 1.00 . A A . 28 LYS CE 1 1 1 388 1 1 28 LYS CG C 10.375 -7.125 -4.575 1.00 . A A . 28 LYS CG 1 1 1 389 1 1 28 LYS H H 11.970 -4.784 -3.718 1.00 . A A . 28 LYS H 1 1 1 390 1 1 28 LYS HA H 9.836 -4.589 -5.718 1.00 . A A . 28 LYS HA 1 1 1 391 1 1 28 LYS HB2 H 9.775 -5.851 -2.971 1.00 . A A . 28 LYS HB2 1 1 1 392 1 1 28 LYS HB3 H 8.579 -6.043 -4.250 1.00 . A A . 28 LYS HB3 1 1 1 393 1 1 28 LYS HD2 H 10.637 -6.417 -6.568 1.00 . A A . 28 LYS HD2 1 1 1 394 1 1 28 LYS HD3 H 10.673 -8.174 -6.408 1.00 . A A . 28 LYS HD3 1 1 1 395 1 1 28 LYS HE2 H 8.317 -8.282 -6.127 1.00 . A A . 28 LYS HE2 1 1 1 396 1 1 28 LYS HE3 H 8.192 -6.533 -5.942 1.00 . A A . 28 LYS HE3 1 1 1 397 1 1 28 LYS HG2 H 11.434 -7.020 -4.353 1.00 . A A . 28 LYS HG2 1 1 1 398 1 1 28 LYS HG3 H 9.989 -8.009 -4.089 1.00 . A A . 28 LYS HG3 1 1 1 399 1 1 28 LYS HZ1 H 8.832 -8.055 -8.403 1.00 . A A . 28 LYS HZ1 1 1 1 400 1 1 28 LYS HZ2 H 9.029 -6.375 -8.278 1.00 . A A . 28 LYS HZ2 1 1 1 401 1 1 28 LYS HZ3 H 7.489 -7.058 -8.116 1.00 . A A . 28 LYS HZ3 1 1 1 402 1 1 28 LYS N N 11.513 -4.441 -4.532 1.00 . A A . 28 LYS N 1 1 1 403 1 1 28 LYS NZ N 8.501 -7.196 -7.912 1.00 . A A . 28 LYS NZ 1 1 1 404 1 1 28 LYS O O 9.953 -2.686 -3.223 1.00 . A A . 28 LYS O 1 1 1 405 1 1 29 TYR C C 5.838 -2.529 -3.642 1.00 . A A . 29 TYR C 1 1 1 406 1 1 29 TYR CA C 7.321 -2.207 -3.667 1.00 . A A . 29 TYR CA 1 1 1 407 1 1 29 TYR CB C 7.590 -0.876 -4.404 1.00 . A A . 29 TYR CB 1 1 1 408 1 1 29 TYR CD1 C 8.205 -1.431 -6.800 1.00 . A A . 29 TYR CD1 1 1 1 409 1 1 29 TYR CD2 C 6.122 -0.345 -6.395 1.00 . A A . 29 TYR CD2 1 1 1 410 1 1 29 TYR CE1 C 7.941 -1.437 -8.156 1.00 . A A . 29 TYR CE1 1 1 1 411 1 1 29 TYR CE2 C 5.855 -0.347 -7.749 1.00 . A A . 29 TYR CE2 1 1 1 412 1 1 29 TYR CG C 7.300 -0.888 -5.895 1.00 . A A . 29 TYR CG 1 1 1 413 1 1 29 TYR CZ C 6.765 -0.895 -8.625 1.00 . A A . 29 TYR CZ 1 1 1 414 1 1 29 TYR H H 7.628 -3.941 -4.818 1.00 . A A . 29 TYR H 1 1 1 415 1 1 29 TYR HA H 7.656 -2.101 -2.643 1.00 . A A . 29 TYR HA 1 1 1 416 1 1 29 TYR HB2 H 6.977 -0.105 -3.962 1.00 . A A . 29 TYR HB2 1 1 1 417 1 1 29 TYR HB3 H 8.629 -0.612 -4.271 1.00 . A A . 29 TYR HB3 1 1 1 418 1 1 29 TYR HD1 H 9.126 -1.857 -6.430 1.00 . A A . 29 TYR HD1 1 1 1 419 1 1 29 TYR HD2 H 5.408 0.081 -5.705 1.00 . A A . 29 TYR HD2 1 1 1 420 1 1 29 TYR HE1 H 8.655 -1.869 -8.843 1.00 . A A . 29 TYR HE1 1 1 1 421 1 1 29 TYR HE2 H 4.932 0.080 -8.116 1.00 . A A . 29 TYR HE2 1 1 1 422 1 1 29 TYR HH H 6.847 -1.704 -10.375 1.00 . A A . 29 TYR HH 1 1 1 423 1 1 29 TYR N N 8.079 -3.294 -4.246 1.00 . A A . 29 TYR N 1 1 1 424 1 1 29 TYR O O 5.160 -2.525 -4.665 1.00 . A A . 29 TYR O 1 1 1 425 1 1 29 TYR OH O 6.499 -0.893 -9.975 1.00 . A A . 29 TYR OH 1 1 1 426 1 1 30 ALA C C 3.554 -1.719 -1.422 1.00 . A A . 30 ALA C 1 1 1 427 1 1 30 ALA CA C 3.940 -2.939 -2.227 1.00 . A A . 30 ALA CA 1 1 1 428 1 1 30 ALA CB C 3.569 -4.220 -1.495 1.00 . A A . 30 ALA CB 1 1 1 429 1 1 30 ALA H H 5.974 -3.068 -1.735 1.00 . A A . 30 ALA H 1 1 1 430 1 1 30 ALA HA H 3.428 -2.916 -3.178 1.00 . A A . 30 ALA HA 1 1 1 431 1 1 30 ALA HB1 H 3.833 -5.073 -2.104 1.00 . A A . 30 ALA HB1 1 1 1 432 1 1 30 ALA HB2 H 4.107 -4.268 -0.559 1.00 . A A . 30 ALA HB2 1 1 1 433 1 1 30 ALA HB3 H 2.507 -4.231 -1.302 1.00 . A A . 30 ALA HB3 1 1 1 434 1 1 30 ALA N N 5.358 -2.865 -2.466 1.00 . A A . 30 ALA N 1 1 1 435 1 1 30 ALA O O 4.123 -1.469 -0.357 1.00 . A A . 30 ALA O 1 1 1 436 1 1 31 CYS C C 0.840 0.196 -0.840 1.00 . A A . 31 CYS C 1 1 1 437 1 1 31 CYS CA C 2.264 0.293 -1.304 1.00 . A A . 31 CYS CA 1 1 1 438 1 1 31 CYS CB C 2.460 1.498 -2.217 1.00 . A A . 31 CYS CB 1 1 1 439 1 1 31 CYS H H 2.130 -1.243 -2.722 1.00 . A A . 31 CYS H 1 1 1 440 1 1 31 CYS HA H 2.896 0.407 -0.436 1.00 . A A . 31 CYS HA 1 1 1 441 1 1 31 CYS HB2 H 3.439 1.447 -2.673 1.00 . A A . 31 CYS HB2 1 1 1 442 1 1 31 CYS HB3 H 1.703 1.492 -2.988 1.00 . A A . 31 CYS HB3 1 1 1 443 1 1 31 CYS N N 2.625 -0.945 -1.939 1.00 . A A . 31 CYS N 1 1 1 444 1 1 31 CYS O O -0.106 0.180 -1.633 1.00 . A A . 31 CYS O 1 1 1 445 1 1 31 CYS SG S 2.337 3.084 -1.326 1.00 . A A . 31 CYS SG 1 1 1 446 1 1 32 ASN C C -0.966 0.964 1.956 1.00 . A A . 32 ASN C 1 1 1 447 1 1 32 ASN CA C -0.552 -0.183 1.061 1.00 . A A . 32 ASN CA 1 1 1 448 1 1 32 ASN CB C -0.415 -1.500 1.823 1.00 . A A . 32 ASN CB 1 1 1 449 1 1 32 ASN CG C -1.492 -1.710 2.872 1.00 . A A . 32 ASN CG 1 1 1 450 1 1 32 ASN H H 1.484 0.291 1.021 1.00 . A A . 32 ASN H 1 1 1 451 1 1 32 ASN HA H -1.284 -0.299 0.276 1.00 . A A . 32 ASN HA 1 1 1 452 1 1 32 ASN HB2 H -0.476 -2.313 1.115 1.00 . A A . 32 ASN HB2 1 1 1 453 1 1 32 ASN HB3 H 0.554 -1.521 2.294 1.00 . A A . 32 ASN HB3 1 1 1 454 1 1 32 ASN HD21 H -0.226 -2.737 4.006 1.00 . A A . 32 ASN HD21 1 1 1 455 1 1 32 ASN HD22 H -1.819 -2.546 4.642 1.00 . A A . 32 ASN HD22 1 1 1 456 1 1 32 ASN N N 0.706 0.116 0.450 1.00 . A A . 32 ASN N 1 1 1 457 1 1 32 ASN ND2 N -1.146 -2.401 3.947 1.00 . A A . 32 ASN ND2 1 1 1 458 1 1 32 ASN O O -0.438 1.149 3.047 1.00 . A A . 32 ASN O 1 1 1 459 1 1 32 ASN OD1 O -2.626 -1.260 2.714 1.00 . A A . 32 ASN OD1 1 1 1 460 1 1 33 CYS C C -3.316 2.494 3.309 1.00 . A A . 33 CYS C 1 1 1 461 1 1 33 CYS CA C -2.411 2.898 2.150 1.00 . A A . 33 CYS CA 1 1 1 462 1 1 33 CYS CB C -3.192 3.786 1.178 1.00 . A A . 33 CYS CB 1 1 1 463 1 1 33 CYS H H -2.239 1.539 0.557 1.00 . A A . 33 CYS H 1 1 1 464 1 1 33 CYS HA H -1.571 3.454 2.537 1.00 . A A . 33 CYS HA 1 1 1 465 1 1 33 CYS HB2 H -3.818 3.151 0.572 1.00 . A A . 33 CYS HB2 1 1 1 466 1 1 33 CYS HB3 H -3.815 4.463 1.745 1.00 . A A . 33 CYS HB3 1 1 1 467 1 1 33 CYS N N -1.897 1.742 1.449 1.00 . A A . 33 CYS N 1 1 1 468 1 1 33 CYS O O -2.893 2.443 4.457 1.00 . A A . 33 CYS O 1 1 1 469 1 1 33 CYS SG S -2.178 4.786 0.032 1.00 . A A . 33 CYS SG 1 1 1 470 1 1 34 VAL C C -6.653 1.065 3.473 1.00 . A A . 34 VAL C 1 1 1 471 1 1 34 VAL CA C -5.571 1.991 4.012 1.00 . A A . 34 VAL CA 1 1 1 472 1 1 34 VAL CB C -6.168 3.365 4.403 1.00 . A A . 34 VAL CB 1 1 1 473 1 1 34 VAL CG1 C -7.191 3.833 3.380 1.00 . A A . 34 VAL CG1 1 1 1 474 1 1 34 VAL CG2 C -6.765 3.325 5.802 1.00 . A A . 34 VAL CG2 1 1 1 475 1 1 34 VAL H H -4.805 2.053 2.054 1.00 . A A . 34 VAL H 1 1 1 476 1 1 34 VAL HA H -5.115 1.543 4.882 1.00 . A A . 34 VAL HA 1 1 1 477 1 1 34 VAL HB H -5.358 4.090 4.401 1.00 . A A . 34 VAL HB 1 1 1 478 1 1 34 VAL HG11 H -6.714 3.943 2.418 1.00 . A A . 34 VAL HG11 1 1 1 479 1 1 34 VAL HG12 H -7.987 3.107 3.308 1.00 . A A . 34 VAL HG12 1 1 1 480 1 1 34 VAL HG13 H -7.599 4.784 3.689 1.00 . A A . 34 VAL HG13 1 1 1 481 1 1 34 VAL HG21 H -7.206 4.283 6.034 1.00 . A A . 34 VAL HG21 1 1 1 482 1 1 34 VAL HG22 H -7.525 2.558 5.847 1.00 . A A . 34 VAL HG22 1 1 1 483 1 1 34 VAL HG23 H -5.988 3.102 6.518 1.00 . A A . 34 VAL HG23 1 1 1 484 1 1 34 VAL N N -4.561 2.176 2.992 1.00 . A A . 34 VAL N 1 1 1 485 1 1 34 VAL O O -6.734 0.855 2.259 1.00 . A A . 34 VAL O 1 1 1 486 1 1 35 VAL C C -9.649 0.433 3.298 1.00 . A A . 35 VAL C 1 1 1 487 1 1 35 VAL CA C -8.527 -0.408 3.920 1.00 . A A . 35 VAL CA 1 1 1 488 1 1 35 VAL CB C -9.048 -1.333 5.058 1.00 . A A . 35 VAL CB 1 1 1 489 1 1 35 VAL CG1 C -7.910 -2.176 5.615 1.00 . A A . 35 VAL CG1 1 1 1 490 1 1 35 VAL CG2 C -9.700 -0.548 6.192 1.00 . A A . 35 VAL CG2 1 1 1 491 1 1 35 VAL H H -7.267 0.572 5.316 1.00 . A A . 35 VAL H 1 1 1 492 1 1 35 VAL HA H -8.128 -1.044 3.140 1.00 . A A . 35 VAL HA 1 1 1 493 1 1 35 VAL HB H -9.782 -2.010 4.629 1.00 . A A . 35 VAL HB 1 1 1 494 1 1 35 VAL HG11 H -7.509 -2.803 4.831 1.00 . A A . 35 VAL HG11 1 1 1 495 1 1 35 VAL HG12 H -7.132 -1.527 5.991 1.00 . A A . 35 VAL HG12 1 1 1 496 1 1 35 VAL HG13 H -8.279 -2.796 6.418 1.00 . A A . 35 VAL HG13 1 1 1 497 1 1 35 VAL HG21 H -10.044 -1.231 6.954 1.00 . A A . 35 VAL HG21 1 1 1 498 1 1 35 VAL HG22 H -8.980 0.135 6.618 1.00 . A A . 35 VAL HG22 1 1 1 499 1 1 35 VAL HG23 H -10.541 0.009 5.804 1.00 . A A . 35 VAL HG23 1 1 1 500 1 1 35 VAL N N -7.437 0.454 4.355 1.00 . A A . 35 VAL N 1 1 1 501 1 1 35 VAL O O -10.671 0.732 3.910 1.00 . A A . 35 VAL O 1 1 1 502 1 1 36 GLY C C -9.613 2.289 0.139 1.00 . A A . 36 GLY C 1 1 1 503 1 1 36 GLY CA C -10.299 1.731 1.364 1.00 . A A . 36 GLY CA 1 1 1 504 1 1 36 GLY H H -8.641 0.445 1.589 1.00 . A A . 36 GLY H 1 1 1 505 1 1 36 GLY HA2 H -11.196 1.208 1.065 1.00 . A A . 36 GLY HA2 1 1 1 506 1 1 36 GLY HA3 H -10.559 2.544 2.025 1.00 . A A . 36 GLY HA3 1 1 1 507 1 1 36 GLY N N -9.421 0.809 2.057 1.00 . A A . 36 GLY N 1 1 1 508 1 1 36 GLY O O -10.245 2.869 -0.742 1.00 . A A . 36 GLY O 1 1 1 509 1 1 37 TYR C C -6.426 1.371 -1.289 1.00 . A A . 37 TYR C 1 1 1 510 1 1 37 TYR CA C -7.500 2.435 -1.070 1.00 . A A . 37 TYR CA 1 1 1 511 1 1 37 TYR CB C -6.814 3.795 -0.891 1.00 . A A . 37 TYR CB 1 1 1 512 1 1 37 TYR CD1 C -8.268 5.352 0.461 1.00 . A A . 37 TYR CD1 1 1 1 513 1 1 37 TYR CD2 C -8.110 5.721 -1.885 1.00 . A A . 37 TYR CD2 1 1 1 514 1 1 37 TYR CE1 C -9.114 6.434 0.580 1.00 . A A . 37 TYR CE1 1 1 1 515 1 1 37 TYR CE2 C -8.954 6.810 -1.774 1.00 . A A . 37 TYR CE2 1 1 1 516 1 1 37 TYR CG C -7.753 4.975 -0.771 1.00 . A A . 37 TYR CG 1 1 1 517 1 1 37 TYR CZ C -9.452 7.160 -0.538 1.00 . A A . 37 TYR CZ 1 1 1 518 1 1 37 TYR H H -7.851 1.720 0.882 1.00 . A A . 37 TYR H 1 1 1 519 1 1 37 TYR HA H -8.151 2.469 -1.931 1.00 . A A . 37 TYR HA 1 1 1 520 1 1 37 TYR HB2 H -6.211 3.766 0.003 1.00 . A A . 37 TYR HB2 1 1 1 521 1 1 37 TYR HB3 H -6.171 3.973 -1.740 1.00 . A A . 37 TYR HB3 1 1 1 522 1 1 37 TYR HD1 H -8.001 4.781 1.337 1.00 . A A . 37 TYR HD1 1 1 1 523 1 1 37 TYR HD2 H -7.719 5.441 -2.853 1.00 . A A . 37 TYR HD2 1 1 1 524 1 1 37 TYR HE1 H -9.505 6.709 1.547 1.00 . A A . 37 TYR HE1 1 1 1 525 1 1 37 TYR HE2 H -9.221 7.379 -2.652 1.00 . A A . 37 TYR HE2 1 1 1 526 1 1 37 TYR HH H -10.069 8.735 0.391 1.00 . A A . 37 TYR HH 1 1 1 527 1 1 37 TYR N N -8.299 2.097 0.095 1.00 . A A . 37 TYR N 1 1 1 528 1 1 37 TYR O O -5.460 1.300 -0.526 1.00 . A A . 37 TYR O 1 1 1 529 1 1 37 TYR OH O -10.289 8.246 -0.418 1.00 . A A . 37 TYR OH 1 1 1 530 1 1 38 ILE C C -5.662 -0.717 -4.211 1.00 . A A . 38 ILE C 1 1 1 531 1 1 38 ILE CA C -5.540 -0.391 -2.713 1.00 . A A . 38 ILE CA 1 1 1 532 1 1 38 ILE CB C -5.491 -1.674 -1.832 1.00 . A A . 38 ILE CB 1 1 1 533 1 1 38 ILE CD1 C -3.314 -2.521 -2.903 1.00 . A A . 38 ILE CD1 1 1 1 534 1 1 38 ILE CG1 C -4.038 -2.125 -1.632 1.00 . A A . 38 ILE CG1 1 1 1 535 1 1 38 ILE CG2 C -6.337 -2.815 -2.385 1.00 . A A . 38 ILE CG2 1 1 1 536 1 1 38 ILE H H -7.483 0.463 -2.730 1.00 . A A . 38 ILE H 1 1 1 537 1 1 38 ILE HA H -4.612 0.135 -2.566 1.00 . A A . 38 ILE HA 1 1 1 538 1 1 38 ILE HB H -5.897 -1.414 -0.868 1.00 . A A . 38 ILE HB 1 1 1 539 1 1 38 ILE HD11 H -3.823 -3.353 -3.365 1.00 . A A . 38 ILE HD11 1 1 1 540 1 1 38 ILE HD12 H -3.300 -1.683 -3.584 1.00 . A A . 38 ILE HD12 1 1 1 541 1 1 38 ILE HD13 H -2.299 -2.806 -2.665 1.00 . A A . 38 ILE HD13 1 1 1 542 1 1 38 ILE HG12 H -3.487 -1.315 -1.180 1.00 . A A . 38 ILE HG12 1 1 1 543 1 1 38 ILE HG13 H -4.025 -2.975 -0.965 1.00 . A A . 38 ILE HG13 1 1 1 544 1 1 38 ILE HG21 H -6.257 -3.672 -1.734 1.00 . A A . 38 ILE HG21 1 1 1 545 1 1 38 ILE HG22 H -7.368 -2.502 -2.443 1.00 . A A . 38 ILE HG22 1 1 1 546 1 1 38 ILE HG23 H -5.984 -3.078 -3.371 1.00 . A A . 38 ILE HG23 1 1 1 547 1 1 38 ILE N N -6.607 0.516 -2.291 1.00 . A A . 38 ILE N 1 1 1 548 1 1 38 ILE O O -6.659 -1.226 -4.673 1.00 . A A . 38 ILE O 1 1 1 549 1 1 39 GLY C C -3.318 -0.277 -6.989 1.00 . A A . 39 GLY C 1 1 1 550 1 1 39 GLY CA C -4.644 -0.653 -6.387 1.00 . A A . 39 GLY CA 1 1 1 551 1 1 39 GLY H H -3.962 0.237 -4.605 1.00 . A A . 39 GLY H 1 1 1 552 1 1 39 GLY HA2 H -4.797 -1.717 -6.490 1.00 . A A . 39 GLY HA2 1 1 1 553 1 1 39 GLY HA3 H -5.430 -0.125 -6.906 1.00 . A A . 39 GLY HA3 1 1 1 554 1 1 39 GLY N N -4.682 -0.299 -4.984 1.00 . A A . 39 GLY N 1 1 1 555 1 1 39 GLY O O -3.090 0.907 -7.238 1.00 . A A . 39 GLY O 1 1 1 556 1 1 40 GLU C C -0.247 -0.359 -6.603 1.00 . A A . 40 GLU C 1 1 1 557 1 1 40 GLU CA C -1.081 -1.038 -7.686 1.00 . A A . 40 GLU CA 1 1 1 558 1 1 40 GLU CB C -1.097 -0.185 -8.962 1.00 . A A . 40 GLU CB 1 1 1 559 1 1 40 GLU CD C 0.295 1.056 -10.681 1.00 . A A . 40 GLU CD 1 1 1 560 1 1 40 GLU CG C 0.276 0.006 -9.585 1.00 . A A . 40 GLU CG 1 1 1 561 1 1 40 GLU H H -2.696 -2.179 -6.947 1.00 . A A . 40 GLU H 1 1 1 562 1 1 40 GLU HA H -0.644 -2.003 -7.909 1.00 . A A . 40 GLU HA 1 1 1 563 1 1 40 GLU HB2 H -1.739 -0.661 -9.690 1.00 . A A . 40 GLU HB2 1 1 1 564 1 1 40 GLU HB3 H -1.499 0.788 -8.724 1.00 . A A . 40 GLU HB3 1 1 1 565 1 1 40 GLU HG2 H 0.966 0.307 -8.811 1.00 . A A . 40 GLU HG2 1 1 1 566 1 1 40 GLU HG3 H 0.601 -0.935 -10.005 1.00 . A A . 40 GLU HG3 1 1 1 567 1 1 40 GLU N N -2.437 -1.264 -7.182 1.00 . A A . 40 GLU N 1 1 1 568 1 1 40 GLU O O 0.816 -0.840 -6.215 1.00 . A A . 40 GLU O 1 1 1 569 1 1 40 GLU OE1 O -0.664 1.123 -11.477 1.00 . A A . 40 GLU OE1 1 1 1 570 1 1 40 GLU OE2 O 1.282 1.819 -10.758 1.00 . A A . 40 GLU OE2 1 1 1 571 1 1 41 ARG C C -1.195 2.286 -4.289 1.00 . A A . 41 ARG C 1 1 1 572 1 1 41 ARG CA C -0.135 1.547 -5.095 1.00 . A A . 41 ARG CA 1 1 1 573 1 1 41 ARG CB C 0.860 2.485 -5.770 1.00 . A A . 41 ARG CB 1 1 1 574 1 1 41 ARG CD C -0.548 4.312 -6.813 1.00 . A A . 41 ARG CD 1 1 1 575 1 1 41 ARG CG C 0.344 3.110 -7.060 1.00 . A A . 41 ARG CG 1 1 1 576 1 1 41 ARG CZ C -1.487 6.152 -8.163 1.00 . A A . 41 ARG CZ 1 1 1 577 1 1 41 ARG H H -1.659 1.028 -6.443 1.00 . A A . 41 ARG H 1 1 1 578 1 1 41 ARG HA H 0.401 0.881 -4.435 1.00 . A A . 41 ARG HA 1 1 1 579 1 1 41 ARG HB2 H 1.127 3.276 -5.087 1.00 . A A . 41 ARG HB2 1 1 1 580 1 1 41 ARG HB3 H 1.739 1.908 -6.012 1.00 . A A . 41 ARG HB3 1 1 1 581 1 1 41 ARG HD2 H -1.427 3.983 -6.270 1.00 . A A . 41 ARG HD2 1 1 1 582 1 1 41 ARG HD3 H -0.006 5.033 -6.223 1.00 . A A . 41 ARG HD3 1 1 1 583 1 1 41 ARG HE H -0.847 4.405 -8.893 1.00 . A A . 41 ARG HE 1 1 1 584 1 1 41 ARG HG2 H 1.181 3.416 -7.666 1.00 . A A . 41 ARG HG2 1 1 1 585 1 1 41 ARG HG3 H -0.231 2.361 -7.588 1.00 . A A . 41 ARG HG3 1 1 1 586 1 1 41 ARG HH11 H -1.323 6.570 -6.191 1.00 . A A . 41 ARG HH11 1 1 1 587 1 1 41 ARG HH12 H -2.006 7.839 -7.167 1.00 . A A . 41 ARG HH12 1 1 1 588 1 1 41 ARG HH21 H -1.757 6.055 -10.165 1.00 . A A . 41 ARG HH21 1 1 1 589 1 1 41 ARG HH22 H -2.278 7.533 -9.419 1.00 . A A . 41 ARG HH22 1 1 1 590 1 1 41 ARG N N -0.778 0.741 -6.104 1.00 . A A . 41 ARG N 1 1 1 591 1 1 41 ARG NE N -0.963 4.934 -8.068 1.00 . A A . 41 ARG NE 1 1 1 592 1 1 41 ARG NH1 N -1.616 6.910 -7.085 1.00 . A A . 41 ARG NH1 1 1 1 593 1 1 41 ARG NH2 N -1.867 6.619 -9.343 1.00 . A A . 41 ARG NH2 1 1 1 594 1 1 41 ARG O O -1.143 3.497 -4.105 1.00 . A A . 41 ARG O 1 1 1 595 1 1 42 CYS C C -4.132 3.061 -3.638 1.00 . A A . 42 CYS C 1 1 1 596 1 1 42 CYS CA C -3.300 1.940 -3.023 1.00 . A A . 42 CYS CA 1 1 1 597 1 1 42 CYS CB C -2.867 2.277 -1.575 1.00 . A A . 42 CYS CB 1 1 1 598 1 1 42 CYS H H -2.163 0.570 -4.150 1.00 . A A . 42 CYS H 1 1 1 599 1 1 42 CYS HA H -3.946 1.090 -2.961 1.00 . A A . 42 CYS HA 1 1 1 600 1 1 42 CYS HB2 H -3.716 2.686 -1.052 1.00 . A A . 42 CYS HB2 1 1 1 601 1 1 42 CYS HB3 H -2.572 1.359 -1.084 1.00 . A A . 42 CYS HB3 1 1 1 602 1 1 42 CYS N N -2.183 1.503 -3.866 1.00 . A A . 42 CYS N 1 1 1 603 1 1 42 CYS O O -3.824 4.239 -3.475 1.00 . A A . 42 CYS O 1 1 1 604 1 1 42 CYS SG S -1.501 3.468 -1.360 1.00 . A A . 42 CYS SG 1 1 1 605 1 1 43 GLN C C -7.432 3.008 -5.383 1.00 . A A . 43 GLN C 1 1 1 606 1 1 43 GLN CA C -6.131 3.657 -4.916 1.00 . A A . 43 GLN CA 1 1 1 607 1 1 43 GLN CB C -5.456 4.377 -6.089 1.00 . A A . 43 GLN CB 1 1 1 608 1 1 43 GLN CD C -4.467 4.206 -8.419 1.00 . A A . 43 GLN CD 1 1 1 609 1 1 43 GLN CG C -5.024 3.454 -7.222 1.00 . A A . 43 GLN CG 1 1 1 610 1 1 43 GLN H H -5.427 1.716 -4.441 1.00 . A A . 43 GLN H 1 1 1 611 1 1 43 GLN HA H -6.365 4.383 -4.153 1.00 . A A . 43 GLN HA 1 1 1 612 1 1 43 GLN HB2 H -6.143 5.107 -6.490 1.00 . A A . 43 GLN HB2 1 1 1 613 1 1 43 GLN HB3 H -4.580 4.887 -5.716 1.00 . A A . 43 GLN HB3 1 1 1 614 1 1 43 GLN HE21 H -5.688 5.734 -8.065 1.00 . A A . 43 GLN HE21 1 1 1 615 1 1 43 GLN HE22 H -4.624 5.918 -9.417 1.00 . A A . 43 GLN HE22 1 1 1 616 1 1 43 GLN HG2 H -4.259 2.787 -6.850 1.00 . A A . 43 GLN HG2 1 1 1 617 1 1 43 GLN HG3 H -5.878 2.878 -7.543 1.00 . A A . 43 GLN HG3 1 1 1 618 1 1 43 GLN N N -5.226 2.677 -4.327 1.00 . A A . 43 GLN N 1 1 1 619 1 1 43 GLN NE2 N -4.979 5.403 -8.660 1.00 . A A . 43 GLN NE2 1 1 1 620 1 1 43 GLN O O -8.202 3.620 -6.122 1.00 . A A . 43 GLN O 1 1 1 621 1 1 43 GLN OE1 O -3.598 3.707 -9.132 1.00 . A A . 43 GLN OE1 1 1 1 622 1 1 44 TYR C C -9.469 0.320 -4.179 1.00 . A A . 44 TYR C 1 1 1 623 1 1 44 TYR CA C -8.897 1.080 -5.346 1.00 . A A . 44 TYR CA 1 1 1 624 1 1 44 TYR CB C -8.629 0.088 -6.484 1.00 . A A . 44 TYR CB 1 1 1 625 1 1 44 TYR CD1 C -9.588 0.898 -8.673 1.00 . A A . 44 TYR CD1 1 1 1 626 1 1 44 TYR CD2 C -7.228 1.000 -8.372 1.00 . A A . 44 TYR CD2 1 1 1 627 1 1 44 TYR CE1 C -9.452 1.404 -9.951 1.00 . A A . 44 TYR CE1 1 1 1 628 1 1 44 TYR CE2 C -7.085 1.515 -9.643 1.00 . A A . 44 TYR CE2 1 1 1 629 1 1 44 TYR CG C -8.479 0.686 -7.863 1.00 . A A . 44 TYR CG 1 1 1 630 1 1 44 TYR CZ C -8.197 1.713 -10.429 1.00 . A A . 44 TYR CZ 1 1 1 631 1 1 44 TYR H H -7.041 1.293 -4.393 1.00 . A A . 44 TYR H 1 1 1 632 1 1 44 TYR HA H -9.624 1.806 -5.664 1.00 . A A . 44 TYR HA 1 1 1 633 1 1 44 TYR HB2 H -7.713 -0.442 -6.265 1.00 . A A . 44 TYR HB2 1 1 1 634 1 1 44 TYR HB3 H -9.442 -0.624 -6.519 1.00 . A A . 44 TYR HB3 1 1 1 635 1 1 44 TYR HD1 H -10.570 0.658 -8.292 1.00 . A A . 44 TYR HD1 1 1 1 636 1 1 44 TYR HD2 H -6.356 0.846 -7.754 1.00 . A A . 44 TYR HD2 1 1 1 637 1 1 44 TYR HE1 H -10.326 1.561 -10.567 1.00 . A A . 44 TYR HE1 1 1 1 638 1 1 44 TYR HE2 H -6.101 1.757 -10.018 1.00 . A A . 44 TYR HE2 1 1 1 639 1 1 44 TYR HH H -8.775 2.826 -11.901 1.00 . A A . 44 TYR HH 1 1 1 640 1 1 44 TYR N N -7.683 1.769 -4.966 1.00 . A A . 44 TYR N 1 1 1 641 1 1 44 TYR O O -8.877 -0.648 -3.711 1.00 . A A . 44 TYR O 1 1 1 642 1 1 44 TYR OH O -8.051 2.209 -11.706 1.00 . A A . 44 TYR OH 1 1 1 643 1 1 45 ARG C C -10.880 -0.448 -1.545 1.00 . A A . 45 ARG C 1 1 1 644 1 1 45 ARG CA C -11.462 -0.087 -2.902 1.00 . A A . 45 ARG CA 1 1 1 645 1 1 45 ARG CB C -11.644 -1.376 -3.672 1.00 . A A . 45 ARG CB 1 1 1 646 1 1 45 ARG CD C -11.432 -1.989 -6.062 1.00 . A A . 45 ARG CD 1 1 1 647 1 1 45 ARG CG C -12.246 -1.209 -5.050 1.00 . A A . 45 ARG CG 1 1 1 648 1 1 45 ARG CZ C -13.075 -3.139 -7.490 1.00 . A A . 45 ARG CZ 1 1 1 649 1 1 45 ARG H H -10.865 1.709 -3.845 1.00 . A A . 45 ARG H 1 1 1 650 1 1 45 ARG HA H -12.419 0.390 -2.777 1.00 . A A . 45 ARG HA 1 1 1 651 1 1 45 ARG HB2 H -10.658 -1.817 -3.795 1.00 . A A . 45 ARG HB2 1 1 1 652 1 1 45 ARG HB3 H -12.268 -2.047 -3.099 1.00 . A A . 45 ARG HB3 1 1 1 653 1 1 45 ARG HD2 H -10.510 -1.441 -6.262 1.00 . A A . 45 ARG HD2 1 1 1 654 1 1 45 ARG HD3 H -11.188 -2.953 -5.641 1.00 . A A . 45 ARG HD3 1 1 1 655 1 1 45 ARG HE H -11.927 -1.598 -8.071 1.00 . A A . 45 ARG HE 1 1 1 656 1 1 45 ARG HG2 H -13.261 -1.579 -5.044 1.00 . A A . 45 ARG HG2 1 1 1 657 1 1 45 ARG HG3 H -12.237 -0.162 -5.317 1.00 . A A . 45 ARG HG3 1 1 1 658 1 1 45 ARG HH11 H -13.116 -3.727 -5.542 1.00 . A A . 45 ARG HH11 1 1 1 659 1 1 45 ARG HH12 H -14.188 -4.588 -6.604 1.00 . A A . 45 ARG HH12 1 1 1 660 1 1 45 ARG HH21 H -13.351 -2.740 -9.461 1.00 . A A . 45 ARG HH21 1 1 1 661 1 1 45 ARG HH22 H -14.303 -4.055 -8.811 1.00 . A A . 45 ARG HH22 1 1 1 662 1 1 45 ARG N N -10.603 0.774 -3.689 1.00 . A A . 45 ARG N 1 1 1 663 1 1 45 ARG NE N -12.157 -2.189 -7.313 1.00 . A A . 45 ARG NE 1 1 1 664 1 1 45 ARG NH1 N -13.490 -3.878 -6.463 1.00 . A A . 45 ARG NH1 1 1 1 665 1 1 45 ARG NH2 N -13.622 -3.322 -8.680 1.00 . A A . 45 ARG NH2 1 1 1 666 1 1 45 ARG O O -9.727 -0.160 -1.221 1.00 . A A . 45 ARG O 1 1 1 667 1 1 46 ASP C C -11.235 -3.162 0.468 1.00 . A A . 46 ASP C 1 1 1 668 1 1 46 ASP CA C -11.301 -1.655 0.514 1.00 . A A . 46 ASP CA 1 1 1 669 1 1 46 ASP CB C -12.240 -1.137 1.621 1.00 . A A . 46 ASP CB 1 1 1 670 1 1 46 ASP CG C -13.721 -1.192 1.279 1.00 . A A . 46 ASP CG 1 1 1 671 1 1 46 ASP H H -12.575 -1.397 -1.146 1.00 . A A . 46 ASP H 1 1 1 672 1 1 46 ASP HA H -10.306 -1.294 0.709 1.00 . A A . 46 ASP HA 1 1 1 673 1 1 46 ASP HB2 H -12.085 -1.726 2.511 1.00 . A A . 46 ASP HB2 1 1 1 674 1 1 46 ASP HB3 H -11.983 -0.109 1.839 1.00 . A A . 46 ASP HB3 1 1 1 675 1 1 46 ASP N N -11.685 -1.164 -0.794 1.00 . A A . 46 ASP N 1 1 1 676 1 1 46 ASP O O -11.694 -3.866 1.368 1.00 . A A . 46 ASP O 1 1 1 677 1 1 46 ASP OD1 O -14.113 -0.744 0.183 1.00 . A A . 46 ASP OD1 1 1 1 678 1 1 46 ASP OD2 O -14.507 -1.644 2.130 1.00 . A A . 46 ASP OD2 1 1 1 679 1 1 47 LEU C C -9.809 -5.760 0.286 1.00 . A A . 47 LEU C 1 1 1 680 1 1 47 LEU CA C -10.422 -5.037 -0.903 1.00 . A A . 47 LEU CA 1 1 1 681 1 1 47 LEU CB C -9.476 -5.172 -2.101 1.00 . A A . 47 LEU CB 1 1 1 682 1 1 47 LEU CD1 C -8.801 -4.544 -4.432 1.00 . A A . 47 LEU CD1 1 1 1 683 1 1 47 LEU CD2 C -11.208 -4.938 -3.902 1.00 . A A . 47 LEU CD2 1 1 1 684 1 1 47 LEU CG C -9.884 -4.417 -3.371 1.00 . A A . 47 LEU CG 1 1 1 685 1 1 47 LEU H H -10.300 -2.971 -1.276 1.00 . A A . 47 LEU H 1 1 1 686 1 1 47 LEU HA H -11.373 -5.480 -1.145 1.00 . A A . 47 LEU HA 1 1 1 687 1 1 47 LEU HB2 H -8.503 -4.814 -1.801 1.00 . A A . 47 LEU HB2 1 1 1 688 1 1 47 LEU HB3 H -9.395 -6.221 -2.345 1.00 . A A . 47 LEU HB3 1 1 1 689 1 1 47 LEU HD11 H -9.102 -4.012 -5.321 1.00 . A A . 47 LEU HD11 1 1 1 690 1 1 47 LEU HD12 H -7.880 -4.124 -4.054 1.00 . A A . 47 LEU HD12 1 1 1 691 1 1 47 LEU HD13 H -8.649 -5.587 -4.669 1.00 . A A . 47 LEU HD13 1 1 1 692 1 1 47 LEU HD21 H -11.979 -4.776 -3.163 1.00 . A A . 47 LEU HD21 1 1 1 693 1 1 47 LEU HD22 H -11.465 -4.412 -4.810 1.00 . A A . 47 LEU HD22 1 1 1 694 1 1 47 LEU HD23 H -11.126 -5.995 -4.110 1.00 . A A . 47 LEU HD23 1 1 1 695 1 1 47 LEU HG H -10.002 -3.368 -3.137 1.00 . A A . 47 LEU HG 1 1 1 696 1 1 47 LEU N N -10.624 -3.624 -0.619 1.00 . A A . 47 LEU N 1 1 1 697 1 1 47 LEU O O -10.264 -6.830 0.684 1.00 . A A . 47 LEU O 1 1 1 698 1 1 48 LYS C C -8.793 -6.212 3.094 1.00 . A A . 48 LYS C 1 1 1 699 1 1 48 LYS CA C -7.970 -5.739 1.895 1.00 . A A . 48 LYS CA 1 1 1 700 1 1 48 LYS CB C -6.916 -4.731 2.346 1.00 . A A . 48 LYS CB 1 1 1 701 1 1 48 LYS CD C -7.143 -2.396 1.412 1.00 . A A . 48 LYS CD 1 1 1 702 1 1 48 LYS CE C -5.663 -2.056 1.385 1.00 . A A . 48 LYS CE 1 1 1 703 1 1 48 LYS CG C -7.481 -3.340 2.556 1.00 . A A . 48 LYS CG 1 1 1 704 1 1 48 LYS H H -8.594 -4.218 0.573 1.00 . A A . 48 LYS H 1 1 1 705 1 1 48 LYS HA H -7.471 -6.589 1.465 1.00 . A A . 48 LYS HA 1 1 1 706 1 1 48 LYS HB2 H -6.486 -5.067 3.279 1.00 . A A . 48 LYS HB2 1 1 1 707 1 1 48 LYS HB3 H -6.140 -4.673 1.600 1.00 . A A . 48 LYS HB3 1 1 1 708 1 1 48 LYS HD2 H -7.408 -2.870 0.479 1.00 . A A . 48 LYS HD2 1 1 1 709 1 1 48 LYS HD3 H -7.711 -1.486 1.532 1.00 . A A . 48 LYS HD3 1 1 1 710 1 1 48 LYS HE2 H -5.107 -2.935 1.090 1.00 . A A . 48 LYS HE2 1 1 1 711 1 1 48 LYS HE3 H -5.504 -1.264 0.657 1.00 . A A . 48 LYS HE3 1 1 1 712 1 1 48 LYS HG2 H -8.556 -3.416 2.631 1.00 . A A . 48 LYS HG2 1 1 1 713 1 1 48 LYS HG3 H -7.082 -2.936 3.476 1.00 . A A . 48 LYS HG3 1 1 1 714 1 1 48 LYS HZ1 H -5.291 -2.361 3.420 1.00 . A A . 48 LYS HZ1 1 1 1 715 1 1 48 LYS HZ2 H -5.715 -0.768 3.026 1.00 . A A . 48 LYS HZ2 1 1 1 716 1 1 48 LYS HZ3 H -4.168 -1.346 2.659 1.00 . A A . 48 LYS HZ3 1 1 1 717 1 1 48 LYS N N -8.792 -5.135 0.854 1.00 . A A . 48 LYS N 1 1 1 718 1 1 48 LYS NZ N -5.179 -1.599 2.712 1.00 . A A . 48 LYS NZ 1 1 1 719 1 1 48 LYS O O -8.636 -7.340 3.550 1.00 . A A . 48 LYS O 1 1 1 720 1 1 49 TRP C C -11.838 -6.105 4.440 1.00 . A A . 49 TRP C 1 1 1 721 1 1 49 TRP CA C -10.424 -5.667 4.796 1.00 . A A . 49 TRP CA 1 1 1 722 1 1 49 TRP CB C -10.461 -4.467 5.742 1.00 . A A . 49 TRP CB 1 1 1 723 1 1 49 TRP CD1 C -11.146 -5.660 7.904 1.00 . A A . 49 TRP CD1 1 1 1 724 1 1 49 TRP CD2 C -12.429 -3.902 7.375 1.00 . A A . 49 TRP CD2 1 1 1 725 1 1 49 TRP CE2 C -12.909 -4.462 8.572 1.00 . A A . 49 TRP CE2 1 1 1 726 1 1 49 TRP CE3 C -13.080 -2.782 6.847 1.00 . A A . 49 TRP CE3 1 1 1 727 1 1 49 TRP CG C -11.304 -4.684 6.961 1.00 . A A . 49 TRP CG 1 1 1 728 1 1 49 TRP CH2 C -14.624 -2.845 8.711 1.00 . A A . 49 TRP CH2 1 1 1 729 1 1 49 TRP CZ2 C -14.007 -3.940 9.249 1.00 . A A . 49 TRP CZ2 1 1 1 730 1 1 49 TRP CZ3 C -14.170 -2.267 7.521 1.00 . A A . 49 TRP CZ3 1 1 1 731 1 1 49 TRP H H -9.764 -4.471 3.194 1.00 . A A . 49 TRP H 1 1 1 732 1 1 49 TRP HA H -9.929 -6.484 5.299 1.00 . A A . 49 TRP HA 1 1 1 733 1 1 49 TRP HB2 H -9.456 -4.247 6.068 1.00 . A A . 49 TRP HB2 1 1 1 734 1 1 49 TRP HB3 H -10.855 -3.611 5.207 1.00 . A A . 49 TRP HB3 1 1 1 735 1 1 49 TRP HD1 H -10.376 -6.415 7.877 1.00 . A A . 49 TRP HD1 1 1 1 736 1 1 49 TRP HE1 H -12.210 -6.117 9.658 1.00 . A A . 49 TRP HE1 1 1 1 737 1 1 49 TRP HE3 H -12.744 -2.322 5.930 1.00 . A A . 49 TRP HE3 1 1 1 738 1 1 49 TRP HH2 H -15.480 -2.409 9.205 1.00 . A A . 49 TRP HH2 1 1 1 739 1 1 49 TRP HZ2 H -14.368 -4.373 10.171 1.00 . A A . 49 TRP HZ2 1 1 1 740 1 1 49 TRP HZ3 H -14.685 -1.403 7.129 1.00 . A A . 49 TRP HZ3 1 1 1 741 1 1 49 TRP N N -9.643 -5.342 3.618 1.00 . A A . 49 TRP N 1 1 1 742 1 1 49 TRP NE1 N -12.111 -5.534 8.874 1.00 . A A . 49 TRP NE1 1 1 1 743 1 1 49 TRP O O -12.263 -7.207 4.778 1.00 . A A . 49 TRP O 1 1 1 744 1 1 50 TRP C C -14.419 -6.077 2.315 1.00 . A A . 50 TRP C 1 1 1 745 1 1 50 TRP CA C -14.011 -5.419 3.633 1.00 . A A . 50 TRP CA 1 1 1 746 1 1 50 TRP CB C -14.731 -4.084 3.799 1.00 . A A . 50 TRP CB 1 1 1 747 1 1 50 TRP CD1 C -16.920 -4.611 5.015 1.00 . A A . 50 TRP CD1 1 1 1 748 1 1 50 TRP CD2 C -17.186 -3.952 2.893 1.00 . A A . 50 TRP CD2 1 1 1 749 1 1 50 TRP CE2 C -18.455 -4.210 3.444 1.00 . A A . 50 TRP CE2 1 1 1 750 1 1 50 TRP CE3 C -17.102 -3.522 1.565 1.00 . A A . 50 TRP CE3 1 1 1 751 1 1 50 TRP CG C -16.219 -4.217 3.915 1.00 . A A . 50 TRP CG 1 1 1 752 1 1 50 TRP CH2 C -19.517 -3.630 1.416 1.00 . A A . 50 TRP CH2 1 1 1 753 1 1 50 TRP CZ2 C -19.629 -4.051 2.712 1.00 . A A . 50 TRP CZ2 1 1 1 754 1 1 50 TRP CZ3 C -18.268 -3.366 0.841 1.00 . A A . 50 TRP CZ3 1 1 1 755 1 1 50 TRP H H -12.138 -4.474 3.313 1.00 . A A . 50 TRP H 1 1 1 756 1 1 50 TRP HA H -14.319 -6.068 4.439 1.00 . A A . 50 TRP HA 1 1 1 757 1 1 50 TRP HB2 H -14.368 -3.598 4.693 1.00 . A A . 50 TRP HB2 1 1 1 758 1 1 50 TRP HB3 H -14.516 -3.459 2.944 1.00 . A A . 50 TRP HB3 1 1 1 759 1 1 50 TRP HD1 H -16.469 -4.887 5.958 1.00 . A A . 50 TRP HD1 1 1 1 760 1 1 50 TRP HE1 H -18.977 -4.861 5.377 1.00 . A A . 50 TRP HE1 1 1 1 761 1 1 50 TRP HE3 H -16.149 -3.312 1.105 1.00 . A A . 50 TRP HE3 1 1 1 762 1 1 50 TRP HH2 H -20.404 -3.494 0.812 1.00 . A A . 50 TRP HH2 1 1 1 763 1 1 50 TRP HZ2 H -20.600 -4.250 3.141 1.00 . A A . 50 TRP HZ2 1 1 1 764 1 1 50 TRP HZ3 H -18.222 -3.034 -0.187 1.00 . A A . 50 TRP HZ3 1 1 1 765 1 1 50 TRP N N -12.572 -5.236 3.760 1.00 . A A . 50 TRP N 1 1 1 766 1 1 50 TRP NE1 N -18.264 -4.611 4.741 1.00 . A A . 50 TRP NE1 1 1 1 767 1 1 50 TRP O O -15.167 -7.056 2.315 1.00 . A A . 50 TRP O 1 1 1 768 1 1 51 GLU C C -14.115 -7.378 -0.449 1.00 . A A . 51 GLU C 1 1 1 769 1 1 51 GLU CA C -14.440 -5.935 -0.110 1.00 . A A . 51 GLU CA 1 1 1 770 1 1 51 GLU CB C -13.915 -5.013 -1.211 1.00 . A A . 51 GLU CB 1 1 1 771 1 1 51 GLU CD C -14.492 -2.970 -2.547 1.00 . A A . 51 GLU CD 1 1 1 772 1 1 51 GLU CG C -14.530 -3.637 -1.187 1.00 . A A . 51 GLU CG 1 1 1 773 1 1 51 GLU H H -13.191 -4.901 1.256 1.00 . A A . 51 GLU H 1 1 1 774 1 1 51 GLU HA H -15.512 -5.837 -0.070 1.00 . A A . 51 GLU HA 1 1 1 775 1 1 51 GLU HB2 H -12.846 -4.892 -1.093 1.00 . A A . 51 GLU HB2 1 1 1 776 1 1 51 GLU HB3 H -14.118 -5.461 -2.173 1.00 . A A . 51 GLU HB3 1 1 1 777 1 1 51 GLU HG2 H -15.557 -3.716 -0.863 1.00 . A A . 51 GLU HG2 1 1 1 778 1 1 51 GLU HG3 H -13.970 -3.035 -0.485 1.00 . A A . 51 GLU HG3 1 1 1 779 1 1 51 GLU N N -13.925 -5.548 1.199 1.00 . A A . 51 GLU N 1 1 1 780 1 1 51 GLU O O -14.991 -8.139 -0.859 1.00 . A A . 51 GLU O 1 1 1 781 1 1 51 GLU OE1 O -13.957 -3.580 -3.497 1.00 . A A . 51 GLU OE1 1 1 1 782 1 1 51 GLU OE2 O -15.011 -1.844 -2.686 1.00 . A A . 51 GLU OE2 1 1 1 783 1 1 52 LEU C C -12.368 -10.001 0.538 1.00 . A A . 52 LEU C 1 1 1 784 1 1 52 LEU CA C -12.447 -9.100 -0.662 1.00 . A A . 52 LEU CA 1 1 1 785 1 1 52 LEU CB C -11.089 -9.077 -1.339 1.00 . A A . 52 LEU CB 1 1 1 786 1 1 52 LEU CD1 C -9.657 -8.319 -3.230 1.00 . A A . 52 LEU CD1 1 1 1 787 1 1 52 LEU CD2 C -12.152 -8.335 -3.478 1.00 . A A . 52 LEU CD2 1 1 1 788 1 1 52 LEU CG C -10.988 -8.133 -2.518 1.00 . A A . 52 LEU CG 1 1 1 789 1 1 52 LEU H H -12.201 -7.119 0.076 1.00 . A A . 52 LEU H 1 1 1 790 1 1 52 LEU HA H -13.176 -9.496 -1.347 1.00 . A A . 52 LEU HA 1 1 1 791 1 1 52 LEU HB2 H -10.357 -8.777 -0.602 1.00 . A A . 52 LEU HB2 1 1 1 792 1 1 52 LEU HB3 H -10.856 -10.077 -1.677 1.00 . A A . 52 LEU HB3 1 1 1 793 1 1 52 LEU HD11 H -9.597 -7.639 -4.066 1.00 . A A . 52 LEU HD11 1 1 1 794 1 1 52 LEU HD12 H -8.850 -8.115 -2.541 1.00 . A A . 52 LEU HD12 1 1 1 795 1 1 52 LEU HD13 H -9.577 -9.336 -3.587 1.00 . A A . 52 LEU HD13 1 1 1 796 1 1 52 LEU HD21 H -12.063 -7.645 -4.304 1.00 . A A . 52 LEU HD21 1 1 1 797 1 1 52 LEU HD22 H -12.139 -9.348 -3.855 1.00 . A A . 52 LEU HD22 1 1 1 798 1 1 52 LEU HD23 H -13.082 -8.155 -2.958 1.00 . A A . 52 LEU HD23 1 1 1 799 1 1 52 LEU HG H -11.035 -7.120 -2.131 1.00 . A A . 52 LEU HG 1 1 1 800 1 1 52 LEU N N -12.861 -7.755 -0.292 1.00 . A A . 52 LEU N 1 1 1 801 1 1 52 LEU O O -12.649 -11.197 0.447 1.00 . A A . 52 LEU O 1 1 1 802 1 1 53 ARG C C -12.988 -10.312 3.715 1.00 . A A . 53 ARG C 1 1 1 803 1 1 53 ARG CA C -11.735 -10.250 2.840 1.00 . A A . 53 ARG CA 1 1 1 804 1 1 53 ARG CB C -10.556 -9.707 3.641 1.00 . A A . 53 ARG CB 1 1 1 805 1 1 53 ARG CD C -9.556 -10.125 5.901 1.00 . A A . 53 ARG CD 1 1 1 806 1 1 53 ARG CG C -9.916 -10.735 4.560 1.00 . A A . 53 ARG CG 1 1 1 807 1 1 53 ARG CZ C -10.823 -9.570 7.945 1.00 . A A . 53 ARG CZ 1 1 1 808 1 1 53 ARG H H -11.797 -8.455 1.665 1.00 . A A . 53 ARG H 1 1 1 809 1 1 53 ARG HA H -11.499 -11.250 2.509 1.00 . A A . 53 ARG HA 1 1 1 810 1 1 53 ARG HB2 H -9.802 -9.350 2.955 1.00 . A A . 53 ARG HB2 1 1 1 811 1 1 53 ARG HB3 H -10.900 -8.880 4.246 1.00 . A A . 53 ARG HB3 1 1 1 812 1 1 53 ARG HD2 H -9.031 -10.861 6.494 1.00 . A A . 53 ARG HD2 1 1 1 813 1 1 53 ARG HD3 H -8.915 -9.269 5.737 1.00 . A A . 53 ARG HD3 1 1 1 814 1 1 53 ARG HE H -11.554 -9.488 6.079 1.00 . A A . 53 ARG HE 1 1 1 815 1 1 53 ARG HG2 H -10.613 -11.545 4.720 1.00 . A A . 53 ARG HG2 1 1 1 816 1 1 53 ARG HG3 H -9.018 -11.115 4.092 1.00 . A A . 53 ARG HG3 1 1 1 817 1 1 53 ARG HH11 H -8.926 -10.195 8.277 1.00 . A A . 53 ARG HH11 1 1 1 818 1 1 53 ARG HH12 H -9.823 -9.766 9.701 1.00 . A A . 53 ARG HH12 1 1 1 819 1 1 53 ARG HH21 H -12.765 -8.977 7.941 1.00 . A A . 53 ARG HH21 1 1 1 820 1 1 53 ARG HH22 H -12.020 -9.080 9.511 1.00 . A A . 53 ARG HH22 1 1 1 821 1 1 53 ARG N N -11.959 -9.436 1.650 1.00 . A A . 53 ARG N 1 1 1 822 1 1 53 ARG NE N -10.751 -9.694 6.624 1.00 . A A . 53 ARG NE 1 1 1 823 1 1 53 ARG NH1 N -9.774 -9.868 8.700 1.00 . A A . 53 ARG NH1 1 1 1 824 1 1 53 ARG NH2 N -11.957 -9.176 8.511 1.00 . A A . 53 ARG NH2 1 1 1 825 1 1 53 ARG O O -14.062 -10.678 3.195 1.00 . A A . 53 ARG O 1 1 1 826 1 1 53 ARG OXT O -12.888 -10.029 4.929 1.00 . A A . 53 ARG OXT 1 1 2 827 1 1 1 ASN C C 16.689 -1.584 2.600 1.00 . A A . 1 ASN C 1 1 2 828 1 1 1 ASN CA C 17.487 -1.023 1.429 1.00 . A A . 1 ASN CA 1 1 2 829 1 1 1 ASN CB C 16.558 -0.833 0.226 1.00 . A A . 1 ASN CB 1 1 2 830 1 1 1 ASN CG C 17.249 -0.233 -0.980 1.00 . A A . 1 ASN CG 1 1 2 831 1 1 1 ASN H1 H 19.285 -1.960 1.904 1.00 . A A . 1 ASN H1 1 1 2 832 1 1 1 ASN H2 H 19.130 -1.575 0.258 1.00 . A A . 1 ASN H2 1 1 2 833 1 1 1 ASN H3 H 18.273 -2.886 0.911 1.00 . A A . 1 ASN H3 1 1 2 834 1 1 1 ASN HA H 17.892 -0.063 1.719 1.00 . A A . 1 ASN HA 1 1 2 835 1 1 1 ASN HB2 H 16.157 -1.794 -0.061 1.00 . A A . 1 ASN HB2 1 1 2 836 1 1 1 ASN HB3 H 15.742 -0.183 0.510 1.00 . A A . 1 ASN HB3 1 1 2 837 1 1 1 ASN HD21 H 16.833 1.609 -0.349 1.00 . A A . 1 ASN HD21 1 1 2 838 1 1 1 ASN HD22 H 17.693 1.502 -1.852 1.00 . A A . 1 ASN HD22 1 1 2 839 1 1 1 ASN N N 18.617 -1.921 1.099 1.00 . A A . 1 ASN N 1 1 2 840 1 1 1 ASN ND2 N 17.261 1.090 -1.065 1.00 . A A . 1 ASN ND2 1 1 2 841 1 1 1 ASN O O 16.713 -1.029 3.695 1.00 . A A . 1 ASN O 1 1 2 842 1 1 1 ASN OD1 O 17.760 -0.954 -1.830 1.00 . A A . 1 ASN OD1 1 1 2 843 1 1 2 SER C C 14.106 -2.413 3.936 1.00 . A A . 2 SER C 1 1 2 844 1 1 2 SER CA C 15.145 -3.365 3.347 1.00 . A A . 2 SER CA 1 1 2 845 1 1 2 SER CB C 15.985 -4.049 4.447 1.00 . A A . 2 SER CB 1 1 2 846 1 1 2 SER H H 16.023 -3.076 1.451 1.00 . A A . 2 SER H 1 1 2 847 1 1 2 SER HA H 14.603 -4.137 2.815 1.00 . A A . 2 SER HA 1 1 2 848 1 1 2 SER HB2 H 15.320 -4.488 5.176 1.00 . A A . 2 SER HB2 1 1 2 849 1 1 2 SER HB3 H 16.581 -4.831 3.997 1.00 . A A . 2 SER HB3 1 1 2 850 1 1 2 SER HG H 16.755 -2.262 4.737 1.00 . A A . 2 SER HG 1 1 2 851 1 1 2 SER N N 15.986 -2.694 2.350 1.00 . A A . 2 SER N 1 1 2 852 1 1 2 SER O O 14.236 -1.950 5.070 1.00 . A A . 2 SER O 1 1 2 853 1 1 2 SER OG O 16.854 -3.149 5.119 1.00 . A A . 2 SER OG 1 1 2 854 1 1 3 ASP C C 12.437 0.055 4.143 1.00 . A A . 3 ASP C 1 1 2 855 1 1 3 ASP CA C 11.960 -1.265 3.533 1.00 . A A . 3 ASP CA 1 1 2 856 1 1 3 ASP CB C 11.051 -2.001 4.526 1.00 . A A . 3 ASP CB 1 1 2 857 1 1 3 ASP CG C 10.486 -3.289 3.962 1.00 . A A . 3 ASP CG 1 1 2 858 1 1 3 ASP H H 13.052 -2.537 2.237 1.00 . A A . 3 ASP H 1 1 2 859 1 1 3 ASP HA H 11.386 -1.042 2.645 1.00 . A A . 3 ASP HA 1 1 2 860 1 1 3 ASP HB2 H 11.620 -2.241 5.411 1.00 . A A . 3 ASP HB2 1 1 2 861 1 1 3 ASP HB3 H 10.229 -1.355 4.797 1.00 . A A . 3 ASP HB3 1 1 2 862 1 1 3 ASP N N 13.077 -2.126 3.131 1.00 . A A . 3 ASP N 1 1 2 863 1 1 3 ASP O O 11.864 0.537 5.119 1.00 . A A . 3 ASP O 1 1 2 864 1 1 3 ASP OD1 O 10.506 -3.459 2.724 1.00 . A A . 3 ASP OD1 1 1 2 865 1 1 3 ASP OD2 O 10.024 -4.139 4.752 1.00 . A A . 3 ASP OD2 1 1 2 866 1 1 4 SER C C 13.487 3.100 3.376 1.00 . A A . 4 SER C 1 1 2 867 1 1 4 SER CA C 14.047 1.875 4.093 1.00 . A A . 4 SER CA 1 1 2 868 1 1 4 SER CB C 15.568 1.849 3.962 1.00 . A A . 4 SER CB 1 1 2 869 1 1 4 SER H H 13.893 0.221 2.784 1.00 . A A . 4 SER H 1 1 2 870 1 1 4 SER HA H 13.788 1.934 5.139 1.00 . A A . 4 SER HA 1 1 2 871 1 1 4 SER HB2 H 15.970 2.801 4.274 1.00 . A A . 4 SER HB2 1 1 2 872 1 1 4 SER HB3 H 15.969 1.065 4.584 1.00 . A A . 4 SER HB3 1 1 2 873 1 1 4 SER HG H 15.961 2.454 2.124 1.00 . A A . 4 SER HG 1 1 2 874 1 1 4 SER N N 13.482 0.637 3.567 1.00 . A A . 4 SER N 1 1 2 875 1 1 4 SER O O 13.230 4.130 4.003 1.00 . A A . 4 SER O 1 1 2 876 1 1 4 SER OG O 15.955 1.607 2.615 1.00 . A A . 4 SER OG 1 1 2 877 1 1 5 GLU C C 11.344 4.302 1.448 1.00 . A A . 5 GLU C 1 1 2 878 1 1 5 GLU CA C 12.839 4.099 1.244 1.00 . A A . 5 GLU CA 1 1 2 879 1 1 5 GLU CB C 13.126 3.828 -0.236 1.00 . A A . 5 GLU CB 1 1 2 880 1 1 5 GLU CD C 15.641 4.031 0.036 1.00 . A A . 5 GLU CD 1 1 2 881 1 1 5 GLU CG C 14.492 3.209 -0.508 1.00 . A A . 5 GLU CG 1 1 2 882 1 1 5 GLU H H 13.476 2.121 1.639 1.00 . A A . 5 GLU H 1 1 2 883 1 1 5 GLU HA H 13.365 4.989 1.558 1.00 . A A . 5 GLU HA 1 1 2 884 1 1 5 GLU HB2 H 12.371 3.158 -0.618 1.00 . A A . 5 GLU HB2 1 1 2 885 1 1 5 GLU HB3 H 13.068 4.762 -0.775 1.00 . A A . 5 GLU HB3 1 1 2 886 1 1 5 GLU HG2 H 14.525 2.232 -0.048 1.00 . A A . 5 GLU HG2 1 1 2 887 1 1 5 GLU HG3 H 14.617 3.105 -1.576 1.00 . A A . 5 GLU HG3 1 1 2 888 1 1 5 GLU N N 13.299 2.981 2.067 1.00 . A A . 5 GLU N 1 1 2 889 1 1 5 GLU O O 10.527 3.888 0.622 1.00 . A A . 5 GLU O 1 1 2 890 1 1 5 GLU OE1 O 16.034 5.017 -0.614 1.00 . A A . 5 GLU OE1 1 1 2 891 1 1 5 GLU OE2 O 16.173 3.673 1.107 1.00 . A A . 5 GLU OE2 1 1 2 892 1 1 6 CYS C C 8.894 6.255 2.333 1.00 . A A . 6 CYS C 1 1 2 893 1 1 6 CYS CA C 9.579 5.015 2.912 1.00 . A A . 6 CYS CA 1 1 2 894 1 1 6 CYS CB C 9.409 4.946 4.429 1.00 . A A . 6 CYS CB 1 1 2 895 1 1 6 CYS H H 11.661 5.333 3.126 1.00 . A A . 6 CYS H 1 1 2 896 1 1 6 CYS HA H 9.095 4.149 2.487 1.00 . A A . 6 CYS HA 1 1 2 897 1 1 6 CYS HB2 H 10.293 4.504 4.869 1.00 . A A . 6 CYS HB2 1 1 2 898 1 1 6 CYS HB3 H 9.277 5.945 4.819 1.00 . A A . 6 CYS HB3 1 1 2 899 1 1 6 CYS N N 10.977 4.928 2.546 1.00 . A A . 6 CYS N 1 1 2 900 1 1 6 CYS O O 7.945 6.109 1.569 1.00 . A A . 6 CYS O 1 1 2 901 1 1 6 CYS SG S 7.972 3.954 4.942 1.00 . A A . 6 CYS SG 1 1 2 902 1 1 7 PRO C C 8.693 8.918 0.707 1.00 . A A . 7 PRO C 1 1 2 903 1 1 7 PRO CA C 8.650 8.704 2.224 1.00 . A A . 7 PRO CA 1 1 2 904 1 1 7 PRO CB C 9.369 9.839 2.972 1.00 . A A . 7 PRO CB 1 1 2 905 1 1 7 PRO CD C 10.539 7.813 3.449 1.00 . A A . 7 PRO CD 1 1 2 906 1 1 7 PRO CG C 10.202 9.162 4.009 1.00 . A A . 7 PRO CG 1 1 2 907 1 1 7 PRO HA H 7.615 8.680 2.534 1.00 . A A . 7 PRO HA 1 1 2 908 1 1 7 PRO HB2 H 9.979 10.403 2.282 1.00 . A A . 7 PRO HB2 1 1 2 909 1 1 7 PRO HB3 H 8.638 10.493 3.424 1.00 . A A . 7 PRO HB3 1 1 2 910 1 1 7 PRO HD2 H 11.417 7.869 2.822 1.00 . A A . 7 PRO HD2 1 1 2 911 1 1 7 PRO HD3 H 10.682 7.093 4.242 1.00 . A A . 7 PRO HD3 1 1 2 912 1 1 7 PRO HG2 H 11.103 9.732 4.185 1.00 . A A . 7 PRO HG2 1 1 2 913 1 1 7 PRO HG3 H 9.637 9.058 4.923 1.00 . A A . 7 PRO HG3 1 1 2 914 1 1 7 PRO N N 9.345 7.488 2.656 1.00 . A A . 7 PRO N 1 1 2 915 1 1 7 PRO O O 7.767 8.517 0.001 1.00 . A A . 7 PRO O 1 1 2 916 1 1 8 LEU C C 9.538 8.809 -2.179 1.00 . A A . 8 LEU C 1 1 2 917 1 1 8 LEU CA C 9.880 9.924 -1.193 1.00 . A A . 8 LEU CA 1 1 2 918 1 1 8 LEU CB C 11.286 10.454 -1.486 1.00 . A A . 8 LEU CB 1 1 2 919 1 1 8 LEU CD1 C 10.636 12.290 -3.073 1.00 . A A . 8 LEU CD1 1 1 2 920 1 1 8 LEU CD2 C 12.955 11.359 -3.119 1.00 . A A . 8 LEU CD2 1 1 2 921 1 1 8 LEU CG C 11.488 11.042 -2.884 1.00 . A A . 8 LEU CG 1 1 2 922 1 1 8 LEU H H 10.592 9.570 0.777 1.00 . A A . 8 LEU H 1 1 2 923 1 1 8 LEU HA H 9.172 10.727 -1.320 1.00 . A A . 8 LEU HA 1 1 2 924 1 1 8 LEU HB2 H 11.515 11.219 -0.760 1.00 . A A . 8 LEU HB2 1 1 2 925 1 1 8 LEU HB3 H 11.986 9.641 -1.360 1.00 . A A . 8 LEU HB3 1 1 2 926 1 1 8 LEU HD11 H 10.807 12.698 -4.060 1.00 . A A . 8 LEU HD11 1 1 2 927 1 1 8 LEU HD12 H 9.592 12.036 -2.963 1.00 . A A . 8 LEU HD12 1 1 2 928 1 1 8 LEU HD13 H 10.906 13.025 -2.329 1.00 . A A . 8 LEU HD13 1 1 2 929 1 1 8 LEU HD21 H 13.285 12.088 -2.394 1.00 . A A . 8 LEU HD21 1 1 2 930 1 1 8 LEU HD22 H 13.541 10.458 -3.015 1.00 . A A . 8 LEU HD22 1 1 2 931 1 1 8 LEU HD23 H 13.081 11.759 -4.113 1.00 . A A . 8 LEU HD23 1 1 2 932 1 1 8 LEU HG H 11.181 10.312 -3.621 1.00 . A A . 8 LEU HG 1 1 2 933 1 1 8 LEU N N 9.796 9.473 0.201 1.00 . A A . 8 LEU N 1 1 2 934 1 1 8 LEU O O 9.163 9.069 -3.323 1.00 . A A . 8 LEU O 1 1 2 935 1 1 9 SER C C 7.978 5.940 -2.426 1.00 . A A . 9 SER C 1 1 2 936 1 1 9 SER CA C 9.410 6.439 -2.583 1.00 . A A . 9 SER CA 1 1 2 937 1 1 9 SER CB C 10.405 5.318 -2.263 1.00 . A A . 9 SER CB 1 1 2 938 1 1 9 SER H H 9.869 7.430 -0.787 1.00 . A A . 9 SER H 1 1 2 939 1 1 9 SER HA H 9.559 6.757 -3.604 1.00 . A A . 9 SER HA 1 1 2 940 1 1 9 SER HB2 H 11.412 5.682 -2.396 1.00 . A A . 9 SER HB2 1 1 2 941 1 1 9 SER HB3 H 10.269 5.005 -1.239 1.00 . A A . 9 SER HB3 1 1 2 942 1 1 9 SER HG H 10.574 4.394 -3.981 1.00 . A A . 9 SER HG 1 1 2 943 1 1 9 SER N N 9.651 7.575 -1.727 1.00 . A A . 9 SER N 1 1 2 944 1 1 9 SER O O 7.249 5.818 -3.402 1.00 . A A . 9 SER O 1 1 2 945 1 1 9 SER OG O 10.213 4.196 -3.109 1.00 . A A . 9 SER OG 1 1 2 946 1 1 10 HIS C C 5.225 5.949 -0.508 1.00 . A A . 10 HIS C 1 1 2 947 1 1 10 HIS CA C 6.296 4.985 -0.976 1.00 . A A . 10 HIS CA 1 1 2 948 1 1 10 HIS CB C 6.433 3.790 -0.039 1.00 . A A . 10 HIS CB 1 1 2 949 1 1 10 HIS CD2 C 7.980 2.316 -1.507 1.00 . A A . 10 HIS CD2 1 1 2 950 1 1 10 HIS CE1 C 6.763 0.498 -1.528 1.00 . A A . 10 HIS CE1 1 1 2 951 1 1 10 HIS CG C 6.877 2.556 -0.759 1.00 . A A . 10 HIS CG 1 1 2 952 1 1 10 HIS H H 8.095 5.975 -0.422 1.00 . A A . 10 HIS H 1 1 2 953 1 1 10 HIS HA H 5.989 4.613 -1.941 1.00 . A A . 10 HIS HA 1 1 2 954 1 1 10 HIS HB2 H 7.163 4.014 0.726 1.00 . A A . 10 HIS HB2 1 1 2 955 1 1 10 HIS HB3 H 5.479 3.583 0.425 1.00 . A A . 10 HIS HB3 1 1 2 956 1 1 10 HIS HD1 H 5.273 1.250 -0.340 1.00 . A A . 10 HIS HD1 1 1 2 957 1 1 10 HIS HD2 H 8.788 3.009 -1.694 1.00 . A A . 10 HIS HD2 1 1 2 958 1 1 10 HIS HE1 H 6.416 -0.505 -1.732 1.00 . A A . 10 HIS HE1 1 1 2 959 1 1 10 HIS HE2 H 8.450 0.640 -2.676 1.00 . A A . 10 HIS HE2 1 1 2 960 1 1 10 HIS N N 7.574 5.649 -1.195 1.00 . A A . 10 HIS N 1 1 2 961 1 1 10 HIS ND1 N 6.135 1.396 -0.791 1.00 . A A . 10 HIS ND1 1 1 2 962 1 1 10 HIS NE2 N 7.883 1.031 -1.975 1.00 . A A . 10 HIS NE2 1 1 2 963 1 1 10 HIS O O 4.213 6.102 -1.163 1.00 . A A . 10 HIS O 1 1 2 964 1 1 11 ASP C C 4.254 8.684 0.084 1.00 . A A . 11 ASP C 1 1 2 965 1 1 11 ASP CA C 4.552 7.621 1.150 1.00 . A A . 11 ASP CA 1 1 2 966 1 1 11 ASP CB C 5.196 8.272 2.375 1.00 . A A . 11 ASP CB 1 1 2 967 1 1 11 ASP CG C 4.388 9.430 2.931 1.00 . A A . 11 ASP CG 1 1 2 968 1 1 11 ASP H H 6.228 6.317 1.173 1.00 . A A . 11 ASP H 1 1 2 969 1 1 11 ASP HA H 3.627 7.153 1.446 1.00 . A A . 11 ASP HA 1 1 2 970 1 1 11 ASP HB2 H 5.304 7.529 3.149 1.00 . A A . 11 ASP HB2 1 1 2 971 1 1 11 ASP HB3 H 6.176 8.640 2.102 1.00 . A A . 11 ASP HB3 1 1 2 972 1 1 11 ASP N N 5.447 6.576 0.635 1.00 . A A . 11 ASP N 1 1 2 973 1 1 11 ASP O O 3.204 9.327 0.102 1.00 . A A . 11 ASP O 1 1 2 974 1 1 11 ASP OD1 O 3.486 9.188 3.757 1.00 . A A . 11 ASP OD1 1 1 2 975 1 1 11 ASP OD2 O 4.669 10.588 2.557 1.00 . A A . 11 ASP OD2 1 1 2 976 1 1 12 GLY C C 4.316 9.227 -3.127 1.00 . A A . 12 GLY C 1 1 2 977 1 1 12 GLY CA C 5.010 9.816 -1.916 1.00 . A A . 12 GLY CA 1 1 2 978 1 1 12 GLY H H 5.990 8.303 -0.810 1.00 . A A . 12 GLY H 1 1 2 979 1 1 12 GLY HA2 H 4.423 10.645 -1.547 1.00 . A A . 12 GLY HA2 1 1 2 980 1 1 12 GLY HA3 H 5.982 10.183 -2.213 1.00 . A A . 12 GLY HA3 1 1 2 981 1 1 12 GLY N N 5.178 8.848 -0.850 1.00 . A A . 12 GLY N 1 1 2 982 1 1 12 GLY O O 3.707 9.946 -3.917 1.00 . A A . 12 GLY O 1 1 2 983 1 1 13 TYR C C 2.354 6.803 -3.963 1.00 . A A . 13 TYR C 1 1 2 984 1 1 13 TYR CA C 3.767 7.208 -4.372 1.00 . A A . 13 TYR CA 1 1 2 985 1 1 13 TYR CB C 4.592 5.971 -4.734 1.00 . A A . 13 TYR CB 1 1 2 986 1 1 13 TYR CD1 C 4.166 6.007 -7.225 1.00 . A A . 13 TYR CD1 1 1 2 987 1 1 13 TYR CD2 C 3.888 3.945 -6.065 1.00 . A A . 13 TYR CD2 1 1 2 988 1 1 13 TYR CE1 C 3.825 5.388 -8.413 1.00 . A A . 13 TYR CE1 1 1 2 989 1 1 13 TYR CE2 C 3.551 3.319 -7.249 1.00 . A A . 13 TYR CE2 1 1 2 990 1 1 13 TYR CG C 4.202 5.297 -6.033 1.00 . A A . 13 TYR CG 1 1 2 991 1 1 13 TYR CZ C 3.521 4.043 -8.419 1.00 . A A . 13 TYR CZ 1 1 2 992 1 1 13 TYR H H 4.931 7.402 -2.615 1.00 . A A . 13 TYR H 1 1 2 993 1 1 13 TYR HA H 3.717 7.870 -5.223 1.00 . A A . 13 TYR HA 1 1 2 994 1 1 13 TYR HB2 H 5.631 6.255 -4.812 1.00 . A A . 13 TYR HB2 1 1 2 995 1 1 13 TYR HB3 H 4.488 5.244 -3.942 1.00 . A A . 13 TYR HB3 1 1 2 996 1 1 13 TYR HD1 H 4.404 7.061 -7.216 1.00 . A A . 13 TYR HD1 1 1 2 997 1 1 13 TYR HD2 H 3.912 3.379 -5.146 1.00 . A A . 13 TYR HD2 1 1 2 998 1 1 13 TYR HE1 H 3.805 5.959 -9.331 1.00 . A A . 13 TYR HE1 1 1 2 999 1 1 13 TYR HE2 H 3.309 2.265 -7.253 1.00 . A A . 13 TYR HE2 1 1 2 1000 1 1 13 TYR HH H 2.492 2.759 -9.437 1.00 . A A . 13 TYR HH 1 1 2 1001 1 1 13 TYR N N 4.411 7.916 -3.271 1.00 . A A . 13 TYR N 1 1 2 1002 1 1 13 TYR O O 1.437 6.756 -4.778 1.00 . A A . 13 TYR O 1 1 2 1003 1 1 13 TYR OH O 3.189 3.422 -9.601 1.00 . A A . 13 TYR OH 1 1 2 1004 1 1 14 CYS C C 0.167 7.360 -1.635 1.00 . A A . 14 CYS C 1 1 2 1005 1 1 14 CYS CA C 0.922 6.123 -2.125 1.00 . A A . 14 CYS CA 1 1 2 1006 1 1 14 CYS CB C 1.181 5.116 -1.008 1.00 . A A . 14 CYS CB 1 1 2 1007 1 1 14 CYS H H 2.972 6.591 -2.086 1.00 . A A . 14 CYS H 1 1 2 1008 1 1 14 CYS HA H 0.347 5.649 -2.909 1.00 . A A . 14 CYS HA 1 1 2 1009 1 1 14 CYS HB2 H 1.698 5.603 -0.189 1.00 . A A . 14 CYS HB2 1 1 2 1010 1 1 14 CYS HB3 H 0.240 4.718 -0.657 1.00 . A A . 14 CYS HB3 1 1 2 1011 1 1 14 CYS N N 2.195 6.524 -2.686 1.00 . A A . 14 CYS N 1 1 2 1012 1 1 14 CYS O O 0.699 8.467 -1.688 1.00 . A A . 14 CYS O 1 1 2 1013 1 1 14 CYS SG S 2.209 3.715 -1.551 1.00 . A A . 14 CYS SG 1 1 2 1014 1 1 15 LEU C C -2.427 8.536 0.427 1.00 . A A . 15 LEU C 1 1 2 1015 1 1 15 LEU CA C -1.947 8.346 -0.998 1.00 . A A . 15 LEU CA 1 1 2 1016 1 1 15 LEU CB C -3.165 8.231 -1.918 1.00 . A A . 15 LEU CB 1 1 2 1017 1 1 15 LEU CD1 C -4.132 7.874 -4.196 1.00 . A A . 15 LEU CD1 1 1 2 1018 1 1 15 LEU CD2 C -1.952 9.054 -3.954 1.00 . A A . 15 LEU CD2 1 1 2 1019 1 1 15 LEU CG C -2.849 7.966 -3.386 1.00 . A A . 15 LEU CG 1 1 2 1020 1 1 15 LEU H H -1.376 6.305 -0.898 1.00 . A A . 15 LEU H 1 1 2 1021 1 1 15 LEU HA H -1.389 9.218 -1.284 1.00 . A A . 15 LEU HA 1 1 2 1022 1 1 15 LEU HB2 H -3.788 7.425 -1.554 1.00 . A A . 15 LEU HB2 1 1 2 1023 1 1 15 LEU HB3 H -3.726 9.151 -1.853 1.00 . A A . 15 LEU HB3 1 1 2 1024 1 1 15 LEU HD11 H -4.686 8.796 -4.098 1.00 . A A . 15 LEU HD11 1 1 2 1025 1 1 15 LEU HD12 H -3.889 7.707 -5.234 1.00 . A A . 15 LEU HD12 1 1 2 1026 1 1 15 LEU HD13 H -4.732 7.053 -3.831 1.00 . A A . 15 LEU HD13 1 1 2 1027 1 1 15 LEU HD21 H -1.752 8.848 -4.996 1.00 . A A . 15 LEU HD21 1 1 2 1028 1 1 15 LEU HD22 H -2.447 10.011 -3.868 1.00 . A A . 15 LEU HD22 1 1 2 1029 1 1 15 LEU HD23 H -1.021 9.081 -3.408 1.00 . A A . 15 LEU HD23 1 1 2 1030 1 1 15 LEU HG H -2.327 7.020 -3.456 1.00 . A A . 15 LEU HG 1 1 2 1031 1 1 15 LEU N N -1.067 7.192 -1.163 1.00 . A A . 15 LEU N 1 1 2 1032 1 1 15 LEU O O -1.979 9.435 1.127 1.00 . A A . 15 LEU O 1 1 2 1033 1 1 16 HIS C C -3.553 7.299 3.299 1.00 . A A . 16 HIS C 1 1 2 1034 1 1 16 HIS CA C -4.100 7.982 2.072 1.00 . A A . 16 HIS CA 1 1 2 1035 1 1 16 HIS CB C -5.578 7.645 1.886 1.00 . A A . 16 HIS CB 1 1 2 1036 1 1 16 HIS CD2 C -6.880 9.267 0.335 1.00 . A A . 16 HIS CD2 1 1 2 1037 1 1 16 HIS CE1 C -7.520 10.703 1.855 1.00 . A A . 16 HIS CE1 1 1 2 1038 1 1 16 HIS CG C -6.406 8.836 1.528 1.00 . A A . 16 HIS CG 1 1 2 1039 1 1 16 HIS H H -3.425 6.790 0.422 1.00 . A A . 16 HIS H 1 1 2 1040 1 1 16 HIS HA H -4.013 9.044 2.230 1.00 . A A . 16 HIS HA 1 1 2 1041 1 1 16 HIS HB2 H -5.680 6.915 1.097 1.00 . A A . 16 HIS HB2 1 1 2 1042 1 1 16 HIS HB3 H -5.965 7.234 2.808 1.00 . A A . 16 HIS HB3 1 1 2 1043 1 1 16 HIS HD1 H -6.625 9.737 3.426 1.00 . A A . 16 HIS HD1 1 1 2 1044 1 1 16 HIS HD2 H -6.741 8.784 -0.623 1.00 . A A . 16 HIS HD2 1 1 2 1045 1 1 16 HIS HE1 H -7.970 11.558 2.338 1.00 . A A . 16 HIS HE1 1 1 2 1046 1 1 16 HIS HE2 H -7.823 11.082 -0.131 1.00 . A A . 16 HIS HE2 1 1 2 1047 1 1 16 HIS N N -3.323 7.671 0.872 1.00 . A A . 16 HIS N 1 1 2 1048 1 1 16 HIS ND1 N -6.824 9.760 2.458 1.00 . A A . 16 HIS ND1 1 1 2 1049 1 1 16 HIS NE2 N -7.568 10.431 0.565 1.00 . A A . 16 HIS NE2 1 1 2 1050 1 1 16 HIS O O -4.282 7.044 4.256 1.00 . A A . 16 HIS O 1 1 2 1051 1 1 17 ASP C C -0.135 6.088 3.908 1.00 . A A . 17 ASP C 1 1 2 1052 1 1 17 ASP CA C -1.533 6.443 4.370 1.00 . A A . 17 ASP CA 1 1 2 1053 1 1 17 ASP CB C -2.241 5.200 4.916 1.00 . A A . 17 ASP CB 1 1 2 1054 1 1 17 ASP CG C -1.666 4.734 6.238 1.00 . A A . 17 ASP CG 1 1 2 1055 1 1 17 ASP H H -1.763 7.302 2.459 1.00 . A A . 17 ASP H 1 1 2 1056 1 1 17 ASP HA H -1.459 7.183 5.148 1.00 . A A . 17 ASP HA 1 1 2 1057 1 1 17 ASP HB2 H -3.287 5.428 5.065 1.00 . A A . 17 ASP HB2 1 1 2 1058 1 1 17 ASP HB3 H -2.153 4.395 4.197 1.00 . A A . 17 ASP HB3 1 1 2 1059 1 1 17 ASP N N -2.260 7.043 3.261 1.00 . A A . 17 ASP N 1 1 2 1060 1 1 17 ASP O O 0.839 6.498 4.527 1.00 . A A . 17 ASP O 1 1 2 1061 1 1 17 ASP OD1 O -2.069 5.265 7.287 1.00 . A A . 17 ASP OD1 1 1 2 1062 1 1 17 ASP OD2 O -0.794 3.838 6.229 1.00 . A A . 17 ASP OD2 1 1 2 1063 1 1 18 GLY C C 2.215 4.341 3.134 1.00 . A A . 18 GLY C 1 1 2 1064 1 1 18 GLY CA C 1.205 4.975 2.177 1.00 . A A . 18 GLY CA 1 1 2 1065 1 1 18 GLY H H -0.910 5.177 2.291 1.00 . A A . 18 GLY H 1 1 2 1066 1 1 18 GLY HA2 H 0.984 4.247 1.405 1.00 . A A . 18 GLY HA2 1 1 2 1067 1 1 18 GLY HA3 H 1.663 5.837 1.712 1.00 . A A . 18 GLY HA3 1 1 2 1068 1 1 18 GLY N N -0.067 5.390 2.768 1.00 . A A . 18 GLY N 1 1 2 1069 1 1 18 GLY O O 2.826 5.011 3.964 1.00 . A A . 18 GLY O 1 1 2 1070 1 1 19 VAL C C 4.407 1.587 2.878 1.00 . A A . 19 VAL C 1 1 2 1071 1 1 19 VAL CA C 3.401 2.306 3.774 1.00 . A A . 19 VAL CA 1 1 2 1072 1 1 19 VAL CB C 2.694 1.292 4.713 1.00 . A A . 19 VAL CB 1 1 2 1073 1 1 19 VAL CG1 C 3.694 0.371 5.401 1.00 . A A . 19 VAL CG1 1 1 2 1074 1 1 19 VAL CG2 C 1.872 2.025 5.760 1.00 . A A . 19 VAL CG2 1 1 2 1075 1 1 19 VAL H H 1.985 2.597 2.218 1.00 . A A . 19 VAL H 1 1 2 1076 1 1 19 VAL HA H 3.933 3.023 4.387 1.00 . A A . 19 VAL HA 1 1 2 1077 1 1 19 VAL HB H 2.025 0.687 4.118 1.00 . A A . 19 VAL HB 1 1 2 1078 1 1 19 VAL HG11 H 4.253 -0.175 4.656 1.00 . A A . 19 VAL HG11 1 1 2 1079 1 1 19 VAL HG12 H 4.373 0.960 6.000 1.00 . A A . 19 VAL HG12 1 1 2 1080 1 1 19 VAL HG13 H 3.166 -0.326 6.037 1.00 . A A . 19 VAL HG13 1 1 2 1081 1 1 19 VAL HG21 H 1.356 1.307 6.380 1.00 . A A . 19 VAL HG21 1 1 2 1082 1 1 19 VAL HG22 H 2.523 2.630 6.372 1.00 . A A . 19 VAL HG22 1 1 2 1083 1 1 19 VAL HG23 H 1.148 2.660 5.269 1.00 . A A . 19 VAL HG23 1 1 2 1084 1 1 19 VAL N N 2.446 3.051 2.951 1.00 . A A . 19 VAL N 1 1 2 1085 1 1 19 VAL O O 4.062 1.138 1.784 1.00 . A A . 19 VAL O 1 1 2 1086 1 1 20 CYS C C 7.118 -0.463 2.877 1.00 . A A . 20 CYS C 1 1 2 1087 1 1 20 CYS CA C 6.736 0.973 2.521 1.00 . A A . 20 CYS CA 1 1 2 1088 1 1 20 CYS CB C 7.957 1.881 2.695 1.00 . A A . 20 CYS CB 1 1 2 1089 1 1 20 CYS H H 5.831 1.730 4.275 1.00 . A A . 20 CYS H 1 1 2 1090 1 1 20 CYS HA H 6.415 1.003 1.490 1.00 . A A . 20 CYS HA 1 1 2 1091 1 1 20 CYS HB2 H 8.782 1.476 2.129 1.00 . A A . 20 CYS HB2 1 1 2 1092 1 1 20 CYS HB3 H 7.720 2.868 2.320 1.00 . A A . 20 CYS HB3 1 1 2 1093 1 1 20 CYS N N 5.645 1.475 3.344 1.00 . A A . 20 CYS N 1 1 2 1094 1 1 20 CYS O O 7.363 -0.778 4.040 1.00 . A A . 20 CYS O 1 1 2 1095 1 1 20 CYS SG S 8.507 2.063 4.426 1.00 . A A . 20 CYS SG 1 1 2 1096 1 1 21 MET C C 8.035 -3.289 0.673 1.00 . A A . 21 MET C 1 1 2 1097 1 1 21 MET CA C 7.658 -2.692 2.031 1.00 . A A . 21 MET CA 1 1 2 1098 1 1 21 MET CB C 6.622 -3.570 2.743 1.00 . A A . 21 MET CB 1 1 2 1099 1 1 21 MET CE C 3.978 -3.339 4.523 1.00 . A A . 21 MET CE 1 1 2 1100 1 1 21 MET CG C 5.256 -3.566 2.079 1.00 . A A . 21 MET CG 1 1 2 1101 1 1 21 MET H H 6.776 -1.070 0.995 1.00 . A A . 21 MET H 1 1 2 1102 1 1 21 MET HA H 8.549 -2.636 2.641 1.00 . A A . 21 MET HA 1 1 2 1103 1 1 21 MET HB2 H 6.985 -4.587 2.763 1.00 . A A . 21 MET HB2 1 1 2 1104 1 1 21 MET HB3 H 6.507 -3.219 3.757 1.00 . A A . 21 MET HB3 1 1 2 1105 1 1 21 MET HE1 H 3.730 -2.325 4.241 1.00 . A A . 21 MET HE1 1 1 2 1106 1 1 21 MET HE2 H 3.242 -3.706 5.224 1.00 . A A . 21 MET HE2 1 1 2 1107 1 1 21 MET HE3 H 4.954 -3.357 4.984 1.00 . A A . 21 MET HE3 1 1 2 1108 1 1 21 MET HG2 H 4.957 -2.541 1.916 1.00 . A A . 21 MET HG2 1 1 2 1109 1 1 21 MET HG3 H 5.333 -4.071 1.128 1.00 . A A . 21 MET HG3 1 1 2 1110 1 1 21 MET N N 7.143 -1.333 1.867 1.00 . A A . 21 MET N 1 1 2 1111 1 1 21 MET O O 7.610 -2.764 -0.364 1.00 . A A . 21 MET O 1 1 2 1112 1 1 21 MET SD S 3.986 -4.381 3.065 1.00 . A A . 21 MET SD 1 1 2 1113 1 1 22 TYR C C 10.471 -4.518 -1.131 1.00 . A A . 22 TYR C 1 1 2 1114 1 1 22 TYR CA C 9.257 -5.124 -0.457 1.00 . A A . 22 TYR CA 1 1 2 1115 1 1 22 TYR CB C 8.067 -5.306 -1.380 1.00 . A A . 22 TYR CB 1 1 2 1116 1 1 22 TYR CD1 C 6.585 -6.299 0.419 1.00 . A A . 22 TYR CD1 1 1 2 1117 1 1 22 TYR CD2 C 6.664 -7.396 -1.693 1.00 . A A . 22 TYR CD2 1 1 2 1118 1 1 22 TYR CE1 C 5.700 -7.248 0.887 1.00 . A A . 22 TYR CE1 1 1 2 1119 1 1 22 TYR CE2 C 5.775 -8.350 -1.231 1.00 . A A . 22 TYR CE2 1 1 2 1120 1 1 22 TYR CG C 7.084 -6.353 -0.878 1.00 . A A . 22 TYR CG 1 1 2 1121 1 1 22 TYR CZ C 5.296 -8.269 0.060 1.00 . A A . 22 TYR CZ 1 1 2 1122 1 1 22 TYR H H 9.363 -4.526 1.504 1.00 . A A . 22 TYR H 1 1 2 1123 1 1 22 TYR HA H 9.537 -6.083 -0.086 1.00 . A A . 22 TYR HA 1 1 2 1124 1 1 22 TYR HB2 H 7.560 -4.363 -1.452 1.00 . A A . 22 TYR HB2 1 1 2 1125 1 1 22 TYR HB3 H 8.412 -5.607 -2.358 1.00 . A A . 22 TYR HB3 1 1 2 1126 1 1 22 TYR HD1 H 6.901 -5.494 1.067 1.00 . A A . 22 TYR HD1 1 1 2 1127 1 1 22 TYR HD2 H 7.041 -7.458 -2.704 1.00 . A A . 22 TYR HD2 1 1 2 1128 1 1 22 TYR HE1 H 5.326 -7.185 1.899 1.00 . A A . 22 TYR HE1 1 1 2 1129 1 1 22 TYR HE2 H 5.458 -9.151 -1.880 1.00 . A A . 22 TYR HE2 1 1 2 1130 1 1 22 TYR HH H 4.866 -10.077 0.575 1.00 . A A . 22 TYR HH 1 1 2 1131 1 1 22 TYR N N 8.895 -4.329 0.692 1.00 . A A . 22 TYR N 1 1 2 1132 1 1 22 TYR O O 11.255 -5.193 -1.798 1.00 . A A . 22 TYR O 1 1 2 1133 1 1 22 TYR OH O 4.415 -9.219 0.528 1.00 . A A . 22 TYR OH 1 1 2 1134 1 1 23 ILE C C 13.068 -2.937 -0.501 1.00 . A A . 23 ILE C 1 1 2 1135 1 1 23 ILE CA C 11.838 -2.523 -1.321 1.00 . A A . 23 ILE CA 1 1 2 1136 1 1 23 ILE CB C 11.636 -1.004 -1.208 1.00 . A A . 23 ILE CB 1 1 2 1137 1 1 23 ILE CD1 C 10.706 0.784 0.363 1.00 . A A . 23 ILE CD1 1 1 2 1138 1 1 23 ILE CG1 C 11.124 -0.658 0.191 1.00 . A A . 23 ILE CG1 1 1 2 1139 1 1 23 ILE CG2 C 10.683 -0.514 -2.288 1.00 . A A . 23 ILE CG2 1 1 2 1140 1 1 23 ILE H H 9.938 -2.766 -0.412 1.00 . A A . 23 ILE H 1 1 2 1141 1 1 23 ILE HA H 12.005 -2.772 -2.351 1.00 . A A . 23 ILE HA 1 1 2 1142 1 1 23 ILE HB H 12.589 -0.529 -1.362 1.00 . A A . 23 ILE HB 1 1 2 1143 1 1 23 ILE HD11 H 10.355 0.937 1.371 1.00 . A A . 23 ILE HD11 1 1 2 1144 1 1 23 ILE HD12 H 11.552 1.428 0.175 1.00 . A A . 23 ILE HD12 1 1 2 1145 1 1 23 ILE HD13 H 9.915 1.016 -0.336 1.00 . A A . 23 ILE HD13 1 1 2 1146 1 1 23 ILE HG12 H 10.278 -1.283 0.417 1.00 . A A . 23 ILE HG12 1 1 2 1147 1 1 23 ILE HG13 H 11.907 -0.860 0.907 1.00 . A A . 23 ILE HG13 1 1 2 1148 1 1 23 ILE HG21 H 9.728 -0.999 -2.170 1.00 . A A . 23 ILE HG21 1 1 2 1149 1 1 23 ILE HG22 H 10.557 0.556 -2.196 1.00 . A A . 23 ILE HG22 1 1 2 1150 1 1 23 ILE HG23 H 11.089 -0.747 -3.261 1.00 . A A . 23 ILE HG23 1 1 2 1151 1 1 23 ILE N N 10.647 -3.243 -0.887 1.00 . A A . 23 ILE N 1 1 2 1152 1 1 23 ILE O O 13.712 -2.123 0.161 1.00 . A A . 23 ILE O 1 1 2 1153 1 1 24 GLU C C 15.677 -5.068 -0.658 1.00 . A A . 24 GLU C 1 1 2 1154 1 1 24 GLU CA C 14.475 -4.786 0.220 1.00 . A A . 24 GLU CA 1 1 2 1155 1 1 24 GLU CB C 13.996 -6.078 0.836 1.00 . A A . 24 GLU CB 1 1 2 1156 1 1 24 GLU CD C 12.138 -7.206 2.107 1.00 . A A . 24 GLU CD 1 1 2 1157 1 1 24 GLU CG C 12.773 -5.892 1.712 1.00 . A A . 24 GLU CG 1 1 2 1158 1 1 24 GLU H H 12.851 -4.807 -1.137 1.00 . A A . 24 GLU H 1 1 2 1159 1 1 24 GLU HA H 14.748 -4.092 0.999 1.00 . A A . 24 GLU HA 1 1 2 1160 1 1 24 GLU HB2 H 13.748 -6.755 0.032 1.00 . A A . 24 GLU HB2 1 1 2 1161 1 1 24 GLU HB3 H 14.790 -6.503 1.433 1.00 . A A . 24 GLU HB3 1 1 2 1162 1 1 24 GLU HG2 H 13.069 -5.369 2.609 1.00 . A A . 24 GLU HG2 1 1 2 1163 1 1 24 GLU HG3 H 12.047 -5.295 1.173 1.00 . A A . 24 GLU HG3 1 1 2 1164 1 1 24 GLU N N 13.387 -4.213 -0.560 1.00 . A A . 24 GLU N 1 1 2 1165 1 1 24 GLU O O 16.404 -6.034 -0.439 1.00 . A A . 24 GLU O 1 1 2 1166 1 1 24 GLU OE1 O 11.563 -7.885 1.231 1.00 . A A . 24 GLU OE1 1 1 2 1167 1 1 24 GLU OE2 O 12.227 -7.573 3.296 1.00 . A A . 24 GLU OE2 1 1 2 1168 1 1 25 ALA C C 16.599 -5.557 -3.569 1.00 . A A . 25 ALA C 1 1 2 1169 1 1 25 ALA CA C 16.904 -4.375 -2.663 1.00 . A A . 25 ALA CA 1 1 2 1170 1 1 25 ALA CB C 18.279 -4.508 -2.022 1.00 . A A . 25 ALA CB 1 1 2 1171 1 1 25 ALA H H 15.210 -3.490 -1.764 1.00 . A A . 25 ALA H 1 1 2 1172 1 1 25 ALA HA H 16.905 -3.478 -3.268 1.00 . A A . 25 ALA HA 1 1 2 1173 1 1 25 ALA HB1 H 19.030 -4.589 -2.793 1.00 . A A . 25 ALA HB1 1 1 2 1174 1 1 25 ALA HB2 H 18.479 -3.638 -1.415 1.00 . A A . 25 ALA HB2 1 1 2 1175 1 1 25 ALA HB3 H 18.302 -5.391 -1.401 1.00 . A A . 25 ALA HB3 1 1 2 1176 1 1 25 ALA N N 15.844 -4.226 -1.667 1.00 . A A . 25 ALA N 1 1 2 1177 1 1 25 ALA O O 17.424 -5.981 -4.377 1.00 . A A . 25 ALA O 1 1 2 1178 1 1 26 LEU C C 14.011 -6.423 -5.327 1.00 . A A . 26 LEU C 1 1 2 1179 1 1 26 LEU CA C 14.886 -7.097 -4.316 1.00 . A A . 26 LEU CA 1 1 2 1180 1 1 26 LEU CB C 14.111 -8.176 -3.558 1.00 . A A . 26 LEU CB 1 1 2 1181 1 1 26 LEU CD1 C 14.049 -10.027 -1.871 1.00 . A A . 26 LEU CD1 1 1 2 1182 1 1 26 LEU CD2 C 16.129 -9.628 -3.204 1.00 . A A . 26 LEU CD2 1 1 2 1183 1 1 26 LEU CG C 14.924 -8.976 -2.536 1.00 . A A . 26 LEU CG 1 1 2 1184 1 1 26 LEU H H 14.792 -5.739 -2.735 1.00 . A A . 26 LEU H 1 1 2 1185 1 1 26 LEU HA H 15.713 -7.533 -4.821 1.00 . A A . 26 LEU HA 1 1 2 1186 1 1 26 LEU HB2 H 13.291 -7.700 -3.037 1.00 . A A . 26 LEU HB2 1 1 2 1187 1 1 26 LEU HB3 H 13.702 -8.868 -4.278 1.00 . A A . 26 LEU HB3 1 1 2 1188 1 1 26 LEU HD11 H 13.646 -10.688 -2.624 1.00 . A A . 26 LEU HD11 1 1 2 1189 1 1 26 LEU HD12 H 14.640 -10.597 -1.171 1.00 . A A . 26 LEU HD12 1 1 2 1190 1 1 26 LEU HD13 H 13.239 -9.541 -1.348 1.00 . A A . 26 LEU HD13 1 1 2 1191 1 1 26 LEU HD21 H 16.692 -10.182 -2.468 1.00 . A A . 26 LEU HD21 1 1 2 1192 1 1 26 LEU HD22 H 15.791 -10.299 -3.980 1.00 . A A . 26 LEU HD22 1 1 2 1193 1 1 26 LEU HD23 H 16.756 -8.863 -3.637 1.00 . A A . 26 LEU HD23 1 1 2 1194 1 1 26 LEU HG H 15.285 -8.307 -1.768 1.00 . A A . 26 LEU HG 1 1 2 1195 1 1 26 LEU N N 15.383 -6.077 -3.431 1.00 . A A . 26 LEU N 1 1 2 1196 1 1 26 LEU O O 13.460 -7.051 -6.233 1.00 . A A . 26 LEU O 1 1 2 1197 1 1 27 ASP C C 11.723 -4.738 -6.062 1.00 . A A . 27 ASP C 1 1 2 1198 1 1 27 ASP CA C 13.143 -4.254 -6.011 1.00 . A A . 27 ASP CA 1 1 2 1199 1 1 27 ASP CB C 13.781 -4.206 -7.392 1.00 . A A . 27 ASP CB 1 1 2 1200 1 1 27 ASP CG C 14.659 -2.985 -7.563 1.00 . A A . 27 ASP CG 1 1 2 1201 1 1 27 ASP H H 14.351 -4.711 -4.357 1.00 . A A . 27 ASP H 1 1 2 1202 1 1 27 ASP HA H 13.153 -3.261 -5.586 1.00 . A A . 27 ASP HA 1 1 2 1203 1 1 27 ASP HB2 H 14.393 -5.086 -7.516 1.00 . A A . 27 ASP HB2 1 1 2 1204 1 1 27 ASP HB3 H 13.007 -4.188 -8.146 1.00 . A A . 27 ASP HB3 1 1 2 1205 1 1 27 ASP N N 13.903 -5.110 -5.134 1.00 . A A . 27 ASP N 1 1 2 1206 1 1 27 ASP O O 11.108 -4.840 -7.120 1.00 . A A . 27 ASP O 1 1 2 1207 1 1 27 ASP OD1 O 15.589 -2.795 -6.749 1.00 . A A . 27 ASP OD1 1 1 2 1208 1 1 27 ASP OD2 O 14.428 -2.205 -8.515 1.00 . A A . 27 ASP OD2 1 1 2 1209 1 1 28 LYS C C 9.014 -4.244 -4.332 1.00 . A A . 28 LYS C 1 1 2 1210 1 1 28 LYS CA C 9.839 -5.446 -4.742 1.00 . A A . 28 LYS CA 1 1 2 1211 1 1 28 LYS CB C 9.704 -6.564 -3.693 1.00 . A A . 28 LYS CB 1 1 2 1212 1 1 28 LYS CD C 10.557 -8.302 -5.313 1.00 . A A . 28 LYS CD 1 1 2 1213 1 1 28 LYS CE C 9.143 -8.774 -5.627 1.00 . A A . 28 LYS CE 1 1 2 1214 1 1 28 LYS CG C 10.673 -7.721 -3.906 1.00 . A A . 28 LYS CG 1 1 2 1215 1 1 28 LYS H H 11.806 -5.016 -4.096 1.00 . A A . 28 LYS H 1 1 2 1216 1 1 28 LYS HA H 9.495 -5.805 -5.696 1.00 . A A . 28 LYS HA 1 1 2 1217 1 1 28 LYS HB2 H 9.872 -6.140 -2.681 1.00 . A A . 28 LYS HB2 1 1 2 1218 1 1 28 LYS HB3 H 8.697 -6.957 -3.739 1.00 . A A . 28 LYS HB3 1 1 2 1219 1 1 28 LYS HD2 H 10.835 -7.544 -6.028 1.00 . A A . 28 LYS HD2 1 1 2 1220 1 1 28 LYS HD3 H 11.232 -9.142 -5.400 1.00 . A A . 28 LYS HD3 1 1 2 1221 1 1 28 LYS HE2 H 8.452 -7.977 -5.398 1.00 . A A . 28 LYS HE2 1 1 2 1222 1 1 28 LYS HE3 H 9.084 -9.009 -6.679 1.00 . A A . 28 LYS HE3 1 1 2 1223 1 1 28 LYS HG2 H 11.686 -7.361 -3.758 1.00 . A A . 28 LYS HG2 1 1 2 1224 1 1 28 LYS HG3 H 10.458 -8.498 -3.187 1.00 . A A . 28 LYS HG3 1 1 2 1225 1 1 28 LYS HZ1 H 7.761 -10.199 -4.992 1.00 . A A . 28 LYS HZ1 1 1 2 1226 1 1 28 LYS HZ2 H 8.931 -9.814 -3.825 1.00 . A A . 28 LYS HZ2 1 1 2 1227 1 1 28 LYS HZ3 H 9.337 -10.793 -5.149 1.00 . A A . 28 LYS HZ3 1 1 2 1228 1 1 28 LYS N N 11.215 -5.032 -4.886 1.00 . A A . 28 LYS N 1 1 2 1229 1 1 28 LYS NZ N 8.767 -9.975 -4.844 1.00 . A A . 28 LYS NZ 1 1 2 1230 1 1 28 LYS O O 9.537 -3.278 -3.774 1.00 . A A . 28 LYS O 1 1 2 1231 1 1 29 TYR C C 5.573 -3.543 -3.762 1.00 . A A . 29 TYR C 1 1 2 1232 1 1 29 TYR CA C 6.874 -3.145 -4.429 1.00 . A A . 29 TYR CA 1 1 2 1233 1 1 29 TYR CB C 6.571 -2.470 -5.775 1.00 . A A . 29 TYR CB 1 1 2 1234 1 1 29 TYR CD1 C 8.585 -2.549 -7.309 1.00 . A A . 29 TYR CD1 1 1 2 1235 1 1 29 TYR CD2 C 8.086 -0.495 -6.204 1.00 . A A . 29 TYR CD2 1 1 2 1236 1 1 29 TYR CE1 C 9.676 -1.961 -7.918 1.00 . A A . 29 TYR CE1 1 1 2 1237 1 1 29 TYR CE2 C 9.176 0.099 -6.811 1.00 . A A . 29 TYR CE2 1 1 2 1238 1 1 29 TYR CG C 7.770 -1.828 -6.442 1.00 . A A . 29 TYR CG 1 1 2 1239 1 1 29 TYR CZ C 9.966 -0.638 -7.666 1.00 . A A . 29 TYR CZ 1 1 2 1240 1 1 29 TYR H H 7.344 -5.138 -4.939 1.00 . A A . 29 TYR H 1 1 2 1241 1 1 29 TYR HA H 7.392 -2.443 -3.794 1.00 . A A . 29 TYR HA 1 1 2 1242 1 1 29 TYR HB2 H 6.176 -3.206 -6.456 1.00 . A A . 29 TYR HB2 1 1 2 1243 1 1 29 TYR HB3 H 5.829 -1.700 -5.619 1.00 . A A . 29 TYR HB3 1 1 2 1244 1 1 29 TYR HD1 H 8.354 -3.586 -7.506 1.00 . A A . 29 TYR HD1 1 1 2 1245 1 1 29 TYR HD2 H 7.466 0.082 -5.535 1.00 . A A . 29 TYR HD2 1 1 2 1246 1 1 29 TYR HE1 H 10.296 -2.539 -8.588 1.00 . A A . 29 TYR HE1 1 1 2 1247 1 1 29 TYR HE2 H 9.406 1.135 -6.616 1.00 . A A . 29 TYR HE2 1 1 2 1248 1 1 29 TYR HH H 11.213 -0.463 -9.124 1.00 . A A . 29 TYR HH 1 1 2 1249 1 1 29 TYR N N 7.732 -4.296 -4.619 1.00 . A A . 29 TYR N 1 1 2 1250 1 1 29 TYR O O 4.696 -4.139 -4.388 1.00 . A A . 29 TYR O 1 1 2 1251 1 1 29 TYR OH O 11.057 -0.050 -8.266 1.00 . A A . 29 TYR OH 1 1 2 1252 1 1 30 ALA C C 3.997 -2.090 -0.934 1.00 . A A . 30 ALA C 1 1 2 1253 1 1 30 ALA CA C 4.191 -3.320 -1.802 1.00 . A A . 30 ALA CA 1 1 2 1254 1 1 30 ALA CB C 4.078 -4.589 -0.978 1.00 . A A . 30 ALA CB 1 1 2 1255 1 1 30 ALA H H 6.274 -3.003 -1.971 1.00 . A A . 30 ALA H 1 1 2 1256 1 1 30 ALA HA H 3.416 -3.335 -2.555 1.00 . A A . 30 ALA HA 1 1 2 1257 1 1 30 ALA HB1 H 4.816 -4.571 -0.190 1.00 . A A . 30 ALA HB1 1 1 2 1258 1 1 30 ALA HB2 H 3.090 -4.650 -0.545 1.00 . A A . 30 ALA HB2 1 1 2 1259 1 1 30 ALA HB3 H 4.247 -5.446 -1.613 1.00 . A A . 30 ALA HB3 1 1 2 1260 1 1 30 ALA N N 5.466 -3.246 -2.482 1.00 . A A . 30 ALA N 1 1 2 1261 1 1 30 ALA O O 4.955 -1.553 -0.370 1.00 . A A . 30 ALA O 1 1 2 1262 1 1 31 CYS C C 1.138 -0.690 0.639 1.00 . A A . 31 CYS C 1 1 2 1263 1 1 31 CYS CA C 2.439 -0.462 -0.088 1.00 . A A . 31 CYS CA 1 1 2 1264 1 1 31 CYS CB C 2.321 0.756 -1.004 1.00 . A A . 31 CYS CB 1 1 2 1265 1 1 31 CYS H H 2.048 -2.123 -1.294 1.00 . A A . 31 CYS H 1 1 2 1266 1 1 31 CYS HA H 3.226 -0.292 0.633 1.00 . A A . 31 CYS HA 1 1 2 1267 1 1 31 CYS HB2 H 3.257 0.903 -1.520 1.00 . A A . 31 CYS HB2 1 1 2 1268 1 1 31 CYS HB3 H 1.538 0.583 -1.727 1.00 . A A . 31 CYS HB3 1 1 2 1269 1 1 31 CYS N N 2.770 -1.639 -0.847 1.00 . A A . 31 CYS N 1 1 2 1270 1 1 31 CYS O O 0.259 -1.403 0.151 1.00 . A A . 31 CYS O 1 1 2 1271 1 1 31 CYS SG S 1.930 2.304 -0.130 1.00 . A A . 31 CYS SG 1 1 2 1272 1 1 32 ASN C C -0.805 1.085 2.879 1.00 . A A . 32 ASN C 1 1 2 1273 1 1 32 ASN CA C -0.192 -0.270 2.590 1.00 . A A . 32 ASN CA 1 1 2 1274 1 1 32 ASN CB C 0.142 -1.010 3.886 1.00 . A A . 32 ASN CB 1 1 2 1275 1 1 32 ASN CG C -1.088 -1.449 4.661 1.00 . A A . 32 ASN CG 1 1 2 1276 1 1 32 ASN H H 1.736 0.473 2.140 1.00 . A A . 32 ASN H 1 1 2 1277 1 1 32 ASN HA H -0.892 -0.852 2.013 1.00 . A A . 32 ASN HA 1 1 2 1278 1 1 32 ASN HB2 H 0.722 -1.887 3.639 1.00 . A A . 32 ASN HB2 1 1 2 1279 1 1 32 ASN HB3 H 0.730 -0.361 4.517 1.00 . A A . 32 ASN HB3 1 1 2 1280 1 1 32 ASN HD21 H -0.995 -3.251 3.824 1.00 . A A . 32 ASN HD21 1 1 2 1281 1 1 32 ASN HD22 H -2.286 -3.006 4.953 1.00 . A A . 32 ASN HD22 1 1 2 1282 1 1 32 ASN N N 1.010 -0.100 1.804 1.00 . A A . 32 ASN N 1 1 2 1283 1 1 32 ASN ND2 N -1.500 -2.691 4.457 1.00 . A A . 32 ASN ND2 1 1 2 1284 1 1 32 ASN O O -0.311 1.839 3.705 1.00 . A A . 32 ASN O 1 1 2 1285 1 1 32 ASN OD1 O -1.644 -0.690 5.455 1.00 . A A . 32 ASN OD1 1 1 2 1286 1 1 33 CYS C C -3.647 2.526 3.380 1.00 . A A . 33 CYS C 1 1 2 1287 1 1 33 CYS CA C -2.534 2.659 2.336 1.00 . A A . 33 CYS CA 1 1 2 1288 1 1 33 CYS CB C -3.054 3.090 0.982 1.00 . A A . 33 CYS CB 1 1 2 1289 1 1 33 CYS H H -2.140 0.831 1.423 1.00 . A A . 33 CYS H 1 1 2 1290 1 1 33 CYS HA H -1.815 3.384 2.683 1.00 . A A . 33 CYS HA 1 1 2 1291 1 1 33 CYS HB2 H -2.231 3.084 0.283 1.00 . A A . 33 CYS HB2 1 1 2 1292 1 1 33 CYS HB3 H -3.792 2.378 0.651 1.00 . A A . 33 CYS HB3 1 1 2 1293 1 1 33 CYS N N -1.850 1.415 2.148 1.00 . A A . 33 CYS N 1 1 2 1294 1 1 33 CYS O O -3.368 2.420 4.569 1.00 . A A . 33 CYS O 1 1 2 1295 1 1 33 CYS SG S -3.795 4.737 0.910 1.00 . A A . 33 CYS SG 1 1 2 1296 1 1 34 VAL C C -7.063 1.501 3.344 1.00 . A A . 34 VAL C 1 1 2 1297 1 1 34 VAL CA C -6.004 2.429 3.889 1.00 . A A . 34 VAL CA 1 1 2 1298 1 1 34 VAL CB C -6.603 3.835 4.117 1.00 . A A . 34 VAL CB 1 1 2 1299 1 1 34 VAL CG1 C -7.290 4.354 2.862 1.00 . A A . 34 VAL CG1 1 1 2 1300 1 1 34 VAL CG2 C -7.559 3.839 5.303 1.00 . A A . 34 VAL CG2 1 1 2 1301 1 1 34 VAL H H -5.094 2.477 1.991 1.00 . A A . 34 VAL H 1 1 2 1302 1 1 34 VAL HA H -5.641 2.045 4.831 1.00 . A A . 34 VAL HA 1 1 2 1303 1 1 34 VAL HB H -5.790 4.501 4.340 1.00 . A A . 34 VAL HB 1 1 2 1304 1 1 34 VAL HG11 H -6.577 4.392 2.051 1.00 . A A . 34 VAL HG11 1 1 2 1305 1 1 34 VAL HG12 H -8.100 3.691 2.597 1.00 . A A . 34 VAL HG12 1 1 2 1306 1 1 34 VAL HG13 H -7.678 5.344 3.047 1.00 . A A . 34 VAL HG13 1 1 2 1307 1 1 34 VAL HG21 H -8.354 3.131 5.123 1.00 . A A . 34 VAL HG21 1 1 2 1308 1 1 34 VAL HG22 H -7.025 3.562 6.200 1.00 . A A . 34 VAL HG22 1 1 2 1309 1 1 34 VAL HG23 H -7.979 4.827 5.423 1.00 . A A . 34 VAL HG23 1 1 2 1310 1 1 34 VAL N N -4.898 2.483 2.952 1.00 . A A . 34 VAL N 1 1 2 1311 1 1 34 VAL O O -7.176 1.355 2.125 1.00 . A A . 34 VAL O 1 1 2 1312 1 1 35 VAL C C -9.952 0.872 3.118 1.00 . A A . 35 VAL C 1 1 2 1313 1 1 35 VAL CA C -8.890 -0.005 3.792 1.00 . A A . 35 VAL CA 1 1 2 1314 1 1 35 VAL CB C -9.471 -0.871 4.944 1.00 . A A . 35 VAL CB 1 1 2 1315 1 1 35 VAL CG1 C -8.368 -1.710 5.571 1.00 . A A . 35 VAL CG1 1 1 2 1316 1 1 35 VAL CG2 C -10.151 -0.033 6.021 1.00 . A A . 35 VAL CG2 1 1 2 1317 1 1 35 VAL H H -7.568 0.878 5.178 1.00 . A A . 35 VAL H 1 1 2 1318 1 1 35 VAL HA H -8.496 -0.680 3.040 1.00 . A A . 35 VAL HA 1 1 2 1319 1 1 35 VAL HB H -10.203 -1.554 4.515 1.00 . A A . 35 VAL HB 1 1 2 1320 1 1 35 VAL HG11 H -8.779 -2.300 6.377 1.00 . A A . 35 VAL HG11 1 1 2 1321 1 1 35 VAL HG12 H -7.944 -2.364 4.824 1.00 . A A . 35 VAL HG12 1 1 2 1322 1 1 35 VAL HG13 H -7.598 -1.060 5.958 1.00 . A A . 35 VAL HG13 1 1 2 1323 1 1 35 VAL HG21 H -9.439 0.663 6.439 1.00 . A A . 35 VAL HG21 1 1 2 1324 1 1 35 VAL HG22 H -10.974 0.513 5.586 1.00 . A A . 35 VAL HG22 1 1 2 1325 1 1 35 VAL HG23 H -10.522 -0.681 6.801 1.00 . A A . 35 VAL HG23 1 1 2 1326 1 1 35 VAL N N -7.787 0.825 4.225 1.00 . A A . 35 VAL N 1 1 2 1327 1 1 35 VAL O O -10.803 1.500 3.752 1.00 . A A . 35 VAL O 1 1 2 1328 1 1 36 GLY C C -9.950 2.288 -0.210 1.00 . A A . 36 GLY C 1 1 2 1329 1 1 36 GLY CA C -10.679 1.800 1.017 1.00 . A A . 36 GLY CA 1 1 2 1330 1 1 36 GLY H H -9.106 0.455 1.371 1.00 . A A . 36 GLY H 1 1 2 1331 1 1 36 GLY HA2 H -11.547 1.231 0.715 1.00 . A A . 36 GLY HA2 1 1 2 1332 1 1 36 GLY HA3 H -10.993 2.648 1.606 1.00 . A A . 36 GLY HA3 1 1 2 1333 1 1 36 GLY N N -9.821 0.960 1.810 1.00 . A A . 36 GLY N 1 1 2 1334 1 1 36 GLY O O -10.570 2.626 -1.218 1.00 . A A . 36 GLY O 1 1 2 1335 1 1 37 TYR C C -6.516 1.856 -1.267 1.00 . A A . 37 TYR C 1 1 2 1336 1 1 37 TYR CA C -7.790 2.680 -1.263 1.00 . A A . 37 TYR CA 1 1 2 1337 1 1 37 TYR CB C -7.398 4.163 -1.219 1.00 . A A . 37 TYR CB 1 1 2 1338 1 1 37 TYR CD1 C -9.020 5.576 -2.536 1.00 . A A . 37 TYR CD1 1 1 2 1339 1 1 37 TYR CD2 C -9.164 5.617 -0.156 1.00 . A A . 37 TYR CD2 1 1 2 1340 1 1 37 TYR CE1 C -10.068 6.469 -2.616 1.00 . A A . 37 TYR CE1 1 1 2 1341 1 1 37 TYR CE2 C -10.215 6.507 -0.232 1.00 . A A . 37 TYR CE2 1 1 2 1342 1 1 37 TYR CG C -8.551 5.135 -1.306 1.00 . A A . 37 TYR CG 1 1 2 1343 1 1 37 TYR CZ C -10.662 6.931 -1.464 1.00 . A A . 37 TYR CZ 1 1 2 1344 1 1 37 TYR H H -8.176 2.083 0.727 1.00 . A A . 37 TYR H 1 1 2 1345 1 1 37 TYR HA H -8.347 2.483 -2.167 1.00 . A A . 37 TYR HA 1 1 2 1346 1 1 37 TYR HB2 H -6.878 4.357 -0.294 1.00 . A A . 37 TYR HB2 1 1 2 1347 1 1 37 TYR HB3 H -6.727 4.366 -2.046 1.00 . A A . 37 TYR HB3 1 1 2 1348 1 1 37 TYR HD1 H -8.552 5.212 -3.439 1.00 . A A . 37 TYR HD1 1 1 2 1349 1 1 37 TYR HD2 H -8.811 5.281 0.807 1.00 . A A . 37 TYR HD2 1 1 2 1350 1 1 37 TYR HE1 H -10.420 6.802 -3.582 1.00 . A A . 37 TYR HE1 1 1 2 1351 1 1 37 TYR HE2 H -10.680 6.871 0.673 1.00 . A A . 37 TYR HE2 1 1 2 1352 1 1 37 TYR HH H -12.347 7.492 -2.207 1.00 . A A . 37 TYR HH 1 1 2 1353 1 1 37 TYR N N -8.616 2.317 -0.126 1.00 . A A . 37 TYR N 1 1 2 1354 1 1 37 TYR O O -5.603 2.120 -0.481 1.00 . A A . 37 TYR O 1 1 2 1355 1 1 37 TYR OH O -11.712 7.817 -1.547 1.00 . A A . 37 TYR OH 1 1 2 1356 1 1 38 ILE C C -5.150 -0.483 -3.702 1.00 . A A . 38 ILE C 1 1 2 1357 1 1 38 ILE CA C -5.174 0.187 -2.344 1.00 . A A . 38 ILE CA 1 1 2 1358 1 1 38 ILE CB C -4.832 -0.814 -1.205 1.00 . A A . 38 ILE CB 1 1 2 1359 1 1 38 ILE CD1 C -2.326 -0.835 -1.713 1.00 . A A . 38 ILE CD1 1 1 2 1360 1 1 38 ILE CG1 C -3.407 -0.563 -0.690 1.00 . A A . 38 ILE CG1 1 1 2 1361 1 1 38 ILE CG2 C -4.984 -2.267 -1.648 1.00 . A A . 38 ILE CG2 1 1 2 1362 1 1 38 ILE H H -7.253 0.528 -2.591 1.00 . A A . 38 ILE H 1 1 2 1363 1 1 38 ILE HA H -4.413 0.955 -2.340 1.00 . A A . 38 ILE HA 1 1 2 1364 1 1 38 ILE HB H -5.524 -0.643 -0.396 1.00 . A A . 38 ILE HB 1 1 2 1365 1 1 38 ILE HD11 H -2.387 -1.864 -2.035 1.00 . A A . 38 ILE HD11 1 1 2 1366 1 1 38 ILE HD12 H -2.464 -0.183 -2.565 1.00 . A A . 38 ILE HD12 1 1 2 1367 1 1 38 ILE HD13 H -1.357 -0.652 -1.272 1.00 . A A . 38 ILE HD13 1 1 2 1368 1 1 38 ILE HG12 H -3.319 0.468 -0.386 1.00 . A A . 38 ILE HG12 1 1 2 1369 1 1 38 ILE HG13 H -3.222 -1.200 0.165 1.00 . A A . 38 ILE HG13 1 1 2 1370 1 1 38 ILE HG21 H -4.321 -2.461 -2.478 1.00 . A A . 38 ILE HG21 1 1 2 1371 1 1 38 ILE HG22 H -4.734 -2.919 -0.826 1.00 . A A . 38 ILE HG22 1 1 2 1372 1 1 38 ILE HG23 H -6.006 -2.447 -1.952 1.00 . A A . 38 ILE HG23 1 1 2 1373 1 1 38 ILE N N -6.439 0.852 -2.126 1.00 . A A . 38 ILE N 1 1 2 1374 1 1 38 ILE O O -6.086 -1.144 -4.103 1.00 . A A . 38 ILE O 1 1 2 1375 1 1 39 GLY C C -2.491 -0.548 -6.162 1.00 . A A . 39 GLY C 1 1 2 1376 1 1 39 GLY CA C -3.872 -0.872 -5.688 1.00 . A A . 39 GLY CA 1 1 2 1377 1 1 39 GLY H H -3.498 0.505 -4.144 1.00 . A A . 39 GLY H 1 1 2 1378 1 1 39 GLY HA2 H -3.961 -1.939 -5.537 1.00 . A A . 39 GLY HA2 1 1 2 1379 1 1 39 GLY HA3 H -4.586 -0.550 -6.425 1.00 . A A . 39 GLY HA3 1 1 2 1380 1 1 39 GLY N N -4.118 -0.188 -4.445 1.00 . A A . 39 GLY N 1 1 2 1381 1 1 39 GLY O O -2.259 0.567 -6.630 1.00 . A A . 39 GLY O 1 1 2 1382 1 1 40 GLU C C 0.462 -0.362 -5.229 1.00 . A A . 40 GLU C 1 1 2 1383 1 1 40 GLU CA C -0.153 -1.297 -6.256 1.00 . A A . 40 GLU CA 1 1 2 1384 1 1 40 GLU CB C 0.064 -0.757 -7.673 1.00 . A A . 40 GLU CB 1 1 2 1385 1 1 40 GLU CD C 1.671 0.257 -9.319 1.00 . A A . 40 GLU CD 1 1 2 1386 1 1 40 GLU CG C 1.517 -0.476 -8.005 1.00 . A A . 40 GLU CG 1 1 2 1387 1 1 40 GLU H H -1.848 -2.342 -5.603 1.00 . A A . 40 GLU H 1 1 2 1388 1 1 40 GLU HA H 0.321 -2.249 -6.165 1.00 . A A . 40 GLU HA 1 1 2 1389 1 1 40 GLU HB2 H -0.311 -1.481 -8.384 1.00 . A A . 40 GLU HB2 1 1 2 1390 1 1 40 GLU HB3 H -0.494 0.162 -7.783 1.00 . A A . 40 GLU HB3 1 1 2 1391 1 1 40 GLU HG2 H 1.944 0.125 -7.214 1.00 . A A . 40 GLU HG2 1 1 2 1392 1 1 40 GLU HG3 H 2.049 -1.415 -8.068 1.00 . A A . 40 GLU HG3 1 1 2 1393 1 1 40 GLU N N -1.570 -1.488 -5.969 1.00 . A A . 40 GLU N 1 1 2 1394 1 1 40 GLU O O 1.550 -0.599 -4.713 1.00 . A A . 40 GLU O 1 1 2 1395 1 1 40 GLU OE1 O 1.458 1.484 -9.346 1.00 . A A . 40 GLU OE1 1 1 2 1396 1 1 40 GLU OE2 O 1.999 -0.392 -10.337 1.00 . A A . 40 GLU OE2 1 1 2 1397 1 1 41 ARG C C -0.892 2.161 -3.086 1.00 . A A . 41 ARG C 1 1 2 1398 1 1 41 ARG CA C 0.197 1.714 -4.043 1.00 . A A . 41 ARG CA 1 1 2 1399 1 1 41 ARG CB C 0.734 2.863 -4.899 1.00 . A A . 41 ARG CB 1 1 2 1400 1 1 41 ARG CD C -0.908 4.382 -6.121 1.00 . A A . 41 ARG CD 1 1 2 1401 1 1 41 ARG CG C -0.075 3.110 -6.175 1.00 . A A . 41 ARG CG 1 1 2 1402 1 1 41 ARG CZ C -0.025 6.021 -7.753 1.00 . A A . 41 ARG CZ 1 1 2 1403 1 1 41 ARG H H -1.159 0.767 -5.329 1.00 . A A . 41 ARG H 1 1 2 1404 1 1 41 ARG HA H 0.998 1.305 -3.466 1.00 . A A . 41 ARG HA 1 1 2 1405 1 1 41 ARG HB2 H 0.744 3.770 -4.314 1.00 . A A . 41 ARG HB2 1 1 2 1406 1 1 41 ARG HB3 H 1.739 2.612 -5.191 1.00 . A A . 41 ARG HB3 1 1 2 1407 1 1 41 ARG HD2 H -1.743 4.277 -6.797 1.00 . A A . 41 ARG HD2 1 1 2 1408 1 1 41 ARG HD3 H -1.276 4.513 -5.114 1.00 . A A . 41 ARG HD3 1 1 2 1409 1 1 41 ARG HE H 0.323 6.059 -5.776 1.00 . A A . 41 ARG HE 1 1 2 1410 1 1 41 ARG HG2 H 0.607 3.187 -7.007 1.00 . A A . 41 ARG HG2 1 1 2 1411 1 1 41 ARG HG3 H -0.736 2.272 -6.335 1.00 . A A . 41 ARG HG3 1 1 2 1412 1 1 41 ARG HH11 H -1.086 4.511 -8.597 1.00 . A A . 41 ARG HH11 1 1 2 1413 1 1 41 ARG HH12 H -0.500 5.713 -9.707 1.00 . A A . 41 ARG HH12 1 1 2 1414 1 1 41 ARG HH21 H 1.097 7.642 -7.243 1.00 . A A . 41 ARG HH21 1 1 2 1415 1 1 41 ARG HH22 H 0.759 7.468 -8.944 1.00 . A A . 41 ARG HH22 1 1 2 1416 1 1 41 ARG N N -0.271 0.683 -4.922 1.00 . A A . 41 ARG N 1 1 2 1417 1 1 41 ARG NE N -0.135 5.564 -6.501 1.00 . A A . 41 ARG NE 1 1 2 1418 1 1 41 ARG NH1 N -0.582 5.359 -8.761 1.00 . A A . 41 ARG NH1 1 1 2 1419 1 1 41 ARG NH2 N 0.662 7.132 -7.999 1.00 . A A . 41 ARG NH2 1 1 2 1420 1 1 41 ARG O O -0.670 2.229 -1.880 1.00 . A A . 41 ARG O 1 1 2 1421 1 1 42 CYS C C -4.128 3.696 -3.824 1.00 . A A . 42 CYS C 1 1 2 1422 1 1 42 CYS CA C -3.209 2.953 -2.887 1.00 . A A . 42 CYS CA 1 1 2 1423 1 1 42 CYS CB C -2.735 3.968 -1.828 1.00 . A A . 42 CYS CB 1 1 2 1424 1 1 42 CYS H H -2.220 2.105 -4.561 1.00 . A A . 42 CYS H 1 1 2 1425 1 1 42 CYS HA H -3.753 2.155 -2.406 1.00 . A A . 42 CYS HA 1 1 2 1426 1 1 42 CYS HB2 H -2.244 3.435 -1.027 1.00 . A A . 42 CYS HB2 1 1 2 1427 1 1 42 CYS HB3 H -2.028 4.645 -2.286 1.00 . A A . 42 CYS HB3 1 1 2 1428 1 1 42 CYS N N -2.083 2.373 -3.631 1.00 . A A . 42 CYS N 1 1 2 1429 1 1 42 CYS O O -3.888 4.872 -4.056 1.00 . A A . 42 CYS O 1 1 2 1430 1 1 42 CYS SG S -4.066 4.978 -1.081 1.00 . A A . 42 CYS SG 1 1 2 1431 1 1 43 GLN C C -7.156 2.805 -5.811 1.00 . A A . 43 GLN C 1 1 2 1432 1 1 43 GLN CA C -6.226 3.737 -5.065 1.00 . A A . 43 GLN CA 1 1 2 1433 1 1 43 GLN CB C -5.698 4.803 -6.028 1.00 . A A . 43 GLN CB 1 1 2 1434 1 1 43 GLN CD C -4.784 5.241 -8.336 1.00 . A A . 43 GLN CD 1 1 2 1435 1 1 43 GLN CG C -4.886 4.257 -7.190 1.00 . A A . 43 GLN CG 1 1 2 1436 1 1 43 GLN H H -5.133 2.030 -4.391 1.00 . A A . 43 GLN H 1 1 2 1437 1 1 43 GLN HA H -6.798 4.233 -4.295 1.00 . A A . 43 GLN HA 1 1 2 1438 1 1 43 GLN HB2 H -6.528 5.366 -6.425 1.00 . A A . 43 GLN HB2 1 1 2 1439 1 1 43 GLN HB3 H -5.057 5.466 -5.453 1.00 . A A . 43 GLN HB3 1 1 2 1440 1 1 43 GLN HE21 H -3.187 6.094 -7.521 1.00 . A A . 43 GLN HE21 1 1 2 1441 1 1 43 GLN HE22 H -3.709 6.761 -9.030 1.00 . A A . 43 GLN HE22 1 1 2 1442 1 1 43 GLN HG2 H -3.890 4.026 -6.842 1.00 . A A . 43 GLN HG2 1 1 2 1443 1 1 43 GLN HG3 H -5.358 3.355 -7.552 1.00 . A A . 43 GLN HG3 1 1 2 1444 1 1 43 GLN N N -5.135 3.020 -4.396 1.00 . A A . 43 GLN N 1 1 2 1445 1 1 43 GLN NE2 N -3.794 6.118 -8.287 1.00 . A A . 43 GLN NE2 1 1 2 1446 1 1 43 GLN O O -7.838 3.225 -6.743 1.00 . A A . 43 GLN O 1 1 2 1447 1 1 43 GLN OE1 O -5.605 5.228 -9.248 1.00 . A A . 43 GLN OE1 1 1 2 1448 1 1 44 TYR C C -8.918 -0.133 -5.074 1.00 . A A . 44 TYR C 1 1 2 1449 1 1 44 TYR CA C -8.098 0.628 -6.083 1.00 . A A . 44 TYR CA 1 1 2 1450 1 1 44 TYR CB C -7.333 -0.305 -7.027 1.00 . A A . 44 TYR CB 1 1 2 1451 1 1 44 TYR CD1 C -7.405 0.983 -9.205 1.00 . A A . 44 TYR CD1 1 1 2 1452 1 1 44 TYR CD2 C -5.276 0.559 -8.224 1.00 . A A . 44 TYR CD2 1 1 2 1453 1 1 44 TYR CE1 C -6.793 1.640 -10.257 1.00 . A A . 44 TYR CE1 1 1 2 1454 1 1 44 TYR CE2 C -4.659 1.217 -9.271 1.00 . A A . 44 TYR CE2 1 1 2 1455 1 1 44 TYR CG C -6.660 0.431 -8.171 1.00 . A A . 44 TYR CG 1 1 2 1456 1 1 44 TYR CZ C -5.433 1.813 -10.256 1.00 . A A . 44 TYR CZ 1 1 2 1457 1 1 44 TYR H H -6.662 1.231 -4.661 1.00 . A A . 44 TYR H 1 1 2 1458 1 1 44 TYR HA H -8.784 1.219 -6.668 1.00 . A A . 44 TYR HA 1 1 2 1459 1 1 44 TYR HB2 H -6.569 -0.826 -6.469 1.00 . A A . 44 TYR HB2 1 1 2 1460 1 1 44 TYR HB3 H -8.019 -1.024 -7.451 1.00 . A A . 44 TYR HB3 1 1 2 1461 1 1 44 TYR HD1 H -8.480 0.893 -9.182 1.00 . A A . 44 TYR HD1 1 1 2 1462 1 1 44 TYR HD2 H -4.681 0.134 -7.431 1.00 . A A . 44 TYR HD2 1 1 2 1463 1 1 44 TYR HE1 H -7.393 2.061 -11.051 1.00 . A A . 44 TYR HE1 1 1 2 1464 1 1 44 TYR HE2 H -3.582 1.305 -9.293 1.00 . A A . 44 TYR HE2 1 1 2 1465 1 1 44 TYR HH H -5.324 3.181 -11.585 1.00 . A A . 44 TYR HH 1 1 2 1466 1 1 44 TYR N N -7.205 1.546 -5.419 1.00 . A A . 44 TYR N 1 1 2 1467 1 1 44 TYR O O -8.566 -1.230 -4.653 1.00 . A A . 44 TYR O 1 1 2 1468 1 1 44 TYR OH O -4.803 2.402 -11.333 1.00 . A A . 44 TYR OH 1 1 2 1469 1 1 45 ARG C C -10.435 -0.545 -2.495 1.00 . A A . 45 ARG C 1 1 2 1470 1 1 45 ARG CA C -11.019 -0.149 -3.841 1.00 . A A . 45 ARG CA 1 1 2 1471 1 1 45 ARG CB C -11.543 -1.399 -4.532 1.00 . A A . 45 ARG CB 1 1 2 1472 1 1 45 ARG CD C -10.826 -1.910 -6.871 1.00 . A A . 45 ARG CD 1 1 2 1473 1 1 45 ARG CG C -11.863 -1.212 -6.005 1.00 . A A . 45 ARG CG 1 1 2 1474 1 1 45 ARG CZ C -10.072 -4.236 -7.278 1.00 . A A . 45 ARG CZ 1 1 2 1475 1 1 45 ARG H H -10.167 1.423 -4.967 1.00 . A A . 45 ARG H 1 1 2 1476 1 1 45 ARG HA H -11.833 0.541 -3.688 1.00 . A A . 45 ARG HA 1 1 2 1477 1 1 45 ARG HB2 H -10.787 -2.170 -4.443 1.00 . A A . 45 ARG HB2 1 1 2 1478 1 1 45 ARG HB3 H -12.440 -1.726 -4.026 1.00 . A A . 45 ARG HB3 1 1 2 1479 1 1 45 ARG HD2 H -11.065 -1.743 -7.910 1.00 . A A . 45 ARG HD2 1 1 2 1480 1 1 45 ARG HD3 H -9.842 -1.489 -6.644 1.00 . A A . 45 ARG HD3 1 1 2 1481 1 1 45 ARG HE H -11.381 -3.676 -5.869 1.00 . A A . 45 ARG HE 1 1 2 1482 1 1 45 ARG HG2 H -12.838 -1.630 -6.213 1.00 . A A . 45 ARG HG2 1 1 2 1483 1 1 45 ARG HG3 H -11.861 -0.158 -6.233 1.00 . A A . 45 ARG HG3 1 1 2 1484 1 1 45 ARG HH11 H -9.268 -2.879 -8.562 1.00 . A A . 45 ARG HH11 1 1 2 1485 1 1 45 ARG HH12 H -8.764 -4.525 -8.799 1.00 . A A . 45 ARG HH12 1 1 2 1486 1 1 45 ARG HH21 H -10.721 -5.826 -6.194 1.00 . A A . 45 ARG HH21 1 1 2 1487 1 1 45 ARG HH22 H -9.572 -6.195 -7.454 1.00 . A A . 45 ARG HH22 1 1 2 1488 1 1 45 ARG N N -10.019 0.491 -4.679 1.00 . A A . 45 ARG N 1 1 2 1489 1 1 45 ARG NE N -10.804 -3.349 -6.604 1.00 . A A . 45 ARG NE 1 1 2 1490 1 1 45 ARG NH1 N -9.305 -3.850 -8.291 1.00 . A A . 45 ARG NH1 1 1 2 1491 1 1 45 ARG NH2 N -10.126 -5.519 -6.949 1.00 . A A . 45 ARG NH2 1 1 2 1492 1 1 45 ARG O O -9.402 -0.028 -2.061 1.00 . A A . 45 ARG O 1 1 2 1493 1 1 46 ASP C C -10.607 -3.465 -0.555 1.00 . A A . 46 ASP C 1 1 2 1494 1 1 46 ASP CA C -10.696 -1.958 -0.546 1.00 . A A . 46 ASP CA 1 1 2 1495 1 1 46 ASP CB C -11.684 -1.491 0.521 1.00 . A A . 46 ASP CB 1 1 2 1496 1 1 46 ASP CG C -11.237 -1.862 1.923 1.00 . A A . 46 ASP CG 1 1 2 1497 1 1 46 ASP H H -11.831 -1.953 -2.322 1.00 . A A . 46 ASP H 1 1 2 1498 1 1 46 ASP HA H -9.719 -1.552 -0.330 1.00 . A A . 46 ASP HA 1 1 2 1499 1 1 46 ASP HB2 H -11.783 -0.416 0.467 1.00 . A A . 46 ASP HB2 1 1 2 1500 1 1 46 ASP HB3 H -12.647 -1.946 0.337 1.00 . A A . 46 ASP HB3 1 1 2 1501 1 1 46 ASP N N -11.087 -1.502 -1.864 1.00 . A A . 46 ASP N 1 1 2 1502 1 1 46 ASP O O -11.420 -4.164 0.052 1.00 . A A . 46 ASP O 1 1 2 1503 1 1 46 ASP OD1 O -10.162 -2.469 2.061 1.00 . A A . 46 ASP OD1 1 1 2 1504 1 1 46 ASP OD2 O -11.963 -1.553 2.893 1.00 . A A . 46 ASP OD2 1 1 2 1505 1 1 47 LEU C C -8.968 -5.995 -0.037 1.00 . A A . 47 LEU C 1 1 2 1506 1 1 47 LEU CA C -9.407 -5.389 -1.376 1.00 . A A . 47 LEU CA 1 1 2 1507 1 1 47 LEU CB C -8.392 -5.678 -2.497 1.00 . A A . 47 LEU CB 1 1 2 1508 1 1 47 LEU CD1 C -6.119 -5.906 -1.408 1.00 . A A . 47 LEU CD1 1 1 2 1509 1 1 47 LEU CD2 C -6.328 -4.922 -3.695 1.00 . A A . 47 LEU CD2 1 1 2 1510 1 1 47 LEU CG C -6.992 -5.070 -2.335 1.00 . A A . 47 LEU CG 1 1 2 1511 1 1 47 LEU H H -9.041 -3.348 -1.775 1.00 . A A . 47 LEU H 1 1 2 1512 1 1 47 LEU HA H -10.353 -5.834 -1.651 1.00 . A A . 47 LEU HA 1 1 2 1513 1 1 47 LEU HB2 H -8.285 -6.749 -2.585 1.00 . A A . 47 LEU HB2 1 1 2 1514 1 1 47 LEU HB3 H -8.808 -5.301 -3.421 1.00 . A A . 47 LEU HB3 1 1 2 1515 1 1 47 LEU HD11 H -5.137 -5.461 -1.335 1.00 . A A . 47 LEU HD11 1 1 2 1516 1 1 47 LEU HD12 H -6.570 -5.946 -0.428 1.00 . A A . 47 LEU HD12 1 1 2 1517 1 1 47 LEU HD13 H -6.029 -6.908 -1.805 1.00 . A A . 47 LEU HD13 1 1 2 1518 1 1 47 LEU HD21 H -6.947 -4.307 -4.332 1.00 . A A . 47 LEU HD21 1 1 2 1519 1 1 47 LEU HD22 H -5.360 -4.459 -3.574 1.00 . A A . 47 LEU HD22 1 1 2 1520 1 1 47 LEU HD23 H -6.207 -5.898 -4.144 1.00 . A A . 47 LEU HD23 1 1 2 1521 1 1 47 LEU HG H -7.086 -4.085 -1.902 1.00 . A A . 47 LEU HG 1 1 2 1522 1 1 47 LEU N N -9.624 -3.962 -1.274 1.00 . A A . 47 LEU N 1 1 2 1523 1 1 47 LEU O O -8.838 -7.212 0.079 1.00 . A A . 47 LEU O 1 1 2 1524 1 1 48 LYS C C -9.477 -5.858 3.247 1.00 . A A . 48 LYS C 1 1 2 1525 1 1 48 LYS CA C -8.316 -5.671 2.271 1.00 . A A . 48 LYS CA 1 1 2 1526 1 1 48 LYS CB C -7.198 -4.824 2.901 1.00 . A A . 48 LYS CB 1 1 2 1527 1 1 48 LYS CD C -6.709 -2.785 1.499 1.00 . A A . 48 LYS CD 1 1 2 1528 1 1 48 LYS CE C -6.239 -1.357 1.697 1.00 . A A . 48 LYS CE 1 1 2 1529 1 1 48 LYS CG C -7.349 -3.320 2.770 1.00 . A A . 48 LYS CG 1 1 2 1530 1 1 48 LYS H H -8.903 -4.200 0.859 1.00 . A A . 48 LYS H 1 1 2 1531 1 1 48 LYS HA H -7.912 -6.647 2.086 1.00 . A A . 48 LYS HA 1 1 2 1532 1 1 48 LYS HB2 H -7.149 -5.051 3.953 1.00 . A A . 48 LYS HB2 1 1 2 1533 1 1 48 LYS HB3 H -6.259 -5.106 2.444 1.00 . A A . 48 LYS HB3 1 1 2 1534 1 1 48 LYS HD2 H -5.863 -3.403 1.243 1.00 . A A . 48 LYS HD2 1 1 2 1535 1 1 48 LYS HD3 H -7.437 -2.811 0.701 1.00 . A A . 48 LYS HD3 1 1 2 1536 1 1 48 LYS HE2 H -5.942 -0.936 0.740 1.00 . A A . 48 LYS HE2 1 1 2 1537 1 1 48 LYS HE3 H -7.057 -0.777 2.101 1.00 . A A . 48 LYS HE3 1 1 2 1538 1 1 48 LYS HG2 H -8.402 -3.077 2.755 1.00 . A A . 48 LYS HG2 1 1 2 1539 1 1 48 LYS HG3 H -6.884 -2.849 3.621 1.00 . A A . 48 LYS HG3 1 1 2 1540 1 1 48 LYS HZ1 H -4.229 -1.675 2.187 1.00 . A A . 48 LYS HZ1 1 1 2 1541 1 1 48 LYS HZ2 H -5.288 -1.844 3.497 1.00 . A A . 48 LYS HZ2 1 1 2 1542 1 1 48 LYS HZ3 H -4.906 -0.302 2.918 1.00 . A A . 48 LYS HZ3 1 1 2 1543 1 1 48 LYS N N -8.748 -5.161 0.977 1.00 . A A . 48 LYS N 1 1 2 1544 1 1 48 LYS NZ N -5.087 -1.285 2.637 1.00 . A A . 48 LYS NZ 1 1 2 1545 1 1 48 LYS O O -9.693 -6.962 3.737 1.00 . A A . 48 LYS O 1 1 2 1546 1 1 49 TRP C C -12.658 -5.100 3.946 1.00 . A A . 49 TRP C 1 1 2 1547 1 1 49 TRP CA C -11.270 -4.898 4.555 1.00 . A A . 49 TRP CA 1 1 2 1548 1 1 49 TRP CB C -11.266 -3.657 5.449 1.00 . A A . 49 TRP CB 1 1 2 1549 1 1 49 TRP CD1 C -13.430 -2.834 6.546 1.00 . A A . 49 TRP CD1 1 1 2 1550 1 1 49 TRP CD2 C -12.443 -4.533 7.623 1.00 . A A . 49 TRP CD2 1 1 2 1551 1 1 49 TRP CE2 C -13.613 -4.178 8.321 1.00 . A A . 49 TRP CE2 1 1 2 1552 1 1 49 TRP CE3 C -11.657 -5.579 8.115 1.00 . A A . 49 TRP CE3 1 1 2 1553 1 1 49 TRP CG C -12.344 -3.659 6.491 1.00 . A A . 49 TRP CG 1 1 2 1554 1 1 49 TRP CH2 C -13.226 -5.854 9.941 1.00 . A A . 49 TRP CH2 1 1 2 1555 1 1 49 TRP CZ2 C -14.013 -4.834 9.484 1.00 . A A . 49 TRP CZ2 1 1 2 1556 1 1 49 TRP CZ3 C -12.057 -6.228 9.268 1.00 . A A . 49 TRP CZ3 1 1 2 1557 1 1 49 TRP H H -10.056 -3.945 3.086 1.00 . A A . 49 TRP H 1 1 2 1558 1 1 49 TRP HA H -11.045 -5.757 5.167 1.00 . A A . 49 TRP HA 1 1 2 1559 1 1 49 TRP HB2 H -10.315 -3.593 5.957 1.00 . A A . 49 TRP HB2 1 1 2 1560 1 1 49 TRP HB3 H -11.396 -2.779 4.834 1.00 . A A . 49 TRP HB3 1 1 2 1561 1 1 49 TRP HD1 H -13.642 -2.057 5.826 1.00 . A A . 49 TRP HD1 1 1 2 1562 1 1 49 TRP HE1 H -15.031 -2.682 7.905 1.00 . A A . 49 TRP HE1 1 1 2 1563 1 1 49 TRP HE3 H -10.752 -5.883 7.612 1.00 . A A . 49 TRP HE3 1 1 2 1564 1 1 49 TRP HH2 H -13.498 -6.387 10.838 1.00 . A A . 49 TRP HH2 1 1 2 1565 1 1 49 TRP HZ2 H -14.913 -4.558 10.013 1.00 . A A . 49 TRP HZ2 1 1 2 1566 1 1 49 TRP HZ3 H -11.462 -7.037 9.663 1.00 . A A . 49 TRP HZ3 1 1 2 1567 1 1 49 TRP N N -10.215 -4.803 3.548 1.00 . A A . 49 TRP N 1 1 2 1568 1 1 49 TRP NE1 N -14.197 -3.139 7.645 1.00 . A A . 49 TRP NE1 1 1 2 1569 1 1 49 TRP O O -13.409 -5.978 4.368 1.00 . A A . 49 TRP O 1 1 2 1570 1 1 50 TRP C C -14.725 -5.151 1.400 1.00 . A A . 50 TRP C 1 1 2 1571 1 1 50 TRP CA C -14.377 -4.172 2.515 1.00 . A A . 50 TRP CA 1 1 2 1572 1 1 50 TRP CB C -14.641 -2.739 2.056 1.00 . A A . 50 TRP CB 1 1 2 1573 1 1 50 TRP CD1 C -16.808 -2.051 0.878 1.00 . A A . 50 TRP CD1 1 1 2 1574 1 1 50 TRP CD2 C -16.999 -2.287 3.095 1.00 . A A . 50 TRP CD2 1 1 2 1575 1 1 50 TRP CE2 C -18.249 -1.904 2.576 1.00 . A A . 50 TRP CE2 1 1 2 1576 1 1 50 TRP CE3 C -16.878 -2.493 4.473 1.00 . A A . 50 TRP CE3 1 1 2 1577 1 1 50 TRP CG C -16.091 -2.374 1.992 1.00 . A A . 50 TRP CG 1 1 2 1578 1 1 50 TRP CH2 C -19.221 -1.937 4.729 1.00 . A A . 50 TRP CH2 1 1 2 1579 1 1 50 TRP CZ2 C -19.369 -1.727 3.385 1.00 . A A . 50 TRP CZ2 1 1 2 1580 1 1 50 TRP CZ3 C -17.989 -2.318 5.274 1.00 . A A . 50 TRP CZ3 1 1 2 1581 1 1 50 TRP H H -12.290 -3.768 2.504 1.00 . A A . 50 TRP H 1 1 2 1582 1 1 50 TRP HA H -15.006 -4.381 3.367 1.00 . A A . 50 TRP HA 1 1 2 1583 1 1 50 TRP HB2 H -14.158 -2.056 2.739 1.00 . A A . 50 TRP HB2 1 1 2 1584 1 1 50 TRP HB3 H -14.221 -2.607 1.070 1.00 . A A . 50 TRP HB3 1 1 2 1585 1 1 50 TRP HD1 H -16.402 -2.024 -0.122 1.00 . A A . 50 TRP HD1 1 1 2 1586 1 1 50 TRP HE1 H -18.822 -1.501 0.592 1.00 . A A . 50 TRP HE1 1 1 2 1587 1 1 50 TRP HE3 H -15.937 -2.786 4.912 1.00 . A A . 50 TRP HE3 1 1 2 1588 1 1 50 TRP HH2 H -20.064 -1.810 5.392 1.00 . A A . 50 TRP HH2 1 1 2 1589 1 1 50 TRP HZ2 H -20.326 -1.433 2.980 1.00 . A A . 50 TRP HZ2 1 1 2 1590 1 1 50 TRP HZ3 H -17.914 -2.474 6.340 1.00 . A A . 50 TRP HZ3 1 1 2 1591 1 1 50 TRP N N -12.991 -4.295 2.953 1.00 . A A . 50 TRP N 1 1 2 1592 1 1 50 TRP NE1 N -18.108 -1.766 1.221 1.00 . A A . 50 TRP NE1 1 1 2 1593 1 1 50 TRP O O -15.737 -5.852 1.472 1.00 . A A . 50 TRP O 1 1 2 1594 1 1 51 GLU C C -13.939 -7.467 -0.596 1.00 . A A . 51 GLU C 1 1 2 1595 1 1 51 GLU CA C -14.199 -5.983 -0.806 1.00 . A A . 51 GLU CA 1 1 2 1596 1 1 51 GLU CB C -13.406 -5.469 -2.007 1.00 . A A . 51 GLU CB 1 1 2 1597 1 1 51 GLU CD C -13.717 -3.944 -3.961 1.00 . A A . 51 GLU CD 1 1 2 1598 1 1 51 GLU CG C -13.826 -4.096 -2.463 1.00 . A A . 51 GLU CG 1 1 2 1599 1 1 51 GLU H H -13.033 -4.725 0.431 1.00 . A A . 51 GLU H 1 1 2 1600 1 1 51 GLU HA H -15.250 -5.850 -1.008 1.00 . A A . 51 GLU HA 1 1 2 1601 1 1 51 GLU HB2 H -12.359 -5.410 -1.741 1.00 . A A . 51 GLU HB2 1 1 2 1602 1 1 51 GLU HB3 H -13.528 -6.156 -2.831 1.00 . A A . 51 GLU HB3 1 1 2 1603 1 1 51 GLU HG2 H -14.852 -3.926 -2.167 1.00 . A A . 51 GLU HG2 1 1 2 1604 1 1 51 GLU HG3 H -13.183 -3.368 -1.987 1.00 . A A . 51 GLU HG3 1 1 2 1605 1 1 51 GLU N N -13.887 -5.210 0.382 1.00 . A A . 51 GLU N 1 1 2 1606 1 1 51 GLU O O -14.842 -8.288 -0.743 1.00 . A A . 51 GLU O 1 1 2 1607 1 1 51 GLU OE1 O -12.619 -4.169 -4.508 1.00 . A A . 51 GLU OE1 1 1 2 1608 1 1 51 GLU OE2 O -14.739 -3.615 -4.600 1.00 . A A . 51 GLU OE2 1 1 2 1609 1 1 52 LEU C C -12.389 -9.666 1.316 1.00 . A A . 52 LEU C 1 1 2 1610 1 1 52 LEU CA C -12.335 -9.209 -0.126 1.00 . A A . 52 LEU CA 1 1 2 1611 1 1 52 LEU CB C -10.933 -9.428 -0.677 1.00 . A A . 52 LEU CB 1 1 2 1612 1 1 52 LEU CD1 C -9.267 -9.114 -2.518 1.00 . A A . 52 LEU CD1 1 1 2 1613 1 1 52 LEU CD2 C -11.698 -9.318 -3.064 1.00 . A A . 52 LEU CD2 1 1 2 1614 1 1 52 LEU CG C -10.681 -8.809 -2.050 1.00 . A A . 52 LEU CG 1 1 2 1615 1 1 52 LEU H H -12.047 -7.110 -0.071 1.00 . A A . 52 LEU H 1 1 2 1616 1 1 52 LEU HA H -13.033 -9.791 -0.701 1.00 . A A . 52 LEU HA 1 1 2 1617 1 1 52 LEU HB2 H -10.228 -9.004 0.023 1.00 . A A . 52 LEU HB2 1 1 2 1618 1 1 52 LEU HB3 H -10.757 -10.489 -0.746 1.00 . A A . 52 LEU HB3 1 1 2 1619 1 1 52 LEU HD11 H -9.097 -8.652 -3.479 1.00 . A A . 52 LEU HD11 1 1 2 1620 1 1 52 LEU HD12 H -8.558 -8.726 -1.803 1.00 . A A . 52 LEU HD12 1 1 2 1621 1 1 52 LEU HD13 H -9.141 -10.184 -2.608 1.00 . A A . 52 LEU HD13 1 1 2 1622 1 1 52 LEU HD21 H -11.607 -10.391 -3.156 1.00 . A A . 52 LEU HD21 1 1 2 1623 1 1 52 LEU HD22 H -12.695 -9.070 -2.733 1.00 . A A . 52 LEU HD22 1 1 2 1624 1 1 52 LEU HD23 H -11.512 -8.858 -4.023 1.00 . A A . 52 LEU HD23 1 1 2 1625 1 1 52 LEU HG H -10.791 -7.732 -1.965 1.00 . A A . 52 LEU HG 1 1 2 1626 1 1 52 LEU N N -12.713 -7.809 -0.248 1.00 . A A . 52 LEU N 1 1 2 1627 1 1 52 LEU O O -12.804 -10.790 1.603 1.00 . A A . 52 LEU O 1 1 2 1628 1 1 53 ARG C C -10.946 -10.276 3.870 1.00 . A A . 53 ARG C 1 1 2 1629 1 1 53 ARG CA C -11.884 -9.085 3.636 1.00 . A A . 53 ARG CA 1 1 2 1630 1 1 53 ARG CB C -13.280 -9.361 4.210 1.00 . A A . 53 ARG CB 1 1 2 1631 1 1 53 ARG CD C -14.696 -10.043 6.162 1.00 . A A . 53 ARG CD 1 1 2 1632 1 1 53 ARG CG C -13.298 -9.661 5.700 1.00 . A A . 53 ARG CG 1 1 2 1633 1 1 53 ARG CZ C -15.743 -11.119 8.117 1.00 . A A . 53 ARG CZ 1 1 2 1634 1 1 53 ARG H H -11.703 -7.888 1.891 1.00 . A A . 53 ARG H 1 1 2 1635 1 1 53 ARG HA H -11.468 -8.219 4.130 1.00 . A A . 53 ARG HA 1 1 2 1636 1 1 53 ARG HB2 H -13.901 -8.495 4.037 1.00 . A A . 53 ARG HB2 1 1 2 1637 1 1 53 ARG HB3 H -13.708 -10.207 3.690 1.00 . A A . 53 ARG HB3 1 1 2 1638 1 1 53 ARG HD2 H -15.346 -9.189 6.039 1.00 . A A . 53 ARG HD2 1 1 2 1639 1 1 53 ARG HD3 H -15.053 -10.856 5.548 1.00 . A A . 53 ARG HD3 1 1 2 1640 1 1 53 ARG HE H -13.946 -10.236 8.119 1.00 . A A . 53 ARG HE 1 1 2 1641 1 1 53 ARG HG2 H -12.624 -10.480 5.902 1.00 . A A . 53 ARG HG2 1 1 2 1642 1 1 53 ARG HG3 H -12.976 -8.781 6.239 1.00 . A A . 53 ARG HG3 1 1 2 1643 1 1 53 ARG HH11 H -16.826 -11.229 6.402 1.00 . A A . 53 ARG HH11 1 1 2 1644 1 1 53 ARG HH12 H -17.567 -11.962 7.795 1.00 . A A . 53 ARG HH12 1 1 2 1645 1 1 53 ARG HH21 H -14.897 -11.216 9.961 1.00 . A A . 53 ARG HH21 1 1 2 1646 1 1 53 ARG HH22 H -16.464 -11.952 9.818 1.00 . A A . 53 ARG HH22 1 1 2 1647 1 1 53 ARG N N -11.967 -8.779 2.207 1.00 . A A . 53 ARG N 1 1 2 1648 1 1 53 ARG NE N -14.726 -10.459 7.564 1.00 . A A . 53 ARG NE 1 1 2 1649 1 1 53 ARG NH1 N -16.795 -11.462 7.380 1.00 . A A . 53 ARG NH1 1 1 2 1650 1 1 53 ARG NH2 N -15.699 -11.456 9.399 1.00 . A A . 53 ARG NH2 1 1 2 1651 1 1 53 ARG O O -9.717 -10.075 3.830 1.00 . A A . 53 ARG O 1 1 2 1652 1 1 53 ARG OXT O -11.437 -11.406 4.081 1.00 . A A . 53 ARG OXT 1 1 3 1653 1 1 1 ASN C C 13.666 -7.987 3.321 1.00 . A A . 1 ASN C 1 1 3 1654 1 1 1 ASN CA C 14.884 -7.193 2.888 1.00 . A A . 1 ASN CA 1 1 3 1655 1 1 1 ASN CB C 15.958 -8.140 2.349 1.00 . A A . 1 ASN CB 1 1 3 1656 1 1 1 ASN CG C 17.064 -7.404 1.619 1.00 . A A . 1 ASN CG 1 1 3 1657 1 1 1 ASN H1 H 15.772 -7.045 4.766 1.00 . A A . 1 ASN H1 1 1 3 1658 1 1 1 ASN H2 H 14.656 -5.817 4.430 1.00 . A A . 1 ASN H2 1 1 3 1659 1 1 1 ASN H3 H 16.190 -5.784 3.706 1.00 . A A . 1 ASN H3 1 1 3 1660 1 1 1 ASN HA H 14.591 -6.507 2.106 1.00 . A A . 1 ASN HA 1 1 3 1661 1 1 1 ASN HB2 H 16.397 -8.684 3.172 1.00 . A A . 1 ASN HB2 1 1 3 1662 1 1 1 ASN HB3 H 15.501 -8.839 1.664 1.00 . A A . 1 ASN HB3 1 1 3 1663 1 1 1 ASN HD21 H 18.406 -8.734 2.243 1.00 . A A . 1 ASN HD21 1 1 3 1664 1 1 1 ASN HD22 H 19.021 -7.448 1.253 1.00 . A A . 1 ASN HD22 1 1 3 1665 1 1 1 ASN N N 15.414 -6.406 4.025 1.00 . A A . 1 ASN N 1 1 3 1666 1 1 1 ASN ND2 N 18.282 -7.915 1.713 1.00 . A A . 1 ASN ND2 1 1 3 1667 1 1 1 ASN O O 13.506 -8.282 4.506 1.00 . A A . 1 ASN O 1 1 3 1668 1 1 1 ASN OD1 O 16.824 -6.381 0.978 1.00 . A A . 1 ASN OD1 1 1 3 1669 1 1 2 SER C C 10.659 -8.341 3.541 1.00 . A A . 2 SER C 1 1 3 1670 1 1 2 SER CA C 11.604 -9.094 2.605 1.00 . A A . 2 SER CA 1 1 3 1671 1 1 2 SER CB C 11.973 -10.467 3.182 1.00 . A A . 2 SER CB 1 1 3 1672 1 1 2 SER H H 12.990 -8.010 1.444 1.00 . A A . 2 SER H 1 1 3 1673 1 1 2 SER HA H 11.105 -9.238 1.657 1.00 . A A . 2 SER HA 1 1 3 1674 1 1 2 SER HB2 H 12.349 -10.347 4.188 1.00 . A A . 2 SER HB2 1 1 3 1675 1 1 2 SER HB3 H 11.097 -11.099 3.199 1.00 . A A . 2 SER HB3 1 1 3 1676 1 1 2 SER HG H 12.603 -11.871 1.951 1.00 . A A . 2 SER HG 1 1 3 1677 1 1 2 SER N N 12.809 -8.312 2.355 1.00 . A A . 2 SER N 1 1 3 1678 1 1 2 SER O O 10.552 -8.662 4.727 1.00 . A A . 2 SER O 1 1 3 1679 1 1 2 SER OG O 12.977 -11.093 2.391 1.00 . A A . 2 SER OG 1 1 3 1680 1 1 3 ASP C C 9.730 -5.849 4.950 1.00 . A A . 3 ASP C 1 1 3 1681 1 1 3 ASP CA C 9.048 -6.489 3.743 1.00 . A A . 3 ASP CA 1 1 3 1682 1 1 3 ASP CB C 7.855 -7.310 4.222 1.00 . A A . 3 ASP CB 1 1 3 1683 1 1 3 ASP CG C 6.785 -7.496 3.172 1.00 . A A . 3 ASP CG 1 1 3 1684 1 1 3 ASP H H 10.077 -7.176 2.020 1.00 . A A . 3 ASP H 1 1 3 1685 1 1 3 ASP HA H 8.698 -5.707 3.087 1.00 . A A . 3 ASP HA 1 1 3 1686 1 1 3 ASP HB2 H 8.217 -8.283 4.505 1.00 . A A . 3 ASP HB2 1 1 3 1687 1 1 3 ASP HB3 H 7.414 -6.829 5.083 1.00 . A A . 3 ASP HB3 1 1 3 1688 1 1 3 ASP N N 9.974 -7.336 2.981 1.00 . A A . 3 ASP N 1 1 3 1689 1 1 3 ASP O O 9.501 -6.257 6.089 1.00 . A A . 3 ASP O 1 1 3 1690 1 1 3 ASP OD1 O 5.991 -6.556 2.956 1.00 . A A . 3 ASP OD1 1 1 3 1691 1 1 3 ASP OD2 O 6.756 -8.563 2.535 1.00 . A A . 3 ASP OD2 1 1 3 1692 1 1 4 SER C C 11.466 -2.709 5.558 1.00 . A A . 4 SER C 1 1 3 1693 1 1 4 SER CA C 11.280 -4.206 5.798 1.00 . A A . 4 SER CA 1 1 3 1694 1 1 4 SER CB C 12.639 -4.880 5.971 1.00 . A A . 4 SER CB 1 1 3 1695 1 1 4 SER H H 10.683 -4.529 3.797 1.00 . A A . 4 SER H 1 1 3 1696 1 1 4 SER HA H 10.704 -4.345 6.700 1.00 . A A . 4 SER HA 1 1 3 1697 1 1 4 SER HB2 H 13.190 -4.378 6.753 1.00 . A A . 4 SER HB2 1 1 3 1698 1 1 4 SER HB3 H 12.495 -5.916 6.243 1.00 . A A . 4 SER HB3 1 1 3 1699 1 1 4 SER HG H 13.790 -3.940 4.687 1.00 . A A . 4 SER HG 1 1 3 1700 1 1 4 SER N N 10.556 -4.844 4.710 1.00 . A A . 4 SER N 1 1 3 1701 1 1 4 SER O O 11.697 -2.286 4.428 1.00 . A A . 4 SER O 1 1 3 1702 1 1 4 SER OG O 13.388 -4.823 4.767 1.00 . A A . 4 SER OG 1 1 3 1703 1 1 5 GLU C C 11.120 0.284 5.471 1.00 . A A . 5 GLU C 1 1 3 1704 1 1 5 GLU CA C 11.641 -0.501 6.682 1.00 . A A . 5 GLU CA 1 1 3 1705 1 1 5 GLU CB C 13.150 -0.290 6.834 1.00 . A A . 5 GLU CB 1 1 3 1706 1 1 5 GLU CD C 15.025 1.340 7.278 1.00 . A A . 5 GLU CD 1 1 3 1707 1 1 5 GLU CG C 13.528 1.130 7.221 1.00 . A A . 5 GLU CG 1 1 3 1708 1 1 5 GLU H H 10.987 -2.360 7.464 1.00 . A A . 5 GLU H 1 1 3 1709 1 1 5 GLU HA H 11.160 -0.105 7.562 1.00 . A A . 5 GLU HA 1 1 3 1710 1 1 5 GLU HB2 H 13.522 -0.960 7.597 1.00 . A A . 5 GLU HB2 1 1 3 1711 1 1 5 GLU HB3 H 13.631 -0.525 5.896 1.00 . A A . 5 GLU HB3 1 1 3 1712 1 1 5 GLU HG2 H 13.111 1.812 6.494 1.00 . A A . 5 GLU HG2 1 1 3 1713 1 1 5 GLU HG3 H 13.111 1.345 8.194 1.00 . A A . 5 GLU HG3 1 1 3 1714 1 1 5 GLU N N 11.326 -1.938 6.639 1.00 . A A . 5 GLU N 1 1 3 1715 1 1 5 GLU O O 9.970 0.727 5.470 1.00 . A A . 5 GLU O 1 1 3 1716 1 1 5 GLU OE1 O 15.676 0.771 8.179 1.00 . A A . 5 GLU OE1 1 1 3 1717 1 1 5 GLU OE2 O 15.556 2.082 6.426 1.00 . A A . 5 GLU OE2 1 1 3 1718 1 1 6 CYS C C 11.781 2.748 3.596 1.00 . A A . 6 CYS C 1 1 3 1719 1 1 6 CYS CA C 11.698 1.254 3.267 1.00 . A A . 6 CYS CA 1 1 3 1720 1 1 6 CYS CB C 10.328 0.900 2.666 1.00 . A A . 6 CYS CB 1 1 3 1721 1 1 6 CYS H H 12.848 -0.011 4.511 1.00 . A A . 6 CYS H 1 1 3 1722 1 1 6 CYS HA H 12.463 1.028 2.536 1.00 . A A . 6 CYS HA 1 1 3 1723 1 1 6 CYS HB2 H 10.327 -0.140 2.381 1.00 . A A . 6 CYS HB2 1 1 3 1724 1 1 6 CYS HB3 H 9.564 1.061 3.413 1.00 . A A . 6 CYS HB3 1 1 3 1725 1 1 6 CYS N N 11.985 0.442 4.455 1.00 . A A . 6 CYS N 1 1 3 1726 1 1 6 CYS O O 11.192 3.220 4.570 1.00 . A A . 6 CYS O 1 1 3 1727 1 1 6 CYS SG S 9.873 1.874 1.189 1.00 . A A . 6 CYS SG 1 1 3 1728 1 1 7 PRO C C 11.467 5.738 2.641 1.00 . A A . 7 PRO C 1 1 3 1729 1 1 7 PRO CA C 12.720 4.952 3.009 1.00 . A A . 7 PRO CA 1 1 3 1730 1 1 7 PRO CB C 13.874 5.310 2.074 1.00 . A A . 7 PRO CB 1 1 3 1731 1 1 7 PRO CD C 13.293 3.036 1.617 1.00 . A A . 7 PRO CD 1 1 3 1732 1 1 7 PRO CG C 13.804 4.301 0.984 1.00 . A A . 7 PRO CG 1 1 3 1733 1 1 7 PRO HA H 12.997 5.169 4.032 1.00 . A A . 7 PRO HA 1 1 3 1734 1 1 7 PRO HB2 H 13.738 6.313 1.697 1.00 . A A . 7 PRO HB2 1 1 3 1735 1 1 7 PRO HB3 H 14.811 5.247 2.610 1.00 . A A . 7 PRO HB3 1 1 3 1736 1 1 7 PRO HD2 H 12.640 2.515 0.934 1.00 . A A . 7 PRO HD2 1 1 3 1737 1 1 7 PRO HD3 H 14.115 2.402 1.916 1.00 . A A . 7 PRO HD3 1 1 3 1738 1 1 7 PRO HG2 H 13.123 4.639 0.218 1.00 . A A . 7 PRO HG2 1 1 3 1739 1 1 7 PRO HG3 H 14.787 4.141 0.567 1.00 . A A . 7 PRO HG3 1 1 3 1740 1 1 7 PRO N N 12.545 3.514 2.795 1.00 . A A . 7 PRO N 1 1 3 1741 1 1 7 PRO O O 10.708 5.331 1.764 1.00 . A A . 7 PRO O 1 1 3 1742 1 1 8 LEU C C 9.806 8.215 1.779 1.00 . A A . 8 LEU C 1 1 3 1743 1 1 8 LEU CA C 10.074 7.703 3.195 1.00 . A A . 8 LEU CA 1 1 3 1744 1 1 8 LEU CB C 10.185 8.885 4.153 1.00 . A A . 8 LEU CB 1 1 3 1745 1 1 8 LEU CD1 C 7.840 8.735 5.034 1.00 . A A . 8 LEU CD1 1 1 3 1746 1 1 8 LEU CD2 C 9.134 10.846 5.316 1.00 . A A . 8 LEU CD2 1 1 3 1747 1 1 8 LEU CG C 8.883 9.650 4.415 1.00 . A A . 8 LEU CG 1 1 3 1748 1 1 8 LEU H H 12.022 7.204 3.875 1.00 . A A . 8 LEU H 1 1 3 1749 1 1 8 LEU HA H 9.242 7.089 3.504 1.00 . A A . 8 LEU HA 1 1 3 1750 1 1 8 LEU HB2 H 10.560 8.513 5.088 1.00 . A A . 8 LEU HB2 1 1 3 1751 1 1 8 LEU HB3 H 10.907 9.578 3.747 1.00 . A A . 8 LEU HB3 1 1 3 1752 1 1 8 LEU HD11 H 8.221 8.327 5.959 1.00 . A A . 8 LEU HD11 1 1 3 1753 1 1 8 LEU HD12 H 6.940 9.299 5.233 1.00 . A A . 8 LEU HD12 1 1 3 1754 1 1 8 LEU HD13 H 7.618 7.929 4.350 1.00 . A A . 8 LEU HD13 1 1 3 1755 1 1 8 LEU HD21 H 9.824 11.522 4.832 1.00 . A A . 8 LEU HD21 1 1 3 1756 1 1 8 LEU HD22 H 8.202 11.355 5.505 1.00 . A A . 8 LEU HD22 1 1 3 1757 1 1 8 LEU HD23 H 9.556 10.509 6.252 1.00 . A A . 8 LEU HD23 1 1 3 1758 1 1 8 LEU HG H 8.493 10.013 3.476 1.00 . A A . 8 LEU HG 1 1 3 1759 1 1 8 LEU N N 11.293 6.886 3.290 1.00 . A A . 8 LEU N 1 1 3 1760 1 1 8 LEU O O 8.801 8.874 1.529 1.00 . A A . 8 LEU O 1 1 3 1761 1 1 9 SER C C 9.473 7.648 -1.198 1.00 . A A . 9 SER C 1 1 3 1762 1 1 9 SER CA C 10.592 8.387 -0.496 1.00 . A A . 9 SER CA 1 1 3 1763 1 1 9 SER CB C 11.914 8.164 -1.227 1.00 . A A . 9 SER CB 1 1 3 1764 1 1 9 SER H H 11.405 7.299 1.093 1.00 . A A . 9 SER H 1 1 3 1765 1 1 9 SER HA H 10.367 9.441 -0.471 1.00 . A A . 9 SER HA 1 1 3 1766 1 1 9 SER HB2 H 12.057 7.106 -1.395 1.00 . A A . 9 SER HB2 1 1 3 1767 1 1 9 SER HB3 H 11.894 8.681 -2.173 1.00 . A A . 9 SER HB3 1 1 3 1768 1 1 9 SER HG H 12.859 9.597 -0.270 1.00 . A A . 9 SER HG 1 1 3 1769 1 1 9 SER N N 10.694 7.908 0.863 1.00 . A A . 9 SER N 1 1 3 1770 1 1 9 SER O O 8.842 8.167 -2.112 1.00 . A A . 9 SER O 1 1 3 1771 1 1 9 SER OG O 13.001 8.656 -0.462 1.00 . A A . 9 SER OG 1 1 3 1772 1 1 10 HIS C C 6.892 5.762 -0.494 1.00 . A A . 10 HIS C 1 1 3 1773 1 1 10 HIS CA C 8.163 5.620 -1.320 1.00 . A A . 10 HIS CA 1 1 3 1774 1 1 10 HIS CB C 8.578 4.150 -1.420 1.00 . A A . 10 HIS CB 1 1 3 1775 1 1 10 HIS CD2 C 11.114 3.684 -1.660 1.00 . A A . 10 HIS CD2 1 1 3 1776 1 1 10 HIS CE1 C 11.258 3.783 -3.842 1.00 . A A . 10 HIS CE1 1 1 3 1777 1 1 10 HIS CG C 9.874 3.938 -2.138 1.00 . A A . 10 HIS CG 1 1 3 1778 1 1 10 HIS H H 9.751 6.072 0.002 1.00 . A A . 10 HIS H 1 1 3 1779 1 1 10 HIS HA H 7.979 6.003 -2.306 1.00 . A A . 10 HIS HA 1 1 3 1780 1 1 10 HIS HB2 H 8.678 3.744 -0.425 1.00 . A A . 10 HIS HB2 1 1 3 1781 1 1 10 HIS HB3 H 7.812 3.603 -1.951 1.00 . A A . 10 HIS HB3 1 1 3 1782 1 1 10 HIS HD1 H 9.263 4.163 -4.150 1.00 . A A . 10 HIS HD1 1 1 3 1783 1 1 10 HIS HD2 H 11.391 3.578 -0.620 1.00 . A A . 10 HIS HD2 1 1 3 1784 1 1 10 HIS HE1 H 11.653 3.775 -4.846 1.00 . A A . 10 HIS HE1 1 1 3 1785 1 1 10 HIS HE2 H 12.935 3.483 -2.690 1.00 . A A . 10 HIS HE2 1 1 3 1786 1 1 10 HIS N N 9.221 6.427 -0.744 1.00 . A A . 10 HIS N 1 1 3 1787 1 1 10 HIS ND1 N 9.999 3.994 -3.508 1.00 . A A . 10 HIS ND1 1 1 3 1788 1 1 10 HIS NE2 N 11.952 3.592 -2.737 1.00 . A A . 10 HIS NE2 1 1 3 1789 1 1 10 HIS O O 5.815 5.986 -1.032 1.00 . A A . 10 HIS O 1 1 3 1790 1 1 11 ASP C C 5.316 7.214 1.527 1.00 . A A . 11 ASP C 1 1 3 1791 1 1 11 ASP CA C 5.954 5.854 1.772 1.00 . A A . 11 ASP CA 1 1 3 1792 1 1 11 ASP CB C 6.505 5.794 3.201 1.00 . A A . 11 ASP CB 1 1 3 1793 1 1 11 ASP CG C 5.431 5.913 4.266 1.00 . A A . 11 ASP CG 1 1 3 1794 1 1 11 ASP H H 7.900 5.338 1.163 1.00 . A A . 11 ASP H 1 1 3 1795 1 1 11 ASP HA H 5.214 5.081 1.639 1.00 . A A . 11 ASP HA 1 1 3 1796 1 1 11 ASP HB2 H 7.019 4.854 3.340 1.00 . A A . 11 ASP HB2 1 1 3 1797 1 1 11 ASP HB3 H 7.209 6.602 3.336 1.00 . A A . 11 ASP HB3 1 1 3 1798 1 1 11 ASP N N 7.041 5.626 0.820 1.00 . A A . 11 ASP N 1 1 3 1799 1 1 11 ASP O O 4.098 7.332 1.411 1.00 . A A . 11 ASP O 1 1 3 1800 1 1 11 ASP OD1 O 4.937 7.034 4.508 1.00 . A A . 11 ASP OD1 1 1 3 1801 1 1 11 ASP OD2 O 5.095 4.884 4.883 1.00 . A A . 11 ASP OD2 1 1 3 1802 1 1 12 GLY C C 5.150 9.712 -0.244 1.00 . A A . 12 GLY C 1 1 3 1803 1 1 12 GLY CA C 5.687 9.574 1.161 1.00 . A A . 12 GLY CA 1 1 3 1804 1 1 12 GLY H H 7.117 8.075 1.551 1.00 . A A . 12 GLY H 1 1 3 1805 1 1 12 GLY HA2 H 4.902 9.819 1.861 1.00 . A A . 12 GLY HA2 1 1 3 1806 1 1 12 GLY HA3 H 6.506 10.267 1.295 1.00 . A A . 12 GLY HA3 1 1 3 1807 1 1 12 GLY N N 6.158 8.233 1.432 1.00 . A A . 12 GLY N 1 1 3 1808 1 1 12 GLY O O 4.337 10.594 -0.518 1.00 . A A . 12 GLY O 1 1 3 1809 1 1 13 TYR C C 3.668 8.265 -2.528 1.00 . A A . 13 TYR C 1 1 3 1810 1 1 13 TYR CA C 5.086 8.837 -2.509 1.00 . A A . 13 TYR CA 1 1 3 1811 1 1 13 TYR CB C 6.003 8.037 -3.440 1.00 . A A . 13 TYR CB 1 1 3 1812 1 1 13 TYR CD1 C 5.782 9.251 -5.649 1.00 . A A . 13 TYR CD1 1 1 3 1813 1 1 13 TYR CD2 C 5.023 6.994 -5.518 1.00 . A A . 13 TYR CD2 1 1 3 1814 1 1 13 TYR CE1 C 5.408 9.302 -6.979 1.00 . A A . 13 TYR CE1 1 1 3 1815 1 1 13 TYR CE2 C 4.649 7.039 -6.846 1.00 . A A . 13 TYR CE2 1 1 3 1816 1 1 13 TYR CG C 5.596 8.098 -4.895 1.00 . A A . 13 TYR CG 1 1 3 1817 1 1 13 TYR CZ C 4.852 8.224 -7.573 1.00 . A A . 13 TYR CZ 1 1 3 1818 1 1 13 TYR H H 6.311 8.199 -0.885 1.00 . A A . 13 TYR H 1 1 3 1819 1 1 13 TYR HA H 5.048 9.863 -2.850 1.00 . A A . 13 TYR HA 1 1 3 1820 1 1 13 TYR HB2 H 7.007 8.424 -3.361 1.00 . A A . 13 TYR HB2 1 1 3 1821 1 1 13 TYR HB3 H 5.995 7.001 -3.135 1.00 . A A . 13 TYR HB3 1 1 3 1822 1 1 13 TYR HD1 H 6.227 10.118 -5.182 1.00 . A A . 13 TYR HD1 1 1 3 1823 1 1 13 TYR HD2 H 4.872 6.089 -4.948 1.00 . A A . 13 TYR HD2 1 1 3 1824 1 1 13 TYR HE1 H 5.559 10.208 -7.548 1.00 . A A . 13 TYR HE1 1 1 3 1825 1 1 13 TYR HE2 H 4.204 6.172 -7.310 1.00 . A A . 13 TYR HE2 1 1 3 1826 1 1 13 TYR HH H 5.190 8.638 -9.411 1.00 . A A . 13 TYR HH 1 1 3 1827 1 1 13 TYR N N 5.605 8.845 -1.144 1.00 . A A . 13 TYR N 1 1 3 1828 1 1 13 TYR O O 2.852 8.630 -3.375 1.00 . A A . 13 TYR O 1 1 3 1829 1 1 13 TYR OH O 4.472 8.243 -8.896 1.00 . A A . 13 TYR OH 1 1 3 1830 1 1 14 CYS C C 1.025 7.904 -1.143 1.00 . A A . 14 CYS C 1 1 3 1831 1 1 14 CYS CA C 2.050 6.805 -1.421 1.00 . A A . 14 CYS CA 1 1 3 1832 1 1 14 CYS CB C 2.056 5.763 -0.301 1.00 . A A . 14 CYS CB 1 1 3 1833 1 1 14 CYS H H 4.096 7.095 -0.965 1.00 . A A . 14 CYS H 1 1 3 1834 1 1 14 CYS HA H 1.790 6.317 -2.350 1.00 . A A . 14 CYS HA 1 1 3 1835 1 1 14 CYS HB2 H 2.560 6.173 0.563 1.00 . A A . 14 CYS HB2 1 1 3 1836 1 1 14 CYS HB3 H 1.037 5.526 -0.036 1.00 . A A . 14 CYS HB3 1 1 3 1837 1 1 14 CYS N N 3.384 7.375 -1.580 1.00 . A A . 14 CYS N 1 1 3 1838 1 1 14 CYS O O 1.361 8.976 -0.630 1.00 . A A . 14 CYS O 1 1 3 1839 1 1 14 CYS SG S 2.895 4.202 -0.735 1.00 . A A . 14 CYS SG 1 1 3 1840 1 1 15 LEU C C -2.141 8.677 -0.306 1.00 . A A . 15 LEU C 1 1 3 1841 1 1 15 LEU CA C -1.247 8.674 -1.529 1.00 . A A . 15 LEU CA 1 1 3 1842 1 1 15 LEU CB C -2.117 8.499 -2.771 1.00 . A A . 15 LEU CB 1 1 3 1843 1 1 15 LEU CD1 C -2.331 7.949 -5.187 1.00 . A A . 15 LEU CD1 1 1 3 1844 1 1 15 LEU CD2 C -0.456 9.408 -4.409 1.00 . A A . 15 LEU CD2 1 1 3 1845 1 1 15 LEU CG C -1.357 8.232 -4.058 1.00 . A A . 15 LEU CG 1 1 3 1846 1 1 15 LEU H H -0.491 6.702 -1.659 1.00 . A A . 15 LEU H 1 1 3 1847 1 1 15 LEU HA H -0.742 9.623 -1.591 1.00 . A A . 15 LEU HA 1 1 3 1848 1 1 15 LEU HB2 H -2.792 7.673 -2.597 1.00 . A A . 15 LEU HB2 1 1 3 1849 1 1 15 LEU HB3 H -2.701 9.397 -2.905 1.00 . A A . 15 LEU HB3 1 1 3 1850 1 1 15 LEU HD11 H -1.781 7.742 -6.094 1.00 . A A . 15 LEU HD11 1 1 3 1851 1 1 15 LEU HD12 H -2.938 7.094 -4.931 1.00 . A A . 15 LEU HD12 1 1 3 1852 1 1 15 LEU HD13 H -2.965 8.810 -5.338 1.00 . A A . 15 LEU HD13 1 1 3 1853 1 1 15 LEU HD21 H -1.056 10.297 -4.535 1.00 . A A . 15 LEU HD21 1 1 3 1854 1 1 15 LEU HD22 H 0.257 9.565 -3.613 1.00 . A A . 15 LEU HD22 1 1 3 1855 1 1 15 LEU HD23 H 0.073 9.197 -5.328 1.00 . A A . 15 LEU HD23 1 1 3 1856 1 1 15 LEU HG H -0.736 7.360 -3.914 1.00 . A A . 15 LEU HG 1 1 3 1857 1 1 15 LEU N N -0.234 7.629 -1.471 1.00 . A A . 15 LEU N 1 1 3 1858 1 1 15 LEU O O -1.897 9.401 0.650 1.00 . A A . 15 LEU O 1 1 3 1859 1 1 16 HIS C C -3.873 7.089 1.899 1.00 . A A . 16 HIS C 1 1 3 1860 1 1 16 HIS CA C -4.221 7.910 0.668 1.00 . A A . 16 HIS CA 1 1 3 1861 1 1 16 HIS CB C -5.561 7.465 0.075 1.00 . A A . 16 HIS CB 1 1 3 1862 1 1 16 HIS CD2 C -6.055 8.266 -2.346 1.00 . A A . 16 HIS CD2 1 1 3 1863 1 1 16 HIS CE1 C -7.004 10.180 -1.864 1.00 . A A . 16 HIS CE1 1 1 3 1864 1 1 16 HIS CG C -6.074 8.383 -0.997 1.00 . A A . 16 HIS CG 1 1 3 1865 1 1 16 HIS H H -3.203 7.143 -1.029 1.00 . A A . 16 HIS H 1 1 3 1866 1 1 16 HIS HA H -4.304 8.942 0.968 1.00 . A A . 16 HIS HA 1 1 3 1867 1 1 16 HIS HB2 H -5.448 6.484 -0.358 1.00 . A A . 16 HIS HB2 1 1 3 1868 1 1 16 HIS HB3 H -6.300 7.425 0.862 1.00 . A A . 16 HIS HB3 1 1 3 1869 1 1 16 HIS HD1 H -6.831 9.976 0.171 1.00 . A A . 16 HIS HD1 1 1 3 1870 1 1 16 HIS HD2 H -5.659 7.437 -2.913 1.00 . A A . 16 HIS HD2 1 1 3 1871 1 1 16 HIS HE1 H -7.490 11.139 -1.962 1.00 . A A . 16 HIS HE1 1 1 3 1872 1 1 16 HIS HE2 H -6.756 9.602 -3.819 1.00 . A A . 16 HIS HE2 1 1 3 1873 1 1 16 HIS N N -3.167 7.839 -0.332 1.00 . A A . 16 HIS N 1 1 3 1874 1 1 16 HIS ND1 N -6.675 9.594 -0.730 1.00 . A A . 16 HIS ND1 1 1 3 1875 1 1 16 HIS NE2 N -6.639 9.397 -2.859 1.00 . A A . 16 HIS NE2 1 1 3 1876 1 1 16 HIS O O -4.616 6.179 2.272 1.00 . A A . 16 HIS O 1 1 3 1877 1 1 17 ASP C C -1.369 5.642 3.566 1.00 . A A . 17 ASP C 1 1 3 1878 1 1 17 ASP CA C -2.245 6.884 3.768 1.00 . A A . 17 ASP CA 1 1 3 1879 1 1 17 ASP CB C -3.432 6.597 4.694 1.00 . A A . 17 ASP CB 1 1 3 1880 1 1 17 ASP CG C -3.041 6.291 6.130 1.00 . A A . 17 ASP CG 1 1 3 1881 1 1 17 ASP H H -2.151 8.076 2.030 1.00 . A A . 17 ASP H 1 1 3 1882 1 1 17 ASP HA H -1.633 7.647 4.223 1.00 . A A . 17 ASP HA 1 1 3 1883 1 1 17 ASP HB2 H -4.083 7.458 4.700 1.00 . A A . 17 ASP HB2 1 1 3 1884 1 1 17 ASP HB3 H -3.973 5.752 4.290 1.00 . A A . 17 ASP HB3 1 1 3 1885 1 1 17 ASP N N -2.718 7.426 2.487 1.00 . A A . 17 ASP N 1 1 3 1886 1 1 17 ASP O O -1.126 4.872 4.495 1.00 . A A . 17 ASP O 1 1 3 1887 1 1 17 ASP OD1 O -2.246 7.060 6.708 1.00 . A A . 17 ASP OD1 1 1 3 1888 1 1 17 ASP OD2 O -3.562 5.304 6.698 1.00 . A A . 17 ASP OD2 1 1 3 1889 1 1 18 GLY C C 1.257 4.306 2.829 1.00 . A A . 18 GLY C 1 1 3 1890 1 1 18 GLY CA C 0.003 4.389 1.989 1.00 . A A . 18 GLY CA 1 1 3 1891 1 1 18 GLY H H -1.275 5.993 1.608 1.00 . A A . 18 GLY H 1 1 3 1892 1 1 18 GLY HA2 H -0.522 3.449 2.078 1.00 . A A . 18 GLY HA2 1 1 3 1893 1 1 18 GLY HA3 H 0.293 4.513 0.956 1.00 . A A . 18 GLY HA3 1 1 3 1894 1 1 18 GLY N N -0.917 5.451 2.328 1.00 . A A . 18 GLY N 1 1 3 1895 1 1 18 GLY O O 1.585 5.197 3.611 1.00 . A A . 18 GLY O 1 1 3 1896 1 1 19 VAL C C 3.872 1.819 2.447 1.00 . A A . 19 VAL C 1 1 3 1897 1 1 19 VAL CA C 3.116 2.786 3.345 1.00 . A A . 19 VAL CA 1 1 3 1898 1 1 19 VAL CB C 2.660 2.076 4.652 1.00 . A A . 19 VAL CB 1 1 3 1899 1 1 19 VAL CG1 C 3.744 1.163 5.209 1.00 . A A . 19 VAL CG1 1 1 3 1900 1 1 19 VAL CG2 C 2.255 3.087 5.711 1.00 . A A . 19 VAL CG2 1 1 3 1901 1 1 19 VAL H H 1.730 2.706 1.787 1.00 . A A . 19 VAL H 1 1 3 1902 1 1 19 VAL HA H 3.737 3.638 3.586 1.00 . A A . 19 VAL HA 1 1 3 1903 1 1 19 VAL HB H 1.791 1.477 4.417 1.00 . A A . 19 VAL HB 1 1 3 1904 1 1 19 VAL HG11 H 3.378 0.670 6.098 1.00 . A A . 19 VAL HG11 1 1 3 1905 1 1 19 VAL HG12 H 4.007 0.421 4.469 1.00 . A A . 19 VAL HG12 1 1 3 1906 1 1 19 VAL HG13 H 4.617 1.749 5.457 1.00 . A A . 19 VAL HG13 1 1 3 1907 1 1 19 VAL HG21 H 3.088 3.739 5.924 1.00 . A A . 19 VAL HG21 1 1 3 1908 1 1 19 VAL HG22 H 1.422 3.674 5.348 1.00 . A A . 19 VAL HG22 1 1 3 1909 1 1 19 VAL HG23 H 1.964 2.568 6.612 1.00 . A A . 19 VAL HG23 1 1 3 1910 1 1 19 VAL N N 1.971 3.232 2.574 1.00 . A A . 19 VAL N 1 1 3 1911 1 1 19 VAL O O 3.239 1.133 1.650 1.00 . A A . 19 VAL O 1 1 3 1912 1 1 20 CYS C C 6.755 -0.099 2.275 1.00 . A A . 20 CYS C 1 1 3 1913 1 1 20 CYS CA C 5.947 0.974 1.578 1.00 . A A . 20 CYS CA 1 1 3 1914 1 1 20 CYS CB C 6.868 1.877 0.751 1.00 . A A . 20 CYS CB 1 1 3 1915 1 1 20 CYS H H 5.655 2.186 3.285 1.00 . A A . 20 CYS H 1 1 3 1916 1 1 20 CYS HA H 5.245 0.495 0.913 1.00 . A A . 20 CYS HA 1 1 3 1917 1 1 20 CYS HB2 H 7.389 1.275 0.024 1.00 . A A . 20 CYS HB2 1 1 3 1918 1 1 20 CYS HB3 H 6.267 2.613 0.235 1.00 . A A . 20 CYS HB3 1 1 3 1919 1 1 20 CYS N N 5.187 1.754 2.537 1.00 . A A . 20 CYS N 1 1 3 1920 1 1 20 CYS O O 7.460 0.174 3.245 1.00 . A A . 20 CYS O 1 1 3 1921 1 1 20 CYS SG S 8.130 2.773 1.719 1.00 . A A . 20 CYS SG 1 1 3 1922 1 1 21 MET C C 7.344 -3.642 1.394 1.00 . A A . 21 MET C 1 1 3 1923 1 1 21 MET CA C 7.424 -2.420 2.312 1.00 . A A . 21 MET CA 1 1 3 1924 1 1 21 MET CB C 6.989 -2.784 3.741 1.00 . A A . 21 MET CB 1 1 3 1925 1 1 21 MET CE C 5.381 -2.204 6.426 1.00 . A A . 21 MET CE 1 1 3 1926 1 1 21 MET CG C 5.548 -3.258 3.865 1.00 . A A . 21 MET CG 1 1 3 1927 1 1 21 MET H H 5.942 -1.504 1.115 1.00 . A A . 21 MET H 1 1 3 1928 1 1 21 MET HA H 8.448 -2.082 2.339 1.00 . A A . 21 MET HA 1 1 3 1929 1 1 21 MET HB2 H 7.631 -3.563 4.109 1.00 . A A . 21 MET HB2 1 1 3 1930 1 1 21 MET HB3 H 7.108 -1.913 4.369 1.00 . A A . 21 MET HB3 1 1 3 1931 1 1 21 MET HE1 H 4.761 -1.431 5.998 1.00 . A A . 21 MET HE1 1 1 3 1932 1 1 21 MET HE2 H 5.126 -2.334 7.467 1.00 . A A . 21 MET HE2 1 1 3 1933 1 1 21 MET HE3 H 6.421 -1.919 6.344 1.00 . A A . 21 MET HE3 1 1 3 1934 1 1 21 MET HG2 H 4.892 -2.458 3.554 1.00 . A A . 21 MET HG2 1 1 3 1935 1 1 21 MET HG3 H 5.408 -4.108 3.212 1.00 . A A . 21 MET HG3 1 1 3 1936 1 1 21 MET N N 6.620 -1.326 1.804 1.00 . A A . 21 MET N 1 1 3 1937 1 1 21 MET O O 6.288 -4.241 1.240 1.00 . A A . 21 MET O 1 1 3 1938 1 1 21 MET SD S 5.112 -3.742 5.545 1.00 . A A . 21 MET SD 1 1 3 1939 1 1 22 TYR C C 10.099 -5.512 -0.120 1.00 . A A . 22 TYR C 1 1 3 1940 1 1 22 TYR CA C 8.626 -5.249 0.091 1.00 . A A . 22 TYR CA 1 1 3 1941 1 1 22 TYR CB C 7.848 -5.367 -1.214 1.00 . A A . 22 TYR CB 1 1 3 1942 1 1 22 TYR CD1 C 5.818 -6.682 -0.505 1.00 . A A . 22 TYR CD1 1 1 3 1943 1 1 22 TYR CD2 C 7.292 -7.675 -2.087 1.00 . A A . 22 TYR CD2 1 1 3 1944 1 1 22 TYR CE1 C 5.008 -7.796 -0.548 1.00 . A A . 22 TYR CE1 1 1 3 1945 1 1 22 TYR CE2 C 6.486 -8.796 -2.134 1.00 . A A . 22 TYR CE2 1 1 3 1946 1 1 22 TYR CG C 6.971 -6.600 -1.272 1.00 . A A . 22 TYR CG 1 1 3 1947 1 1 22 TYR CZ C 5.344 -8.851 -1.362 1.00 . A A . 22 TYR CZ 1 1 3 1948 1 1 22 TYR H H 9.136 -3.273 0.594 1.00 . A A . 22 TYR H 1 1 3 1949 1 1 22 TYR HA H 8.270 -5.983 0.765 1.00 . A A . 22 TYR HA 1 1 3 1950 1 1 22 TYR HB2 H 7.213 -4.502 -1.330 1.00 . A A . 22 TYR HB2 1 1 3 1951 1 1 22 TYR HB3 H 8.543 -5.414 -2.034 1.00 . A A . 22 TYR HB3 1 1 3 1952 1 1 22 TYR HD1 H 5.557 -5.853 0.134 1.00 . A A . 22 TYR HD1 1 1 3 1953 1 1 22 TYR HD2 H 8.188 -7.631 -2.690 1.00 . A A . 22 TYR HD2 1 1 3 1954 1 1 22 TYR HE1 H 4.114 -7.836 0.059 1.00 . A A . 22 TYR HE1 1 1 3 1955 1 1 22 TYR HE2 H 6.752 -9.625 -2.775 1.00 . A A . 22 TYR HE2 1 1 3 1956 1 1 22 TYR HH H 3.609 -9.674 -1.509 1.00 . A A . 22 TYR HH 1 1 3 1957 1 1 22 TYR N N 8.446 -3.948 0.713 1.00 . A A . 22 TYR N 1 1 3 1958 1 1 22 TYR O O 10.589 -6.566 0.258 1.00 . A A . 22 TYR O 1 1 3 1959 1 1 22 TYR OH O 4.530 -9.960 -1.407 1.00 . A A . 22 TYR OH 1 1 3 1960 1 1 23 ILE C C 12.958 -5.742 -0.482 1.00 . A A . 23 ILE C 1 1 3 1961 1 1 23 ILE CA C 12.222 -4.486 -0.951 1.00 . A A . 23 ILE CA 1 1 3 1962 1 1 23 ILE CB C 12.902 -3.234 -0.352 1.00 . A A . 23 ILE CB 1 1 3 1963 1 1 23 ILE CD1 C 13.245 -1.888 1.780 1.00 . A A . 23 ILE CD1 1 1 3 1964 1 1 23 ILE CG1 C 12.520 -3.041 1.120 1.00 . A A . 23 ILE CG1 1 1 3 1965 1 1 23 ILE CG2 C 12.540 -1.999 -1.164 1.00 . A A . 23 ILE CG2 1 1 3 1966 1 1 23 ILE H H 10.244 -3.731 -0.962 1.00 . A A . 23 ILE H 1 1 3 1967 1 1 23 ILE HA H 12.337 -4.425 -2.024 1.00 . A A . 23 ILE HA 1 1 3 1968 1 1 23 ILE HB H 13.972 -3.370 -0.420 1.00 . A A . 23 ILE HB 1 1 3 1969 1 1 23 ILE HD11 H 13.031 -0.973 1.248 1.00 . A A . 23 ILE HD11 1 1 3 1970 1 1 23 ILE HD12 H 12.915 -1.795 2.805 1.00 . A A . 23 ILE HD12 1 1 3 1971 1 1 23 ILE HD13 H 14.309 -2.074 1.762 1.00 . A A . 23 ILE HD13 1 1 3 1972 1 1 23 ILE HG12 H 11.459 -2.851 1.189 1.00 . A A . 23 ILE HG12 1 1 3 1973 1 1 23 ILE HG13 H 12.758 -3.942 1.667 1.00 . A A . 23 ILE HG13 1 1 3 1974 1 1 23 ILE HG21 H 11.470 -1.854 -1.144 1.00 . A A . 23 ILE HG21 1 1 3 1975 1 1 23 ILE HG22 H 13.028 -1.134 -0.738 1.00 . A A . 23 ILE HG22 1 1 3 1976 1 1 23 ILE HG23 H 12.866 -2.129 -2.185 1.00 . A A . 23 ILE HG23 1 1 3 1977 1 1 23 ILE N N 10.767 -4.506 -0.687 1.00 . A A . 23 ILE N 1 1 3 1978 1 1 23 ILE O O 13.568 -5.783 0.583 1.00 . A A . 23 ILE O 1 1 3 1979 1 1 24 GLU C C 14.857 -8.154 -1.665 1.00 . A A . 24 GLU C 1 1 3 1980 1 1 24 GLU CA C 13.477 -8.058 -1.039 1.00 . A A . 24 GLU CA 1 1 3 1981 1 1 24 GLU CB C 12.584 -9.117 -1.651 1.00 . A A . 24 GLU CB 1 1 3 1982 1 1 24 GLU CD C 10.277 -10.059 -1.837 1.00 . A A . 24 GLU CD 1 1 3 1983 1 1 24 GLU CG C 11.241 -9.277 -0.973 1.00 . A A . 24 GLU CG 1 1 3 1984 1 1 24 GLU H H 12.392 -6.642 -2.150 1.00 . A A . 24 GLU H 1 1 3 1985 1 1 24 GLU HA H 13.540 -8.202 0.028 1.00 . A A . 24 GLU HA 1 1 3 1986 1 1 24 GLU HB2 H 12.402 -8.826 -2.674 1.00 . A A . 24 GLU HB2 1 1 3 1987 1 1 24 GLU HB3 H 13.097 -10.067 -1.636 1.00 . A A . 24 GLU HB3 1 1 3 1988 1 1 24 GLU HG2 H 11.381 -9.805 -0.041 1.00 . A A . 24 GLU HG2 1 1 3 1989 1 1 24 GLU HG3 H 10.824 -8.296 -0.777 1.00 . A A . 24 GLU HG3 1 1 3 1990 1 1 24 GLU N N 12.883 -6.760 -1.314 1.00 . A A . 24 GLU N 1 1 3 1991 1 1 24 GLU O O 15.312 -9.240 -2.021 1.00 . A A . 24 GLU O 1 1 3 1992 1 1 24 GLU OE1 O 9.701 -9.473 -2.780 1.00 . A A . 24 GLU OE1 1 1 3 1993 1 1 24 GLU OE2 O 10.064 -11.254 -1.553 1.00 . A A . 24 GLU OE2 1 1 3 1994 1 1 25 ALA C C 16.437 -7.003 -4.052 1.00 . A A . 25 ALA C 1 1 3 1995 1 1 25 ALA CA C 16.737 -6.852 -2.570 1.00 . A A . 25 ALA CA 1 1 3 1996 1 1 25 ALA CB C 17.806 -7.841 -2.113 1.00 . A A . 25 ALA CB 1 1 3 1997 1 1 25 ALA H H 15.087 -6.197 -1.423 1.00 . A A . 25 ALA H 1 1 3 1998 1 1 25 ALA HA H 17.107 -5.851 -2.396 1.00 . A A . 25 ALA HA 1 1 3 1999 1 1 25 ALA HB1 H 18.721 -7.653 -2.651 1.00 . A A . 25 ALA HB1 1 1 3 2000 1 1 25 ALA HB2 H 17.979 -7.718 -1.054 1.00 . A A . 25 ALA HB2 1 1 3 2001 1 1 25 ALA HB3 H 17.472 -8.850 -2.307 1.00 . A A . 25 ALA HB3 1 1 3 2002 1 1 25 ALA N N 15.488 -6.995 -1.819 1.00 . A A . 25 ALA N 1 1 3 2003 1 1 25 ALA O O 17.330 -7.144 -4.884 1.00 . A A . 25 ALA O 1 1 3 2004 1 1 26 LEU C C 13.975 -5.773 -6.103 1.00 . A A . 26 LEU C 1 1 3 2005 1 1 26 LEU CA C 14.649 -7.064 -5.711 1.00 . A A . 26 LEU CA 1 1 3 2006 1 1 26 LEU CB C 13.657 -8.222 -5.827 1.00 . A A . 26 LEU CB 1 1 3 2007 1 1 26 LEU CD1 C 13.088 -10.616 -5.422 1.00 . A A . 26 LEU CD1 1 1 3 2008 1 1 26 LEU CD2 C 15.290 -10.026 -6.417 1.00 . A A . 26 LEU CD2 1 1 3 2009 1 1 26 LEU CG C 14.206 -9.594 -5.446 1.00 . A A . 26 LEU CG 1 1 3 2010 1 1 26 LEU H H 14.506 -6.820 -3.631 1.00 . A A . 26 LEU H 1 1 3 2011 1 1 26 LEU HA H 15.481 -7.236 -6.363 1.00 . A A . 26 LEU HA 1 1 3 2012 1 1 26 LEU HB2 H 12.811 -8.007 -5.191 1.00 . A A . 26 LEU HB2 1 1 3 2013 1 1 26 LEU HB3 H 13.313 -8.269 -6.849 1.00 . A A . 26 LEU HB3 1 1 3 2014 1 1 26 LEU HD11 H 12.640 -10.681 -6.402 1.00 . A A . 26 LEU HD11 1 1 3 2015 1 1 26 LEU HD12 H 13.487 -11.579 -5.143 1.00 . A A . 26 LEU HD12 1 1 3 2016 1 1 26 LEU HD13 H 12.342 -10.316 -4.703 1.00 . A A . 26 LEU HD13 1 1 3 2017 1 1 26 LEU HD21 H 15.669 -10.996 -6.127 1.00 . A A . 26 LEU HD21 1 1 3 2018 1 1 26 LEU HD22 H 14.878 -10.083 -7.413 1.00 . A A . 26 LEU HD22 1 1 3 2019 1 1 26 LEU HD23 H 16.094 -9.305 -6.402 1.00 . A A . 26 LEU HD23 1 1 3 2020 1 1 26 LEU HG H 14.639 -9.543 -4.457 1.00 . A A . 26 LEU HG 1 1 3 2021 1 1 26 LEU N N 15.146 -6.951 -4.354 1.00 . A A . 26 LEU N 1 1 3 2022 1 1 26 LEU O O 13.403 -5.652 -7.187 1.00 . A A . 26 LEU O 1 1 3 2023 1 1 27 ASP C C 11.984 -3.560 -5.526 1.00 . A A . 27 ASP C 1 1 3 2024 1 1 27 ASP CA C 13.495 -3.488 -5.378 1.00 . A A . 27 ASP CA 1 1 3 2025 1 1 27 ASP CB C 14.155 -2.838 -6.592 1.00 . A A . 27 ASP CB 1 1 3 2026 1 1 27 ASP CG C 14.175 -1.326 -6.501 1.00 . A A . 27 ASP CG 1 1 3 2027 1 1 27 ASP H H 14.449 -5.038 -4.308 1.00 . A A . 27 ASP H 1 1 3 2028 1 1 27 ASP HA H 13.727 -2.905 -4.498 1.00 . A A . 27 ASP HA 1 1 3 2029 1 1 27 ASP HB2 H 15.174 -3.190 -6.661 1.00 . A A . 27 ASP HB2 1 1 3 2030 1 1 27 ASP HB3 H 13.618 -3.123 -7.483 1.00 . A A . 27 ASP HB3 1 1 3 2031 1 1 27 ASP N N 14.030 -4.825 -5.173 1.00 . A A . 27 ASP N 1 1 3 2032 1 1 27 ASP O O 11.397 -3.093 -6.504 1.00 . A A . 27 ASP O 1 1 3 2033 1 1 27 ASP OD1 O 14.952 -0.778 -5.698 1.00 . A A . 27 ASP OD1 1 1 3 2034 1 1 27 ASP OD2 O 13.396 -0.677 -7.230 1.00 . A A . 27 ASP OD2 1 1 3 2035 1 1 28 LYS C C 9.231 -3.330 -3.656 1.00 . A A . 28 LYS C 1 1 3 2036 1 1 28 LYS CA C 9.927 -4.379 -4.509 1.00 . A A . 28 LYS CA 1 1 3 2037 1 1 28 LYS CB C 9.617 -5.758 -3.927 1.00 . A A . 28 LYS CB 1 1 3 2038 1 1 28 LYS CD C 9.878 -7.287 -5.918 1.00 . A A . 28 LYS CD 1 1 3 2039 1 1 28 LYS CE C 8.539 -8.012 -5.812 1.00 . A A . 28 LYS CE 1 1 3 2040 1 1 28 LYS CG C 10.417 -6.896 -4.548 1.00 . A A . 28 LYS CG 1 1 3 2041 1 1 28 LYS H H 11.904 -4.468 -3.765 1.00 . A A . 28 LYS H 1 1 3 2042 1 1 28 LYS HA H 9.562 -4.324 -5.523 1.00 . A A . 28 LYS HA 1 1 3 2043 1 1 28 LYS HB2 H 9.814 -5.732 -2.861 1.00 . A A . 28 LYS HB2 1 1 3 2044 1 1 28 LYS HB3 H 8.566 -5.965 -4.076 1.00 . A A . 28 LYS HB3 1 1 3 2045 1 1 28 LYS HD2 H 9.744 -6.393 -6.511 1.00 . A A . 28 LYS HD2 1 1 3 2046 1 1 28 LYS HD3 H 10.591 -7.937 -6.402 1.00 . A A . 28 LYS HD3 1 1 3 2047 1 1 28 LYS HE2 H 7.872 -7.417 -5.205 1.00 . A A . 28 LYS HE2 1 1 3 2048 1 1 28 LYS HE3 H 8.124 -8.116 -6.803 1.00 . A A . 28 LYS HE3 1 1 3 2049 1 1 28 LYS HG2 H 11.444 -6.581 -4.656 1.00 . A A . 28 LYS HG2 1 1 3 2050 1 1 28 LYS HG3 H 10.368 -7.754 -3.894 1.00 . A A . 28 LYS HG3 1 1 3 2051 1 1 28 LYS HZ1 H 9.086 -9.294 -4.238 1.00 . A A . 28 LYS HZ1 1 1 3 2052 1 1 28 LYS HZ2 H 9.281 -9.969 -5.785 1.00 . A A . 28 LYS HZ2 1 1 3 2053 1 1 28 LYS HZ3 H 7.732 -9.816 -5.122 1.00 . A A . 28 LYS HZ3 1 1 3 2054 1 1 28 LYS N N 11.366 -4.152 -4.517 1.00 . A A . 28 LYS N 1 1 3 2055 1 1 28 LYS NZ N 8.670 -9.362 -5.197 1.00 . A A . 28 LYS NZ 1 1 3 2056 1 1 28 LYS O O 9.793 -2.836 -2.678 1.00 . A A . 28 LYS O 1 1 3 2057 1 1 29 TYR C C 5.791 -2.458 -3.136 1.00 . A A . 29 TYR C 1 1 3 2058 1 1 29 TYR CA C 7.225 -1.990 -3.338 1.00 . A A . 29 TYR CA 1 1 3 2059 1 1 29 TYR CB C 7.162 -0.682 -4.143 1.00 . A A . 29 TYR CB 1 1 3 2060 1 1 29 TYR CD1 C 9.589 -0.106 -3.861 1.00 . A A . 29 TYR CD1 1 1 3 2061 1 1 29 TYR CD2 C 8.613 0.240 -6.007 1.00 . A A . 29 TYR CD2 1 1 3 2062 1 1 29 TYR CE1 C 10.802 0.344 -4.332 1.00 . A A . 29 TYR CE1 1 1 3 2063 1 1 29 TYR CE2 C 9.827 0.692 -6.488 1.00 . A A . 29 TYR CE2 1 1 3 2064 1 1 29 TYR CG C 8.475 -0.165 -4.686 1.00 . A A . 29 TYR CG 1 1 3 2065 1 1 29 TYR CZ C 10.852 0.823 -5.720 1.00 . A A . 29 TYR CZ 1 1 3 2066 1 1 29 TYR H H 7.581 -3.521 -4.738 1.00 . A A . 29 TYR H 1 1 3 2067 1 1 29 TYR HA H 7.679 -1.799 -2.378 1.00 . A A . 29 TYR HA 1 1 3 2068 1 1 29 TYR HB2 H 6.506 -0.831 -4.986 1.00 . A A . 29 TYR HB2 1 1 3 2069 1 1 29 TYR HB3 H 6.743 0.088 -3.513 1.00 . A A . 29 TYR HB3 1 1 3 2070 1 1 29 TYR HD1 H 9.498 -0.423 -2.832 1.00 . A A . 29 TYR HD1 1 1 3 2071 1 1 29 TYR HD2 H 7.753 0.200 -6.662 1.00 . A A . 29 TYR HD2 1 1 3 2072 1 1 29 TYR HE1 H 11.656 0.384 -3.672 1.00 . A A . 29 TYR HE1 1 1 3 2073 1 1 29 TYR HE2 H 9.917 1.003 -7.517 1.00 . A A . 29 TYR HE2 1 1 3 2074 1 1 29 TYR HH H 12.090 2.146 -6.251 1.00 . A A . 29 TYR HH 1 1 3 2075 1 1 29 TYR N N 7.997 -3.020 -4.015 1.00 . A A . 29 TYR N 1 1 3 2076 1 1 29 TYR O O 5.035 -2.577 -4.096 1.00 . A A . 29 TYR O 1 1 3 2077 1 1 29 TYR OH O 12.129 1.183 -6.113 1.00 . A A . 29 TYR OH 1 1 3 2078 1 1 30 ALA C C 3.546 -1.674 -0.829 1.00 . A A . 30 ALA C 1 1 3 2079 1 1 30 ALA CA C 4.022 -2.911 -1.565 1.00 . A A . 30 ALA CA 1 1 3 2080 1 1 30 ALA CB C 3.798 -4.150 -0.718 1.00 . A A . 30 ALA CB 1 1 3 2081 1 1 30 ALA H H 6.102 -2.861 -1.213 1.00 . A A . 30 ALA H 1 1 3 2082 1 1 30 ALA HA H 3.462 -3.015 -2.486 1.00 . A A . 30 ALA HA 1 1 3 2083 1 1 30 ALA HB1 H 4.139 -5.022 -1.256 1.00 . A A . 30 ALA HB1 1 1 3 2084 1 1 30 ALA HB2 H 4.349 -4.059 0.205 1.00 . A A . 30 ALA HB2 1 1 3 2085 1 1 30 ALA HB3 H 2.745 -4.249 -0.501 1.00 . A A . 30 ALA HB3 1 1 3 2086 1 1 30 ALA N N 5.424 -2.743 -1.904 1.00 . A A . 30 ALA N 1 1 3 2087 1 1 30 ALA O O 4.026 -1.376 0.266 1.00 . A A . 30 ALA O 1 1 3 2088 1 1 31 CYS C C 0.703 0.038 -0.367 1.00 . A A . 31 CYS C 1 1 3 2089 1 1 31 CYS CA C 2.116 0.278 -0.848 1.00 . A A . 31 CYS CA 1 1 3 2090 1 1 31 CYS CB C 2.153 1.446 -1.837 1.00 . A A . 31 CYS CB 1 1 3 2091 1 1 31 CYS H H 2.290 -1.227 -2.313 1.00 . A A . 31 CYS H 1 1 3 2092 1 1 31 CYS HA H 2.734 0.520 0.003 1.00 . A A . 31 CYS HA 1 1 3 2093 1 1 31 CYS HB2 H 3.181 1.683 -2.068 1.00 . A A . 31 CYS HB2 1 1 3 2094 1 1 31 CYS HB3 H 1.643 1.156 -2.745 1.00 . A A . 31 CYS HB3 1 1 3 2095 1 1 31 CYS N N 2.639 -0.936 -1.445 1.00 . A A . 31 CYS N 1 1 3 2096 1 1 31 CYS O O -0.135 -0.484 -1.105 1.00 . A A . 31 CYS O 1 1 3 2097 1 1 31 CYS SG S 1.358 2.969 -1.216 1.00 . A A . 31 CYS SG 1 1 3 2098 1 1 32 ASN C C -1.403 1.396 2.110 1.00 . A A . 32 ASN C 1 1 3 2099 1 1 32 ASN CA C -0.847 0.144 1.475 1.00 . A A . 32 ASN CA 1 1 3 2100 1 1 32 ASN CB C -0.711 -0.984 2.502 1.00 . A A . 32 ASN CB 1 1 3 2101 1 1 32 ASN CG C -2.033 -1.420 3.095 1.00 . A A . 32 ASN CG 1 1 3 2102 1 1 32 ASN H H 1.150 0.826 1.406 1.00 . A A . 32 ASN H 1 1 3 2103 1 1 32 ASN HA H -1.518 -0.148 0.696 1.00 . A A . 32 ASN HA 1 1 3 2104 1 1 32 ASN HB2 H -0.256 -1.838 2.020 1.00 . A A . 32 ASN HB2 1 1 3 2105 1 1 32 ASN HB3 H -0.071 -0.650 3.305 1.00 . A A . 32 ASN HB3 1 1 3 2106 1 1 32 ASN HD21 H -1.152 -1.801 4.831 1.00 . A A . 32 ASN HD21 1 1 3 2107 1 1 32 ASN HD22 H -2.850 -2.104 4.774 1.00 . A A . 32 ASN HD22 1 1 3 2108 1 1 32 ASN N N 0.447 0.395 0.877 1.00 . A A . 32 ASN N 1 1 3 2109 1 1 32 ASN ND2 N -2.010 -1.814 4.360 1.00 . A A . 32 ASN ND2 1 1 3 2110 1 1 32 ASN O O -0.996 1.794 3.198 1.00 . A A . 32 ASN O 1 1 3 2111 1 1 32 ASN OD1 O -3.062 -1.402 2.430 1.00 . A A . 32 ASN OD1 1 1 3 2112 1 1 33 CYS C C -4.040 3.058 2.875 1.00 . A A . 33 CYS C 1 1 3 2113 1 1 33 CYS CA C -2.932 3.258 1.847 1.00 . A A . 33 CYS CA 1 1 3 2114 1 1 33 CYS CB C -3.431 4.066 0.647 1.00 . A A . 33 CYS CB 1 1 3 2115 1 1 33 CYS H H -2.654 1.600 0.574 1.00 . A A . 33 CYS H 1 1 3 2116 1 1 33 CYS HA H -2.138 3.817 2.322 1.00 . A A . 33 CYS HA 1 1 3 2117 1 1 33 CYS HB2 H -3.979 3.412 -0.013 1.00 . A A . 33 CYS HB2 1 1 3 2118 1 1 33 CYS HB3 H -4.089 4.846 1.001 1.00 . A A . 33 CYS HB3 1 1 3 2119 1 1 33 CYS N N -2.353 2.002 1.412 1.00 . A A . 33 CYS N 1 1 3 2120 1 1 33 CYS O O -3.765 2.922 4.060 1.00 . A A . 33 CYS O 1 1 3 2121 1 1 33 CYS SG S -2.103 4.860 -0.333 1.00 . A A . 33 CYS SG 1 1 3 2122 1 1 34 VAL C C -7.358 1.877 2.890 1.00 . A A . 34 VAL C 1 1 3 2123 1 1 34 VAL CA C -6.394 2.943 3.358 1.00 . A A . 34 VAL CA 1 1 3 2124 1 1 34 VAL CB C -7.106 4.312 3.472 1.00 . A A . 34 VAL CB 1 1 3 2125 1 1 34 VAL CG1 C -7.812 4.673 2.174 1.00 . A A . 34 VAL CG1 1 1 3 2126 1 1 34 VAL CG2 C -8.077 4.331 4.647 1.00 . A A . 34 VAL CG2 1 1 3 2127 1 1 34 VAL H H -5.469 2.985 1.467 1.00 . A A . 34 VAL H 1 1 3 2128 1 1 34 VAL HA H -6.010 2.670 4.331 1.00 . A A . 34 VAL HA 1 1 3 2129 1 1 34 VAL HB H -6.350 5.062 3.651 1.00 . A A . 34 VAL HB 1 1 3 2130 1 1 34 VAL HG11 H -8.561 3.927 1.950 1.00 . A A . 34 VAL HG11 1 1 3 2131 1 1 34 VAL HG12 H -8.286 5.639 2.277 1.00 . A A . 34 VAL HG12 1 1 3 2132 1 1 34 VAL HG13 H -7.089 4.710 1.371 1.00 . A A . 34 VAL HG13 1 1 3 2133 1 1 34 VAL HG21 H -8.828 3.568 4.507 1.00 . A A . 34 VAL HG21 1 1 3 2134 1 1 34 VAL HG22 H -7.538 4.139 5.563 1.00 . A A . 34 VAL HG22 1 1 3 2135 1 1 34 VAL HG23 H -8.555 5.298 4.707 1.00 . A A . 34 VAL HG23 1 1 3 2136 1 1 34 VAL N N -5.285 3.006 2.432 1.00 . A A . 34 VAL N 1 1 3 2137 1 1 34 VAL O O -7.408 1.575 1.697 1.00 . A A . 34 VAL O 1 1 3 2138 1 1 35 VAL C C -10.198 0.809 2.708 1.00 . A A . 35 VAL C 1 1 3 2139 1 1 35 VAL CA C -9.025 0.228 3.503 1.00 . A A . 35 VAL CA 1 1 3 2140 1 1 35 VAL CB C -9.503 -0.515 4.771 1.00 . A A . 35 VAL CB 1 1 3 2141 1 1 35 VAL CG1 C -8.326 -1.204 5.444 1.00 . A A . 35 VAL CG1 1 1 3 2142 1 1 35 VAL CG2 C -10.177 0.427 5.761 1.00 . A A . 35 VAL CG2 1 1 3 2143 1 1 35 VAL H H -7.929 1.509 4.762 1.00 . A A . 35 VAL H 1 1 3 2144 1 1 35 VAL HA H -8.518 -0.490 2.873 1.00 . A A . 35 VAL HA 1 1 3 2145 1 1 35 VAL HB H -10.213 -1.274 4.469 1.00 . A A . 35 VAL HB 1 1 3 2146 1 1 35 VAL HG11 H -8.672 -1.733 6.319 1.00 . A A . 35 VAL HG11 1 1 3 2147 1 1 35 VAL HG12 H -7.877 -1.903 4.755 1.00 . A A . 35 VAL HG12 1 1 3 2148 1 1 35 VAL HG13 H -7.595 -0.466 5.734 1.00 . A A . 35 VAL HG13 1 1 3 2149 1 1 35 VAL HG21 H -10.500 -0.130 6.627 1.00 . A A . 35 VAL HG21 1 1 3 2150 1 1 35 VAL HG22 H -9.474 1.189 6.067 1.00 . A A . 35 VAL HG22 1 1 3 2151 1 1 35 VAL HG23 H -11.030 0.892 5.291 1.00 . A A . 35 VAL HG23 1 1 3 2152 1 1 35 VAL N N -8.063 1.262 3.826 1.00 . A A . 35 VAL N 1 1 3 2153 1 1 35 VAL O O -11.286 1.056 3.223 1.00 . A A . 35 VAL O 1 1 3 2154 1 1 36 GLY C C -10.224 2.056 -0.737 1.00 . A A . 36 GLY C 1 1 3 2155 1 1 36 GLY CA C -10.897 1.630 0.544 1.00 . A A . 36 GLY CA 1 1 3 2156 1 1 36 GLY H H -9.057 0.760 1.081 1.00 . A A . 36 GLY H 1 1 3 2157 1 1 36 GLY HA2 H -11.671 0.912 0.317 1.00 . A A . 36 GLY HA2 1 1 3 2158 1 1 36 GLY HA3 H -11.336 2.494 1.021 1.00 . A A . 36 GLY HA3 1 1 3 2159 1 1 36 GLY N N -9.937 1.022 1.432 1.00 . A A . 36 GLY N 1 1 3 2160 1 1 36 GLY O O -10.878 2.348 -1.738 1.00 . A A . 36 GLY O 1 1 3 2161 1 1 37 TYR C C -6.865 1.452 -1.911 1.00 . A A . 37 TYR C 1 1 3 2162 1 1 37 TYR CA C -8.097 2.350 -1.882 1.00 . A A . 37 TYR CA 1 1 3 2163 1 1 37 TYR CB C -7.630 3.811 -1.923 1.00 . A A . 37 TYR CB 1 1 3 2164 1 1 37 TYR CD1 C -9.539 4.979 -3.077 1.00 . A A . 37 TYR CD1 1 1 3 2165 1 1 37 TYR CD2 C -8.979 5.671 -0.869 1.00 . A A . 37 TYR CD2 1 1 3 2166 1 1 37 TYR CE1 C -10.562 5.904 -3.114 1.00 . A A . 37 TYR CE1 1 1 3 2167 1 1 37 TYR CE2 C -9.999 6.603 -0.899 1.00 . A A . 37 TYR CE2 1 1 3 2168 1 1 37 TYR CG C -8.733 4.845 -1.957 1.00 . A A . 37 TYR CG 1 1 3 2169 1 1 37 TYR CZ C -10.729 6.776 -2.018 1.00 . A A . 37 TYR CZ 1 1 3 2170 1 1 37 TYR H H -8.441 1.907 0.150 1.00 . A A . 37 TYR H 1 1 3 2171 1 1 37 TYR HA H -8.707 2.148 -2.750 1.00 . A A . 37 TYR HA 1 1 3 2172 1 1 37 TYR HB2 H -7.029 4.008 -1.047 1.00 . A A . 37 TYR HB2 1 1 3 2173 1 1 37 TYR HB3 H -7.018 3.954 -2.802 1.00 . A A . 37 TYR HB3 1 1 3 2174 1 1 37 TYR HD1 H -9.358 4.345 -3.931 1.00 . A A . 37 TYR HD1 1 1 3 2175 1 1 37 TYR HD2 H -8.358 5.581 0.011 1.00 . A A . 37 TYR HD2 1 1 3 2176 1 1 37 TYR HE1 H -11.178 5.992 -3.996 1.00 . A A . 37 TYR HE1 1 1 3 2177 1 1 37 TYR HE2 H -10.177 7.237 -0.045 1.00 . A A . 37 TYR HE2 1 1 3 2178 1 1 37 TYR HH H -11.474 8.498 -1.791 1.00 . A A . 37 TYR HH 1 1 3 2179 1 1 37 TYR N N -8.893 2.079 -0.699 1.00 . A A . 37 TYR N 1 1 3 2180 1 1 37 TYR O O -5.984 1.582 -1.056 1.00 . A A . 37 TYR O 1 1 3 2181 1 1 37 TYR OH O -11.810 7.630 -2.059 1.00 . A A . 37 TYR OH 1 1 3 2182 1 1 38 ILE C C -5.526 -0.551 -4.659 1.00 . A A . 38 ILE C 1 1 3 2183 1 1 38 ILE CA C -5.565 -0.166 -3.176 1.00 . A A . 38 ILE CA 1 1 3 2184 1 1 38 ILE CB C -5.289 -1.374 -2.242 1.00 . A A . 38 ILE CB 1 1 3 2185 1 1 38 ILE CD1 C -2.829 -1.647 -2.913 1.00 . A A . 38 ILE CD1 1 1 3 2186 1 1 38 ILE CG1 C -3.820 -1.358 -1.801 1.00 . A A . 38 ILE CG1 1 1 3 2187 1 1 38 ILE CG2 C -5.638 -2.712 -2.878 1.00 . A A . 38 ILE CG2 1 1 3 2188 1 1 38 ILE H H -7.642 0.254 -3.323 1.00 . A A . 38 ILE H 1 1 3 2189 1 1 38 ILE HA H -4.779 0.545 -3.007 1.00 . A A . 38 ILE HA 1 1 3 2190 1 1 38 ILE HB H -5.904 -1.252 -1.369 1.00 . A A . 38 ILE HB 1 1 3 2191 1 1 38 ILE HD11 H -1.826 -1.651 -2.510 1.00 . A A . 38 ILE HD11 1 1 3 2192 1 1 38 ILE HD12 H -3.046 -2.612 -3.348 1.00 . A A . 38 ILE HD12 1 1 3 2193 1 1 38 ILE HD13 H -2.908 -0.883 -3.673 1.00 . A A . 38 ILE HD13 1 1 3 2194 1 1 38 ILE HG12 H -3.592 -0.375 -1.410 1.00 . A A . 38 ILE HG12 1 1 3 2195 1 1 38 ILE HG13 H -3.676 -2.094 -1.023 1.00 . A A . 38 ILE HG13 1 1 3 2196 1 1 38 ILE HG21 H -5.439 -3.509 -2.174 1.00 . A A . 38 ILE HG21 1 1 3 2197 1 1 38 ILE HG22 H -6.684 -2.722 -3.145 1.00 . A A . 38 ILE HG22 1 1 3 2198 1 1 38 ILE HG23 H -5.038 -2.857 -3.764 1.00 . A A . 38 ILE HG23 1 1 3 2199 1 1 38 ILE N N -6.814 0.517 -2.856 1.00 . A A . 38 ILE N 1 1 3 2200 1 1 38 ILE O O -6.417 -1.194 -5.177 1.00 . A A . 38 ILE O 1 1 3 2201 1 1 39 GLY C C -3.009 0.111 -7.215 1.00 . A A . 39 GLY C 1 1 3 2202 1 1 39 GLY CA C -4.354 -0.368 -6.756 1.00 . A A . 39 GLY CA 1 1 3 2203 1 1 39 GLY H H -3.901 0.562 -4.916 1.00 . A A . 39 GLY H 1 1 3 2204 1 1 39 GLY HA2 H -4.420 -1.440 -6.883 1.00 . A A . 39 GLY HA2 1 1 3 2205 1 1 39 GLY HA3 H -5.121 0.114 -7.343 1.00 . A A . 39 GLY HA3 1 1 3 2206 1 1 39 GLY N N -4.537 -0.039 -5.358 1.00 . A A . 39 GLY N 1 1 3 2207 1 1 39 GLY O O -2.821 1.321 -7.377 1.00 . A A . 39 GLY O 1 1 3 2208 1 1 40 GLU C C -0.042 0.009 -6.343 1.00 . A A . 40 GLU C 1 1 3 2209 1 1 40 GLU CA C -0.662 -0.511 -7.614 1.00 . A A . 40 GLU CA 1 1 3 2210 1 1 40 GLU CB C -0.501 0.509 -8.753 1.00 . A A . 40 GLU CB 1 1 3 2211 1 1 40 GLU CD C 0.962 2.286 -9.794 1.00 . A A . 40 GLU CD 1 1 3 2212 1 1 40 GLU CG C 0.891 1.117 -8.834 1.00 . A A . 40 GLU CG 1 1 3 2213 1 1 40 GLU H H -2.294 -1.752 -7.168 1.00 . A A . 40 GLU H 1 1 3 2214 1 1 40 GLU HA H -0.173 -1.426 -7.880 1.00 . A A . 40 GLU HA 1 1 3 2215 1 1 40 GLU HB2 H -0.711 0.017 -9.692 1.00 . A A . 40 GLU HB2 1 1 3 2216 1 1 40 GLU HB3 H -1.213 1.308 -8.609 1.00 . A A . 40 GLU HB3 1 1 3 2217 1 1 40 GLU HG2 H 1.176 1.464 -7.844 1.00 . A A . 40 GLU HG2 1 1 3 2218 1 1 40 GLU HG3 H 1.583 0.357 -9.161 1.00 . A A . 40 GLU HG3 1 1 3 2219 1 1 40 GLU N N -2.059 -0.821 -7.337 1.00 . A A . 40 GLU N 1 1 3 2220 1 1 40 GLU O O 1.025 -0.423 -5.910 1.00 . A A . 40 GLU O 1 1 3 2221 1 1 40 GLU OE1 O -0.100 2.811 -10.192 1.00 . A A . 40 GLU OE1 1 1 3 2222 1 1 40 GLU OE2 O 2.088 2.706 -10.134 1.00 . A A . 40 GLU OE2 1 1 3 2223 1 1 41 ARG C C -1.557 1.882 -3.623 1.00 . A A . 41 ARG C 1 1 3 2224 1 1 41 ARG CA C -0.365 1.511 -4.493 1.00 . A A . 41 ARG CA 1 1 3 2225 1 1 41 ARG CB C 0.576 2.685 -4.751 1.00 . A A . 41 ARG CB 1 1 3 2226 1 1 41 ARG CD C -0.720 4.137 -6.416 1.00 . A A . 41 ARG CD 1 1 3 2227 1 1 41 ARG CG C 0.499 3.269 -6.159 1.00 . A A . 41 ARG CG 1 1 3 2228 1 1 41 ARG CZ C -1.083 5.491 -8.466 1.00 . A A . 41 ARG CZ 1 1 3 2229 1 1 41 ARG H H -1.574 1.233 -6.180 1.00 . A A . 41 ARG H 1 1 3 2230 1 1 41 ARG HA H 0.177 0.755 -3.967 1.00 . A A . 41 ARG HA 1 1 3 2231 1 1 41 ARG HB2 H 0.383 3.469 -4.038 1.00 . A A . 41 ARG HB2 1 1 3 2232 1 1 41 ARG HB3 H 1.575 2.315 -4.618 1.00 . A A . 41 ARG HB3 1 1 3 2233 1 1 41 ARG HD2 H -1.590 3.659 -5.998 1.00 . A A . 41 ARG HD2 1 1 3 2234 1 1 41 ARG HD3 H -0.572 5.101 -5.953 1.00 . A A . 41 ARG HD3 1 1 3 2235 1 1 41 ARG HE H -0.882 3.506 -8.416 1.00 . A A . 41 ARG HE 1 1 3 2236 1 1 41 ARG HG2 H 1.380 3.862 -6.337 1.00 . A A . 41 ARG HG2 1 1 3 2237 1 1 41 ARG HG3 H 0.479 2.446 -6.858 1.00 . A A . 41 ARG HG3 1 1 3 2238 1 1 41 ARG HH11 H -1.055 6.599 -6.773 1.00 . A A . 41 ARG HH11 1 1 3 2239 1 1 41 ARG HH12 H -1.258 7.499 -8.241 1.00 . A A . 41 ARG HH12 1 1 3 2240 1 1 41 ARG HH21 H -1.129 4.676 -10.317 1.00 . A A . 41 ARG HH21 1 1 3 2241 1 1 41 ARG HH22 H -1.325 6.408 -10.262 1.00 . A A . 41 ARG HH22 1 1 3 2242 1 1 41 ARG N N -0.758 0.930 -5.743 1.00 . A A . 41 ARG N 1 1 3 2243 1 1 41 ARG NE N -0.912 4.320 -7.855 1.00 . A A . 41 ARG NE 1 1 3 2244 1 1 41 ARG NH1 N -1.140 6.617 -7.769 1.00 . A A . 41 ARG NH1 1 1 3 2245 1 1 41 ARG NH2 N -1.188 5.526 -9.785 1.00 . A A . 41 ARG NH2 1 1 3 2246 1 1 41 ARG O O -1.463 1.788 -2.404 1.00 . A A . 41 ARG O 1 1 3 2247 1 1 42 CYS C C -4.831 3.403 -4.390 1.00 . A A . 42 CYS C 1 1 3 2248 1 1 42 CYS CA C -3.922 2.546 -3.552 1.00 . A A . 42 CYS CA 1 1 3 2249 1 1 42 CYS CB C -3.723 3.224 -2.199 1.00 . A A . 42 CYS CB 1 1 3 2250 1 1 42 CYS H H -2.691 2.259 -5.224 1.00 . A A . 42 CYS H 1 1 3 2251 1 1 42 CYS HA H -4.413 1.613 -3.393 1.00 . A A . 42 CYS HA 1 1 3 2252 1 1 42 CYS HB2 H -4.691 3.439 -1.774 1.00 . A A . 42 CYS HB2 1 1 3 2253 1 1 42 CYS HB3 H -3.197 2.543 -1.546 1.00 . A A . 42 CYS HB3 1 1 3 2254 1 1 42 CYS N N -2.680 2.241 -4.253 1.00 . A A . 42 CYS N 1 1 3 2255 1 1 42 CYS O O -4.611 4.604 -4.524 1.00 . A A . 42 CYS O 1 1 3 2256 1 1 42 CYS SG S -2.790 4.782 -2.228 1.00 . A A . 42 CYS SG 1 1 3 2257 1 1 43 GLN C C -7.995 2.609 -6.185 1.00 . A A . 43 GLN C 1 1 3 2258 1 1 43 GLN CA C -6.891 3.520 -5.661 1.00 . A A . 43 GLN CA 1 1 3 2259 1 1 43 GLN CB C -6.282 4.347 -6.800 1.00 . A A . 43 GLN CB 1 1 3 2260 1 1 43 GLN CD C -5.070 4.378 -9.018 1.00 . A A . 43 GLN CD 1 1 3 2261 1 1 43 GLN CG C -5.657 3.520 -7.914 1.00 . A A . 43 GLN CG 1 1 3 2262 1 1 43 GLN H H -5.902 1.783 -4.898 1.00 . A A . 43 GLN H 1 1 3 2263 1 1 43 GLN HA H -7.331 4.201 -4.947 1.00 . A A . 43 GLN HA 1 1 3 2264 1 1 43 GLN HB2 H -7.054 4.968 -7.229 1.00 . A A . 43 GLN HB2 1 1 3 2265 1 1 43 GLN HB3 H -5.511 4.985 -6.375 1.00 . A A . 43 GLN HB3 1 1 3 2266 1 1 43 GLN HE21 H -3.783 2.938 -9.492 1.00 . A A . 43 GLN HE21 1 1 3 2267 1 1 43 GLN HE22 H -3.688 4.381 -10.439 1.00 . A A . 43 GLN HE22 1 1 3 2268 1 1 43 GLN HG2 H -4.870 2.911 -7.496 1.00 . A A . 43 GLN HG2 1 1 3 2269 1 1 43 GLN HG3 H -6.418 2.882 -8.339 1.00 . A A . 43 GLN HG3 1 1 3 2270 1 1 43 GLN N N -5.853 2.773 -4.955 1.00 . A A . 43 GLN N 1 1 3 2271 1 1 43 GLN NE2 N -4.080 3.848 -9.718 1.00 . A A . 43 GLN NE2 1 1 3 2272 1 1 43 GLN O O -8.781 3.010 -7.044 1.00 . A A . 43 GLN O 1 1 3 2273 1 1 43 GLN OE1 O -5.517 5.497 -9.257 1.00 . A A . 43 GLN OE1 1 1 3 2274 1 1 44 TYR C C -9.541 -0.370 -4.894 1.00 . A A . 44 TYR C 1 1 3 2275 1 1 44 TYR CA C -9.092 0.453 -6.071 1.00 . A A . 44 TYR CA 1 1 3 2276 1 1 44 TYR CB C -8.572 -0.479 -7.172 1.00 . A A . 44 TYR CB 1 1 3 2277 1 1 44 TYR CD1 C -9.546 0.346 -9.347 1.00 . A A . 44 TYR CD1 1 1 3 2278 1 1 44 TYR CD2 C -7.194 0.559 -9.022 1.00 . A A . 44 TYR CD2 1 1 3 2279 1 1 44 TYR CE1 C -9.431 0.936 -10.590 1.00 . A A . 44 TYR CE1 1 1 3 2280 1 1 44 TYR CE2 C -7.073 1.148 -10.266 1.00 . A A . 44 TYR CE2 1 1 3 2281 1 1 44 TYR CG C -8.433 0.147 -8.542 1.00 . A A . 44 TYR CG 1 1 3 2282 1 1 44 TYR CZ C -8.159 1.263 -11.073 1.00 . A A . 44 TYR CZ 1 1 3 2283 1 1 44 TYR H H -7.422 1.100 -4.986 1.00 . A A . 44 TYR H 1 1 3 2284 1 1 44 TYR HA H -9.942 1.004 -6.434 1.00 . A A . 44 TYR HA 1 1 3 2285 1 1 44 TYR HB2 H -7.590 -0.832 -6.882 1.00 . A A . 44 TYR HB2 1 1 3 2286 1 1 44 TYR HB3 H -9.238 -1.326 -7.257 1.00 . A A . 44 TYR HB3 1 1 3 2287 1 1 44 TYR HD1 H -10.517 0.034 -8.990 1.00 . A A . 44 TYR HD1 1 1 3 2288 1 1 44 TYR HD2 H -6.317 0.412 -8.411 1.00 . A A . 44 TYR HD2 1 1 3 2289 1 1 44 TYR HE1 H -10.309 1.080 -11.202 1.00 . A A . 44 TYR HE1 1 1 3 2290 1 1 44 TYR HE2 H -6.102 1.461 -10.623 1.00 . A A . 44 TYR HE2 1 1 3 2291 1 1 44 TYR HH H -7.321 1.552 -12.750 1.00 . A A . 44 TYR HH 1 1 3 2292 1 1 44 TYR N N -8.069 1.388 -5.663 1.00 . A A . 44 TYR N 1 1 3 2293 1 1 44 TYR O O -8.773 -1.152 -4.347 1.00 . A A . 44 TYR O 1 1 3 2294 1 1 44 TYR OH O -8.084 1.929 -12.280 1.00 . A A . 44 TYR OH 1 1 3 2295 1 1 45 ARG C C -10.786 -1.101 -2.189 1.00 . A A . 45 ARG C 1 1 3 2296 1 1 45 ARG CA C -11.425 -1.082 -3.573 1.00 . A A . 45 ARG CA 1 1 3 2297 1 1 45 ARG CB C -11.344 -2.490 -4.152 1.00 . A A . 45 ARG CB 1 1 3 2298 1 1 45 ARG CD C -10.853 -3.096 -6.529 1.00 . A A . 45 ARG CD 1 1 3 2299 1 1 45 ARG CG C -11.924 -2.645 -5.547 1.00 . A A . 45 ARG CG 1 1 3 2300 1 1 45 ARG CZ C -10.575 -3.265 -8.974 1.00 . A A . 45 ARG CZ 1 1 3 2301 1 1 45 ARG H H -11.256 0.635 -4.788 1.00 . A A . 45 ARG H 1 1 3 2302 1 1 45 ARG HA H -12.456 -0.794 -3.482 1.00 . A A . 45 ARG HA 1 1 3 2303 1 1 45 ARG HB2 H -10.289 -2.752 -4.203 1.00 . A A . 45 ARG HB2 1 1 3 2304 1 1 45 ARG HB3 H -11.849 -3.176 -3.488 1.00 . A A . 45 ARG HB3 1 1 3 2305 1 1 45 ARG HD2 H -10.030 -2.391 -6.493 1.00 . A A . 45 ARG HD2 1 1 3 2306 1 1 45 ARG HD3 H -10.500 -4.073 -6.233 1.00 . A A . 45 ARG HD3 1 1 3 2307 1 1 45 ARG HE H -12.332 -3.130 -8.018 1.00 . A A . 45 ARG HE 1 1 3 2308 1 1 45 ARG HG2 H -12.712 -3.383 -5.519 1.00 . A A . 45 ARG HG2 1 1 3 2309 1 1 45 ARG HG3 H -12.322 -1.695 -5.870 1.00 . A A . 45 ARG HG3 1 1 3 2310 1 1 45 ARG HH11 H -8.833 -3.427 -7.935 1.00 . A A . 45 ARG HH11 1 1 3 2311 1 1 45 ARG HH12 H -8.672 -3.455 -9.667 1.00 . A A . 45 ARG HH12 1 1 3 2312 1 1 45 ARG HH21 H -12.124 -3.192 -10.279 1.00 . A A . 45 ARG HH21 1 1 3 2313 1 1 45 ARG HH22 H -10.543 -3.343 -11.003 1.00 . A A . 45 ARG HH22 1 1 3 2314 1 1 45 ARG N N -10.772 -0.161 -4.482 1.00 . A A . 45 ARG N 1 1 3 2315 1 1 45 ARG NE N -11.354 -3.167 -7.896 1.00 . A A . 45 ARG NE 1 1 3 2316 1 1 45 ARG NH1 N -9.256 -3.394 -8.847 1.00 . A A . 45 ARG NH1 1 1 3 2317 1 1 45 ARG NH2 N -11.121 -3.266 -10.180 1.00 . A A . 45 ARG NH2 1 1 3 2318 1 1 45 ARG O O -9.738 -0.505 -1.934 1.00 . A A . 45 ARG O 1 1 3 2319 1 1 46 ASP C C -10.667 -3.498 0.285 1.00 . A A . 46 ASP C 1 1 3 2320 1 1 46 ASP CA C -10.960 -2.031 0.039 1.00 . A A . 46 ASP CA 1 1 3 2321 1 1 46 ASP CB C -11.989 -1.505 1.042 1.00 . A A . 46 ASP CB 1 1 3 2322 1 1 46 ASP CG C -13.416 -1.692 0.580 1.00 . A A . 46 ASP CG 1 1 3 2323 1 1 46 ASP H H -12.241 -2.295 -1.605 1.00 . A A . 46 ASP H 1 1 3 2324 1 1 46 ASP HA H -10.042 -1.479 0.153 1.00 . A A . 46 ASP HA 1 1 3 2325 1 1 46 ASP HB2 H -11.867 -2.030 1.975 1.00 . A A . 46 ASP HB2 1 1 3 2326 1 1 46 ASP HB3 H -11.817 -0.451 1.204 1.00 . A A . 46 ASP HB3 1 1 3 2327 1 1 46 ASP N N -11.421 -1.844 -1.319 1.00 . A A . 46 ASP N 1 1 3 2328 1 1 46 ASP O O -11.137 -4.082 1.262 1.00 . A A . 46 ASP O 1 1 3 2329 1 1 46 ASP OD1 O -13.876 -2.848 0.507 1.00 . A A . 46 ASP OD1 1 1 3 2330 1 1 46 ASP OD2 O -14.085 -0.687 0.302 1.00 . A A . 46 ASP OD2 1 1 3 2331 1 1 47 LEU C C -9.030 -5.862 0.861 1.00 . A A . 47 LEU C 1 1 3 2332 1 1 47 LEU CA C -9.469 -5.482 -0.545 1.00 . A A . 47 LEU CA 1 1 3 2333 1 1 47 LEU CB C -8.304 -5.766 -1.506 1.00 . A A . 47 LEU CB 1 1 3 2334 1 1 47 LEU CD1 C -8.713 -4.240 -3.458 1.00 . A A . 47 LEU CD1 1 1 3 2335 1 1 47 LEU CD2 C -7.554 -6.415 -3.814 1.00 . A A . 47 LEU CD2 1 1 3 2336 1 1 47 LEU CG C -8.616 -5.682 -3.005 1.00 . A A . 47 LEU CG 1 1 3 2337 1 1 47 LEU H H -9.547 -3.534 -1.367 1.00 . A A . 47 LEU H 1 1 3 2338 1 1 47 LEU HA H -10.315 -6.088 -0.827 1.00 . A A . 47 LEU HA 1 1 3 2339 1 1 47 LEU HB2 H -7.517 -5.060 -1.291 1.00 . A A . 47 LEU HB2 1 1 3 2340 1 1 47 LEU HB3 H -7.935 -6.759 -1.296 1.00 . A A . 47 LEU HB3 1 1 3 2341 1 1 47 LEU HD11 H -9.507 -3.744 -2.919 1.00 . A A . 47 LEU HD11 1 1 3 2342 1 1 47 LEU HD12 H -7.777 -3.737 -3.265 1.00 . A A . 47 LEU HD12 1 1 3 2343 1 1 47 LEU HD13 H -8.925 -4.208 -4.517 1.00 . A A . 47 LEU HD13 1 1 3 2344 1 1 47 LEU HD21 H -6.591 -5.956 -3.643 1.00 . A A . 47 LEU HD21 1 1 3 2345 1 1 47 LEU HD22 H -7.519 -7.451 -3.509 1.00 . A A . 47 LEU HD22 1 1 3 2346 1 1 47 LEU HD23 H -7.798 -6.356 -4.864 1.00 . A A . 47 LEU HD23 1 1 3 2347 1 1 47 LEU HG H -9.567 -6.157 -3.195 1.00 . A A . 47 LEU HG 1 1 3 2348 1 1 47 LEU N N -9.870 -4.076 -0.615 1.00 . A A . 47 LEU N 1 1 3 2349 1 1 47 LEU O O -9.361 -6.931 1.365 1.00 . A A . 47 LEU O 1 1 3 2350 1 1 48 LYS C C -8.690 -5.468 3.872 1.00 . A A . 48 LYS C 1 1 3 2351 1 1 48 LYS CA C -7.679 -5.190 2.765 1.00 . A A . 48 LYS CA 1 1 3 2352 1 1 48 LYS CB C -6.794 -3.991 3.135 1.00 . A A . 48 LYS CB 1 1 3 2353 1 1 48 LYS CD C -6.654 -2.457 1.131 1.00 . A A . 48 LYS CD 1 1 3 2354 1 1 48 LYS CE C -6.185 -1.020 0.896 1.00 . A A . 48 LYS CE 1 1 3 2355 1 1 48 LYS CG C -7.261 -2.676 2.519 1.00 . A A . 48 LYS CG 1 1 3 2356 1 1 48 LYS H H -8.262 -4.053 1.093 1.00 . A A . 48 LYS H 1 1 3 2357 1 1 48 LYS HA H -7.050 -6.058 2.650 1.00 . A A . 48 LYS HA 1 1 3 2358 1 1 48 LYS HB2 H -6.790 -3.881 4.209 1.00 . A A . 48 LYS HB2 1 1 3 2359 1 1 48 LYS HB3 H -5.787 -4.185 2.797 1.00 . A A . 48 LYS HB3 1 1 3 2360 1 1 48 LYS HD2 H -5.809 -3.118 1.013 1.00 . A A . 48 LYS HD2 1 1 3 2361 1 1 48 LYS HD3 H -7.403 -2.699 0.394 1.00 . A A . 48 LYS HD3 1 1 3 2362 1 1 48 LYS HE2 H -5.536 -1.017 0.034 1.00 . A A . 48 LYS HE2 1 1 3 2363 1 1 48 LYS HE3 H -7.034 -0.374 0.694 1.00 . A A . 48 LYS HE3 1 1 3 2364 1 1 48 LYS HG2 H -8.344 -2.725 2.425 1.00 . A A . 48 LYS HG2 1 1 3 2365 1 1 48 LYS HG3 H -6.983 -1.857 3.167 1.00 . A A . 48 LYS HG3 1 1 3 2366 1 1 48 LYS HZ1 H -5.193 0.515 1.899 1.00 . A A . 48 LYS HZ1 1 1 3 2367 1 1 48 LYS HZ2 H -4.532 -1.013 2.172 1.00 . A A . 48 LYS HZ2 1 1 3 2368 1 1 48 LYS HZ3 H -5.979 -0.568 2.929 1.00 . A A . 48 LYS HZ3 1 1 3 2369 1 1 48 LYS N N -8.327 -4.944 1.489 1.00 . A A . 48 LYS N 1 1 3 2370 1 1 48 LYS NZ N -5.424 -0.484 2.053 1.00 . A A . 48 LYS NZ 1 1 3 2371 1 1 48 LYS O O -8.579 -6.463 4.583 1.00 . A A . 48 LYS O 1 1 3 2372 1 1 49 TRP C C -11.952 -5.331 4.618 1.00 . A A . 49 TRP C 1 1 3 2373 1 1 49 TRP CA C -10.638 -4.725 5.102 1.00 . A A . 49 TRP CA 1 1 3 2374 1 1 49 TRP CB C -10.906 -3.378 5.778 1.00 . A A . 49 TRP CB 1 1 3 2375 1 1 49 TRP CD1 C -12.024 -4.169 7.949 1.00 . A A . 49 TRP CD1 1 1 3 2376 1 1 49 TRP CD2 C -13.229 -2.690 6.774 1.00 . A A . 49 TRP CD2 1 1 3 2377 1 1 49 TRP CE2 C -13.952 -3.045 7.927 1.00 . A A . 49 TRP CE2 1 1 3 2378 1 1 49 TRP CE3 C -13.788 -1.768 5.883 1.00 . A A . 49 TRP CE3 1 1 3 2379 1 1 49 TRP CG C -11.998 -3.425 6.804 1.00 . A A . 49 TRP CG 1 1 3 2380 1 1 49 TRP CH2 C -15.729 -1.614 7.324 1.00 . A A . 49 TRP CH2 1 1 3 2381 1 1 49 TRP CZ2 C -15.205 -2.512 8.212 1.00 . A A . 49 TRP CZ2 1 1 3 2382 1 1 49 TRP CZ3 C -15.033 -1.240 6.168 1.00 . A A . 49 TRP CZ3 1 1 3 2383 1 1 49 TRP H H -9.716 -3.817 3.427 1.00 . A A . 49 TRP H 1 1 3 2384 1 1 49 TRP HA H -10.213 -5.392 5.835 1.00 . A A . 49 TRP HA 1 1 3 2385 1 1 49 TRP HB2 H -10.006 -3.044 6.269 1.00 . A A . 49 TRP HB2 1 1 3 2386 1 1 49 TRP HB3 H -11.189 -2.656 5.026 1.00 . A A . 49 TRP HB3 1 1 3 2387 1 1 49 TRP HD1 H -11.232 -4.835 8.261 1.00 . A A . 49 TRP HD1 1 1 3 2388 1 1 49 TRP HE1 H -13.452 -4.370 9.482 1.00 . A A . 49 TRP HE1 1 1 3 2389 1 1 49 TRP HE3 H -13.265 -1.467 4.987 1.00 . A A . 49 TRP HE3 1 1 3 2390 1 1 49 TRP HH2 H -16.699 -1.176 7.506 1.00 . A A . 49 TRP HH2 1 1 3 2391 1 1 49 TRP HZ2 H -15.755 -2.789 9.098 1.00 . A A . 49 TRP HZ2 1 1 3 2392 1 1 49 TRP HZ3 H -15.483 -0.528 5.492 1.00 . A A . 49 TRP HZ3 1 1 3 2393 1 1 49 TRP N N -9.655 -4.578 4.036 1.00 . A A . 49 TRP N 1 1 3 2394 1 1 49 TRP NE1 N -13.196 -3.947 8.628 1.00 . A A . 49 TRP NE1 1 1 3 2395 1 1 49 TRP O O -12.408 -6.338 5.144 1.00 . A A . 49 TRP O 1 1 3 2396 1 1 50 TRP C C -14.170 -5.900 2.153 1.00 . A A . 50 TRP C 1 1 3 2397 1 1 50 TRP CA C -13.973 -4.970 3.350 1.00 . A A . 50 TRP CA 1 1 3 2398 1 1 50 TRP CB C -14.724 -3.658 3.150 1.00 . A A . 50 TRP CB 1 1 3 2399 1 1 50 TRP CD1 C -17.083 -3.483 2.171 1.00 . A A . 50 TRP CD1 1 1 3 2400 1 1 50 TRP CD2 C -17.011 -4.316 4.247 1.00 . A A . 50 TRP CD2 1 1 3 2401 1 1 50 TRP CE2 C -18.353 -4.270 3.829 1.00 . A A . 50 TRP CE2 1 1 3 2402 1 1 50 TRP CE3 C -16.720 -4.808 5.523 1.00 . A A . 50 TRP CE3 1 1 3 2403 1 1 50 TRP CG C -16.213 -3.805 3.171 1.00 . A A . 50 TRP CG 1 1 3 2404 1 1 50 TRP CH2 C -19.089 -5.170 5.881 1.00 . A A . 50 TRP CH2 1 1 3 2405 1 1 50 TRP CZ2 C -19.402 -4.695 4.639 1.00 . A A . 50 TRP CZ2 1 1 3 2406 1 1 50 TRP CZ3 C -17.763 -5.229 6.327 1.00 . A A . 50 TRP CZ3 1 1 3 2407 1 1 50 TRP H H -12.080 -4.054 3.086 1.00 . A A . 50 TRP H 1 1 3 2408 1 1 50 TRP HA H -14.385 -5.458 4.219 1.00 . A A . 50 TRP HA 1 1 3 2409 1 1 50 TRP HB2 H -14.447 -2.973 3.937 1.00 . A A . 50 TRP HB2 1 1 3 2410 1 1 50 TRP HB3 H -14.442 -3.236 2.197 1.00 . A A . 50 TRP HB3 1 1 3 2411 1 1 50 TRP HD1 H -16.789 -3.068 1.216 1.00 . A A . 50 TRP HD1 1 1 3 2412 1 1 50 TRP HE1 H -19.179 -3.606 2.012 1.00 . A A . 50 TRP HE1 1 1 3 2413 1 1 50 TRP HE3 H -15.705 -4.861 5.884 1.00 . A A . 50 TRP HE3 1 1 3 2414 1 1 50 TRP HH2 H -19.872 -5.509 6.545 1.00 . A A . 50 TRP HH2 1 1 3 2415 1 1 50 TRP HZ2 H -20.430 -4.657 4.309 1.00 . A A . 50 TRP HZ2 1 1 3 2416 1 1 50 TRP HZ3 H -17.559 -5.610 7.317 1.00 . A A . 50 TRP HZ3 1 1 3 2417 1 1 50 TRP N N -12.576 -4.692 3.646 1.00 . A A . 50 TRP N 1 1 3 2418 1 1 50 TRP NE1 N -18.370 -3.756 2.561 1.00 . A A . 50 TRP NE1 1 1 3 2419 1 1 50 TRP O O -15.030 -6.778 2.187 1.00 . A A . 50 TRP O 1 1 3 2420 1 1 51 GLU C C -13.229 -7.905 -0.005 1.00 . A A . 51 GLU C 1 1 3 2421 1 1 51 GLU CA C -13.616 -6.449 -0.149 1.00 . A A . 51 GLU CA 1 1 3 2422 1 1 51 GLU CB C -12.844 -5.832 -1.318 1.00 . A A . 51 GLU CB 1 1 3 2423 1 1 51 GLU CD C -14.845 -4.729 -2.379 1.00 . A A . 51 GLU CD 1 1 3 2424 1 1 51 GLU CG C -13.446 -4.545 -1.824 1.00 . A A . 51 GLU CG 1 1 3 2425 1 1 51 GLU H H -12.662 -5.052 1.135 1.00 . A A . 51 GLU H 1 1 3 2426 1 1 51 GLU HA H -14.671 -6.398 -0.371 1.00 . A A . 51 GLU HA 1 1 3 2427 1 1 51 GLU HB2 H -11.833 -5.621 -0.999 1.00 . A A . 51 GLU HB2 1 1 3 2428 1 1 51 GLU HB3 H -12.816 -6.540 -2.133 1.00 . A A . 51 GLU HB3 1 1 3 2429 1 1 51 GLU HG2 H -13.487 -3.852 -0.998 1.00 . A A . 51 GLU HG2 1 1 3 2430 1 1 51 GLU HG3 H -12.812 -4.145 -2.601 1.00 . A A . 51 GLU HG3 1 1 3 2431 1 1 51 GLU N N -13.394 -5.707 1.089 1.00 . A A . 51 GLU N 1 1 3 2432 1 1 51 GLU O O -14.047 -8.800 -0.221 1.00 . A A . 51 GLU O 1 1 3 2433 1 1 51 GLU OE1 O -14.982 -5.142 -3.547 1.00 . A A . 51 GLU OE1 1 1 3 2434 1 1 51 GLU OE2 O -15.820 -4.459 -1.647 1.00 . A A . 51 GLU OE2 1 1 3 2435 1 1 52 LEU C C -11.573 -10.045 1.825 1.00 . A A . 52 LEU C 1 1 3 2436 1 1 52 LEU CA C -11.468 -9.497 0.427 1.00 . A A . 52 LEU CA 1 1 3 2437 1 1 52 LEU CB C -10.016 -9.545 -0.011 1.00 . A A . 52 LEU CB 1 1 3 2438 1 1 52 LEU CD1 C -8.265 -9.111 -1.723 1.00 . A A . 52 LEU CD1 1 1 3 2439 1 1 52 LEU CD2 C -10.641 -9.395 -2.435 1.00 . A A . 52 LEU CD2 1 1 3 2440 1 1 52 LEU CG C -9.717 -8.878 -1.343 1.00 . A A . 52 LEU CG 1 1 3 2441 1 1 52 LEU H H -11.395 -7.386 0.578 1.00 . A A . 52 LEU H 1 1 3 2442 1 1 52 LEU HA H -12.056 -10.110 -0.230 1.00 . A A . 52 LEU HA 1 1 3 2443 1 1 52 LEU HB2 H -9.425 -9.054 0.749 1.00 . A A . 52 LEU HB2 1 1 3 2444 1 1 52 LEU HB3 H -9.711 -10.579 -0.072 1.00 . A A . 52 LEU HB3 1 1 3 2445 1 1 52 LEU HD11 H -7.622 -8.689 -0.966 1.00 . A A . 52 LEU HD11 1 1 3 2446 1 1 52 LEU HD12 H -8.082 -10.173 -1.803 1.00 . A A . 52 LEU HD12 1 1 3 2447 1 1 52 LEU HD13 H -8.062 -8.640 -2.674 1.00 . A A . 52 LEU HD13 1 1 3 2448 1 1 52 LEU HD21 H -11.665 -9.174 -2.174 1.00 . A A . 52 LEU HD21 1 1 3 2449 1 1 52 LEU HD22 H -10.398 -8.914 -3.372 1.00 . A A . 52 LEU HD22 1 1 3 2450 1 1 52 LEU HD23 H -10.518 -10.463 -2.536 1.00 . A A . 52 LEU HD23 1 1 3 2451 1 1 52 LEU HG H -9.877 -7.810 -1.233 1.00 . A A . 52 LEU HG 1 1 3 2452 1 1 52 LEU N N -11.982 -8.141 0.356 1.00 . A A . 52 LEU N 1 1 3 2453 1 1 52 LEU O O -11.906 -11.212 2.018 1.00 . A A . 52 LEU O 1 1 3 2454 1 1 53 ARG C C -12.675 -9.956 4.684 1.00 . A A . 53 ARG C 1 1 3 2455 1 1 53 ARG CA C -11.256 -9.688 4.183 1.00 . A A . 53 ARG CA 1 1 3 2456 1 1 53 ARG CB C -10.531 -8.705 5.097 1.00 . A A . 53 ARG CB 1 1 3 2457 1 1 53 ARG CD C -9.651 -10.483 6.655 1.00 . A A . 53 ARG CD 1 1 3 2458 1 1 53 ARG CG C -10.418 -9.173 6.539 1.00 . A A . 53 ARG CG 1 1 3 2459 1 1 53 ARG CZ C -7.304 -11.255 6.571 1.00 . A A . 53 ARG CZ 1 1 3 2460 1 1 53 ARG H H -11.068 -8.254 2.588 1.00 . A A . 53 ARG H 1 1 3 2461 1 1 53 ARG HA H -10.717 -10.625 4.190 1.00 . A A . 53 ARG HA 1 1 3 2462 1 1 53 ARG HB2 H -9.534 -8.546 4.715 1.00 . A A . 53 ARG HB2 1 1 3 2463 1 1 53 ARG HB3 H -11.064 -7.766 5.087 1.00 . A A . 53 ARG HB3 1 1 3 2464 1 1 53 ARG HD2 H -9.720 -10.835 7.673 1.00 . A A . 53 ARG HD2 1 1 3 2465 1 1 53 ARG HD3 H -10.106 -11.208 5.995 1.00 . A A . 53 ARG HD3 1 1 3 2466 1 1 53 ARG HE H -7.971 -9.513 5.838 1.00 . A A . 53 ARG HE 1 1 3 2467 1 1 53 ARG HG2 H -9.901 -8.416 7.111 1.00 . A A . 53 ARG HG2 1 1 3 2468 1 1 53 ARG HG3 H -11.412 -9.311 6.941 1.00 . A A . 53 ARG HG3 1 1 3 2469 1 1 53 ARG HH11 H -8.581 -12.550 7.485 1.00 . A A . 53 ARG HH11 1 1 3 2470 1 1 53 ARG HH12 H -6.919 -13.065 7.409 1.00 . A A . 53 ARG HH12 1 1 3 2471 1 1 53 ARG HH21 H -5.795 -10.199 5.721 1.00 . A A . 53 ARG HH21 1 1 3 2472 1 1 53 ARG HH22 H -5.333 -11.728 6.419 1.00 . A A . 53 ARG HH22 1 1 3 2473 1 1 53 ARG N N -11.273 -9.212 2.802 1.00 . A A . 53 ARG N 1 1 3 2474 1 1 53 ARG NE N -8.238 -10.341 6.300 1.00 . A A . 53 ARG NE 1 1 3 2475 1 1 53 ARG NH1 N -7.626 -12.377 7.203 1.00 . A A . 53 ARG NH1 1 1 3 2476 1 1 53 ARG NH2 N -6.046 -11.045 6.206 1.00 . A A . 53 ARG NH2 1 1 3 2477 1 1 53 ARG O O -13.373 -8.997 5.056 1.00 . A A . 53 ARG O 1 1 3 2478 1 1 53 ARG OXT O -13.083 -11.135 4.692 1.00 . A A . 53 ARG OXT 1 1 4 2479 1 1 1 ASN C C 12.449 -10.331 4.515 1.00 . A A . 1 ASN C 1 1 4 2480 1 1 1 ASN CA C 13.838 -10.690 5.003 1.00 . A A . 1 ASN CA 1 1 4 2481 1 1 1 ASN CB C 14.826 -9.577 4.637 1.00 . A A . 1 ASN CB 1 1 4 2482 1 1 1 ASN CG C 16.167 -9.748 5.321 1.00 . A A . 1 ASN CG 1 1 4 2483 1 1 1 ASN H1 H 14.305 -11.917 3.384 1.00 . A A . 1 ASN H1 1 1 4 2484 1 1 1 ASN H2 H 13.588 -12.730 4.686 1.00 . A A . 1 ASN H2 1 1 4 2485 1 1 1 ASN H3 H 15.205 -12.246 4.781 1.00 . A A . 1 ASN H3 1 1 4 2486 1 1 1 ASN HA H 13.807 -10.795 6.078 1.00 . A A . 1 ASN HA 1 1 4 2487 1 1 1 ASN HB2 H 14.985 -9.582 3.571 1.00 . A A . 1 ASN HB2 1 1 4 2488 1 1 1 ASN HB3 H 14.414 -8.623 4.932 1.00 . A A . 1 ASN HB3 1 1 4 2489 1 1 1 ASN HD21 H 16.388 -7.777 5.432 1.00 . A A . 1 ASN HD21 1 1 4 2490 1 1 1 ASN HD22 H 17.679 -8.717 6.104 1.00 . A A . 1 ASN HD22 1 1 4 2491 1 1 1 ASN N N 14.264 -11.982 4.424 1.00 . A A . 1 ASN N 1 1 4 2492 1 1 1 ASN ND2 N 16.809 -8.637 5.650 1.00 . A A . 1 ASN ND2 1 1 4 2493 1 1 1 ASN O O 11.820 -11.110 3.803 1.00 . A A . 1 ASN O 1 1 4 2494 1 1 1 ASN OD1 O 16.617 -10.869 5.561 1.00 . A A . 1 ASN OD1 1 1 4 2495 1 1 2 SER C C 10.509 -7.224 4.842 1.00 . A A . 2 SER C 1 1 4 2496 1 1 2 SER CA C 10.640 -8.714 4.553 1.00 . A A . 2 SER CA 1 1 4 2497 1 1 2 SER CB C 9.606 -9.516 5.354 1.00 . A A . 2 SER CB 1 1 4 2498 1 1 2 SER H H 12.551 -8.549 5.426 1.00 . A A . 2 SER H 1 1 4 2499 1 1 2 SER HA H 10.489 -8.887 3.498 1.00 . A A . 2 SER HA 1 1 4 2500 1 1 2 SER HB2 H 9.854 -10.567 5.308 1.00 . A A . 2 SER HB2 1 1 4 2501 1 1 2 SER HB3 H 9.626 -9.187 6.382 1.00 . A A . 2 SER HB3 1 1 4 2502 1 1 2 SER HG H 8.286 -9.583 3.896 1.00 . A A . 2 SER HG 1 1 4 2503 1 1 2 SER N N 11.978 -9.151 4.897 1.00 . A A . 2 SER N 1 1 4 2504 1 1 2 SER O O 9.973 -6.833 5.879 1.00 . A A . 2 SER O 1 1 4 2505 1 1 2 SER OG O 8.296 -9.334 4.842 1.00 . A A . 2 SER OG 1 1 4 2506 1 1 3 ASP C C 11.912 -4.583 5.307 1.00 . A A . 3 ASP C 1 1 4 2507 1 1 3 ASP CA C 11.092 -4.957 4.077 1.00 . A A . 3 ASP CA 1 1 4 2508 1 1 3 ASP CB C 9.695 -4.340 4.160 1.00 . A A . 3 ASP CB 1 1 4 2509 1 1 3 ASP CG C 9.737 -2.829 4.116 1.00 . A A . 3 ASP CG 1 1 4 2510 1 1 3 ASP H H 11.369 -6.809 3.090 1.00 . A A . 3 ASP H 1 1 4 2511 1 1 3 ASP HA H 11.592 -4.561 3.204 1.00 . A A . 3 ASP HA 1 1 4 2512 1 1 3 ASP HB2 H 9.104 -4.690 3.328 1.00 . A A . 3 ASP HB2 1 1 4 2513 1 1 3 ASP HB3 H 9.226 -4.645 5.084 1.00 . A A . 3 ASP HB3 1 1 4 2514 1 1 3 ASP N N 11.025 -6.414 3.919 1.00 . A A . 3 ASP N 1 1 4 2515 1 1 3 ASP O O 11.407 -4.569 6.432 1.00 . A A . 3 ASP O 1 1 4 2516 1 1 3 ASP OD1 O 9.739 -2.259 3.004 1.00 . A A . 3 ASP OD1 1 1 4 2517 1 1 3 ASP OD2 O 9.773 -2.208 5.196 1.00 . A A . 3 ASP OD2 1 1 4 2518 1 1 4 SER C C 14.212 -2.496 6.423 1.00 . A A . 4 SER C 1 1 4 2519 1 1 4 SER CA C 14.094 -4.001 6.192 1.00 . A A . 4 SER CA 1 1 4 2520 1 1 4 SER CB C 15.475 -4.590 5.906 1.00 . A A . 4 SER CB 1 1 4 2521 1 1 4 SER H H 13.534 -4.316 4.178 1.00 . A A . 4 SER H 1 1 4 2522 1 1 4 SER HA H 13.697 -4.460 7.085 1.00 . A A . 4 SER HA 1 1 4 2523 1 1 4 SER HB2 H 15.897 -4.108 5.036 1.00 . A A . 4 SER HB2 1 1 4 2524 1 1 4 SER HB3 H 16.119 -4.421 6.758 1.00 . A A . 4 SER HB3 1 1 4 2525 1 1 4 SER HG H 14.583 -6.341 6.050 1.00 . A A . 4 SER HG 1 1 4 2526 1 1 4 SER N N 13.188 -4.307 5.094 1.00 . A A . 4 SER N 1 1 4 2527 1 1 4 SER O O 14.789 -2.061 7.419 1.00 . A A . 4 SER O 1 1 4 2528 1 1 4 SER OG O 15.398 -5.987 5.657 1.00 . A A . 4 SER OG 1 1 4 2529 1 1 5 GLU C C 12.954 0.361 4.426 1.00 . A A . 5 GLU C 1 1 4 2530 1 1 5 GLU CA C 13.760 -0.259 5.561 1.00 . A A . 5 GLU CA 1 1 4 2531 1 1 5 GLU CB C 15.229 0.184 5.464 1.00 . A A . 5 GLU CB 1 1 4 2532 1 1 5 GLU CD C 14.928 2.364 6.727 1.00 . A A . 5 GLU CD 1 1 4 2533 1 1 5 GLU CG C 15.426 1.695 5.459 1.00 . A A . 5 GLU CG 1 1 4 2534 1 1 5 GLU H H 13.168 -2.121 4.762 1.00 . A A . 5 GLU H 1 1 4 2535 1 1 5 GLU HA H 13.350 0.068 6.507 1.00 . A A . 5 GLU HA 1 1 4 2536 1 1 5 GLU HB2 H 15.772 -0.222 6.306 1.00 . A A . 5 GLU HB2 1 1 4 2537 1 1 5 GLU HB3 H 15.648 -0.213 4.552 1.00 . A A . 5 GLU HB3 1 1 4 2538 1 1 5 GLU HG2 H 16.479 1.907 5.350 1.00 . A A . 5 GLU HG2 1 1 4 2539 1 1 5 GLU HG3 H 14.890 2.109 4.618 1.00 . A A . 5 GLU HG3 1 1 4 2540 1 1 5 GLU N N 13.664 -1.712 5.501 1.00 . A A . 5 GLU N 1 1 4 2541 1 1 5 GLU O O 12.801 -0.237 3.363 1.00 . A A . 5 GLU O 1 1 4 2542 1 1 5 GLU OE1 O 13.711 2.629 6.832 1.00 . A A . 5 GLU OE1 1 1 4 2543 1 1 5 GLU OE2 O 15.757 2.652 7.615 1.00 . A A . 5 GLU OE2 1 1 4 2544 1 1 6 CYS C C 11.727 3.752 3.820 1.00 . A A . 6 CYS C 1 1 4 2545 1 1 6 CYS CA C 11.685 2.243 3.620 1.00 . A A . 6 CYS CA 1 1 4 2546 1 1 6 CYS CB C 10.237 1.746 3.589 1.00 . A A . 6 CYS CB 1 1 4 2547 1 1 6 CYS H H 12.573 1.988 5.523 1.00 . A A . 6 CYS H 1 1 4 2548 1 1 6 CYS HA H 12.148 2.013 2.671 1.00 . A A . 6 CYS HA 1 1 4 2549 1 1 6 CYS HB2 H 9.711 2.247 2.791 1.00 . A A . 6 CYS HB2 1 1 4 2550 1 1 6 CYS HB3 H 10.239 0.683 3.396 1.00 . A A . 6 CYS HB3 1 1 4 2551 1 1 6 CYS N N 12.438 1.555 4.647 1.00 . A A . 6 CYS N 1 1 4 2552 1 1 6 CYS O O 11.254 4.272 4.831 1.00 . A A . 6 CYS O 1 1 4 2553 1 1 6 CYS SG S 9.293 2.026 5.125 1.00 . A A . 6 CYS SG 1 1 4 2554 1 1 7 PRO C C 10.824 6.398 2.655 1.00 . A A . 7 PRO C 1 1 4 2555 1 1 7 PRO CA C 12.268 5.935 2.824 1.00 . A A . 7 PRO CA 1 1 4 2556 1 1 7 PRO CB C 13.096 6.300 1.584 1.00 . A A . 7 PRO CB 1 1 4 2557 1 1 7 PRO CD C 13.135 3.922 1.765 1.00 . A A . 7 PRO CD 1 1 4 2558 1 1 7 PRO CG C 13.943 5.103 1.316 1.00 . A A . 7 PRO CG 1 1 4 2559 1 1 7 PRO HA H 12.700 6.385 3.706 1.00 . A A . 7 PRO HA 1 1 4 2560 1 1 7 PRO HB2 H 12.434 6.509 0.757 1.00 . A A . 7 PRO HB2 1 1 4 2561 1 1 7 PRO HB3 H 13.700 7.169 1.797 1.00 . A A . 7 PRO HB3 1 1 4 2562 1 1 7 PRO HD2 H 12.504 3.570 0.965 1.00 . A A . 7 PRO HD2 1 1 4 2563 1 1 7 PRO HD3 H 13.782 3.133 2.117 1.00 . A A . 7 PRO HD3 1 1 4 2564 1 1 7 PRO HG2 H 14.157 5.033 0.261 1.00 . A A . 7 PRO HG2 1 1 4 2565 1 1 7 PRO HG3 H 14.860 5.168 1.883 1.00 . A A . 7 PRO HG3 1 1 4 2566 1 1 7 PRO N N 12.331 4.473 2.866 1.00 . A A . 7 PRO N 1 1 4 2567 1 1 7 PRO O O 9.998 5.683 2.076 1.00 . A A . 7 PRO O 1 1 4 2568 1 1 8 LEU C C 8.651 8.389 1.725 1.00 . A A . 8 LEU C 1 1 4 2569 1 1 8 LEU CA C 9.161 8.126 3.140 1.00 . A A . 8 LEU CA 1 1 4 2570 1 1 8 LEU CB C 9.070 9.399 3.990 1.00 . A A . 8 LEU CB 1 1 4 2571 1 1 8 LEU CD1 C 9.560 11.343 2.460 1.00 . A A . 8 LEU CD1 1 1 4 2572 1 1 8 LEU CD2 C 10.261 11.422 4.858 1.00 . A A . 8 LEU CD2 1 1 4 2573 1 1 8 LEU CG C 10.050 10.526 3.647 1.00 . A A . 8 LEU CG 1 1 4 2574 1 1 8 LEU H H 11.247 8.144 3.536 1.00 . A A . 8 LEU H 1 1 4 2575 1 1 8 LEU HA H 8.526 7.376 3.587 1.00 . A A . 8 LEU HA 1 1 4 2576 1 1 8 LEU HB2 H 8.072 9.786 3.880 1.00 . A A . 8 LEU HB2 1 1 4 2577 1 1 8 LEU HB3 H 9.218 9.124 5.022 1.00 . A A . 8 LEU HB3 1 1 4 2578 1 1 8 LEU HD11 H 8.602 11.784 2.699 1.00 . A A . 8 LEU HD11 1 1 4 2579 1 1 8 LEU HD12 H 10.271 12.123 2.238 1.00 . A A . 8 LEU HD12 1 1 4 2580 1 1 8 LEU HD13 H 9.454 10.698 1.599 1.00 . A A . 8 LEU HD13 1 1 4 2581 1 1 8 LEU HD21 H 10.942 12.220 4.601 1.00 . A A . 8 LEU HD21 1 1 4 2582 1 1 8 LEU HD22 H 9.314 11.840 5.168 1.00 . A A . 8 LEU HD22 1 1 4 2583 1 1 8 LEU HD23 H 10.678 10.841 5.669 1.00 . A A . 8 LEU HD23 1 1 4 2584 1 1 8 LEU HG H 11.005 10.095 3.382 1.00 . A A . 8 LEU HG 1 1 4 2585 1 1 8 LEU N N 10.525 7.597 3.146 1.00 . A A . 8 LEU N 1 1 4 2586 1 1 8 LEU O O 7.499 8.759 1.531 1.00 . A A . 8 LEU O 1 1 4 2587 1 1 9 SER C C 8.278 7.274 -1.115 1.00 . A A . 9 SER C 1 1 4 2588 1 1 9 SER CA C 9.173 8.402 -0.635 1.00 . A A . 9 SER CA 1 1 4 2589 1 1 9 SER CB C 10.444 8.476 -1.481 1.00 . A A . 9 SER CB 1 1 4 2590 1 1 9 SER H H 10.382 7.829 0.965 1.00 . A A . 9 SER H 1 1 4 2591 1 1 9 SER HA H 8.637 9.337 -0.705 1.00 . A A . 9 SER HA 1 1 4 2592 1 1 9 SER HB2 H 10.921 7.508 -1.500 1.00 . A A . 9 SER HB2 1 1 4 2593 1 1 9 SER HB3 H 10.186 8.770 -2.487 1.00 . A A . 9 SER HB3 1 1 4 2594 1 1 9 SER HG H 11.973 9.704 -1.644 1.00 . A A . 9 SER HG 1 1 4 2595 1 1 9 SER N N 9.511 8.178 0.749 1.00 . A A . 9 SER N 1 1 4 2596 1 1 9 SER O O 7.528 7.426 -2.071 1.00 . A A . 9 SER O 1 1 4 2597 1 1 9 SER OG O 11.354 9.425 -0.947 1.00 . A A . 9 SER OG 1 1 4 2598 1 1 10 HIS C C 6.161 5.177 -0.042 1.00 . A A . 10 HIS C 1 1 4 2599 1 1 10 HIS CA C 7.502 5.008 -0.749 1.00 . A A . 10 HIS CA 1 1 4 2600 1 1 10 HIS CB C 8.169 3.691 -0.337 1.00 . A A . 10 HIS CB 1 1 4 2601 1 1 10 HIS CD2 C 6.377 1.807 -0.430 1.00 . A A . 10 HIS CD2 1 1 4 2602 1 1 10 HIS CE1 C 7.125 0.735 -2.188 1.00 . A A . 10 HIS CE1 1 1 4 2603 1 1 10 HIS CG C 7.481 2.463 -0.865 1.00 . A A . 10 HIS CG 1 1 4 2604 1 1 10 HIS H H 9.006 6.058 0.304 1.00 . A A . 10 HIS H 1 1 4 2605 1 1 10 HIS HA H 7.344 5.013 -1.813 1.00 . A A . 10 HIS HA 1 1 4 2606 1 1 10 HIS HB2 H 9.183 3.684 -0.703 1.00 . A A . 10 HIS HB2 1 1 4 2607 1 1 10 HIS HB3 H 8.181 3.628 0.741 1.00 . A A . 10 HIS HB3 1 1 4 2608 1 1 10 HIS HD1 H 8.712 1.989 -2.527 1.00 . A A . 10 HIS HD1 1 1 4 2609 1 1 10 HIS HD2 H 5.761 2.080 0.416 1.00 . A A . 10 HIS HD2 1 1 4 2610 1 1 10 HIS HE1 H 7.231 0.012 -2.982 1.00 . A A . 10 HIS HE1 1 1 4 2611 1 1 10 HIS HE2 H 5.504 0.029 -1.143 1.00 . A A . 10 HIS HE2 1 1 4 2612 1 1 10 HIS N N 8.355 6.137 -0.430 1.00 . A A . 10 HIS N 1 1 4 2613 1 1 10 HIS ND1 N 7.925 1.761 -1.970 1.00 . A A . 10 HIS ND1 1 1 4 2614 1 1 10 HIS NE2 N 6.180 0.737 -1.265 1.00 . A A . 10 HIS NE2 1 1 4 2615 1 1 10 HIS O O 5.126 4.703 -0.507 1.00 . A A . 10 HIS O 1 1 4 2616 1 1 11 ASP C C 4.261 7.318 1.128 1.00 . A A . 11 ASP C 1 1 4 2617 1 1 11 ASP CA C 5.011 6.208 1.850 1.00 . A A . 11 ASP CA 1 1 4 2618 1 1 11 ASP CB C 5.420 6.662 3.260 1.00 . A A . 11 ASP CB 1 1 4 2619 1 1 11 ASP CG C 4.252 7.102 4.122 1.00 . A A . 11 ASP CG 1 1 4 2620 1 1 11 ASP H H 7.074 6.170 1.418 1.00 . A A . 11 ASP H 1 1 4 2621 1 1 11 ASP HA H 4.383 5.331 1.919 1.00 . A A . 11 ASP HA 1 1 4 2622 1 1 11 ASP HB2 H 5.914 5.844 3.760 1.00 . A A . 11 ASP HB2 1 1 4 2623 1 1 11 ASP HB3 H 6.108 7.489 3.174 1.00 . A A . 11 ASP HB3 1 1 4 2624 1 1 11 ASP N N 6.206 5.866 1.089 1.00 . A A . 11 ASP N 1 1 4 2625 1 1 11 ASP O O 3.045 7.258 0.945 1.00 . A A . 11 ASP O 1 1 4 2626 1 1 11 ASP OD1 O 3.763 8.233 3.929 1.00 . A A . 11 ASP OD1 1 1 4 2627 1 1 11 ASP OD2 O 3.789 6.301 4.959 1.00 . A A . 11 ASP OD2 1 1 4 2628 1 1 12 GLY C C 4.141 9.018 -1.491 1.00 . A A . 12 GLY C 1 1 4 2629 1 1 12 GLY CA C 4.477 9.414 -0.073 1.00 . A A . 12 GLY CA 1 1 4 2630 1 1 12 GLY H H 5.980 8.290 0.887 1.00 . A A . 12 GLY H 1 1 4 2631 1 1 12 GLY HA2 H 3.580 9.765 0.416 1.00 . A A . 12 GLY HA2 1 1 4 2632 1 1 12 GLY HA3 H 5.201 10.216 -0.094 1.00 . A A . 12 GLY HA3 1 1 4 2633 1 1 12 GLY N N 5.023 8.308 0.684 1.00 . A A . 12 GLY N 1 1 4 2634 1 1 12 GLY O O 3.398 9.718 -2.179 1.00 . A A . 12 GLY O 1 1 4 2635 1 1 13 TYR C C 2.884 6.804 -3.143 1.00 . A A . 13 TYR C 1 1 4 2636 1 1 13 TYR CA C 4.320 7.314 -3.225 1.00 . A A . 13 TYR CA 1 1 4 2637 1 1 13 TYR CB C 5.266 6.171 -3.613 1.00 . A A . 13 TYR CB 1 1 4 2638 1 1 13 TYR CD1 C 5.405 6.213 -6.139 1.00 . A A . 13 TYR CD1 1 1 4 2639 1 1 13 TYR CD2 C 4.280 4.385 -5.106 1.00 . A A . 13 TYR CD2 1 1 4 2640 1 1 13 TYR CE1 C 5.137 5.679 -7.385 1.00 . A A . 13 TYR CE1 1 1 4 2641 1 1 13 TYR CE2 C 4.005 3.848 -6.348 1.00 . A A . 13 TYR CE2 1 1 4 2642 1 1 13 TYR CG C 4.982 5.576 -4.978 1.00 . A A . 13 TYR CG 1 1 4 2643 1 1 13 TYR CZ C 4.436 4.497 -7.483 1.00 . A A . 13 TYR CZ 1 1 4 2644 1 1 13 TYR H H 5.423 7.478 -1.407 1.00 . A A . 13 TYR H 1 1 4 2645 1 1 13 TYR HA H 4.373 8.091 -3.973 1.00 . A A . 13 TYR HA 1 1 4 2646 1 1 13 TYR HB2 H 6.279 6.540 -3.616 1.00 . A A . 13 TYR HB2 1 1 4 2647 1 1 13 TYR HB3 H 5.181 5.380 -2.882 1.00 . A A . 13 TYR HB3 1 1 4 2648 1 1 13 TYR HD1 H 5.955 7.139 -6.060 1.00 . A A . 13 TYR HD1 1 1 4 2649 1 1 13 TYR HD2 H 3.945 3.875 -4.217 1.00 . A A . 13 TYR HD2 1 1 4 2650 1 1 13 TYR HE1 H 5.473 6.187 -8.276 1.00 . A A . 13 TYR HE1 1 1 4 2651 1 1 13 TYR HE2 H 3.456 2.923 -6.425 1.00 . A A . 13 TYR HE2 1 1 4 2652 1 1 13 TYR HH H 4.970 3.934 -9.248 1.00 . A A . 13 TYR HH 1 1 4 2653 1 1 13 TYR N N 4.708 7.901 -1.941 1.00 . A A . 13 TYR N 1 1 4 2654 1 1 13 TYR O O 2.230 6.566 -4.155 1.00 . A A . 13 TYR O 1 1 4 2655 1 1 13 TYR OH O 4.158 3.962 -8.720 1.00 . A A . 13 TYR OH 1 1 4 2656 1 1 14 CYS C C 0.174 7.479 -1.463 1.00 . A A . 14 CYS C 1 1 4 2657 1 1 14 CYS CA C 1.028 6.242 -1.699 1.00 . A A . 14 CYS CA 1 1 4 2658 1 1 14 CYS CB C 0.945 5.305 -0.514 1.00 . A A . 14 CYS CB 1 1 4 2659 1 1 14 CYS H H 2.992 6.772 -1.156 1.00 . A A . 14 CYS H 1 1 4 2660 1 1 14 CYS HA H 0.673 5.732 -2.583 1.00 . A A . 14 CYS HA 1 1 4 2661 1 1 14 CYS HB2 H 1.897 5.312 0.009 1.00 . A A . 14 CYS HB2 1 1 4 2662 1 1 14 CYS HB3 H 0.169 5.649 0.154 1.00 . A A . 14 CYS HB3 1 1 4 2663 1 1 14 CYS N N 2.405 6.626 -1.927 1.00 . A A . 14 CYS N 1 1 4 2664 1 1 14 CYS O O 0.691 8.594 -1.411 1.00 . A A . 14 CYS O 1 1 4 2665 1 1 14 CYS SG S 0.571 3.580 -0.964 1.00 . A A . 14 CYS SG 1 1 4 2666 1 1 15 LEU C C -2.709 8.645 0.017 1.00 . A A . 15 LEU C 1 1 4 2667 1 1 15 LEU CA C -2.047 8.412 -1.322 1.00 . A A . 15 LEU CA 1 1 4 2668 1 1 15 LEU CB C -3.122 8.207 -2.387 1.00 . A A . 15 LEU CB 1 1 4 2669 1 1 15 LEU CD1 C -3.753 7.698 -4.751 1.00 . A A . 15 LEU CD1 1 1 4 2670 1 1 15 LEU CD2 C -1.557 8.760 -4.272 1.00 . A A . 15 LEU CD2 1 1 4 2671 1 1 15 LEU CG C -2.606 7.788 -3.761 1.00 . A A . 15 LEU CG 1 1 4 2672 1 1 15 LEU H H -1.472 6.385 -1.128 1.00 . A A . 15 LEU H 1 1 4 2673 1 1 15 LEU HA H -1.476 9.287 -1.575 1.00 . A A . 15 LEU HA 1 1 4 2674 1 1 15 LEU HB2 H -3.805 7.448 -2.037 1.00 . A A . 15 LEU HB2 1 1 4 2675 1 1 15 LEU HB3 H -3.668 9.133 -2.501 1.00 . A A . 15 LEU HB3 1 1 4 2676 1 1 15 LEU HD11 H -4.222 8.666 -4.847 1.00 . A A . 15 LEU HD11 1 1 4 2677 1 1 15 LEU HD12 H -3.375 7.384 -5.712 1.00 . A A . 15 LEU HD12 1 1 4 2678 1 1 15 LEU HD13 H -4.478 6.980 -4.398 1.00 . A A . 15 LEU HD13 1 1 4 2679 1 1 15 LEU HD21 H -1.990 9.746 -4.352 1.00 . A A . 15 LEU HD21 1 1 4 2680 1 1 15 LEU HD22 H -0.725 8.788 -3.583 1.00 . A A . 15 LEU HD22 1 1 4 2681 1 1 15 LEU HD23 H -1.211 8.438 -5.242 1.00 . A A . 15 LEU HD23 1 1 4 2682 1 1 15 LEU HG H -2.147 6.807 -3.673 1.00 . A A . 15 LEU HG 1 1 4 2683 1 1 15 LEU N N -1.129 7.286 -1.293 1.00 . A A . 15 LEU N 1 1 4 2684 1 1 15 LEU O O -2.567 9.713 0.607 1.00 . A A . 15 LEU O 1 1 4 2685 1 1 16 HIS C C -3.877 7.065 2.867 1.00 . A A . 16 HIS C 1 1 4 2686 1 1 16 HIS CA C -4.281 7.889 1.670 1.00 . A A . 16 HIS CA 1 1 4 2687 1 1 16 HIS CB C -5.753 7.658 1.323 1.00 . A A . 16 HIS CB 1 1 4 2688 1 1 16 HIS CD2 C -6.724 9.057 -0.642 1.00 . A A . 16 HIS CD2 1 1 4 2689 1 1 16 HIS CE1 C -7.310 10.832 0.500 1.00 . A A . 16 HIS CE1 1 1 4 2690 1 1 16 HIS CG C -6.396 8.835 0.653 1.00 . A A . 16 HIS CG 1 1 4 2691 1 1 16 HIS H H -3.345 6.730 0.125 1.00 . A A . 16 HIS H 1 1 4 2692 1 1 16 HIS HA H -4.156 8.925 1.935 1.00 . A A . 16 HIS HA 1 1 4 2693 1 1 16 HIS HB2 H -5.833 6.811 0.658 1.00 . A A . 16 HIS HB2 1 1 4 2694 1 1 16 HIS HB3 H -6.301 7.451 2.229 1.00 . A A . 16 HIS HB3 1 1 4 2695 1 1 16 HIS HD1 H -6.650 10.127 2.312 1.00 . A A . 16 HIS HD1 1 1 4 2696 1 1 16 HIS HD2 H -6.571 8.377 -1.467 1.00 . A A . 16 HIS HD2 1 1 4 2697 1 1 16 HIS HE1 H -7.700 11.806 0.757 1.00 . A A . 16 HIS HE1 1 1 4 2698 1 1 16 HIS HE2 H -7.695 10.712 -1.514 1.00 . A A . 16 HIS HE2 1 1 4 2699 1 1 16 HIS N N -3.421 7.648 0.515 1.00 . A A . 16 HIS N 1 1 4 2700 1 1 16 HIS ND1 N -6.774 9.969 1.339 1.00 . A A . 16 HIS ND1 1 1 4 2701 1 1 16 HIS NE2 N -7.290 10.305 -0.707 1.00 . A A . 16 HIS NE2 1 1 4 2702 1 1 16 HIS O O -4.714 6.718 3.699 1.00 . A A . 16 HIS O 1 1 4 2703 1 1 17 ASP C C -0.567 5.711 3.798 1.00 . A A . 17 ASP C 1 1 4 2704 1 1 17 ASP CA C -2.009 6.073 4.089 1.00 . A A . 17 ASP CA 1 1 4 2705 1 1 17 ASP CB C -2.783 4.794 4.424 1.00 . A A . 17 ASP CB 1 1 4 2706 1 1 17 ASP CG C -2.453 4.263 5.807 1.00 . A A . 17 ASP CG 1 1 4 2707 1 1 17 ASP H H -1.996 7.082 2.230 1.00 . A A . 17 ASP H 1 1 4 2708 1 1 17 ASP HA H -2.035 6.739 4.934 1.00 . A A . 17 ASP HA 1 1 4 2709 1 1 17 ASP HB2 H -3.842 5.001 4.381 1.00 . A A . 17 ASP HB2 1 1 4 2710 1 1 17 ASP HB3 H -2.538 4.033 3.699 1.00 . A A . 17 ASP HB3 1 1 4 2711 1 1 17 ASP N N -2.587 6.780 2.948 1.00 . A A . 17 ASP N 1 1 4 2712 1 1 17 ASP O O 0.337 6.154 4.493 1.00 . A A . 17 ASP O 1 1 4 2713 1 1 17 ASP OD1 O -1.491 3.473 5.927 1.00 . A A . 17 ASP OD1 1 1 4 2714 1 1 17 ASP OD2 O -3.147 4.618 6.776 1.00 . A A . 17 ASP OD2 1 1 4 2715 1 1 18 GLY C C 1.574 3.515 3.474 1.00 . A A . 18 GLY C 1 1 4 2716 1 1 18 GLY CA C 0.953 4.422 2.410 1.00 . A A . 18 GLY CA 1 1 4 2717 1 1 18 GLY H H -1.117 4.814 2.096 1.00 . A A . 18 GLY H 1 1 4 2718 1 1 18 GLY HA2 H 0.869 3.850 1.497 1.00 . A A . 18 GLY HA2 1 1 4 2719 1 1 18 GLY HA3 H 1.622 5.252 2.229 1.00 . A A . 18 GLY HA3 1 1 4 2720 1 1 18 GLY N N -0.368 4.958 2.724 1.00 . A A . 18 GLY N 1 1 4 2721 1 1 18 GLY O O 1.600 3.836 4.661 1.00 . A A . 18 GLY O 1 1 4 2722 1 1 19 VAL C C 3.909 0.751 2.975 1.00 . A A . 19 VAL C 1 1 4 2723 1 1 19 VAL CA C 2.864 1.444 3.851 1.00 . A A . 19 VAL CA 1 1 4 2724 1 1 19 VAL CB C 1.959 0.382 4.546 1.00 . A A . 19 VAL CB 1 1 4 2725 1 1 19 VAL CG1 C 2.774 -0.792 5.076 1.00 . A A . 19 VAL CG1 1 1 4 2726 1 1 19 VAL CG2 C 1.178 1.003 5.694 1.00 . A A . 19 VAL CG2 1 1 4 2727 1 1 19 VAL H H 2.001 2.178 2.061 1.00 . A A . 19 VAL H 1 1 4 2728 1 1 19 VAL HA H 3.374 2.019 4.615 1.00 . A A . 19 VAL HA 1 1 4 2729 1 1 19 VAL HB H 1.253 0.005 3.821 1.00 . A A . 19 VAL HB 1 1 4 2730 1 1 19 VAL HG11 H 3.283 -1.277 4.255 1.00 . A A . 19 VAL HG11 1 1 4 2731 1 1 19 VAL HG12 H 3.502 -0.432 5.788 1.00 . A A . 19 VAL HG12 1 1 4 2732 1 1 19 VAL HG13 H 2.116 -1.499 5.561 1.00 . A A . 19 VAL HG13 1 1 4 2733 1 1 19 VAL HG21 H 0.540 0.255 6.140 1.00 . A A . 19 VAL HG21 1 1 4 2734 1 1 19 VAL HG22 H 1.866 1.379 6.435 1.00 . A A . 19 VAL HG22 1 1 4 2735 1 1 19 VAL HG23 H 0.572 1.815 5.319 1.00 . A A . 19 VAL HG23 1 1 4 2736 1 1 19 VAL N N 2.105 2.383 3.014 1.00 . A A . 19 VAL N 1 1 4 2737 1 1 19 VAL O O 3.666 0.516 1.791 1.00 . A A . 19 VAL O 1 1 4 2738 1 1 20 CYS C C 6.367 -1.583 2.914 1.00 . A A . 20 CYS C 1 1 4 2739 1 1 20 CYS CA C 6.178 -0.077 2.756 1.00 . A A . 20 CYS CA 1 1 4 2740 1 1 20 CYS CB C 7.453 0.660 3.160 1.00 . A A . 20 CYS CB 1 1 4 2741 1 1 20 CYS H H 5.170 0.534 4.512 1.00 . A A . 20 CYS H 1 1 4 2742 1 1 20 CYS HA H 5.972 0.135 1.718 1.00 . A A . 20 CYS HA 1 1 4 2743 1 1 20 CYS HB2 H 8.303 0.160 2.717 1.00 . A A . 20 CYS HB2 1 1 4 2744 1 1 20 CYS HB3 H 7.404 1.672 2.789 1.00 . A A . 20 CYS HB3 1 1 4 2745 1 1 20 CYS N N 5.062 0.431 3.541 1.00 . A A . 20 CYS N 1 1 4 2746 1 1 20 CYS O O 6.642 -2.070 4.007 1.00 . A A . 20 CYS O 1 1 4 2747 1 1 20 CYS SG S 7.734 0.740 4.959 1.00 . A A . 20 CYS SG 1 1 4 2748 1 1 21 MET C C 7.040 -4.027 0.334 1.00 . A A . 21 MET C 1 1 4 2749 1 1 21 MET CA C 6.522 -3.728 1.733 1.00 . A A . 21 MET CA 1 1 4 2750 1 1 21 MET CB C 5.310 -4.616 1.991 1.00 . A A . 21 MET CB 1 1 4 2751 1 1 21 MET CE C 5.831 -6.641 4.338 1.00 . A A . 21 MET CE 1 1 4 2752 1 1 21 MET CG C 4.611 -4.367 3.318 1.00 . A A . 21 MET CG 1 1 4 2753 1 1 21 MET H H 5.759 -1.886 1.034 1.00 . A A . 21 MET H 1 1 4 2754 1 1 21 MET HA H 7.292 -3.937 2.459 1.00 . A A . 21 MET HA 1 1 4 2755 1 1 21 MET HB2 H 4.608 -4.455 1.200 1.00 . A A . 21 MET HB2 1 1 4 2756 1 1 21 MET HB3 H 5.629 -5.649 1.968 1.00 . A A . 21 MET HB3 1 1 4 2757 1 1 21 MET HE1 H 6.419 -7.110 5.113 1.00 . A A . 21 MET HE1 1 1 4 2758 1 1 21 MET HE2 H 4.872 -7.131 4.268 1.00 . A A . 21 MET HE2 1 1 4 2759 1 1 21 MET HE3 H 6.346 -6.730 3.392 1.00 . A A . 21 MET HE3 1 1 4 2760 1 1 21 MET HG2 H 4.424 -3.307 3.411 1.00 . A A . 21 MET HG2 1 1 4 2761 1 1 21 MET HG3 H 3.673 -4.901 3.323 1.00 . A A . 21 MET HG3 1 1 4 2762 1 1 21 MET N N 6.170 -2.310 1.815 1.00 . A A . 21 MET N 1 1 4 2763 1 1 21 MET O O 6.264 -4.068 -0.616 1.00 . A A . 21 MET O 1 1 4 2764 1 1 21 MET SD S 5.591 -4.908 4.732 1.00 . A A . 21 MET SD 1 1 4 2765 1 1 22 TYR C C 10.274 -5.148 -1.010 1.00 . A A . 22 TYR C 1 1 4 2766 1 1 22 TYR CA C 8.927 -4.425 -1.091 1.00 . A A . 22 TYR CA 1 1 4 2767 1 1 22 TYR CB C 9.034 -3.101 -1.844 1.00 . A A . 22 TYR CB 1 1 4 2768 1 1 22 TYR CD1 C 9.362 -1.439 0.031 1.00 . A A . 22 TYR CD1 1 1 4 2769 1 1 22 TYR CD2 C 10.994 -1.499 -1.699 1.00 . A A . 22 TYR CD2 1 1 4 2770 1 1 22 TYR CE1 C 10.058 -0.425 0.659 1.00 . A A . 22 TYR CE1 1 1 4 2771 1 1 22 TYR CE2 C 11.698 -0.490 -1.074 1.00 . A A . 22 TYR CE2 1 1 4 2772 1 1 22 TYR CG C 9.815 -1.992 -1.159 1.00 . A A . 22 TYR CG 1 1 4 2773 1 1 22 TYR CZ C 11.265 0.026 0.088 1.00 . A A . 22 TYR CZ 1 1 4 2774 1 1 22 TYR H H 8.902 -4.165 0.951 1.00 . A A . 22 TYR H 1 1 4 2775 1 1 22 TYR HA H 8.267 -5.057 -1.630 1.00 . A A . 22 TYR HA 1 1 4 2776 1 1 22 TYR HB2 H 9.512 -3.311 -2.761 1.00 . A A . 22 TYR HB2 1 1 4 2777 1 1 22 TYR HB3 H 8.039 -2.731 -2.045 1.00 . A A . 22 TYR HB3 1 1 4 2778 1 1 22 TYR HD1 H 8.445 -1.809 0.466 1.00 . A A . 22 TYR HD1 1 1 4 2779 1 1 22 TYR HD2 H 11.367 -1.920 -2.621 1.00 . A A . 22 TYR HD2 1 1 4 2780 1 1 22 TYR HE1 H 9.689 -0.008 1.582 1.00 . A A . 22 TYR HE1 1 1 4 2781 1 1 22 TYR HE2 H 12.612 -0.119 -1.512 1.00 . A A . 22 TYR HE2 1 1 4 2782 1 1 22 TYR HH H 11.976 1.815 0.100 1.00 . A A . 22 TYR HH 1 1 4 2783 1 1 22 TYR N N 8.338 -4.202 0.194 1.00 . A A . 22 TYR N 1 1 4 2784 1 1 22 TYR O O 10.387 -6.317 -1.360 1.00 . A A . 22 TYR O 1 1 4 2785 1 1 22 TYR OH O 11.915 1.065 0.710 1.00 . A A . 22 TYR OH 1 1 4 2786 1 1 23 ILE C C 12.656 -6.153 0.587 1.00 . A A . 23 ILE C 1 1 4 2787 1 1 23 ILE CA C 12.627 -5.027 -0.449 1.00 . A A . 23 ILE CA 1 1 4 2788 1 1 23 ILE CB C 13.674 -3.976 -0.060 1.00 . A A . 23 ILE CB 1 1 4 2789 1 1 23 ILE CD1 C 14.203 -2.598 2.003 1.00 . A A . 23 ILE CD1 1 1 4 2790 1 1 23 ILE CG1 C 13.130 -3.149 1.089 1.00 . A A . 23 ILE CG1 1 1 4 2791 1 1 23 ILE CG2 C 14.040 -3.106 -1.252 1.00 . A A . 23 ILE CG2 1 1 4 2792 1 1 23 ILE H H 11.134 -3.520 -0.349 1.00 . A A . 23 ILE H 1 1 4 2793 1 1 23 ILE HA H 12.901 -5.435 -1.410 1.00 . A A . 23 ILE HA 1 1 4 2794 1 1 23 ILE HB H 14.562 -4.492 0.265 1.00 . A A . 23 ILE HB 1 1 4 2795 1 1 23 ILE HD11 H 14.861 -1.957 1.438 1.00 . A A . 23 ILE HD11 1 1 4 2796 1 1 23 ILE HD12 H 13.741 -2.031 2.798 1.00 . A A . 23 ILE HD12 1 1 4 2797 1 1 23 ILE HD13 H 14.772 -3.415 2.426 1.00 . A A . 23 ILE HD13 1 1 4 2798 1 1 23 ILE HG12 H 12.568 -2.317 0.693 1.00 . A A . 23 ILE HG12 1 1 4 2799 1 1 23 ILE HG13 H 12.472 -3.786 1.669 1.00 . A A . 23 ILE HG13 1 1 4 2800 1 1 23 ILE HG21 H 13.156 -2.606 -1.614 1.00 . A A . 23 ILE HG21 1 1 4 2801 1 1 23 ILE HG22 H 14.772 -2.372 -0.951 1.00 . A A . 23 ILE HG22 1 1 4 2802 1 1 23 ILE HG23 H 14.451 -3.724 -2.036 1.00 . A A . 23 ILE HG23 1 1 4 2803 1 1 23 ILE N N 11.286 -4.450 -0.574 1.00 . A A . 23 ILE N 1 1 4 2804 1 1 23 ILE O O 12.891 -5.940 1.775 1.00 . A A . 23 ILE O 1 1 4 2805 1 1 24 GLU C C 13.414 -9.512 0.628 1.00 . A A . 24 GLU C 1 1 4 2806 1 1 24 GLU CA C 12.338 -8.512 0.980 1.00 . A A . 24 GLU CA 1 1 4 2807 1 1 24 GLU CB C 10.973 -9.162 0.800 1.00 . A A . 24 GLU CB 1 1 4 2808 1 1 24 GLU CD C 8.526 -9.060 1.467 1.00 . A A . 24 GLU CD 1 1 4 2809 1 1 24 GLU CG C 9.831 -8.302 1.324 1.00 . A A . 24 GLU CG 1 1 4 2810 1 1 24 GLU H H 12.293 -7.463 -0.850 1.00 . A A . 24 GLU H 1 1 4 2811 1 1 24 GLU HA H 12.455 -8.194 2.003 1.00 . A A . 24 GLU HA 1 1 4 2812 1 1 24 GLU HB2 H 10.822 -9.338 -0.268 1.00 . A A . 24 GLU HB2 1 1 4 2813 1 1 24 GLU HB3 H 10.959 -10.109 1.320 1.00 . A A . 24 GLU HB3 1 1 4 2814 1 1 24 GLU HG2 H 10.108 -7.918 2.291 1.00 . A A . 24 GLU HG2 1 1 4 2815 1 1 24 GLU HG3 H 9.680 -7.478 0.645 1.00 . A A . 24 GLU HG3 1 1 4 2816 1 1 24 GLU N N 12.422 -7.351 0.118 1.00 . A A . 24 GLU N 1 1 4 2817 1 1 24 GLU O O 13.552 -10.541 1.286 1.00 . A A . 24 GLU O 1 1 4 2818 1 1 24 GLU OE1 O 8.459 -9.971 2.317 1.00 . A A . 24 GLU OE1 1 1 4 2819 1 1 24 GLU OE2 O 7.566 -8.743 0.744 1.00 . A A . 24 GLU OE2 1 1 4 2820 1 1 25 ALA C C 14.168 -11.158 -1.832 1.00 . A A . 25 ALA C 1 1 4 2821 1 1 25 ALA CA C 15.036 -10.134 -1.107 1.00 . A A . 25 ALA CA 1 1 4 2822 1 1 25 ALA CB C 16.022 -10.808 -0.155 1.00 . A A . 25 ALA CB 1 1 4 2823 1 1 25 ALA H H 14.141 -8.254 -0.742 1.00 . A A . 25 ALA H 1 1 4 2824 1 1 25 ALA HA H 15.604 -9.584 -1.845 1.00 . A A . 25 ALA HA 1 1 4 2825 1 1 25 ALA HB1 H 16.632 -11.511 -0.703 1.00 . A A . 25 ALA HB1 1 1 4 2826 1 1 25 ALA HB2 H 16.655 -10.060 0.299 1.00 . A A . 25 ALA HB2 1 1 4 2827 1 1 25 ALA HB3 H 15.478 -11.330 0.617 1.00 . A A . 25 ALA HB3 1 1 4 2828 1 1 25 ALA N N 14.170 -9.182 -0.420 1.00 . A A . 25 ALA N 1 1 4 2829 1 1 25 ALA O O 14.662 -12.115 -2.421 1.00 . A A . 25 ALA O 1 1 4 2830 1 1 26 LEU C C 11.497 -10.932 -3.734 1.00 . A A . 26 LEU C 1 1 4 2831 1 1 26 LEU CA C 11.902 -11.725 -2.521 1.00 . A A . 26 LEU CA 1 1 4 2832 1 1 26 LEU CB C 10.678 -12.053 -1.656 1.00 . A A . 26 LEU CB 1 1 4 2833 1 1 26 LEU CD1 C 9.697 -12.960 0.466 1.00 . A A . 26 LEU CD1 1 1 4 2834 1 1 26 LEU CD2 C 11.756 -13.997 -0.495 1.00 . A A . 26 LEU CD2 1 1 4 2835 1 1 26 LEU CG C 10.983 -12.704 -0.304 1.00 . A A . 26 LEU CG 1 1 4 2836 1 1 26 LEU H H 12.522 -10.168 -1.270 1.00 . A A . 26 LEU H 1 1 4 2837 1 1 26 LEU HA H 12.385 -12.631 -2.835 1.00 . A A . 26 LEU HA 1 1 4 2838 1 1 26 LEU HB2 H 10.138 -11.135 -1.475 1.00 . A A . 26 LEU HB2 1 1 4 2839 1 1 26 LEU HB3 H 10.040 -12.721 -2.213 1.00 . A A . 26 LEU HB3 1 1 4 2840 1 1 26 LEU HD11 H 9.926 -13.439 1.406 1.00 . A A . 26 LEU HD11 1 1 4 2841 1 1 26 LEU HD12 H 9.196 -12.021 0.655 1.00 . A A . 26 LEU HD12 1 1 4 2842 1 1 26 LEU HD13 H 9.051 -13.602 -0.117 1.00 . A A . 26 LEU HD13 1 1 4 2843 1 1 26 LEU HD21 H 11.998 -14.419 0.470 1.00 . A A . 26 LEU HD21 1 1 4 2844 1 1 26 LEU HD22 H 11.153 -14.698 -1.054 1.00 . A A . 26 LEU HD22 1 1 4 2845 1 1 26 LEU HD23 H 12.668 -13.795 -1.039 1.00 . A A . 26 LEU HD23 1 1 4 2846 1 1 26 LEU HG H 11.594 -12.031 0.283 1.00 . A A . 26 LEU HG 1 1 4 2847 1 1 26 LEU N N 12.855 -10.921 -1.794 1.00 . A A . 26 LEU N 1 1 4 2848 1 1 26 LEU O O 10.724 -11.378 -4.585 1.00 . A A . 26 LEU O 1 1 4 2849 1 1 27 ASP C C 10.499 -8.306 -4.975 1.00 . A A . 27 ASP C 1 1 4 2850 1 1 27 ASP CA C 11.915 -8.801 -4.882 1.00 . A A . 27 ASP CA 1 1 4 2851 1 1 27 ASP CB C 12.363 -9.490 -6.175 1.00 . A A . 27 ASP CB 1 1 4 2852 1 1 27 ASP CG C 12.576 -8.508 -7.313 1.00 . A A . 27 ASP CG 1 1 4 2853 1 1 27 ASP H H 12.406 -9.360 -2.901 1.00 . A A . 27 ASP H 1 1 4 2854 1 1 27 ASP HA H 12.563 -7.957 -4.687 1.00 . A A . 27 ASP HA 1 1 4 2855 1 1 27 ASP HB2 H 13.291 -10.007 -5.990 1.00 . A A . 27 ASP HB2 1 1 4 2856 1 1 27 ASP HB3 H 11.610 -10.205 -6.475 1.00 . A A . 27 ASP HB3 1 1 4 2857 1 1 27 ASP N N 12.004 -9.699 -3.739 1.00 . A A . 27 ASP N 1 1 4 2858 1 1 27 ASP O O 9.811 -8.479 -5.977 1.00 . A A . 27 ASP O 1 1 4 2859 1 1 27 ASP OD1 O 13.561 -7.740 -7.278 1.00 . A A . 27 ASP OD1 1 1 4 2860 1 1 27 ASP OD2 O 11.757 -8.500 -8.256 1.00 . A A . 27 ASP OD2 1 1 4 2861 1 1 28 LYS C C 8.545 -5.798 -3.975 1.00 . A A . 28 LYS C 1 1 4 2862 1 1 28 LYS CA C 8.685 -7.302 -3.763 1.00 . A A . 28 LYS CA 1 1 4 2863 1 1 28 LYS CB C 8.130 -7.728 -2.404 1.00 . A A . 28 LYS CB 1 1 4 2864 1 1 28 LYS CD C 7.002 -9.979 -2.713 1.00 . A A . 28 LYS CD 1 1 4 2865 1 1 28 LYS CE C 6.962 -9.968 -4.233 1.00 . A A . 28 LYS CE 1 1 4 2866 1 1 28 LYS CG C 8.208 -9.233 -2.143 1.00 . A A . 28 LYS CG 1 1 4 2867 1 1 28 LYS H H 10.689 -7.552 -3.125 1.00 . A A . 28 LYS H 1 1 4 2868 1 1 28 LYS HA H 8.128 -7.807 -4.537 1.00 . A A . 28 LYS HA 1 1 4 2869 1 1 28 LYS HB2 H 8.689 -7.223 -1.629 1.00 . A A . 28 LYS HB2 1 1 4 2870 1 1 28 LYS HB3 H 7.094 -7.427 -2.341 1.00 . A A . 28 LYS HB3 1 1 4 2871 1 1 28 LYS HD2 H 7.041 -11.003 -2.379 1.00 . A A . 28 LYS HD2 1 1 4 2872 1 1 28 LYS HD3 H 6.100 -9.516 -2.338 1.00 . A A . 28 LYS HD3 1 1 4 2873 1 1 28 LYS HE2 H 5.978 -10.269 -4.559 1.00 . A A . 28 LYS HE2 1 1 4 2874 1 1 28 LYS HE3 H 7.163 -8.963 -4.576 1.00 . A A . 28 LYS HE3 1 1 4 2875 1 1 28 LYS HG2 H 9.116 -9.624 -2.588 1.00 . A A . 28 LYS HG2 1 1 4 2876 1 1 28 LYS HG3 H 8.240 -9.392 -1.074 1.00 . A A . 28 LYS HG3 1 1 4 2877 1 1 28 LYS HZ1 H 7.934 -10.833 -5.868 1.00 . A A . 28 LYS HZ1 1 1 4 2878 1 1 28 LYS HZ2 H 7.764 -11.875 -4.539 1.00 . A A . 28 LYS HZ2 1 1 4 2879 1 1 28 LYS HZ3 H 8.924 -10.641 -4.507 1.00 . A A . 28 LYS HZ3 1 1 4 2880 1 1 28 LYS N N 10.062 -7.713 -3.887 1.00 . A A . 28 LYS N 1 1 4 2881 1 1 28 LYS NZ N 7.967 -10.891 -4.825 1.00 . A A . 28 LYS NZ 1 1 4 2882 1 1 28 LYS O O 9.533 -5.069 -4.076 1.00 . A A . 28 LYS O 1 1 4 2883 1 1 29 TYR C C 5.456 -3.843 -4.086 1.00 . A A . 29 TYR C 1 1 4 2884 1 1 29 TYR CA C 6.934 -3.995 -4.376 1.00 . A A . 29 TYR CA 1 1 4 2885 1 1 29 TYR CB C 7.225 -3.597 -5.836 1.00 . A A . 29 TYR CB 1 1 4 2886 1 1 29 TYR CD1 C 7.616 -5.754 -7.100 1.00 . A A . 29 TYR CD1 1 1 4 2887 1 1 29 TYR CD2 C 5.656 -4.502 -7.611 1.00 . A A . 29 TYR CD2 1 1 4 2888 1 1 29 TYR CE1 C 7.257 -6.701 -8.039 1.00 . A A . 29 TYR CE1 1 1 4 2889 1 1 29 TYR CE2 C 5.292 -5.444 -8.551 1.00 . A A . 29 TYR CE2 1 1 4 2890 1 1 29 TYR CG C 6.825 -4.638 -6.869 1.00 . A A . 29 TYR CG 1 1 4 2891 1 1 29 TYR CZ C 6.085 -6.548 -8.749 1.00 . A A . 29 TYR CZ 1 1 4 2892 1 1 29 TYR H H 6.595 -5.998 -3.886 1.00 . A A . 29 TYR H 1 1 4 2893 1 1 29 TYR HA H 7.490 -3.350 -3.710 1.00 . A A . 29 TYR HA 1 1 4 2894 1 1 29 TYR HB2 H 6.667 -2.686 -6.060 1.00 . A A . 29 TYR HB2 1 1 4 2895 1 1 29 TYR HB3 H 8.283 -3.401 -5.948 1.00 . A A . 29 TYR HB3 1 1 4 2896 1 1 29 TYR HD1 H 8.525 -5.879 -6.532 1.00 . A A . 29 TYR HD1 1 1 4 2897 1 1 29 TYR HD2 H 5.027 -3.639 -7.445 1.00 . A A . 29 TYR HD2 1 1 4 2898 1 1 29 TYR HE1 H 7.887 -7.560 -8.205 1.00 . A A . 29 TYR HE1 1 1 4 2899 1 1 29 TYR HE2 H 4.381 -5.319 -9.119 1.00 . A A . 29 TYR HE2 1 1 4 2900 1 1 29 TYR HH H 5.658 -7.059 -10.564 1.00 . A A . 29 TYR HH 1 1 4 2901 1 1 29 TYR N N 7.306 -5.370 -4.084 1.00 . A A . 29 TYR N 1 1 4 2902 1 1 29 TYR O O 4.607 -4.295 -4.851 1.00 . A A . 29 TYR O 1 1 4 2903 1 1 29 TYR OH O 5.742 -7.484 -9.698 1.00 . A A . 29 TYR OH 1 1 4 2904 1 1 30 ALA C C 3.659 -1.886 -1.637 1.00 . A A . 30 ALA C 1 1 4 2905 1 1 30 ALA CA C 3.778 -3.064 -2.570 1.00 . A A . 30 ALA CA 1 1 4 2906 1 1 30 ALA CB C 3.238 -4.324 -1.903 1.00 . A A . 30 ALA CB 1 1 4 2907 1 1 30 ALA H H 5.863 -2.948 -2.362 1.00 . A A . 30 ALA H 1 1 4 2908 1 1 30 ALA HA H 3.192 -2.873 -3.458 1.00 . A A . 30 ALA HA 1 1 4 2909 1 1 30 ALA HB1 H 3.309 -5.153 -2.591 1.00 . A A . 30 ALA HB1 1 1 4 2910 1 1 30 ALA HB2 H 3.825 -4.539 -1.020 1.00 . A A . 30 ALA HB2 1 1 4 2911 1 1 30 ALA HB3 H 2.207 -4.171 -1.622 1.00 . A A . 30 ALA HB3 1 1 4 2912 1 1 30 ALA N N 5.149 -3.247 -2.963 1.00 . A A . 30 ALA N 1 1 4 2913 1 1 30 ALA O O 4.622 -1.494 -0.966 1.00 . A A . 30 ALA O 1 1 4 2914 1 1 31 CYS C C 0.819 -0.496 -0.132 1.00 . A A . 31 CYS C 1 1 4 2915 1 1 31 CYS CA C 2.186 -0.243 -0.712 1.00 . A A . 31 CYS CA 1 1 4 2916 1 1 31 CYS CB C 2.237 1.097 -1.445 1.00 . A A . 31 CYS CB 1 1 4 2917 1 1 31 CYS H H 1.775 -1.664 -2.188 1.00 . A A . 31 CYS H 1 1 4 2918 1 1 31 CYS HA H 2.916 -0.251 0.084 1.00 . A A . 31 CYS HA 1 1 4 2919 1 1 31 CYS HB2 H 3.149 1.149 -2.024 1.00 . A A . 31 CYS HB2 1 1 4 2920 1 1 31 CYS HB3 H 1.390 1.168 -2.111 1.00 . A A . 31 CYS HB3 1 1 4 2921 1 1 31 CYS N N 2.483 -1.324 -1.604 1.00 . A A . 31 CYS N 1 1 4 2922 1 1 31 CYS O O -0.117 -0.849 -0.850 1.00 . A A . 31 CYS O 1 1 4 2923 1 1 31 CYS SG S 2.199 2.547 -0.344 1.00 . A A . 31 CYS SG 1 1 4 2924 1 1 32 ASN C C -1.134 0.630 2.302 1.00 . A A . 32 ASN C 1 1 4 2925 1 1 32 ASN CA C -0.533 -0.660 1.821 1.00 . A A . 32 ASN CA 1 1 4 2926 1 1 32 ASN CB C -0.300 -1.631 2.978 1.00 . A A . 32 ASN CB 1 1 4 2927 1 1 32 ASN CG C -1.593 -2.095 3.621 1.00 . A A . 32 ASN CG 1 1 4 2928 1 1 32 ASN H H 1.435 0.027 1.677 1.00 . A A . 32 ASN H 1 1 4 2929 1 1 32 ASN HA H -1.197 -1.110 1.098 1.00 . A A . 32 ASN HA 1 1 4 2930 1 1 32 ASN HB2 H 0.225 -2.495 2.602 1.00 . A A . 32 ASN HB2 1 1 4 2931 1 1 32 ASN HB3 H 0.305 -1.149 3.732 1.00 . A A . 32 ASN HB3 1 1 4 2932 1 1 32 ASN HD21 H -0.686 -2.266 5.377 1.00 . A A . 32 ASN HD21 1 1 4 2933 1 1 32 ASN HD22 H -2.367 -2.665 5.356 1.00 . A A . 32 ASN HD22 1 1 4 2934 1 1 32 ASN N N 0.702 -0.352 1.164 1.00 . A A . 32 ASN N 1 1 4 2935 1 1 32 ASN ND2 N -1.544 -2.371 4.913 1.00 . A A . 32 ASN ND2 1 1 4 2936 1 1 32 ASN O O -0.735 1.191 3.310 1.00 . A A . 32 ASN O 1 1 4 2937 1 1 32 ASN OD1 O -2.626 -2.201 2.960 1.00 . A A . 32 ASN OD1 1 1 4 2938 1 1 33 CYS C C -3.841 2.123 2.830 1.00 . A A . 33 CYS C 1 1 4 2939 1 1 33 CYS CA C -2.718 2.341 1.814 1.00 . A A . 33 CYS CA 1 1 4 2940 1 1 33 CYS CB C -3.209 2.841 0.476 1.00 . A A . 33 CYS CB 1 1 4 2941 1 1 33 CYS H H -2.319 0.638 0.721 1.00 . A A . 33 CYS H 1 1 4 2942 1 1 33 CYS HA H -1.991 3.028 2.216 1.00 . A A . 33 CYS HA 1 1 4 2943 1 1 33 CYS HB2 H -2.413 2.711 -0.242 1.00 . A A . 33 CYS HB2 1 1 4 2944 1 1 33 CYS HB3 H -4.041 2.238 0.172 1.00 . A A . 33 CYS HB3 1 1 4 2945 1 1 33 CYS N N -2.074 1.108 1.538 1.00 . A A . 33 CYS N 1 1 4 2946 1 1 33 CYS O O -3.629 1.485 3.860 1.00 . A A . 33 CYS O 1 1 4 2947 1 1 33 CYS SG S -3.699 4.576 0.398 1.00 . A A . 33 CYS SG 1 1 4 2948 1 1 34 VAL C C -7.185 1.611 2.929 1.00 . A A . 34 VAL C 1 1 4 2949 1 1 34 VAL CA C -6.108 2.502 3.506 1.00 . A A . 34 VAL CA 1 1 4 2950 1 1 34 VAL CB C -6.681 3.898 3.858 1.00 . A A . 34 VAL CB 1 1 4 2951 1 1 34 VAL CG1 C -7.334 4.539 2.647 1.00 . A A . 34 VAL CG1 1 1 4 2952 1 1 34 VAL CG2 C -7.657 3.813 5.025 1.00 . A A . 34 VAL CG2 1 1 4 2953 1 1 34 VAL H H -5.209 2.987 1.659 1.00 . A A . 34 VAL H 1 1 4 2954 1 1 34 VAL HA H -5.716 2.051 4.406 1.00 . A A . 34 VAL HA 1 1 4 2955 1 1 34 VAL HB H -5.858 4.529 4.157 1.00 . A A . 34 VAL HB 1 1 4 2956 1 1 34 VAL HG11 H -8.133 3.905 2.291 1.00 . A A . 34 VAL HG11 1 1 4 2957 1 1 34 VAL HG12 H -7.736 5.503 2.922 1.00 . A A . 34 VAL HG12 1 1 4 2958 1 1 34 VAL HG13 H -6.599 4.665 1.868 1.00 . A A . 34 VAL HG13 1 1 4 2959 1 1 34 VAL HG21 H -7.145 3.425 5.894 1.00 . A A . 34 VAL HG21 1 1 4 2960 1 1 34 VAL HG22 H -8.042 4.798 5.244 1.00 . A A . 34 VAL HG22 1 1 4 2961 1 1 34 VAL HG23 H -8.473 3.156 4.767 1.00 . A A . 34 VAL HG23 1 1 4 2962 1 1 34 VAL N N -5.031 2.606 2.546 1.00 . A A . 34 VAL N 1 1 4 2963 1 1 34 VAL O O -7.282 1.475 1.707 1.00 . A A . 34 VAL O 1 1 4 2964 1 1 35 VAL C C -10.081 1.094 2.680 1.00 . A A . 35 VAL C 1 1 4 2965 1 1 35 VAL CA C -9.076 0.167 3.335 1.00 . A A . 35 VAL CA 1 1 4 2966 1 1 35 VAL CB C -9.722 -0.655 4.468 1.00 . A A . 35 VAL CB 1 1 4 2967 1 1 35 VAL CG1 C -9.852 0.161 5.745 1.00 . A A . 35 VAL CG1 1 1 4 2968 1 1 35 VAL CG2 C -11.078 -1.198 4.046 1.00 . A A . 35 VAL CG2 1 1 4 2969 1 1 35 VAL H H -7.704 0.951 4.745 1.00 . A A . 35 VAL H 1 1 4 2970 1 1 35 VAL HA H -8.718 -0.523 2.584 1.00 . A A . 35 VAL HA 1 1 4 2971 1 1 35 VAL HB H -9.078 -1.495 4.665 1.00 . A A . 35 VAL HB 1 1 4 2972 1 1 35 VAL HG11 H -8.875 0.501 6.057 1.00 . A A . 35 VAL HG11 1 1 4 2973 1 1 35 VAL HG12 H -10.488 1.015 5.562 1.00 . A A . 35 VAL HG12 1 1 4 2974 1 1 35 VAL HG13 H -10.287 -0.449 6.522 1.00 . A A . 35 VAL HG13 1 1 4 2975 1 1 35 VAL HG21 H -10.960 -1.832 3.179 1.00 . A A . 35 VAL HG21 1 1 4 2976 1 1 35 VAL HG22 H -11.503 -1.772 4.855 1.00 . A A . 35 VAL HG22 1 1 4 2977 1 1 35 VAL HG23 H -11.735 -0.377 3.803 1.00 . A A . 35 VAL HG23 1 1 4 2978 1 1 35 VAL N N -7.934 0.936 3.789 1.00 . A A . 35 VAL N 1 1 4 2979 1 1 35 VAL O O -10.929 1.705 3.333 1.00 . A A . 35 VAL O 1 1 4 2980 1 1 36 GLY C C -10.013 2.669 -0.554 1.00 . A A . 36 GLY C 1 1 4 2981 1 1 36 GLY CA C -10.759 2.120 0.627 1.00 . A A . 36 GLY CA 1 1 4 2982 1 1 36 GLY H H -9.186 0.747 0.932 1.00 . A A . 36 GLY H 1 1 4 2983 1 1 36 GLY HA2 H -11.622 1.571 0.279 1.00 . A A . 36 GLY HA2 1 1 4 2984 1 1 36 GLY HA3 H -11.081 2.935 1.257 1.00 . A A . 36 GLY HA3 1 1 4 2985 1 1 36 GLY N N -9.918 1.237 1.385 1.00 . A A . 36 GLY N 1 1 4 2986 1 1 36 GLY O O -10.612 3.196 -1.491 1.00 . A A . 36 GLY O 1 1 4 2987 1 1 37 TYR C C -6.692 1.969 -1.798 1.00 . A A . 37 TYR C 1 1 4 2988 1 1 37 TYR CA C -7.873 2.916 -1.643 1.00 . A A . 37 TYR CA 1 1 4 2989 1 1 37 TYR CB C -7.322 4.340 -1.485 1.00 . A A . 37 TYR CB 1 1 4 2990 1 1 37 TYR CD1 C -8.877 6.079 -2.450 1.00 . A A . 37 TYR CD1 1 1 4 2991 1 1 37 TYR CD2 C -8.833 5.803 -0.084 1.00 . A A . 37 TYR CD2 1 1 4 2992 1 1 37 TYR CE1 C -9.840 7.058 -2.325 1.00 . A A . 37 TYR CE1 1 1 4 2993 1 1 37 TYR CE2 C -9.798 6.786 0.050 1.00 . A A . 37 TYR CE2 1 1 4 2994 1 1 37 TYR CG C -8.359 5.433 -1.336 1.00 . A A . 37 TYR CG 1 1 4 2995 1 1 37 TYR CZ C -10.230 7.469 -1.044 1.00 . A A . 37 TYR CZ 1 1 4 2996 1 1 37 TYR H H -8.257 2.156 0.293 1.00 . A A . 37 TYR H 1 1 4 2997 1 1 37 TYR HA H -8.489 2.867 -2.533 1.00 . A A . 37 TYR HA 1 1 4 2998 1 1 37 TYR HB2 H -6.692 4.371 -0.610 1.00 . A A . 37 TYR HB2 1 1 4 2999 1 1 37 TYR HB3 H -6.725 4.576 -2.352 1.00 . A A . 37 TYR HB3 1 1 4 3000 1 1 37 TYR HD1 H -8.520 5.801 -3.431 1.00 . A A . 37 TYR HD1 1 1 4 3001 1 1 37 TYR HD2 H -8.440 5.315 0.793 1.00 . A A . 37 TYR HD2 1 1 4 3002 1 1 37 TYR HE1 H -10.229 7.546 -3.206 1.00 . A A . 37 TYR HE1 1 1 4 3003 1 1 37 TYR HE2 H -10.155 7.062 1.032 1.00 . A A . 37 TYR HE2 1 1 4 3004 1 1 37 TYR HH H -11.105 8.900 -0.148 1.00 . A A . 37 TYR HH 1 1 4 3005 1 1 37 TYR N N -8.690 2.534 -0.514 1.00 . A A . 37 TYR N 1 1 4 3006 1 1 37 TYR O O -5.725 2.044 -1.038 1.00 . A A . 37 TYR O 1 1 4 3007 1 1 37 TYR OH O -11.266 8.380 -0.953 1.00 . A A . 37 TYR OH 1 1 4 3008 1 1 38 ILE C C -5.673 0.060 -4.706 1.00 . A A . 38 ILE C 1 1 4 3009 1 1 38 ILE CA C -5.583 0.377 -3.218 1.00 . A A . 38 ILE CA 1 1 4 3010 1 1 38 ILE CB C -5.251 -0.890 -2.404 1.00 . A A . 38 ILE CB 1 1 4 3011 1 1 38 ILE CD1 C -3.152 -2.352 -2.132 1.00 . A A . 38 ILE CD1 1 1 4 3012 1 1 38 ILE CG1 C -3.731 -0.959 -2.264 1.00 . A A . 38 ILE CG1 1 1 4 3013 1 1 38 ILE CG2 C -5.827 -2.153 -3.033 1.00 . A A . 38 ILE CG2 1 1 4 3014 1 1 38 ILE H H -7.649 0.827 -3.134 1.00 . A A . 38 ILE H 1 1 4 3015 1 1 38 ILE HA H -4.762 1.068 -3.084 1.00 . A A . 38 ILE HA 1 1 4 3016 1 1 38 ILE HB H -5.684 -0.782 -1.422 1.00 . A A . 38 ILE HB 1 1 4 3017 1 1 38 ILE HD11 H -3.402 -2.929 -3.010 1.00 . A A . 38 ILE HD11 1 1 4 3018 1 1 38 ILE HD12 H -2.078 -2.289 -2.038 1.00 . A A . 38 ILE HD12 1 1 4 3019 1 1 38 ILE HD13 H -3.564 -2.833 -1.257 1.00 . A A . 38 ILE HD13 1 1 4 3020 1 1 38 ILE HG12 H -3.276 -0.496 -3.126 1.00 . A A . 38 ILE HG12 1 1 4 3021 1 1 38 ILE HG13 H -3.463 -0.399 -1.377 1.00 . A A . 38 ILE HG13 1 1 4 3022 1 1 38 ILE HG21 H -5.427 -2.273 -4.029 1.00 . A A . 38 ILE HG21 1 1 4 3023 1 1 38 ILE HG22 H -5.561 -3.011 -2.432 1.00 . A A . 38 ILE HG22 1 1 4 3024 1 1 38 ILE HG23 H -6.903 -2.072 -3.085 1.00 . A A . 38 ILE HG23 1 1 4 3025 1 1 38 ILE N N -6.770 1.064 -2.758 1.00 . A A . 38 ILE N 1 1 4 3026 1 1 38 ILE O O -6.649 -0.472 -5.195 1.00 . A A . 38 ILE O 1 1 4 3027 1 1 39 GLY C C -3.222 0.323 -7.322 1.00 . A A . 39 GLY C 1 1 4 3028 1 1 39 GLY CA C -4.627 0.205 -6.847 1.00 . A A . 39 GLY CA 1 1 4 3029 1 1 39 GLY H H -3.919 0.914 -4.997 1.00 . A A . 39 GLY H 1 1 4 3030 1 1 39 GLY HA2 H -4.995 -0.792 -7.048 1.00 . A A . 39 GLY HA2 1 1 4 3031 1 1 39 GLY HA3 H -5.241 0.930 -7.358 1.00 . A A . 39 GLY HA3 1 1 4 3032 1 1 39 GLY N N -4.666 0.456 -5.428 1.00 . A A . 39 GLY N 1 1 4 3033 1 1 39 GLY O O -2.696 1.437 -7.399 1.00 . A A . 39 GLY O 1 1 4 3034 1 1 40 GLU C C -0.423 -0.696 -6.527 1.00 . A A . 40 GLU C 1 1 4 3035 1 1 40 GLU CA C -1.177 -0.925 -7.826 1.00 . A A . 40 GLU CA 1 1 4 3036 1 1 40 GLU CB C -0.738 0.085 -8.890 1.00 . A A . 40 GLU CB 1 1 4 3037 1 1 40 GLU CD C 1.008 -1.345 -10.001 1.00 . A A . 40 GLU CD 1 1 4 3038 1 1 40 GLU CG C 0.722 -0.043 -9.279 1.00 . A A . 40 GLU CG 1 1 4 3039 1 1 40 GLU H H -3.121 -1.658 -7.513 1.00 . A A . 40 GLU H 1 1 4 3040 1 1 40 GLU HA H -0.976 -1.920 -8.170 1.00 . A A . 40 GLU HA 1 1 4 3041 1 1 40 GLU HB2 H -1.342 -0.059 -9.776 1.00 . A A . 40 GLU HB2 1 1 4 3042 1 1 40 GLU HB3 H -0.909 1.082 -8.505 1.00 . A A . 40 GLU HB3 1 1 4 3043 1 1 40 GLU HG2 H 0.985 0.781 -9.928 1.00 . A A . 40 GLU HG2 1 1 4 3044 1 1 40 GLU HG3 H 1.325 -0.003 -8.380 1.00 . A A . 40 GLU HG3 1 1 4 3045 1 1 40 GLU N N -2.602 -0.827 -7.556 1.00 . A A . 40 GLU N 1 1 4 3046 1 1 40 GLU O O 0.425 -1.485 -6.115 1.00 . A A . 40 GLU O 1 1 4 3047 1 1 40 GLU OE1 O 1.051 -2.402 -9.335 1.00 . A A . 40 GLU OE1 1 1 4 3048 1 1 40 GLU OE2 O 1.198 -1.322 -11.233 1.00 . A A . 40 GLU OE2 1 1 4 3049 1 1 41 ARG C C -1.196 1.412 -3.658 1.00 . A A . 41 ARG C 1 1 4 3050 1 1 41 ARG CA C -0.185 0.758 -4.616 1.00 . A A . 41 ARG CA 1 1 4 3051 1 1 41 ARG CB C 1.031 1.655 -4.900 1.00 . A A . 41 ARG CB 1 1 4 3052 1 1 41 ARG CD C -0.019 3.922 -5.399 1.00 . A A . 41 ARG CD 1 1 4 3053 1 1 41 ARG CG C 0.768 2.738 -5.952 1.00 . A A . 41 ARG CG 1 1 4 3054 1 1 41 ARG CZ C -0.406 5.945 -6.794 1.00 . A A . 41 ARG CZ 1 1 4 3055 1 1 41 ARG H H -1.444 0.968 -6.285 1.00 . A A . 41 ARG H 1 1 4 3056 1 1 41 ARG HA H 0.158 -0.148 -4.153 1.00 . A A . 41 ARG HA 1 1 4 3057 1 1 41 ARG HB2 H 1.341 2.135 -3.982 1.00 . A A . 41 ARG HB2 1 1 4 3058 1 1 41 ARG HB3 H 1.841 1.018 -5.265 1.00 . A A . 41 ARG HB3 1 1 4 3059 1 1 41 ARG HD2 H -0.765 3.549 -4.708 1.00 . A A . 41 ARG HD2 1 1 4 3060 1 1 41 ARG HD3 H 0.658 4.577 -4.873 1.00 . A A . 41 ARG HD3 1 1 4 3061 1 1 41 ARG HE H -1.438 4.235 -6.927 1.00 . A A . 41 ARG HE 1 1 4 3062 1 1 41 ARG HG2 H 1.715 3.099 -6.319 1.00 . A A . 41 ARG HG2 1 1 4 3063 1 1 41 ARG HG3 H 0.211 2.299 -6.769 1.00 . A A . 41 ARG HG3 1 1 4 3064 1 1 41 ARG HH11 H 1.182 6.112 -5.540 1.00 . A A . 41 ARG HH11 1 1 4 3065 1 1 41 ARG HH12 H 0.833 7.523 -6.492 1.00 . A A . 41 ARG HH12 1 1 4 3066 1 1 41 ARG HH21 H -1.909 6.103 -8.149 1.00 . A A . 41 ARG HH21 1 1 4 3067 1 1 41 ARG HH22 H -0.929 7.532 -7.955 1.00 . A A . 41 ARG HH22 1 1 4 3068 1 1 41 ARG N N -0.778 0.389 -5.877 1.00 . A A . 41 ARG N 1 1 4 3069 1 1 41 ARG NE N -0.698 4.684 -6.458 1.00 . A A . 41 ARG NE 1 1 4 3070 1 1 41 ARG NH1 N 0.614 6.574 -6.230 1.00 . A A . 41 ARG NH1 1 1 4 3071 1 1 41 ARG NH2 N -1.136 6.573 -7.707 1.00 . A A . 41 ARG NH2 1 1 4 3072 1 1 41 ARG O O -1.051 1.303 -2.445 1.00 . A A . 41 ARG O 1 1 4 3073 1 1 42 CYS C C -4.086 3.667 -4.279 1.00 . A A . 42 CYS C 1 1 4 3074 1 1 42 CYS CA C -3.251 2.754 -3.405 1.00 . A A . 42 CYS CA 1 1 4 3075 1 1 42 CYS CB C -2.613 3.635 -2.311 1.00 . A A . 42 CYS CB 1 1 4 3076 1 1 42 CYS H H -2.335 2.050 -5.176 1.00 . A A . 42 CYS H 1 1 4 3077 1 1 42 CYS HA H -3.892 2.019 -2.943 1.00 . A A . 42 CYS HA 1 1 4 3078 1 1 42 CYS HB2 H -2.275 3.004 -1.502 1.00 . A A . 42 CYS HB2 1 1 4 3079 1 1 42 CYS HB3 H -1.765 4.155 -2.731 1.00 . A A . 42 CYS HB3 1 1 4 3080 1 1 42 CYS N N -2.237 2.049 -4.207 1.00 . A A . 42 CYS N 1 1 4 3081 1 1 42 CYS O O -3.585 4.709 -4.677 1.00 . A A . 42 CYS O 1 1 4 3082 1 1 42 CYS SG S -3.747 4.896 -1.602 1.00 . A A . 42 CYS SG 1 1 4 3083 1 1 43 GLN C C -7.623 3.551 -5.573 1.00 . A A . 43 GLN C 1 1 4 3084 1 1 43 GLN CA C -6.336 4.214 -5.093 1.00 . A A . 43 GLN CA 1 1 4 3085 1 1 43 GLN CB C -5.781 5.107 -6.201 1.00 . A A . 43 GLN CB 1 1 4 3086 1 1 43 GLN CD C -4.604 5.223 -8.434 1.00 . A A . 43 GLN CD 1 1 4 3087 1 1 43 GLN CG C -5.366 4.352 -7.454 1.00 . A A . 43 GLN CG 1 1 4 3088 1 1 43 GLN H H -5.534 2.282 -4.613 1.00 . A A . 43 GLN H 1 1 4 3089 1 1 43 GLN HA H -6.584 4.842 -4.250 1.00 . A A . 43 GLN HA 1 1 4 3090 1 1 43 GLN HB2 H -6.533 5.833 -6.473 1.00 . A A . 43 GLN HB2 1 1 4 3091 1 1 43 GLN HB3 H -4.916 5.623 -5.805 1.00 . A A . 43 GLN HB3 1 1 4 3092 1 1 43 GLN HE21 H -6.298 5.834 -9.269 1.00 . A A . 43 GLN HE21 1 1 4 3093 1 1 43 GLN HE22 H -4.846 6.500 -9.936 1.00 . A A . 43 GLN HE22 1 1 4 3094 1 1 43 GLN HG2 H -4.737 3.523 -7.168 1.00 . A A . 43 GLN HG2 1 1 4 3095 1 1 43 GLN HG3 H -6.254 3.976 -7.943 1.00 . A A . 43 GLN HG3 1 1 4 3096 1 1 43 GLN N N -5.322 3.252 -4.623 1.00 . A A . 43 GLN N 1 1 4 3097 1 1 43 GLN NE2 N -5.323 5.918 -9.302 1.00 . A A . 43 GLN NE2 1 1 4 3098 1 1 43 GLN O O -8.424 4.187 -6.258 1.00 . A A . 43 GLN O 1 1 4 3099 1 1 43 GLN OE1 O -3.375 5.275 -8.401 1.00 . A A . 43 GLN OE1 1 1 4 3100 1 1 44 TYR C C -9.556 0.627 -4.625 1.00 . A A . 44 TYR C 1 1 4 3101 1 1 44 TYR CA C -9.028 1.589 -5.670 1.00 . A A . 44 TYR CA 1 1 4 3102 1 1 44 TYR CB C -8.738 0.823 -6.969 1.00 . A A . 44 TYR CB 1 1 4 3103 1 1 44 TYR CD1 C -9.636 2.350 -8.762 1.00 . A A . 44 TYR CD1 1 1 4 3104 1 1 44 TYR CD2 C -7.305 1.860 -8.769 1.00 . A A . 44 TYR CD2 1 1 4 3105 1 1 44 TYR CE1 C -9.476 3.146 -9.878 1.00 . A A . 44 TYR CE1 1 1 4 3106 1 1 44 TYR CE2 C -7.137 2.654 -9.886 1.00 . A A . 44 TYR CE2 1 1 4 3107 1 1 44 TYR CG C -8.557 1.689 -8.193 1.00 . A A . 44 TYR CG 1 1 4 3108 1 1 44 TYR CZ C -8.222 3.266 -10.457 1.00 . A A . 44 TYR CZ 1 1 4 3109 1 1 44 TYR H H -7.201 1.830 -4.634 1.00 . A A . 44 TYR H 1 1 4 3110 1 1 44 TYR HA H -9.800 2.317 -5.859 1.00 . A A . 44 TYR HA 1 1 4 3111 1 1 44 TYR HB2 H -7.832 0.253 -6.837 1.00 . A A . 44 TYR HB2 1 1 4 3112 1 1 44 TYR HB3 H -9.553 0.143 -7.162 1.00 . A A . 44 TYR HB3 1 1 4 3113 1 1 44 TYR HD1 H -10.615 2.228 -8.325 1.00 . A A . 44 TYR HD1 1 1 4 3114 1 1 44 TYR HD2 H -6.456 1.354 -8.337 1.00 . A A . 44 TYR HD2 1 1 4 3115 1 1 44 TYR HE1 H -10.329 3.654 -10.305 1.00 . A A . 44 TYR HE1 1 1 4 3116 1 1 44 TYR HE2 H -6.157 2.775 -10.322 1.00 . A A . 44 TYR HE2 1 1 4 3117 1 1 44 TYR HH H -7.370 3.720 -12.109 1.00 . A A . 44 TYR HH 1 1 4 3118 1 1 44 TYR N N -7.839 2.294 -5.216 1.00 . A A . 44 TYR N 1 1 4 3119 1 1 44 TYR O O -8.888 -0.319 -4.227 1.00 . A A . 44 TYR O 1 1 4 3120 1 1 44 TYR OH O -8.062 4.095 -11.544 1.00 . A A . 44 TYR OH 1 1 4 3121 1 1 45 ARG C C -11.005 -0.362 -2.032 1.00 . A A . 45 ARG C 1 1 4 3122 1 1 45 ARG CA C -11.530 -0.103 -3.439 1.00 . A A . 45 ARG CA 1 1 4 3123 1 1 45 ARG CB C -11.527 -1.424 -4.213 1.00 . A A . 45 ARG CB 1 1 4 3124 1 1 45 ARG CD C -11.389 -1.084 -6.705 1.00 . A A . 45 ARG CD 1 1 4 3125 1 1 45 ARG CG C -12.297 -1.396 -5.526 1.00 . A A . 45 ARG CG 1 1 4 3126 1 1 45 ARG CZ C -9.988 -2.582 -8.085 1.00 . A A . 45 ARG CZ 1 1 4 3127 1 1 45 ARG H H -11.145 1.788 -4.312 1.00 . A A . 45 ARG H 1 1 4 3128 1 1 45 ARG HA H -12.541 0.255 -3.368 1.00 . A A . 45 ARG HA 1 1 4 3129 1 1 45 ARG HB2 H -10.488 -1.666 -4.438 1.00 . A A . 45 ARG HB2 1 1 4 3130 1 1 45 ARG HB3 H -11.943 -2.200 -3.585 1.00 . A A . 45 ARG HB3 1 1 4 3131 1 1 45 ARG HD2 H -11.989 -1.012 -7.599 1.00 . A A . 45 ARG HD2 1 1 4 3132 1 1 45 ARG HD3 H -10.892 -0.134 -6.521 1.00 . A A . 45 ARG HD3 1 1 4 3133 1 1 45 ARG HE H -9.924 -2.460 -6.087 1.00 . A A . 45 ARG HE 1 1 4 3134 1 1 45 ARG HG2 H -12.752 -2.362 -5.685 1.00 . A A . 45 ARG HG2 1 1 4 3135 1 1 45 ARG HG3 H -13.066 -0.641 -5.466 1.00 . A A . 45 ARG HG3 1 1 4 3136 1 1 45 ARG HH11 H -11.341 -1.491 -9.138 1.00 . A A . 45 ARG HH11 1 1 4 3137 1 1 45 ARG HH12 H -10.318 -2.525 -10.091 1.00 . A A . 45 ARG HH12 1 1 4 3138 1 1 45 ARG HH21 H -8.560 -3.813 -7.336 1.00 . A A . 45 ARG HH21 1 1 4 3139 1 1 45 ARG HH22 H -8.718 -3.833 -9.066 1.00 . A A . 45 ARG HH22 1 1 4 3140 1 1 45 ARG N N -10.762 0.889 -4.168 1.00 . A A . 45 ARG N 1 1 4 3141 1 1 45 ARG NE N -10.366 -2.115 -6.894 1.00 . A A . 45 ARG NE 1 1 4 3142 1 1 45 ARG NH1 N -10.596 -2.162 -9.190 1.00 . A A . 45 ARG NH1 1 1 4 3143 1 1 45 ARG NH2 N -9.013 -3.481 -8.167 1.00 . A A . 45 ARG NH2 1 1 4 3144 1 1 45 ARG O O -9.891 0.012 -1.662 1.00 . A A . 45 ARG O 1 1 4 3145 1 1 46 ASP C C -10.882 -2.779 0.151 1.00 . A A . 46 ASP C 1 1 4 3146 1 1 46 ASP CA C -11.532 -1.411 0.108 1.00 . A A . 46 ASP CA 1 1 4 3147 1 1 46 ASP CB C -12.818 -1.437 0.951 1.00 . A A . 46 ASP CB 1 1 4 3148 1 1 46 ASP CG C -13.620 -0.148 0.899 1.00 . A A . 46 ASP CG 1 1 4 3149 1 1 46 ASP H H -12.658 -1.391 -1.680 1.00 . A A . 46 ASP H 1 1 4 3150 1 1 46 ASP HA H -10.850 -0.683 0.510 1.00 . A A . 46 ASP HA 1 1 4 3151 1 1 46 ASP HB2 H -13.450 -2.237 0.601 1.00 . A A . 46 ASP HB2 1 1 4 3152 1 1 46 ASP HB3 H -12.550 -1.629 1.982 1.00 . A A . 46 ASP HB3 1 1 4 3153 1 1 46 ASP N N -11.825 -1.067 -1.278 1.00 . A A . 46 ASP N 1 1 4 3154 1 1 46 ASP O O -10.997 -3.498 1.143 1.00 . A A . 46 ASP O 1 1 4 3155 1 1 46 ASP OD1 O -13.351 0.762 1.711 1.00 . A A . 46 ASP OD1 1 1 4 3156 1 1 46 ASP OD2 O -14.545 -0.050 0.070 1.00 . A A . 46 ASP OD2 1 1 4 3157 1 1 47 LEU C C -8.969 -5.052 0.026 1.00 . A A . 47 LEU C 1 1 4 3158 1 1 47 LEU CA C -9.674 -4.457 -1.183 1.00 . A A . 47 LEU CA 1 1 4 3159 1 1 47 LEU CB C -8.717 -4.454 -2.377 1.00 . A A . 47 LEU CB 1 1 4 3160 1 1 47 LEU CD1 C -8.283 -4.057 -4.816 1.00 . A A . 47 LEU CD1 1 1 4 3161 1 1 47 LEU CD2 C -10.539 -4.800 -4.071 1.00 . A A . 47 LEU CD2 1 1 4 3162 1 1 47 LEU CG C -9.317 -3.978 -3.702 1.00 . A A . 47 LEU CG 1 1 4 3163 1 1 47 LEU H H -9.996 -2.408 -1.595 1.00 . A A . 47 LEU H 1 1 4 3164 1 1 47 LEU HA H -10.517 -5.081 -1.424 1.00 . A A . 47 LEU HA 1 1 4 3165 1 1 47 LEU HB2 H -7.875 -3.820 -2.137 1.00 . A A . 47 LEU HB2 1 1 4 3166 1 1 47 LEU HB3 H -8.354 -5.463 -2.515 1.00 . A A . 47 LEU HB3 1 1 4 3167 1 1 47 LEU HD11 H -7.978 -5.084 -4.952 1.00 . A A . 47 LEU HD11 1 1 4 3168 1 1 47 LEU HD12 H -8.714 -3.687 -5.735 1.00 . A A . 47 LEU HD12 1 1 4 3169 1 1 47 LEU HD13 H -7.424 -3.458 -4.553 1.00 . A A . 47 LEU HD13 1 1 4 3170 1 1 47 LEU HD21 H -10.268 -5.843 -4.131 1.00 . A A . 47 LEU HD21 1 1 4 3171 1 1 47 LEU HD22 H -11.302 -4.670 -3.317 1.00 . A A . 47 LEU HD22 1 1 4 3172 1 1 47 LEU HD23 H -10.918 -4.472 -5.028 1.00 . A A . 47 LEU HD23 1 1 4 3173 1 1 47 LEU HG H -9.623 -2.947 -3.603 1.00 . A A . 47 LEU HG 1 1 4 3174 1 1 47 LEU N N -10.181 -3.108 -0.933 1.00 . A A . 47 LEU N 1 1 4 3175 1 1 47 LEU O O -9.254 -6.178 0.420 1.00 . A A . 47 LEU O 1 1 4 3176 1 1 48 LYS C C -7.946 -5.360 2.873 1.00 . A A . 48 LYS C 1 1 4 3177 1 1 48 LYS CA C -7.200 -4.794 1.671 1.00 . A A . 48 LYS CA 1 1 4 3178 1 1 48 LYS CB C -6.223 -3.715 2.110 1.00 . A A . 48 LYS CB 1 1 4 3179 1 1 48 LYS CD C -5.771 -1.293 2.493 1.00 . A A . 48 LYS CD 1 1 4 3180 1 1 48 LYS CE C -4.921 -0.918 1.283 1.00 . A A . 48 LYS CE 1 1 4 3181 1 1 48 LYS CG C -6.826 -2.325 2.159 1.00 . A A . 48 LYS CG 1 1 4 3182 1 1 48 LYS H H -8.052 -3.328 0.397 1.00 . A A . 48 LYS H 1 1 4 3183 1 1 48 LYS HA H -6.631 -5.593 1.228 1.00 . A A . 48 LYS HA 1 1 4 3184 1 1 48 LYS HB2 H -5.855 -3.958 3.094 1.00 . A A . 48 LYS HB2 1 1 4 3185 1 1 48 LYS HB3 H -5.391 -3.698 1.420 1.00 . A A . 48 LYS HB3 1 1 4 3186 1 1 48 LYS HD2 H -6.253 -0.405 2.872 1.00 . A A . 48 LYS HD2 1 1 4 3187 1 1 48 LYS HD3 H -5.127 -1.711 3.253 1.00 . A A . 48 LYS HD3 1 1 4 3188 1 1 48 LYS HE2 H -5.566 -0.532 0.497 1.00 . A A . 48 LYS HE2 1 1 4 3189 1 1 48 LYS HE3 H -4.229 -0.143 1.581 1.00 . A A . 48 LYS HE3 1 1 4 3190 1 1 48 LYS HG2 H -7.251 -2.095 1.194 1.00 . A A . 48 LYS HG2 1 1 4 3191 1 1 48 LYS HG3 H -7.601 -2.300 2.911 1.00 . A A . 48 LYS HG3 1 1 4 3192 1 1 48 LYS HZ1 H -3.563 -2.488 1.527 1.00 . A A . 48 LYS HZ1 1 1 4 3193 1 1 48 LYS HZ2 H -3.521 -1.779 -0.008 1.00 . A A . 48 LYS HZ2 1 1 4 3194 1 1 48 LYS HZ3 H -4.791 -2.818 0.401 1.00 . A A . 48 LYS HZ3 1 1 4 3195 1 1 48 LYS N N -8.091 -4.276 0.636 1.00 . A A . 48 LYS N 1 1 4 3196 1 1 48 LYS NZ N -4.145 -2.079 0.764 1.00 . A A . 48 LYS NZ 1 1 4 3197 1 1 48 LYS O O -7.752 -6.513 3.241 1.00 . A A . 48 LYS O 1 1 4 3198 1 1 49 TRP C C -10.876 -5.477 4.408 1.00 . A A . 49 TRP C 1 1 4 3199 1 1 49 TRP CA C -9.466 -4.972 4.701 1.00 . A A . 49 TRP CA 1 1 4 3200 1 1 49 TRP CB C -9.502 -3.817 5.707 1.00 . A A . 49 TRP CB 1 1 4 3201 1 1 49 TRP CD1 C -9.452 -4.919 8.021 1.00 . A A . 49 TRP CD1 1 1 4 3202 1 1 49 TRP CD2 C -11.366 -3.851 7.559 1.00 . A A . 49 TRP CD2 1 1 4 3203 1 1 49 TRP CE2 C -11.463 -4.411 8.847 1.00 . A A . 49 TRP CE2 1 1 4 3204 1 1 49 TRP CE3 C -12.455 -3.134 7.056 1.00 . A A . 49 TRP CE3 1 1 4 3205 1 1 49 TRP CG C -10.070 -4.191 7.045 1.00 . A A . 49 TRP CG 1 1 4 3206 1 1 49 TRP CH2 C -13.648 -3.562 9.121 1.00 . A A . 49 TRP CH2 1 1 4 3207 1 1 49 TRP CZ2 C -12.600 -4.268 9.639 1.00 . A A . 49 TRP CZ2 1 1 4 3208 1 1 49 TRP CZ3 C -13.582 -2.993 7.842 1.00 . A A . 49 TRP CZ3 1 1 4 3209 1 1 49 TRP H H -8.948 -3.663 3.131 1.00 . A A . 49 TRP H 1 1 4 3210 1 1 49 TRP HA H -8.897 -5.783 5.130 1.00 . A A . 49 TRP HA 1 1 4 3211 1 1 49 TRP HB2 H -8.495 -3.460 5.866 1.00 . A A . 49 TRP HB2 1 1 4 3212 1 1 49 TRP HB3 H -10.101 -3.014 5.301 1.00 . A A . 49 TRP HB3 1 1 4 3213 1 1 49 TRP HD1 H -8.455 -5.325 7.939 1.00 . A A . 49 TRP HD1 1 1 4 3214 1 1 49 TRP HE1 H -10.064 -5.538 9.941 1.00 . A A . 49 TRP HE1 1 1 4 3215 1 1 49 TRP HE3 H -12.424 -2.687 6.070 1.00 . A A . 49 TRP HE3 1 1 4 3216 1 1 49 TRP HH2 H -14.550 -3.430 9.700 1.00 . A A . 49 TRP HH2 1 1 4 3217 1 1 49 TRP HZ2 H -12.666 -4.700 10.630 1.00 . A A . 49 TRP HZ2 1 1 4 3218 1 1 49 TRP HZ3 H -14.435 -2.443 7.469 1.00 . A A . 49 TRP HZ3 1 1 4 3219 1 1 49 TRP N N -8.783 -4.551 3.492 1.00 . A A . 49 TRP N 1 1 4 3220 1 1 49 TRP NE1 N -10.282 -5.056 9.106 1.00 . A A . 49 TRP NE1 1 1 4 3221 1 1 49 TRP O O -11.263 -6.555 4.852 1.00 . A A . 49 TRP O 1 1 4 3222 1 1 50 TRP C C -13.464 -5.744 2.322 1.00 . A A . 50 TRP C 1 1 4 3223 1 1 50 TRP CA C -13.075 -4.940 3.559 1.00 . A A . 50 TRP CA 1 1 4 3224 1 1 50 TRP CB C -13.833 -3.614 3.592 1.00 . A A . 50 TRP CB 1 1 4 3225 1 1 50 TRP CD1 C -15.738 -4.337 5.125 1.00 . A A . 50 TRP CD1 1 1 4 3226 1 1 50 TRP CD2 C -16.415 -3.337 3.244 1.00 . A A . 50 TRP CD2 1 1 4 3227 1 1 50 TRP CE2 C -17.550 -3.690 3.998 1.00 . A A . 50 TRP CE2 1 1 4 3228 1 1 50 TRP CE3 C -16.593 -2.690 2.021 1.00 . A A . 50 TRP CE3 1 1 4 3229 1 1 50 TRP CG C -15.267 -3.766 3.982 1.00 . A A . 50 TRP CG 1 1 4 3230 1 1 50 TRP CH2 C -18.989 -2.784 2.363 1.00 . A A . 50 TRP CH2 1 1 4 3231 1 1 50 TRP CZ2 C -18.844 -3.416 3.566 1.00 . A A . 50 TRP CZ2 1 1 4 3232 1 1 50 TRP CZ3 C -17.877 -2.419 1.594 1.00 . A A . 50 TRP CZ3 1 1 4 3233 1 1 50 TRP H H -11.232 -3.985 3.117 1.00 . A A . 50 TRP H 1 1 4 3234 1 1 50 TRP HA H -13.360 -5.511 4.429 1.00 . A A . 50 TRP HA 1 1 4 3235 1 1 50 TRP HB2 H -13.360 -2.955 4.304 1.00 . A A . 50 TRP HB2 1 1 4 3236 1 1 50 TRP HB3 H -13.798 -3.161 2.610 1.00 . A A . 50 TRP HB3 1 1 4 3237 1 1 50 TRP HD1 H -15.111 -4.759 5.897 1.00 . A A . 50 TRP HD1 1 1 4 3238 1 1 50 TRP HE1 H -17.682 -4.656 5.863 1.00 . A A . 50 TRP HE1 1 1 4 3239 1 1 50 TRP HE3 H -15.748 -2.400 1.413 1.00 . A A . 50 TRP HE3 1 1 4 3240 1 1 50 TRP HH2 H -19.975 -2.552 1.988 1.00 . A A . 50 TRP HH2 1 1 4 3241 1 1 50 TRP HZ2 H -19.712 -3.690 4.147 1.00 . A A . 50 TRP HZ2 1 1 4 3242 1 1 50 TRP HZ3 H -18.035 -1.919 0.648 1.00 . A A . 50 TRP HZ3 1 1 4 3243 1 1 50 TRP N N -11.641 -4.703 3.650 1.00 . A A . 50 TRP N 1 1 4 3244 1 1 50 TRP NE1 N -17.109 -4.300 5.141 1.00 . A A . 50 TRP NE1 1 1 4 3245 1 1 50 TRP O O -14.153 -6.759 2.430 1.00 . A A . 50 TRP O 1 1 4 3246 1 1 51 GLU C C -12.983 -7.313 -0.262 1.00 . A A . 51 GLU C 1 1 4 3247 1 1 51 GLU CA C -13.460 -5.879 -0.111 1.00 . A A . 51 GLU CA 1 1 4 3248 1 1 51 GLU CB C -12.969 -5.047 -1.303 1.00 . A A . 51 GLU CB 1 1 4 3249 1 1 51 GLU CD C -15.201 -3.996 -1.796 1.00 . A A . 51 GLU CD 1 1 4 3250 1 1 51 GLU CG C -13.731 -3.761 -1.519 1.00 . A A . 51 GLU CG 1 1 4 3251 1 1 51 GLU H H -12.329 -4.592 1.136 1.00 . A A . 51 GLU H 1 1 4 3252 1 1 51 GLU HA H -14.539 -5.874 -0.103 1.00 . A A . 51 GLU HA 1 1 4 3253 1 1 51 GLU HB2 H -11.936 -4.779 -1.142 1.00 . A A . 51 GLU HB2 1 1 4 3254 1 1 51 GLU HB3 H -13.045 -5.642 -2.199 1.00 . A A . 51 GLU HB3 1 1 4 3255 1 1 51 GLU HG2 H -13.627 -3.152 -0.632 1.00 . A A . 51 GLU HG2 1 1 4 3256 1 1 51 GLU HG3 H -13.300 -3.240 -2.362 1.00 . A A . 51 GLU HG3 1 1 4 3257 1 1 51 GLU N N -13.008 -5.303 1.151 1.00 . A A . 51 GLU N 1 1 4 3258 1 1 51 GLU O O -13.766 -8.211 -0.569 1.00 . A A . 51 GLU O 1 1 4 3259 1 1 51 GLU OE1 O -15.525 -4.517 -2.884 1.00 . A A . 51 GLU OE1 1 1 4 3260 1 1 51 GLU OE2 O -16.034 -3.659 -0.936 1.00 . A A . 51 GLU OE2 1 1 4 3261 1 1 52 LEU C C -10.669 -9.431 1.081 1.00 . A A . 52 LEU C 1 1 4 3262 1 1 52 LEU CA C -11.103 -8.832 -0.238 1.00 . A A . 52 LEU CA 1 1 4 3263 1 1 52 LEU CB C -9.896 -8.715 -1.155 1.00 . A A . 52 LEU CB 1 1 4 3264 1 1 52 LEU CD1 C -8.872 -7.920 -3.288 1.00 . A A . 52 LEU CD1 1 1 4 3265 1 1 52 LEU CD2 C -11.288 -8.570 -3.233 1.00 . A A . 52 LEU CD2 1 1 4 3266 1 1 52 LEU CG C -10.140 -7.953 -2.446 1.00 . A A . 52 LEU CG 1 1 4 3267 1 1 52 LEU H H -11.130 -6.770 0.240 1.00 . A A . 52 LEU H 1 1 4 3268 1 1 52 LEU HA H -11.835 -9.473 -0.695 1.00 . A A . 52 LEU HA 1 1 4 3269 1 1 52 LEU HB2 H -9.120 -8.203 -0.605 1.00 . A A . 52 LEU HB2 1 1 4 3270 1 1 52 LEU HB3 H -9.551 -9.709 -1.401 1.00 . A A . 52 LEU HB3 1 1 4 3271 1 1 52 LEU HD11 H -8.082 -7.439 -2.728 1.00 . A A . 52 LEU HD11 1 1 4 3272 1 1 52 LEU HD12 H -8.576 -8.930 -3.532 1.00 . A A . 52 LEU HD12 1 1 4 3273 1 1 52 LEU HD13 H -9.057 -7.368 -4.197 1.00 . A A . 52 LEU HD13 1 1 4 3274 1 1 52 LEU HD21 H -12.191 -8.530 -2.641 1.00 . A A . 52 LEU HD21 1 1 4 3275 1 1 52 LEU HD22 H -11.432 -8.017 -4.150 1.00 . A A . 52 LEU HD22 1 1 4 3276 1 1 52 LEU HD23 H -11.053 -9.598 -3.466 1.00 . A A . 52 LEU HD23 1 1 4 3277 1 1 52 LEU HG H -10.411 -6.934 -2.192 1.00 . A A . 52 LEU HG 1 1 4 3278 1 1 52 LEU N N -11.699 -7.520 -0.045 1.00 . A A . 52 LEU N 1 1 4 3279 1 1 52 LEU O O -10.814 -10.632 1.300 1.00 . A A . 52 LEU O 1 1 4 3280 1 1 53 ARG C C -8.300 -9.854 2.970 1.00 . A A . 53 ARG C 1 1 4 3281 1 1 53 ARG CA C -9.539 -8.994 3.219 1.00 . A A . 53 ARG CA 1 1 4 3282 1 1 53 ARG CB C -10.547 -9.763 4.089 1.00 . A A . 53 ARG CB 1 1 4 3283 1 1 53 ARG CD C -10.979 -10.995 6.248 1.00 . A A . 53 ARG CD 1 1 4 3284 1 1 53 ARG CG C -10.016 -10.103 5.476 1.00 . A A . 53 ARG CG 1 1 4 3285 1 1 53 ARG CZ C -10.724 -12.432 8.251 1.00 . A A . 53 ARG CZ 1 1 4 3286 1 1 53 ARG H H -10.120 -7.622 1.701 1.00 . A A . 53 ARG H 1 1 4 3287 1 1 53 ARG HA H -9.236 -8.099 3.745 1.00 . A A . 53 ARG HA 1 1 4 3288 1 1 53 ARG HB2 H -11.437 -9.163 4.208 1.00 . A A . 53 ARG HB2 1 1 4 3289 1 1 53 ARG HB3 H -10.809 -10.685 3.592 1.00 . A A . 53 ARG HB3 1 1 4 3290 1 1 53 ARG HD2 H -11.925 -10.488 6.333 1.00 . A A . 53 ARG HD2 1 1 4 3291 1 1 53 ARG HD3 H -11.110 -11.917 5.703 1.00 . A A . 53 ARG HD3 1 1 4 3292 1 1 53 ARG HE H -9.908 -10.619 8.018 1.00 . A A . 53 ARG HE 1 1 4 3293 1 1 53 ARG HG2 H -9.071 -10.615 5.373 1.00 . A A . 53 ARG HG2 1 1 4 3294 1 1 53 ARG HG3 H -9.868 -9.185 6.027 1.00 . A A . 53 ARG HG3 1 1 4 3295 1 1 53 ARG HH11 H -11.917 -13.251 6.821 1.00 . A A . 53 ARG HH11 1 1 4 3296 1 1 53 ARG HH12 H -11.679 -14.225 8.246 1.00 . A A . 53 ARG HH12 1 1 4 3297 1 1 53 ARG HH21 H -9.600 -11.903 9.850 1.00 . A A . 53 ARG HH21 1 1 4 3298 1 1 53 ARG HH22 H -10.355 -13.468 9.956 1.00 . A A . 53 ARG HH22 1 1 4 3299 1 1 53 ARG N N -10.132 -8.577 1.941 1.00 . A A . 53 ARG N 1 1 4 3300 1 1 53 ARG NE N -10.478 -11.298 7.588 1.00 . A A . 53 ARG NE 1 1 4 3301 1 1 53 ARG NH1 N -11.500 -13.375 7.729 1.00 . A A . 53 ARG NH1 1 1 4 3302 1 1 53 ARG NH2 N -10.188 -12.615 9.448 1.00 . A A . 53 ARG NH2 1 1 4 3303 1 1 53 ARG O O -8.433 -11.089 2.878 1.00 . A A . 53 ARG O 1 1 4 3304 1 1 53 ARG OXT O -7.192 -9.290 2.852 1.00 . A A . 53 ARG OXT 1 1 5 3305 1 1 1 ASN C C 8.340 -6.792 3.310 1.00 . A A . 1 ASN C 1 1 5 3306 1 1 1 ASN CA C 7.458 -7.816 2.607 1.00 . A A . 1 ASN CA 1 1 5 3307 1 1 1 ASN CB C 6.767 -8.703 3.644 1.00 . A A . 1 ASN CB 1 1 5 3308 1 1 1 ASN CG C 5.564 -9.424 3.073 1.00 . A A . 1 ASN CG 1 1 5 3309 1 1 1 ASN H1 H 9.025 -9.120 2.171 1.00 . A A . 1 ASN H1 1 1 5 3310 1 1 1 ASN H2 H 8.642 -8.048 0.908 1.00 . A A . 1 ASN H2 1 1 5 3311 1 1 1 ASN H3 H 7.640 -9.373 1.229 1.00 . A A . 1 ASN H3 1 1 5 3312 1 1 1 ASN HA H 6.706 -7.287 2.041 1.00 . A A . 1 ASN HA 1 1 5 3313 1 1 1 ASN HB2 H 7.470 -9.438 4.004 1.00 . A A . 1 ASN HB2 1 1 5 3314 1 1 1 ASN HB3 H 6.438 -8.090 4.469 1.00 . A A . 1 ASN HB3 1 1 5 3315 1 1 1 ASN HD21 H 4.356 -8.000 3.746 1.00 . A A . 1 ASN HD21 1 1 5 3316 1 1 1 ASN HD22 H 3.583 -9.303 2.906 1.00 . A A . 1 ASN HD22 1 1 5 3317 1 1 1 ASN N N 8.244 -8.647 1.663 1.00 . A A . 1 ASN N 1 1 5 3318 1 1 1 ASN ND2 N 4.387 -8.848 3.257 1.00 . A A . 1 ASN ND2 1 1 5 3319 1 1 1 ASN O O 8.570 -6.886 4.514 1.00 . A A . 1 ASN O 1 1 5 3320 1 1 1 ASN OD1 O 5.692 -10.492 2.478 1.00 . A A . 1 ASN OD1 1 1 5 3321 1 1 2 SER C C 10.928 -5.241 3.712 1.00 . A A . 2 SER C 1 1 5 3322 1 1 2 SER CA C 9.636 -4.722 3.078 1.00 . A A . 2 SER CA 1 1 5 3323 1 1 2 SER CB C 8.820 -3.910 4.098 1.00 . A A . 2 SER CB 1 1 5 3324 1 1 2 SER H H 8.659 -5.851 1.571 1.00 . A A . 2 SER H 1 1 5 3325 1 1 2 SER HA H 9.896 -4.077 2.251 1.00 . A A . 2 SER HA 1 1 5 3326 1 1 2 SER HB2 H 7.877 -3.629 3.657 1.00 . A A . 2 SER HB2 1 1 5 3327 1 1 2 SER HB3 H 8.638 -4.517 4.974 1.00 . A A . 2 SER HB3 1 1 5 3328 1 1 2 SER HG H 9.191 -1.986 3.963 1.00 . A A . 2 SER HG 1 1 5 3329 1 1 2 SER N N 8.834 -5.821 2.543 1.00 . A A . 2 SER N 1 1 5 3330 1 1 2 SER O O 11.057 -5.304 4.935 1.00 . A A . 2 SER O 1 1 5 3331 1 1 2 SER OG O 9.503 -2.730 4.494 1.00 . A A . 2 SER OG 1 1 5 3332 1 1 3 ASP C C 13.958 -4.856 3.903 1.00 . A A . 3 ASP C 1 1 5 3333 1 1 3 ASP CA C 13.200 -6.044 3.359 1.00 . A A . 3 ASP CA 1 1 5 3334 1 1 3 ASP CB C 14.011 -6.738 2.261 1.00 . A A . 3 ASP CB 1 1 5 3335 1 1 3 ASP CG C 15.443 -7.016 2.681 1.00 . A A . 3 ASP CG 1 1 5 3336 1 1 3 ASP H H 11.698 -5.640 1.906 1.00 . A A . 3 ASP H 1 1 5 3337 1 1 3 ASP HA H 13.036 -6.720 4.156 1.00 . A A . 3 ASP HA 1 1 5 3338 1 1 3 ASP HB2 H 13.541 -7.677 2.015 1.00 . A A . 3 ASP HB2 1 1 5 3339 1 1 3 ASP HB3 H 14.030 -6.108 1.383 1.00 . A A . 3 ASP HB3 1 1 5 3340 1 1 3 ASP N N 11.885 -5.626 2.869 1.00 . A A . 3 ASP N 1 1 5 3341 1 1 3 ASP O O 14.760 -4.957 4.831 1.00 . A A . 3 ASP O 1 1 5 3342 1 1 3 ASP OD1 O 15.677 -8.030 3.377 1.00 . A A . 3 ASP OD1 1 1 5 3343 1 1 3 ASP OD2 O 16.341 -6.228 2.313 1.00 . A A . 3 ASP OD2 1 1 5 3344 1 1 4 SER C C 13.153 -1.584 4.312 1.00 . A A . 4 SER C 1 1 5 3345 1 1 4 SER CA C 14.239 -2.472 3.728 1.00 . A A . 4 SER CA 1 1 5 3346 1 1 4 SER CB C 14.899 -1.783 2.532 1.00 . A A . 4 SER CB 1 1 5 3347 1 1 4 SER H H 13.008 -3.759 2.603 1.00 . A A . 4 SER H 1 1 5 3348 1 1 4 SER HA H 14.983 -2.667 4.486 1.00 . A A . 4 SER HA 1 1 5 3349 1 1 4 SER HB2 H 14.140 -1.499 1.819 1.00 . A A . 4 SER HB2 1 1 5 3350 1 1 4 SER HB3 H 15.424 -0.900 2.872 1.00 . A A . 4 SER HB3 1 1 5 3351 1 1 4 SER HG H 16.359 -3.102 2.566 1.00 . A A . 4 SER HG 1 1 5 3352 1 1 4 SER N N 13.661 -3.735 3.323 1.00 . A A . 4 SER N 1 1 5 3353 1 1 4 SER O O 12.248 -1.154 3.597 1.00 . A A . 4 SER O 1 1 5 3354 1 1 4 SER OG O 15.827 -2.645 1.892 1.00 . A A . 4 SER OG 1 1 5 3355 1 1 5 GLU C C 12.353 0.925 5.712 1.00 . A A . 5 GLU C 1 1 5 3356 1 1 5 GLU CA C 12.255 -0.485 6.274 1.00 . A A . 5 GLU CA 1 1 5 3357 1 1 5 GLU CB C 12.453 -0.483 7.791 1.00 . A A . 5 GLU CB 1 1 5 3358 1 1 5 GLU CD C 13.918 0.079 9.751 1.00 . A A . 5 GLU CD 1 1 5 3359 1 1 5 GLU CG C 13.826 -0.020 8.247 1.00 . A A . 5 GLU CG 1 1 5 3360 1 1 5 GLU H H 13.927 -1.778 6.148 1.00 . A A . 5 GLU H 1 1 5 3361 1 1 5 GLU HA H 11.270 -0.872 6.052 1.00 . A A . 5 GLU HA 1 1 5 3362 1 1 5 GLU HB2 H 11.716 0.170 8.234 1.00 . A A . 5 GLU HB2 1 1 5 3363 1 1 5 GLU HB3 H 12.295 -1.486 8.160 1.00 . A A . 5 GLU HB3 1 1 5 3364 1 1 5 GLU HG2 H 14.567 -0.725 7.899 1.00 . A A . 5 GLU HG2 1 1 5 3365 1 1 5 GLU HG3 H 14.026 0.954 7.821 1.00 . A A . 5 GLU HG3 1 1 5 3366 1 1 5 GLU N N 13.219 -1.350 5.616 1.00 . A A . 5 GLU N 1 1 5 3367 1 1 5 GLU O O 13.391 1.584 5.811 1.00 . A A . 5 GLU O 1 1 5 3368 1 1 5 GLU OE1 O 13.434 1.080 10.315 1.00 . A A . 5 GLU OE1 1 1 5 3369 1 1 5 GLU OE2 O 14.490 -0.838 10.377 1.00 . A A . 5 GLU OE2 1 1 5 3370 1 1 6 CYS C C 11.134 3.788 5.417 1.00 . A A . 6 CYS C 1 1 5 3371 1 1 6 CYS CA C 11.259 2.645 4.423 1.00 . A A . 6 CYS CA 1 1 5 3372 1 1 6 CYS CB C 10.094 2.679 3.440 1.00 . A A . 6 CYS CB 1 1 5 3373 1 1 6 CYS H H 10.464 0.820 5.106 1.00 . A A . 6 CYS H 1 1 5 3374 1 1 6 CYS HA H 12.184 2.750 3.878 1.00 . A A . 6 CYS HA 1 1 5 3375 1 1 6 CYS HB2 H 9.164 2.683 3.990 1.00 . A A . 6 CYS HB2 1 1 5 3376 1 1 6 CYS HB3 H 10.159 3.579 2.846 1.00 . A A . 6 CYS HB3 1 1 5 3377 1 1 6 CYS N N 11.276 1.368 5.102 1.00 . A A . 6 CYS N 1 1 5 3378 1 1 6 CYS O O 10.414 3.682 6.411 1.00 . A A . 6 CYS O 1 1 5 3379 1 1 6 CYS SG S 10.065 1.260 2.301 1.00 . A A . 6 CYS SG 1 1 5 3380 1 1 7 PRO C C 10.357 6.758 5.491 1.00 . A A . 7 PRO C 1 1 5 3381 1 1 7 PRO CA C 11.676 6.126 5.912 1.00 . A A . 7 PRO CA 1 1 5 3382 1 1 7 PRO CB C 12.860 7.003 5.482 1.00 . A A . 7 PRO CB 1 1 5 3383 1 1 7 PRO CD C 12.979 4.975 4.229 1.00 . A A . 7 PRO CD 1 1 5 3384 1 1 7 PRO CG C 13.815 6.075 4.809 1.00 . A A . 7 PRO CG 1 1 5 3385 1 1 7 PRO HA H 11.687 5.980 6.983 1.00 . A A . 7 PRO HA 1 1 5 3386 1 1 7 PRO HB2 H 12.515 7.769 4.804 1.00 . A A . 7 PRO HB2 1 1 5 3387 1 1 7 PRO HB3 H 13.305 7.460 6.353 1.00 . A A . 7 PRO HB3 1 1 5 3388 1 1 7 PRO HD2 H 12.617 5.246 3.247 1.00 . A A . 7 PRO HD2 1 1 5 3389 1 1 7 PRO HD3 H 13.540 4.052 4.187 1.00 . A A . 7 PRO HD3 1 1 5 3390 1 1 7 PRO HG2 H 14.342 6.599 4.026 1.00 . A A . 7 PRO HG2 1 1 5 3391 1 1 7 PRO HG3 H 14.511 5.675 5.531 1.00 . A A . 7 PRO HG3 1 1 5 3392 1 1 7 PRO N N 11.877 4.876 5.190 1.00 . A A . 7 PRO N 1 1 5 3393 1 1 7 PRO O O 9.898 6.532 4.373 1.00 . A A . 7 PRO O 1 1 5 3394 1 1 8 LEU C C 8.079 8.694 4.883 1.00 . A A . 8 LEU C 1 1 5 3395 1 1 8 LEU CA C 8.404 8.075 6.250 1.00 . A A . 8 LEU CA 1 1 5 3396 1 1 8 LEU CB C 8.113 9.118 7.338 1.00 . A A . 8 LEU CB 1 1 5 3397 1 1 8 LEU CD1 C 8.232 11.497 8.117 1.00 . A A . 8 LEU CD1 1 1 5 3398 1 1 8 LEU CD2 C 10.339 10.291 7.570 1.00 . A A . 8 LEU CD2 1 1 5 3399 1 1 8 LEU CG C 8.867 10.453 7.216 1.00 . A A . 8 LEU CG 1 1 5 3400 1 1 8 LEU H H 10.296 7.815 7.179 1.00 . A A . 8 LEU H 1 1 5 3401 1 1 8 LEU HA H 7.739 7.240 6.405 1.00 . A A . 8 LEU HA 1 1 5 3402 1 1 8 LEU HB2 H 7.056 9.329 7.318 1.00 . A A . 8 LEU HB2 1 1 5 3403 1 1 8 LEU HB3 H 8.357 8.683 8.295 1.00 . A A . 8 LEU HB3 1 1 5 3404 1 1 8 LEU HD11 H 8.236 11.142 9.136 1.00 . A A . 8 LEU HD11 1 1 5 3405 1 1 8 LEU HD12 H 8.792 12.419 8.055 1.00 . A A . 8 LEU HD12 1 1 5 3406 1 1 8 LEU HD13 H 7.213 11.674 7.802 1.00 . A A . 8 LEU HD13 1 1 5 3407 1 1 8 LEU HD21 H 10.780 9.534 6.939 1.00 . A A . 8 LEU HD21 1 1 5 3408 1 1 8 LEU HD22 H 10.852 11.230 7.420 1.00 . A A . 8 LEU HD22 1 1 5 3409 1 1 8 LEU HD23 H 10.429 9.994 8.605 1.00 . A A . 8 LEU HD23 1 1 5 3410 1 1 8 LEU HG H 8.801 10.804 6.195 1.00 . A A . 8 LEU HG 1 1 5 3411 1 1 8 LEU N N 9.779 7.562 6.381 1.00 . A A . 8 LEU N 1 1 5 3412 1 1 8 LEU O O 6.911 8.809 4.519 1.00 . A A . 8 LEU O 1 1 5 3413 1 1 9 SER C C 8.471 8.763 1.805 1.00 . A A . 9 SER C 1 1 5 3414 1 1 9 SER CA C 8.894 9.758 2.870 1.00 . A A . 9 SER CA 1 1 5 3415 1 1 9 SER CB C 10.182 10.466 2.453 1.00 . A A . 9 SER CB 1 1 5 3416 1 1 9 SER H H 9.992 8.866 4.401 1.00 . A A . 9 SER H 1 1 5 3417 1 1 9 SER HA H 8.112 10.491 3.001 1.00 . A A . 9 SER HA 1 1 5 3418 1 1 9 SER HB2 H 10.919 9.730 2.168 1.00 . A A . 9 SER HB2 1 1 5 3419 1 1 9 SER HB3 H 9.980 11.118 1.616 1.00 . A A . 9 SER HB3 1 1 5 3420 1 1 9 SER HG H 10.146 12.023 3.640 1.00 . A A . 9 SER HG 1 1 5 3421 1 1 9 SER N N 9.093 9.078 4.128 1.00 . A A . 9 SER N 1 1 5 3422 1 1 9 SER O O 7.692 9.088 0.922 1.00 . A A . 9 SER O 1 1 5 3423 1 1 9 SER OG O 10.697 11.240 3.521 1.00 . A A . 9 SER OG 1 1 5 3424 1 1 10 HIS C C 7.288 5.882 1.191 1.00 . A A . 10 HIS C 1 1 5 3425 1 1 10 HIS CA C 8.654 6.509 0.935 1.00 . A A . 10 HIS CA 1 1 5 3426 1 1 10 HIS CB C 9.747 5.437 0.910 1.00 . A A . 10 HIS CB 1 1 5 3427 1 1 10 HIS CD2 C 11.196 5.400 -1.240 1.00 . A A . 10 HIS CD2 1 1 5 3428 1 1 10 HIS CE1 C 12.789 6.746 -0.585 1.00 . A A . 10 HIS CE1 1 1 5 3429 1 1 10 HIS CG C 10.905 5.786 0.024 1.00 . A A . 10 HIS CG 1 1 5 3430 1 1 10 HIS H H 9.504 7.303 2.705 1.00 . A A . 10 HIS H 1 1 5 3431 1 1 10 HIS HA H 8.632 7.002 -0.020 1.00 . A A . 10 HIS HA 1 1 5 3432 1 1 10 HIS HB2 H 10.124 5.294 1.911 1.00 . A A . 10 HIS HB2 1 1 5 3433 1 1 10 HIS HB3 H 9.323 4.509 0.554 1.00 . A A . 10 HIS HB3 1 1 5 3434 1 1 10 HIS HD1 H 12.000 7.095 1.273 1.00 . A A . 10 HIS HD1 1 1 5 3435 1 1 10 HIS HD2 H 10.610 4.733 -1.858 1.00 . A A . 10 HIS HD2 1 1 5 3436 1 1 10 HIS HE1 H 13.689 7.343 -0.570 1.00 . A A . 10 HIS HE1 1 1 5 3437 1 1 10 HIS HE2 H 12.937 5.747 -2.362 1.00 . A A . 10 HIS HE2 1 1 5 3438 1 1 10 HIS N N 8.951 7.532 1.925 1.00 . A A . 10 HIS N 1 1 5 3439 1 1 10 HIS ND1 N 11.925 6.629 0.405 1.00 . A A . 10 HIS ND1 1 1 5 3440 1 1 10 HIS NE2 N 12.373 6.011 -1.596 1.00 . A A . 10 HIS NE2 1 1 5 3441 1 1 10 HIS O O 6.742 5.181 0.337 1.00 . A A . 10 HIS O 1 1 5 3442 1 1 11 ASP C C 4.430 6.816 2.464 1.00 . A A . 11 ASP C 1 1 5 3443 1 1 11 ASP CA C 5.414 5.690 2.742 1.00 . A A . 11 ASP CA 1 1 5 3444 1 1 11 ASP CB C 5.347 5.323 4.233 1.00 . A A . 11 ASP CB 1 1 5 3445 1 1 11 ASP CG C 6.368 4.283 4.649 1.00 . A A . 11 ASP CG 1 1 5 3446 1 1 11 ASP H H 7.263 6.652 3.026 1.00 . A A . 11 ASP H 1 1 5 3447 1 1 11 ASP HA H 5.161 4.832 2.141 1.00 . A A . 11 ASP HA 1 1 5 3448 1 1 11 ASP HB2 H 5.517 6.211 4.818 1.00 . A A . 11 ASP HB2 1 1 5 3449 1 1 11 ASP HB3 H 4.360 4.940 4.455 1.00 . A A . 11 ASP HB3 1 1 5 3450 1 1 11 ASP N N 6.749 6.139 2.376 1.00 . A A . 11 ASP N 1 1 5 3451 1 1 11 ASP O O 3.380 6.624 1.856 1.00 . A A . 11 ASP O 1 1 5 3452 1 1 11 ASP OD1 O 7.560 4.629 4.795 1.00 . A A . 11 ASP OD1 1 1 5 3453 1 1 11 ASP OD2 O 5.988 3.108 4.815 1.00 . A A . 11 ASP OD2 1 1 5 3454 1 1 12 GLY C C 3.907 9.662 1.321 1.00 . A A . 12 GLY C 1 1 5 3455 1 1 12 GLY CA C 3.984 9.181 2.752 1.00 . A A . 12 GLY CA 1 1 5 3456 1 1 12 GLY H H 5.690 8.087 3.325 1.00 . A A . 12 GLY H 1 1 5 3457 1 1 12 GLY HA2 H 2.988 8.948 3.095 1.00 . A A . 12 GLY HA2 1 1 5 3458 1 1 12 GLY HA3 H 4.389 9.973 3.363 1.00 . A A . 12 GLY HA3 1 1 5 3459 1 1 12 GLY N N 4.816 8.007 2.897 1.00 . A A . 12 GLY N 1 1 5 3460 1 1 12 GLY O O 2.953 10.348 0.945 1.00 . A A . 12 GLY O 1 1 5 3461 1 1 13 TYR C C 3.773 8.930 -1.635 1.00 . A A . 13 TYR C 1 1 5 3462 1 1 13 TYR CA C 4.904 9.653 -0.904 1.00 . A A . 13 TYR CA 1 1 5 3463 1 1 13 TYR CB C 6.240 9.293 -1.551 1.00 . A A . 13 TYR CB 1 1 5 3464 1 1 13 TYR CD1 C 6.334 11.131 -3.267 1.00 . A A . 13 TYR CD1 1 1 5 3465 1 1 13 TYR CD2 C 6.519 8.878 -4.027 1.00 . A A . 13 TYR CD2 1 1 5 3466 1 1 13 TYR CE1 C 6.446 11.583 -4.565 1.00 . A A . 13 TYR CE1 1 1 5 3467 1 1 13 TYR CE2 C 6.632 9.323 -5.328 1.00 . A A . 13 TYR CE2 1 1 5 3468 1 1 13 TYR CG C 6.370 9.775 -2.975 1.00 . A A . 13 TYR CG 1 1 5 3469 1 1 13 TYR CZ C 6.592 10.676 -5.595 1.00 . A A . 13 TYR CZ 1 1 5 3470 1 1 13 TYR H H 5.693 8.839 0.904 1.00 . A A . 13 TYR H 1 1 5 3471 1 1 13 TYR HA H 4.748 10.718 -0.990 1.00 . A A . 13 TYR HA 1 1 5 3472 1 1 13 TYR HB2 H 7.036 9.735 -0.975 1.00 . A A . 13 TYR HB2 1 1 5 3473 1 1 13 TYR HB3 H 6.355 8.218 -1.550 1.00 . A A . 13 TYR HB3 1 1 5 3474 1 1 13 TYR HD1 H 6.216 11.838 -2.459 1.00 . A A . 13 TYR HD1 1 1 5 3475 1 1 13 TYR HD2 H 6.548 7.819 -3.815 1.00 . A A . 13 TYR HD2 1 1 5 3476 1 1 13 TYR HE1 H 6.417 12.643 -4.771 1.00 . A A . 13 TYR HE1 1 1 5 3477 1 1 13 TYR HE2 H 6.746 8.614 -6.132 1.00 . A A . 13 TYR HE2 1 1 5 3478 1 1 13 TYR HH H 7.220 11.949 -6.901 1.00 . A A . 13 TYR HH 1 1 5 3479 1 1 13 TYR N N 4.910 9.313 0.522 1.00 . A A . 13 TYR N 1 1 5 3480 1 1 13 TYR O O 3.434 9.269 -2.767 1.00 . A A . 13 TYR O 1 1 5 3481 1 1 13 TYR OH O 6.705 11.124 -6.892 1.00 . A A . 13 TYR OH 1 1 5 3482 1 1 14 CYS C C 0.831 7.980 -1.675 1.00 . A A . 14 CYS C 1 1 5 3483 1 1 14 CYS CA C 2.122 7.153 -1.569 1.00 . A A . 14 CYS CA 1 1 5 3484 1 1 14 CYS CB C 1.893 5.897 -0.741 1.00 . A A . 14 CYS CB 1 1 5 3485 1 1 14 CYS H H 3.512 7.717 -0.078 1.00 . A A . 14 CYS H 1 1 5 3486 1 1 14 CYS HA H 2.431 6.866 -2.563 1.00 . A A . 14 CYS HA 1 1 5 3487 1 1 14 CYS HB2 H 2.804 5.641 -0.212 1.00 . A A . 14 CYS HB2 1 1 5 3488 1 1 14 CYS HB3 H 1.118 6.103 -0.015 1.00 . A A . 14 CYS HB3 1 1 5 3489 1 1 14 CYS N N 3.196 7.937 -0.979 1.00 . A A . 14 CYS N 1 1 5 3490 1 1 14 CYS O O 0.860 9.203 -1.549 1.00 . A A . 14 CYS O 1 1 5 3491 1 1 14 CYS SG S 1.364 4.440 -1.703 1.00 . A A . 14 CYS SG 1 1 5 3492 1 1 15 LEU C C -2.402 8.474 -1.148 1.00 . A A . 15 LEU C 1 1 5 3493 1 1 15 LEU CA C -1.508 8.032 -2.302 1.00 . A A . 15 LEU CA 1 1 5 3494 1 1 15 LEU CB C -2.298 7.196 -3.307 1.00 . A A . 15 LEU CB 1 1 5 3495 1 1 15 LEU CD1 C -2.424 6.126 -5.565 1.00 . A A . 15 LEU CD1 1 1 5 3496 1 1 15 LEU CD2 C -0.792 7.970 -5.167 1.00 . A A . 15 LEU CD2 1 1 5 3497 1 1 15 LEU CG C -1.507 6.776 -4.545 1.00 . A A . 15 LEU CG 1 1 5 3498 1 1 15 LEU H H -0.345 6.357 -1.706 1.00 . A A . 15 LEU H 1 1 5 3499 1 1 15 LEU HA H -1.174 8.919 -2.807 1.00 . A A . 15 LEU HA 1 1 5 3500 1 1 15 LEU HB2 H -2.650 6.304 -2.807 1.00 . A A . 15 LEU HB2 1 1 5 3501 1 1 15 LEU HB3 H -3.152 7.769 -3.631 1.00 . A A . 15 LEU HB3 1 1 5 3502 1 1 15 LEU HD11 H -1.856 5.864 -6.446 1.00 . A A . 15 LEU HD11 1 1 5 3503 1 1 15 LEU HD12 H -2.861 5.233 -5.140 1.00 . A A . 15 LEU HD12 1 1 5 3504 1 1 15 LEU HD13 H -3.208 6.817 -5.834 1.00 . A A . 15 LEU HD13 1 1 5 3505 1 1 15 LEU HD21 H -1.518 8.722 -5.438 1.00 . A A . 15 LEU HD21 1 1 5 3506 1 1 15 LEU HD22 H -0.094 8.384 -4.454 1.00 . A A . 15 LEU HD22 1 1 5 3507 1 1 15 LEU HD23 H -0.258 7.651 -6.050 1.00 . A A . 15 LEU HD23 1 1 5 3508 1 1 15 LEU HG H -0.759 6.050 -4.251 1.00 . A A . 15 LEU HG 1 1 5 3509 1 1 15 LEU N N -0.308 7.321 -1.870 1.00 . A A . 15 LEU N 1 1 5 3510 1 1 15 LEU O O -2.296 9.608 -0.685 1.00 . A A . 15 LEU O 1 1 5 3511 1 1 16 HIS C C -3.982 7.685 1.697 1.00 . A A . 16 HIS C 1 1 5 3512 1 1 16 HIS CA C -4.315 8.042 0.267 1.00 . A A . 16 HIS CA 1 1 5 3513 1 1 16 HIS CB C -5.686 7.465 -0.106 1.00 . A A . 16 HIS CB 1 1 5 3514 1 1 16 HIS CD2 C -5.957 8.209 -2.577 1.00 . A A . 16 HIS CD2 1 1 5 3515 1 1 16 HIS CE1 C -7.878 9.243 -2.386 1.00 . A A . 16 HIS CE1 1 1 5 3516 1 1 16 HIS CG C -6.337 8.126 -1.281 1.00 . A A . 16 HIS CG 1 1 5 3517 1 1 16 HIS H H -3.190 6.630 -0.895 1.00 . A A . 16 HIS H 1 1 5 3518 1 1 16 HIS HA H -4.357 9.113 0.197 1.00 . A A . 16 HIS HA 1 1 5 3519 1 1 16 HIS HB2 H -5.573 6.419 -0.344 1.00 . A A . 16 HIS HB2 1 1 5 3520 1 1 16 HIS HB3 H -6.351 7.565 0.739 1.00 . A A . 16 HIS HB3 1 1 5 3521 1 1 16 HIS HD1 H -8.082 8.903 -0.372 1.00 . A A . 16 HIS HD1 1 1 5 3522 1 1 16 HIS HD2 H -5.052 7.802 -3.006 1.00 . A A . 16 HIS HD2 1 1 5 3523 1 1 16 HIS HE1 H -8.773 9.799 -2.618 1.00 . A A . 16 HIS HE1 1 1 5 3524 1 1 16 HIS HE2 H -6.844 9.281 -4.156 1.00 . A A . 16 HIS HE2 1 1 5 3525 1 1 16 HIS N N -3.271 7.595 -0.663 1.00 . A A . 16 HIS N 1 1 5 3526 1 1 16 HIS ND1 N -7.543 8.785 -1.195 1.00 . A A . 16 HIS ND1 1 1 5 3527 1 1 16 HIS NE2 N -6.933 8.907 -3.243 1.00 . A A . 16 HIS NE2 1 1 5 3528 1 1 16 HIS O O -4.862 7.640 2.554 1.00 . A A . 16 HIS O 1 1 5 3529 1 1 17 ASP C C -0.758 6.584 3.067 1.00 . A A . 17 ASP C 1 1 5 3530 1 1 17 ASP CA C -2.187 7.059 3.242 1.00 . A A . 17 ASP CA 1 1 5 3531 1 1 17 ASP CB C -3.025 5.924 3.847 1.00 . A A . 17 ASP CB 1 1 5 3532 1 1 17 ASP CG C -2.825 5.771 5.344 1.00 . A A . 17 ASP CG 1 1 5 3533 1 1 17 ASP H H -2.072 7.630 1.203 1.00 . A A . 17 ASP H 1 1 5 3534 1 1 17 ASP HA H -2.199 7.913 3.895 1.00 . A A . 17 ASP HA 1 1 5 3535 1 1 17 ASP HB2 H -4.071 6.122 3.665 1.00 . A A . 17 ASP HB2 1 1 5 3536 1 1 17 ASP HB3 H -2.754 4.993 3.370 1.00 . A A . 17 ASP HB3 1 1 5 3537 1 1 17 ASP N N -2.703 7.472 1.934 1.00 . A A . 17 ASP N 1 1 5 3538 1 1 17 ASP O O 0.173 7.159 3.629 1.00 . A A . 17 ASP O 1 1 5 3539 1 1 17 ASP OD1 O -1.747 5.286 5.753 1.00 . A A . 17 ASP OD1 1 1 5 3540 1 1 17 ASP OD2 O -3.728 6.144 6.118 1.00 . A A . 17 ASP OD2 1 1 5 3541 1 1 18 GLY C C 1.477 4.368 3.024 1.00 . A A . 18 GLY C 1 1 5 3542 1 1 18 GLY CA C 0.708 5.045 1.895 1.00 . A A . 18 GLY CA 1 1 5 3543 1 1 18 GLY H H -1.389 5.218 1.757 1.00 . A A . 18 GLY H 1 1 5 3544 1 1 18 GLY HA2 H 0.582 4.320 1.104 1.00 . A A . 18 GLY HA2 1 1 5 3545 1 1 18 GLY HA3 H 1.311 5.855 1.511 1.00 . A A . 18 GLY HA3 1 1 5 3546 1 1 18 GLY N N -0.599 5.577 2.217 1.00 . A A . 18 GLY N 1 1 5 3547 1 1 18 GLY O O 1.674 4.925 4.102 1.00 . A A . 18 GLY O 1 1 5 3548 1 1 19 VAL C C 3.825 1.688 2.569 1.00 . A A . 19 VAL C 1 1 5 3549 1 1 19 VAL CA C 2.900 2.422 3.532 1.00 . A A . 19 VAL CA 1 1 5 3550 1 1 19 VAL CB C 2.229 1.413 4.505 1.00 . A A . 19 VAL CB 1 1 5 3551 1 1 19 VAL CG1 C 3.255 0.461 5.109 1.00 . A A . 19 VAL CG1 1 1 5 3552 1 1 19 VAL CG2 C 1.486 2.143 5.616 1.00 . A A . 19 VAL CG2 1 1 5 3553 1 1 19 VAL H H 1.623 2.749 1.889 1.00 . A A . 19 VAL H 1 1 5 3554 1 1 19 VAL HA H 3.480 3.134 4.105 1.00 . A A . 19 VAL HA 1 1 5 3555 1 1 19 VAL HB H 1.512 0.826 3.947 1.00 . A A . 19 VAL HB 1 1 5 3556 1 1 19 VAL HG11 H 3.785 -0.047 4.317 1.00 . A A . 19 VAL HG11 1 1 5 3557 1 1 19 VAL HG12 H 3.956 1.023 5.711 1.00 . A A . 19 VAL HG12 1 1 5 3558 1 1 19 VAL HG13 H 2.751 -0.265 5.729 1.00 . A A . 19 VAL HG13 1 1 5 3559 1 1 19 VAL HG21 H 2.178 2.764 6.165 1.00 . A A . 19 VAL HG21 1 1 5 3560 1 1 19 VAL HG22 H 0.710 2.761 5.184 1.00 . A A . 19 VAL HG22 1 1 5 3561 1 1 19 VAL HG23 H 1.040 1.422 6.285 1.00 . A A . 19 VAL HG23 1 1 5 3562 1 1 19 VAL N N 1.935 3.162 2.719 1.00 . A A . 19 VAL N 1 1 5 3563 1 1 19 VAL O O 3.357 1.101 1.599 1.00 . A A . 19 VAL O 1 1 5 3564 1 1 20 CYS C C 6.608 -0.099 1.989 1.00 . A A . 20 CYS C 1 1 5 3565 1 1 20 CYS CA C 6.088 1.323 1.821 1.00 . A A . 20 CYS CA 1 1 5 3566 1 1 20 CYS CB C 7.258 2.306 1.869 1.00 . A A . 20 CYS CB 1 1 5 3567 1 1 20 CYS H H 5.423 1.985 3.726 1.00 . A A . 20 CYS H 1 1 5 3568 1 1 20 CYS HA H 5.612 1.405 0.857 1.00 . A A . 20 CYS HA 1 1 5 3569 1 1 20 CYS HB2 H 6.929 3.260 1.487 1.00 . A A . 20 CYS HB2 1 1 5 3570 1 1 20 CYS HB3 H 7.575 2.428 2.895 1.00 . A A . 20 CYS HB3 1 1 5 3571 1 1 20 CYS N N 5.112 1.698 2.832 1.00 . A A . 20 CYS N 1 1 5 3572 1 1 20 CYS O O 7.095 -0.477 3.057 1.00 . A A . 20 CYS O 1 1 5 3573 1 1 20 CYS SG S 8.709 1.795 0.896 1.00 . A A . 20 CYS SG 1 1 5 3574 1 1 21 MET C C 7.308 -2.598 -0.621 1.00 . A A . 21 MET C 1 1 5 3575 1 1 21 MET CA C 7.114 -2.190 0.831 1.00 . A A . 21 MET CA 1 1 5 3576 1 1 21 MET CB C 6.318 -3.255 1.588 1.00 . A A . 21 MET CB 1 1 5 3577 1 1 21 MET CE C 2.318 -4.433 1.482 1.00 . A A . 21 MET CE 1 1 5 3578 1 1 21 MET CG C 4.840 -3.311 1.240 1.00 . A A . 21 MET CG 1 1 5 3579 1 1 21 MET H H 5.930 -0.577 0.159 1.00 . A A . 21 MET H 1 1 5 3580 1 1 21 MET HA H 8.089 -2.100 1.288 1.00 . A A . 21 MET HA 1 1 5 3581 1 1 21 MET HB2 H 6.750 -4.223 1.378 1.00 . A A . 21 MET HB2 1 1 5 3582 1 1 21 MET HB3 H 6.415 -3.057 2.637 1.00 . A A . 21 MET HB3 1 1 5 3583 1 1 21 MET HE1 H 1.942 -3.448 1.712 1.00 . A A . 21 MET HE1 1 1 5 3584 1 1 21 MET HE2 H 2.341 -4.569 0.410 1.00 . A A . 21 MET HE2 1 1 5 3585 1 1 21 MET HE3 H 1.673 -5.178 1.925 1.00 . A A . 21 MET HE3 1 1 5 3586 1 1 21 MET HG2 H 4.390 -2.360 1.481 1.00 . A A . 21 MET HG2 1 1 5 3587 1 1 21 MET HG3 H 4.738 -3.499 0.181 1.00 . A A . 21 MET HG3 1 1 5 3588 1 1 21 MET N N 6.478 -0.886 0.917 1.00 . A A . 21 MET N 1 1 5 3589 1 1 21 MET O O 6.382 -3.024 -1.301 1.00 . A A . 21 MET O 1 1 5 3590 1 1 21 MET SD S 3.972 -4.609 2.143 1.00 . A A . 21 MET SD 1 1 5 3591 1 1 22 TYR C C 10.378 -3.058 -2.525 1.00 . A A . 22 TYR C 1 1 5 3592 1 1 22 TYR CA C 8.893 -2.772 -2.423 1.00 . A A . 22 TYR CA 1 1 5 3593 1 1 22 TYR CB C 8.483 -1.660 -3.388 1.00 . A A . 22 TYR CB 1 1 5 3594 1 1 22 TYR CD1 C 9.661 0.503 -2.842 1.00 . A A . 22 TYR CD1 1 1 5 3595 1 1 22 TYR CD2 C 7.324 0.365 -2.410 1.00 . A A . 22 TYR CD2 1 1 5 3596 1 1 22 TYR CE1 C 9.689 1.781 -2.326 1.00 . A A . 22 TYR CE1 1 1 5 3597 1 1 22 TYR CE2 C 7.340 1.650 -1.903 1.00 . A A . 22 TYR CE2 1 1 5 3598 1 1 22 TYR CG C 8.482 -0.227 -2.893 1.00 . A A . 22 TYR CG 1 1 5 3599 1 1 22 TYR CZ C 8.432 2.441 -2.118 1.00 . A A . 22 TYR CZ 1 1 5 3600 1 1 22 TYR H H 9.215 -2.180 -0.490 1.00 . A A . 22 TYR H 1 1 5 3601 1 1 22 TYR HA H 8.376 -3.660 -2.691 1.00 . A A . 22 TYR HA 1 1 5 3602 1 1 22 TYR HB2 H 9.165 -1.694 -4.202 1.00 . A A . 22 TYR HB2 1 1 5 3603 1 1 22 TYR HB3 H 7.491 -1.879 -3.759 1.00 . A A . 22 TYR HB3 1 1 5 3604 1 1 22 TYR HD1 H 10.571 0.054 -3.216 1.00 . A A . 22 TYR HD1 1 1 5 3605 1 1 22 TYR HD2 H 6.396 -0.188 -2.443 1.00 . A A . 22 TYR HD2 1 1 5 3606 1 1 22 TYR HE1 H 10.617 2.331 -2.297 1.00 . A A . 22 TYR HE1 1 1 5 3607 1 1 22 TYR HE2 H 6.427 2.095 -1.536 1.00 . A A . 22 TYR HE2 1 1 5 3608 1 1 22 TYR HH H 9.057 4.201 -1.924 1.00 . A A . 22 TYR HH 1 1 5 3609 1 1 22 TYR N N 8.531 -2.468 -1.078 1.00 . A A . 22 TYR N 1 1 5 3610 1 1 22 TYR O O 10.801 -4.104 -3.003 1.00 . A A . 22 TYR O 1 1 5 3611 1 1 22 TYR OH O 8.552 3.626 -1.337 1.00 . A A . 22 TYR OH 1 1 5 3612 1 1 23 ILE C C 12.916 -3.488 -1.043 1.00 . A A . 23 ILE C 1 1 5 3613 1 1 23 ILE CA C 12.595 -2.307 -1.959 1.00 . A A . 23 ILE CA 1 1 5 3614 1 1 23 ILE CB C 13.260 -1.044 -1.417 1.00 . A A . 23 ILE CB 1 1 5 3615 1 1 23 ILE CD1 C 13.082 0.524 0.584 1.00 . A A . 23 ILE CD1 1 1 5 3616 1 1 23 ILE CG1 C 12.367 -0.436 -0.340 1.00 . A A . 23 ILE CG1 1 1 5 3617 1 1 23 ILE CG2 C 13.518 -0.054 -2.543 1.00 . A A . 23 ILE CG2 1 1 5 3618 1 1 23 ILE H H 10.754 -1.280 -1.814 1.00 . A A . 23 ILE H 1 1 5 3619 1 1 23 ILE HA H 12.989 -2.509 -2.944 1.00 . A A . 23 ILE HA 1 1 5 3620 1 1 23 ILE HB H 14.203 -1.321 -0.982 1.00 . A A . 23 ILE HB 1 1 5 3621 1 1 23 ILE HD11 H 13.897 0.013 1.075 1.00 . A A . 23 ILE HD11 1 1 5 3622 1 1 23 ILE HD12 H 13.470 1.354 0.011 1.00 . A A . 23 ILE HD12 1 1 5 3623 1 1 23 ILE HD13 H 12.388 0.894 1.326 1.00 . A A . 23 ILE HD13 1 1 5 3624 1 1 23 ILE HG12 H 11.563 0.105 -0.818 1.00 . A A . 23 ILE HG12 1 1 5 3625 1 1 23 ILE HG13 H 11.951 -1.242 0.248 1.00 . A A . 23 ILE HG13 1 1 5 3626 1 1 23 ILE HG21 H 13.986 0.833 -2.143 1.00 . A A . 23 ILE HG21 1 1 5 3627 1 1 23 ILE HG22 H 14.171 -0.506 -3.274 1.00 . A A . 23 ILE HG22 1 1 5 3628 1 1 23 ILE HG23 H 12.581 0.212 -3.011 1.00 . A A . 23 ILE HG23 1 1 5 3629 1 1 23 ILE N N 11.156 -2.124 -2.073 1.00 . A A . 23 ILE N 1 1 5 3630 1 1 23 ILE O O 12.887 -3.380 0.184 1.00 . A A . 23 ILE O 1 1 5 3631 1 1 24 GLU C C 14.558 -6.658 -1.466 1.00 . A A . 24 GLU C 1 1 5 3632 1 1 24 GLU CA C 13.383 -5.868 -0.930 1.00 . A A . 24 GLU CA 1 1 5 3633 1 1 24 GLU CB C 12.133 -6.720 -1.073 1.00 . A A . 24 GLU CB 1 1 5 3634 1 1 24 GLU CD C 9.687 -6.968 -0.453 1.00 . A A . 24 GLU CD 1 1 5 3635 1 1 24 GLU CG C 10.917 -6.088 -0.423 1.00 . A A . 24 GLU CG 1 1 5 3636 1 1 24 GLU H H 13.239 -4.630 -2.631 1.00 . A A . 24 GLU H 1 1 5 3637 1 1 24 GLU HA H 13.544 -5.640 0.111 1.00 . A A . 24 GLU HA 1 1 5 3638 1 1 24 GLU HB2 H 11.936 -6.854 -2.138 1.00 . A A . 24 GLU HB2 1 1 5 3639 1 1 24 GLU HB3 H 12.307 -7.682 -0.616 1.00 . A A . 24 GLU HB3 1 1 5 3640 1 1 24 GLU HG2 H 11.155 -5.869 0.607 1.00 . A A . 24 GLU HG2 1 1 5 3641 1 1 24 GLU HG3 H 10.700 -5.166 -0.940 1.00 . A A . 24 GLU HG3 1 1 5 3642 1 1 24 GLU N N 13.191 -4.624 -1.658 1.00 . A A . 24 GLU N 1 1 5 3643 1 1 24 GLU O O 14.711 -7.833 -1.134 1.00 . A A . 24 GLU O 1 1 5 3644 1 1 24 GLU OE1 O 9.780 -8.136 -0.877 1.00 . A A . 24 GLU OE1 1 1 5 3645 1 1 24 GLU OE2 O 8.618 -6.504 -0.019 1.00 . A A . 24 GLU OE2 1 1 5 3646 1 1 25 ALA C C 15.808 -7.621 -4.130 1.00 . A A . 25 ALA C 1 1 5 3647 1 1 25 ALA CA C 16.410 -6.687 -3.080 1.00 . A A . 25 ALA CA 1 1 5 3648 1 1 25 ALA CB C 17.370 -7.442 -2.164 1.00 . A A . 25 ALA CB 1 1 5 3649 1 1 25 ALA H H 15.237 -5.046 -2.433 1.00 . A A . 25 ALA H 1 1 5 3650 1 1 25 ALA HA H 16.975 -5.920 -3.591 1.00 . A A . 25 ALA HA 1 1 5 3651 1 1 25 ALA HB1 H 17.792 -6.760 -1.441 1.00 . A A . 25 ALA HB1 1 1 5 3652 1 1 25 ALA HB2 H 16.832 -8.224 -1.649 1.00 . A A . 25 ALA HB2 1 1 5 3653 1 1 25 ALA HB3 H 18.162 -7.877 -2.755 1.00 . A A . 25 ALA HB3 1 1 5 3654 1 1 25 ALA N N 15.352 -6.015 -2.320 1.00 . A A . 25 ALA N 1 1 5 3655 1 1 25 ALA O O 16.494 -8.056 -5.052 1.00 . A A . 25 ALA O 1 1 5 3656 1 1 26 LEU C C 13.235 -7.790 -5.995 1.00 . A A . 26 LEU C 1 1 5 3657 1 1 26 LEU CA C 13.795 -8.714 -4.956 1.00 . A A . 26 LEU CA 1 1 5 3658 1 1 26 LEU CB C 12.662 -9.501 -4.289 1.00 . A A . 26 LEU CB 1 1 5 3659 1 1 26 LEU CD1 C 11.848 -11.063 -2.516 1.00 . A A . 26 LEU CD1 1 1 5 3660 1 1 26 LEU CD2 C 14.041 -11.490 -3.632 1.00 . A A . 26 LEU CD2 1 1 5 3661 1 1 26 LEU CG C 13.077 -10.424 -3.141 1.00 . A A . 26 LEU CG 1 1 5 3662 1 1 26 LEU H H 14.027 -7.544 -3.231 1.00 . A A . 26 LEU H 1 1 5 3663 1 1 26 LEU HA H 14.488 -9.387 -5.419 1.00 . A A . 26 LEU HA 1 1 5 3664 1 1 26 LEU HB2 H 11.942 -8.794 -3.907 1.00 . A A . 26 LEU HB2 1 1 5 3665 1 1 26 LEU HB3 H 12.179 -10.104 -5.045 1.00 . A A . 26 LEU HB3 1 1 5 3666 1 1 26 LEU HD11 H 11.197 -10.290 -2.133 1.00 . A A . 26 LEU HD11 1 1 5 3667 1 1 26 LEU HD12 H 11.321 -11.640 -3.263 1.00 . A A . 26 LEU HD12 1 1 5 3668 1 1 26 LEU HD13 H 12.151 -11.712 -1.708 1.00 . A A . 26 LEU HD13 1 1 5 3669 1 1 26 LEU HD21 H 13.562 -12.087 -4.394 1.00 . A A . 26 LEU HD21 1 1 5 3670 1 1 26 LEU HD22 H 14.920 -11.019 -4.044 1.00 . A A . 26 LEU HD22 1 1 5 3671 1 1 26 LEU HD23 H 14.328 -12.126 -2.806 1.00 . A A . 26 LEU HD23 1 1 5 3672 1 1 26 LEU HG H 13.575 -9.842 -2.380 1.00 . A A . 26 LEU HG 1 1 5 3673 1 1 26 LEU N N 14.509 -7.902 -3.994 1.00 . A A . 26 LEU N 1 1 5 3674 1 1 26 LEU O O 12.782 -8.202 -7.062 1.00 . A A . 26 LEU O 1 1 5 3675 1 1 27 ASP C C 11.358 -5.498 -6.618 1.00 . A A . 27 ASP C 1 1 5 3676 1 1 27 ASP CA C 12.852 -5.433 -6.476 1.00 . A A . 27 ASP CA 1 1 5 3677 1 1 27 ASP CB C 13.566 -5.482 -7.825 1.00 . A A . 27 ASP CB 1 1 5 3678 1 1 27 ASP CG C 13.457 -4.170 -8.576 1.00 . A A . 27 ASP CG 1 1 5 3679 1 1 27 ASP H H 13.505 -6.321 -4.681 1.00 . A A . 27 ASP H 1 1 5 3680 1 1 27 ASP HA H 13.108 -4.508 -5.976 1.00 . A A . 27 ASP HA 1 1 5 3681 1 1 27 ASP HB2 H 14.610 -5.701 -7.655 1.00 . A A . 27 ASP HB2 1 1 5 3682 1 1 27 ASP HB3 H 13.130 -6.263 -8.431 1.00 . A A . 27 ASP HB3 1 1 5 3683 1 1 27 ASP N N 13.255 -6.521 -5.613 1.00 . A A . 27 ASP N 1 1 5 3684 1 1 27 ASP O O 10.801 -5.733 -7.686 1.00 . A A . 27 ASP O 1 1 5 3685 1 1 27 ASP OD1 O 13.641 -3.105 -7.948 1.00 . A A . 27 ASP OD1 1 1 5 3686 1 1 27 ASP OD2 O 13.213 -4.193 -9.801 1.00 . A A . 27 ASP OD2 1 1 5 3687 1 1 28 LYS C C 8.637 -4.057 -5.439 1.00 . A A . 28 LYS C 1 1 5 3688 1 1 28 LYS CA C 9.297 -5.421 -5.340 1.00 . A A . 28 LYS CA 1 1 5 3689 1 1 28 LYS CB C 8.971 -6.087 -4.003 1.00 . A A . 28 LYS CB 1 1 5 3690 1 1 28 LYS CD C 8.784 -8.546 -4.485 1.00 . A A . 28 LYS CD 1 1 5 3691 1 1 28 LYS CE C 7.568 -8.872 -3.634 1.00 . A A . 28 LYS CE 1 1 5 3692 1 1 28 LYS CG C 9.620 -7.451 -3.847 1.00 . A A . 28 LYS CG 1 1 5 3693 1 1 28 LYS H H 11.276 -5.057 -4.687 1.00 . A A . 28 LYS H 1 1 5 3694 1 1 28 LYS HA H 8.940 -6.047 -6.143 1.00 . A A . 28 LYS HA 1 1 5 3695 1 1 28 LYS HB2 H 9.315 -5.447 -3.198 1.00 . A A . 28 LYS HB2 1 1 5 3696 1 1 28 LYS HB3 H 7.902 -6.207 -3.925 1.00 . A A . 28 LYS HB3 1 1 5 3697 1 1 28 LYS HD2 H 8.456 -8.213 -5.458 1.00 . A A . 28 LYS HD2 1 1 5 3698 1 1 28 LYS HD3 H 9.390 -9.435 -4.591 1.00 . A A . 28 LYS HD3 1 1 5 3699 1 1 28 LYS HE2 H 7.022 -7.960 -3.443 1.00 . A A . 28 LYS HE2 1 1 5 3700 1 1 28 LYS HE3 H 6.940 -9.562 -4.175 1.00 . A A . 28 LYS HE3 1 1 5 3701 1 1 28 LYS HG2 H 10.589 -7.432 -4.322 1.00 . A A . 28 LYS HG2 1 1 5 3702 1 1 28 LYS HG3 H 9.736 -7.665 -2.795 1.00 . A A . 28 LYS HG3 1 1 5 3703 1 1 28 LYS HZ1 H 7.132 -9.550 -1.703 1.00 . A A . 28 LYS HZ1 1 1 5 3704 1 1 28 LYS HZ2 H 8.699 -8.912 -1.869 1.00 . A A . 28 LYS HZ2 1 1 5 3705 1 1 28 LYS HZ3 H 8.331 -10.447 -2.497 1.00 . A A . 28 LYS HZ3 1 1 5 3706 1 1 28 LYS N N 10.733 -5.286 -5.490 1.00 . A A . 28 LYS N 1 1 5 3707 1 1 28 LYS NZ N 7.958 -9.486 -2.335 1.00 . A A . 28 LYS NZ 1 1 5 3708 1 1 28 LYS O O 9.315 -3.054 -5.664 1.00 . A A . 28 LYS O 1 1 5 3709 1 1 29 TYR C C 5.158 -3.027 -4.877 1.00 . A A . 29 TYR C 1 1 5 3710 1 1 29 TYR CA C 6.530 -2.824 -5.512 1.00 . A A . 29 TYR CA 1 1 5 3711 1 1 29 TYR CB C 6.400 -2.371 -6.984 1.00 . A A . 29 TYR CB 1 1 5 3712 1 1 29 TYR CD1 C 6.406 -4.480 -8.376 1.00 . A A . 29 TYR CD1 1 1 5 3713 1 1 29 TYR CD2 C 4.405 -3.185 -8.328 1.00 . A A . 29 TYR CD2 1 1 5 3714 1 1 29 TYR CE1 C 5.802 -5.393 -9.217 1.00 . A A . 29 TYR CE1 1 1 5 3715 1 1 29 TYR CE2 C 3.793 -4.096 -9.170 1.00 . A A . 29 TYR CE2 1 1 5 3716 1 1 29 TYR CG C 5.722 -3.360 -7.917 1.00 . A A . 29 TYR CG 1 1 5 3717 1 1 29 TYR CZ C 4.464 -5.144 -9.644 1.00 . A A . 29 TYR CZ 1 1 5 3718 1 1 29 TYR H H 6.863 -4.858 -5.108 1.00 . A A . 29 TYR H 1 1 5 3719 1 1 29 TYR HA H 7.042 -2.050 -4.958 1.00 . A A . 29 TYR HA 1 1 5 3720 1 1 29 TYR HB2 H 5.819 -1.455 -7.011 1.00 . A A . 29 TYR HB2 1 1 5 3721 1 1 29 TYR HB3 H 7.388 -2.171 -7.376 1.00 . A A . 29 TYR HB3 1 1 5 3722 1 1 29 TYR HD1 H 7.429 -4.633 -8.068 1.00 . A A . 29 TYR HD1 1 1 5 3723 1 1 29 TYR HD2 H 3.858 -2.322 -7.982 1.00 . A A . 29 TYR HD2 1 1 5 3724 1 1 29 TYR HE1 H 6.354 -6.255 -9.563 1.00 . A A . 29 TYR HE1 1 1 5 3725 1 1 29 TYR HE2 H 2.768 -3.942 -9.480 1.00 . A A . 29 TYR HE2 1 1 5 3726 1 1 29 TYR HH H 3.296 -5.642 -11.058 1.00 . A A . 29 TYR HH 1 1 5 3727 1 1 29 TYR N N 7.318 -4.043 -5.370 1.00 . A A . 29 TYR N 1 1 5 3728 1 1 29 TYR O O 4.307 -3.738 -5.408 1.00 . A A . 29 TYR O 1 1 5 3729 1 1 29 TYR OH O 3.893 -6.108 -10.449 1.00 . A A . 29 TYR OH 1 1 5 3730 1 1 30 ALA C C 3.603 -1.355 -2.030 1.00 . A A . 30 ALA C 1 1 5 3731 1 1 30 ALA CA C 3.699 -2.495 -3.026 1.00 . A A . 30 ALA CA 1 1 5 3732 1 1 30 ALA CB C 3.492 -3.836 -2.333 1.00 . A A . 30 ALA CB 1 1 5 3733 1 1 30 ALA H H 5.729 -2.004 -3.254 1.00 . A A . 30 ALA H 1 1 5 3734 1 1 30 ALA HA H 2.925 -2.375 -3.769 1.00 . A A . 30 ALA HA 1 1 5 3735 1 1 30 ALA HB1 H 2.504 -3.870 -1.896 1.00 . A A . 30 ALA HB1 1 1 5 3736 1 1 30 ALA HB2 H 3.593 -4.631 -3.058 1.00 . A A . 30 ALA HB2 1 1 5 3737 1 1 30 ALA HB3 H 4.235 -3.960 -1.558 1.00 . A A . 30 ALA HB3 1 1 5 3738 1 1 30 ALA N N 4.976 -2.453 -3.701 1.00 . A A . 30 ALA N 1 1 5 3739 1 1 30 ALA O O 4.616 -0.857 -1.529 1.00 . A A . 30 ALA O 1 1 5 3740 1 1 31 CYS C C 0.841 -0.140 -0.127 1.00 . A A . 31 CYS C 1 1 5 3741 1 1 31 CYS CA C 2.149 0.129 -0.825 1.00 . A A . 31 CYS CA 1 1 5 3742 1 1 31 CYS CB C 2.112 1.484 -1.542 1.00 . A A . 31 CYS CB 1 1 5 3743 1 1 31 CYS H H 1.627 -1.380 -2.183 1.00 . A A . 31 CYS H 1 1 5 3744 1 1 31 CYS HA H 2.947 0.129 -0.096 1.00 . A A . 31 CYS HA 1 1 5 3745 1 1 31 CYS HB2 H 3.073 1.671 -1.993 1.00 . A A . 31 CYS HB2 1 1 5 3746 1 1 31 CYS HB3 H 1.357 1.453 -2.315 1.00 . A A . 31 CYS HB3 1 1 5 3747 1 1 31 CYS N N 2.393 -0.940 -1.756 1.00 . A A . 31 CYS N 1 1 5 3748 1 1 31 CYS O O -0.160 -0.433 -0.773 1.00 . A A . 31 CYS O 1 1 5 3749 1 1 31 CYS SG S 1.729 2.889 -0.445 1.00 . A A . 31 CYS SG 1 1 5 3750 1 1 32 ASN C C -0.951 0.968 2.392 1.00 . A A . 32 ASN C 1 1 5 3751 1 1 32 ASN CA C -0.364 -0.341 1.932 1.00 . A A . 32 ASN CA 1 1 5 3752 1 1 32 ASN CB C -0.064 -1.265 3.108 1.00 . A A . 32 ASN CB 1 1 5 3753 1 1 32 ASN CG C -1.322 -1.861 3.718 1.00 . A A . 32 ASN CG 1 1 5 3754 1 1 32 ASN H H 1.665 0.181 1.658 1.00 . A A . 32 ASN H 1 1 5 3755 1 1 32 ASN HA H -1.067 -0.815 1.271 1.00 . A A . 32 ASN HA 1 1 5 3756 1 1 32 ASN HB2 H 0.566 -2.072 2.760 1.00 . A A . 32 ASN HB2 1 1 5 3757 1 1 32 ASN HB3 H 0.460 -0.708 3.871 1.00 . A A . 32 ASN HB3 1 1 5 3758 1 1 32 ASN HD21 H -1.217 -3.411 2.487 1.00 . A A . 32 ASN HD21 1 1 5 3759 1 1 32 ASN HD22 H -2.547 -3.424 3.595 1.00 . A A . 32 ASN HD22 1 1 5 3760 1 1 32 ASN N N 0.842 -0.072 1.186 1.00 . A A . 32 ASN N 1 1 5 3761 1 1 32 ASN ND2 N -1.735 -3.012 3.212 1.00 . A A . 32 ASN ND2 1 1 5 3762 1 1 32 ASN O O -0.497 1.580 3.348 1.00 . A A . 32 ASN O 1 1 5 3763 1 1 32 ASN OD1 O -1.916 -1.295 4.635 1.00 . A A . 32 ASN OD1 1 1 5 3764 1 1 33 CYS C C -3.645 2.721 2.853 1.00 . A A . 33 CYS C 1 1 5 3765 1 1 33 CYS CA C -2.516 2.694 1.825 1.00 . A A . 33 CYS CA 1 1 5 3766 1 1 33 CYS CB C -2.979 3.111 0.444 1.00 . A A . 33 CYS CB 1 1 5 3767 1 1 33 CYS H H -2.321 0.814 0.978 1.00 . A A . 33 CYS H 1 1 5 3768 1 1 33 CYS HA H -1.731 3.352 2.146 1.00 . A A . 33 CYS HA 1 1 5 3769 1 1 33 CYS HB2 H -2.128 3.098 -0.221 1.00 . A A . 33 CYS HB2 1 1 5 3770 1 1 33 CYS HB3 H -3.699 2.386 0.093 1.00 . A A . 33 CYS HB3 1 1 5 3771 1 1 33 CYS N N -1.960 1.390 1.673 1.00 . A A . 33 CYS N 1 1 5 3772 1 1 33 CYS O O -3.397 2.666 4.057 1.00 . A A . 33 CYS O 1 1 5 3773 1 1 33 CYS SG S -3.733 4.742 0.302 1.00 . A A . 33 CYS SG 1 1 5 3774 1 1 34 VAL C C -6.988 1.782 2.879 1.00 . A A . 34 VAL C 1 1 5 3775 1 1 34 VAL CA C -6.016 2.862 3.277 1.00 . A A . 34 VAL CA 1 1 5 3776 1 1 34 VAL CB C -6.676 4.261 3.191 1.00 . A A . 34 VAL CB 1 1 5 3777 1 1 34 VAL CG1 C -7.235 4.527 1.801 1.00 . A A . 34 VAL CG1 1 1 5 3778 1 1 34 VAL CG2 C -7.760 4.424 4.246 1.00 . A A . 34 VAL CG2 1 1 5 3779 1 1 34 VAL H H -5.046 2.692 1.418 1.00 . A A . 34 VAL H 1 1 5 3780 1 1 34 VAL HA H -5.678 2.690 4.289 1.00 . A A . 34 VAL HA 1 1 5 3781 1 1 34 VAL HB H -5.911 4.995 3.381 1.00 . A A . 34 VAL HB 1 1 5 3782 1 1 34 VAL HG11 H -6.440 4.464 1.073 1.00 . A A . 34 VAL HG11 1 1 5 3783 1 1 34 VAL HG12 H -7.995 3.795 1.572 1.00 . A A . 34 VAL HG12 1 1 5 3784 1 1 34 VAL HG13 H -7.671 5.517 1.774 1.00 . A A . 34 VAL HG13 1 1 5 3785 1 1 34 VAL HG21 H -8.519 3.669 4.101 1.00 . A A . 34 VAL HG21 1 1 5 3786 1 1 34 VAL HG22 H -7.326 4.315 5.227 1.00 . A A . 34 VAL HG22 1 1 5 3787 1 1 34 VAL HG23 H -8.207 5.404 4.154 1.00 . A A . 34 VAL HG23 1 1 5 3788 1 1 34 VAL N N -4.881 2.764 2.387 1.00 . A A . 34 VAL N 1 1 5 3789 1 1 34 VAL O O -7.077 1.465 1.692 1.00 . A A . 34 VAL O 1 1 5 3790 1 1 35 VAL C C -9.780 0.390 2.730 1.00 . A A . 35 VAL C 1 1 5 3791 1 1 35 VAL CA C -8.558 0.047 3.585 1.00 . A A . 35 VAL CA 1 1 5 3792 1 1 35 VAL CB C -9.022 -0.622 4.887 1.00 . A A . 35 VAL CB 1 1 5 3793 1 1 35 VAL CG1 C -7.827 -1.155 5.664 1.00 . A A . 35 VAL CG1 1 1 5 3794 1 1 35 VAL CG2 C -9.837 0.342 5.744 1.00 . A A . 35 VAL CG2 1 1 5 3795 1 1 35 VAL H H -7.620 1.541 4.765 1.00 . A A . 35 VAL H 1 1 5 3796 1 1 35 VAL HA H -7.968 -0.676 3.043 1.00 . A A . 35 VAL HA 1 1 5 3797 1 1 35 VAL HB H -9.651 -1.457 4.615 1.00 . A A . 35 VAL HB 1 1 5 3798 1 1 35 VAL HG11 H -8.169 -1.652 6.560 1.00 . A A . 35 VAL HG11 1 1 5 3799 1 1 35 VAL HG12 H -7.282 -1.857 5.050 1.00 . A A . 35 VAL HG12 1 1 5 3800 1 1 35 VAL HG13 H -7.177 -0.335 5.933 1.00 . A A . 35 VAL HG13 1 1 5 3801 1 1 35 VAL HG21 H -10.715 0.654 5.199 1.00 . A A . 35 VAL HG21 1 1 5 3802 1 1 35 VAL HG22 H -10.134 -0.152 6.656 1.00 . A A . 35 VAL HG22 1 1 5 3803 1 1 35 VAL HG23 H -9.235 1.207 5.983 1.00 . A A . 35 VAL HG23 1 1 5 3804 1 1 35 VAL N N -7.694 1.198 3.844 1.00 . A A . 35 VAL N 1 1 5 3805 1 1 35 VAL O O -10.851 -0.188 2.892 1.00 . A A . 35 VAL O 1 1 5 3806 1 1 36 GLY C C -10.028 1.885 -0.516 1.00 . A A . 36 GLY C 1 1 5 3807 1 1 36 GLY CA C -10.610 1.674 0.857 1.00 . A A . 36 GLY CA 1 1 5 3808 1 1 36 GLY H H -8.674 1.663 1.692 1.00 . A A . 36 GLY H 1 1 5 3809 1 1 36 GLY HA2 H -11.362 0.899 0.813 1.00 . A A . 36 GLY HA2 1 1 5 3810 1 1 36 GLY HA3 H -11.061 2.593 1.198 1.00 . A A . 36 GLY HA3 1 1 5 3811 1 1 36 GLY N N -9.574 1.276 1.780 1.00 . A A . 36 GLY N 1 1 5 3812 1 1 36 GLY O O -10.743 1.908 -1.514 1.00 . A A . 36 GLY O 1 1 5 3813 1 1 37 TYR C C -6.666 1.441 -1.773 1.00 . A A . 37 TYR C 1 1 5 3814 1 1 37 TYR CA C -7.992 2.179 -1.823 1.00 . A A . 37 TYR CA 1 1 5 3815 1 1 37 TYR CB C -7.723 3.658 -2.130 1.00 . A A . 37 TYR CB 1 1 5 3816 1 1 37 TYR CD1 C -9.598 4.330 -3.675 1.00 . A A . 37 TYR CD1 1 1 5 3817 1 1 37 TYR CD2 C -9.480 5.367 -1.532 1.00 . A A . 37 TYR CD2 1 1 5 3818 1 1 37 TYR CE1 C -10.728 5.062 -3.972 1.00 . A A . 37 TYR CE1 1 1 5 3819 1 1 37 TYR CE2 C -10.610 6.104 -1.821 1.00 . A A . 37 TYR CE2 1 1 5 3820 1 1 37 TYR CG C -8.956 4.469 -2.452 1.00 . A A . 37 TYR CG 1 1 5 3821 1 1 37 TYR CZ C -11.218 5.969 -3.042 1.00 . A A . 37 TYR CZ 1 1 5 3822 1 1 37 TYR H H -8.193 2.010 0.277 1.00 . A A . 37 TYR H 1 1 5 3823 1 1 37 TYR HA H -8.602 1.759 -2.608 1.00 . A A . 37 TYR HA 1 1 5 3824 1 1 37 TYR HB2 H -7.249 4.114 -1.275 1.00 . A A . 37 TYR HB2 1 1 5 3825 1 1 37 TYR HB3 H -7.053 3.721 -2.977 1.00 . A A . 37 TYR HB3 1 1 5 3826 1 1 37 TYR HD1 H -9.200 3.632 -4.398 1.00 . A A . 37 TYR HD1 1 1 5 3827 1 1 37 TYR HD2 H -8.988 5.487 -0.575 1.00 . A A . 37 TYR HD2 1 1 5 3828 1 1 37 TYR HE1 H -11.213 4.941 -4.928 1.00 . A A . 37 TYR HE1 1 1 5 3829 1 1 37 TYR HE2 H -11.005 6.798 -1.093 1.00 . A A . 37 TYR HE2 1 1 5 3830 1 1 37 TYR HH H -12.191 7.620 -3.161 1.00 . A A . 37 TYR HH 1 1 5 3831 1 1 37 TYR N N -8.703 2.019 -0.563 1.00 . A A . 37 TYR N 1 1 5 3832 1 1 37 TYR O O -5.771 1.824 -1.022 1.00 . A A . 37 TYR O 1 1 5 3833 1 1 37 TYR OH O -12.362 6.677 -3.336 1.00 . A A . 37 TYR OH 1 1 5 3834 1 1 38 ILE C C -5.128 -0.967 -4.023 1.00 . A A . 38 ILE C 1 1 5 3835 1 1 38 ILE CA C -5.256 -0.297 -2.665 1.00 . A A . 38 ILE CA 1 1 5 3836 1 1 38 ILE CB C -4.998 -1.297 -1.506 1.00 . A A . 38 ILE CB 1 1 5 3837 1 1 38 ILE CD1 C -2.539 -1.657 -2.082 1.00 . A A . 38 ILE CD1 1 1 5 3838 1 1 38 ILE CG1 C -3.546 -1.196 -1.048 1.00 . A A . 38 ILE CG1 1 1 5 3839 1 1 38 ILE CG2 C -5.346 -2.740 -1.867 1.00 . A A . 38 ILE CG2 1 1 5 3840 1 1 38 ILE H H -7.328 0.005 -3.023 1.00 . A A . 38 ILE H 1 1 5 3841 1 1 38 ILE HA H -4.504 0.477 -2.600 1.00 . A A . 38 ILE HA 1 1 5 3842 1 1 38 ILE HB H -5.633 -1.009 -0.684 1.00 . A A . 38 ILE HB 1 1 5 3843 1 1 38 ILE HD11 H -2.612 -1.030 -2.959 1.00 . A A . 38 ILE HD11 1 1 5 3844 1 1 38 ILE HD12 H -1.544 -1.585 -1.670 1.00 . A A . 38 ILE HD12 1 1 5 3845 1 1 38 ILE HD13 H -2.744 -2.682 -2.354 1.00 . A A . 38 ILE HD13 1 1 5 3846 1 1 38 ILE HG12 H -3.335 -0.162 -0.814 1.00 . A A . 38 ILE HG12 1 1 5 3847 1 1 38 ILE HG13 H -3.413 -1.797 -0.160 1.00 . A A . 38 ILE HG13 1 1 5 3848 1 1 38 ILE HG21 H -5.149 -3.380 -1.020 1.00 . A A . 38 ILE HG21 1 1 5 3849 1 1 38 ILE HG22 H -6.390 -2.803 -2.132 1.00 . A A . 38 ILE HG22 1 1 5 3850 1 1 38 ILE HG23 H -4.741 -3.057 -2.705 1.00 . A A . 38 ILE HG23 1 1 5 3851 1 1 38 ILE N N -6.542 0.364 -2.538 1.00 . A A . 38 ILE N 1 1 5 3852 1 1 38 ILE O O -5.943 -1.777 -4.409 1.00 . A A . 38 ILE O 1 1 5 3853 1 1 39 GLY C C -2.514 -0.768 -6.540 1.00 . A A . 39 GLY C 1 1 5 3854 1 1 39 GLY CA C -3.875 -1.157 -6.059 1.00 . A A . 39 GLY CA 1 1 5 3855 1 1 39 GLY H H -3.535 0.141 -4.434 1.00 . A A . 39 GLY H 1 1 5 3856 1 1 39 GLY HA2 H -3.929 -2.233 -5.973 1.00 . A A . 39 GLY HA2 1 1 5 3857 1 1 39 GLY HA3 H -4.613 -0.816 -6.768 1.00 . A A . 39 GLY HA3 1 1 5 3858 1 1 39 GLY N N -4.129 -0.561 -4.768 1.00 . A A . 39 GLY N 1 1 5 3859 1 1 39 GLY O O -2.318 0.370 -6.976 1.00 . A A . 39 GLY O 1 1 5 3860 1 1 40 GLU C C 0.406 -0.537 -5.583 1.00 . A A . 40 GLU C 1 1 5 3861 1 1 40 GLU CA C -0.154 -1.460 -6.652 1.00 . A A . 40 GLU CA 1 1 5 3862 1 1 40 GLU CB C 0.079 -0.875 -8.049 1.00 . A A . 40 GLU CB 1 1 5 3863 1 1 40 GLU CD C 1.746 -0.077 -9.762 1.00 . A A . 40 GLU CD 1 1 5 3864 1 1 40 GLU CG C 1.546 -0.740 -8.417 1.00 . A A . 40 GLU CG 1 1 5 3865 1 1 40 GLU H H -1.843 -2.584 -6.109 1.00 . A A . 40 GLU H 1 1 5 3866 1 1 40 GLU HA H 0.346 -2.404 -6.578 1.00 . A A . 40 GLU HA 1 1 5 3867 1 1 40 GLU HB2 H -0.394 -1.515 -8.778 1.00 . A A . 40 GLU HB2 1 1 5 3868 1 1 40 GLU HB3 H -0.372 0.105 -8.096 1.00 . A A . 40 GLU HB3 1 1 5 3869 1 1 40 GLU HG2 H 2.041 -0.147 -7.662 1.00 . A A . 40 GLU HG2 1 1 5 3870 1 1 40 GLU HG3 H 1.987 -1.725 -8.449 1.00 . A A . 40 GLU HG3 1 1 5 3871 1 1 40 GLU N N -1.573 -1.698 -6.404 1.00 . A A . 40 GLU N 1 1 5 3872 1 1 40 GLU O O 1.444 -0.797 -4.978 1.00 . A A . 40 GLU O 1 1 5 3873 1 1 40 GLU OE1 O 1.343 -0.667 -10.782 1.00 . A A . 40 GLU OE1 1 1 5 3874 1 1 40 GLU OE2 O 2.320 1.031 -9.803 1.00 . A A . 40 GLU OE2 1 1 5 3875 1 1 41 ARG C C -1.128 1.894 -3.489 1.00 . A A . 41 ARG C 1 1 5 3876 1 1 41 ARG CA C 0.049 1.538 -4.408 1.00 . A A . 41 ARG CA 1 1 5 3877 1 1 41 ARG CB C 0.500 2.761 -5.197 1.00 . A A . 41 ARG CB 1 1 5 3878 1 1 41 ARG CD C -0.332 2.908 -7.587 1.00 . A A . 41 ARG CD 1 1 5 3879 1 1 41 ARG CG C -0.588 3.261 -6.135 1.00 . A A . 41 ARG CG 1 1 5 3880 1 1 41 ARG CZ C 0.736 3.979 -9.543 1.00 . A A . 41 ARG CZ 1 1 5 3881 1 1 41 ARG H H -1.164 0.625 -5.846 1.00 . A A . 41 ARG H 1 1 5 3882 1 1 41 ARG HA H 0.869 1.173 -3.814 1.00 . A A . 41 ARG HA 1 1 5 3883 1 1 41 ARG HB2 H 0.760 3.555 -4.509 1.00 . A A . 41 ARG HB2 1 1 5 3884 1 1 41 ARG HB3 H 1.370 2.494 -5.788 1.00 . A A . 41 ARG HB3 1 1 5 3885 1 1 41 ARG HD2 H 0.094 1.915 -7.631 1.00 . A A . 41 ARG HD2 1 1 5 3886 1 1 41 ARG HD3 H -1.281 2.917 -8.109 1.00 . A A . 41 ARG HD3 1 1 5 3887 1 1 41 ARG HE H 1.134 4.421 -7.625 1.00 . A A . 41 ARG HE 1 1 5 3888 1 1 41 ARG HG2 H -1.523 2.798 -5.841 1.00 . A A . 41 ARG HG2 1 1 5 3889 1 1 41 ARG HG3 H -0.668 4.334 -6.040 1.00 . A A . 41 ARG HG3 1 1 5 3890 1 1 41 ARG HH11 H -0.673 2.588 -10.026 1.00 . A A . 41 ARG HH11 1 1 5 3891 1 1 41 ARG HH12 H 0.122 3.347 -11.368 1.00 . A A . 41 ARG HH12 1 1 5 3892 1 1 41 ARG HH21 H 2.162 5.413 -9.399 1.00 . A A . 41 ARG HH21 1 1 5 3893 1 1 41 ARG HH22 H 1.740 4.946 -11.016 1.00 . A A . 41 ARG HH22 1 1 5 3894 1 1 41 ARG N N -0.329 0.520 -5.343 1.00 . A A . 41 ARG N 1 1 5 3895 1 1 41 ARG NE N 0.586 3.849 -8.223 1.00 . A A . 41 ARG NE 1 1 5 3896 1 1 41 ARG NH1 N 0.003 3.250 -10.380 1.00 . A A . 41 ARG NH1 1 1 5 3897 1 1 41 ARG NH2 N 1.614 4.852 -10.026 1.00 . A A . 41 ARG NH2 1 1 5 3898 1 1 41 ARG O O -0.966 1.967 -2.275 1.00 . A A . 41 ARG O 1 1 5 3899 1 1 42 CYS C C -4.535 3.186 -4.337 1.00 . A A . 42 CYS C 1 1 5 3900 1 1 42 CYS CA C -3.484 2.627 -3.373 1.00 . A A . 42 CYS CA 1 1 5 3901 1 1 42 CYS CB C -3.028 3.788 -2.469 1.00 . A A . 42 CYS CB 1 1 5 3902 1 1 42 CYS H H -2.439 1.733 -5.002 1.00 . A A . 42 CYS H 1 1 5 3903 1 1 42 CYS HA H -3.931 1.858 -2.764 1.00 . A A . 42 CYS HA 1 1 5 3904 1 1 42 CYS HB2 H -2.371 3.400 -1.710 1.00 . A A . 42 CYS HB2 1 1 5 3905 1 1 42 CYS HB3 H -2.484 4.502 -3.072 1.00 . A A . 42 CYS HB3 1 1 5 3906 1 1 42 CYS N N -2.327 2.048 -4.081 1.00 . A A . 42 CYS N 1 1 5 3907 1 1 42 CYS O O -4.681 4.402 -4.425 1.00 . A A . 42 CYS O 1 1 5 3908 1 1 42 CYS SG S -4.369 4.695 -1.616 1.00 . A A . 42 CYS SG 1 1 5 3909 1 1 43 GLN C C -7.191 1.747 -6.520 1.00 . A A . 43 GLN C 1 1 5 3910 1 1 43 GLN CA C -6.377 2.860 -5.870 1.00 . A A . 43 GLN CA 1 1 5 3911 1 1 43 GLN CB C -5.851 3.840 -6.923 1.00 . A A . 43 GLN CB 1 1 5 3912 1 1 43 GLN CD C -4.470 4.220 -8.999 1.00 . A A . 43 GLN CD 1 1 5 3913 1 1 43 GLN CG C -4.957 3.208 -7.979 1.00 . A A . 43 GLN CG 1 1 5 3914 1 1 43 GLN H H -5.073 1.375 -5.080 1.00 . A A . 43 GLN H 1 1 5 3915 1 1 43 GLN HA H -7.030 3.402 -5.200 1.00 . A A . 43 GLN HA 1 1 5 3916 1 1 43 GLN HB2 H -6.691 4.303 -7.421 1.00 . A A . 43 GLN HB2 1 1 5 3917 1 1 43 GLN HB3 H -5.278 4.607 -6.406 1.00 . A A . 43 GLN HB3 1 1 5 3918 1 1 43 GLN HE21 H -2.833 4.561 -7.934 1.00 . A A . 43 GLN HE21 1 1 5 3919 1 1 43 GLN HE22 H -2.968 5.456 -9.405 1.00 . A A . 43 GLN HE22 1 1 5 3920 1 1 43 GLN HG2 H -4.098 2.767 -7.494 1.00 . A A . 43 GLN HG2 1 1 5 3921 1 1 43 GLN HG3 H -5.515 2.440 -8.493 1.00 . A A . 43 GLN HG3 1 1 5 3922 1 1 43 GLN N N -5.274 2.339 -5.063 1.00 . A A . 43 GLN N 1 1 5 3923 1 1 43 GLN NE2 N -3.309 4.804 -8.750 1.00 . A A . 43 GLN NE2 1 1 5 3924 1 1 43 GLN O O -7.861 1.965 -7.528 1.00 . A A . 43 GLN O 1 1 5 3925 1 1 43 GLN OE1 O -5.131 4.474 -10.005 1.00 . A A . 43 GLN OE1 1 1 5 3926 1 1 44 TYR C C -8.766 -1.156 -5.328 1.00 . A A . 44 TYR C 1 1 5 3927 1 1 44 TYR CA C -7.939 -0.547 -6.439 1.00 . A A . 44 TYR CA 1 1 5 3928 1 1 44 TYR CB C -7.025 -1.580 -7.116 1.00 . A A . 44 TYR CB 1 1 5 3929 1 1 44 TYR CD1 C -8.116 -2.399 -9.246 1.00 . A A . 44 TYR CD1 1 1 5 3930 1 1 44 TYR CD2 C -8.062 -3.865 -7.370 1.00 . A A . 44 TYR CD2 1 1 5 3931 1 1 44 TYR CE1 C -8.784 -3.356 -9.981 1.00 . A A . 44 TYR CE1 1 1 5 3932 1 1 44 TYR CE2 C -8.728 -4.831 -8.100 1.00 . A A . 44 TYR CE2 1 1 5 3933 1 1 44 TYR CG C -7.742 -2.636 -7.929 1.00 . A A . 44 TYR CG 1 1 5 3934 1 1 44 TYR CZ C -9.033 -4.582 -9.439 1.00 . A A . 44 TYR CZ 1 1 5 3935 1 1 44 TYR H H -6.605 0.431 -5.128 1.00 . A A . 44 TYR H 1 1 5 3936 1 1 44 TYR HA H -8.629 -0.150 -7.165 1.00 . A A . 44 TYR HA 1 1 5 3937 1 1 44 TYR HB2 H -6.349 -1.062 -7.782 1.00 . A A . 44 TYR HB2 1 1 5 3938 1 1 44 TYR HB3 H -6.447 -2.084 -6.356 1.00 . A A . 44 TYR HB3 1 1 5 3939 1 1 44 TYR HD1 H -7.876 -1.445 -9.695 1.00 . A A . 44 TYR HD1 1 1 5 3940 1 1 44 TYR HD2 H -7.779 -4.068 -6.346 1.00 . A A . 44 TYR HD2 1 1 5 3941 1 1 44 TYR HE1 H -9.065 -3.152 -11.004 1.00 . A A . 44 TYR HE1 1 1 5 3942 1 1 44 TYR HE2 H -8.966 -5.781 -7.648 1.00 . A A . 44 TYR HE2 1 1 5 3943 1 1 44 TYR HH H -9.285 -5.662 -10.978 1.00 . A A . 44 TYR HH 1 1 5 3944 1 1 44 TYR N N -7.158 0.564 -5.925 1.00 . A A . 44 TYR N 1 1 5 3945 1 1 44 TYR O O -8.435 -2.188 -4.750 1.00 . A A . 44 TYR O 1 1 5 3946 1 1 44 TYR OH O -9.750 -5.529 -10.140 1.00 . A A . 44 TYR OH 1 1 5 3947 1 1 45 ARG C C -10.342 -1.162 -2.706 1.00 . A A . 45 ARG C 1 1 5 3948 1 1 45 ARG CA C -10.869 -0.965 -4.124 1.00 . A A . 45 ARG CA 1 1 5 3949 1 1 45 ARG CB C -11.448 -2.278 -4.664 1.00 . A A . 45 ARG CB 1 1 5 3950 1 1 45 ARG CD C -11.241 -1.998 -7.169 1.00 . A A . 45 ARG CD 1 1 5 3951 1 1 45 ARG CG C -12.193 -2.118 -5.985 1.00 . A A . 45 ARG CG 1 1 5 3952 1 1 45 ARG CZ C -12.198 -1.921 -9.452 1.00 . A A . 45 ARG CZ 1 1 5 3953 1 1 45 ARG H H -9.984 0.410 -5.464 1.00 . A A . 45 ARG H 1 1 5 3954 1 1 45 ARG HA H -11.660 -0.232 -4.092 1.00 . A A . 45 ARG HA 1 1 5 3955 1 1 45 ARG HB2 H -10.630 -2.971 -4.814 1.00 . A A . 45 ARG HB2 1 1 5 3956 1 1 45 ARG HB3 H -12.130 -2.686 -3.935 1.00 . A A . 45 ARG HB3 1 1 5 3957 1 1 45 ARG HD2 H -10.362 -1.434 -6.855 1.00 . A A . 45 ARG HD2 1 1 5 3958 1 1 45 ARG HD3 H -10.938 -2.991 -7.470 1.00 . A A . 45 ARG HD3 1 1 5 3959 1 1 45 ARG HE H -11.989 -0.346 -8.237 1.00 . A A . 45 ARG HE 1 1 5 3960 1 1 45 ARG HG2 H -12.826 -2.979 -6.135 1.00 . A A . 45 ARG HG2 1 1 5 3961 1 1 45 ARG HG3 H -12.804 -1.228 -5.936 1.00 . A A . 45 ARG HG3 1 1 5 3962 1 1 45 ARG HH11 H -11.782 -3.804 -8.811 1.00 . A A . 45 ARG HH11 1 1 5 3963 1 1 45 ARG HH12 H -12.356 -3.684 -10.452 1.00 . A A . 45 ARG HH12 1 1 5 3964 1 1 45 ARG HH21 H -12.746 -0.193 -10.358 1.00 . A A . 45 ARG HH21 1 1 5 3965 1 1 45 ARG HH22 H -12.921 -1.628 -11.328 1.00 . A A . 45 ARG HH22 1 1 5 3966 1 1 45 ARG N N -9.851 -0.468 -5.032 1.00 . A A . 45 ARG N 1 1 5 3967 1 1 45 ARG NE N -11.856 -1.321 -8.310 1.00 . A A . 45 ARG NE 1 1 5 3968 1 1 45 ARG NH1 N -12.107 -3.238 -9.577 1.00 . A A . 45 ARG NH1 1 1 5 3969 1 1 45 ARG NH2 N -12.659 -1.190 -10.460 1.00 . A A . 45 ARG NH2 1 1 5 3970 1 1 45 ARG O O -9.257 -0.692 -2.334 1.00 . A A . 45 ARG O 1 1 5 3971 1 1 46 ASP C C -10.687 -3.410 -0.078 1.00 . A A . 46 ASP C 1 1 5 3972 1 1 46 ASP CA C -10.921 -1.979 -0.495 1.00 . A A . 46 ASP CA 1 1 5 3973 1 1 46 ASP CB C -12.122 -1.365 0.242 1.00 . A A . 46 ASP CB 1 1 5 3974 1 1 46 ASP CG C -13.438 -1.527 -0.507 1.00 . A A . 46 ASP CG 1 1 5 3975 1 1 46 ASP H H -11.824 -2.438 -2.344 1.00 . A A . 46 ASP H 1 1 5 3976 1 1 46 ASP HA H -10.039 -1.414 -0.250 1.00 . A A . 46 ASP HA 1 1 5 3977 1 1 46 ASP HB2 H -12.225 -1.841 1.204 1.00 . A A . 46 ASP HB2 1 1 5 3978 1 1 46 ASP HB3 H -11.943 -0.308 0.388 1.00 . A A . 46 ASP HB3 1 1 5 3979 1 1 46 ASP N N -11.111 -1.898 -1.929 1.00 . A A . 46 ASP N 1 1 5 3980 1 1 46 ASP O O -11.136 -3.846 0.981 1.00 . A A . 46 ASP O 1 1 5 3981 1 1 46 ASP OD1 O -13.763 -0.669 -1.338 1.00 . A A . 46 ASP OD1 1 1 5 3982 1 1 46 ASP OD2 O -14.153 -2.523 -0.260 1.00 . A A . 46 ASP OD2 1 1 5 3983 1 1 47 LEU C C -9.299 -5.896 0.694 1.00 . A A . 47 LEU C 1 1 5 3984 1 1 47 LEU CA C -9.598 -5.523 -0.755 1.00 . A A . 47 LEU CA 1 1 5 3985 1 1 47 LEU CB C -8.394 -5.874 -1.631 1.00 . A A . 47 LEU CB 1 1 5 3986 1 1 47 LEU CD1 C -7.282 -5.878 -3.876 1.00 . A A . 47 LEU CD1 1 1 5 3987 1 1 47 LEU CD2 C -9.735 -6.322 -3.709 1.00 . A A . 47 LEU CD2 1 1 5 3988 1 1 47 LEU CG C -8.558 -5.555 -3.120 1.00 . A A . 47 LEU CG 1 1 5 3989 1 1 47 LEU H H -9.586 -3.646 -1.723 1.00 . A A . 47 LEU H 1 1 5 3990 1 1 47 LEU HA H -10.444 -6.099 -1.091 1.00 . A A . 47 LEU HA 1 1 5 3991 1 1 47 LEU HB2 H -7.536 -5.331 -1.261 1.00 . A A . 47 LEU HB2 1 1 5 3992 1 1 47 LEU HB3 H -8.199 -6.931 -1.533 1.00 . A A . 47 LEU HB3 1 1 5 3993 1 1 47 LEU HD11 H -6.463 -5.306 -3.465 1.00 . A A . 47 LEU HD11 1 1 5 3994 1 1 47 LEU HD12 H -7.065 -6.933 -3.784 1.00 . A A . 47 LEU HD12 1 1 5 3995 1 1 47 LEU HD13 H -7.408 -5.627 -4.919 1.00 . A A . 47 LEU HD13 1 1 5 3996 1 1 47 LEU HD21 H -10.642 -6.047 -3.188 1.00 . A A . 47 LEU HD21 1 1 5 3997 1 1 47 LEU HD22 H -9.834 -6.078 -4.757 1.00 . A A . 47 LEU HD22 1 1 5 3998 1 1 47 LEU HD23 H -9.566 -7.382 -3.601 1.00 . A A . 47 LEU HD23 1 1 5 3999 1 1 47 LEU HG H -8.755 -4.499 -3.233 1.00 . A A . 47 LEU HG 1 1 5 4000 1 1 47 LEU N N -9.926 -4.106 -0.923 1.00 . A A . 47 LEU N 1 1 5 4001 1 1 47 LEU O O -9.855 -6.853 1.212 1.00 . A A . 47 LEU O 1 1 5 4002 1 1 48 LYS C C -9.042 -5.664 3.707 1.00 . A A . 48 LYS C 1 1 5 4003 1 1 48 LYS CA C -7.940 -5.481 2.668 1.00 . A A . 48 LYS CA 1 1 5 4004 1 1 48 LYS CB C -6.917 -4.452 3.165 1.00 . A A . 48 LYS CB 1 1 5 4005 1 1 48 LYS CD C -6.282 -2.621 1.573 1.00 . A A . 48 LYS CD 1 1 5 4006 1 1 48 LYS CE C -6.555 -1.196 1.133 1.00 . A A . 48 LYS CE 1 1 5 4007 1 1 48 LYS CG C -7.196 -3.031 2.715 1.00 . A A . 48 LYS CG 1 1 5 4008 1 1 48 LYS H H -8.228 -4.245 0.972 1.00 . A A . 48 LYS H 1 1 5 4009 1 1 48 LYS HA H -7.437 -6.429 2.547 1.00 . A A . 48 LYS HA 1 1 5 4010 1 1 48 LYS HB2 H -6.911 -4.462 4.245 1.00 . A A . 48 LYS HB2 1 1 5 4011 1 1 48 LYS HB3 H -5.937 -4.735 2.806 1.00 . A A . 48 LYS HB3 1 1 5 4012 1 1 48 LYS HD2 H -5.256 -2.696 1.900 1.00 . A A . 48 LYS HD2 1 1 5 4013 1 1 48 LYS HD3 H -6.446 -3.285 0.736 1.00 . A A . 48 LYS HD3 1 1 5 4014 1 1 48 LYS HE2 H -6.594 -0.568 2.011 1.00 . A A . 48 LYS HE2 1 1 5 4015 1 1 48 LYS HE3 H -5.749 -0.858 0.491 1.00 . A A . 48 LYS HE3 1 1 5 4016 1 1 48 LYS HG2 H -8.222 -2.963 2.385 1.00 . A A . 48 LYS HG2 1 1 5 4017 1 1 48 LYS HG3 H -7.038 -2.362 3.548 1.00 . A A . 48 LYS HG3 1 1 5 4018 1 1 48 LYS HZ1 H -8.011 -0.068 0.149 1.00 . A A . 48 LYS HZ1 1 1 5 4019 1 1 48 LYS HZ2 H -8.631 -1.399 0.983 1.00 . A A . 48 LYS HZ2 1 1 5 4020 1 1 48 LYS HZ3 H -7.814 -1.623 -0.480 1.00 . A A . 48 LYS HZ3 1 1 5 4021 1 1 48 LYS N N -8.468 -5.107 1.356 1.00 . A A . 48 LYS N 1 1 5 4022 1 1 48 LYS NZ N -7.843 -1.065 0.397 1.00 . A A . 48 LYS NZ 1 1 5 4023 1 1 48 LYS O O -9.237 -6.759 4.227 1.00 . A A . 48 LYS O 1 1 5 4024 1 1 49 TRP C C -12.144 -4.883 4.608 1.00 . A A . 49 TRP C 1 1 5 4025 1 1 49 TRP CA C -10.722 -4.620 5.096 1.00 . A A . 49 TRP CA 1 1 5 4026 1 1 49 TRP CB C -10.664 -3.300 5.869 1.00 . A A . 49 TRP CB 1 1 5 4027 1 1 49 TRP CD1 C -11.686 -4.034 8.099 1.00 . A A . 49 TRP CD1 1 1 5 4028 1 1 49 TRP CD2 C -12.680 -2.251 7.175 1.00 . A A . 49 TRP CD2 1 1 5 4029 1 1 49 TRP CE2 C -13.332 -2.550 8.386 1.00 . A A . 49 TRP CE2 1 1 5 4030 1 1 49 TRP CE3 C -13.132 -1.166 6.417 1.00 . A A . 49 TRP CE3 1 1 5 4031 1 1 49 TRP CG C -11.634 -3.216 7.008 1.00 . A A . 49 TRP CG 1 1 5 4032 1 1 49 TRP CH2 C -14.829 -0.744 8.097 1.00 . A A . 49 TRP CH2 1 1 5 4033 1 1 49 TRP CZ2 C -14.409 -1.802 8.858 1.00 . A A . 49 TRP CZ2 1 1 5 4034 1 1 49 TRP CZ3 C -14.200 -0.422 6.887 1.00 . A A . 49 TRP CZ3 1 1 5 4035 1 1 49 TRP H H -9.633 -3.774 3.498 1.00 . A A . 49 TRP H 1 1 5 4036 1 1 49 TRP HA H -10.436 -5.419 5.762 1.00 . A A . 49 TRP HA 1 1 5 4037 1 1 49 TRP HB2 H -9.671 -3.174 6.272 1.00 . A A . 49 TRP HB2 1 1 5 4038 1 1 49 TRP HB3 H -10.876 -2.486 5.189 1.00 . A A . 49 TRP HB3 1 1 5 4039 1 1 49 TRP HD1 H -11.023 -4.869 8.267 1.00 . A A . 49 TRP HD1 1 1 5 4040 1 1 49 TRP HE1 H -12.948 -4.081 9.783 1.00 . A A . 49 TRP HE1 1 1 5 4041 1 1 49 TRP HE3 H -12.659 -0.901 5.484 1.00 . A A . 49 TRP HE3 1 1 5 4042 1 1 49 TRP HH2 H -15.660 -0.137 8.425 1.00 . A A . 49 TRP HH2 1 1 5 4043 1 1 49 TRP HZ2 H -14.903 -2.037 9.791 1.00 . A A . 49 TRP HZ2 1 1 5 4044 1 1 49 TRP HZ3 H -14.561 0.420 6.317 1.00 . A A . 49 TRP HZ3 1 1 5 4045 1 1 49 TRP N N -9.756 -4.594 4.009 1.00 . A A . 49 TRP N 1 1 5 4046 1 1 49 TRP NE1 N -12.708 -3.644 8.930 1.00 . A A . 49 TRP NE1 1 1 5 4047 1 1 49 TRP O O -12.880 -5.652 5.218 1.00 . A A . 49 TRP O 1 1 5 4048 1 1 50 TRP C C -14.273 -5.249 2.065 1.00 . A A . 50 TRP C 1 1 5 4049 1 1 50 TRP CA C -13.943 -4.217 3.150 1.00 . A A . 50 TRP CA 1 1 5 4050 1 1 50 TRP CB C -14.344 -2.806 2.724 1.00 . A A . 50 TRP CB 1 1 5 4051 1 1 50 TRP CD1 C -16.635 -2.254 1.742 1.00 . A A . 50 TRP CD1 1 1 5 4052 1 1 50 TRP CD2 C -16.650 -2.611 3.947 1.00 . A A . 50 TRP CD2 1 1 5 4053 1 1 50 TRP CE2 C -17.961 -2.315 3.534 1.00 . A A . 50 TRP CE2 1 1 5 4054 1 1 50 TRP CE3 C -16.415 -2.874 5.299 1.00 . A A . 50 TRP CE3 1 1 5 4055 1 1 50 TRP CG C -15.818 -2.564 2.784 1.00 . A A . 50 TRP CG 1 1 5 4056 1 1 50 TRP CH2 C -18.773 -2.537 5.738 1.00 . A A . 50 TRP CH2 1 1 5 4057 1 1 50 TRP CZ2 C -19.032 -2.275 4.423 1.00 . A A . 50 TRP CZ2 1 1 5 4058 1 1 50 TRP CZ3 C -17.479 -2.836 6.179 1.00 . A A . 50 TRP CZ3 1 1 5 4059 1 1 50 TRP H H -11.880 -3.777 2.963 1.00 . A A . 50 TRP H 1 1 5 4060 1 1 50 TRP HA H -14.508 -4.475 4.035 1.00 . A A . 50 TRP HA 1 1 5 4061 1 1 50 TRP HB2 H -13.863 -2.092 3.374 1.00 . A A . 50 TRP HB2 1 1 5 4062 1 1 50 TRP HB3 H -14.019 -2.639 1.708 1.00 . A A . 50 TRP HB3 1 1 5 4063 1 1 50 TRP HD1 H -16.303 -2.143 0.722 1.00 . A A . 50 TRP HD1 1 1 5 4064 1 1 50 TRP HE1 H -18.693 -1.873 1.617 1.00 . A A . 50 TRP HE1 1 1 5 4065 1 1 50 TRP HE3 H -15.425 -3.107 5.659 1.00 . A A . 50 TRP HE3 1 1 5 4066 1 1 50 TRP HH2 H -19.574 -2.518 6.462 1.00 . A A . 50 TRP HH2 1 1 5 4067 1 1 50 TRP HZ2 H -20.036 -2.048 4.097 1.00 . A A . 50 TRP HZ2 1 1 5 4068 1 1 50 TRP HZ3 H -17.314 -3.039 7.228 1.00 . A A . 50 TRP HZ3 1 1 5 4069 1 1 50 TRP N N -12.539 -4.230 3.527 1.00 . A A . 50 TRP N 1 1 5 4070 1 1 50 TRP NE1 N -17.923 -2.101 2.183 1.00 . A A . 50 TRP NE1 1 1 5 4071 1 1 50 TRP O O -15.246 -5.995 2.191 1.00 . A A . 50 TRP O 1 1 5 4072 1 1 51 GLU C C -13.548 -7.641 0.263 1.00 . A A . 51 GLU C 1 1 5 4073 1 1 51 GLU CA C -13.733 -6.187 -0.125 1.00 . A A . 51 GLU CA 1 1 5 4074 1 1 51 GLU CB C -12.810 -5.858 -1.306 1.00 . A A . 51 GLU CB 1 1 5 4075 1 1 51 GLU CD C -14.573 -4.935 -2.841 1.00 . A A . 51 GLU CD 1 1 5 4076 1 1 51 GLU CG C -13.259 -4.679 -2.130 1.00 . A A . 51 GLU CG 1 1 5 4077 1 1 51 GLU H H -12.662 -4.735 0.989 1.00 . A A . 51 GLU H 1 1 5 4078 1 1 51 GLU HA H -14.756 -6.035 -0.428 1.00 . A A . 51 GLU HA 1 1 5 4079 1 1 51 GLU HB2 H -11.828 -5.625 -0.924 1.00 . A A . 51 GLU HB2 1 1 5 4080 1 1 51 GLU HB3 H -12.744 -6.722 -1.950 1.00 . A A . 51 GLU HB3 1 1 5 4081 1 1 51 GLU HG2 H -13.365 -3.829 -1.471 1.00 . A A . 51 GLU HG2 1 1 5 4082 1 1 51 GLU HG3 H -12.501 -4.466 -2.868 1.00 . A A . 51 GLU HG3 1 1 5 4083 1 1 51 GLU N N -13.462 -5.300 1.007 1.00 . A A . 51 GLU N 1 1 5 4084 1 1 51 GLU O O -14.496 -8.429 0.275 1.00 . A A . 51 GLU O 1 1 5 4085 1 1 51 GLU OE1 O -15.607 -5.055 -2.154 1.00 . A A . 51 GLU OE1 1 1 5 4086 1 1 51 GLU OE2 O -14.587 -5.015 -4.087 1.00 . A A . 51 GLU OE2 1 1 5 4087 1 1 52 LEU C C -12.212 -9.608 2.380 1.00 . A A . 52 LEU C 1 1 5 4088 1 1 52 LEU CA C -11.984 -9.358 0.903 1.00 . A A . 52 LEU CA 1 1 5 4089 1 1 52 LEU CB C -10.528 -9.628 0.550 1.00 . A A . 52 LEU CB 1 1 5 4090 1 1 52 LEU CD1 C -8.642 -9.504 -1.095 1.00 . A A . 52 LEU CD1 1 1 5 4091 1 1 52 LEU CD2 C -10.965 -9.936 -1.907 1.00 . A A . 52 LEU CD2 1 1 5 4092 1 1 52 LEU CG C -10.118 -9.217 -0.866 1.00 . A A . 52 LEU CG 1 1 5 4093 1 1 52 LEU H H -11.618 -7.295 0.602 1.00 . A A . 52 LEU H 1 1 5 4094 1 1 52 LEU HA H -12.622 -10.007 0.331 1.00 . A A . 52 LEU HA 1 1 5 4095 1 1 52 LEU HB2 H -9.911 -9.083 1.250 1.00 . A A . 52 LEU HB2 1 1 5 4096 1 1 52 LEU HB3 H -10.336 -10.684 0.668 1.00 . A A . 52 LEU HB3 1 1 5 4097 1 1 52 LEU HD11 H -8.458 -10.562 -0.969 1.00 . A A . 52 LEU HD11 1 1 5 4098 1 1 52 LEU HD12 H -8.370 -9.209 -2.096 1.00 . A A . 52 LEU HD12 1 1 5 4099 1 1 52 LEU HD13 H -8.051 -8.949 -0.380 1.00 . A A . 52 LEU HD13 1 1 5 4100 1 1 52 LEU HD21 H -10.844 -11.003 -1.795 1.00 . A A . 52 LEU HD21 1 1 5 4101 1 1 52 LEU HD22 H -12.004 -9.675 -1.770 1.00 . A A . 52 LEU HD22 1 1 5 4102 1 1 52 LEU HD23 H -10.647 -9.639 -2.895 1.00 . A A . 52 LEU HD23 1 1 5 4103 1 1 52 LEU HG H -10.277 -8.148 -0.978 1.00 . A A . 52 LEU HG 1 1 5 4104 1 1 52 LEU N N -12.322 -7.986 0.578 1.00 . A A . 52 LEU N 1 1 5 4105 1 1 52 LEU O O -12.759 -10.639 2.770 1.00 . A A . 52 LEU O 1 1 5 4106 1 1 53 ARG C C -11.147 -9.900 5.192 1.00 . A A . 53 ARG C 1 1 5 4107 1 1 53 ARG CA C -11.901 -8.691 4.636 1.00 . A A . 53 ARG CA 1 1 5 4108 1 1 53 ARG CB C -13.366 -8.707 5.082 1.00 . A A . 53 ARG CB 1 1 5 4109 1 1 53 ARG CD C -14.999 -8.451 6.972 1.00 . A A . 53 ARG CD 1 1 5 4110 1 1 53 ARG CG C -13.544 -8.658 6.591 1.00 . A A . 53 ARG CG 1 1 5 4111 1 1 53 ARG CZ C -16.064 -7.844 9.121 1.00 . A A . 53 ARG CZ 1 1 5 4112 1 1 53 ARG H H -11.423 -7.826 2.761 1.00 . A A . 53 ARG H 1 1 5 4113 1 1 53 ARG HA H -11.434 -7.795 5.023 1.00 . A A . 53 ARG HA 1 1 5 4114 1 1 53 ARG HB2 H -13.871 -7.854 4.656 1.00 . A A . 53 ARG HB2 1 1 5 4115 1 1 53 ARG HB3 H -13.830 -9.610 4.717 1.00 . A A . 53 ARG HB3 1 1 5 4116 1 1 53 ARG HD2 H -15.302 -7.460 6.665 1.00 . A A . 53 ARG HD2 1 1 5 4117 1 1 53 ARG HD3 H -15.602 -9.186 6.460 1.00 . A A . 53 ARG HD3 1 1 5 4118 1 1 53 ARG HE H -14.696 -9.292 8.877 1.00 . A A . 53 ARG HE 1 1 5 4119 1 1 53 ARG HG2 H -13.197 -9.588 7.015 1.00 . A A . 53 ARG HG2 1 1 5 4120 1 1 53 ARG HG3 H -12.956 -7.840 6.984 1.00 . A A . 53 ARG HG3 1 1 5 4121 1 1 53 ARG HH11 H -16.552 -6.615 7.583 1.00 . A A . 53 ARG HH11 1 1 5 4122 1 1 53 ARG HH12 H -17.362 -6.276 9.085 1.00 . A A . 53 ARG HH12 1 1 5 4123 1 1 53 ARG HH21 H -15.741 -8.839 10.856 1.00 . A A . 53 ARG HH21 1 1 5 4124 1 1 53 ARG HH22 H -16.897 -7.544 10.953 1.00 . A A . 53 ARG HH22 1 1 5 4125 1 1 53 ARG N N -11.804 -8.629 3.177 1.00 . A A . 53 ARG N 1 1 5 4126 1 1 53 ARG NE N -15.209 -8.585 8.414 1.00 . A A . 53 ARG NE 1 1 5 4127 1 1 53 ARG NH1 N -16.711 -6.832 8.550 1.00 . A A . 53 ARG NH1 1 1 5 4128 1 1 53 ARG NH2 N -16.245 -8.095 10.411 1.00 . A A . 53 ARG NH2 1 1 5 4129 1 1 53 ARG O O -11.741 -10.993 5.296 1.00 . A A . 53 ARG O 1 1 5 4130 1 1 53 ARG OXT O -9.955 -9.747 5.533 1.00 . A A . 53 ARG OXT 1 1 6 4131 1 1 1 ASN C C 16.515 -5.854 2.531 1.00 . A A . 1 ASN C 1 1 6 4132 1 1 1 ASN CA C 17.409 -4.802 1.890 1.00 . A A . 1 ASN CA 1 1 6 4133 1 1 1 ASN CB C 18.380 -5.467 0.898 1.00 . A A . 1 ASN CB 1 1 6 4134 1 1 1 ASN CG C 19.223 -6.568 1.532 1.00 . A A . 1 ASN CG 1 1 6 4135 1 1 1 ASN H1 H 17.495 -3.627 3.609 1.00 . A A . 1 ASN H1 1 1 6 4136 1 1 1 ASN H2 H 18.737 -3.319 2.502 1.00 . A A . 1 ASN H2 1 1 6 4137 1 1 1 ASN H3 H 18.780 -4.717 3.456 1.00 . A A . 1 ASN H3 1 1 6 4138 1 1 1 ASN HA H 16.787 -4.096 1.359 1.00 . A A . 1 ASN HA 1 1 6 4139 1 1 1 ASN HB2 H 17.814 -5.901 0.088 1.00 . A A . 1 ASN HB2 1 1 6 4140 1 1 1 ASN HB3 H 19.048 -4.716 0.498 1.00 . A A . 1 ASN HB3 1 1 6 4141 1 1 1 ASN HD21 H 19.416 -7.479 -0.224 1.00 . A A . 1 ASN HD21 1 1 6 4142 1 1 1 ASN HD22 H 20.183 -8.251 1.120 1.00 . A A . 1 ASN HD22 1 1 6 4143 1 1 1 ASN N N 18.157 -4.068 2.936 1.00 . A A . 1 ASN N 1 1 6 4144 1 1 1 ASN ND2 N 19.651 -7.528 0.731 1.00 . A A . 1 ASN ND2 1 1 6 4145 1 1 1 ASN O O 16.727 -6.225 3.686 1.00 . A A . 1 ASN O 1 1 6 4146 1 1 1 ASN OD1 O 19.507 -6.543 2.729 1.00 . A A . 1 ASN OD1 1 1 6 4147 1 1 2 SER C C 13.644 -6.783 3.304 1.00 . A A . 2 SER C 1 1 6 4148 1 1 2 SER CA C 14.582 -7.338 2.233 1.00 . A A . 2 SER CA 1 1 6 4149 1 1 2 SER CB C 15.341 -8.567 2.753 1.00 . A A . 2 SER CB 1 1 6 4150 1 1 2 SER H H 15.379 -5.919 0.889 1.00 . A A . 2 SER H 1 1 6 4151 1 1 2 SER HA H 13.985 -7.635 1.381 1.00 . A A . 2 SER HA 1 1 6 4152 1 1 2 SER HB2 H 16.085 -8.861 2.028 1.00 . A A . 2 SER HB2 1 1 6 4153 1 1 2 SER HB3 H 15.827 -8.316 3.684 1.00 . A A . 2 SER HB3 1 1 6 4154 1 1 2 SER HG H 13.722 -9.609 2.350 1.00 . A A . 2 SER HG 1 1 6 4155 1 1 2 SER N N 15.512 -6.306 1.778 1.00 . A A . 2 SER N 1 1 6 4156 1 1 2 SER O O 13.968 -6.785 4.495 1.00 . A A . 2 SER O 1 1 6 4157 1 1 2 SER OG O 14.467 -9.662 2.975 1.00 . A A . 2 SER OG 1 1 6 4158 1 1 3 ASP C C 12.109 -4.610 4.584 1.00 . A A . 3 ASP C 1 1 6 4159 1 1 3 ASP CA C 11.473 -5.708 3.736 1.00 . A A . 3 ASP CA 1 1 6 4160 1 1 3 ASP CB C 10.810 -6.772 4.613 1.00 . A A . 3 ASP CB 1 1 6 4161 1 1 3 ASP CG C 9.625 -6.240 5.404 1.00 . A A . 3 ASP CG 1 1 6 4162 1 1 3 ASP H H 12.270 -6.409 1.899 1.00 . A A . 3 ASP H 1 1 6 4163 1 1 3 ASP HA H 10.722 -5.259 3.103 1.00 . A A . 3 ASP HA 1 1 6 4164 1 1 3 ASP HB2 H 10.466 -7.572 3.982 1.00 . A A . 3 ASP HB2 1 1 6 4165 1 1 3 ASP HB3 H 11.540 -7.159 5.309 1.00 . A A . 3 ASP HB3 1 1 6 4166 1 1 3 ASP N N 12.475 -6.321 2.857 1.00 . A A . 3 ASP N 1 1 6 4167 1 1 3 ASP O O 12.099 -4.650 5.817 1.00 . A A . 3 ASP O 1 1 6 4168 1 1 3 ASP OD1 O 8.622 -5.821 4.783 1.00 . A A . 3 ASP OD1 1 1 6 4169 1 1 3 ASP OD2 O 9.685 -6.254 6.652 1.00 . A A . 3 ASP OD2 1 1 6 4170 1 1 4 SER C C 12.375 -1.443 4.946 1.00 . A A . 4 SER C 1 1 6 4171 1 1 4 SER CA C 13.365 -2.530 4.541 1.00 . A A . 4 SER CA 1 1 6 4172 1 1 4 SER CB C 14.418 -1.962 3.591 1.00 . A A . 4 SER CB 1 1 6 4173 1 1 4 SER H H 12.665 -3.684 2.923 1.00 . A A . 4 SER H 1 1 6 4174 1 1 4 SER HA H 13.857 -2.904 5.427 1.00 . A A . 4 SER HA 1 1 6 4175 1 1 4 SER HB2 H 13.938 -1.597 2.697 1.00 . A A . 4 SER HB2 1 1 6 4176 1 1 4 SER HB3 H 14.945 -1.155 4.076 1.00 . A A . 4 SER HB3 1 1 6 4177 1 1 4 SER HG H 15.614 -3.447 4.034 1.00 . A A . 4 SER HG 1 1 6 4178 1 1 4 SER N N 12.687 -3.644 3.898 1.00 . A A . 4 SER N 1 1 6 4179 1 1 4 SER O O 11.275 -1.350 4.397 1.00 . A A . 4 SER O 1 1 6 4180 1 1 4 SER OG O 15.350 -2.968 3.231 1.00 . A A . 4 SER OG 1 1 6 4181 1 1 5 GLU C C 11.772 1.527 5.366 1.00 . A A . 5 GLU C 1 1 6 4182 1 1 5 GLU CA C 11.954 0.450 6.424 1.00 . A A . 5 GLU CA 1 1 6 4183 1 1 5 GLU CB C 12.594 1.067 7.663 1.00 . A A . 5 GLU CB 1 1 6 4184 1 1 5 GLU CD C 13.499 0.721 9.980 1.00 . A A . 5 GLU CD 1 1 6 4185 1 1 5 GLU CG C 12.742 0.105 8.827 1.00 . A A . 5 GLU CG 1 1 6 4186 1 1 5 GLU H H 13.671 -0.781 6.316 1.00 . A A . 5 GLU H 1 1 6 4187 1 1 5 GLU HA H 10.988 0.047 6.686 1.00 . A A . 5 GLU HA 1 1 6 4188 1 1 5 GLU HB2 H 13.575 1.431 7.400 1.00 . A A . 5 GLU HB2 1 1 6 4189 1 1 5 GLU HB3 H 11.988 1.899 7.987 1.00 . A A . 5 GLU HB3 1 1 6 4190 1 1 5 GLU HG2 H 11.759 -0.177 9.172 1.00 . A A . 5 GLU HG2 1 1 6 4191 1 1 5 GLU HG3 H 13.275 -0.771 8.490 1.00 . A A . 5 GLU HG3 1 1 6 4192 1 1 5 GLU N N 12.779 -0.638 5.920 1.00 . A A . 5 GLU N 1 1 6 4193 1 1 5 GLU O O 12.711 1.868 4.643 1.00 . A A . 5 GLU O 1 1 6 4194 1 1 5 GLU OE1 O 12.855 1.339 10.852 1.00 . A A . 5 GLU OE1 1 1 6 4195 1 1 5 GLU OE2 O 14.739 0.582 10.027 1.00 . A A . 5 GLU OE2 1 1 6 4196 1 1 6 CYS C C 9.796 4.352 5.107 1.00 . A A . 6 CYS C 1 1 6 4197 1 1 6 CYS CA C 10.265 3.118 4.343 1.00 . A A . 6 CYS CA 1 1 6 4198 1 1 6 CYS CB C 9.187 2.636 3.373 1.00 . A A . 6 CYS CB 1 1 6 4199 1 1 6 CYS H H 9.874 1.767 5.913 1.00 . A A . 6 CYS H 1 1 6 4200 1 1 6 CYS HA H 11.164 3.358 3.797 1.00 . A A . 6 CYS HA 1 1 6 4201 1 1 6 CYS HB2 H 9.316 1.579 3.200 1.00 . A A . 6 CYS HB2 1 1 6 4202 1 1 6 CYS HB3 H 8.216 2.803 3.818 1.00 . A A . 6 CYS HB3 1 1 6 4203 1 1 6 CYS N N 10.573 2.070 5.294 1.00 . A A . 6 CYS N 1 1 6 4204 1 1 6 CYS O O 8.729 4.334 5.723 1.00 . A A . 6 CYS O 1 1 6 4205 1 1 6 CYS SG S 9.195 3.455 1.746 1.00 . A A . 6 CYS SG 1 1 6 4206 1 1 7 PRO C C 9.161 7.452 5.429 1.00 . A A . 7 PRO C 1 1 6 4207 1 1 7 PRO CA C 10.356 6.626 5.913 1.00 . A A . 7 PRO CA 1 1 6 4208 1 1 7 PRO CB C 11.655 7.420 5.775 1.00 . A A . 7 PRO CB 1 1 6 4209 1 1 7 PRO CD C 11.830 5.556 4.289 1.00 . A A . 7 PRO CD 1 1 6 4210 1 1 7 PRO CG C 12.222 6.996 4.466 1.00 . A A . 7 PRO CG 1 1 6 4211 1 1 7 PRO HA H 10.204 6.368 6.951 1.00 . A A . 7 PRO HA 1 1 6 4212 1 1 7 PRO HB2 H 11.437 8.479 5.786 1.00 . A A . 7 PRO HB2 1 1 6 4213 1 1 7 PRO HB3 H 12.319 7.176 6.589 1.00 . A A . 7 PRO HB3 1 1 6 4214 1 1 7 PRO HD2 H 11.626 5.347 3.250 1.00 . A A . 7 PRO HD2 1 1 6 4215 1 1 7 PRO HD3 H 12.605 4.905 4.662 1.00 . A A . 7 PRO HD3 1 1 6 4216 1 1 7 PRO HG2 H 11.805 7.598 3.672 1.00 . A A . 7 PRO HG2 1 1 6 4217 1 1 7 PRO HG3 H 13.299 7.091 4.483 1.00 . A A . 7 PRO HG3 1 1 6 4218 1 1 7 PRO N N 10.605 5.427 5.098 1.00 . A A . 7 PRO N 1 1 6 4219 1 1 7 PRO O O 8.328 6.939 4.684 1.00 . A A . 7 PRO O 1 1 6 4220 1 1 8 LEU C C 7.487 9.568 4.073 1.00 . A A . 8 LEU C 1 1 6 4221 1 1 8 LEU CA C 7.950 9.616 5.539 1.00 . A A . 8 LEU CA 1 1 6 4222 1 1 8 LEU CB C 8.318 11.055 5.913 1.00 . A A . 8 LEU CB 1 1 6 4223 1 1 8 LEU CD1 C 6.070 11.718 6.811 1.00 . A A . 8 LEU CD1 1 1 6 4224 1 1 8 LEU CD2 C 7.700 13.474 6.091 1.00 . A A . 8 LEU CD2 1 1 6 4225 1 1 8 LEU CG C 7.176 12.070 5.831 1.00 . A A . 8 LEU CG 1 1 6 4226 1 1 8 LEU H H 9.875 9.108 6.288 1.00 . A A . 8 LEU H 1 1 6 4227 1 1 8 LEU HA H 7.135 9.294 6.167 1.00 . A A . 8 LEU HA 1 1 6 4228 1 1 8 LEU HB2 H 8.696 11.053 6.924 1.00 . A A . 8 LEU HB2 1 1 6 4229 1 1 8 LEU HB3 H 9.109 11.382 5.254 1.00 . A A . 8 LEU HB3 1 1 6 4230 1 1 8 LEU HD11 H 5.286 12.456 6.752 1.00 . A A . 8 LEU HD11 1 1 6 4231 1 1 8 LEU HD12 H 5.671 10.744 6.565 1.00 . A A . 8 LEU HD12 1 1 6 4232 1 1 8 LEU HD13 H 6.472 11.697 7.814 1.00 . A A . 8 LEU HD13 1 1 6 4233 1 1 8 LEU HD21 H 8.416 13.737 5.327 1.00 . A A . 8 LEU HD21 1 1 6 4234 1 1 8 LEU HD22 H 6.879 14.176 6.070 1.00 . A A . 8 LEU HD22 1 1 6 4235 1 1 8 LEU HD23 H 8.178 13.507 7.058 1.00 . A A . 8 LEU HD23 1 1 6 4236 1 1 8 LEU HG H 6.757 12.050 4.834 1.00 . A A . 8 LEU HG 1 1 6 4237 1 1 8 LEU N N 9.106 8.732 5.810 1.00 . A A . 8 LEU N 1 1 6 4238 1 1 8 LEU O O 6.341 9.879 3.750 1.00 . A A . 8 LEU O 1 1 6 4239 1 1 9 SER C C 7.070 8.017 1.491 1.00 . A A . 9 SER C 1 1 6 4240 1 1 9 SER CA C 8.128 9.061 1.789 1.00 . A A . 9 SER CA 1 1 6 4241 1 1 9 SER CB C 9.429 8.720 1.059 1.00 . A A . 9 SER CB 1 1 6 4242 1 1 9 SER H H 9.185 8.745 3.543 1.00 . A A . 9 SER H 1 1 6 4243 1 1 9 SER HA H 7.776 10.030 1.467 1.00 . A A . 9 SER HA 1 1 6 4244 1 1 9 SER HB2 H 9.698 7.697 1.270 1.00 . A A . 9 SER HB2 1 1 6 4245 1 1 9 SER HB3 H 9.287 8.845 -0.005 1.00 . A A . 9 SER HB3 1 1 6 4246 1 1 9 SER HG H 10.728 10.169 0.760 1.00 . A A . 9 SER HG 1 1 6 4247 1 1 9 SER N N 8.370 9.111 3.208 1.00 . A A . 9 SER N 1 1 6 4248 1 1 9 SER O O 6.478 8.017 0.426 1.00 . A A . 9 SER O 1 1 6 4249 1 1 9 SER OG O 10.486 9.569 1.485 1.00 . A A . 9 SER OG 1 1 6 4250 1 1 10 HIS C C 4.427 6.834 2.120 1.00 . A A . 10 HIS C 1 1 6 4251 1 1 10 HIS CA C 5.764 6.141 2.302 1.00 . A A . 10 HIS CA 1 1 6 4252 1 1 10 HIS CB C 5.704 5.162 3.507 1.00 . A A . 10 HIS CB 1 1 6 4253 1 1 10 HIS CD2 C 6.066 5.992 5.961 1.00 . A A . 10 HIS CD2 1 1 6 4254 1 1 10 HIS CE1 C 4.019 6.588 6.422 1.00 . A A . 10 HIS CE1 1 1 6 4255 1 1 10 HIS CG C 5.324 5.757 4.850 1.00 . A A . 10 HIS CG 1 1 6 4256 1 1 10 HIS H H 7.358 7.146 3.277 1.00 . A A . 10 HIS H 1 1 6 4257 1 1 10 HIS HA H 5.991 5.586 1.403 1.00 . A A . 10 HIS HA 1 1 6 4258 1 1 10 HIS HB2 H 4.982 4.392 3.285 1.00 . A A . 10 HIS HB2 1 1 6 4259 1 1 10 HIS HB3 H 6.676 4.699 3.619 1.00 . A A . 10 HIS HB3 1 1 6 4260 1 1 10 HIS HD1 H 3.246 6.067 4.600 1.00 . A A . 10 HIS HD1 1 1 6 4261 1 1 10 HIS HD2 H 7.124 5.801 6.071 1.00 . A A . 10 HIS HD2 1 1 6 4262 1 1 10 HIS HE1 H 3.146 6.950 6.947 1.00 . A A . 10 HIS HE1 1 1 6 4263 1 1 10 HIS HE2 H 5.449 6.573 7.880 1.00 . A A . 10 HIS HE2 1 1 6 4264 1 1 10 HIS N N 6.816 7.134 2.456 1.00 . A A . 10 HIS N 1 1 6 4265 1 1 10 HIS ND1 N 4.042 6.141 5.182 1.00 . A A . 10 HIS ND1 1 1 6 4266 1 1 10 HIS NE2 N 5.231 6.506 6.920 1.00 . A A . 10 HIS NE2 1 1 6 4267 1 1 10 HIS O O 3.535 6.351 1.433 1.00 . A A . 10 HIS O 1 1 6 4268 1 1 11 ASP C C 3.090 9.776 1.629 1.00 . A A . 11 ASP C 1 1 6 4269 1 1 11 ASP CA C 3.120 8.768 2.767 1.00 . A A . 11 ASP CA 1 1 6 4270 1 1 11 ASP CB C 3.105 9.435 4.129 1.00 . A A . 11 ASP CB 1 1 6 4271 1 1 11 ASP CG C 1.869 10.280 4.409 1.00 . A A . 11 ASP CG 1 1 6 4272 1 1 11 ASP H H 5.143 8.369 3.139 1.00 . A A . 11 ASP H 1 1 6 4273 1 1 11 ASP HA H 2.278 8.097 2.683 1.00 . A A . 11 ASP HA 1 1 6 4274 1 1 11 ASP HB2 H 3.173 8.644 4.866 1.00 . A A . 11 ASP HB2 1 1 6 4275 1 1 11 ASP HB3 H 3.978 10.067 4.214 1.00 . A A . 11 ASP HB3 1 1 6 4276 1 1 11 ASP N N 4.340 7.998 2.715 1.00 . A A . 11 ASP N 1 1 6 4277 1 1 11 ASP O O 2.038 10.287 1.245 1.00 . A A . 11 ASP O 1 1 6 4278 1 1 11 ASP OD1 O 1.803 11.434 3.926 1.00 . A A . 11 ASP OD1 1 1 6 4279 1 1 11 ASP OD2 O 0.975 9.814 5.149 1.00 . A A . 11 ASP OD2 1 1 6 4280 1 1 12 GLY C C 4.368 10.245 -1.365 1.00 . A A . 12 GLY C 1 1 6 4281 1 1 12 GLY CA C 4.411 10.946 -0.028 1.00 . A A . 12 GLY CA 1 1 6 4282 1 1 12 GLY H H 5.042 9.498 1.370 1.00 . A A . 12 GLY H 1 1 6 4283 1 1 12 GLY HA2 H 3.612 11.673 0.017 1.00 . A A . 12 GLY HA2 1 1 6 4284 1 1 12 GLY HA3 H 5.360 11.453 0.074 1.00 . A A . 12 GLY HA3 1 1 6 4285 1 1 12 GLY N N 4.266 10.005 1.062 1.00 . A A . 12 GLY N 1 1 6 4286 1 1 12 GLY O O 3.854 10.776 -2.351 1.00 . A A . 12 GLY O 1 1 6 4287 1 1 13 TYR C C 3.505 7.804 -2.963 1.00 . A A . 13 TYR C 1 1 6 4288 1 1 13 TYR CA C 4.922 8.210 -2.590 1.00 . A A . 13 TYR CA 1 1 6 4289 1 1 13 TYR CB C 5.752 6.945 -2.349 1.00 . A A . 13 TYR CB 1 1 6 4290 1 1 13 TYR CD1 C 5.650 5.755 -4.577 1.00 . A A . 13 TYR CD1 1 1 6 4291 1 1 13 TYR CD2 C 7.774 6.502 -3.794 1.00 . A A . 13 TYR CD2 1 1 6 4292 1 1 13 TYR CE1 C 6.242 5.247 -5.716 1.00 . A A . 13 TYR CE1 1 1 6 4293 1 1 13 TYR CE2 C 8.373 5.995 -4.931 1.00 . A A . 13 TYR CE2 1 1 6 4294 1 1 13 TYR CG C 6.403 6.392 -3.598 1.00 . A A . 13 TYR CG 1 1 6 4295 1 1 13 TYR CZ C 7.604 5.370 -5.887 1.00 . A A . 13 TYR CZ 1 1 6 4296 1 1 13 TYR H H 5.339 8.683 -0.566 1.00 . A A . 13 TYR H 1 1 6 4297 1 1 13 TYR HA H 5.360 8.782 -3.396 1.00 . A A . 13 TYR HA 1 1 6 4298 1 1 13 TYR HB2 H 6.529 7.154 -1.624 1.00 . A A . 13 TYR HB2 1 1 6 4299 1 1 13 TYR HB3 H 5.103 6.179 -1.951 1.00 . A A . 13 TYR HB3 1 1 6 4300 1 1 13 TYR HD1 H 4.582 5.662 -4.440 1.00 . A A . 13 TYR HD1 1 1 6 4301 1 1 13 TYR HD2 H 8.375 6.995 -3.045 1.00 . A A . 13 TYR HD2 1 1 6 4302 1 1 13 TYR HE1 H 5.639 4.757 -6.467 1.00 . A A . 13 TYR HE1 1 1 6 4303 1 1 13 TYR HE2 H 9.441 6.089 -5.065 1.00 . A A . 13 TYR HE2 1 1 6 4304 1 1 13 TYR HH H 7.723 5.201 -7.801 1.00 . A A . 13 TYR HH 1 1 6 4305 1 1 13 TYR N N 4.909 9.033 -1.389 1.00 . A A . 13 TYR N 1 1 6 4306 1 1 13 TYR O O 3.157 7.699 -4.142 1.00 . A A . 13 TYR O 1 1 6 4307 1 1 13 TYR OH O 8.196 4.868 -7.023 1.00 . A A . 13 TYR OH 1 1 6 4308 1 1 14 CYS C C 0.260 8.020 -1.877 1.00 . A A . 14 CYS C 1 1 6 4309 1 1 14 CYS CA C 1.375 7.007 -2.128 1.00 . A A . 14 CYS CA 1 1 6 4310 1 1 14 CYS CB C 1.259 5.794 -1.221 1.00 . A A . 14 CYS CB 1 1 6 4311 1 1 14 CYS H H 2.976 7.847 -1.047 1.00 . A A . 14 CYS H 1 1 6 4312 1 1 14 CYS HA H 1.310 6.674 -3.152 1.00 . A A . 14 CYS HA 1 1 6 4313 1 1 14 CYS HB2 H 1.535 6.083 -0.215 1.00 . A A . 14 CYS HB2 1 1 6 4314 1 1 14 CYS HB3 H 0.242 5.430 -1.231 1.00 . A A . 14 CYS HB3 1 1 6 4315 1 1 14 CYS N N 2.687 7.593 -1.947 1.00 . A A . 14 CYS N 1 1 6 4316 1 1 14 CYS O O 0.492 9.224 -1.970 1.00 . A A . 14 CYS O 1 1 6 4317 1 1 14 CYS SG S 2.352 4.426 -1.729 1.00 . A A . 14 CYS SG 1 1 6 4318 1 1 15 LEU C C -2.664 8.809 -0.247 1.00 . A A . 15 LEU C 1 1 6 4319 1 1 15 LEU CA C -2.119 8.418 -1.616 1.00 . A A . 15 LEU CA 1 1 6 4320 1 1 15 LEU CB C -3.220 7.765 -2.451 1.00 . A A . 15 LEU CB 1 1 6 4321 1 1 15 LEU CD1 C -4.018 6.877 -4.646 1.00 . A A . 15 LEU CD1 1 1 6 4322 1 1 15 LEU CD2 C -2.242 8.628 -4.593 1.00 . A A . 15 LEU CD2 1 1 6 4323 1 1 15 LEU CG C -2.821 7.413 -3.883 1.00 . A A . 15 LEU CG 1 1 6 4324 1 1 15 LEU H H -1.048 6.623 -1.265 1.00 . A A . 15 LEU H 1 1 6 4325 1 1 15 LEU HA H -1.816 9.323 -2.117 1.00 . A A . 15 LEU HA 1 1 6 4326 1 1 15 LEU HB2 H -3.529 6.857 -1.954 1.00 . A A . 15 LEU HB2 1 1 6 4327 1 1 15 LEU HB3 H -4.061 8.439 -2.493 1.00 . A A . 15 LEU HB3 1 1 6 4328 1 1 15 LEU HD11 H -3.716 6.619 -5.650 1.00 . A A . 15 LEU HD11 1 1 6 4329 1 1 15 LEU HD12 H -4.398 5.998 -4.147 1.00 . A A . 15 LEU HD12 1 1 6 4330 1 1 15 LEU HD13 H -4.788 7.632 -4.683 1.00 . A A . 15 LEU HD13 1 1 6 4331 1 1 15 LEU HD21 H -2.998 9.396 -4.666 1.00 . A A . 15 LEU HD21 1 1 6 4332 1 1 15 LEU HD22 H -1.399 9.003 -4.033 1.00 . A A . 15 LEU HD22 1 1 6 4333 1 1 15 LEU HD23 H -1.919 8.346 -5.583 1.00 . A A . 15 LEU HD23 1 1 6 4334 1 1 15 LEU HG H -2.062 6.642 -3.857 1.00 . A A . 15 LEU HG 1 1 6 4335 1 1 15 LEU N N -0.946 7.552 -1.557 1.00 . A A . 15 LEU N 1 1 6 4336 1 1 15 LEU O O -2.207 9.777 0.357 1.00 . A A . 15 LEU O 1 1 6 4337 1 1 16 HIS C C -4.006 7.962 2.685 1.00 . A A . 16 HIS C 1 1 6 4338 1 1 16 HIS CA C -4.461 8.513 1.353 1.00 . A A . 16 HIS CA 1 1 6 4339 1 1 16 HIS CB C -5.930 8.173 1.088 1.00 . A A . 16 HIS CB 1 1 6 4340 1 1 16 HIS CD2 C -6.757 10.541 1.762 1.00 . A A . 16 HIS CD2 1 1 6 4341 1 1 16 HIS CE1 C -8.719 9.992 2.563 1.00 . A A . 16 HIS CE1 1 1 6 4342 1 1 16 HIS CG C -6.879 9.194 1.652 1.00 . A A . 16 HIS CG 1 1 6 4343 1 1 16 HIS H H -3.706 7.111 -0.061 1.00 . A A . 16 HIS H 1 1 6 4344 1 1 16 HIS HA H -4.352 9.581 1.387 1.00 . A A . 16 HIS HA 1 1 6 4345 1 1 16 HIS HB2 H -6.093 8.112 0.021 1.00 . A A . 16 HIS HB2 1 1 6 4346 1 1 16 HIS HB3 H -6.159 7.219 1.539 1.00 . A A . 16 HIS HB3 1 1 6 4347 1 1 16 HIS HD1 H -8.519 7.979 2.219 1.00 . A A . 16 HIS HD1 1 1 6 4348 1 1 16 HIS HD2 H -5.906 11.136 1.463 1.00 . A A . 16 HIS HD2 1 1 6 4349 1 1 16 HIS HE1 H -9.702 10.056 3.006 1.00 . A A . 16 HIS HE1 1 1 6 4350 1 1 16 HIS HE2 H -8.067 11.938 2.624 1.00 . A A . 16 HIS HE2 1 1 6 4351 1 1 16 HIS N N -3.610 8.030 0.266 1.00 . A A . 16 HIS N 1 1 6 4352 1 1 16 HIS ND1 N -8.123 8.884 2.161 1.00 . A A . 16 HIS ND1 1 1 6 4353 1 1 16 HIS NE2 N -7.913 11.008 2.329 1.00 . A A . 16 HIS NE2 1 1 6 4354 1 1 16 HIS O O -4.771 7.874 3.645 1.00 . A A . 16 HIS O 1 1 6 4355 1 1 17 ASP C C -0.637 6.783 3.518 1.00 . A A . 17 ASP C 1 1 6 4356 1 1 17 ASP CA C -2.049 7.172 3.901 1.00 . A A . 17 ASP CA 1 1 6 4357 1 1 17 ASP CB C -2.757 5.994 4.580 1.00 . A A . 17 ASP CB 1 1 6 4358 1 1 17 ASP CG C -2.180 5.688 5.950 1.00 . A A . 17 ASP CG 1 1 6 4359 1 1 17 ASP H H -2.249 7.663 1.868 1.00 . A A . 17 ASP H 1 1 6 4360 1 1 17 ASP HA H -2.007 8.008 4.579 1.00 . A A . 17 ASP HA 1 1 6 4361 1 1 17 ASP HB2 H -3.804 6.233 4.697 1.00 . A A . 17 ASP HB2 1 1 6 4362 1 1 17 ASP HB3 H -2.659 5.112 3.962 1.00 . A A . 17 ASP HB3 1 1 6 4363 1 1 17 ASP N N -2.745 7.608 2.702 1.00 . A A . 17 ASP N 1 1 6 4364 1 1 17 ASP O O 0.325 7.314 4.061 1.00 . A A . 17 ASP O 1 1 6 4365 1 1 17 ASP OD1 O -2.521 6.408 6.915 1.00 . A A . 17 ASP OD1 1 1 6 4366 1 1 17 ASP OD2 O -1.372 4.742 6.070 1.00 . A A . 17 ASP OD2 1 1 6 4367 1 1 18 GLY C C 1.650 4.775 3.079 1.00 . A A . 18 GLY C 1 1 6 4368 1 1 18 GLY CA C 0.758 5.450 2.037 1.00 . A A . 18 GLY CA 1 1 6 4369 1 1 18 GLY H H -1.357 5.591 2.082 1.00 . A A . 18 GLY H 1 1 6 4370 1 1 18 GLY HA2 H 0.584 4.743 1.238 1.00 . A A . 18 GLY HA2 1 1 6 4371 1 1 18 GLY HA3 H 1.288 6.299 1.630 1.00 . A A . 18 GLY HA3 1 1 6 4372 1 1 18 GLY N N -0.534 5.908 2.524 1.00 . A A . 18 GLY N 1 1 6 4373 1 1 18 GLY O O 1.857 5.290 4.167 1.00 . A A . 18 GLY O 1 1 6 4374 1 1 19 VAL C C 3.847 1.839 2.549 1.00 . A A . 19 VAL C 1 1 6 4375 1 1 19 VAL CA C 3.144 2.830 3.484 1.00 . A A . 19 VAL CA 1 1 6 4376 1 1 19 VAL CB C 2.424 2.017 4.602 1.00 . A A . 19 VAL CB 1 1 6 4377 1 1 19 VAL CG1 C 3.336 0.932 5.157 1.00 . A A . 19 VAL CG1 1 1 6 4378 1 1 19 VAL CG2 C 1.961 2.911 5.742 1.00 . A A . 19 VAL CG2 1 1 6 4379 1 1 19 VAL H H 2.043 3.363 1.774 1.00 . A A . 19 VAL H 1 1 6 4380 1 1 19 VAL HA H 3.878 3.482 3.934 1.00 . A A . 19 VAL HA 1 1 6 4381 1 1 19 VAL HB H 1.557 1.540 4.170 1.00 . A A . 19 VAL HB 1 1 6 4382 1 1 19 VAL HG11 H 3.629 0.266 4.358 1.00 . A A . 19 VAL HG11 1 1 6 4383 1 1 19 VAL HG12 H 4.215 1.385 5.587 1.00 . A A . 19 VAL HG12 1 1 6 4384 1 1 19 VAL HG13 H 2.811 0.373 5.916 1.00 . A A . 19 VAL HG13 1 1 6 4385 1 1 19 VAL HG21 H 1.520 2.304 6.519 1.00 . A A . 19 VAL HG21 1 1 6 4386 1 1 19 VAL HG22 H 2.806 3.451 6.144 1.00 . A A . 19 VAL HG22 1 1 6 4387 1 1 19 VAL HG23 H 1.227 3.611 5.373 1.00 . A A . 19 VAL HG23 1 1 6 4388 1 1 19 VAL N N 2.224 3.649 2.678 1.00 . A A . 19 VAL N 1 1 6 4389 1 1 19 VAL O O 3.195 0.990 1.962 1.00 . A A . 19 VAL O 1 1 6 4390 1 1 20 CYS C C 6.664 0.014 2.099 1.00 . A A . 20 CYS C 1 1 6 4391 1 1 20 CYS CA C 5.865 1.114 1.425 1.00 . A A . 20 CYS CA 1 1 6 4392 1 1 20 CYS CB C 6.784 1.973 0.548 1.00 . A A . 20 CYS CB 1 1 6 4393 1 1 20 CYS H H 5.679 2.506 3.004 1.00 . A A . 20 CYS H 1 1 6 4394 1 1 20 CYS HA H 5.118 0.653 0.797 1.00 . A A . 20 CYS HA 1 1 6 4395 1 1 20 CYS HB2 H 7.701 1.434 0.370 1.00 . A A . 20 CYS HB2 1 1 6 4396 1 1 20 CYS HB3 H 6.294 2.156 -0.397 1.00 . A A . 20 CYS HB3 1 1 6 4397 1 1 20 CYS N N 5.162 1.929 2.410 1.00 . A A . 20 CYS N 1 1 6 4398 1 1 20 CYS O O 7.484 0.279 2.972 1.00 . A A . 20 CYS O 1 1 6 4399 1 1 20 CYS SG S 7.229 3.591 1.263 1.00 . A A . 20 CYS SG 1 1 6 4400 1 1 21 MET C C 7.017 -3.602 1.411 1.00 . A A . 21 MET C 1 1 6 4401 1 1 21 MET CA C 7.124 -2.346 2.284 1.00 . A A . 21 MET CA 1 1 6 4402 1 1 21 MET CB C 6.604 -2.610 3.704 1.00 . A A . 21 MET CB 1 1 6 4403 1 1 21 MET CE C 5.030 -1.974 6.376 1.00 . A A . 21 MET CE 1 1 6 4404 1 1 21 MET CG C 5.122 -2.958 3.781 1.00 . A A . 21 MET CG 1 1 6 4405 1 1 21 MET H H 5.728 -1.387 1.011 1.00 . A A . 21 MET H 1 1 6 4406 1 1 21 MET HA H 8.166 -2.072 2.348 1.00 . A A . 21 MET HA 1 1 6 4407 1 1 21 MET HB2 H 7.165 -3.415 4.134 1.00 . A A . 21 MET HB2 1 1 6 4408 1 1 21 MET HB3 H 6.766 -1.723 4.297 1.00 . A A . 21 MET HB3 1 1 6 4409 1 1 21 MET HE1 H 4.763 -2.118 7.412 1.00 . A A . 21 MET HE1 1 1 6 4410 1 1 21 MET HE2 H 6.092 -1.795 6.299 1.00 . A A . 21 MET HE2 1 1 6 4411 1 1 21 MET HE3 H 4.491 -1.124 5.982 1.00 . A A . 21 MET HE3 1 1 6 4412 1 1 21 MET HG2 H 4.550 -2.095 3.479 1.00 . A A . 21 MET HG2 1 1 6 4413 1 1 21 MET HG3 H 4.921 -3.775 3.103 1.00 . A A . 21 MET HG3 1 1 6 4414 1 1 21 MET N N 6.415 -1.224 1.701 1.00 . A A . 21 MET N 1 1 6 4415 1 1 21 MET O O 5.943 -4.180 1.257 1.00 . A A . 21 MET O 1 1 6 4416 1 1 21 MET SD S 4.602 -3.441 5.440 1.00 . A A . 21 MET SD 1 1 6 4417 1 1 22 TYR C C 9.744 -5.323 -0.346 1.00 . A A . 22 TYR C 1 1 6 4418 1 1 22 TYR CA C 8.300 -5.227 0.110 1.00 . A A . 22 TYR CA 1 1 6 4419 1 1 22 TYR CB C 7.338 -5.350 -1.070 1.00 . A A . 22 TYR CB 1 1 6 4420 1 1 22 TYR CD1 C 7.454 -7.856 -0.717 1.00 . A A . 22 TYR CD1 1 1 6 4421 1 1 22 TYR CD2 C 5.923 -7.011 -2.334 1.00 . A A . 22 TYR CD2 1 1 6 4422 1 1 22 TYR CE1 C 7.049 -9.147 -1.000 1.00 . A A . 22 TYR CE1 1 1 6 4423 1 1 22 TYR CE2 C 5.510 -8.297 -2.623 1.00 . A A . 22 TYR CE2 1 1 6 4424 1 1 22 TYR CG C 6.898 -6.765 -1.377 1.00 . A A . 22 TYR CG 1 1 6 4425 1 1 22 TYR CZ C 6.078 -9.362 -1.957 1.00 . A A . 22 TYR CZ 1 1 6 4426 1 1 22 TYR H H 8.879 -3.356 0.780 1.00 . A A . 22 TYR H 1 1 6 4427 1 1 22 TYR HA H 8.118 -6.010 0.801 1.00 . A A . 22 TYR HA 1 1 6 4428 1 1 22 TYR HB2 H 6.453 -4.767 -0.865 1.00 . A A . 22 TYR HB2 1 1 6 4429 1 1 22 TYR HB3 H 7.822 -4.959 -1.945 1.00 . A A . 22 TYR HB3 1 1 6 4430 1 1 22 TYR HD1 H 8.215 -7.684 0.030 1.00 . A A . 22 TYR HD1 1 1 6 4431 1 1 22 TYR HD2 H 5.479 -6.175 -2.856 1.00 . A A . 22 TYR HD2 1 1 6 4432 1 1 22 TYR HE1 H 7.493 -9.980 -0.477 1.00 . A A . 22 TYR HE1 1 1 6 4433 1 1 22 TYR HE2 H 4.750 -8.465 -3.370 1.00 . A A . 22 TYR HE2 1 1 6 4434 1 1 22 TYR HH H 5.600 -11.156 -1.433 1.00 . A A . 22 TYR HH 1 1 6 4435 1 1 22 TYR N N 8.136 -3.965 0.794 1.00 . A A . 22 TYR N 1 1 6 4436 1 1 22 TYR O O 10.353 -6.382 -0.273 1.00 . A A . 22 TYR O 1 1 6 4437 1 1 22 TYR OH O 5.674 -10.645 -2.251 1.00 . A A . 22 TYR OH 1 1 6 4438 1 1 23 ILE C C 12.619 -5.024 -0.704 1.00 . A A . 23 ILE C 1 1 6 4439 1 1 23 ILE CA C 11.653 -3.962 -1.220 1.00 . A A . 23 ILE CA 1 1 6 4440 1 1 23 ILE CB C 12.148 -2.566 -0.786 1.00 . A A . 23 ILE CB 1 1 6 4441 1 1 23 ILE CD1 C 11.998 -0.843 1.094 1.00 . A A . 23 ILE CD1 1 1 6 4442 1 1 23 ILE CG1 C 11.641 -2.235 0.620 1.00 . A A . 23 ILE CG1 1 1 6 4443 1 1 23 ILE CG2 C 11.700 -1.506 -1.786 1.00 . A A . 23 ILE CG2 1 1 6 4444 1 1 23 ILE H H 9.626 -3.445 -0.953 1.00 . A A . 23 ILE H 1 1 6 4445 1 1 23 ILE HA H 11.679 -3.990 -2.298 1.00 . A A . 23 ILE HA 1 1 6 4446 1 1 23 ILE HB H 13.227 -2.581 -0.775 1.00 . A A . 23 ILE HB 1 1 6 4447 1 1 23 ILE HD11 H 11.605 -0.115 0.399 1.00 . A A . 23 ILE HD11 1 1 6 4448 1 1 23 ILE HD12 H 11.572 -0.675 2.073 1.00 . A A . 23 ILE HD12 1 1 6 4449 1 1 23 ILE HD13 H 13.072 -0.746 1.149 1.00 . A A . 23 ILE HD13 1 1 6 4450 1 1 23 ILE HG12 H 10.567 -2.323 0.628 1.00 . A A . 23 ILE HG12 1 1 6 4451 1 1 23 ILE HG13 H 12.059 -2.943 1.322 1.00 . A A . 23 ILE HG13 1 1 6 4452 1 1 23 ILE HG21 H 12.051 -0.538 -1.465 1.00 . A A . 23 ILE HG21 1 1 6 4453 1 1 23 ILE HG22 H 12.107 -1.734 -2.760 1.00 . A A . 23 ILE HG22 1 1 6 4454 1 1 23 ILE HG23 H 10.619 -1.497 -1.840 1.00 . A A . 23 ILE HG23 1 1 6 4455 1 1 23 ILE N N 10.249 -4.179 -0.822 1.00 . A A . 23 ILE N 1 1 6 4456 1 1 23 ILE O O 13.155 -4.938 0.398 1.00 . A A . 23 ILE O 1 1 6 4457 1 1 24 GLU C C 15.028 -7.032 -1.920 1.00 . A A . 24 GLU C 1 1 6 4458 1 1 24 GLU CA C 13.687 -7.147 -1.224 1.00 . A A . 24 GLU CA 1 1 6 4459 1 1 24 GLU CB C 13.006 -8.423 -1.699 1.00 . A A . 24 GLU CB 1 1 6 4460 1 1 24 GLU CD C 12.514 -9.561 0.478 1.00 . A A . 24 GLU CD 1 1 6 4461 1 1 24 GLU CG C 11.931 -8.925 -0.763 1.00 . A A . 24 GLU CG 1 1 6 4462 1 1 24 GLU H H 12.378 -6.003 -2.406 1.00 . A A . 24 GLU H 1 1 6 4463 1 1 24 GLU HA H 13.830 -7.190 -0.156 1.00 . A A . 24 GLU HA 1 1 6 4464 1 1 24 GLU HB2 H 12.549 -8.228 -2.661 1.00 . A A . 24 GLU HB2 1 1 6 4465 1 1 24 GLU HB3 H 13.752 -9.198 -1.811 1.00 . A A . 24 GLU HB3 1 1 6 4466 1 1 24 GLU HG2 H 11.320 -8.085 -0.469 1.00 . A A . 24 GLU HG2 1 1 6 4467 1 1 24 GLU HG3 H 11.325 -9.654 -1.281 1.00 . A A . 24 GLU HG3 1 1 6 4468 1 1 24 GLU N N 12.832 -6.018 -1.541 1.00 . A A . 24 GLU N 1 1 6 4469 1 1 24 GLU O O 15.892 -7.887 -1.736 1.00 . A A . 24 GLU O 1 1 6 4470 1 1 24 GLU OE1 O 13.334 -10.491 0.338 1.00 . A A . 24 GLU OE1 1 1 6 4471 1 1 24 GLU OE2 O 12.177 -9.130 1.595 1.00 . A A . 24 GLU OE2 1 1 6 4472 1 1 25 ALA C C 15.985 -6.858 -4.816 1.00 . A A . 25 ALA C 1 1 6 4473 1 1 25 ALA CA C 16.267 -5.872 -3.698 1.00 . A A . 25 ALA CA 1 1 6 4474 1 1 25 ALA CB C 17.639 -6.106 -3.074 1.00 . A A . 25 ALA CB 1 1 6 4475 1 1 25 ALA H H 14.530 -5.243 -2.674 1.00 . A A . 25 ALA H 1 1 6 4476 1 1 25 ALA HA H 16.243 -4.871 -4.108 1.00 . A A . 25 ALA HA 1 1 6 4477 1 1 25 ALA HB1 H 18.404 -5.993 -3.827 1.00 . A A . 25 ALA HB1 1 1 6 4478 1 1 25 ALA HB2 H 17.801 -5.386 -2.286 1.00 . A A . 25 ALA HB2 1 1 6 4479 1 1 25 ALA HB3 H 17.681 -7.103 -2.662 1.00 . A A . 25 ALA HB3 1 1 6 4480 1 1 25 ALA N N 15.181 -5.974 -2.724 1.00 . A A . 25 ALA N 1 1 6 4481 1 1 25 ALA O O 16.826 -7.147 -5.660 1.00 . A A . 25 ALA O 1 1 6 4482 1 1 26 LEU C C 13.163 -7.480 -6.540 1.00 . A A . 26 LEU C 1 1 6 4483 1 1 26 LEU CA C 14.234 -8.240 -5.809 1.00 . A A . 26 LEU CA 1 1 6 4484 1 1 26 LEU CB C 13.655 -9.514 -5.187 1.00 . A A . 26 LEU CB 1 1 6 4485 1 1 26 LEU CD1 C 13.942 -11.545 -3.742 1.00 . A A . 26 LEU CD1 1 1 6 4486 1 1 26 LEU CD2 C 15.822 -10.782 -5.204 1.00 . A A . 26 LEU CD2 1 1 6 4487 1 1 26 LEU CG C 14.639 -10.340 -4.353 1.00 . A A . 26 LEU CG 1 1 6 4488 1 1 26 LEU H H 14.168 -7.097 -4.066 1.00 . A A . 26 LEU H 1 1 6 4489 1 1 26 LEU HA H 15.021 -8.482 -6.488 1.00 . A A . 26 LEU HA 1 1 6 4490 1 1 26 LEU HB2 H 12.823 -9.231 -4.554 1.00 . A A . 26 LEU HB2 1 1 6 4491 1 1 26 LEU HB3 H 13.280 -10.140 -5.983 1.00 . A A . 26 LEU HB3 1 1 6 4492 1 1 26 LEU HD11 H 13.533 -12.163 -4.527 1.00 . A A . 26 LEU HD11 1 1 6 4493 1 1 26 LEU HD12 H 14.654 -12.120 -3.168 1.00 . A A . 26 LEU HD12 1 1 6 4494 1 1 26 LEU HD13 H 13.145 -11.212 -3.094 1.00 . A A . 26 LEU HD13 1 1 6 4495 1 1 26 LEU HD21 H 16.334 -9.913 -5.593 1.00 . A A . 26 LEU HD21 1 1 6 4496 1 1 26 LEU HD22 H 16.506 -11.360 -4.598 1.00 . A A . 26 LEU HD22 1 1 6 4497 1 1 26 LEU HD23 H 15.469 -11.388 -6.026 1.00 . A A . 26 LEU HD23 1 1 6 4498 1 1 26 LEU HG H 15.017 -9.727 -3.548 1.00 . A A . 26 LEU HG 1 1 6 4499 1 1 26 LEU N N 14.757 -7.358 -4.792 1.00 . A A . 26 LEU N 1 1 6 4500 1 1 26 LEU O O 12.333 -8.049 -7.247 1.00 . A A . 26 LEU O 1 1 6 4501 1 1 27 ASP C C 10.918 -5.350 -6.474 1.00 . A A . 27 ASP C 1 1 6 4502 1 1 27 ASP CA C 12.330 -5.222 -6.971 1.00 . A A . 27 ASP CA 1 1 6 4503 1 1 27 ASP CB C 12.426 -5.435 -8.467 1.00 . A A . 27 ASP CB 1 1 6 4504 1 1 27 ASP CG C 12.137 -4.173 -9.251 1.00 . A A . 27 ASP CG 1 1 6 4505 1 1 27 ASP H H 13.726 -5.863 -5.530 1.00 . A A . 27 ASP H 1 1 6 4506 1 1 27 ASP HA H 12.691 -4.233 -6.729 1.00 . A A . 27 ASP HA 1 1 6 4507 1 1 27 ASP HB2 H 13.427 -5.768 -8.691 1.00 . A A . 27 ASP HB2 1 1 6 4508 1 1 27 ASP HB3 H 11.718 -6.197 -8.765 1.00 . A A . 27 ASP HB3 1 1 6 4509 1 1 27 ASP N N 13.163 -6.181 -6.268 1.00 . A A . 27 ASP N 1 1 6 4510 1 1 27 ASP O O 9.962 -5.524 -7.228 1.00 . A A . 27 ASP O 1 1 6 4511 1 1 27 ASP OD1 O 13.043 -3.324 -9.383 1.00 . A A . 27 ASP OD1 1 1 6 4512 1 1 27 ASP OD2 O 10.994 -4.030 -9.736 1.00 . A A . 27 ASP OD2 1 1 6 4513 1 1 28 LYS C C 9.087 -4.086 -3.981 1.00 . A A . 28 LYS C 1 1 6 4514 1 1 28 LYS CA C 9.569 -5.436 -4.472 1.00 . A A . 28 LYS CA 1 1 6 4515 1 1 28 LYS CB C 9.768 -6.381 -3.297 1.00 . A A . 28 LYS CB 1 1 6 4516 1 1 28 LYS CD C 8.647 -8.424 -4.350 1.00 . A A . 28 LYS CD 1 1 6 4517 1 1 28 LYS CE C 8.540 -8.074 -5.833 1.00 . A A . 28 LYS CE 1 1 6 4518 1 1 28 LYS CG C 9.898 -7.854 -3.679 1.00 . A A . 28 LYS CG 1 1 6 4519 1 1 28 LYS H H 11.655 -5.180 -4.647 1.00 . A A . 28 LYS H 1 1 6 4520 1 1 28 LYS HA H 8.843 -5.856 -5.151 1.00 . A A . 28 LYS HA 1 1 6 4521 1 1 28 LYS HB2 H 10.685 -6.097 -2.797 1.00 . A A . 28 LYS HB2 1 1 6 4522 1 1 28 LYS HB3 H 8.951 -6.260 -2.594 1.00 . A A . 28 LYS HB3 1 1 6 4523 1 1 28 LYS HD2 H 8.663 -9.497 -4.254 1.00 . A A . 28 LYS HD2 1 1 6 4524 1 1 28 LYS HD3 H 7.776 -8.034 -3.838 1.00 . A A . 28 LYS HD3 1 1 6 4525 1 1 28 LYS HE2 H 7.593 -8.433 -6.204 1.00 . A A . 28 LYS HE2 1 1 6 4526 1 1 28 LYS HE3 H 8.579 -6.999 -5.937 1.00 . A A . 28 LYS HE3 1 1 6 4527 1 1 28 LYS HG2 H 10.728 -7.955 -4.356 1.00 . A A . 28 LYS HG2 1 1 6 4528 1 1 28 LYS HG3 H 10.098 -8.423 -2.784 1.00 . A A . 28 LYS HG3 1 1 6 4529 1 1 28 LYS HZ1 H 9.692 -9.704 -6.475 1.00 . A A . 28 LYS HZ1 1 1 6 4530 1 1 28 LYS HZ2 H 10.546 -8.244 -6.410 1.00 . A A . 28 LYS HZ2 1 1 6 4531 1 1 28 LYS HZ3 H 9.446 -8.521 -7.663 1.00 . A A . 28 LYS HZ3 1 1 6 4532 1 1 28 LYS N N 10.825 -5.305 -5.169 1.00 . A A . 28 LYS N 1 1 6 4533 1 1 28 LYS NZ N 9.632 -8.675 -6.647 1.00 . A A . 28 LYS NZ 1 1 6 4534 1 1 28 LYS O O 9.891 -3.244 -3.589 1.00 . A A . 28 LYS O 1 1 6 4535 1 1 29 TYR C C 5.689 -2.813 -3.347 1.00 . A A . 29 TYR C 1 1 6 4536 1 1 29 TYR CA C 7.192 -2.645 -3.530 1.00 . A A . 29 TYR CA 1 1 6 4537 1 1 29 TYR CB C 7.470 -1.498 -4.505 1.00 . A A . 29 TYR CB 1 1 6 4538 1 1 29 TYR CD1 C 5.851 0.399 -4.087 1.00 . A A . 29 TYR CD1 1 1 6 4539 1 1 29 TYR CD2 C 8.074 0.599 -3.247 1.00 . A A . 29 TYR CD2 1 1 6 4540 1 1 29 TYR CE1 C 5.535 1.633 -3.556 1.00 . A A . 29 TYR CE1 1 1 6 4541 1 1 29 TYR CE2 C 7.765 1.835 -2.716 1.00 . A A . 29 TYR CE2 1 1 6 4542 1 1 29 TYR CG C 7.125 -0.139 -3.940 1.00 . A A . 29 TYR CG 1 1 6 4543 1 1 29 TYR CZ C 6.496 2.345 -2.872 1.00 . A A . 29 TYR CZ 1 1 6 4544 1 1 29 TYR H H 7.191 -4.588 -4.344 1.00 . A A . 29 TYR H 1 1 6 4545 1 1 29 TYR HA H 7.638 -2.410 -2.575 1.00 . A A . 29 TYR HA 1 1 6 4546 1 1 29 TYR HB2 H 8.518 -1.496 -4.766 1.00 . A A . 29 TYR HB2 1 1 6 4547 1 1 29 TYR HB3 H 6.881 -1.647 -5.398 1.00 . A A . 29 TYR HB3 1 1 6 4548 1 1 29 TYR HD1 H 5.103 -0.163 -4.624 1.00 . A A . 29 TYR HD1 1 1 6 4549 1 1 29 TYR HD2 H 9.069 0.197 -3.128 1.00 . A A . 29 TYR HD2 1 1 6 4550 1 1 29 TYR HE1 H 4.540 2.036 -3.679 1.00 . A A . 29 TYR HE1 1 1 6 4551 1 1 29 TYR HE2 H 8.516 2.396 -2.180 1.00 . A A . 29 TYR HE2 1 1 6 4552 1 1 29 TYR HH H 6.900 4.182 -2.497 1.00 . A A . 29 TYR HH 1 1 6 4553 1 1 29 TYR N N 7.780 -3.882 -4.004 1.00 . A A . 29 TYR N 1 1 6 4554 1 1 29 TYR O O 4.938 -2.842 -4.318 1.00 . A A . 29 TYR O 1 1 6 4555 1 1 29 TYR OH O 6.185 3.566 -2.329 1.00 . A A . 29 TYR OH 1 1 6 4556 1 1 30 ALA C C 3.546 -1.700 -0.951 1.00 . A A . 30 ALA C 1 1 6 4557 1 1 30 ALA CA C 3.847 -2.931 -1.785 1.00 . A A . 30 ALA CA 1 1 6 4558 1 1 30 ALA CB C 3.453 -4.201 -1.042 1.00 . A A . 30 ALA CB 1 1 6 4559 1 1 30 ALA H H 5.910 -3.049 -1.378 1.00 . A A . 30 ALA H 1 1 6 4560 1 1 30 ALA HA H 3.291 -2.882 -2.709 1.00 . A A . 30 ALA HA 1 1 6 4561 1 1 30 ALA HB1 H 4.044 -4.290 -0.141 1.00 . A A . 30 ALA HB1 1 1 6 4562 1 1 30 ALA HB2 H 2.407 -4.156 -0.782 1.00 . A A . 30 ALA HB2 1 1 6 4563 1 1 30 ALA HB3 H 3.630 -5.058 -1.674 1.00 . A A . 30 ALA HB3 1 1 6 4564 1 1 30 ALA N N 5.260 -2.940 -2.104 1.00 . A A . 30 ALA N 1 1 6 4565 1 1 30 ALA O O 4.326 -1.352 -0.065 1.00 . A A . 30 ALA O 1 1 6 4566 1 1 31 CYS C C 0.730 0.031 0.120 1.00 . A A . 31 CYS C 1 1 6 4567 1 1 31 CYS CA C 2.102 0.169 -0.506 1.00 . A A . 31 CYS CA 1 1 6 4568 1 1 31 CYS CB C 2.168 1.418 -1.377 1.00 . A A . 31 CYS CB 1 1 6 4569 1 1 31 CYS H H 1.852 -1.347 -1.947 1.00 . A A . 31 CYS H 1 1 6 4570 1 1 31 CYS HA H 2.825 0.269 0.292 1.00 . A A . 31 CYS HA 1 1 6 4571 1 1 31 CYS HB2 H 3.140 1.476 -1.847 1.00 . A A . 31 CYS HB2 1 1 6 4572 1 1 31 CYS HB3 H 1.402 1.364 -2.136 1.00 . A A . 31 CYS HB3 1 1 6 4573 1 1 31 CYS N N 2.448 -1.025 -1.246 1.00 . A A . 31 CYS N 1 1 6 4574 1 1 31 CYS O O -0.208 -0.488 -0.495 1.00 . A A . 31 CYS O 1 1 6 4575 1 1 31 CYS SG S 1.909 2.948 -0.424 1.00 . A A . 31 CYS SG 1 1 6 4576 1 1 32 ASN C C -1.111 1.620 2.642 1.00 . A A . 32 ASN C 1 1 6 4577 1 1 32 ASN CA C -0.556 0.297 2.146 1.00 . A A . 32 ASN CA 1 1 6 4578 1 1 32 ASN CB C -0.190 -0.603 3.316 1.00 . A A . 32 ASN CB 1 1 6 4579 1 1 32 ASN CG C -1.407 -1.190 3.999 1.00 . A A . 32 ASN CG 1 1 6 4580 1 1 32 ASN H H 1.385 0.993 1.731 1.00 . A A . 32 ASN H 1 1 6 4581 1 1 32 ASN HA H -1.298 -0.195 1.537 1.00 . A A . 32 ASN HA 1 1 6 4582 1 1 32 ASN HB2 H 0.430 -1.402 2.950 1.00 . A A . 32 ASN HB2 1 1 6 4583 1 1 32 ASN HB3 H 0.364 -0.026 4.041 1.00 . A A . 32 ASN HB3 1 1 6 4584 1 1 32 ASN HD21 H -0.378 -1.417 5.691 1.00 . A A . 32 ASN HD21 1 1 6 4585 1 1 32 ASN HD22 H -2.031 -1.947 5.730 1.00 . A A . 32 ASN HD22 1 1 6 4586 1 1 32 ASN N N 0.626 0.500 1.344 1.00 . A A . 32 ASN N 1 1 6 4587 1 1 32 ASN ND2 N -1.261 -1.551 5.265 1.00 . A A . 32 ASN ND2 1 1 6 4588 1 1 32 ASN O O -0.528 2.265 3.506 1.00 . A A . 32 ASN O 1 1 6 4589 1 1 32 ASN OD1 O -2.464 -1.337 3.386 1.00 . A A . 32 ASN OD1 1 1 6 4590 1 1 33 CYS C C -3.944 2.974 3.538 1.00 . A A . 33 CYS C 1 1 6 4591 1 1 33 CYS CA C -2.888 3.256 2.479 1.00 . A A . 33 CYS CA 1 1 6 4592 1 1 33 CYS CB C -3.547 3.952 1.280 1.00 . A A . 33 CYS CB 1 1 6 4593 1 1 33 CYS H H -2.612 1.499 1.350 1.00 . A A . 33 CYS H 1 1 6 4594 1 1 33 CYS HA H -2.140 3.913 2.898 1.00 . A A . 33 CYS HA 1 1 6 4595 1 1 33 CYS HB2 H -4.068 3.209 0.693 1.00 . A A . 33 CYS HB2 1 1 6 4596 1 1 33 CYS HB3 H -4.261 4.674 1.647 1.00 . A A . 33 CYS HB3 1 1 6 4597 1 1 33 CYS N N -2.227 2.031 2.069 1.00 . A A . 33 CYS N 1 1 6 4598 1 1 33 CYS O O -3.678 3.037 4.732 1.00 . A A . 33 CYS O 1 1 6 4599 1 1 33 CYS SG S -2.402 4.821 0.158 1.00 . A A . 33 CYS SG 1 1 6 4600 1 1 34 VAL C C -7.219 1.450 3.416 1.00 . A A . 34 VAL C 1 1 6 4601 1 1 34 VAL CA C -6.269 2.501 3.968 1.00 . A A . 34 VAL CA 1 1 6 4602 1 1 34 VAL CB C -6.984 3.869 4.084 1.00 . A A . 34 VAL CB 1 1 6 4603 1 1 34 VAL CG1 C -7.731 4.210 2.802 1.00 . A A . 34 VAL CG1 1 1 6 4604 1 1 34 VAL CG2 C -7.914 3.906 5.288 1.00 . A A . 34 VAL CG2 1 1 6 4605 1 1 34 VAL H H -5.247 2.434 2.135 1.00 . A A . 34 VAL H 1 1 6 4606 1 1 34 VAL HA H -5.925 2.202 4.946 1.00 . A A . 34 VAL HA 1 1 6 4607 1 1 34 VAL HB H -6.219 4.625 4.221 1.00 . A A . 34 VAL HB 1 1 6 4608 1 1 34 VAL HG11 H -7.030 4.275 1.982 1.00 . A A . 34 VAL HG11 1 1 6 4609 1 1 34 VAL HG12 H -8.458 3.440 2.594 1.00 . A A . 34 VAL HG12 1 1 6 4610 1 1 34 VAL HG13 H -8.234 5.158 2.921 1.00 . A A . 34 VAL HG13 1 1 6 4611 1 1 34 VAL HG21 H -7.348 3.725 6.189 1.00 . A A . 34 VAL HG21 1 1 6 4612 1 1 34 VAL HG22 H -8.388 4.875 5.348 1.00 . A A . 34 VAL HG22 1 1 6 4613 1 1 34 VAL HG23 H -8.671 3.143 5.180 1.00 . A A . 34 VAL HG23 1 1 6 4614 1 1 34 VAL N N -5.130 2.624 3.087 1.00 . A A . 34 VAL N 1 1 6 4615 1 1 34 VAL O O -7.173 1.145 2.221 1.00 . A A . 34 VAL O 1 1 6 4616 1 1 35 VAL C C -10.115 0.592 2.997 1.00 . A A . 35 VAL C 1 1 6 4617 1 1 35 VAL CA C -9.039 -0.097 3.843 1.00 . A A . 35 VAL CA 1 1 6 4618 1 1 35 VAL CB C -9.651 -0.886 5.028 1.00 . A A . 35 VAL CB 1 1 6 4619 1 1 35 VAL CG1 C -8.562 -1.635 5.778 1.00 . A A . 35 VAL CG1 1 1 6 4620 1 1 35 VAL CG2 C -10.400 0.019 5.996 1.00 . A A . 35 VAL CG2 1 1 6 4621 1 1 35 VAL H H -7.970 1.086 5.228 1.00 . A A . 35 VAL H 1 1 6 4622 1 1 35 VAL HA H -8.526 -0.808 3.207 1.00 . A A . 35 VAL HA 1 1 6 4623 1 1 35 VAL HB H -10.342 -1.616 4.621 1.00 . A A . 35 VAL HB 1 1 6 4624 1 1 35 VAL HG11 H -8.075 -2.330 5.111 1.00 . A A . 35 VAL HG11 1 1 6 4625 1 1 35 VAL HG12 H -7.837 -0.930 6.156 1.00 . A A . 35 VAL HG12 1 1 6 4626 1 1 35 VAL HG13 H -9.000 -2.176 6.605 1.00 . A A . 35 VAL HG13 1 1 6 4627 1 1 35 VAL HG21 H -9.717 0.748 6.405 1.00 . A A . 35 VAL HG21 1 1 6 4628 1 1 35 VAL HG22 H -11.196 0.525 5.471 1.00 . A A . 35 VAL HG22 1 1 6 4629 1 1 35 VAL HG23 H -10.814 -0.577 6.796 1.00 . A A . 35 VAL HG23 1 1 6 4630 1 1 35 VAL N N -8.043 0.868 4.279 1.00 . A A . 35 VAL N 1 1 6 4631 1 1 35 VAL O O -11.207 0.927 3.452 1.00 . A A . 35 VAL O 1 1 6 4632 1 1 36 GLY C C -9.782 1.959 -0.382 1.00 . A A . 36 GLY C 1 1 6 4633 1 1 36 GLY CA C -10.584 1.560 0.833 1.00 . A A . 36 GLY CA 1 1 6 4634 1 1 36 GLY H H -8.922 0.402 1.422 1.00 . A A . 36 GLY H 1 1 6 4635 1 1 36 GLY HA2 H -11.433 0.964 0.523 1.00 . A A . 36 GLY HA2 1 1 6 4636 1 1 36 GLY HA3 H -10.935 2.451 1.333 1.00 . A A . 36 GLY HA3 1 1 6 4637 1 1 36 GLY N N -9.765 0.791 1.744 1.00 . A A . 36 GLY N 1 1 6 4638 1 1 36 GLY O O -10.331 2.310 -1.426 1.00 . A A . 36 GLY O 1 1 6 4639 1 1 37 TYR C C -6.380 1.132 -1.283 1.00 . A A . 37 TYR C 1 1 6 4640 1 1 37 TYR CA C -7.541 2.119 -1.339 1.00 . A A . 37 TYR CA 1 1 6 4641 1 1 37 TYR CB C -6.985 3.546 -1.303 1.00 . A A . 37 TYR CB 1 1 6 4642 1 1 37 TYR CD1 C -8.302 4.878 -2.995 1.00 . A A . 37 TYR CD1 1 1 6 4643 1 1 37 TYR CD2 C -8.619 5.367 -0.684 1.00 . A A . 37 TYR CD2 1 1 6 4644 1 1 37 TYR CE1 C -9.220 5.851 -3.332 1.00 . A A . 37 TYR CE1 1 1 6 4645 1 1 37 TYR CE2 C -9.540 6.343 -1.015 1.00 . A A . 37 TYR CE2 1 1 6 4646 1 1 37 TYR CG C -7.983 4.619 -1.669 1.00 . A A . 37 TYR CG 1 1 6 4647 1 1 37 TYR CZ C -9.807 6.607 -2.345 1.00 . A A . 37 TYR CZ 1 1 6 4648 1 1 37 TYR H H -8.092 1.689 0.654 1.00 . A A . 37 TYR H 1 1 6 4649 1 1 37 TYR HA H -8.082 1.975 -2.262 1.00 . A A . 37 TYR HA 1 1 6 4650 1 1 37 TYR HB2 H -6.630 3.758 -0.305 1.00 . A A . 37 TYR HB2 1 1 6 4651 1 1 37 TYR HB3 H -6.154 3.615 -1.991 1.00 . A A . 37 TYR HB3 1 1 6 4652 1 1 37 TYR HD1 H -7.814 4.306 -3.772 1.00 . A A . 37 TYR HD1 1 1 6 4653 1 1 37 TYR HD2 H -8.384 5.177 0.353 1.00 . A A . 37 TYR HD2 1 1 6 4654 1 1 37 TYR HE1 H -9.454 6.036 -4.368 1.00 . A A . 37 TYR HE1 1 1 6 4655 1 1 37 TYR HE2 H -10.022 6.916 -0.235 1.00 . A A . 37 TYR HE2 1 1 6 4656 1 1 37 TYR HH H -11.396 7.176 -3.303 1.00 . A A . 37 TYR HH 1 1 6 4657 1 1 37 TYR N N -8.461 1.891 -0.234 1.00 . A A . 37 TYR N 1 1 6 4658 1 1 37 TYR O O -5.495 1.257 -0.436 1.00 . A A . 37 TYR O 1 1 6 4659 1 1 37 TYR OH O -10.756 7.549 -2.674 1.00 . A A . 37 TYR OH 1 1 6 4660 1 1 38 ILE C C -5.151 -1.242 -3.771 1.00 . A A . 38 ILE C 1 1 6 4661 1 1 38 ILE CA C -5.235 -0.730 -2.328 1.00 . A A . 38 ILE CA 1 1 6 4662 1 1 38 ILE CB C -5.200 -1.882 -1.279 1.00 . A A . 38 ILE CB 1 1 6 4663 1 1 38 ILE CD1 C -2.847 -2.652 -1.963 1.00 . A A . 38 ILE CD1 1 1 6 4664 1 1 38 ILE CG1 C -3.754 -2.166 -0.851 1.00 . A A . 38 ILE CG1 1 1 6 4665 1 1 38 ILE CG2 C -5.877 -3.157 -1.765 1.00 . A A . 38 ILE CG2 1 1 6 4666 1 1 38 ILE H H -7.216 -0.051 -2.673 1.00 . A A . 38 ILE H 1 1 6 4667 1 1 38 ILE HA H -4.369 -0.114 -2.150 1.00 . A A . 38 ILE HA 1 1 6 4668 1 1 38 ILE HB H -5.744 -1.541 -0.413 1.00 . A A . 38 ILE HB 1 1 6 4669 1 1 38 ILE HD11 H -3.214 -3.594 -2.344 1.00 . A A . 38 ILE HD11 1 1 6 4670 1 1 38 ILE HD12 H -2.832 -1.924 -2.760 1.00 . A A . 38 ILE HD12 1 1 6 4671 1 1 38 ILE HD13 H -1.846 -2.786 -1.580 1.00 . A A . 38 ILE HD13 1 1 6 4672 1 1 38 ILE HG12 H -3.330 -1.253 -0.460 1.00 . A A . 38 ILE HG12 1 1 6 4673 1 1 38 ILE HG13 H -3.758 -2.915 -0.074 1.00 . A A . 38 ILE HG13 1 1 6 4674 1 1 38 ILE HG21 H -5.851 -3.898 -0.980 1.00 . A A . 38 ILE HG21 1 1 6 4675 1 1 38 ILE HG22 H -6.905 -2.943 -2.025 1.00 . A A . 38 ILE HG22 1 1 6 4676 1 1 38 ILE HG23 H -5.357 -3.532 -2.634 1.00 . A A . 38 ILE HG23 1 1 6 4677 1 1 38 ILE N N -6.396 0.129 -2.156 1.00 . A A . 38 ILE N 1 1 6 4678 1 1 38 ILE O O -6.027 -1.930 -4.253 1.00 . A A . 38 ILE O 1 1 6 4679 1 1 39 GLY C C -2.597 -0.763 -6.374 1.00 . A A . 39 GLY C 1 1 6 4680 1 1 39 GLY CA C -3.934 -1.230 -5.852 1.00 . A A . 39 GLY CA 1 1 6 4681 1 1 39 GLY H H -3.532 -0.135 -4.103 1.00 . A A . 39 GLY H 1 1 6 4682 1 1 39 GLY HA2 H -3.966 -2.308 -5.875 1.00 . A A . 39 GLY HA2 1 1 6 4683 1 1 39 GLY HA3 H -4.717 -0.837 -6.486 1.00 . A A . 39 GLY HA3 1 1 6 4684 1 1 39 GLY N N -4.147 -0.778 -4.493 1.00 . A A . 39 GLY N 1 1 6 4685 1 1 39 GLY O O -2.448 0.422 -6.672 1.00 . A A . 39 GLY O 1 1 6 4686 1 1 40 GLU C C 0.454 -0.550 -5.794 1.00 . A A . 40 GLU C 1 1 6 4687 1 1 40 GLU CA C -0.259 -1.374 -6.862 1.00 . A A . 40 GLU CA 1 1 6 4688 1 1 40 GLU CB C -0.248 -0.643 -8.211 1.00 . A A . 40 GLU CB 1 1 6 4689 1 1 40 GLU CD C 1.096 0.433 -10.044 1.00 . A A . 40 GLU CD 1 1 6 4690 1 1 40 GLU CG C 1.138 -0.249 -8.695 1.00 . A A . 40 GLU CG 1 1 6 4691 1 1 40 GLU H H -1.846 -2.601 -6.222 1.00 . A A . 40 GLU H 1 1 6 4692 1 1 40 GLU HA H 0.263 -2.315 -6.974 1.00 . A A . 40 GLU HA 1 1 6 4693 1 1 40 GLU HB2 H -0.692 -1.285 -8.955 1.00 . A A . 40 GLU HB2 1 1 6 4694 1 1 40 GLU HB3 H -0.842 0.255 -8.122 1.00 . A A . 40 GLU HB3 1 1 6 4695 1 1 40 GLU HG2 H 1.579 0.427 -7.978 1.00 . A A . 40 GLU HG2 1 1 6 4696 1 1 40 GLU HG3 H 1.746 -1.139 -8.773 1.00 . A A . 40 GLU HG3 1 1 6 4697 1 1 40 GLU N N -1.630 -1.678 -6.448 1.00 . A A . 40 GLU N 1 1 6 4698 1 1 40 GLU O O 1.538 -0.903 -5.333 1.00 . A A . 40 GLU O 1 1 6 4699 1 1 40 GLU OE1 O 1.027 -0.276 -11.067 1.00 . A A . 40 GLU OE1 1 1 6 4700 1 1 40 GLU OE2 O 1.129 1.681 -10.087 1.00 . A A . 40 GLU OE2 1 1 6 4701 1 1 41 ARG C C -0.765 2.093 -3.633 1.00 . A A . 41 ARG C 1 1 6 4702 1 1 41 ARG CA C 0.367 1.454 -4.434 1.00 . A A . 41 ARG CA 1 1 6 4703 1 1 41 ARG CB C 1.224 2.482 -5.181 1.00 . A A . 41 ARG CB 1 1 6 4704 1 1 41 ARG CD C -0.304 4.353 -5.882 1.00 . A A . 41 ARG CD 1 1 6 4705 1 1 41 ARG CG C 0.519 3.166 -6.350 1.00 . A A . 41 ARG CG 1 1 6 4706 1 1 41 ARG CZ C -0.251 6.363 -7.299 1.00 . A A . 41 ARG CZ 1 1 6 4707 1 1 41 ARG H H -1.084 0.702 -5.753 1.00 . A A . 41 ARG H 1 1 6 4708 1 1 41 ARG HA H 0.995 0.895 -3.758 1.00 . A A . 41 ARG HA 1 1 6 4709 1 1 41 ARG HB2 H 1.546 3.242 -4.486 1.00 . A A . 41 ARG HB2 1 1 6 4710 1 1 41 ARG HB3 H 2.090 1.967 -5.569 1.00 . A A . 41 ARG HB3 1 1 6 4711 1 1 41 ARG HD2 H -1.157 3.974 -5.330 1.00 . A A . 41 ARG HD2 1 1 6 4712 1 1 41 ARG HD3 H 0.305 4.956 -5.223 1.00 . A A . 41 ARG HD3 1 1 6 4713 1 1 41 ARG HE H -1.579 4.873 -7.477 1.00 . A A . 41 ARG HE 1 1 6 4714 1 1 41 ARG HG2 H 1.260 3.505 -7.058 1.00 . A A . 41 ARG HG2 1 1 6 4715 1 1 41 ARG HG3 H -0.139 2.443 -6.823 1.00 . A A . 41 ARG HG3 1 1 6 4716 1 1 41 ARG HH11 H 1.243 6.237 -5.939 1.00 . A A . 41 ARG HH11 1 1 6 4717 1 1 41 ARG HH12 H 1.237 7.684 -6.895 1.00 . A A . 41 ARG HH12 1 1 6 4718 1 1 41 ARG HH21 H -1.622 6.787 -8.735 1.00 . A A . 41 ARG HH21 1 1 6 4719 1 1 41 ARG HH22 H -0.389 7.994 -8.500 1.00 . A A . 41 ARG HH22 1 1 6 4720 1 1 41 ARG N N -0.189 0.525 -5.388 1.00 . A A . 41 ARG N 1 1 6 4721 1 1 41 ARG NE N -0.785 5.188 -6.977 1.00 . A A . 41 ARG NE 1 1 6 4722 1 1 41 ARG NH1 N 0.830 6.795 -6.660 1.00 . A A . 41 ARG NH1 1 1 6 4723 1 1 41 ARG NH2 N -0.798 7.107 -8.251 1.00 . A A . 41 ARG NH2 1 1 6 4724 1 1 41 ARG O O -0.790 3.289 -3.398 1.00 . A A . 41 ARG O 1 1 6 4725 1 1 42 CYS C C -3.777 2.624 -3.222 1.00 . A A . 42 CYS C 1 1 6 4726 1 1 42 CYS CA C -2.909 1.592 -2.493 1.00 . A A . 42 CYS CA 1 1 6 4727 1 1 42 CYS CB C -2.624 2.017 -1.034 1.00 . A A . 42 CYS CB 1 1 6 4728 1 1 42 CYS H H -1.549 0.296 -3.447 1.00 . A A . 42 CYS H 1 1 6 4729 1 1 42 CYS HA H -3.488 0.689 -2.445 1.00 . A A . 42 CYS HA 1 1 6 4730 1 1 42 CYS HB2 H -3.544 2.371 -0.601 1.00 . A A . 42 CYS HB2 1 1 6 4731 1 1 42 CYS HB3 H -2.299 1.143 -0.483 1.00 . A A . 42 CYS HB3 1 1 6 4732 1 1 42 CYS N N -1.693 1.231 -3.234 1.00 . A A . 42 CYS N 1 1 6 4733 1 1 42 CYS O O -3.620 3.826 -3.029 1.00 . A A . 42 CYS O 1 1 6 4734 1 1 42 CYS SG S -1.382 3.325 -0.759 1.00 . A A . 42 CYS SG 1 1 6 4735 1 1 43 GLN C C -6.748 2.246 -5.476 1.00 . A A . 43 GLN C 1 1 6 4736 1 1 43 GLN CA C -5.624 3.018 -4.785 1.00 . A A . 43 GLN CA 1 1 6 4737 1 1 43 GLN CB C -4.852 3.815 -5.839 1.00 . A A . 43 GLN CB 1 1 6 4738 1 1 43 GLN CD C -3.785 3.826 -8.122 1.00 . A A . 43 GLN CD 1 1 6 4739 1 1 43 GLN CG C -4.341 2.977 -6.998 1.00 . A A . 43 GLN CG 1 1 6 4740 1 1 43 GLN H H -4.849 1.164 -4.136 1.00 . A A . 43 GLN H 1 1 6 4741 1 1 43 GLN HA H -6.064 3.708 -4.082 1.00 . A A . 43 GLN HA 1 1 6 4742 1 1 43 GLN HB2 H -5.498 4.585 -6.235 1.00 . A A . 43 GLN HB2 1 1 6 4743 1 1 43 GLN HB3 H -4.004 4.285 -5.362 1.00 . A A . 43 GLN HB3 1 1 6 4744 1 1 43 GLN HE21 H -4.329 2.473 -9.464 1.00 . A A . 43 GLN HE21 1 1 6 4745 1 1 43 GLN HE22 H -3.564 3.888 -10.092 1.00 . A A . 43 GLN HE22 1 1 6 4746 1 1 43 GLN HG2 H -3.561 2.324 -6.638 1.00 . A A . 43 GLN HG2 1 1 6 4747 1 1 43 GLN HG3 H -5.159 2.384 -7.383 1.00 . A A . 43 GLN HG3 1 1 6 4748 1 1 43 GLN N N -4.731 2.134 -4.043 1.00 . A A . 43 GLN N 1 1 6 4749 1 1 43 GLN NE2 N -3.899 3.343 -9.348 1.00 . A A . 43 GLN NE2 1 1 6 4750 1 1 43 GLN O O -7.472 2.817 -6.288 1.00 . A A . 43 GLN O 1 1 6 4751 1 1 43 GLN OE1 O -3.258 4.908 -7.892 1.00 . A A . 43 GLN OE1 1 1 6 4752 1 1 44 TYR C C -8.822 -0.532 -4.876 1.00 . A A . 44 TYR C 1 1 6 4753 1 1 44 TYR CA C -7.933 0.180 -5.854 1.00 . A A . 44 TYR CA 1 1 6 4754 1 1 44 TYR CB C -7.331 -0.800 -6.864 1.00 . A A . 44 TYR CB 1 1 6 4755 1 1 44 TYR CD1 C -7.858 0.578 -8.911 1.00 . A A . 44 TYR CD1 1 1 6 4756 1 1 44 TYR CD2 C -5.637 -0.239 -8.632 1.00 . A A . 44 TYR CD2 1 1 6 4757 1 1 44 TYR CE1 C -7.492 1.173 -10.101 1.00 . A A . 44 TYR CE1 1 1 6 4758 1 1 44 TYR CE2 C -5.264 0.353 -9.818 1.00 . A A . 44 TYR CE2 1 1 6 4759 1 1 44 TYR CG C -6.937 -0.136 -8.159 1.00 . A A . 44 TYR CG 1 1 6 4760 1 1 44 TYR CZ C -6.232 1.115 -10.531 1.00 . A A . 44 TYR CZ 1 1 6 4761 1 1 44 TYR H H -6.371 0.529 -4.474 1.00 . A A . 44 TYR H 1 1 6 4762 1 1 44 TYR HA H -8.554 0.877 -6.387 1.00 . A A . 44 TYR HA 1 1 6 4763 1 1 44 TYR HB2 H -6.446 -1.253 -6.438 1.00 . A A . 44 TYR HB2 1 1 6 4764 1 1 44 TYR HB3 H -8.053 -1.568 -7.088 1.00 . A A . 44 TYR HB3 1 1 6 4765 1 1 44 TYR HD1 H -8.873 0.666 -8.554 1.00 . A A . 44 TYR HD1 1 1 6 4766 1 1 44 TYR HD2 H -4.911 -0.794 -8.056 1.00 . A A . 44 TYR HD2 1 1 6 4767 1 1 44 TYR HE1 H -8.222 1.726 -10.675 1.00 . A A . 44 TYR HE1 1 1 6 4768 1 1 44 TYR HE2 H -4.247 0.262 -10.169 1.00 . A A . 44 TYR HE2 1 1 6 4769 1 1 44 TYR HH H -5.268 1.022 -12.237 1.00 . A A . 44 TYR HH 1 1 6 4770 1 1 44 TYR N N -6.911 0.957 -5.175 1.00 . A A . 44 TYR N 1 1 6 4771 1 1 44 TYR O O -8.607 -1.692 -4.531 1.00 . A A . 44 TYR O 1 1 6 4772 1 1 44 TYR OH O -5.822 1.645 -11.734 1.00 . A A . 44 TYR OH 1 1 6 4773 1 1 45 ARG C C -10.312 -0.835 -2.281 1.00 . A A . 45 ARG C 1 1 6 4774 1 1 45 ARG CA C -10.873 -0.362 -3.606 1.00 . A A . 45 ARG CA 1 1 6 4775 1 1 45 ARG CB C -11.560 -1.522 -4.327 1.00 . A A . 45 ARG CB 1 1 6 4776 1 1 45 ARG CD C -11.226 -1.253 -6.817 1.00 . A A . 45 ARG CD 1 1 6 4777 1 1 45 ARG CG C -12.201 -1.131 -5.653 1.00 . A A . 45 ARG CG 1 1 6 4778 1 1 45 ARG CZ C -10.736 -3.052 -8.443 1.00 . A A . 45 ARG CZ 1 1 6 4779 1 1 45 ARG H H -9.890 1.144 -4.701 1.00 . A A . 45 ARG H 1 1 6 4780 1 1 45 ARG HA H -11.601 0.414 -3.422 1.00 . A A . 45 ARG HA 1 1 6 4781 1 1 45 ARG HB2 H -10.814 -2.282 -4.519 1.00 . A A . 45 ARG HB2 1 1 6 4782 1 1 45 ARG HB3 H -12.325 -1.932 -3.683 1.00 . A A . 45 ARG HB3 1 1 6 4783 1 1 45 ARG HD2 H -11.619 -0.704 -7.662 1.00 . A A . 45 ARG HD2 1 1 6 4784 1 1 45 ARG HD3 H -10.265 -0.829 -6.520 1.00 . A A . 45 ARG HD3 1 1 6 4785 1 1 45 ARG HE H -11.127 -3.331 -6.500 1.00 . A A . 45 ARG HE 1 1 6 4786 1 1 45 ARG HG2 H -13.044 -1.778 -5.839 1.00 . A A . 45 ARG HG2 1 1 6 4787 1 1 45 ARG HG3 H -12.540 -0.106 -5.586 1.00 . A A . 45 ARG HG3 1 1 6 4788 1 1 45 ARG HH11 H -10.743 -1.189 -9.256 1.00 . A A . 45 ARG HH11 1 1 6 4789 1 1 45 ARG HH12 H -10.404 -2.489 -10.364 1.00 . A A . 45 ARG HH12 1 1 6 4790 1 1 45 ARG HH21 H -10.685 -5.015 -7.957 1.00 . A A . 45 ARG HH21 1 1 6 4791 1 1 45 ARG HH22 H -10.361 -4.660 -9.626 1.00 . A A . 45 ARG HH22 1 1 6 4792 1 1 45 ARG N N -9.835 0.191 -4.440 1.00 . A A . 45 ARG N 1 1 6 4793 1 1 45 ARG NE N -11.027 -2.649 -7.205 1.00 . A A . 45 ARG NE 1 1 6 4794 1 1 45 ARG NH1 N -10.615 -2.172 -9.431 1.00 . A A . 45 ARG NH1 1 1 6 4795 1 1 45 ARG NH2 N -10.581 -4.344 -8.694 1.00 . A A . 45 ARG NH2 1 1 6 4796 1 1 45 ARG O O -9.163 -0.558 -1.921 1.00 . A A . 45 ARG O 1 1 6 4797 1 1 46 ASP C C -10.617 -3.460 -0.164 1.00 . A A . 46 ASP C 1 1 6 4798 1 1 46 ASP CA C -10.829 -1.971 -0.222 1.00 . A A . 46 ASP CA 1 1 6 4799 1 1 46 ASP CB C -11.959 -1.538 0.715 1.00 . A A . 46 ASP CB 1 1 6 4800 1 1 46 ASP CG C -13.247 -1.243 -0.025 1.00 . A A . 46 ASP CG 1 1 6 4801 1 1 46 ASP H H -11.943 -1.907 -2.000 1.00 . A A . 46 ASP H 1 1 6 4802 1 1 46 ASP HA H -9.915 -1.480 0.077 1.00 . A A . 46 ASP HA 1 1 6 4803 1 1 46 ASP HB2 H -12.147 -2.327 1.428 1.00 . A A . 46 ASP HB2 1 1 6 4804 1 1 46 ASP HB3 H -11.656 -0.647 1.244 1.00 . A A . 46 ASP HB3 1 1 6 4805 1 1 46 ASP N N -11.122 -1.579 -1.577 1.00 . A A . 46 ASP N 1 1 6 4806 1 1 46 ASP O O -11.195 -4.155 0.676 1.00 . A A . 46 ASP O 1 1 6 4807 1 1 46 ASP OD1 O -13.946 -2.200 -0.415 1.00 . A A . 46 ASP OD1 1 1 6 4808 1 1 46 ASP OD2 O -13.571 -0.057 -0.201 1.00 . A A . 46 ASP OD2 1 1 6 4809 1 1 47 LEU C C -8.924 -5.897 0.174 1.00 . A A . 47 LEU C 1 1 6 4810 1 1 47 LEU CA C -9.424 -5.353 -1.163 1.00 . A A . 47 LEU CA 1 1 6 4811 1 1 47 LEU CB C -8.345 -5.563 -2.231 1.00 . A A . 47 LEU CB 1 1 6 4812 1 1 47 LEU CD1 C -7.519 -5.269 -4.578 1.00 . A A . 47 LEU CD1 1 1 6 4813 1 1 47 LEU CD2 C -9.907 -5.860 -4.171 1.00 . A A . 47 LEU CD2 1 1 6 4814 1 1 47 LEU CG C -8.706 -5.095 -3.644 1.00 . A A . 47 LEU CG 1 1 6 4815 1 1 47 LEU H H -9.370 -3.312 -1.715 1.00 . A A . 47 LEU H 1 1 6 4816 1 1 47 LEU HA H -10.311 -5.895 -1.451 1.00 . A A . 47 LEU HA 1 1 6 4817 1 1 47 LEU HB2 H -7.455 -5.035 -1.920 1.00 . A A . 47 LEU HB2 1 1 6 4818 1 1 47 LEU HB3 H -8.118 -6.616 -2.276 1.00 . A A . 47 LEU HB3 1 1 6 4819 1 1 47 LEU HD11 H -7.794 -4.953 -5.575 1.00 . A A . 47 LEU HD11 1 1 6 4820 1 1 47 LEU HD12 H -6.693 -4.671 -4.225 1.00 . A A . 47 LEU HD12 1 1 6 4821 1 1 47 LEU HD13 H -7.228 -6.308 -4.598 1.00 . A A . 47 LEU HD13 1 1 6 4822 1 1 47 LEU HD21 H -10.177 -5.482 -5.147 1.00 . A A . 47 LEU HD21 1 1 6 4823 1 1 47 LEU HD22 H -9.660 -6.909 -4.246 1.00 . A A . 47 LEU HD22 1 1 6 4824 1 1 47 LEU HD23 H -10.737 -5.734 -3.492 1.00 . A A . 47 LEU HD23 1 1 6 4825 1 1 47 LEU HG H -8.960 -4.046 -3.618 1.00 . A A . 47 LEU HG 1 1 6 4826 1 1 47 LEU N N -9.768 -3.938 -1.070 1.00 . A A . 47 LEU N 1 1 6 4827 1 1 47 LEU O O -8.909 -7.103 0.397 1.00 . A A . 47 LEU O 1 1 6 4828 1 1 48 LYS C C -9.164 -5.831 3.282 1.00 . A A . 48 LYS C 1 1 6 4829 1 1 48 LYS CA C -8.023 -5.423 2.356 1.00 . A A . 48 LYS CA 1 1 6 4830 1 1 48 LYS CB C -7.162 -4.325 2.998 1.00 . A A . 48 LYS CB 1 1 6 4831 1 1 48 LYS CD C -7.027 -2.216 1.607 1.00 . A A . 48 LYS CD 1 1 6 4832 1 1 48 LYS CE C -5.736 -1.500 1.995 1.00 . A A . 48 LYS CE 1 1 6 4833 1 1 48 LYS CG C -7.683 -2.909 2.791 1.00 . A A . 48 LYS CG 1 1 6 4834 1 1 48 LYS H H -8.601 -4.054 0.862 1.00 . A A . 48 LYS H 1 1 6 4835 1 1 48 LYS HA H -7.403 -6.287 2.191 1.00 . A A . 48 LYS HA 1 1 6 4836 1 1 48 LYS HB2 H -7.105 -4.507 4.060 1.00 . A A . 48 LYS HB2 1 1 6 4837 1 1 48 LYS HB3 H -6.166 -4.382 2.581 1.00 . A A . 48 LYS HB3 1 1 6 4838 1 1 48 LYS HD2 H -6.802 -2.952 0.856 1.00 . A A . 48 LYS HD2 1 1 6 4839 1 1 48 LYS HD3 H -7.719 -1.490 1.202 1.00 . A A . 48 LYS HD3 1 1 6 4840 1 1 48 LYS HE2 H -5.311 -1.055 1.103 1.00 . A A . 48 LYS HE2 1 1 6 4841 1 1 48 LYS HE3 H -5.980 -0.718 2.698 1.00 . A A . 48 LYS HE3 1 1 6 4842 1 1 48 LYS HG2 H -8.745 -2.947 2.617 1.00 . A A . 48 LYS HG2 1 1 6 4843 1 1 48 LYS HG3 H -7.486 -2.334 3.684 1.00 . A A . 48 LYS HG3 1 1 6 4844 1 1 48 LYS HZ1 H -4.576 -3.255 2.018 1.00 . A A . 48 LYS HZ1 1 1 6 4845 1 1 48 LYS HZ2 H -5.069 -2.728 3.554 1.00 . A A . 48 LYS HZ2 1 1 6 4846 1 1 48 LYS HZ3 H -3.825 -1.917 2.744 1.00 . A A . 48 LYS HZ3 1 1 6 4847 1 1 48 LYS N N -8.526 -5.006 1.066 1.00 . A A . 48 LYS N 1 1 6 4848 1 1 48 LYS NZ N -4.735 -2.414 2.616 1.00 . A A . 48 LYS NZ 1 1 6 4849 1 1 48 LYS O O -9.286 -6.997 3.634 1.00 . A A . 48 LYS O 1 1 6 4850 1 1 49 TRP C C -12.399 -5.421 4.082 1.00 . A A . 49 TRP C 1 1 6 4851 1 1 49 TRP CA C -11.016 -5.146 4.672 1.00 . A A . 49 TRP CA 1 1 6 4852 1 1 49 TRP CB C -11.088 -4.001 5.679 1.00 . A A . 49 TRP CB 1 1 6 4853 1 1 49 TRP CD1 C -11.387 -5.478 7.738 1.00 . A A . 49 TRP CD1 1 1 6 4854 1 1 49 TRP CD2 C -12.854 -3.795 7.612 1.00 . A A . 49 TRP CD2 1 1 6 4855 1 1 49 TRP CE2 C -13.120 -4.541 8.777 1.00 . A A . 49 TRP CE2 1 1 6 4856 1 1 49 TRP CE3 C -13.652 -2.687 7.331 1.00 . A A . 49 TRP CE3 1 1 6 4857 1 1 49 TRP CG C -11.742 -4.415 6.960 1.00 . A A . 49 TRP CG 1 1 6 4858 1 1 49 TRP CH2 C -14.912 -3.123 9.352 1.00 . A A . 49 TRP CH2 1 1 6 4859 1 1 49 TRP CZ2 C -14.148 -4.214 9.653 1.00 . A A . 49 TRP CZ2 1 1 6 4860 1 1 49 TRP CZ3 C -14.672 -2.363 8.205 1.00 . A A . 49 TRP CZ3 1 1 6 4861 1 1 49 TRP H H -9.948 -3.994 3.266 1.00 . A A . 49 TRP H 1 1 6 4862 1 1 49 TRP HA H -10.704 -6.033 5.201 1.00 . A A . 49 TRP HA 1 1 6 4863 1 1 49 TRP HB2 H -10.086 -3.667 5.906 1.00 . A A . 49 TRP HB2 1 1 6 4864 1 1 49 TRP HB3 H -11.652 -3.182 5.251 1.00 . A A . 49 TRP HB3 1 1 6 4865 1 1 49 TRP HD1 H -10.576 -6.152 7.511 1.00 . A A . 49 TRP HD1 1 1 6 4866 1 1 49 TRP HE1 H -12.164 -6.249 9.534 1.00 . A A . 49 TRP HE1 1 1 6 4867 1 1 49 TRP HE3 H -13.482 -2.086 6.451 1.00 . A A . 49 TRP HE3 1 1 6 4868 1 1 49 TRP HH2 H -15.720 -2.830 10.004 1.00 . A A . 49 TRP HH2 1 1 6 4869 1 1 49 TRP HZ2 H -14.344 -4.792 10.544 1.00 . A A . 49 TRP HZ2 1 1 6 4870 1 1 49 TRP HZ3 H -15.299 -1.508 8.003 1.00 . A A . 49 TRP HZ3 1 1 6 4871 1 1 49 TRP N N -10.001 -4.879 3.668 1.00 . A A . 49 TRP N 1 1 6 4872 1 1 49 TRP NE1 N -12.214 -5.562 8.826 1.00 . A A . 49 TRP NE1 1 1 6 4873 1 1 49 TRP O O -13.102 -6.312 4.543 1.00 . A A . 49 TRP O 1 1 6 4874 1 1 50 TRP C C -14.345 -5.649 1.406 1.00 . A A . 50 TRP C 1 1 6 4875 1 1 50 TRP CA C -14.189 -4.712 2.599 1.00 . A A . 50 TRP CA 1 1 6 4876 1 1 50 TRP CB C -14.700 -3.325 2.206 1.00 . A A . 50 TRP CB 1 1 6 4877 1 1 50 TRP CD1 C -13.769 -1.500 3.746 1.00 . A A . 50 TRP CD1 1 1 6 4878 1 1 50 TRP CD2 C -15.911 -2.022 4.127 1.00 . A A . 50 TRP CD2 1 1 6 4879 1 1 50 TRP CE2 C -15.531 -1.007 5.022 1.00 . A A . 50 TRP CE2 1 1 6 4880 1 1 50 TRP CE3 C -17.217 -2.513 4.178 1.00 . A A . 50 TRP CE3 1 1 6 4881 1 1 50 TRP CG C -14.768 -2.327 3.320 1.00 . A A . 50 TRP CG 1 1 6 4882 1 1 50 TRP CH2 C -17.687 -0.969 5.985 1.00 . A A . 50 TRP CH2 1 1 6 4883 1 1 50 TRP CZ2 C -16.413 -0.470 5.958 1.00 . A A . 50 TRP CZ2 1 1 6 4884 1 1 50 TRP CZ3 C -18.092 -1.981 5.106 1.00 . A A . 50 TRP CZ3 1 1 6 4885 1 1 50 TRP H H -12.164 -4.056 2.634 1.00 . A A . 50 TRP H 1 1 6 4886 1 1 50 TRP HA H -14.796 -5.087 3.409 1.00 . A A . 50 TRP HA 1 1 6 4887 1 1 50 TRP HB2 H -14.049 -2.919 1.447 1.00 . A A . 50 TRP HB2 1 1 6 4888 1 1 50 TRP HB3 H -15.693 -3.428 1.794 1.00 . A A . 50 TRP HB3 1 1 6 4889 1 1 50 TRP HD1 H -12.772 -1.488 3.331 1.00 . A A . 50 TRP HD1 1 1 6 4890 1 1 50 TRP HE1 H -13.688 -0.024 5.242 1.00 . A A . 50 TRP HE1 1 1 6 4891 1 1 50 TRP HE3 H -17.547 -3.294 3.508 1.00 . A A . 50 TRP HE3 1 1 6 4892 1 1 50 TRP HH2 H -18.405 -0.582 6.693 1.00 . A A . 50 TRP HH2 1 1 6 4893 1 1 50 TRP HZ2 H -16.114 0.310 6.643 1.00 . A A . 50 TRP HZ2 1 1 6 4894 1 1 50 TRP HZ3 H -19.109 -2.344 5.160 1.00 . A A . 50 TRP HZ3 1 1 6 4895 1 1 50 TRP N N -12.804 -4.652 3.077 1.00 . A A . 50 TRP N 1 1 6 4896 1 1 50 TRP NE1 N -14.219 -0.705 4.770 1.00 . A A . 50 TRP NE1 1 1 6 4897 1 1 50 TRP O O -15.029 -6.671 1.504 1.00 . A A . 50 TRP O 1 1 6 4898 1 1 51 GLU C C -13.674 -7.498 -0.807 1.00 . A A . 51 GLU C 1 1 6 4899 1 1 51 GLU CA C -13.867 -6.001 -0.976 1.00 . A A . 51 GLU CA 1 1 6 4900 1 1 51 GLU CB C -12.865 -5.471 -2.008 1.00 . A A . 51 GLU CB 1 1 6 4901 1 1 51 GLU CD C -14.505 -4.310 -3.521 1.00 . A A . 51 GLU CD 1 1 6 4902 1 1 51 GLU CG C -13.277 -4.165 -2.652 1.00 . A A . 51 GLU CG 1 1 6 4903 1 1 51 GLU H H -13.104 -4.515 0.318 1.00 . A A . 51 GLU H 1 1 6 4904 1 1 51 GLU HA H -14.869 -5.818 -1.335 1.00 . A A . 51 GLU HA 1 1 6 4905 1 1 51 GLU HB2 H -11.917 -5.306 -1.520 1.00 . A A . 51 GLU HB2 1 1 6 4906 1 1 51 GLU HB3 H -12.741 -6.208 -2.787 1.00 . A A . 51 GLU HB3 1 1 6 4907 1 1 51 GLU HG2 H -13.484 -3.448 -1.870 1.00 . A A . 51 GLU HG2 1 1 6 4908 1 1 51 GLU HG3 H -12.461 -3.804 -3.260 1.00 . A A . 51 GLU HG3 1 1 6 4909 1 1 51 GLU N N -13.708 -5.289 0.290 1.00 . A A . 51 GLU N 1 1 6 4910 1 1 51 GLU O O -14.580 -8.290 -1.074 1.00 . A A . 51 GLU O 1 1 6 4911 1 1 51 GLU OE1 O -15.629 -4.171 -2.994 1.00 . A A . 51 GLU OE1 1 1 6 4912 1 1 51 GLU OE2 O -14.354 -4.567 -4.729 1.00 . A A . 51 GLU OE2 1 1 6 4913 1 1 52 LEU C C -12.398 -9.761 1.182 1.00 . A A . 52 LEU C 1 1 6 4914 1 1 52 LEU CA C -12.147 -9.278 -0.233 1.00 . A A . 52 LEU CA 1 1 6 4915 1 1 52 LEU CB C -10.682 -9.466 -0.598 1.00 . A A . 52 LEU CB 1 1 6 4916 1 1 52 LEU CD1 C -8.796 -9.063 -2.199 1.00 . A A . 52 LEU CD1 1 1 6 4917 1 1 52 LEU CD2 C -11.110 -9.383 -3.074 1.00 . A A . 52 LEU CD2 1 1 6 4918 1 1 52 LEU CG C -10.273 -8.835 -1.928 1.00 . A A . 52 LEU CG 1 1 6 4919 1 1 52 LEU H H -11.842 -7.193 -0.106 1.00 . A A . 52 LEU H 1 1 6 4920 1 1 52 LEU HA H -12.762 -9.839 -0.915 1.00 . A A . 52 LEU HA 1 1 6 4921 1 1 52 LEU HB2 H -10.083 -9.020 0.185 1.00 . A A . 52 LEU HB2 1 1 6 4922 1 1 52 LEU HB3 H -10.471 -10.525 -0.639 1.00 . A A . 52 LEU HB3 1 1 6 4923 1 1 52 LEU HD11 H -8.535 -8.636 -3.155 1.00 . A A . 52 LEU HD11 1 1 6 4924 1 1 52 LEU HD12 H -8.211 -8.592 -1.422 1.00 . A A . 52 LEU HD12 1 1 6 4925 1 1 52 LEU HD13 H -8.591 -10.123 -2.209 1.00 . A A . 52 LEU HD13 1 1 6 4926 1 1 52 LEU HD21 H -11.007 -10.457 -3.113 1.00 . A A . 52 LEU HD21 1 1 6 4927 1 1 52 LEU HD22 H -12.147 -9.127 -2.916 1.00 . A A . 52 LEU HD22 1 1 6 4928 1 1 52 LEU HD23 H -10.771 -8.954 -4.006 1.00 . A A . 52 LEU HD23 1 1 6 4929 1 1 52 LEU HG H -10.444 -7.766 -1.865 1.00 . A A . 52 LEU HG 1 1 6 4930 1 1 52 LEU N N -12.496 -7.875 -0.359 1.00 . A A . 52 LEU N 1 1 6 4931 1 1 52 LEU O O -12.806 -10.905 1.391 1.00 . A A . 52 LEU O 1 1 6 4932 1 1 53 ARG C C -11.235 -10.174 3.994 1.00 . A A . 53 ARG C 1 1 6 4933 1 1 53 ARG CA C -12.286 -9.151 3.563 1.00 . A A . 53 ARG CA 1 1 6 4934 1 1 53 ARG CB C -13.697 -9.653 3.920 1.00 . A A . 53 ARG CB 1 1 6 4935 1 1 53 ARG CD C -13.937 -8.688 6.240 1.00 . A A . 53 ARG CD 1 1 6 4936 1 1 53 ARG CG C -13.884 -9.955 5.403 1.00 . A A . 53 ARG CG 1 1 6 4937 1 1 53 ARG CZ C -15.754 -7.115 6.827 1.00 . A A . 53 ARG CZ 1 1 6 4938 1 1 53 ARG H H -11.899 -7.961 1.855 1.00 . A A . 53 ARG H 1 1 6 4939 1 1 53 ARG HA H -12.103 -8.228 4.095 1.00 . A A . 53 ARG HA 1 1 6 4940 1 1 53 ARG HB2 H -14.417 -8.901 3.635 1.00 . A A . 53 ARG HB2 1 1 6 4941 1 1 53 ARG HB3 H -13.897 -10.557 3.364 1.00 . A A . 53 ARG HB3 1 1 6 4942 1 1 53 ARG HD2 H -13.322 -8.823 7.116 1.00 . A A . 53 ARG HD2 1 1 6 4943 1 1 53 ARG HD3 H -13.549 -7.871 5.651 1.00 . A A . 53 ARG HD3 1 1 6 4944 1 1 53 ARG HE H -15.900 -9.110 6.882 1.00 . A A . 53 ARG HE 1 1 6 4945 1 1 53 ARG HG2 H -14.809 -10.498 5.537 1.00 . A A . 53 ARG HG2 1 1 6 4946 1 1 53 ARG HG3 H -13.059 -10.563 5.745 1.00 . A A . 53 ARG HG3 1 1 6 4947 1 1 53 ARG HH11 H -14.109 -6.223 6.046 1.00 . A A . 53 ARG HH11 1 1 6 4948 1 1 53 ARG HH12 H -15.356 -5.145 6.585 1.00 . A A . 53 ARG HH12 1 1 6 4949 1 1 53 ARG HH21 H -17.538 -7.704 7.583 1.00 . A A . 53 ARG HH21 1 1 6 4950 1 1 53 ARG HH22 H -17.308 -5.979 7.470 1.00 . A A . 53 ARG HH22 1 1 6 4951 1 1 53 ARG N N -12.167 -8.860 2.131 1.00 . A A . 53 ARG N 1 1 6 4952 1 1 53 ARG NE N -15.300 -8.357 6.665 1.00 . A A . 53 ARG NE 1 1 6 4953 1 1 53 ARG NH1 N -15.016 -6.076 6.457 1.00 . A A . 53 ARG NH1 1 1 6 4954 1 1 53 ARG NH2 N -16.963 -6.915 7.327 1.00 . A A . 53 ARG NH2 1 1 6 4955 1 1 53 ARG O O -11.449 -11.384 3.779 1.00 . A A . 53 ARG O 1 1 6 4956 1 1 53 ARG OXT O -10.195 -9.762 4.544 1.00 . A A . 53 ARG OXT 1 1 7 4957 1 1 1 ASN C C 15.382 -8.508 2.150 1.00 . A A . 1 ASN C 1 1 7 4958 1 1 1 ASN CA C 16.489 -7.504 2.419 1.00 . A A . 1 ASN CA 1 1 7 4959 1 1 1 ASN CB C 16.421 -6.380 1.380 1.00 . A A . 1 ASN CB 1 1 7 4960 1 1 1 ASN CG C 17.193 -5.147 1.802 1.00 . A A . 1 ASN CG 1 1 7 4961 1 1 1 ASN H1 H 17.996 -8.586 1.466 1.00 . A A . 1 ASN H1 1 1 7 4962 1 1 1 ASN H2 H 17.854 -8.912 3.117 1.00 . A A . 1 ASN H2 1 1 7 4963 1 1 1 ASN H3 H 18.572 -7.466 2.609 1.00 . A A . 1 ASN H3 1 1 7 4964 1 1 1 ASN HA H 16.338 -7.080 3.401 1.00 . A A . 1 ASN HA 1 1 7 4965 1 1 1 ASN HB2 H 16.830 -6.739 0.448 1.00 . A A . 1 ASN HB2 1 1 7 4966 1 1 1 ASN HB3 H 15.387 -6.102 1.231 1.00 . A A . 1 ASN HB3 1 1 7 4967 1 1 1 ASN HD21 H 17.515 -4.660 -0.099 1.00 . A A . 1 ASN HD21 1 1 7 4968 1 1 1 ASN HD22 H 18.187 -3.581 1.078 1.00 . A A . 1 ASN HD22 1 1 7 4969 1 1 1 ASN N N 17.819 -8.161 2.403 1.00 . A A . 1 ASN N 1 1 7 4970 1 1 1 ASN ND2 N 17.680 -4.388 0.830 1.00 . A A . 1 ASN ND2 1 1 7 4971 1 1 1 ASN O O 15.584 -9.482 1.425 1.00 . A A . 1 ASN O 1 1 7 4972 1 1 1 ASN OD1 O 17.341 -4.871 2.992 1.00 . A A . 1 ASN OD1 1 1 7 4973 1 1 2 SER C C 11.913 -8.515 3.450 1.00 . A A . 2 SER C 1 1 7 4974 1 1 2 SER CA C 13.051 -9.111 2.625 1.00 . A A . 2 SER CA 1 1 7 4975 1 1 2 SER CB C 13.375 -10.536 3.101 1.00 . A A . 2 SER CB 1 1 7 4976 1 1 2 SER H H 14.137 -7.417 3.256 1.00 . A A . 2 SER H 1 1 7 4977 1 1 2 SER HA H 12.750 -9.141 1.587 1.00 . A A . 2 SER HA 1 1 7 4978 1 1 2 SER HB2 H 12.462 -11.109 3.162 1.00 . A A . 2 SER HB2 1 1 7 4979 1 1 2 SER HB3 H 14.046 -11.003 2.394 1.00 . A A . 2 SER HB3 1 1 7 4980 1 1 2 SER HG H 14.226 -9.622 4.622 1.00 . A A . 2 SER HG 1 1 7 4981 1 1 2 SER N N 14.218 -8.244 2.731 1.00 . A A . 2 SER N 1 1 7 4982 1 1 2 SER O O 11.917 -8.606 4.682 1.00 . A A . 2 SER O 1 1 7 4983 1 1 2 SER OG O 13.995 -10.528 4.379 1.00 . A A . 2 SER OG 1 1 7 4984 1 1 3 ASP C C 10.503 -6.021 4.256 1.00 . A A . 3 ASP C 1 1 7 4985 1 1 3 ASP CA C 9.888 -7.138 3.426 1.00 . A A . 3 ASP CA 1 1 7 4986 1 1 3 ASP CB C 9.023 -8.050 4.295 1.00 . A A . 3 ASP CB 1 1 7 4987 1 1 3 ASP CG C 7.679 -7.428 4.633 1.00 . A A . 3 ASP CG 1 1 7 4988 1 1 3 ASP H H 10.966 -7.926 1.786 1.00 . A A . 3 ASP H 1 1 7 4989 1 1 3 ASP HA H 9.271 -6.697 2.653 1.00 . A A . 3 ASP HA 1 1 7 4990 1 1 3 ASP HB2 H 8.853 -8.971 3.762 1.00 . A A . 3 ASP HB2 1 1 7 4991 1 1 3 ASP HB3 H 9.545 -8.264 5.218 1.00 . A A . 3 ASP HB3 1 1 7 4992 1 1 3 ASP N N 10.956 -7.886 2.766 1.00 . A A . 3 ASP N 1 1 7 4993 1 1 3 ASP O O 10.248 -5.872 5.451 1.00 . A A . 3 ASP O 1 1 7 4994 1 1 3 ASP OD1 O 7.625 -6.548 5.519 1.00 . A A . 3 ASP OD1 1 1 7 4995 1 1 3 ASP OD2 O 6.669 -7.826 4.024 1.00 . A A . 3 ASP OD2 1 1 7 4996 1 1 4 SER C C 11.235 -2.889 4.167 1.00 . A A . 4 SER C 1 1 7 4997 1 1 4 SER CA C 12.053 -4.171 4.261 1.00 . A A . 4 SER CA 1 1 7 4998 1 1 4 SER CB C 13.426 -3.991 3.619 1.00 . A A . 4 SER CB 1 1 7 4999 1 1 4 SER H H 11.550 -5.454 2.670 1.00 . A A . 4 SER H 1 1 7 5000 1 1 4 SER HA H 12.182 -4.432 5.301 1.00 . A A . 4 SER HA 1 1 7 5001 1 1 4 SER HB2 H 13.303 -3.712 2.584 1.00 . A A . 4 SER HB2 1 1 7 5002 1 1 4 SER HB3 H 13.969 -3.219 4.143 1.00 . A A . 4 SER HB3 1 1 7 5003 1 1 4 SER HG H 14.541 -5.292 4.577 1.00 . A A . 4 SER HG 1 1 7 5004 1 1 4 SER N N 11.364 -5.264 3.610 1.00 . A A . 4 SER N 1 1 7 5005 1 1 4 SER O O 10.390 -2.745 3.285 1.00 . A A . 4 SER O 1 1 7 5006 1 1 4 SER OG O 14.167 -5.200 3.685 1.00 . A A . 4 SER OG 1 1 7 5007 1 1 5 GLU C C 11.498 0.359 4.328 1.00 . A A . 5 GLU C 1 1 7 5008 1 1 5 GLU CA C 10.766 -0.710 5.135 1.00 . A A . 5 GLU CA 1 1 7 5009 1 1 5 GLU CB C 10.595 -0.265 6.591 1.00 . A A . 5 GLU CB 1 1 7 5010 1 1 5 GLU CD C 11.684 -0.033 8.862 1.00 . A A . 5 GLU CD 1 1 7 5011 1 1 5 GLU CG C 11.896 -0.264 7.382 1.00 . A A . 5 GLU CG 1 1 7 5012 1 1 5 GLU H H 12.185 -2.140 5.752 1.00 . A A . 5 GLU H 1 1 7 5013 1 1 5 GLU HA H 9.791 -0.866 4.700 1.00 . A A . 5 GLU HA 1 1 7 5014 1 1 5 GLU HB2 H 10.190 0.736 6.603 1.00 . A A . 5 GLU HB2 1 1 7 5015 1 1 5 GLU HB3 H 9.900 -0.931 7.079 1.00 . A A . 5 GLU HB3 1 1 7 5016 1 1 5 GLU HG2 H 12.384 -1.217 7.249 1.00 . A A . 5 GLU HG2 1 1 7 5017 1 1 5 GLU HG3 H 12.533 0.521 6.999 1.00 . A A . 5 GLU HG3 1 1 7 5018 1 1 5 GLU N N 11.485 -1.971 5.087 1.00 . A A . 5 GLU N 1 1 7 5019 1 1 5 GLU O O 12.730 0.429 4.341 1.00 . A A . 5 GLU O 1 1 7 5020 1 1 5 GLU OE1 O 11.292 -0.991 9.565 1.00 . A A . 5 GLU OE1 1 1 7 5021 1 1 5 GLU OE2 O 11.919 1.099 9.337 1.00 . A A . 5 GLU OE2 1 1 7 5022 1 1 6 CYS C C 11.160 3.586 3.556 1.00 . A A . 6 CYS C 1 1 7 5023 1 1 6 CYS CA C 11.316 2.254 2.827 1.00 . A A . 6 CYS CA 1 1 7 5024 1 1 6 CYS CB C 10.665 2.326 1.438 1.00 . A A . 6 CYS CB 1 1 7 5025 1 1 6 CYS H H 9.768 1.041 3.602 1.00 . A A . 6 CYS H 1 1 7 5026 1 1 6 CYS HA H 12.370 2.053 2.707 1.00 . A A . 6 CYS HA 1 1 7 5027 1 1 6 CYS HB2 H 10.383 3.348 1.235 1.00 . A A . 6 CYS HB2 1 1 7 5028 1 1 6 CYS HB3 H 11.382 2.004 0.698 1.00 . A A . 6 CYS HB3 1 1 7 5029 1 1 6 CYS N N 10.741 1.170 3.608 1.00 . A A . 6 CYS N 1 1 7 5030 1 1 6 CYS O O 10.171 3.805 4.259 1.00 . A A . 6 CYS O 1 1 7 5031 1 1 6 CYS SG S 9.169 1.299 1.246 1.00 . A A . 6 CYS SG 1 1 7 5032 1 1 7 PRO C C 10.873 6.602 3.617 1.00 . A A . 7 PRO C 1 1 7 5033 1 1 7 PRO CA C 12.123 5.822 4.017 1.00 . A A . 7 PRO CA 1 1 7 5034 1 1 7 PRO CB C 13.375 6.494 3.461 1.00 . A A . 7 PRO CB 1 1 7 5035 1 1 7 PRO CD C 13.424 4.239 2.697 1.00 . A A . 7 PRO CD 1 1 7 5036 1 1 7 PRO CG C 14.301 5.371 3.154 1.00 . A A . 7 PRO CG 1 1 7 5037 1 1 7 PRO HA H 12.183 5.774 5.093 1.00 . A A . 7 PRO HA 1 1 7 5038 1 1 7 PRO HB2 H 13.123 7.051 2.571 1.00 . A A . 7 PRO HB2 1 1 7 5039 1 1 7 PRO HB3 H 13.791 7.157 4.204 1.00 . A A . 7 PRO HB3 1 1 7 5040 1 1 7 PRO HD2 H 13.272 4.288 1.629 1.00 . A A . 7 PRO HD2 1 1 7 5041 1 1 7 PRO HD3 H 13.854 3.289 2.976 1.00 . A A . 7 PRO HD3 1 1 7 5042 1 1 7 PRO HG2 H 14.984 5.661 2.368 1.00 . A A . 7 PRO HG2 1 1 7 5043 1 1 7 PRO HG3 H 14.846 5.089 4.042 1.00 . A A . 7 PRO HG3 1 1 7 5044 1 1 7 PRO N N 12.161 4.479 3.420 1.00 . A A . 7 PRO N 1 1 7 5045 1 1 7 PRO O O 10.239 6.285 2.611 1.00 . A A . 7 PRO O 1 1 7 5046 1 1 8 LEU C C 8.907 8.932 2.976 1.00 . A A . 8 LEU C 1 1 7 5047 1 1 8 LEU CA C 9.289 8.365 4.344 1.00 . A A . 8 LEU CA 1 1 7 5048 1 1 8 LEU CB C 9.274 9.499 5.367 1.00 . A A . 8 LEU CB 1 1 7 5049 1 1 8 LEU CD1 C 10.148 8.196 7.351 1.00 . A A . 8 LEU CD1 1 1 7 5050 1 1 8 LEU CD2 C 8.902 10.332 7.692 1.00 . A A . 8 LEU CD2 1 1 7 5051 1 1 8 LEU CG C 9.034 9.091 6.827 1.00 . A A . 8 LEU CG 1 1 7 5052 1 1 8 LEU H H 11.278 7.996 4.989 1.00 . A A . 8 LEU H 1 1 7 5053 1 1 8 LEU HA H 8.533 7.658 4.632 1.00 . A A . 8 LEU HA 1 1 7 5054 1 1 8 LEU HB2 H 10.219 10.019 5.314 1.00 . A A . 8 LEU HB2 1 1 7 5055 1 1 8 LEU HB3 H 8.493 10.183 5.081 1.00 . A A . 8 LEU HB3 1 1 7 5056 1 1 8 LEU HD11 H 11.086 8.731 7.313 1.00 . A A . 8 LEU HD11 1 1 7 5057 1 1 8 LEU HD12 H 9.936 7.916 8.373 1.00 . A A . 8 LEU HD12 1 1 7 5058 1 1 8 LEU HD13 H 10.214 7.310 6.740 1.00 . A A . 8 LEU HD13 1 1 7 5059 1 1 8 LEU HD21 H 8.077 10.932 7.339 1.00 . A A . 8 LEU HD21 1 1 7 5060 1 1 8 LEU HD22 H 8.721 10.038 8.717 1.00 . A A . 8 LEU HD22 1 1 7 5061 1 1 8 LEU HD23 H 9.815 10.907 7.641 1.00 . A A . 8 LEU HD23 1 1 7 5062 1 1 8 LEU HG H 8.107 8.541 6.889 1.00 . A A . 8 LEU HG 1 1 7 5063 1 1 8 LEU N N 10.585 7.661 4.376 1.00 . A A . 8 LEU N 1 1 7 5064 1 1 8 LEU O O 7.786 9.407 2.789 1.00 . A A . 8 LEU O 1 1 7 5065 1 1 9 SER C C 8.880 8.420 -0.186 1.00 . A A . 9 SER C 1 1 7 5066 1 1 9 SER CA C 9.564 9.438 0.714 1.00 . A A . 9 SER CA 1 1 7 5067 1 1 9 SER CB C 10.878 9.911 0.098 1.00 . A A . 9 SER CB 1 1 7 5068 1 1 9 SER H H 10.642 8.400 2.186 1.00 . A A . 9 SER H 1 1 7 5069 1 1 9 SER HA H 8.910 10.287 0.840 1.00 . A A . 9 SER HA 1 1 7 5070 1 1 9 SER HB2 H 10.757 10.014 -0.971 1.00 . A A . 9 SER HB2 1 1 7 5071 1 1 9 SER HB3 H 11.150 10.867 0.524 1.00 . A A . 9 SER HB3 1 1 7 5072 1 1 9 SER HG H 12.353 9.215 1.191 1.00 . A A . 9 SER HG 1 1 7 5073 1 1 9 SER N N 9.808 8.870 2.021 1.00 . A A . 9 SER N 1 1 7 5074 1 1 9 SER O O 8.258 8.776 -1.178 1.00 . A A . 9 SER O 1 1 7 5075 1 1 9 SER OG O 11.919 8.982 0.352 1.00 . A A . 9 SER OG 1 1 7 5076 1 1 10 HIS C C 6.976 5.752 -0.139 1.00 . A A . 10 HIS C 1 1 7 5077 1 1 10 HIS CA C 8.386 6.083 -0.616 1.00 . A A . 10 HIS CA 1 1 7 5078 1 1 10 HIS CB C 9.270 4.835 -0.614 1.00 . A A . 10 HIS CB 1 1 7 5079 1 1 10 HIS CD2 C 10.496 4.490 -2.874 1.00 . A A . 10 HIS CD2 1 1 7 5080 1 1 10 HIS CE1 C 12.416 5.404 -2.353 1.00 . A A . 10 HIS CE1 1 1 7 5081 1 1 10 HIS CG C 10.408 4.912 -1.589 1.00 . A A . 10 HIS CG 1 1 7 5082 1 1 10 HIS H H 9.453 6.922 1.017 1.00 . A A . 10 HIS H 1 1 7 5083 1 1 10 HIS HA H 8.317 6.449 -1.631 1.00 . A A . 10 HIS HA 1 1 7 5084 1 1 10 HIS HB2 H 9.686 4.694 0.374 1.00 . A A . 10 HIS HB2 1 1 7 5085 1 1 10 HIS HB3 H 8.668 3.976 -0.872 1.00 . A A . 10 HIS HB3 1 1 7 5086 1 1 10 HIS HD1 H 11.890 5.886 -0.436 1.00 . A A . 10 HIS HD1 1 1 7 5087 1 1 10 HIS HD2 H 9.717 3.995 -3.439 1.00 . A A . 10 HIS HD2 1 1 7 5088 1 1 10 HIS HE1 H 13.430 5.771 -2.414 1.00 . A A . 10 HIS HE1 1 1 7 5089 1 1 10 HIS HE2 H 12.030 4.813 -4.277 1.00 . A A . 10 HIS HE2 1 1 7 5090 1 1 10 HIS N N 8.980 7.147 0.183 1.00 . A A . 10 HIS N 1 1 7 5091 1 1 10 HIS ND1 N 11.630 5.481 -1.294 1.00 . A A . 10 HIS ND1 1 1 7 5092 1 1 10 HIS NE2 N 11.753 4.807 -3.324 1.00 . A A . 10 HIS NE2 1 1 7 5093 1 1 10 HIS O O 6.133 5.331 -0.929 1.00 . A A . 10 HIS O 1 1 7 5094 1 1 11 ASP C C 4.613 7.099 1.455 1.00 . A A . 11 ASP C 1 1 7 5095 1 1 11 ASP CA C 5.374 5.804 1.681 1.00 . A A . 11 ASP CA 1 1 7 5096 1 1 11 ASP CB C 5.404 5.437 3.170 1.00 . A A . 11 ASP CB 1 1 7 5097 1 1 11 ASP CG C 5.876 6.567 4.065 1.00 . A A . 11 ASP CG 1 1 7 5098 1 1 11 ASP H H 7.437 6.211 1.747 1.00 . A A . 11 ASP H 1 1 7 5099 1 1 11 ASP HA H 4.884 5.012 1.129 1.00 . A A . 11 ASP HA 1 1 7 5100 1 1 11 ASP HB2 H 4.415 5.147 3.485 1.00 . A A . 11 ASP HB2 1 1 7 5101 1 1 11 ASP HB3 H 6.079 4.602 3.304 1.00 . A A . 11 ASP HB3 1 1 7 5102 1 1 11 ASP N N 6.716 5.955 1.147 1.00 . A A . 11 ASP N 1 1 7 5103 1 1 11 ASP O O 3.403 7.101 1.233 1.00 . A A . 11 ASP O 1 1 7 5104 1 1 11 ASP OD1 O 5.050 7.421 4.445 1.00 . A A . 11 ASP OD1 1 1 7 5105 1 1 11 ASP OD2 O 7.075 6.595 4.391 1.00 . A A . 11 ASP OD2 1 1 7 5106 1 1 12 GLY C C 4.553 9.545 -0.385 1.00 . A A . 12 GLY C 1 1 7 5107 1 1 12 GLY CA C 4.791 9.483 1.105 1.00 . A A . 12 GLY CA 1 1 7 5108 1 1 12 GLY H H 6.275 8.151 1.794 1.00 . A A . 12 GLY H 1 1 7 5109 1 1 12 GLY HA2 H 3.854 9.628 1.623 1.00 . A A . 12 GLY HA2 1 1 7 5110 1 1 12 GLY HA3 H 5.478 10.269 1.387 1.00 . A A . 12 GLY HA3 1 1 7 5111 1 1 12 GLY N N 5.349 8.204 1.486 1.00 . A A . 12 GLY N 1 1 7 5112 1 1 12 GLY O O 3.687 10.276 -0.855 1.00 . A A . 12 GLY O 1 1 7 5113 1 1 13 TYR C C 3.819 7.888 -2.857 1.00 . A A . 13 TYR C 1 1 7 5114 1 1 13 TYR CA C 5.131 8.625 -2.569 1.00 . A A . 13 TYR CA 1 1 7 5115 1 1 13 TYR CB C 6.303 7.878 -3.204 1.00 . A A . 13 TYR CB 1 1 7 5116 1 1 13 TYR CD1 C 6.431 9.103 -5.413 1.00 . A A . 13 TYR CD1 1 1 7 5117 1 1 13 TYR CD2 C 6.172 6.733 -5.448 1.00 . A A . 13 TYR CD2 1 1 7 5118 1 1 13 TYR CE1 C 6.425 9.127 -6.794 1.00 . A A . 13 TYR CE1 1 1 7 5119 1 1 13 TYR CE2 C 6.167 6.749 -6.828 1.00 . A A . 13 TYR CE2 1 1 7 5120 1 1 13 TYR CG C 6.304 7.906 -4.717 1.00 . A A . 13 TYR CG 1 1 7 5121 1 1 13 TYR CZ C 6.319 7.972 -7.496 1.00 . A A . 13 TYR CZ 1 1 7 5122 1 1 13 TYR H H 6.099 8.308 -0.705 1.00 . A A . 13 TYR H 1 1 7 5123 1 1 13 TYR HA H 5.073 9.615 -2.994 1.00 . A A . 13 TYR HA 1 1 7 5124 1 1 13 TYR HB2 H 7.227 8.325 -2.866 1.00 . A A . 13 TYR HB2 1 1 7 5125 1 1 13 TYR HB3 H 6.274 6.845 -2.890 1.00 . A A . 13 TYR HB3 1 1 7 5126 1 1 13 TYR HD1 H 6.536 10.026 -4.860 1.00 . A A . 13 TYR HD1 1 1 7 5127 1 1 13 TYR HD2 H 6.073 5.795 -4.920 1.00 . A A . 13 TYR HD2 1 1 7 5128 1 1 13 TYR HE1 H 6.524 10.065 -7.319 1.00 . A A . 13 TYR HE1 1 1 7 5129 1 1 13 TYR HE2 H 6.061 5.825 -7.379 1.00 . A A . 13 TYR HE2 1 1 7 5130 1 1 13 TYR HH H 6.905 8.644 -9.187 1.00 . A A . 13 TYR HH 1 1 7 5131 1 1 13 TYR N N 5.338 8.769 -1.130 1.00 . A A . 13 TYR N 1 1 7 5132 1 1 13 TYR O O 3.309 7.928 -3.977 1.00 . A A . 13 TYR O 1 1 7 5133 1 1 13 TYR OH O 6.283 7.967 -8.872 1.00 . A A . 13 TYR OH 1 1 7 5134 1 1 14 CYS C C 0.860 7.621 -1.937 1.00 . A A . 14 CYS C 1 1 7 5135 1 1 14 CYS CA C 1.976 6.573 -1.974 1.00 . A A . 14 CYS CA 1 1 7 5136 1 1 14 CYS CB C 1.775 5.510 -0.893 1.00 . A A . 14 CYS CB 1 1 7 5137 1 1 14 CYS H H 3.759 7.159 -0.994 1.00 . A A . 14 CYS H 1 1 7 5138 1 1 14 CYS HA H 1.954 6.090 -2.941 1.00 . A A . 14 CYS HA 1 1 7 5139 1 1 14 CYS HB2 H 2.091 5.906 0.063 1.00 . A A . 14 CYS HB2 1 1 7 5140 1 1 14 CYS HB3 H 0.726 5.257 -0.842 1.00 . A A . 14 CYS HB3 1 1 7 5141 1 1 14 CYS N N 3.277 7.216 -1.846 1.00 . A A . 14 CYS N 1 1 7 5142 1 1 14 CYS O O 1.123 8.812 -2.110 1.00 . A A . 14 CYS O 1 1 7 5143 1 1 14 CYS SG S 2.699 3.969 -1.169 1.00 . A A . 14 CYS SG 1 1 7 5144 1 1 15 LEU C C -2.172 8.617 -0.683 1.00 . A A . 15 LEU C 1 1 7 5145 1 1 15 LEU CA C -1.494 8.119 -1.954 1.00 . A A . 15 LEU CA 1 1 7 5146 1 1 15 LEU CB C -2.522 7.469 -2.879 1.00 . A A . 15 LEU CB 1 1 7 5147 1 1 15 LEU CD1 C -3.089 6.461 -5.098 1.00 . A A . 15 LEU CD1 1 1 7 5148 1 1 15 LEU CD2 C -1.252 8.142 -4.938 1.00 . A A . 15 LEU CD2 1 1 7 5149 1 1 15 LEU CG C -1.971 7.007 -4.227 1.00 . A A . 15 LEU CG 1 1 7 5150 1 1 15 LEU H H -0.550 6.317 -1.339 1.00 . A A . 15 LEU H 1 1 7 5151 1 1 15 LEU HA H -1.088 8.976 -2.463 1.00 . A A . 15 LEU HA 1 1 7 5152 1 1 15 LEU HB2 H -2.942 6.615 -2.370 1.00 . A A . 15 LEU HB2 1 1 7 5153 1 1 15 LEU HB3 H -3.310 8.184 -3.062 1.00 . A A . 15 LEU HB3 1 1 7 5154 1 1 15 LEU HD11 H -3.529 5.598 -4.621 1.00 . A A . 15 LEU HD11 1 1 7 5155 1 1 15 LEU HD12 H -3.844 7.222 -5.236 1.00 . A A . 15 LEU HD12 1 1 7 5156 1 1 15 LEU HD13 H -2.690 6.175 -6.059 1.00 . A A . 15 LEU HD13 1 1 7 5157 1 1 15 LEU HD21 H -0.417 8.472 -4.337 1.00 . A A . 15 LEU HD21 1 1 7 5158 1 1 15 LEU HD22 H -0.890 7.796 -5.896 1.00 . A A . 15 LEU HD22 1 1 7 5159 1 1 15 LEU HD23 H -1.936 8.965 -5.088 1.00 . A A . 15 LEU HD23 1 1 7 5160 1 1 15 LEU HG H -1.260 6.211 -4.057 1.00 . A A . 15 LEU HG 1 1 7 5161 1 1 15 LEU N N -0.382 7.212 -1.703 1.00 . A A . 15 LEU N 1 1 7 5162 1 1 15 LEU O O -1.755 9.617 -0.106 1.00 . A A . 15 LEU O 1 1 7 5163 1 1 16 HIS C C -3.847 7.981 2.154 1.00 . A A . 16 HIS C 1 1 7 5164 1 1 16 HIS CA C -4.128 8.468 0.748 1.00 . A A . 16 HIS CA 1 1 7 5165 1 1 16 HIS CB C -5.573 8.154 0.354 1.00 . A A . 16 HIS CB 1 1 7 5166 1 1 16 HIS CD2 C -6.381 10.539 -0.252 1.00 . A A . 16 HIS CD2 1 1 7 5167 1 1 16 HIS CE1 C -8.198 10.592 0.963 1.00 . A A . 16 HIS CE1 1 1 7 5168 1 1 16 HIS CG C -6.470 9.354 0.395 1.00 . A A . 16 HIS CG 1 1 7 5169 1 1 16 HIS H H -3.284 6.961 -0.510 1.00 . A A . 16 HIS H 1 1 7 5170 1 1 16 HIS HA H -3.987 9.534 0.731 1.00 . A A . 16 HIS HA 1 1 7 5171 1 1 16 HIS HB2 H -5.588 7.759 -0.650 1.00 . A A . 16 HIS HB2 1 1 7 5172 1 1 16 HIS HB3 H -5.973 7.416 1.033 1.00 . A A . 16 HIS HB3 1 1 7 5173 1 1 16 HIS HD1 H -7.958 8.717 1.758 1.00 . A A . 16 HIS HD1 1 1 7 5174 1 1 16 HIS HD2 H -5.593 10.842 -0.930 1.00 . A A . 16 HIS HD2 1 1 7 5175 1 1 16 HIS HE1 H -9.118 10.923 1.419 1.00 . A A . 16 HIS HE1 1 1 7 5176 1 1 16 HIS HE2 H -7.748 12.134 -0.316 1.00 . A A . 16 HIS HE2 1 1 7 5177 1 1 16 HIS N N -3.188 7.896 -0.221 1.00 . A A . 16 HIS N 1 1 7 5178 1 1 16 HIS ND1 N -7.619 9.419 1.152 1.00 . A A . 16 HIS ND1 1 1 7 5179 1 1 16 HIS NE2 N -7.465 11.288 0.117 1.00 . A A . 16 HIS NE2 1 1 7 5180 1 1 16 HIS O O -4.738 7.934 3.003 1.00 . A A . 16 HIS O 1 1 7 5181 1 1 17 ASP C C -0.636 6.757 3.478 1.00 . A A . 17 ASP C 1 1 7 5182 1 1 17 ASP CA C -2.070 7.210 3.659 1.00 . A A . 17 ASP CA 1 1 7 5183 1 1 17 ASP CB C -2.904 6.085 4.277 1.00 . A A . 17 ASP CB 1 1 7 5184 1 1 17 ASP CG C -2.433 5.703 5.667 1.00 . A A . 17 ASP CG 1 1 7 5185 1 1 17 ASP H H -1.989 7.648 1.601 1.00 . A A . 17 ASP H 1 1 7 5186 1 1 17 ASP HA H -2.085 8.067 4.308 1.00 . A A . 17 ASP HA 1 1 7 5187 1 1 17 ASP HB2 H -3.930 6.408 4.348 1.00 . A A . 17 ASP HB2 1 1 7 5188 1 1 17 ASP HB3 H -2.850 5.210 3.641 1.00 . A A . 17 ASP HB3 1 1 7 5189 1 1 17 ASP N N -2.597 7.622 2.361 1.00 . A A . 17 ASP N 1 1 7 5190 1 1 17 ASP O O 0.265 7.219 4.171 1.00 . A A . 17 ASP O 1 1 7 5191 1 1 17 ASP OD1 O -1.579 4.804 5.790 1.00 . A A . 17 ASP OD1 1 1 7 5192 1 1 17 ASP OD2 O -2.940 6.286 6.649 1.00 . A A . 17 ASP OD2 1 1 7 5193 1 1 18 GLY C C 1.732 4.804 3.181 1.00 . A A . 18 GLY C 1 1 7 5194 1 1 18 GLY CA C 0.880 5.439 2.089 1.00 . A A . 18 GLY CA 1 1 7 5195 1 1 18 GLY H H -1.229 5.581 1.977 1.00 . A A . 18 GLY H 1 1 7 5196 1 1 18 GLY HA2 H 0.757 4.710 1.302 1.00 . A A . 18 GLY HA2 1 1 7 5197 1 1 18 GLY HA3 H 1.418 6.284 1.682 1.00 . A A . 18 GLY HA3 1 1 7 5198 1 1 18 GLY N N -0.446 5.894 2.484 1.00 . A A . 18 GLY N 1 1 7 5199 1 1 18 GLY O O 2.257 5.490 4.055 1.00 . A A . 18 GLY O 1 1 7 5200 1 1 19 VAL C C 3.509 1.694 3.033 1.00 . A A . 19 VAL C 1 1 7 5201 1 1 19 VAL CA C 2.864 2.760 3.911 1.00 . A A . 19 VAL CA 1 1 7 5202 1 1 19 VAL CB C 2.212 2.081 5.143 1.00 . A A . 19 VAL CB 1 1 7 5203 1 1 19 VAL CG1 C 3.256 1.335 5.958 1.00 . A A . 19 VAL CG1 1 1 7 5204 1 1 19 VAL CG2 C 1.488 3.096 6.014 1.00 . A A . 19 VAL CG2 1 1 7 5205 1 1 19 VAL H H 1.352 2.988 2.448 1.00 . A A . 19 VAL H 1 1 7 5206 1 1 19 VAL HA H 3.622 3.454 4.249 1.00 . A A . 19 VAL HA 1 1 7 5207 1 1 19 VAL HB H 1.485 1.363 4.787 1.00 . A A . 19 VAL HB 1 1 7 5208 1 1 19 VAL HG11 H 4.019 2.026 6.284 1.00 . A A . 19 VAL HG11 1 1 7 5209 1 1 19 VAL HG12 H 2.784 0.885 6.819 1.00 . A A . 19 VAL HG12 1 1 7 5210 1 1 19 VAL HG13 H 3.705 0.565 5.348 1.00 . A A . 19 VAL HG13 1 1 7 5211 1 1 19 VAL HG21 H 1.058 2.595 6.868 1.00 . A A . 19 VAL HG21 1 1 7 5212 1 1 19 VAL HG22 H 2.190 3.845 6.351 1.00 . A A . 19 VAL HG22 1 1 7 5213 1 1 19 VAL HG23 H 0.703 3.569 5.442 1.00 . A A . 19 VAL HG23 1 1 7 5214 1 1 19 VAL N N 1.895 3.491 3.093 1.00 . A A . 19 VAL N 1 1 7 5215 1 1 19 VAL O O 2.798 0.901 2.437 1.00 . A A . 19 VAL O 1 1 7 5216 1 1 20 CYS C C 6.484 -0.128 2.614 1.00 . A A . 20 CYS C 1 1 7 5217 1 1 20 CYS CA C 5.481 0.804 1.954 1.00 . A A . 20 CYS CA 1 1 7 5218 1 1 20 CYS CB C 6.176 1.643 0.873 1.00 . A A . 20 CYS CB 1 1 7 5219 1 1 20 CYS H H 5.384 2.194 3.549 1.00 . A A . 20 CYS H 1 1 7 5220 1 1 20 CYS HA H 4.711 0.206 1.487 1.00 . A A . 20 CYS HA 1 1 7 5221 1 1 20 CYS HB2 H 6.519 0.987 0.087 1.00 . A A . 20 CYS HB2 1 1 7 5222 1 1 20 CYS HB3 H 5.464 2.344 0.461 1.00 . A A . 20 CYS HB3 1 1 7 5223 1 1 20 CYS N N 4.833 1.666 2.936 1.00 . A A . 20 CYS N 1 1 7 5224 1 1 20 CYS O O 7.300 0.302 3.433 1.00 . A A . 20 CYS O 1 1 7 5225 1 1 20 CYS SG S 7.618 2.598 1.459 1.00 . A A . 20 CYS SG 1 1 7 5226 1 1 21 MET C C 7.250 -3.714 2.008 1.00 . A A . 21 MET C 1 1 7 5227 1 1 21 MET CA C 7.378 -2.378 2.749 1.00 . A A . 21 MET CA 1 1 7 5228 1 1 21 MET CB C 7.258 -2.573 4.267 1.00 . A A . 21 MET CB 1 1 7 5229 1 1 21 MET CE C 6.082 -1.407 6.950 1.00 . A A . 21 MET CE 1 1 7 5230 1 1 21 MET CG C 5.901 -3.070 4.742 1.00 . A A . 21 MET CG 1 1 7 5231 1 1 21 MET H H 5.631 -1.718 1.745 1.00 . A A . 21 MET H 1 1 7 5232 1 1 21 MET HA H 8.352 -1.965 2.532 1.00 . A A . 21 MET HA 1 1 7 5233 1 1 21 MET HB2 H 8.004 -3.275 4.585 1.00 . A A . 21 MET HB2 1 1 7 5234 1 1 21 MET HB3 H 7.452 -1.625 4.749 1.00 . A A . 21 MET HB3 1 1 7 5235 1 1 21 MET HE1 H 6.024 -1.275 8.021 1.00 . A A . 21 MET HE1 1 1 7 5236 1 1 21 MET HE2 H 7.063 -1.118 6.604 1.00 . A A . 21 MET HE2 1 1 7 5237 1 1 21 MET HE3 H 5.336 -0.791 6.470 1.00 . A A . 21 MET HE3 1 1 7 5238 1 1 21 MET HG2 H 5.137 -2.405 4.367 1.00 . A A . 21 MET HG2 1 1 7 5239 1 1 21 MET HG3 H 5.737 -4.063 4.351 1.00 . A A . 21 MET HG3 1 1 7 5240 1 1 21 MET N N 6.391 -1.411 2.290 1.00 . A A . 21 MET N 1 1 7 5241 1 1 21 MET O O 6.213 -4.366 2.078 1.00 . A A . 21 MET O 1 1 7 5242 1 1 21 MET SD S 5.785 -3.128 6.542 1.00 . A A . 21 MET SD 1 1 7 5243 1 1 22 TYR C C 9.756 -5.642 0.048 1.00 . A A . 22 TYR C 1 1 7 5244 1 1 22 TYR CA C 8.388 -5.411 0.653 1.00 . A A . 22 TYR CA 1 1 7 5245 1 1 22 TYR CB C 7.301 -5.639 -0.390 1.00 . A A . 22 TYR CB 1 1 7 5246 1 1 22 TYR CD1 C 5.872 -7.317 0.871 1.00 . A A . 22 TYR CD1 1 1 7 5247 1 1 22 TYR CD2 C 6.725 -7.933 -1.266 1.00 . A A . 22 TYR CD2 1 1 7 5248 1 1 22 TYR CE1 C 5.249 -8.549 0.978 1.00 . A A . 22 TYR CE1 1 1 7 5249 1 1 22 TYR CE2 C 6.108 -9.164 -1.165 1.00 . A A . 22 TYR CE2 1 1 7 5250 1 1 22 TYR CG C 6.621 -6.988 -0.253 1.00 . A A . 22 TYR CG 1 1 7 5251 1 1 22 TYR CZ C 5.376 -9.463 0.036 1.00 . A A . 22 TYR CZ 1 1 7 5252 1 1 22 TYR H H 9.005 -3.446 1.095 1.00 . A A . 22 TYR H 1 1 7 5253 1 1 22 TYR HA H 8.273 -6.128 1.426 1.00 . A A . 22 TYR HA 1 1 7 5254 1 1 22 TYR HB2 H 6.546 -4.872 -0.286 1.00 . A A . 22 TYR HB2 1 1 7 5255 1 1 22 TYR HB3 H 7.742 -5.578 -1.370 1.00 . A A . 22 TYR HB3 1 1 7 5256 1 1 22 TYR HD1 H 5.776 -6.595 1.669 1.00 . A A . 22 TYR HD1 1 1 7 5257 1 1 22 TYR HD2 H 7.304 -7.696 -2.144 1.00 . A A . 22 TYR HD2 1 1 7 5258 1 1 22 TYR HE1 H 4.670 -8.787 1.859 1.00 . A A . 22 TYR HE1 1 1 7 5259 1 1 22 TYR HE2 H 6.203 -9.883 -1.965 1.00 . A A . 22 TYR HE2 1 1 7 5260 1 1 22 TYR HH H 5.325 -11.374 -0.311 1.00 . A A . 22 TYR HH 1 1 7 5261 1 1 22 TYR N N 8.292 -4.084 1.255 1.00 . A A . 22 TYR N 1 1 7 5262 1 1 22 TYR O O 10.239 -6.758 0.070 1.00 . A A . 22 TYR O 1 1 7 5263 1 1 22 TYR OH O 4.750 -10.695 0.058 1.00 . A A . 22 TYR OH 1 1 7 5264 1 1 23 ILE C C 12.590 -5.708 -0.499 1.00 . A A . 23 ILE C 1 1 7 5265 1 1 23 ILE CA C 11.715 -4.582 -1.051 1.00 . A A . 23 ILE CA 1 1 7 5266 1 1 23 ILE CB C 12.453 -3.234 -0.843 1.00 . A A . 23 ILE CB 1 1 7 5267 1 1 23 ILE CD1 C 10.780 -1.719 0.378 1.00 . A A . 23 ILE CD1 1 1 7 5268 1 1 23 ILE CG1 C 12.045 -2.553 0.472 1.00 . A A . 23 ILE CG1 1 1 7 5269 1 1 23 ILE CG2 C 12.222 -2.308 -2.028 1.00 . A A . 23 ILE CG2 1 1 7 5270 1 1 23 ILE H H 9.819 -3.768 -0.579 1.00 . A A . 23 ILE H 1 1 7 5271 1 1 23 ILE HA H 11.620 -4.732 -2.119 1.00 . A A . 23 ILE HA 1 1 7 5272 1 1 23 ILE HB H 13.513 -3.449 -0.804 1.00 . A A . 23 ILE HB 1 1 7 5273 1 1 23 ILE HD11 H 10.583 -1.255 1.333 1.00 . A A . 23 ILE HD11 1 1 7 5274 1 1 23 ILE HD12 H 10.907 -0.954 -0.374 1.00 . A A . 23 ILE HD12 1 1 7 5275 1 1 23 ILE HD13 H 9.948 -2.354 0.108 1.00 . A A . 23 ILE HD13 1 1 7 5276 1 1 23 ILE HG12 H 11.882 -3.312 1.223 1.00 . A A . 23 ILE HG12 1 1 7 5277 1 1 23 ILE HG13 H 12.846 -1.904 0.792 1.00 . A A . 23 ILE HG13 1 1 7 5278 1 1 23 ILE HG21 H 12.563 -2.790 -2.932 1.00 . A A . 23 ILE HG21 1 1 7 5279 1 1 23 ILE HG22 H 11.167 -2.090 -2.113 1.00 . A A . 23 ILE HG22 1 1 7 5280 1 1 23 ILE HG23 H 12.769 -1.390 -1.879 1.00 . A A . 23 ILE HG23 1 1 7 5281 1 1 23 ILE N N 10.346 -4.578 -0.497 1.00 . A A . 23 ILE N 1 1 7 5282 1 1 23 ILE O O 13.096 -5.645 0.621 1.00 . A A . 23 ILE O 1 1 7 5283 1 1 24 GLU C C 14.743 -8.051 -1.790 1.00 . A A . 24 GLU C 1 1 7 5284 1 1 24 GLU CA C 13.471 -7.948 -0.965 1.00 . A A . 24 GLU CA 1 1 7 5285 1 1 24 GLU CB C 12.590 -9.146 -1.286 1.00 . A A . 24 GLU CB 1 1 7 5286 1 1 24 GLU CD C 10.462 -10.404 -0.859 1.00 . A A . 24 GLU CD 1 1 7 5287 1 1 24 GLU CG C 11.403 -9.326 -0.370 1.00 . A A . 24 GLU CG 1 1 7 5288 1 1 24 GLU H H 12.340 -6.682 -2.207 1.00 . A A . 24 GLU H 1 1 7 5289 1 1 24 GLU HA H 13.707 -7.934 0.089 1.00 . A A . 24 GLU HA 1 1 7 5290 1 1 24 GLU HB2 H 12.203 -9.004 -2.279 1.00 . A A . 24 GLU HB2 1 1 7 5291 1 1 24 GLU HB3 H 13.188 -10.046 -1.257 1.00 . A A . 24 GLU HB3 1 1 7 5292 1 1 24 GLU HG2 H 11.757 -9.594 0.615 1.00 . A A . 24 GLU HG2 1 1 7 5293 1 1 24 GLU HG3 H 10.863 -8.393 -0.319 1.00 . A A . 24 GLU HG3 1 1 7 5294 1 1 24 GLU N N 12.743 -6.735 -1.318 1.00 . A A . 24 GLU N 1 1 7 5295 1 1 24 GLU O O 15.306 -9.136 -1.935 1.00 . A A . 24 GLU O 1 1 7 5296 1 1 24 GLU OE1 O 9.554 -10.087 -1.655 1.00 . A A . 24 GLU OE1 1 1 7 5297 1 1 24 GLU OE2 O 10.635 -11.570 -0.461 1.00 . A A . 24 GLU OE2 1 1 7 5298 1 1 25 ALA C C 15.679 -7.486 -4.650 1.00 . A A . 25 ALA C 1 1 7 5299 1 1 25 ALA CA C 16.218 -6.877 -3.361 1.00 . A A . 25 ALA CA 1 1 7 5300 1 1 25 ALA CB C 17.490 -7.582 -2.890 1.00 . A A . 25 ALA CB 1 1 7 5301 1 1 25 ALA H H 14.726 -6.076 -2.093 1.00 . A A . 25 ALA H 1 1 7 5302 1 1 25 ALA HA H 16.455 -5.837 -3.546 1.00 . A A . 25 ALA HA 1 1 7 5303 1 1 25 ALA HB1 H 17.829 -7.132 -1.969 1.00 . A A . 25 ALA HB1 1 1 7 5304 1 1 25 ALA HB2 H 17.279 -8.630 -2.722 1.00 . A A . 25 ALA HB2 1 1 7 5305 1 1 25 ALA HB3 H 18.257 -7.485 -3.643 1.00 . A A . 25 ALA HB3 1 1 7 5306 1 1 25 ALA N N 15.159 -6.918 -2.352 1.00 . A A . 25 ALA N 1 1 7 5307 1 1 25 ALA O O 16.424 -7.885 -5.543 1.00 . A A . 25 ALA O 1 1 7 5308 1 1 26 LEU C C 12.764 -6.898 -6.389 1.00 . A A . 26 LEU C 1 1 7 5309 1 1 26 LEU CA C 13.632 -8.017 -5.872 1.00 . A A . 26 LEU CA 1 1 7 5310 1 1 26 LEU CB C 12.764 -9.227 -5.514 1.00 . A A . 26 LEU CB 1 1 7 5311 1 1 26 LEU CD1 C 12.554 -11.547 -4.610 1.00 . A A . 26 LEU CD1 1 1 7 5312 1 1 26 LEU CD2 C 14.407 -10.990 -6.186 1.00 . A A . 26 LEU CD2 1 1 7 5313 1 1 26 LEU CG C 13.526 -10.469 -5.061 1.00 . A A . 26 LEU CG 1 1 7 5314 1 1 26 LEU H H 13.846 -7.198 -3.955 1.00 . A A . 26 LEU H 1 1 7 5315 1 1 26 LEU HA H 14.343 -8.288 -6.626 1.00 . A A . 26 LEU HA 1 1 7 5316 1 1 26 LEU HB2 H 12.090 -8.935 -4.723 1.00 . A A . 26 LEU HB2 1 1 7 5317 1 1 26 LEU HB3 H 12.179 -9.488 -6.385 1.00 . A A . 26 LEU HB3 1 1 7 5318 1 1 26 LEU HD11 H 11.963 -11.179 -3.785 1.00 . A A . 26 LEU HD11 1 1 7 5319 1 1 26 LEU HD12 H 11.904 -11.811 -5.432 1.00 . A A . 26 LEU HD12 1 1 7 5320 1 1 26 LEU HD13 H 13.107 -12.421 -4.297 1.00 . A A . 26 LEU HD13 1 1 7 5321 1 1 26 LEU HD21 H 14.959 -11.852 -5.841 1.00 . A A . 26 LEU HD21 1 1 7 5322 1 1 26 LEU HD22 H 13.789 -11.270 -7.026 1.00 . A A . 26 LEU HD22 1 1 7 5323 1 1 26 LEU HD23 H 15.097 -10.217 -6.489 1.00 . A A . 26 LEU HD23 1 1 7 5324 1 1 26 LEU HG H 14.160 -10.214 -4.224 1.00 . A A . 26 LEU HG 1 1 7 5325 1 1 26 LEU N N 14.356 -7.532 -4.714 1.00 . A A . 26 LEU N 1 1 7 5326 1 1 26 LEU O O 11.944 -7.077 -7.290 1.00 . A A . 26 LEU O 1 1 7 5327 1 1 27 ASP C C 10.781 -4.675 -5.830 1.00 . A A . 27 ASP C 1 1 7 5328 1 1 27 ASP CA C 12.260 -4.519 -6.117 1.00 . A A . 27 ASP CA 1 1 7 5329 1 1 27 ASP CB C 12.523 -4.160 -7.577 1.00 . A A . 27 ASP CB 1 1 7 5330 1 1 27 ASP CG C 12.091 -2.746 -7.922 1.00 . A A . 27 ASP CG 1 1 7 5331 1 1 27 ASP H H 13.571 -5.724 -4.993 1.00 . A A . 27 ASP H 1 1 7 5332 1 1 27 ASP HA H 12.649 -3.730 -5.488 1.00 . A A . 27 ASP HA 1 1 7 5333 1 1 27 ASP HB2 H 13.582 -4.255 -7.764 1.00 . A A . 27 ASP HB2 1 1 7 5334 1 1 27 ASP HB3 H 11.985 -4.848 -8.214 1.00 . A A . 27 ASP HB3 1 1 7 5335 1 1 27 ASP N N 12.950 -5.744 -5.755 1.00 . A A . 27 ASP N 1 1 7 5336 1 1 27 ASP O O 9.921 -4.524 -6.698 1.00 . A A . 27 ASP O 1 1 7 5337 1 1 27 ASP OD1 O 12.627 -1.793 -7.325 1.00 . A A . 27 ASP OD1 1 1 7 5338 1 1 27 ASP OD2 O 11.239 -2.577 -8.822 1.00 . A A . 27 ASP OD2 1 1 7 5339 1 1 28 LYS C C 8.634 -4.018 -3.387 1.00 . A A . 28 LYS C 1 1 7 5340 1 1 28 LYS CA C 9.155 -5.232 -4.125 1.00 . A A . 28 LYS CA 1 1 7 5341 1 1 28 LYS CB C 9.114 -6.434 -3.184 1.00 . A A . 28 LYS CB 1 1 7 5342 1 1 28 LYS CD C 9.165 -8.229 -4.950 1.00 . A A . 28 LYS CD 1 1 7 5343 1 1 28 LYS CE C 7.861 -8.931 -4.602 1.00 . A A . 28 LYS CE 1 1 7 5344 1 1 28 LYS CG C 9.849 -7.657 -3.715 1.00 . A A . 28 LYS CG 1 1 7 5345 1 1 28 LYS H H 11.250 -5.074 -3.948 1.00 . A A . 28 LYS H 1 1 7 5346 1 1 28 LYS HA H 8.532 -5.427 -4.983 1.00 . A A . 28 LYS HA 1 1 7 5347 1 1 28 LYS HB2 H 9.549 -6.146 -2.230 1.00 . A A . 28 LYS HB2 1 1 7 5348 1 1 28 LYS HB3 H 8.080 -6.708 -3.022 1.00 . A A . 28 LYS HB3 1 1 7 5349 1 1 28 LYS HD2 H 8.953 -7.423 -5.637 1.00 . A A . 28 LYS HD2 1 1 7 5350 1 1 28 LYS HD3 H 9.830 -8.939 -5.421 1.00 . A A . 28 LYS HD3 1 1 7 5351 1 1 28 LYS HE2 H 7.270 -8.279 -3.973 1.00 . A A . 28 LYS HE2 1 1 7 5352 1 1 28 LYS HE3 H 7.322 -9.130 -5.517 1.00 . A A . 28 LYS HE3 1 1 7 5353 1 1 28 LYS HG2 H 10.857 -7.371 -3.977 1.00 . A A . 28 LYS HG2 1 1 7 5354 1 1 28 LYS HG3 H 9.874 -8.413 -2.944 1.00 . A A . 28 LYS HG3 1 1 7 5355 1 1 28 LYS HZ1 H 8.628 -10.050 -3.001 1.00 . A A . 28 LYS HZ1 1 1 7 5356 1 1 28 LYS HZ2 H 8.634 -10.867 -4.489 1.00 . A A . 28 LYS HZ2 1 1 7 5357 1 1 28 LYS HZ3 H 7.179 -10.662 -3.645 1.00 . A A . 28 LYS HZ3 1 1 7 5358 1 1 28 LYS N N 10.509 -4.989 -4.580 1.00 . A A . 28 LYS N 1 1 7 5359 1 1 28 LYS NZ N 8.091 -10.215 -3.886 1.00 . A A . 28 LYS NZ 1 1 7 5360 1 1 28 LYS O O 9.394 -3.285 -2.761 1.00 . A A . 28 LYS O 1 1 7 5361 1 1 29 TYR C C 5.269 -3.062 -2.456 1.00 . A A . 29 TYR C 1 1 7 5362 1 1 29 TYR CA C 6.687 -2.691 -2.840 1.00 . A A . 29 TYR CA 1 1 7 5363 1 1 29 TYR CB C 6.657 -1.483 -3.791 1.00 . A A . 29 TYR CB 1 1 7 5364 1 1 29 TYR CD1 C 8.613 -0.033 -3.099 1.00 . A A . 29 TYR CD1 1 1 7 5365 1 1 29 TYR CD2 C 8.693 -1.086 -5.236 1.00 . A A . 29 TYR CD2 1 1 7 5366 1 1 29 TYR CE1 C 9.849 0.540 -3.331 1.00 . A A . 29 TYR CE1 1 1 7 5367 1 1 29 TYR CE2 C 9.928 -0.518 -5.474 1.00 . A A . 29 TYR CE2 1 1 7 5368 1 1 29 TYR CG C 8.013 -0.856 -4.046 1.00 . A A . 29 TYR CG 1 1 7 5369 1 1 29 TYR CZ C 10.500 0.296 -4.513 1.00 . A A . 29 TYR CZ 1 1 7 5370 1 1 29 TYR H H 6.791 -4.488 -3.927 1.00 . A A . 29 TYR H 1 1 7 5371 1 1 29 TYR HA H 7.236 -2.429 -1.949 1.00 . A A . 29 TYR HA 1 1 7 5372 1 1 29 TYR HB2 H 6.258 -1.798 -4.743 1.00 . A A . 29 TYR HB2 1 1 7 5373 1 1 29 TYR HB3 H 6.012 -0.723 -3.373 1.00 . A A . 29 TYR HB3 1 1 7 5374 1 1 29 TYR HD1 H 8.097 0.157 -2.167 1.00 . A A . 29 TYR HD1 1 1 7 5375 1 1 29 TYR HD2 H 8.241 -1.722 -5.985 1.00 . A A . 29 TYR HD2 1 1 7 5376 1 1 29 TYR HE1 H 10.300 1.176 -2.583 1.00 . A A . 29 TYR HE1 1 1 7 5377 1 1 29 TYR HE2 H 10.440 -0.711 -6.405 1.00 . A A . 29 TYR HE2 1 1 7 5378 1 1 29 TYR HH H 11.726 1.255 -5.644 1.00 . A A . 29 TYR HH 1 1 7 5379 1 1 29 TYR N N 7.339 -3.825 -3.457 1.00 . A A . 29 TYR N 1 1 7 5380 1 1 29 TYR O O 4.393 -3.171 -3.312 1.00 . A A . 29 TYR O 1 1 7 5381 1 1 29 TYR OH O 11.728 0.863 -4.764 1.00 . A A . 29 TYR OH 1 1 7 5382 1 1 30 ALA C C 3.302 -2.195 0.059 1.00 . A A . 30 ALA C 1 1 7 5383 1 1 30 ALA CA C 3.713 -3.458 -0.665 1.00 . A A . 30 ALA CA 1 1 7 5384 1 1 30 ALA CB C 3.627 -4.666 0.257 1.00 . A A . 30 ALA CB 1 1 7 5385 1 1 30 ALA H H 5.812 -3.339 -0.558 1.00 . A A . 30 ALA H 1 1 7 5386 1 1 30 ALA HA H 3.049 -3.616 -1.504 1.00 . A A . 30 ALA HA 1 1 7 5387 1 1 30 ALA HB1 H 2.613 -4.777 0.612 1.00 . A A . 30 ALA HB1 1 1 7 5388 1 1 30 ALA HB2 H 3.915 -5.553 -0.289 1.00 . A A . 30 ALA HB2 1 1 7 5389 1 1 30 ALA HB3 H 4.290 -4.527 1.097 1.00 . A A . 30 ALA HB3 1 1 7 5390 1 1 30 ALA N N 5.053 -3.286 -1.176 1.00 . A A . 30 ALA N 1 1 7 5391 1 1 30 ALA O O 3.784 -1.914 1.157 1.00 . A A . 30 ALA O 1 1 7 5392 1 1 31 CYS C C 0.589 -0.325 0.469 1.00 . A A . 31 CYS C 1 1 7 5393 1 1 31 CYS CA C 2.011 -0.170 -0.010 1.00 . A A . 31 CYS CA 1 1 7 5394 1 1 31 CYS CB C 2.111 0.976 -1.019 1.00 . A A . 31 CYS CB 1 1 7 5395 1 1 31 CYS H H 2.094 -1.695 -1.445 1.00 . A A . 31 CYS H 1 1 7 5396 1 1 31 CYS HA H 2.644 0.051 0.837 1.00 . A A . 31 CYS HA 1 1 7 5397 1 1 31 CYS HB2 H 3.145 1.121 -1.292 1.00 . A A . 31 CYS HB2 1 1 7 5398 1 1 31 CYS HB3 H 1.538 0.724 -1.900 1.00 . A A . 31 CYS HB3 1 1 7 5399 1 1 31 CYS N N 2.454 -1.415 -0.578 1.00 . A A . 31 CYS N 1 1 7 5400 1 1 31 CYS O O -0.212 -1.019 -0.154 1.00 . A A . 31 CYS O 1 1 7 5401 1 1 31 CYS SG S 1.474 2.558 -0.379 1.00 . A A . 31 CYS SG 1 1 7 5402 1 1 32 ASN C C -1.529 1.575 2.576 1.00 . A A . 32 ASN C 1 1 7 5403 1 1 32 ASN CA C -1.042 0.202 2.140 1.00 . A A . 32 ASN CA 1 1 7 5404 1 1 32 ASN CB C -1.069 -0.829 3.276 1.00 . A A . 32 ASN CB 1 1 7 5405 1 1 32 ASN CG C -0.232 -0.462 4.495 1.00 . A A . 32 ASN CG 1 1 7 5406 1 1 32 ASN H H 0.981 0.781 2.074 1.00 . A A . 32 ASN H 1 1 7 5407 1 1 32 ASN HA H -1.691 -0.144 1.349 1.00 . A A . 32 ASN HA 1 1 7 5408 1 1 32 ASN HB2 H -2.088 -0.983 3.594 1.00 . A A . 32 ASN HB2 1 1 7 5409 1 1 32 ASN HB3 H -0.679 -1.751 2.876 1.00 . A A . 32 ASN HB3 1 1 7 5410 1 1 32 ASN HD21 H -1.835 0.247 5.434 1.00 . A A . 32 ASN HD21 1 1 7 5411 1 1 32 ASN HD22 H -0.346 0.332 6.311 1.00 . A A . 32 ASN HD22 1 1 7 5412 1 1 32 ASN N N 0.285 0.285 1.592 1.00 . A A . 32 ASN N 1 1 7 5413 1 1 32 ASN ND2 N -0.867 0.096 5.514 1.00 . A A . 32 ASN ND2 1 1 7 5414 1 1 32 ASN O O -1.075 2.139 3.564 1.00 . A A . 32 ASN O 1 1 7 5415 1 1 32 ASN OD1 O 0.968 -0.722 4.534 1.00 . A A . 32 ASN OD1 1 1 7 5416 1 1 33 CYS C C -4.246 3.218 2.993 1.00 . A A . 33 CYS C 1 1 7 5417 1 1 33 CYS CA C -3.030 3.411 2.105 1.00 . A A . 33 CYS CA 1 1 7 5418 1 1 33 CYS CB C -3.398 4.189 0.839 1.00 . A A . 33 CYS CB 1 1 7 5419 1 1 33 CYS H H -2.652 1.700 0.938 1.00 . A A . 33 CYS H 1 1 7 5420 1 1 33 CYS HA H -2.298 3.983 2.658 1.00 . A A . 33 CYS HA 1 1 7 5421 1 1 33 CYS HB2 H -3.927 3.533 0.153 1.00 . A A . 33 CYS HB2 1 1 7 5422 1 1 33 CYS HB3 H -4.040 5.014 1.107 1.00 . A A . 33 CYS HB3 1 1 7 5423 1 1 33 CYS N N -2.420 2.139 1.776 1.00 . A A . 33 CYS N 1 1 7 5424 1 1 33 CYS O O -4.137 3.268 4.213 1.00 . A A . 33 CYS O 1 1 7 5425 1 1 33 CYS SG S -1.942 4.876 -0.026 1.00 . A A . 33 CYS SG 1 1 7 5426 1 1 34 VAL C C -7.547 1.880 2.575 1.00 . A A . 34 VAL C 1 1 7 5427 1 1 34 VAL CA C -6.604 2.891 3.189 1.00 . A A . 34 VAL CA 1 1 7 5428 1 1 34 VAL CB C -7.271 4.282 3.269 1.00 . A A . 34 VAL CB 1 1 7 5429 1 1 34 VAL CG1 C -7.925 4.666 1.949 1.00 . A A . 34 VAL CG1 1 1 7 5430 1 1 34 VAL CG2 C -8.271 4.345 4.416 1.00 . A A . 34 VAL CG2 1 1 7 5431 1 1 34 VAL H H -5.446 2.820 1.434 1.00 . A A . 34 VAL H 1 1 7 5432 1 1 34 VAL HA H -6.342 2.575 4.189 1.00 . A A . 34 VAL HA 1 1 7 5433 1 1 34 VAL HB H -6.489 5.005 3.462 1.00 . A A . 34 VAL HB 1 1 7 5434 1 1 34 VAL HG11 H -8.368 5.647 2.039 1.00 . A A . 34 VAL HG11 1 1 7 5435 1 1 34 VAL HG12 H -7.178 4.679 1.170 1.00 . A A . 34 VAL HG12 1 1 7 5436 1 1 34 VAL HG13 H -8.691 3.945 1.702 1.00 . A A . 34 VAL HG13 1 1 7 5437 1 1 34 VAL HG21 H -7.757 4.171 5.351 1.00 . A A . 34 VAL HG21 1 1 7 5438 1 1 34 VAL HG22 H -8.734 5.319 4.437 1.00 . A A . 34 VAL HG22 1 1 7 5439 1 1 34 VAL HG23 H -9.029 3.588 4.276 1.00 . A A . 34 VAL HG23 1 1 7 5440 1 1 34 VAL N N -5.398 2.966 2.406 1.00 . A A . 34 VAL N 1 1 7 5441 1 1 34 VAL O O -7.504 1.644 1.364 1.00 . A A . 34 VAL O 1 1 7 5442 1 1 35 VAL C C -10.398 1.144 2.128 1.00 . A A . 35 VAL C 1 1 7 5443 1 1 35 VAL CA C -9.375 0.346 2.922 1.00 . A A . 35 VAL CA 1 1 7 5444 1 1 35 VAL CB C -10.029 -0.458 4.063 1.00 . A A . 35 VAL CB 1 1 7 5445 1 1 35 VAL CG1 C -10.356 0.436 5.251 1.00 . A A . 35 VAL CG1 1 1 7 5446 1 1 35 VAL CG2 C -11.279 -1.171 3.585 1.00 . A A . 35 VAL CG2 1 1 7 5447 1 1 35 VAL H H -8.216 1.351 4.380 1.00 . A A . 35 VAL H 1 1 7 5448 1 1 35 VAL HA H -8.901 -0.357 2.250 1.00 . A A . 35 VAL HA 1 1 7 5449 1 1 35 VAL HB H -9.320 -1.208 4.378 1.00 . A A . 35 VAL HB 1 1 7 5450 1 1 35 VAL HG11 H -10.755 -0.164 6.055 1.00 . A A . 35 VAL HG11 1 1 7 5451 1 1 35 VAL HG12 H -9.457 0.933 5.585 1.00 . A A . 35 VAL HG12 1 1 7 5452 1 1 35 VAL HG13 H -11.089 1.172 4.954 1.00 . A A . 35 VAL HG13 1 1 7 5453 1 1 35 VAL HG21 H -11.954 -0.448 3.149 1.00 . A A . 35 VAL HG21 1 1 7 5454 1 1 35 VAL HG22 H -11.013 -1.907 2.845 1.00 . A A . 35 VAL HG22 1 1 7 5455 1 1 35 VAL HG23 H -11.761 -1.655 4.421 1.00 . A A . 35 VAL HG23 1 1 7 5456 1 1 35 VAL N N -8.339 1.233 3.408 1.00 . A A . 35 VAL N 1 1 7 5457 1 1 35 VAL O O -11.330 1.742 2.669 1.00 . A A . 35 VAL O 1 1 7 5458 1 1 36 GLY C C -10.146 2.412 -1.230 1.00 . A A . 36 GLY C 1 1 7 5459 1 1 36 GLY CA C -10.975 1.955 -0.065 1.00 . A A . 36 GLY CA 1 1 7 5460 1 1 36 GLY H H -9.389 0.670 0.478 1.00 . A A . 36 GLY H 1 1 7 5461 1 1 36 GLY HA2 H -11.793 1.343 -0.420 1.00 . A A . 36 GLY HA2 1 1 7 5462 1 1 36 GLY HA3 H -11.367 2.816 0.455 1.00 . A A . 36 GLY HA3 1 1 7 5463 1 1 36 GLY N N -10.159 1.177 0.834 1.00 . A A . 36 GLY N 1 1 7 5464 1 1 36 GLY O O -10.666 2.788 -2.281 1.00 . A A . 36 GLY O 1 1 7 5465 1 1 37 TYR C C -6.795 1.545 -2.036 1.00 . A A . 37 TYR C 1 1 7 5466 1 1 37 TYR CA C -7.902 2.590 -2.113 1.00 . A A . 37 TYR CA 1 1 7 5467 1 1 37 TYR CB C -7.265 3.988 -2.037 1.00 . A A . 37 TYR CB 1 1 7 5468 1 1 37 TYR CD1 C -9.087 5.469 -1.097 1.00 . A A . 37 TYR CD1 1 1 7 5469 1 1 37 TYR CD2 C -8.291 5.931 -3.292 1.00 . A A . 37 TYR CD2 1 1 7 5470 1 1 37 TYR CE1 C -9.983 6.520 -1.199 1.00 . A A . 37 TYR CE1 1 1 7 5471 1 1 37 TYR CE2 C -9.184 6.977 -3.403 1.00 . A A . 37 TYR CE2 1 1 7 5472 1 1 37 TYR CG C -8.223 5.159 -2.141 1.00 . A A . 37 TYR CG 1 1 7 5473 1 1 37 TYR CZ C -9.939 7.346 -2.307 1.00 . A A . 37 TYR CZ 1 1 7 5474 1 1 37 TYR H H -8.488 2.178 -0.135 1.00 . A A . 37 TYR H 1 1 7 5475 1 1 37 TYR HA H -8.439 2.477 -3.048 1.00 . A A . 37 TYR HA 1 1 7 5476 1 1 37 TYR HB2 H -6.747 4.081 -1.098 1.00 . A A . 37 TYR HB2 1 1 7 5477 1 1 37 TYR HB3 H -6.547 4.083 -2.841 1.00 . A A . 37 TYR HB3 1 1 7 5478 1 1 37 TYR HD1 H -9.048 4.882 -0.194 1.00 . A A . 37 TYR HD1 1 1 7 5479 1 1 37 TYR HD2 H -7.628 5.706 -4.114 1.00 . A A . 37 TYR HD2 1 1 7 5480 1 1 37 TYR HE1 H -10.647 6.746 -0.376 1.00 . A A . 37 TYR HE1 1 1 7 5481 1 1 37 TYR HE2 H -9.217 7.563 -4.309 1.00 . A A . 37 TYR HE2 1 1 7 5482 1 1 37 TYR HH H -11.117 8.675 -1.599 1.00 . A A . 37 TYR HH 1 1 7 5483 1 1 37 TYR N N -8.834 2.371 -1.034 1.00 . A A . 37 TYR N 1 1 7 5484 1 1 37 TYR O O -5.908 1.631 -1.182 1.00 . A A . 37 TYR O 1 1 7 5485 1 1 37 TYR OH O -10.923 8.307 -2.477 1.00 . A A . 37 TYR OH 1 1 7 5486 1 1 38 ILE C C -5.555 -0.773 -4.536 1.00 . A A . 38 ILE C 1 1 7 5487 1 1 38 ILE CA C -5.761 -0.395 -3.051 1.00 . A A . 38 ILE CA 1 1 7 5488 1 1 38 ILE CB C -5.961 -1.638 -2.136 1.00 . A A . 38 ILE CB 1 1 7 5489 1 1 38 ILE CD1 C -4.001 -3.049 -3.037 1.00 . A A . 38 ILE CD1 1 1 7 5490 1 1 38 ILE CG1 C -4.622 -2.320 -1.857 1.00 . A A . 38 ILE CG1 1 1 7 5491 1 1 38 ILE CG2 C -6.967 -2.629 -2.701 1.00 . A A . 38 ILE CG2 1 1 7 5492 1 1 38 ILE H H -7.684 0.403 -3.407 1.00 . A A . 38 ILE H 1 1 7 5493 1 1 38 ILE HA H -4.872 0.111 -2.715 1.00 . A A . 38 ILE HA 1 1 7 5494 1 1 38 ILE HB H -6.356 -1.281 -1.198 1.00 . A A . 38 ILE HB 1 1 7 5495 1 1 38 ILE HD11 H -4.684 -3.803 -3.396 1.00 . A A . 38 ILE HD11 1 1 7 5496 1 1 38 ILE HD12 H -3.797 -2.343 -3.828 1.00 . A A . 38 ILE HD12 1 1 7 5497 1 1 38 ILE HD13 H -3.079 -3.516 -2.726 1.00 . A A . 38 ILE HD13 1 1 7 5498 1 1 38 ILE HG12 H -3.925 -1.561 -1.535 1.00 . A A . 38 ILE HG12 1 1 7 5499 1 1 38 ILE HG13 H -4.756 -3.035 -1.059 1.00 . A A . 38 ILE HG13 1 1 7 5500 1 1 38 ILE HG21 H -7.938 -2.161 -2.767 1.00 . A A . 38 ILE HG21 1 1 7 5501 1 1 38 ILE HG22 H -6.649 -2.943 -3.685 1.00 . A A . 38 ILE HG22 1 1 7 5502 1 1 38 ILE HG23 H -7.025 -3.489 -2.051 1.00 . A A . 38 ILE HG23 1 1 7 5503 1 1 38 ILE N N -6.858 0.543 -2.900 1.00 . A A . 38 ILE N 1 1 7 5504 1 1 38 ILE O O -6.385 -1.385 -5.169 1.00 . A A . 38 ILE O 1 1 7 5505 1 1 39 GLY C C -2.752 -0.464 -6.845 1.00 . A A . 39 GLY C 1 1 7 5506 1 1 39 GLY CA C -4.195 -0.672 -6.501 1.00 . A A . 39 GLY CA 1 1 7 5507 1 1 39 GLY H H -3.785 0.142 -4.587 1.00 . A A . 39 GLY H 1 1 7 5508 1 1 39 GLY HA2 H -4.460 -1.704 -6.684 1.00 . A A . 39 GLY HA2 1 1 7 5509 1 1 39 GLY HA3 H -4.802 -0.034 -7.126 1.00 . A A . 39 GLY HA3 1 1 7 5510 1 1 39 GLY N N -4.448 -0.353 -5.109 1.00 . A A . 39 GLY N 1 1 7 5511 1 1 39 GLY O O -2.320 0.665 -7.062 1.00 . A A . 39 GLY O 1 1 7 5512 1 1 40 GLU C C 0.073 -1.015 -5.786 1.00 . A A . 40 GLU C 1 1 7 5513 1 1 40 GLU CA C -0.573 -1.610 -7.020 1.00 . A A . 40 GLU CA 1 1 7 5514 1 1 40 GLU CB C -0.075 -0.900 -8.282 1.00 . A A . 40 GLU CB 1 1 7 5515 1 1 40 GLU CD C 1.932 -0.419 -9.754 1.00 . A A . 40 GLU CD 1 1 7 5516 1 1 40 GLU CG C 1.440 -0.967 -8.432 1.00 . A A . 40 GLU CG 1 1 7 5517 1 1 40 GLU H H -2.487 -2.409 -6.770 1.00 . A A . 40 GLU H 1 1 7 5518 1 1 40 GLU HA H -0.291 -2.646 -7.072 1.00 . A A . 40 GLU HA 1 1 7 5519 1 1 40 GLU HB2 H -0.525 -1.365 -9.149 1.00 . A A . 40 GLU HB2 1 1 7 5520 1 1 40 GLU HB3 H -0.369 0.140 -8.244 1.00 . A A . 40 GLU HB3 1 1 7 5521 1 1 40 GLU HG2 H 1.889 -0.392 -7.631 1.00 . A A . 40 GLU HG2 1 1 7 5522 1 1 40 GLU HG3 H 1.751 -1.999 -8.348 1.00 . A A . 40 GLU HG3 1 1 7 5523 1 1 40 GLU N N -2.026 -1.571 -6.879 1.00 . A A . 40 GLU N 1 1 7 5524 1 1 40 GLU O O 0.969 -1.599 -5.183 1.00 . A A . 40 GLU O 1 1 7 5525 1 1 40 GLU OE1 O 1.374 -0.797 -10.807 1.00 . A A . 40 GLU OE1 1 1 7 5526 1 1 40 GLU OE2 O 2.899 0.370 -9.750 1.00 . A A . 40 GLU OE2 1 1 7 5527 1 1 41 ARG C C -1.129 1.004 -3.269 1.00 . A A . 41 ARG C 1 1 7 5528 1 1 41 ARG CA C 0.024 0.837 -4.253 1.00 . A A . 41 ARG CA 1 1 7 5529 1 1 41 ARG CB C 0.585 2.194 -4.674 1.00 . A A . 41 ARG CB 1 1 7 5530 1 1 41 ARG CD C -0.413 3.067 -6.837 1.00 . A A . 41 ARG CD 1 1 7 5531 1 1 41 ARG CG C -0.459 3.097 -5.320 1.00 . A A . 41 ARG CG 1 1 7 5532 1 1 41 ARG CZ C 1.280 2.970 -8.615 1.00 . A A . 41 ARG CZ 1 1 7 5533 1 1 41 ARG H H -1.110 0.545 -5.978 1.00 . A A . 41 ARG H 1 1 7 5534 1 1 41 ARG HA H 0.795 0.259 -3.786 1.00 . A A . 41 ARG HA 1 1 7 5535 1 1 41 ARG HB2 H 0.988 2.695 -3.808 1.00 . A A . 41 ARG HB2 1 1 7 5536 1 1 41 ARG HB3 H 1.375 2.024 -5.392 1.00 . A A . 41 ARG HB3 1 1 7 5537 1 1 41 ARG HD2 H -0.769 2.103 -7.172 1.00 . A A . 41 ARG HD2 1 1 7 5538 1 1 41 ARG HD3 H -1.071 3.838 -7.213 1.00 . A A . 41 ARG HD3 1 1 7 5539 1 1 41 ARG HE H 1.599 3.687 -6.763 1.00 . A A . 41 ARG HE 1 1 7 5540 1 1 41 ARG HG2 H -1.435 2.731 -5.020 1.00 . A A . 41 ARG HG2 1 1 7 5541 1 1 41 ARG HG3 H -0.319 4.109 -4.974 1.00 . A A . 41 ARG HG3 1 1 7 5542 1 1 41 ARG HH11 H -0.573 2.366 -9.163 1.00 . A A . 41 ARG HH11 1 1 7 5543 1 1 41 ARG HH12 H 0.635 2.238 -10.404 1.00 . A A . 41 ARG HH12 1 1 7 5544 1 1 41 ARG HH21 H 3.208 3.542 -8.401 1.00 . A A . 41 ARG HH21 1 1 7 5545 1 1 41 ARG HH22 H 2.794 2.890 -9.952 1.00 . A A . 41 ARG HH22 1 1 7 5546 1 1 41 ARG N N -0.418 0.138 -5.419 1.00 . A A . 41 ARG N 1 1 7 5547 1 1 41 ARG NE N 0.926 3.288 -7.370 1.00 . A A . 41 ARG NE 1 1 7 5548 1 1 41 ARG NH1 N 0.372 2.489 -9.459 1.00 . A A . 41 ARG NH1 1 1 7 5549 1 1 41 ARG NH2 N 2.525 3.157 -9.023 1.00 . A A . 41 ARG NH2 1 1 7 5550 1 1 41 ARG O O -0.995 0.674 -2.099 1.00 . A A . 41 ARG O 1 1 7 5551 1 1 42 CYS C C -4.297 2.874 -3.695 1.00 . A A . 42 CYS C 1 1 7 5552 1 1 42 CYS CA C -3.421 1.860 -2.955 1.00 . A A . 42 CYS CA 1 1 7 5553 1 1 42 CYS CB C -2.960 2.493 -1.631 1.00 . A A . 42 CYS CB 1 1 7 5554 1 1 42 CYS H H -2.370 1.483 -4.758 1.00 . A A . 42 CYS H 1 1 7 5555 1 1 42 CYS HA H -4.003 0.986 -2.743 1.00 . A A . 42 CYS HA 1 1 7 5556 1 1 42 CYS HB2 H -3.828 2.798 -1.068 1.00 . A A . 42 CYS HB2 1 1 7 5557 1 1 42 CYS HB3 H -2.410 1.757 -1.063 1.00 . A A . 42 CYS HB3 1 1 7 5558 1 1 42 CYS N N -2.280 1.454 -3.785 1.00 . A A . 42 CYS N 1 1 7 5559 1 1 42 CYS O O -4.266 4.058 -3.383 1.00 . A A . 42 CYS O 1 1 7 5560 1 1 42 CYS SG S -1.889 3.956 -1.831 1.00 . A A . 42 CYS SG 1 1 7 5561 1 1 43 GLN C C -7.185 2.812 -5.967 1.00 . A A . 43 GLN C 1 1 7 5562 1 1 43 GLN CA C -5.910 3.409 -5.399 1.00 . A A . 43 GLN CA 1 1 7 5563 1 1 43 GLN CB C -5.081 4.049 -6.513 1.00 . A A . 43 GLN CB 1 1 7 5564 1 1 43 GLN CD C -3.527 3.689 -8.490 1.00 . A A . 43 GLN CD 1 1 7 5565 1 1 43 GLN CG C -4.383 3.044 -7.414 1.00 . A A . 43 GLN CG 1 1 7 5566 1 1 43 GLN H H -5.164 1.473 -4.875 1.00 . A A . 43 GLN H 1 1 7 5567 1 1 43 GLN HA H -6.188 4.184 -4.700 1.00 . A A . 43 GLN HA 1 1 7 5568 1 1 43 GLN HB2 H -5.728 4.662 -7.122 1.00 . A A . 43 GLN HB2 1 1 7 5569 1 1 43 GLN HB3 H -4.328 4.678 -6.057 1.00 . A A . 43 GLN HB3 1 1 7 5570 1 1 43 GLN HE21 H -3.211 5.284 -7.348 1.00 . A A . 43 GLN HE21 1 1 7 5571 1 1 43 GLN HE22 H -2.448 5.310 -8.908 1.00 . A A . 43 GLN HE22 1 1 7 5572 1 1 43 GLN HG2 H -3.749 2.420 -6.804 1.00 . A A . 43 GLN HG2 1 1 7 5573 1 1 43 GLN HG3 H -5.131 2.431 -7.894 1.00 . A A . 43 GLN HG3 1 1 7 5574 1 1 43 GLN N N -5.101 2.440 -4.662 1.00 . A A . 43 GLN N 1 1 7 5575 1 1 43 GLN NE2 N -3.014 4.878 -8.219 1.00 . A A . 43 GLN NE2 1 1 7 5576 1 1 43 GLN O O -7.913 3.488 -6.688 1.00 . A A . 43 GLN O 1 1 7 5577 1 1 43 GLN OE1 O -3.331 3.118 -9.563 1.00 . A A . 43 GLN OE1 1 1 7 5578 1 1 44 TYR C C -9.300 0.008 -5.163 1.00 . A A . 44 TYR C 1 1 7 5579 1 1 44 TYR CA C -8.669 0.927 -6.172 1.00 . A A . 44 TYR CA 1 1 7 5580 1 1 44 TYR CB C -8.335 0.142 -7.441 1.00 . A A . 44 TYR CB 1 1 7 5581 1 1 44 TYR CD1 C -8.982 1.774 -9.254 1.00 . A A . 44 TYR CD1 1 1 7 5582 1 1 44 TYR CD2 C -6.721 1.029 -9.170 1.00 . A A . 44 TYR CD2 1 1 7 5583 1 1 44 TYR CE1 C -8.687 2.560 -10.348 1.00 . A A . 44 TYR CE1 1 1 7 5584 1 1 44 TYR CE2 C -6.416 1.814 -10.266 1.00 . A A . 44 TYR CE2 1 1 7 5585 1 1 44 TYR CG C -8.007 0.997 -8.647 1.00 . A A . 44 TYR CG 1 1 7 5586 1 1 44 TYR CZ C -7.405 2.548 -10.871 1.00 . A A . 44 TYR CZ 1 1 7 5587 1 1 44 TYR H H -6.895 1.057 -5.025 1.00 . A A . 44 TYR H 1 1 7 5588 1 1 44 TYR HA H -9.387 1.692 -6.407 1.00 . A A . 44 TYR HA 1 1 7 5589 1 1 44 TYR HB2 H -7.478 -0.485 -7.246 1.00 . A A . 44 TYR HB2 1 1 7 5590 1 1 44 TYR HB3 H -9.177 -0.485 -7.697 1.00 . A A . 44 TYR HB3 1 1 7 5591 1 1 44 TYR HD1 H -9.987 1.760 -8.857 1.00 . A A . 44 TYR HD1 1 1 7 5592 1 1 44 TYR HD2 H -5.951 0.426 -8.710 1.00 . A A . 44 TYR HD2 1 1 7 5593 1 1 44 TYR HE1 H -9.461 3.158 -10.808 1.00 . A A . 44 TYR HE1 1 1 7 5594 1 1 44 TYR HE2 H -5.410 1.827 -10.659 1.00 . A A . 44 TYR HE2 1 1 7 5595 1 1 44 TYR HH H -7.495 4.247 -11.806 1.00 . A A . 44 TYR HH 1 1 7 5596 1 1 44 TYR N N -7.478 1.564 -5.640 1.00 . A A . 44 TYR N 1 1 7 5597 1 1 44 TYR O O -8.664 -0.891 -4.650 1.00 . A A . 44 TYR O 1 1 7 5598 1 1 44 TYR OH O -7.109 3.365 -11.937 1.00 . A A . 44 TYR OH 1 1 7 5599 1 1 45 ARG C C -10.795 -0.799 -2.650 1.00 . A A . 45 ARG C 1 1 7 5600 1 1 45 ARG CA C -11.316 -0.701 -4.076 1.00 . A A . 45 ARG CA 1 1 7 5601 1 1 45 ARG CB C -11.251 -2.088 -4.720 1.00 . A A . 45 ARG CB 1 1 7 5602 1 1 45 ARG CD C -10.792 -2.195 -7.200 1.00 . A A . 45 ARG CD 1 1 7 5603 1 1 45 ARG CG C -11.861 -2.175 -6.111 1.00 . A A . 45 ARG CG 1 1 7 5604 1 1 45 ARG CZ C -10.716 -2.066 -9.677 1.00 . A A . 45 ARG CZ 1 1 7 5605 1 1 45 ARG H H -10.986 1.066 -5.191 1.00 . A A . 45 ARG H 1 1 7 5606 1 1 45 ARG HA H -12.331 -0.363 -4.047 1.00 . A A . 45 ARG HA 1 1 7 5607 1 1 45 ARG HB2 H -10.200 -2.361 -4.800 1.00 . A A . 45 ARG HB2 1 1 7 5608 1 1 45 ARG HB3 H -11.755 -2.797 -4.076 1.00 . A A . 45 ARG HB3 1 1 7 5609 1 1 45 ARG HD2 H -10.197 -1.289 -7.127 1.00 . A A . 45 ARG HD2 1 1 7 5610 1 1 45 ARG HD3 H -10.156 -3.052 -7.040 1.00 . A A . 45 ARG HD3 1 1 7 5611 1 1 45 ARG HE H -12.336 -2.531 -8.593 1.00 . A A . 45 ARG HE 1 1 7 5612 1 1 45 ARG HG2 H -12.446 -3.079 -6.180 1.00 . A A . 45 ARG HG2 1 1 7 5613 1 1 45 ARG HG3 H -12.503 -1.320 -6.266 1.00 . A A . 45 ARG HG3 1 1 7 5614 1 1 45 ARG HH11 H -8.938 -1.741 -8.778 1.00 . A A . 45 ARG HH11 1 1 7 5615 1 1 45 ARG HH12 H -8.924 -1.610 -10.511 1.00 . A A . 45 ARG HH12 1 1 7 5616 1 1 45 ARG HH21 H -12.322 -2.395 -10.877 1.00 . A A . 45 ARG HH21 1 1 7 5617 1 1 45 ARG HH22 H -10.848 -1.986 -11.697 1.00 . A A . 45 ARG HH22 1 1 7 5618 1 1 45 ARG N N -10.555 0.238 -4.872 1.00 . A A . 45 ARG N 1 1 7 5619 1 1 45 ARG NE N -11.381 -2.286 -8.541 1.00 . A A . 45 ARG NE 1 1 7 5620 1 1 45 ARG NH1 N -9.424 -1.785 -9.649 1.00 . A A . 45 ARG NH1 1 1 7 5621 1 1 45 ARG NH2 N -11.344 -2.156 -10.842 1.00 . A A . 45 ARG NH2 1 1 7 5622 1 1 45 ARG O O -9.764 -0.229 -2.286 1.00 . A A . 45 ARG O 1 1 7 5623 1 1 46 ASP C C -10.761 -3.185 -0.225 1.00 . A A . 46 ASP C 1 1 7 5624 1 1 46 ASP CA C -11.160 -1.748 -0.466 1.00 . A A . 46 ASP CA 1 1 7 5625 1 1 46 ASP CB C -12.323 -1.303 0.435 1.00 . A A . 46 ASP CB 1 1 7 5626 1 1 46 ASP CG C -13.698 -1.652 -0.104 1.00 . A A . 46 ASP CG 1 1 7 5627 1 1 46 ASP H H -12.247 -2.094 -2.230 1.00 . A A . 46 ASP H 1 1 7 5628 1 1 46 ASP HA H -10.302 -1.128 -0.260 1.00 . A A . 46 ASP HA 1 1 7 5629 1 1 46 ASP HB2 H -12.215 -1.776 1.396 1.00 . A A . 46 ASP HB2 1 1 7 5630 1 1 46 ASP HB3 H -12.273 -0.230 0.566 1.00 . A A . 46 ASP HB3 1 1 7 5631 1 1 46 ASP N N -11.491 -1.583 -1.859 1.00 . A A . 46 ASP N 1 1 7 5632 1 1 46 ASP O O -11.003 -3.754 0.839 1.00 . A A . 46 ASP O 1 1 7 5633 1 1 46 ASP OD1 O -14.097 -1.075 -1.126 1.00 . A A . 46 ASP OD1 1 1 7 5634 1 1 46 ASP OD2 O -14.373 -2.533 0.475 1.00 . A A . 46 ASP OD2 1 1 7 5635 1 1 47 LEU C C -8.818 -5.500 -0.063 1.00 . A A . 47 LEU C 1 1 7 5636 1 1 47 LEU CA C -9.672 -5.135 -1.268 1.00 . A A . 47 LEU CA 1 1 7 5637 1 1 47 LEU CB C -8.889 -5.422 -2.554 1.00 . A A . 47 LEU CB 1 1 7 5638 1 1 47 LEU CD1 C -8.685 -5.281 -5.051 1.00 . A A . 47 LEU CD1 1 1 7 5639 1 1 47 LEU CD2 C -10.825 -6.045 -4.025 1.00 . A A . 47 LEU CD2 1 1 7 5640 1 1 47 LEU CG C -9.625 -5.127 -3.866 1.00 . A A . 47 LEU CG 1 1 7 5641 1 1 47 LEU H H -9.887 -3.173 -2.016 1.00 . A A . 47 LEU H 1 1 7 5642 1 1 47 LEU HA H -10.557 -5.749 -1.260 1.00 . A A . 47 LEU HA 1 1 7 5643 1 1 47 LEU HB2 H -7.985 -4.831 -2.535 1.00 . A A . 47 LEU HB2 1 1 7 5644 1 1 47 LEU HB3 H -8.613 -6.468 -2.551 1.00 . A A . 47 LEU HB3 1 1 7 5645 1 1 47 LEU HD11 H -9.219 -5.062 -5.964 1.00 . A A . 47 LEU HD11 1 1 7 5646 1 1 47 LEU HD12 H -7.856 -4.596 -4.947 1.00 . A A . 47 LEU HD12 1 1 7 5647 1 1 47 LEU HD13 H -8.311 -6.294 -5.088 1.00 . A A . 47 LEU HD13 1 1 7 5648 1 1 47 LEU HD21 H -11.507 -5.894 -3.201 1.00 . A A . 47 LEU HD21 1 1 7 5649 1 1 47 LEU HD22 H -11.327 -5.820 -4.954 1.00 . A A . 47 LEU HD22 1 1 7 5650 1 1 47 LEU HD23 H -10.494 -7.074 -4.034 1.00 . A A . 47 LEU HD23 1 1 7 5651 1 1 47 LEU HG H -9.982 -4.108 -3.850 1.00 . A A . 47 LEU HG 1 1 7 5652 1 1 47 LEU N N -10.097 -3.737 -1.241 1.00 . A A . 47 LEU N 1 1 7 5653 1 1 47 LEU O O -8.763 -6.659 0.324 1.00 . A A . 47 LEU O 1 1 7 5654 1 1 48 LYS C C -8.011 -5.280 2.883 1.00 . A A . 48 LYS C 1 1 7 5655 1 1 48 LYS CA C -7.263 -4.818 1.640 1.00 . A A . 48 LYS CA 1 1 7 5656 1 1 48 LYS CB C -6.352 -3.634 1.952 1.00 . A A . 48 LYS CB 1 1 7 5657 1 1 48 LYS CD C -6.069 -1.182 2.345 1.00 . A A . 48 LYS CD 1 1 7 5658 1 1 48 LYS CE C -4.914 -0.896 1.383 1.00 . A A . 48 LYS CE 1 1 7 5659 1 1 48 LYS CG C -7.008 -2.271 1.848 1.00 . A A . 48 LYS CG 1 1 7 5660 1 1 48 LYS H H -8.347 -3.586 0.301 1.00 . A A . 48 LYS H 1 1 7 5661 1 1 48 LYS HA H -6.640 -5.630 1.313 1.00 . A A . 48 LYS HA 1 1 7 5662 1 1 48 LYS HB2 H -5.980 -3.745 2.960 1.00 . A A . 48 LYS HB2 1 1 7 5663 1 1 48 LYS HB3 H -5.514 -3.655 1.270 1.00 . A A . 48 LYS HB3 1 1 7 5664 1 1 48 LYS HD2 H -6.632 -0.274 2.495 1.00 . A A . 48 LYS HD2 1 1 7 5665 1 1 48 LYS HD3 H -5.658 -1.510 3.287 1.00 . A A . 48 LYS HD3 1 1 7 5666 1 1 48 LYS HE2 H -5.320 -0.696 0.393 1.00 . A A . 48 LYS HE2 1 1 7 5667 1 1 48 LYS HE3 H -4.382 -0.021 1.731 1.00 . A A . 48 LYS HE3 1 1 7 5668 1 1 48 LYS HG2 H -7.263 -2.078 0.817 1.00 . A A . 48 LYS HG2 1 1 7 5669 1 1 48 LYS HG3 H -7.903 -2.263 2.452 1.00 . A A . 48 LYS HG3 1 1 7 5670 1 1 48 LYS HZ1 H -3.608 -2.291 2.261 1.00 . A A . 48 LYS HZ1 1 1 7 5671 1 1 48 LYS HZ2 H -3.138 -1.805 0.704 1.00 . A A . 48 LYS HZ2 1 1 7 5672 1 1 48 LYS HZ3 H -4.426 -2.877 0.901 1.00 . A A . 48 LYS HZ3 1 1 7 5673 1 1 48 LYS N N -8.176 -4.519 0.553 1.00 . A A . 48 LYS N 1 1 7 5674 1 1 48 LYS NZ N -3.957 -2.042 1.306 1.00 . A A . 48 LYS NZ 1 1 7 5675 1 1 48 LYS O O -7.869 -6.422 3.304 1.00 . A A . 48 LYS O 1 1 7 5676 1 1 49 TRP C C -10.920 -5.161 4.537 1.00 . A A . 49 TRP C 1 1 7 5677 1 1 49 TRP CA C -9.468 -4.718 4.722 1.00 . A A . 49 TRP CA 1 1 7 5678 1 1 49 TRP CB C -9.373 -3.520 5.666 1.00 . A A . 49 TRP CB 1 1 7 5679 1 1 49 TRP CD1 C -7.436 -1.836 5.670 1.00 . A A . 49 TRP CD1 1 1 7 5680 1 1 49 TRP CD2 C -6.860 -3.897 6.330 1.00 . A A . 49 TRP CD2 1 1 7 5681 1 1 49 TRP CE2 C -5.718 -3.076 6.368 1.00 . A A . 49 TRP CE2 1 1 7 5682 1 1 49 TRP CE3 C -6.739 -5.240 6.705 1.00 . A A . 49 TRP CE3 1 1 7 5683 1 1 49 TRP CG C -7.954 -3.081 5.886 1.00 . A A . 49 TRP CG 1 1 7 5684 1 1 49 TRP CH2 C -4.379 -4.872 7.121 1.00 . A A . 49 TRP CH2 1 1 7 5685 1 1 49 TRP CZ2 C -4.471 -3.556 6.762 1.00 . A A . 49 TRP CZ2 1 1 7 5686 1 1 49 TRP CZ3 C -5.500 -5.713 7.097 1.00 . A A . 49 TRP CZ3 1 1 7 5687 1 1 49 TRP H H -8.949 -3.532 3.055 1.00 . A A . 49 TRP H 1 1 7 5688 1 1 49 TRP HA H -8.927 -5.538 5.169 1.00 . A A . 49 TRP HA 1 1 7 5689 1 1 49 TRP HB2 H -9.923 -2.689 5.242 1.00 . A A . 49 TRP HB2 1 1 7 5690 1 1 49 TRP HB3 H -9.799 -3.783 6.622 1.00 . A A . 49 TRP HB3 1 1 7 5691 1 1 49 TRP HD1 H -8.012 -0.990 5.322 1.00 . A A . 49 TRP HD1 1 1 7 5692 1 1 49 TRP HE1 H -5.500 -1.042 5.887 1.00 . A A . 49 TRP HE1 1 1 7 5693 1 1 49 TRP HE3 H -7.590 -5.904 6.692 1.00 . A A . 49 TRP HE3 1 1 7 5694 1 1 49 TRP HH2 H -3.429 -5.286 7.433 1.00 . A A . 49 TRP HH2 1 1 7 5695 1 1 49 TRP HZ2 H -3.597 -2.921 6.787 1.00 . A A . 49 TRP HZ2 1 1 7 5696 1 1 49 TRP HZ3 H -5.387 -6.747 7.386 1.00 . A A . 49 TRP HZ3 1 1 7 5697 1 1 49 TRP N N -8.805 -4.402 3.469 1.00 . A A . 49 TRP N 1 1 7 5698 1 1 49 TRP NE1 N -6.094 -1.825 5.959 1.00 . A A . 49 TRP NE1 1 1 7 5699 1 1 49 TRP O O -11.393 -6.050 5.237 1.00 . A A . 49 TRP O 1 1 7 5700 1 1 50 TRP C C -13.461 -5.749 2.439 1.00 . A A . 50 TRP C 1 1 7 5701 1 1 50 TRP CA C -13.077 -4.739 3.518 1.00 . A A . 50 TRP CA 1 1 7 5702 1 1 50 TRP CB C -13.778 -3.408 3.269 1.00 . A A . 50 TRP CB 1 1 7 5703 1 1 50 TRP CD1 C -16.303 -3.848 3.170 1.00 . A A . 50 TRP CD1 1 1 7 5704 1 1 50 TRP CD2 C -15.614 -2.800 5.024 1.00 . A A . 50 TRP CD2 1 1 7 5705 1 1 50 TRP CE2 C -17.006 -2.975 5.100 1.00 . A A . 50 TRP CE2 1 1 7 5706 1 1 50 TRP CE3 C -14.955 -2.163 6.079 1.00 . A A . 50 TRP CE3 1 1 7 5707 1 1 50 TRP CG C -15.183 -3.366 3.783 1.00 . A A . 50 TRP CG 1 1 7 5708 1 1 50 TRP CH2 C -17.083 -1.915 7.208 1.00 . A A . 50 TRP CH2 1 1 7 5709 1 1 50 TRP CZ2 C -17.753 -2.535 6.188 1.00 . A A . 50 TRP CZ2 1 1 7 5710 1 1 50 TRP CZ3 C -15.698 -1.726 7.161 1.00 . A A . 50 TRP CZ3 1 1 7 5711 1 1 50 TRP H H -11.186 -3.952 2.965 1.00 . A A . 50 TRP H 1 1 7 5712 1 1 50 TRP HA H -13.409 -5.125 4.471 1.00 . A A . 50 TRP HA 1 1 7 5713 1 1 50 TRP HB2 H -13.221 -2.623 3.760 1.00 . A A . 50 TRP HB2 1 1 7 5714 1 1 50 TRP HB3 H -13.804 -3.216 2.208 1.00 . A A . 50 TRP HB3 1 1 7 5715 1 1 50 TRP HD1 H -16.309 -4.337 2.208 1.00 . A A . 50 TRP HD1 1 1 7 5716 1 1 50 TRP HE1 H -18.334 -3.874 3.735 1.00 . A A . 50 TRP HE1 1 1 7 5717 1 1 50 TRP HE3 H -13.886 -2.007 6.060 1.00 . A A . 50 TRP HE3 1 1 7 5718 1 1 50 TRP HH2 H -17.624 -1.559 8.072 1.00 . A A . 50 TRP HH2 1 1 7 5719 1 1 50 TRP HZ2 H -18.822 -2.671 6.241 1.00 . A A . 50 TRP HZ2 1 1 7 5720 1 1 50 TRP HZ3 H -15.206 -1.232 7.986 1.00 . A A . 50 TRP HZ3 1 1 7 5721 1 1 50 TRP N N -11.634 -4.535 3.611 1.00 . A A . 50 TRP N 1 1 7 5722 1 1 50 TRP NE1 N -17.405 -3.618 3.958 1.00 . A A . 50 TRP NE1 1 1 7 5723 1 1 50 TRP O O -14.134 -6.738 2.727 1.00 . A A . 50 TRP O 1 1 7 5724 1 1 51 GLU C C -13.019 -7.743 0.203 1.00 . A A . 51 GLU C 1 1 7 5725 1 1 51 GLU CA C -13.468 -6.303 0.060 1.00 . A A . 51 GLU CA 1 1 7 5726 1 1 51 GLU CB C -12.935 -5.722 -1.259 1.00 . A A . 51 GLU CB 1 1 7 5727 1 1 51 GLU CD C -15.210 -4.926 -1.972 1.00 . A A . 51 GLU CD 1 1 7 5728 1 1 51 GLU CG C -13.744 -4.569 -1.809 1.00 . A A . 51 GLU CG 1 1 7 5729 1 1 51 GLU H H -12.383 -4.781 1.054 1.00 . A A . 51 GLU H 1 1 7 5730 1 1 51 GLU HA H -14.547 -6.279 0.042 1.00 . A A . 51 GLU HA 1 1 7 5731 1 1 51 GLU HB2 H -11.932 -5.358 -1.100 1.00 . A A . 51 GLU HB2 1 1 7 5732 1 1 51 GLU HB3 H -12.912 -6.505 -2.004 1.00 . A A . 51 GLU HB3 1 1 7 5733 1 1 51 GLU HG2 H -13.644 -3.725 -1.139 1.00 . A A . 51 GLU HG2 1 1 7 5734 1 1 51 GLU HG3 H -13.347 -4.303 -2.777 1.00 . A A . 51 GLU HG3 1 1 7 5735 1 1 51 GLU N N -13.029 -5.504 1.201 1.00 . A A . 51 GLU N 1 1 7 5736 1 1 51 GLU O O -13.822 -8.672 0.124 1.00 . A A . 51 GLU O 1 1 7 5737 1 1 51 GLU OE1 O -15.946 -4.901 -0.964 1.00 . A A . 51 GLU OE1 1 1 7 5738 1 1 51 GLU OE2 O -15.644 -5.210 -3.104 1.00 . A A . 51 GLU OE2 1 1 7 5739 1 1 52 LEU C C -10.896 -9.600 1.972 1.00 . A A . 52 LEU C 1 1 7 5740 1 1 52 LEU CA C -11.160 -9.252 0.522 1.00 . A A . 52 LEU CA 1 1 7 5741 1 1 52 LEU CB C -9.861 -9.312 -0.266 1.00 . A A . 52 LEU CB 1 1 7 5742 1 1 52 LEU CD1 C -8.607 -8.947 -2.398 1.00 . A A . 52 LEU CD1 1 1 7 5743 1 1 52 LEU CD2 C -11.027 -9.585 -2.464 1.00 . A A . 52 LEU CD2 1 1 7 5744 1 1 52 LEU CG C -9.956 -8.820 -1.703 1.00 . A A . 52 LEU CG 1 1 7 5745 1 1 52 LEU H H -11.146 -7.137 0.493 1.00 . A A . 52 LEU H 1 1 7 5746 1 1 52 LEU HA H -11.862 -9.956 0.108 1.00 . A A . 52 LEU HA 1 1 7 5747 1 1 52 LEU HB2 H -9.137 -8.695 0.250 1.00 . A A . 52 LEU HB2 1 1 7 5748 1 1 52 LEU HB3 H -9.506 -10.332 -0.275 1.00 . A A . 52 LEU HB3 1 1 7 5749 1 1 52 LEU HD11 H -8.701 -8.631 -3.426 1.00 . A A . 52 LEU HD11 1 1 7 5750 1 1 52 LEU HD12 H -7.881 -8.326 -1.894 1.00 . A A . 52 LEU HD12 1 1 7 5751 1 1 52 LEU HD13 H -8.283 -9.978 -2.367 1.00 . A A . 52 LEU HD13 1 1 7 5752 1 1 52 LEU HD21 H -10.781 -10.637 -2.470 1.00 . A A . 52 LEU HD21 1 1 7 5753 1 1 52 LEU HD22 H -11.983 -9.440 -1.982 1.00 . A A . 52 LEU HD22 1 1 7 5754 1 1 52 LEU HD23 H -11.077 -9.222 -3.480 1.00 . A A . 52 LEU HD23 1 1 7 5755 1 1 52 LEU HG H -10.233 -7.771 -1.688 1.00 . A A . 52 LEU HG 1 1 7 5756 1 1 52 LEU N N -11.731 -7.921 0.414 1.00 . A A . 52 LEU N 1 1 7 5757 1 1 52 LEU O O -11.081 -10.742 2.395 1.00 . A A . 52 LEU O 1 1 7 5758 1 1 53 ARG C C -8.953 -9.727 4.290 1.00 . A A . 53 ARG C 1 1 7 5759 1 1 53 ARG CA C -10.114 -8.742 4.133 1.00 . A A . 53 ARG CA 1 1 7 5760 1 1 53 ARG CB C -11.316 -9.207 4.972 1.00 . A A . 53 ARG CB 1 1 7 5761 1 1 53 ARG CD C -12.148 -9.933 7.237 1.00 . A A . 53 ARG CD 1 1 7 5762 1 1 53 ARG CG C -11.028 -9.254 6.467 1.00 . A A . 53 ARG CG 1 1 7 5763 1 1 53 ARG CZ C -12.059 -10.974 9.475 1.00 . A A . 53 ARG CZ 1 1 7 5764 1 1 53 ARG H H -10.424 -7.699 2.307 1.00 . A A . 53 ARG H 1 1 7 5765 1 1 53 ARG HA H -9.793 -7.774 4.492 1.00 . A A . 53 ARG HA 1 1 7 5766 1 1 53 ARG HB2 H -12.138 -8.527 4.807 1.00 . A A . 53 ARG HB2 1 1 7 5767 1 1 53 ARG HB3 H -11.606 -10.197 4.652 1.00 . A A . 53 ARG HB3 1 1 7 5768 1 1 53 ARG HD2 H -13.073 -9.414 7.037 1.00 . A A . 53 ARG HD2 1 1 7 5769 1 1 53 ARG HD3 H -12.227 -10.957 6.904 1.00 . A A . 53 ARG HD3 1 1 7 5770 1 1 53 ARG HE H -11.586 -9.069 9.067 1.00 . A A . 53 ARG HE 1 1 7 5771 1 1 53 ARG HG2 H -10.112 -9.803 6.632 1.00 . A A . 53 ARG HG2 1 1 7 5772 1 1 53 ARG HG3 H -10.914 -8.244 6.834 1.00 . A A . 53 ARG HG3 1 1 7 5773 1 1 53 ARG HH11 H -12.680 -12.225 7.998 1.00 . A A . 53 ARG HH11 1 1 7 5774 1 1 53 ARG HH12 H -12.613 -12.925 9.592 1.00 . A A . 53 ARG HH12 1 1 7 5775 1 1 53 ARG HH21 H -11.485 -9.985 11.150 1.00 . A A . 53 ARG HH21 1 1 7 5776 1 1 53 ARG HH22 H -11.907 -11.656 11.384 1.00 . A A . 53 ARG HH22 1 1 7 5777 1 1 53 ARG N N -10.482 -8.588 2.722 1.00 . A A . 53 ARG N 1 1 7 5778 1 1 53 ARG NE N -11.894 -9.920 8.676 1.00 . A A . 53 ARG NE 1 1 7 5779 1 1 53 ARG NH1 N -12.480 -12.135 8.983 1.00 . A A . 53 ARG NH1 1 1 7 5780 1 1 53 ARG NH2 N -11.798 -10.863 10.773 1.00 . A A . 53 ARG NH2 1 1 7 5781 1 1 53 ARG O O -7.790 -9.318 4.102 1.00 . A A . 53 ARG O 1 1 7 5782 1 1 53 ARG OXT O -9.207 -10.908 4.607 1.00 . A A . 53 ARG OXT 1 1 8 5783 1 1 1 ASN C C 9.505 -9.193 4.251 1.00 . A A . 1 ASN C 1 1 8 5784 1 1 1 ASN CA C 10.197 -10.334 3.530 1.00 . A A . 1 ASN CA 1 1 8 5785 1 1 1 ASN CB C 11.251 -9.745 2.583 1.00 . A A . 1 ASN CB 1 1 8 5786 1 1 1 ASN CG C 12.312 -10.738 2.169 1.00 . A A . 1 ASN CG 1 1 8 5787 1 1 1 ASN H1 H 9.705 -11.976 2.336 1.00 . A A . 1 ASN H1 1 1 8 5788 1 1 1 ASN H2 H 8.727 -10.616 2.078 1.00 . A A . 1 ASN H2 1 1 8 5789 1 1 1 ASN H3 H 8.513 -11.556 3.469 1.00 . A A . 1 ASN H3 1 1 8 5790 1 1 1 ASN HA H 10.695 -10.952 4.261 1.00 . A A . 1 ASN HA 1 1 8 5791 1 1 1 ASN HB2 H 10.760 -9.385 1.690 1.00 . A A . 1 ASN HB2 1 1 8 5792 1 1 1 ASN HB3 H 11.736 -8.914 3.075 1.00 . A A . 1 ASN HB3 1 1 8 5793 1 1 1 ASN HD21 H 13.644 -9.272 2.015 1.00 . A A . 1 ASN HD21 1 1 8 5794 1 1 1 ASN HD22 H 14.233 -10.860 1.653 1.00 . A A . 1 ASN HD22 1 1 8 5795 1 1 1 ASN N N 9.221 -11.177 2.803 1.00 . A A . 1 ASN N 1 1 8 5796 1 1 1 ASN ND2 N 13.515 -10.239 1.919 1.00 . A A . 1 ASN ND2 1 1 8 5797 1 1 1 ASN O O 9.375 -9.218 5.477 1.00 . A A . 1 ASN O 1 1 8 5798 1 1 1 ASN OD1 O 12.061 -11.936 2.072 1.00 . A A . 1 ASN OD1 1 1 8 5799 1 1 2 SER C C 9.770 -6.334 4.815 1.00 . A A . 2 SER C 1 1 8 5800 1 1 2 SER CA C 8.608 -6.934 4.036 1.00 . A A . 2 SER CA 1 1 8 5801 1 1 2 SER CB C 7.363 -7.103 4.913 1.00 . A A . 2 SER CB 1 1 8 5802 1 1 2 SER H H 9.014 -8.334 2.506 1.00 . A A . 2 SER H 1 1 8 5803 1 1 2 SER HA H 8.373 -6.279 3.206 1.00 . A A . 2 SER HA 1 1 8 5804 1 1 2 SER HB2 H 7.571 -7.816 5.697 1.00 . A A . 2 SER HB2 1 1 8 5805 1 1 2 SER HB3 H 7.103 -6.151 5.354 1.00 . A A . 2 SER HB3 1 1 8 5806 1 1 2 SER HG H 5.444 -7.439 4.657 1.00 . A A . 2 SER HG 1 1 8 5807 1 1 2 SER N N 9.045 -8.206 3.482 1.00 . A A . 2 SER N 1 1 8 5808 1 1 2 SER O O 9.770 -6.321 6.048 1.00 . A A . 2 SER O 1 1 8 5809 1 1 2 SER OG O 6.259 -7.569 4.150 1.00 . A A . 2 SER OG 1 1 8 5810 1 1 3 ASP C C 11.925 -4.137 5.423 1.00 . A A . 3 ASP C 1 1 8 5811 1 1 3 ASP CA C 12.052 -5.466 4.665 1.00 . A A . 3 ASP CA 1 1 8 5812 1 1 3 ASP CB C 13.111 -5.364 3.567 1.00 . A A . 3 ASP CB 1 1 8 5813 1 1 3 ASP CG C 14.519 -5.547 4.093 1.00 . A A . 3 ASP CG 1 1 8 5814 1 1 3 ASP H H 10.655 -5.796 3.088 1.00 . A A . 3 ASP H 1 1 8 5815 1 1 3 ASP HA H 12.350 -6.235 5.364 1.00 . A A . 3 ASP HA 1 1 8 5816 1 1 3 ASP HB2 H 12.925 -6.125 2.823 1.00 . A A . 3 ASP HB2 1 1 8 5817 1 1 3 ASP HB3 H 13.044 -4.390 3.101 1.00 . A A . 3 ASP HB3 1 1 8 5818 1 1 3 ASP N N 10.776 -5.874 4.071 1.00 . A A . 3 ASP N 1 1 8 5819 1 1 3 ASP O O 10.850 -3.788 5.912 1.00 . A A . 3 ASP O 1 1 8 5820 1 1 3 ASP OD1 O 14.953 -6.702 4.255 1.00 . A A . 3 ASP OD1 1 1 8 5821 1 1 3 ASP OD2 O 15.198 -4.528 4.343 1.00 . A A . 3 ASP OD2 1 1 8 5822 1 1 4 SER C C 14.087 -1.203 5.755 1.00 . A A . 4 SER C 1 1 8 5823 1 1 4 SER CA C 13.025 -2.160 6.300 1.00 . A A . 4 SER CA 1 1 8 5824 1 1 4 SER CB C 13.283 -2.444 7.785 1.00 . A A . 4 SER CB 1 1 8 5825 1 1 4 SER H H 13.865 -3.718 5.139 1.00 . A A . 4 SER H 1 1 8 5826 1 1 4 SER HA H 12.051 -1.707 6.190 1.00 . A A . 4 SER HA 1 1 8 5827 1 1 4 SER HB2 H 14.297 -2.797 7.913 1.00 . A A . 4 SER HB2 1 1 8 5828 1 1 4 SER HB3 H 13.143 -1.536 8.353 1.00 . A A . 4 SER HB3 1 1 8 5829 1 1 4 SER HG H 11.625 -3.488 7.681 1.00 . A A . 4 SER HG 1 1 8 5830 1 1 4 SER N N 13.026 -3.409 5.557 1.00 . A A . 4 SER N 1 1 8 5831 1 1 4 SER O O 15.087 -0.925 6.420 1.00 . A A . 4 SER O 1 1 8 5832 1 1 4 SER OG O 12.390 -3.434 8.274 1.00 . A A . 4 SER OG 1 1 8 5833 1 1 5 GLU C C 14.095 1.355 3.193 1.00 . A A . 5 GLU C 1 1 8 5834 1 1 5 GLU CA C 14.812 0.235 3.941 1.00 . A A . 5 GLU CA 1 1 8 5835 1 1 5 GLU CB C 15.771 -0.488 2.986 1.00 . A A . 5 GLU CB 1 1 8 5836 1 1 5 GLU CD C 17.747 -0.254 1.404 1.00 . A A . 5 GLU CD 1 1 8 5837 1 1 5 GLU CG C 16.740 0.456 2.283 1.00 . A A . 5 GLU CG 1 1 8 5838 1 1 5 GLU H H 13.059 -0.967 4.046 1.00 . A A . 5 GLU H 1 1 8 5839 1 1 5 GLU HA H 15.391 0.676 4.741 1.00 . A A . 5 GLU HA 1 1 8 5840 1 1 5 GLU HB2 H 16.345 -1.212 3.547 1.00 . A A . 5 GLU HB2 1 1 8 5841 1 1 5 GLU HB3 H 15.193 -1.004 2.233 1.00 . A A . 5 GLU HB3 1 1 8 5842 1 1 5 GLU HG2 H 16.171 1.135 1.665 1.00 . A A . 5 GLU HG2 1 1 8 5843 1 1 5 GLU HG3 H 17.274 1.021 3.033 1.00 . A A . 5 GLU HG3 1 1 8 5844 1 1 5 GLU N N 13.872 -0.699 4.545 1.00 . A A . 5 GLU N 1 1 8 5845 1 1 5 GLU O O 14.603 2.475 3.120 1.00 . A A . 5 GLU O 1 1 8 5846 1 1 5 GLU OE1 O 18.785 -0.707 1.930 1.00 . A A . 5 GLU OE1 1 1 8 5847 1 1 5 GLU OE2 O 17.491 -0.388 0.190 1.00 . A A . 5 GLU OE2 1 1 8 5848 1 1 6 CYS C C 12.092 3.373 2.341 1.00 . A A . 6 CYS C 1 1 8 5849 1 1 6 CYS CA C 12.201 1.963 1.768 1.00 . A A . 6 CYS CA 1 1 8 5850 1 1 6 CYS CB C 10.801 1.438 1.445 1.00 . A A . 6 CYS CB 1 1 8 5851 1 1 6 CYS H H 12.485 0.187 2.895 1.00 . A A . 6 CYS H 1 1 8 5852 1 1 6 CYS HA H 12.767 2.013 0.851 1.00 . A A . 6 CYS HA 1 1 8 5853 1 1 6 CYS HB2 H 10.880 0.447 1.024 1.00 . A A . 6 CYS HB2 1 1 8 5854 1 1 6 CYS HB3 H 10.217 1.397 2.352 1.00 . A A . 6 CYS HB3 1 1 8 5855 1 1 6 CYS N N 12.908 1.052 2.666 1.00 . A A . 6 CYS N 1 1 8 5856 1 1 6 CYS O O 11.512 3.587 3.407 1.00 . A A . 6 CYS O 1 1 8 5857 1 1 6 CYS SG S 9.907 2.487 0.250 1.00 . A A . 6 CYS SG 1 1 8 5858 1 1 7 PRO C C 11.196 6.303 1.917 1.00 . A A . 7 PRO C 1 1 8 5859 1 1 7 PRO CA C 12.617 5.763 2.009 1.00 . A A . 7 PRO CA 1 1 8 5860 1 1 7 PRO CB C 13.517 6.456 0.977 1.00 . A A . 7 PRO CB 1 1 8 5861 1 1 7 PRO CD C 13.476 4.144 0.417 1.00 . A A . 7 PRO CD 1 1 8 5862 1 1 7 PRO CG C 14.337 5.369 0.376 1.00 . A A . 7 PRO CG 1 1 8 5863 1 1 7 PRO HA H 13.003 5.932 3.005 1.00 . A A . 7 PRO HA 1 1 8 5864 1 1 7 PRO HB2 H 12.903 6.944 0.233 1.00 . A A . 7 PRO HB2 1 1 8 5865 1 1 7 PRO HB3 H 14.138 7.190 1.472 1.00 . A A . 7 PRO HB3 1 1 8 5866 1 1 7 PRO HD2 H 12.840 4.098 -0.457 1.00 . A A . 7 PRO HD2 1 1 8 5867 1 1 7 PRO HD3 H 14.082 3.255 0.494 1.00 . A A . 7 PRO HD3 1 1 8 5868 1 1 7 PRO HG2 H 14.591 5.620 -0.644 1.00 . A A . 7 PRO HG2 1 1 8 5869 1 1 7 PRO HG3 H 15.232 5.217 0.961 1.00 . A A . 7 PRO HG3 1 1 8 5870 1 1 7 PRO N N 12.683 4.349 1.636 1.00 . A A . 7 PRO N 1 1 8 5871 1 1 7 PRO O O 10.356 5.750 1.208 1.00 . A A . 7 PRO O 1 1 8 5872 1 1 8 LEU C C 9.054 8.513 1.419 1.00 . A A . 8 LEU C 1 1 8 5873 1 1 8 LEU CA C 9.609 7.982 2.741 1.00 . A A . 8 LEU CA 1 1 8 5874 1 1 8 LEU CB C 9.615 9.103 3.776 1.00 . A A . 8 LEU CB 1 1 8 5875 1 1 8 LEU CD1 C 9.907 9.873 6.144 1.00 . A A . 8 LEU CD1 1 1 8 5876 1 1 8 LEU CD2 C 8.796 7.681 5.673 1.00 . A A . 8 LEU CD2 1 1 8 5877 1 1 8 LEU CG C 9.867 8.664 5.220 1.00 . A A . 8 LEU CG 1 1 8 5878 1 1 8 LEU H H 11.706 7.862 3.055 1.00 . A A . 8 LEU H 1 1 8 5879 1 1 8 LEU HA H 8.957 7.197 3.093 1.00 . A A . 8 LEU HA 1 1 8 5880 1 1 8 LEU HB2 H 10.381 9.814 3.501 1.00 . A A . 8 LEU HB2 1 1 8 5881 1 1 8 LEU HB3 H 8.659 9.597 3.734 1.00 . A A . 8 LEU HB3 1 1 8 5882 1 1 8 LEU HD11 H 8.960 10.390 6.108 1.00 . A A . 8 LEU HD11 1 1 8 5883 1 1 8 LEU HD12 H 10.101 9.548 7.154 1.00 . A A . 8 LEU HD12 1 1 8 5884 1 1 8 LEU HD13 H 10.693 10.542 5.825 1.00 . A A . 8 LEU HD13 1 1 8 5885 1 1 8 LEU HD21 H 7.823 8.145 5.597 1.00 . A A . 8 LEU HD21 1 1 8 5886 1 1 8 LEU HD22 H 8.826 6.806 5.040 1.00 . A A . 8 LEU HD22 1 1 8 5887 1 1 8 LEU HD23 H 8.980 7.395 6.696 1.00 . A A . 8 LEU HD23 1 1 8 5888 1 1 8 LEU HG H 10.823 8.168 5.279 1.00 . A A . 8 LEU HG 1 1 8 5889 1 1 8 LEU N N 10.953 7.409 2.610 1.00 . A A . 8 LEU N 1 1 8 5890 1 1 8 LEU O O 7.912 8.957 1.355 1.00 . A A . 8 LEU O 1 1 8 5891 1 1 9 SER C C 8.581 7.973 -1.630 1.00 . A A . 9 SER C 1 1 8 5892 1 1 9 SER CA C 9.472 8.979 -0.918 1.00 . A A . 9 SER CA 1 1 8 5893 1 1 9 SER CB C 10.721 9.291 -1.748 1.00 . A A . 9 SER CB 1 1 8 5894 1 1 9 SER H H 10.704 8.006 0.459 1.00 . A A . 9 SER H 1 1 8 5895 1 1 9 SER HA H 8.913 9.890 -0.760 1.00 . A A . 9 SER HA 1 1 8 5896 1 1 9 SER HB2 H 11.368 9.947 -1.185 1.00 . A A . 9 SER HB2 1 1 8 5897 1 1 9 SER HB3 H 11.245 8.371 -1.964 1.00 . A A . 9 SER HB3 1 1 8 5898 1 1 9 SER HG H 11.053 9.696 -3.642 1.00 . A A . 9 SER HG 1 1 8 5899 1 1 9 SER N N 9.853 8.454 0.372 1.00 . A A . 9 SER N 1 1 8 5900 1 1 9 SER O O 7.698 8.343 -2.394 1.00 . A A . 9 SER O 1 1 8 5901 1 1 9 SER OG O 10.388 9.925 -2.973 1.00 . A A . 9 SER OG 1 1 8 5902 1 1 10 HIS C C 6.768 5.356 -1.048 1.00 . A A . 10 HIS C 1 1 8 5903 1 1 10 HIS CA C 7.963 5.654 -1.941 1.00 . A A . 10 HIS CA 1 1 8 5904 1 1 10 HIS CB C 8.763 4.379 -2.204 1.00 . A A . 10 HIS CB 1 1 8 5905 1 1 10 HIS CD2 C 10.966 4.959 -3.443 1.00 . A A . 10 HIS CD2 1 1 8 5906 1 1 10 HIS CE1 C 10.398 4.281 -5.445 1.00 . A A . 10 HIS CE1 1 1 8 5907 1 1 10 HIS CG C 9.701 4.484 -3.366 1.00 . A A . 10 HIS CG 1 1 8 5908 1 1 10 HIS H H 9.502 6.443 -0.714 1.00 . A A . 10 HIS H 1 1 8 5909 1 1 10 HIS HA H 7.602 6.038 -2.879 1.00 . A A . 10 HIS HA 1 1 8 5910 1 1 10 HIS HB2 H 9.346 4.142 -1.326 1.00 . A A . 10 HIS HB2 1 1 8 5911 1 1 10 HIS HB3 H 8.078 3.569 -2.401 1.00 . A A . 10 HIS HB3 1 1 8 5912 1 1 10 HIS HD1 H 8.520 3.669 -4.912 1.00 . A A . 10 HIS HD1 1 1 8 5913 1 1 10 HIS HD2 H 11.546 5.374 -2.630 1.00 . A A . 10 HIS HD2 1 1 8 5914 1 1 10 HIS HE1 H 10.429 4.052 -6.498 1.00 . A A . 10 HIS HE1 1 1 8 5915 1 1 10 HIS HE2 H 12.316 4.885 -5.053 1.00 . A A . 10 HIS HE2 1 1 8 5916 1 1 10 HIS N N 8.791 6.692 -1.345 1.00 . A A . 10 HIS N 1 1 8 5917 1 1 10 HIS ND1 N 9.374 4.067 -4.640 1.00 . A A . 10 HIS ND1 1 1 8 5918 1 1 10 HIS NE2 N 11.374 4.821 -4.746 1.00 . A A . 10 HIS NE2 1 1 8 5919 1 1 10 HIS O O 5.845 4.648 -1.439 1.00 . A A . 10 HIS O 1 1 8 5920 1 1 11 ASP C C 4.769 7.004 0.882 1.00 . A A . 11 ASP C 1 1 8 5921 1 1 11 ASP CA C 5.695 5.816 1.093 1.00 . A A . 11 ASP CA 1 1 8 5922 1 1 11 ASP CB C 6.231 5.805 2.529 1.00 . A A . 11 ASP CB 1 1 8 5923 1 1 11 ASP CG C 5.153 5.553 3.566 1.00 . A A . 11 ASP CG 1 1 8 5924 1 1 11 ASP H H 7.584 6.441 0.401 1.00 . A A . 11 ASP H 1 1 8 5925 1 1 11 ASP HA H 5.159 4.900 0.894 1.00 . A A . 11 ASP HA 1 1 8 5926 1 1 11 ASP HB2 H 6.975 5.029 2.621 1.00 . A A . 11 ASP HB2 1 1 8 5927 1 1 11 ASP HB3 H 6.689 6.761 2.740 1.00 . A A . 11 ASP HB3 1 1 8 5928 1 1 11 ASP N N 6.801 5.923 0.149 1.00 . A A . 11 ASP N 1 1 8 5929 1 1 11 ASP O O 3.548 6.878 0.877 1.00 . A A . 11 ASP O 1 1 8 5930 1 1 11 ASP OD1 O 4.401 6.498 3.882 1.00 . A A . 11 ASP OD1 1 1 8 5931 1 1 11 ASP OD2 O 5.036 4.405 4.044 1.00 . A A . 11 ASP OD2 1 1 8 5932 1 1 12 GLY C C 4.209 9.316 -1.120 1.00 . A A . 12 GLY C 1 1 8 5933 1 1 12 GLY CA C 4.670 9.361 0.319 1.00 . A A . 12 GLY CA 1 1 8 5934 1 1 12 GLY H H 6.357 8.195 0.791 1.00 . A A . 12 GLY H 1 1 8 5935 1 1 12 GLY HA2 H 3.810 9.467 0.965 1.00 . A A . 12 GLY HA2 1 1 8 5936 1 1 12 GLY HA3 H 5.321 10.213 0.451 1.00 . A A . 12 GLY HA3 1 1 8 5937 1 1 12 GLY N N 5.390 8.158 0.679 1.00 . A A . 12 GLY N 1 1 8 5938 1 1 12 GLY O O 3.324 10.072 -1.523 1.00 . A A . 12 GLY O 1 1 8 5939 1 1 13 TYR C C 2.941 7.555 -3.171 1.00 . A A . 13 TYR C 1 1 8 5940 1 1 13 TYR CA C 4.356 8.127 -3.251 1.00 . A A . 13 TYR CA 1 1 8 5941 1 1 13 TYR CB C 5.294 7.124 -3.931 1.00 . A A . 13 TYR CB 1 1 8 5942 1 1 13 TYR CD1 C 5.322 7.719 -6.393 1.00 . A A . 13 TYR CD1 1 1 8 5943 1 1 13 TYR CD2 C 4.284 5.673 -5.739 1.00 . A A . 13 TYR CD2 1 1 8 5944 1 1 13 TYR CE1 C 5.011 7.457 -7.716 1.00 . A A . 13 TYR CE1 1 1 8 5945 1 1 13 TYR CE2 C 3.972 5.405 -7.059 1.00 . A A . 13 TYR CE2 1 1 8 5946 1 1 13 TYR CG C 4.964 6.831 -5.383 1.00 . A A . 13 TYR CG 1 1 8 5947 1 1 13 TYR CZ C 4.375 6.290 -8.048 1.00 . A A . 13 TYR CZ 1 1 8 5948 1 1 13 TYR H H 5.659 8.003 -1.575 1.00 . A A . 13 TYR H 1 1 8 5949 1 1 13 TYR HA H 4.335 9.044 -3.822 1.00 . A A . 13 TYR HA 1 1 8 5950 1 1 13 TYR HB2 H 6.300 7.507 -3.894 1.00 . A A . 13 TYR HB2 1 1 8 5951 1 1 13 TYR HB3 H 5.254 6.188 -3.389 1.00 . A A . 13 TYR HB3 1 1 8 5952 1 1 13 TYR HD1 H 5.851 8.624 -6.135 1.00 . A A . 13 TYR HD1 1 1 8 5953 1 1 13 TYR HD2 H 3.998 4.975 -4.968 1.00 . A A . 13 TYR HD2 1 1 8 5954 1 1 13 TYR HE1 H 5.296 8.157 -8.487 1.00 . A A . 13 TYR HE1 1 1 8 5955 1 1 13 TYR HE2 H 3.443 4.498 -7.316 1.00 . A A . 13 TYR HE2 1 1 8 5956 1 1 13 TYR HH H 4.790 6.235 -9.917 1.00 . A A . 13 TYR HH 1 1 8 5957 1 1 13 TYR N N 4.835 8.437 -1.905 1.00 . A A . 13 TYR N 1 1 8 5958 1 1 13 TYR O O 2.148 7.667 -4.109 1.00 . A A . 13 TYR O 1 1 8 5959 1 1 13 TYR OH O 4.026 6.035 -9.355 1.00 . A A . 13 TYR OH 1 1 8 5960 1 1 14 CYS C C 0.364 7.549 -1.377 1.00 . A A . 14 CYS C 1 1 8 5961 1 1 14 CYS CA C 1.316 6.412 -1.765 1.00 . A A . 14 CYS CA 1 1 8 5962 1 1 14 CYS CB C 1.421 5.344 -0.679 1.00 . A A . 14 CYS CB 1 1 8 5963 1 1 14 CYS H H 3.328 6.864 -1.343 1.00 . A A . 14 CYS H 1 1 8 5964 1 1 14 CYS HA H 0.956 5.955 -2.676 1.00 . A A . 14 CYS HA 1 1 8 5965 1 1 14 CYS HB2 H 1.850 5.776 0.219 1.00 . A A . 14 CYS HB2 1 1 8 5966 1 1 14 CYS HB3 H 0.437 4.957 -0.460 1.00 . A A . 14 CYS HB3 1 1 8 5967 1 1 14 CYS N N 2.638 6.946 -2.034 1.00 . A A . 14 CYS N 1 1 8 5968 1 1 14 CYS O O 0.789 8.698 -1.261 1.00 . A A . 14 CYS O 1 1 8 5969 1 1 14 CYS SG S 2.476 3.941 -1.161 1.00 . A A . 14 CYS SG 1 1 8 5970 1 1 15 LEU C C -2.597 8.502 0.183 1.00 . A A . 15 LEU C 1 1 8 5971 1 1 15 LEU CA C -1.930 8.302 -1.164 1.00 . A A . 15 LEU CA 1 1 8 5972 1 1 15 LEU CB C -3.005 8.023 -2.211 1.00 . A A . 15 LEU CB 1 1 8 5973 1 1 15 LEU CD1 C -3.640 7.535 -4.579 1.00 . A A . 15 LEU CD1 1 1 8 5974 1 1 15 LEU CD2 C -1.543 8.809 -4.094 1.00 . A A . 15 LEU CD2 1 1 8 5975 1 1 15 LEU CG C -2.481 7.711 -3.609 1.00 . A A . 15 LEU CG 1 1 8 5976 1 1 15 LEU H H -1.179 6.324 -0.986 1.00 . A A . 15 LEU H 1 1 8 5977 1 1 15 LEU HA H -1.437 9.218 -1.429 1.00 . A A . 15 LEU HA 1 1 8 5978 1 1 15 LEU HB2 H -3.593 7.180 -1.874 1.00 . A A . 15 LEU HB2 1 1 8 5979 1 1 15 LEU HB3 H -3.650 8.885 -2.277 1.00 . A A . 15 LEU HB3 1 1 8 5980 1 1 15 LEU HD11 H -4.256 6.709 -4.255 1.00 . A A . 15 LEU HD11 1 1 8 5981 1 1 15 LEU HD12 H -4.232 8.437 -4.601 1.00 . A A . 15 LEU HD12 1 1 8 5982 1 1 15 LEU HD13 H -3.255 7.331 -5.566 1.00 . A A . 15 LEU HD13 1 1 8 5983 1 1 15 LEU HD21 H -1.176 8.558 -5.078 1.00 . A A . 15 LEU HD21 1 1 8 5984 1 1 15 LEU HD22 H -2.079 9.747 -4.137 1.00 . A A . 15 LEU HD22 1 1 8 5985 1 1 15 LEU HD23 H -0.712 8.899 -3.411 1.00 . A A . 15 LEU HD23 1 1 8 5986 1 1 15 LEU HG H -1.925 6.781 -3.566 1.00 . A A . 15 LEU HG 1 1 8 5987 1 1 15 LEU N N -0.919 7.248 -1.169 1.00 . A A . 15 LEU N 1 1 8 5988 1 1 15 LEU O O -2.383 9.516 0.841 1.00 . A A . 15 LEU O 1 1 8 5989 1 1 16 HIS C C -3.872 7.056 2.968 1.00 . A A . 16 HIS C 1 1 8 5990 1 1 16 HIS CA C -4.305 7.792 1.726 1.00 . A A . 16 HIS CA 1 1 8 5991 1 1 16 HIS CB C -5.747 7.432 1.368 1.00 . A A . 16 HIS CB 1 1 8 5992 1 1 16 HIS CD2 C -6.739 9.408 0.010 1.00 . A A . 16 HIS CD2 1 1 8 5993 1 1 16 HIS CE1 C -8.030 10.249 1.566 1.00 . A A . 16 HIS CE1 1 1 8 5994 1 1 16 HIS CG C -6.600 8.636 1.112 1.00 . A A . 16 HIS CG 1 1 8 5995 1 1 16 HIS H H -3.360 6.639 0.193 1.00 . A A . 16 HIS H 1 1 8 5996 1 1 16 HIS HA H -4.261 8.848 1.935 1.00 . A A . 16 HIS HA 1 1 8 5997 1 1 16 HIS HB2 H -5.750 6.822 0.478 1.00 . A A . 16 HIS HB2 1 1 8 5998 1 1 16 HIS HB3 H -6.187 6.876 2.185 1.00 . A A . 16 HIS HB3 1 1 8 5999 1 1 16 HIS HD1 H -7.537 8.860 2.993 1.00 . A A . 16 HIS HD1 1 1 8 6000 1 1 16 HIS HD2 H -6.238 9.264 -0.938 1.00 . A A . 16 HIS HD2 1 1 8 6001 1 1 16 HIS HE1 H -8.731 10.881 2.089 1.00 . A A . 16 HIS HE1 1 1 8 6002 1 1 16 HIS HE2 H -7.726 11.246 -0.197 1.00 . A A . 16 HIS HE2 1 1 8 6003 1 1 16 HIS N N -3.405 7.544 0.605 1.00 . A A . 16 HIS N 1 1 8 6004 1 1 16 HIS ND1 N -7.423 9.190 2.070 1.00 . A A . 16 HIS ND1 1 1 8 6005 1 1 16 HIS NE2 N -7.632 10.407 0.315 1.00 . A A . 16 HIS NE2 1 1 8 6006 1 1 16 HIS O O -4.701 6.685 3.797 1.00 . A A . 16 HIS O 1 1 8 6007 1 1 17 ASP C C -0.513 5.890 3.870 1.00 . A A . 17 ASP C 1 1 8 6008 1 1 17 ASP CA C -1.935 6.253 4.232 1.00 . A A . 17 ASP CA 1 1 8 6009 1 1 17 ASP CB C -2.677 4.996 4.690 1.00 . A A . 17 ASP CB 1 1 8 6010 1 1 17 ASP CG C -2.345 4.605 6.119 1.00 . A A . 17 ASP CG 1 1 8 6011 1 1 17 ASP H H -1.991 7.194 2.345 1.00 . A A . 17 ASP H 1 1 8 6012 1 1 17 ASP HA H -1.922 6.975 5.030 1.00 . A A . 17 ASP HA 1 1 8 6013 1 1 17 ASP HB2 H -3.739 5.173 4.627 1.00 . A A . 17 ASP HB2 1 1 8 6014 1 1 17 ASP HB3 H -2.416 4.174 4.040 1.00 . A A . 17 ASP HB3 1 1 8 6015 1 1 17 ASP N N -2.566 6.874 3.074 1.00 . A A . 17 ASP N 1 1 8 6016 1 1 17 ASP O O 0.432 6.388 4.478 1.00 . A A . 17 ASP O 1 1 8 6017 1 1 17 ASP OD1 O -1.306 3.945 6.328 1.00 . A A . 17 ASP OD1 1 1 8 6018 1 1 17 ASP OD2 O -3.110 4.958 7.038 1.00 . A A . 17 ASP OD2 1 1 8 6019 1 1 18 GLY C C 1.712 3.818 3.402 1.00 . A A . 18 GLY C 1 1 8 6020 1 1 18 GLY CA C 0.917 4.605 2.367 1.00 . A A . 18 GLY CA 1 1 8 6021 1 1 18 GLY H H -1.184 4.868 2.281 1.00 . A A . 18 GLY H 1 1 8 6022 1 1 18 GLY HA2 H 0.754 3.958 1.514 1.00 . A A . 18 GLY HA2 1 1 8 6023 1 1 18 GLY HA3 H 1.507 5.451 2.047 1.00 . A A . 18 GLY HA3 1 1 8 6024 1 1 18 GLY N N -0.382 5.090 2.810 1.00 . A A . 18 GLY N 1 1 8 6025 1 1 18 GLY O O 1.879 4.235 4.546 1.00 . A A . 18 GLY O 1 1 8 6026 1 1 19 VAL C C 4.025 1.089 2.761 1.00 . A A . 19 VAL C 1 1 8 6027 1 1 19 VAL CA C 3.136 1.842 3.740 1.00 . A A . 19 VAL CA 1 1 8 6028 1 1 19 VAL CB C 2.418 0.818 4.664 1.00 . A A . 19 VAL CB 1 1 8 6029 1 1 19 VAL CG1 C 3.412 -0.185 5.236 1.00 . A A . 19 VAL CG1 1 1 8 6030 1 1 19 VAL CG2 C 1.688 1.515 5.801 1.00 . A A . 19 VAL CG2 1 1 8 6031 1 1 19 VAL H H 1.956 2.370 2.063 1.00 . A A . 19 VAL H 1 1 8 6032 1 1 19 VAL HA H 3.748 2.497 4.347 1.00 . A A . 19 VAL HA 1 1 8 6033 1 1 19 VAL HB H 1.692 0.278 4.073 1.00 . A A . 19 VAL HB 1 1 8 6034 1 1 19 VAL HG11 H 2.893 -0.877 5.884 1.00 . A A . 19 VAL HG11 1 1 8 6035 1 1 19 VAL HG12 H 3.878 -0.729 4.428 1.00 . A A . 19 VAL HG12 1 1 8 6036 1 1 19 VAL HG13 H 4.170 0.340 5.800 1.00 . A A . 19 VAL HG13 1 1 8 6037 1 1 19 VAL HG21 H 0.961 2.203 5.395 1.00 . A A . 19 VAL HG21 1 1 8 6038 1 1 19 VAL HG22 H 1.184 0.779 6.409 1.00 . A A . 19 VAL HG22 1 1 8 6039 1 1 19 VAL HG23 H 2.399 2.057 6.406 1.00 . A A . 19 VAL HG23 1 1 8 6040 1 1 19 VAL N N 2.208 2.670 2.963 1.00 . A A . 19 VAL N 1 1 8 6041 1 1 19 VAL O O 3.530 0.285 1.983 1.00 . A A . 19 VAL O 1 1 8 6042 1 1 20 CYS C C 7.091 -0.290 2.272 1.00 . A A . 20 CYS C 1 1 8 6043 1 1 20 CYS CA C 6.209 0.837 1.758 1.00 . A A . 20 CYS CA 1 1 8 6044 1 1 20 CYS CB C 7.081 1.971 1.227 1.00 . A A . 20 CYS CB 1 1 8 6045 1 1 20 CYS H H 5.697 1.839 3.549 1.00 . A A . 20 CYS H 1 1 8 6046 1 1 20 CYS HA H 5.595 0.461 0.953 1.00 . A A . 20 CYS HA 1 1 8 6047 1 1 20 CYS HB2 H 6.447 2.762 0.856 1.00 . A A . 20 CYS HB2 1 1 8 6048 1 1 20 CYS HB3 H 7.694 2.352 2.032 1.00 . A A . 20 CYS HB3 1 1 8 6049 1 1 20 CYS N N 5.321 1.336 2.799 1.00 . A A . 20 CYS N 1 1 8 6050 1 1 20 CYS O O 7.990 -0.062 3.084 1.00 . A A . 20 CYS O 1 1 8 6051 1 1 20 CYS SG S 8.192 1.472 -0.126 1.00 . A A . 20 CYS SG 1 1 8 6052 1 1 21 MET C C 7.363 -3.874 1.300 1.00 . A A . 21 MET C 1 1 8 6053 1 1 21 MET CA C 7.622 -2.663 2.204 1.00 . A A . 21 MET CA 1 1 8 6054 1 1 21 MET CB C 7.305 -3.034 3.661 1.00 . A A . 21 MET CB 1 1 8 6055 1 1 21 MET CE C 6.200 -2.647 6.557 1.00 . A A . 21 MET CE 1 1 8 6056 1 1 21 MET CG C 5.843 -3.382 3.913 1.00 . A A . 21 MET CG 1 1 8 6057 1 1 21 MET H H 6.073 -1.635 1.183 1.00 . A A . 21 MET H 1 1 8 6058 1 1 21 MET HA H 8.663 -2.390 2.132 1.00 . A A . 21 MET HA 1 1 8 6059 1 1 21 MET HB2 H 7.905 -3.877 3.940 1.00 . A A . 21 MET HB2 1 1 8 6060 1 1 21 MET HB3 H 7.563 -2.197 4.292 1.00 . A A . 21 MET HB3 1 1 8 6061 1 1 21 MET HE1 H 6.131 -2.894 7.608 1.00 . A A . 21 MET HE1 1 1 8 6062 1 1 21 MET HE2 H 7.233 -2.484 6.294 1.00 . A A . 21 MET HE2 1 1 8 6063 1 1 21 MET HE3 H 5.631 -1.752 6.358 1.00 . A A . 21 MET HE3 1 1 8 6064 1 1 21 MET HG2 H 5.245 -2.496 3.761 1.00 . A A . 21 MET HG2 1 1 8 6065 1 1 21 MET HG3 H 5.543 -4.142 3.206 1.00 . A A . 21 MET HG3 1 1 8 6066 1 1 21 MET N N 6.827 -1.508 1.804 1.00 . A A . 21 MET N 1 1 8 6067 1 1 21 MET O O 6.209 -4.241 1.073 1.00 . A A . 21 MET O 1 1 8 6068 1 1 21 MET SD S 5.544 -3.998 5.583 1.00 . A A . 21 MET SD 1 1 8 6069 1 1 22 TYR C C 9.522 -6.593 0.300 1.00 . A A . 22 TYR C 1 1 8 6070 1 1 22 TYR CA C 8.263 -5.788 0.149 1.00 . A A . 22 TYR CA 1 1 8 6071 1 1 22 TYR CB C 7.856 -5.685 -1.319 1.00 . A A . 22 TYR CB 1 1 8 6072 1 1 22 TYR CD1 C 5.993 -7.370 -0.996 1.00 . A A . 22 TYR CD1 1 1 8 6073 1 1 22 TYR CD2 C 7.198 -7.398 -3.051 1.00 . A A . 22 TYR CD2 1 1 8 6074 1 1 22 TYR CE1 C 5.220 -8.432 -1.433 1.00 . A A . 22 TYR CE1 1 1 8 6075 1 1 22 TYR CE2 C 6.428 -8.453 -3.495 1.00 . A A . 22 TYR CE2 1 1 8 6076 1 1 22 TYR CG C 6.997 -6.837 -1.797 1.00 . A A . 22 TYR CG 1 1 8 6077 1 1 22 TYR CZ C 5.394 -8.940 -2.666 1.00 . A A . 22 TYR CZ 1 1 8 6078 1 1 22 TYR H H 9.295 -4.056 0.725 1.00 . A A . 22 TYR H 1 1 8 6079 1 1 22 TYR HA H 7.511 -6.280 0.679 1.00 . A A . 22 TYR HA 1 1 8 6080 1 1 22 TYR HB2 H 7.302 -4.771 -1.471 1.00 . A A . 22 TYR HB2 1 1 8 6081 1 1 22 TYR HB3 H 8.746 -5.665 -1.921 1.00 . A A . 22 TYR HB3 1 1 8 6082 1 1 22 TYR HD1 H 5.824 -6.947 -0.016 1.00 . A A . 22 TYR HD1 1 1 8 6083 1 1 22 TYR HD2 H 7.971 -6.994 -3.687 1.00 . A A . 22 TYR HD2 1 1 8 6084 1 1 22 TYR HE1 H 4.445 -8.832 -0.796 1.00 . A A . 22 TYR HE1 1 1 8 6085 1 1 22 TYR HE2 H 6.602 -8.873 -4.474 1.00 . A A . 22 TYR HE2 1 1 8 6086 1 1 22 TYR HH H 5.274 -10.680 -3.543 1.00 . A A . 22 TYR HH 1 1 8 6087 1 1 22 TYR N N 8.418 -4.488 0.750 1.00 . A A . 22 TYR N 1 1 8 6088 1 1 22 TYR O O 9.547 -7.621 0.965 1.00 . A A . 22 TYR O 1 1 8 6089 1 1 22 TYR OH O 4.688 -10.032 -3.128 1.00 . A A . 22 TYR OH 1 1 8 6090 1 1 23 ILE C C 12.909 -5.725 -0.083 1.00 . A A . 23 ILE C 1 1 8 6091 1 1 23 ILE CA C 11.856 -6.768 -0.264 1.00 . A A . 23 ILE CA 1 1 8 6092 1 1 23 ILE CB C 12.105 -7.593 -1.531 1.00 . A A . 23 ILE CB 1 1 8 6093 1 1 23 ILE CD1 C 10.892 -9.819 -1.147 1.00 . A A . 23 ILE CD1 1 1 8 6094 1 1 23 ILE CG1 C 10.860 -8.444 -1.786 1.00 . A A . 23 ILE CG1 1 1 8 6095 1 1 23 ILE CG2 C 13.355 -8.452 -1.378 1.00 . A A . 23 ILE CG2 1 1 8 6096 1 1 23 ILE H H 10.460 -5.279 -0.803 1.00 . A A . 23 ILE H 1 1 8 6097 1 1 23 ILE HA H 11.866 -7.411 0.579 1.00 . A A . 23 ILE HA 1 1 8 6098 1 1 23 ILE HB H 12.252 -6.919 -2.359 1.00 . A A . 23 ILE HB 1 1 8 6099 1 1 23 ILE HD11 H 9.975 -10.344 -1.371 1.00 . A A . 23 ILE HD11 1 1 8 6100 1 1 23 ILE HD12 H 11.731 -10.378 -1.533 1.00 . A A . 23 ILE HD12 1 1 8 6101 1 1 23 ILE HD13 H 10.993 -9.714 -0.077 1.00 . A A . 23 ILE HD13 1 1 8 6102 1 1 23 ILE HG12 H 10.014 -7.904 -1.349 1.00 . A A . 23 ILE HG12 1 1 8 6103 1 1 23 ILE HG13 H 10.710 -8.560 -2.852 1.00 . A A . 23 ILE HG13 1 1 8 6104 1 1 23 ILE HG21 H 13.505 -9.034 -2.274 1.00 . A A . 23 ILE HG21 1 1 8 6105 1 1 23 ILE HG22 H 14.210 -7.812 -1.216 1.00 . A A . 23 ILE HG22 1 1 8 6106 1 1 23 ILE HG23 H 13.235 -9.113 -0.532 1.00 . A A . 23 ILE HG23 1 1 8 6107 1 1 23 ILE N N 10.562 -6.111 -0.312 1.00 . A A . 23 ILE N 1 1 8 6108 1 1 23 ILE O O 13.900 -5.933 0.605 1.00 . A A . 23 ILE O 1 1 8 6109 1 1 24 GLU C C 14.767 -3.242 -0.701 1.00 . A A . 24 GLU C 1 1 8 6110 1 1 24 GLU CA C 13.255 -3.320 -0.421 1.00 . A A . 24 GLU CA 1 1 8 6111 1 1 24 GLU CB C 12.909 -3.030 1.015 1.00 . A A . 24 GLU CB 1 1 8 6112 1 1 24 GLU CD C 11.135 -2.264 2.619 1.00 . A A . 24 GLU CD 1 1 8 6113 1 1 24 GLU CG C 11.448 -2.671 1.205 1.00 . A A . 24 GLU CG 1 1 8 6114 1 1 24 GLU H H 11.944 -4.636 -1.381 1.00 . A A . 24 GLU H 1 1 8 6115 1 1 24 GLU HA H 12.765 -2.581 -1.035 1.00 . A A . 24 GLU HA 1 1 8 6116 1 1 24 GLU HB2 H 13.087 -3.939 1.565 1.00 . A A . 24 GLU HB2 1 1 8 6117 1 1 24 GLU HB3 H 13.529 -2.232 1.396 1.00 . A A . 24 GLU HB3 1 1 8 6118 1 1 24 GLU HG2 H 11.196 -1.856 0.544 1.00 . A A . 24 GLU HG2 1 1 8 6119 1 1 24 GLU HG3 H 10.837 -3.543 0.959 1.00 . A A . 24 GLU HG3 1 1 8 6120 1 1 24 GLU N N 12.637 -4.604 -0.721 1.00 . A A . 24 GLU N 1 1 8 6121 1 1 24 GLU O O 15.239 -2.255 -1.257 1.00 . A A . 24 GLU O 1 1 8 6122 1 1 24 GLU OE1 O 11.700 -1.261 3.069 1.00 . A A . 24 GLU OE1 1 1 8 6123 1 1 24 GLU OE2 O 10.318 -2.943 3.272 1.00 . A A . 24 GLU OE2 1 1 8 6124 1 1 25 ALA C C 17.027 -4.858 -2.124 1.00 . A A . 25 ALA C 1 1 8 6125 1 1 25 ALA CA C 16.925 -4.376 -0.694 1.00 . A A . 25 ALA CA 1 1 8 6126 1 1 25 ALA CB C 17.638 -5.331 0.250 1.00 . A A . 25 ALA CB 1 1 8 6127 1 1 25 ALA H H 15.092 -5.018 0.131 1.00 . A A . 25 ALA H 1 1 8 6128 1 1 25 ALA HA H 17.370 -3.395 -0.609 1.00 . A A . 25 ALA HA 1 1 8 6129 1 1 25 ALA HB1 H 17.178 -6.307 0.192 1.00 . A A . 25 ALA HB1 1 1 8 6130 1 1 25 ALA HB2 H 18.678 -5.406 -0.032 1.00 . A A . 25 ALA HB2 1 1 8 6131 1 1 25 ALA HB3 H 17.567 -4.958 1.262 1.00 . A A . 25 ALA HB3 1 1 8 6132 1 1 25 ALA N N 15.511 -4.280 -0.353 1.00 . A A . 25 ALA N 1 1 8 6133 1 1 25 ALA O O 18.087 -4.865 -2.743 1.00 . A A . 25 ALA O 1 1 8 6134 1 1 26 LEU C C 14.912 -4.550 -4.673 1.00 . A A . 26 LEU C 1 1 8 6135 1 1 26 LEU CA C 15.707 -5.644 -4.009 1.00 . A A . 26 LEU CA 1 1 8 6136 1 1 26 LEU CB C 14.954 -6.962 -4.094 1.00 . A A . 26 LEU CB 1 1 8 6137 1 1 26 LEU CD1 C 14.777 -9.319 -4.913 1.00 . A A . 26 LEU CD1 1 1 8 6138 1 1 26 LEU CD2 C 15.777 -7.569 -6.388 1.00 . A A . 26 LEU CD2 1 1 8 6139 1 1 26 LEU CG C 15.602 -8.042 -4.954 1.00 . A A . 26 LEU CG 1 1 8 6140 1 1 26 LEU H H 15.092 -5.263 -2.045 1.00 . A A . 26 LEU H 1 1 8 6141 1 1 26 LEU HA H 16.669 -5.729 -4.471 1.00 . A A . 26 LEU HA 1 1 8 6142 1 1 26 LEU HB2 H 14.842 -7.348 -3.091 1.00 . A A . 26 LEU HB2 1 1 8 6143 1 1 26 LEU HB3 H 13.973 -6.753 -4.487 1.00 . A A . 26 LEU HB3 1 1 8 6144 1 1 26 LEU HD11 H 13.778 -9.114 -5.271 1.00 . A A . 26 LEU HD11 1 1 8 6145 1 1 26 LEU HD12 H 15.237 -10.067 -5.542 1.00 . A A . 26 LEU HD12 1 1 8 6146 1 1 26 LEU HD13 H 14.727 -9.683 -3.898 1.00 . A A . 26 LEU HD13 1 1 8 6147 1 1 26 LEU HD21 H 14.814 -7.317 -6.808 1.00 . A A . 26 LEU HD21 1 1 8 6148 1 1 26 LEU HD22 H 16.417 -6.698 -6.404 1.00 . A A . 26 LEU HD22 1 1 8 6149 1 1 26 LEU HD23 H 16.229 -8.358 -6.973 1.00 . A A . 26 LEU HD23 1 1 8 6150 1 1 26 LEU HG H 16.578 -8.266 -4.551 1.00 . A A . 26 LEU HG 1 1 8 6151 1 1 26 LEU N N 15.874 -5.259 -2.628 1.00 . A A . 26 LEU N 1 1 8 6152 1 1 26 LEU O O 14.435 -4.679 -5.796 1.00 . A A . 26 LEU O 1 1 8 6153 1 1 27 ASP C C 12.618 -2.663 -4.741 1.00 . A A . 27 ASP C 1 1 8 6154 1 1 27 ASP CA C 14.001 -2.302 -4.243 1.00 . A A . 27 ASP CA 1 1 8 6155 1 1 27 ASP CB C 14.800 -1.399 -5.188 1.00 . A A . 27 ASP CB 1 1 8 6156 1 1 27 ASP CG C 15.025 -1.934 -6.594 1.00 . A A . 27 ASP CG 1 1 8 6157 1 1 27 ASP H H 15.145 -3.537 -2.993 1.00 . A A . 27 ASP H 1 1 8 6158 1 1 27 ASP HA H 13.861 -1.756 -3.318 1.00 . A A . 27 ASP HA 1 1 8 6159 1 1 27 ASP HB2 H 14.302 -0.446 -5.267 1.00 . A A . 27 ASP HB2 1 1 8 6160 1 1 27 ASP HB3 H 15.769 -1.253 -4.727 1.00 . A A . 27 ASP HB3 1 1 8 6161 1 1 27 ASP N N 14.745 -3.497 -3.884 1.00 . A A . 27 ASP N 1 1 8 6162 1 1 27 ASP O O 12.064 -2.069 -5.664 1.00 . A A . 27 ASP O 1 1 8 6163 1 1 27 ASP OD1 O 16.044 -2.626 -6.826 1.00 . A A . 27 ASP OD1 1 1 8 6164 1 1 27 ASP OD2 O 14.154 -1.714 -7.463 1.00 . A A . 27 ASP OD2 1 1 8 6165 1 1 28 LYS C C 9.860 -3.426 -3.117 1.00 . A A . 28 LYS C 1 1 8 6166 1 1 28 LYS CA C 10.678 -4.039 -4.222 1.00 . A A . 28 LYS CA 1 1 8 6167 1 1 28 LYS CB C 10.523 -5.546 -4.100 1.00 . A A . 28 LYS CB 1 1 8 6168 1 1 28 LYS CD C 11.440 -6.203 -6.349 1.00 . A A . 28 LYS CD 1 1 8 6169 1 1 28 LYS CE C 10.048 -6.607 -6.823 1.00 . A A . 28 LYS CE 1 1 8 6170 1 1 28 LYS CG C 11.582 -6.346 -4.840 1.00 . A A . 28 LYS CG 1 1 8 6171 1 1 28 LYS H H 12.619 -4.127 -3.403 1.00 . A A . 28 LYS H 1 1 8 6172 1 1 28 LYS HA H 10.327 -3.700 -5.184 1.00 . A A . 28 LYS HA 1 1 8 6173 1 1 28 LYS HB2 H 10.553 -5.802 -3.045 1.00 . A A . 28 LYS HB2 1 1 8 6174 1 1 28 LYS HB3 H 9.555 -5.823 -4.495 1.00 . A A . 28 LYS HB3 1 1 8 6175 1 1 28 LYS HD2 H 11.616 -5.174 -6.621 1.00 . A A . 28 LYS HD2 1 1 8 6176 1 1 28 LYS HD3 H 12.173 -6.835 -6.831 1.00 . A A . 28 LYS HD3 1 1 8 6177 1 1 28 LYS HE2 H 9.839 -7.607 -6.472 1.00 . A A . 28 LYS HE2 1 1 8 6178 1 1 28 LYS HE3 H 9.326 -5.922 -6.401 1.00 . A A . 28 LYS HE3 1 1 8 6179 1 1 28 LYS HG2 H 12.562 -5.983 -4.540 1.00 . A A . 28 LYS HG2 1 1 8 6180 1 1 28 LYS HG3 H 11.486 -7.388 -4.573 1.00 . A A . 28 LYS HG3 1 1 8 6181 1 1 28 LYS HZ1 H 10.504 -7.350 -8.718 1.00 . A A . 28 LYS HZ1 1 1 8 6182 1 1 28 LYS HZ2 H 10.268 -5.675 -8.682 1.00 . A A . 28 LYS HZ2 1 1 8 6183 1 1 28 LYS HZ3 H 8.933 -6.722 -8.589 1.00 . A A . 28 LYS HZ3 1 1 8 6184 1 1 28 LYS N N 12.060 -3.640 -4.044 1.00 . A A . 28 LYS N 1 1 8 6185 1 1 28 LYS NZ N 9.929 -6.586 -8.303 1.00 . A A . 28 LYS NZ 1 1 8 6186 1 1 28 LYS O O 10.290 -3.412 -1.959 1.00 . A A . 28 LYS O 1 1 8 6187 1 1 29 TYR C C 6.369 -2.595 -2.757 1.00 . A A . 29 TYR C 1 1 8 6188 1 1 29 TYR CA C 7.836 -2.307 -2.493 1.00 . A A . 29 TYR CA 1 1 8 6189 1 1 29 TYR CB C 8.097 -0.795 -2.479 1.00 . A A . 29 TYR CB 1 1 8 6190 1 1 29 TYR CD1 C 8.935 -0.086 -4.757 1.00 . A A . 29 TYR CD1 1 1 8 6191 1 1 29 TYR CD2 C 6.739 0.581 -4.106 1.00 . A A . 29 TYR CD2 1 1 8 6192 1 1 29 TYR CE1 C 8.780 0.569 -5.962 1.00 . A A . 29 TYR CE1 1 1 8 6193 1 1 29 TYR CE2 C 6.577 1.239 -5.307 1.00 . A A . 29 TYR CE2 1 1 8 6194 1 1 29 TYR CG C 7.920 -0.093 -3.809 1.00 . A A . 29 TYR CG 1 1 8 6195 1 1 29 TYR CZ C 7.599 1.229 -6.232 1.00 . A A . 29 TYR CZ 1 1 8 6196 1 1 29 TYR H H 8.351 -3.119 -4.366 1.00 . A A . 29 TYR H 1 1 8 6197 1 1 29 TYR HA H 8.085 -2.705 -1.520 1.00 . A A . 29 TYR HA 1 1 8 6198 1 1 29 TYR HB2 H 7.415 -0.333 -1.780 1.00 . A A . 29 TYR HB2 1 1 8 6199 1 1 29 TYR HB3 H 9.110 -0.620 -2.148 1.00 . A A . 29 TYR HB3 1 1 8 6200 1 1 29 TYR HD1 H 9.857 -0.605 -4.542 1.00 . A A . 29 TYR HD1 1 1 8 6201 1 1 29 TYR HD2 H 5.940 0.584 -3.380 1.00 . A A . 29 TYR HD2 1 1 8 6202 1 1 29 TYR HE1 H 9.579 0.563 -6.687 1.00 . A A . 29 TYR HE1 1 1 8 6203 1 1 29 TYR HE2 H 5.654 1.756 -5.519 1.00 . A A . 29 TYR HE2 1 1 8 6204 1 1 29 TYR HH H 7.835 1.374 -8.137 1.00 . A A . 29 TYR HH 1 1 8 6205 1 1 29 TYR N N 8.679 -2.973 -3.454 1.00 . A A . 29 TYR N 1 1 8 6206 1 1 29 TYR O O 5.856 -2.362 -3.850 1.00 . A A . 29 TYR O 1 1 8 6207 1 1 29 TYR OH O 7.441 1.894 -7.425 1.00 . A A . 29 TYR OH 1 1 8 6208 1 1 30 ALA C C 3.769 -2.200 -0.798 1.00 . A A . 30 ALA C 1 1 8 6209 1 1 30 ALA CA C 4.282 -3.254 -1.748 1.00 . A A . 30 ALA CA 1 1 8 6210 1 1 30 ALA CB C 3.824 -4.642 -1.323 1.00 . A A . 30 ALA CB 1 1 8 6211 1 1 30 ALA H H 6.223 -3.501 -0.991 1.00 . A A . 30 ALA H 1 1 8 6212 1 1 30 ALA HA H 3.914 -3.051 -2.744 1.00 . A A . 30 ALA HA 1 1 8 6213 1 1 30 ALA HB1 H 4.193 -4.855 -0.330 1.00 . A A . 30 ALA HB1 1 1 8 6214 1 1 30 ALA HB2 H 2.745 -4.679 -1.321 1.00 . A A . 30 ALA HB2 1 1 8 6215 1 1 30 ALA HB3 H 4.208 -5.377 -2.016 1.00 . A A . 30 ALA HB3 1 1 8 6216 1 1 30 ALA N N 5.719 -3.154 -1.756 1.00 . A A . 30 ALA N 1 1 8 6217 1 1 30 ALA O O 4.320 -2.029 0.292 1.00 . A A . 30 ALA O 1 1 8 6218 1 1 31 CYS C C 0.919 -0.645 0.111 1.00 . A A . 31 CYS C 1 1 8 6219 1 1 31 CYS CA C 2.288 -0.362 -0.427 1.00 . A A . 31 CYS CA 1 1 8 6220 1 1 31 CYS CB C 2.279 0.922 -1.245 1.00 . A A . 31 CYS CB 1 1 8 6221 1 1 31 CYS H H 2.265 -1.740 -2.006 1.00 . A A . 31 CYS H 1 1 8 6222 1 1 31 CYS HA H 2.963 -0.241 0.404 1.00 . A A . 31 CYS HA 1 1 8 6223 1 1 31 CYS HB2 H 3.294 1.187 -1.503 1.00 . A A . 31 CYS HB2 1 1 8 6224 1 1 31 CYS HB3 H 1.710 0.763 -2.149 1.00 . A A . 31 CYS HB3 1 1 8 6225 1 1 31 CYS N N 2.748 -1.484 -1.203 1.00 . A A . 31 CYS N 1 1 8 6226 1 1 31 CYS O O 0.029 -1.087 -0.613 1.00 . A A . 31 CYS O 1 1 8 6227 1 1 31 CYS SG S 1.540 2.337 -0.363 1.00 . A A . 31 CYS SG 1 1 8 6228 1 1 32 ASN C C -1.079 0.616 2.537 1.00 . A A . 32 ASN C 1 1 8 6229 1 1 32 ASN CA C -0.482 -0.674 2.045 1.00 . A A . 32 ASN CA 1 1 8 6230 1 1 32 ASN CB C -0.221 -1.649 3.179 1.00 . A A . 32 ASN CB 1 1 8 6231 1 1 32 ASN CG C -1.491 -2.253 3.742 1.00 . A A . 32 ASN CG 1 1 8 6232 1 1 32 ASN H H 1.494 0.008 1.891 1.00 . A A . 32 ASN H 1 1 8 6233 1 1 32 ASN HA H -1.156 -1.119 1.332 1.00 . A A . 32 ASN HA 1 1 8 6234 1 1 32 ASN HB2 H 0.406 -2.443 2.799 1.00 . A A . 32 ASN HB2 1 1 8 6235 1 1 32 ASN HB3 H 0.298 -1.136 3.974 1.00 . A A . 32 ASN HB3 1 1 8 6236 1 1 32 ASN HD21 H -1.389 -3.738 2.430 1.00 . A A . 32 ASN HD21 1 1 8 6237 1 1 32 ASN HD22 H -2.729 -3.792 3.529 1.00 . A A . 32 ASN HD22 1 1 8 6238 1 1 32 ASN N N 0.757 -0.394 1.385 1.00 . A A . 32 ASN N 1 1 8 6239 1 1 32 ASN ND2 N -1.914 -3.369 3.177 1.00 . A A . 32 ASN ND2 1 1 8 6240 1 1 32 ASN O O -0.672 1.169 3.556 1.00 . A A . 32 ASN O 1 1 8 6241 1 1 32 ASN OD1 O -2.085 -1.720 4.678 1.00 . A A . 32 ASN OD1 1 1 8 6242 1 1 33 CYS C C -3.742 2.316 3.041 1.00 . A A . 33 CYS C 1 1 8 6243 1 1 33 CYS CA C -2.618 2.376 2.006 1.00 . A A . 33 CYS CA 1 1 8 6244 1 1 33 CYS CB C -3.079 2.870 0.648 1.00 . A A . 33 CYS CB 1 1 8 6245 1 1 33 CYS H H -2.345 0.585 1.012 1.00 . A A . 33 CYS H 1 1 8 6246 1 1 33 CYS HA H -1.844 3.026 2.372 1.00 . A A . 33 CYS HA 1 1 8 6247 1 1 33 CYS HB2 H -2.252 2.777 -0.041 1.00 . A A . 33 CYS HB2 1 1 8 6248 1 1 33 CYS HB3 H -3.882 2.238 0.302 1.00 . A A . 33 CYS HB3 1 1 8 6249 1 1 33 CYS N N -2.042 1.093 1.783 1.00 . A A . 33 CYS N 1 1 8 6250 1 1 33 CYS O O -3.476 2.198 4.233 1.00 . A A . 33 CYS O 1 1 8 6251 1 1 33 CYS SG S -3.640 4.586 0.560 1.00 . A A . 33 CYS SG 1 1 8 6252 1 1 34 VAL C C -7.181 1.468 3.107 1.00 . A A . 34 VAL C 1 1 8 6253 1 1 34 VAL CA C -6.094 2.427 3.538 1.00 . A A . 34 VAL CA 1 1 8 6254 1 1 34 VAL CB C -6.639 3.873 3.602 1.00 . A A . 34 VAL CB 1 1 8 6255 1 1 34 VAL CG1 C -7.357 4.247 2.313 1.00 . A A . 34 VAL CG1 1 1 8 6256 1 1 34 VAL CG2 C -7.550 4.066 4.807 1.00 . A A . 34 VAL CG2 1 1 8 6257 1 1 34 VAL H H -5.178 2.245 1.649 1.00 . A A . 34 VAL H 1 1 8 6258 1 1 34 VAL HA H -5.739 2.146 4.519 1.00 . A A . 34 VAL HA 1 1 8 6259 1 1 34 VAL HB H -5.794 4.538 3.710 1.00 . A A . 34 VAL HB 1 1 8 6260 1 1 34 VAL HG11 H -7.706 5.268 2.376 1.00 . A A . 34 VAL HG11 1 1 8 6261 1 1 34 VAL HG12 H -6.677 4.149 1.480 1.00 . A A . 34 VAL HG12 1 1 8 6262 1 1 34 VAL HG13 H -8.202 3.587 2.166 1.00 . A A . 34 VAL HG13 1 1 8 6263 1 1 34 VAL HG21 H -6.995 3.876 5.714 1.00 . A A . 34 VAL HG21 1 1 8 6264 1 1 34 VAL HG22 H -7.922 5.081 4.820 1.00 . A A . 34 VAL HG22 1 1 8 6265 1 1 34 VAL HG23 H -8.382 3.380 4.743 1.00 . A A . 34 VAL HG23 1 1 8 6266 1 1 34 VAL N N -4.988 2.331 2.607 1.00 . A A . 34 VAL N 1 1 8 6267 1 1 34 VAL O O -7.229 1.069 1.938 1.00 . A A . 34 VAL O 1 1 8 6268 1 1 35 VAL C C -10.168 0.841 2.889 1.00 . A A . 35 VAL C 1 1 8 6269 1 1 35 VAL CA C -9.096 0.138 3.727 1.00 . A A . 35 VAL CA 1 1 8 6270 1 1 35 VAL CB C -9.693 -0.524 4.994 1.00 . A A . 35 VAL CB 1 1 8 6271 1 1 35 VAL CG1 C -8.608 -1.267 5.763 1.00 . A A . 35 VAL CG1 1 1 8 6272 1 1 35 VAL CG2 C -10.365 0.486 5.916 1.00 . A A . 35 VAL CG2 1 1 8 6273 1 1 35 VAL H H -7.927 1.391 4.959 1.00 . A A . 35 VAL H 1 1 8 6274 1 1 35 VAL HA H -8.665 -0.646 3.120 1.00 . A A . 35 VAL HA 1 1 8 6275 1 1 35 VAL HB H -10.431 -1.254 4.668 1.00 . A A . 35 VAL HB 1 1 8 6276 1 1 35 VAL HG11 H -9.043 -1.735 6.632 1.00 . A A . 35 VAL HG11 1 1 8 6277 1 1 35 VAL HG12 H -8.170 -2.022 5.127 1.00 . A A . 35 VAL HG12 1 1 8 6278 1 1 35 VAL HG13 H -7.844 -0.570 6.073 1.00 . A A . 35 VAL HG13 1 1 8 6279 1 1 35 VAL HG21 H -9.636 1.210 6.246 1.00 . A A . 35 VAL HG21 1 1 8 6280 1 1 35 VAL HG22 H -11.155 0.989 5.381 1.00 . A A . 35 VAL HG22 1 1 8 6281 1 1 35 VAL HG23 H -10.778 -0.027 6.771 1.00 . A A . 35 VAL HG23 1 1 8 6282 1 1 35 VAL N N -8.027 1.060 4.042 1.00 . A A . 35 VAL N 1 1 8 6283 1 1 35 VAL O O -11.204 1.285 3.380 1.00 . A A . 35 VAL O 1 1 8 6284 1 1 36 GLY C C -9.992 2.130 -0.504 1.00 . A A . 36 GLY C 1 1 8 6285 1 1 36 GLY CA C -10.749 1.654 0.703 1.00 . A A . 36 GLY CA 1 1 8 6286 1 1 36 GLY H H -9.012 0.605 1.280 1.00 . A A . 36 GLY H 1 1 8 6287 1 1 36 GLY HA2 H -11.533 0.981 0.390 1.00 . A A . 36 GLY HA2 1 1 8 6288 1 1 36 GLY HA3 H -11.186 2.505 1.203 1.00 . A A . 36 GLY HA3 1 1 8 6289 1 1 36 GLY N N -9.868 0.966 1.613 1.00 . A A . 36 GLY N 1 1 8 6290 1 1 36 GLY O O -10.573 2.417 -1.551 1.00 . A A . 36 GLY O 1 1 8 6291 1 1 37 TYR C C -6.553 1.754 -1.482 1.00 . A A . 37 TYR C 1 1 8 6292 1 1 37 TYR CA C -7.818 2.591 -1.464 1.00 . A A . 37 TYR CA 1 1 8 6293 1 1 37 TYR CB C -7.437 4.072 -1.371 1.00 . A A . 37 TYR CB 1 1 8 6294 1 1 37 TYR CD1 C -9.197 5.276 -2.722 1.00 . A A . 37 TYR CD1 1 1 8 6295 1 1 37 TYR CD2 C -9.111 5.676 -0.376 1.00 . A A . 37 TYR CD2 1 1 8 6296 1 1 37 TYR CE1 C -10.261 6.148 -2.836 1.00 . A A . 37 TYR CE1 1 1 8 6297 1 1 37 TYR CE2 C -10.176 6.548 -0.482 1.00 . A A . 37 TYR CE2 1 1 8 6298 1 1 37 TYR CG C -8.603 5.026 -1.491 1.00 . A A . 37 TYR CG 1 1 8 6299 1 1 37 TYR CZ C -10.745 6.784 -1.711 1.00 . A A . 37 TYR CZ 1 1 8 6300 1 1 37 TYR H H -8.266 1.981 0.509 1.00 . A A . 37 TYR H 1 1 8 6301 1 1 37 TYR HA H -8.364 2.422 -2.380 1.00 . A A . 37 TYR HA 1 1 8 6302 1 1 37 TYR HB2 H -6.963 4.251 -0.419 1.00 . A A . 37 TYR HB2 1 1 8 6303 1 1 37 TYR HB3 H -6.736 4.300 -2.162 1.00 . A A . 37 TYR HB3 1 1 8 6304 1 1 37 TYR HD1 H -8.811 4.777 -3.602 1.00 . A A . 37 TYR HD1 1 1 8 6305 1 1 37 TYR HD2 H -8.662 5.493 0.589 1.00 . A A . 37 TYR HD2 1 1 8 6306 1 1 37 TYR HE1 H -10.710 6.325 -3.802 1.00 . A A . 37 TYR HE1 1 1 8 6307 1 1 37 TYR HE2 H -10.555 7.045 0.398 1.00 . A A . 37 TYR HE2 1 1 8 6308 1 1 37 TYR HH H -11.654 8.404 -1.240 1.00 . A A . 37 TYR HH 1 1 8 6309 1 1 37 TYR N N -8.674 2.202 -0.360 1.00 . A A . 37 TYR N 1 1 8 6310 1 1 37 TYR O O -5.649 1.956 -0.671 1.00 . A A . 37 TYR O 1 1 8 6311 1 1 37 TYR OH O -11.807 7.649 -1.818 1.00 . A A . 37 TYR OH 1 1 8 6312 1 1 38 ILE C C -5.265 -0.369 -4.128 1.00 . A A . 38 ILE C 1 1 8 6313 1 1 38 ILE CA C -5.247 0.131 -2.693 1.00 . A A . 38 ILE CA 1 1 8 6314 1 1 38 ILE CB C -4.902 -1.006 -1.696 1.00 . A A . 38 ILE CB 1 1 8 6315 1 1 38 ILE CD1 C -2.865 -2.107 -0.609 1.00 . A A . 38 ILE CD1 1 1 8 6316 1 1 38 ILE CG1 C -3.409 -0.931 -1.389 1.00 . A A . 38 ILE CG1 1 1 8 6317 1 1 38 ILE CG2 C -5.289 -2.387 -2.218 1.00 . A A . 38 ILE CG2 1 1 8 6318 1 1 38 ILE H H -7.320 0.502 -2.839 1.00 . A A . 38 ILE H 1 1 8 6319 1 1 38 ILE HA H -4.469 0.881 -2.616 1.00 . A A . 38 ILE HA 1 1 8 6320 1 1 38 ILE HB H -5.452 -0.832 -0.786 1.00 . A A . 38 ILE HB 1 1 8 6321 1 1 38 ILE HD11 H -1.803 -1.978 -0.455 1.00 . A A . 38 ILE HD11 1 1 8 6322 1 1 38 ILE HD12 H -3.362 -2.166 0.348 1.00 . A A . 38 ILE HD12 1 1 8 6323 1 1 38 ILE HD13 H -3.039 -3.018 -1.162 1.00 . A A . 38 ILE HD13 1 1 8 6324 1 1 38 ILE HG12 H -2.861 -0.866 -2.315 1.00 . A A . 38 ILE HG12 1 1 8 6325 1 1 38 ILE HG13 H -3.231 -0.036 -0.807 1.00 . A A . 38 ILE HG13 1 1 8 6326 1 1 38 ILE HG21 H -5.046 -3.133 -1.477 1.00 . A A . 38 ILE HG21 1 1 8 6327 1 1 38 ILE HG22 H -6.350 -2.412 -2.420 1.00 . A A . 38 ILE HG22 1 1 8 6328 1 1 38 ILE HG23 H -4.746 -2.593 -3.128 1.00 . A A . 38 ILE HG23 1 1 8 6329 1 1 38 ILE N N -6.497 0.793 -2.387 1.00 . A A . 38 ILE N 1 1 8 6330 1 1 38 ILE O O -6.184 -1.030 -4.548 1.00 . A A . 38 ILE O 1 1 8 6331 1 1 39 GLY C C -2.834 -0.081 -6.802 1.00 . A A . 39 GLY C 1 1 8 6332 1 1 39 GLY CA C -4.210 -0.348 -6.285 1.00 . A A . 39 GLY CA 1 1 8 6333 1 1 39 GLY H H -3.568 0.580 -4.502 1.00 . A A . 39 GLY H 1 1 8 6334 1 1 39 GLY HA2 H -4.437 -1.398 -6.386 1.00 . A A . 39 GLY HA2 1 1 8 6335 1 1 39 GLY HA3 H -4.922 0.234 -6.850 1.00 . A A . 39 GLY HA3 1 1 8 6336 1 1 39 GLY N N -4.278 0.028 -4.888 1.00 . A A . 39 GLY N 1 1 8 6337 1 1 39 GLY O O -2.450 1.085 -6.927 1.00 . A A . 39 GLY O 1 1 8 6338 1 1 40 GLU C C 0.049 -0.726 -5.961 1.00 . A A . 40 GLU C 1 1 8 6339 1 1 40 GLU CA C -0.636 -1.069 -7.264 1.00 . A A . 40 GLU CA 1 1 8 6340 1 1 40 GLU CB C -0.298 -0.025 -8.336 1.00 . A A . 40 GLU CB 1 1 8 6341 1 1 40 GLU CD C 1.498 1.413 -9.379 1.00 . A A . 40 GLU CD 1 1 8 6342 1 1 40 GLU CG C 1.193 0.230 -8.486 1.00 . A A . 40 GLU CG 1 1 8 6343 1 1 40 GLU H H -2.478 -2.037 -6.960 1.00 . A A . 40 GLU H 1 1 8 6344 1 1 40 GLU HA H -0.303 -2.036 -7.585 1.00 . A A . 40 GLU HA 1 1 8 6345 1 1 40 GLU HB2 H -0.682 -0.362 -9.287 1.00 . A A . 40 GLU HB2 1 1 8 6346 1 1 40 GLU HB3 H -0.778 0.910 -8.072 1.00 . A A . 40 GLU HB3 1 1 8 6347 1 1 40 GLU HG2 H 1.613 0.423 -7.506 1.00 . A A . 40 GLU HG2 1 1 8 6348 1 1 40 GLU HG3 H 1.657 -0.651 -8.908 1.00 . A A . 40 GLU HG3 1 1 8 6349 1 1 40 GLU N N -2.069 -1.150 -7.010 1.00 . A A . 40 GLU N 1 1 8 6350 1 1 40 GLU O O 0.994 -1.384 -5.526 1.00 . A A . 40 GLU O 1 1 8 6351 1 1 40 GLU OE1 O 1.631 1.216 -10.604 1.00 . A A . 40 GLU OE1 1 1 8 6352 1 1 40 GLU OE2 O 1.596 2.548 -8.862 1.00 . A A . 40 GLU OE2 1 1 8 6353 1 1 41 ARG C C -1.086 1.440 -3.231 1.00 . A A . 41 ARG C 1 1 8 6354 1 1 41 ARG CA C 0.006 0.759 -4.061 1.00 . A A . 41 ARG CA 1 1 8 6355 1 1 41 ARG CB C 1.227 1.654 -4.263 1.00 . A A . 41 ARG CB 1 1 8 6356 1 1 41 ARG CD C 0.236 3.578 -5.617 1.00 . A A . 41 ARG CD 1 1 8 6357 1 1 41 ARG CG C 1.238 2.437 -5.572 1.00 . A A . 41 ARG CG 1 1 8 6358 1 1 41 ARG CZ C -0.506 5.260 -7.283 1.00 . A A . 41 ARG CZ 1 1 8 6359 1 1 41 ARG H H -1.170 0.805 -5.802 1.00 . A A . 41 ARG H 1 1 8 6360 1 1 41 ARG HA H 0.316 -0.119 -3.525 1.00 . A A . 41 ARG HA 1 1 8 6361 1 1 41 ARG HB2 H 1.293 2.351 -3.443 1.00 . A A . 41 ARG HB2 1 1 8 6362 1 1 41 ARG HB3 H 2.097 1.014 -4.259 1.00 . A A . 41 ARG HB3 1 1 8 6363 1 1 41 ARG HD2 H -0.752 3.194 -5.406 1.00 . A A . 41 ARG HD2 1 1 8 6364 1 1 41 ARG HD3 H 0.508 4.314 -4.877 1.00 . A A . 41 ARG HD3 1 1 8 6365 1 1 41 ARG HE H 0.854 3.825 -7.614 1.00 . A A . 41 ARG HE 1 1 8 6366 1 1 41 ARG HG2 H 2.225 2.843 -5.723 1.00 . A A . 41 ARG HG2 1 1 8 6367 1 1 41 ARG HG3 H 1.009 1.750 -6.373 1.00 . A A . 41 ARG HG3 1 1 8 6368 1 1 41 ARG HH11 H -1.512 5.375 -5.528 1.00 . A A . 41 ARG HH11 1 1 8 6369 1 1 41 ARG HH12 H -1.944 6.566 -6.705 1.00 . A A . 41 ARG HH12 1 1 8 6370 1 1 41 ARG HH21 H 0.292 5.401 -9.141 1.00 . A A . 41 ARG HH21 1 1 8 6371 1 1 41 ARG HH22 H -0.929 6.586 -8.760 1.00 . A A . 41 ARG HH22 1 1 8 6372 1 1 41 ARG N N -0.465 0.312 -5.347 1.00 . A A . 41 ARG N 1 1 8 6373 1 1 41 ARG NE N 0.238 4.207 -6.937 1.00 . A A . 41 ARG NE 1 1 8 6374 1 1 41 ARG NH1 N -1.391 5.773 -6.433 1.00 . A A . 41 ARG NH1 1 1 8 6375 1 1 41 ARG NH2 N -0.371 5.789 -8.489 1.00 . A A . 41 ARG NH2 1 1 8 6376 1 1 41 ARG O O -1.025 1.413 -2.005 1.00 . A A . 41 ARG O 1 1 8 6377 1 1 42 CYS C C -4.064 3.468 -4.134 1.00 . A A . 42 CYS C 1 1 8 6378 1 1 42 CYS CA C -3.177 2.704 -3.177 1.00 . A A . 42 CYS CA 1 1 8 6379 1 1 42 CYS CB C -2.618 3.718 -2.164 1.00 . A A . 42 CYS CB 1 1 8 6380 1 1 42 CYS H H -2.143 1.952 -4.859 1.00 . A A . 42 CYS H 1 1 8 6381 1 1 42 CYS HA H -3.763 1.968 -2.659 1.00 . A A . 42 CYS HA 1 1 8 6382 1 1 42 CYS HB2 H -2.148 3.185 -1.352 1.00 . A A . 42 CYS HB2 1 1 8 6383 1 1 42 CYS HB3 H -1.880 4.335 -2.655 1.00 . A A . 42 CYS HB3 1 1 8 6384 1 1 42 CYS N N -2.103 2.008 -3.886 1.00 . A A . 42 CYS N 1 1 8 6385 1 1 42 CYS O O -3.616 4.490 -4.641 1.00 . A A . 42 CYS O 1 1 8 6386 1 1 42 CYS SG S -3.876 4.831 -1.435 1.00 . A A . 42 CYS SG 1 1 8 6387 1 1 43 GLN C C -7.453 2.902 -5.600 1.00 . A A . 43 GLN C 1 1 8 6388 1 1 43 GLN CA C -6.378 3.762 -4.966 1.00 . A A . 43 GLN CA 1 1 8 6389 1 1 43 GLN CB C -5.898 4.772 -6.009 1.00 . A A . 43 GLN CB 1 1 8 6390 1 1 43 GLN CD C -5.042 5.166 -8.350 1.00 . A A . 43 GLN CD 1 1 8 6391 1 1 43 GLN CG C -5.378 4.139 -7.291 1.00 . A A . 43 GLN CG 1 1 8 6392 1 1 43 GLN H H -5.430 1.964 -4.296 1.00 . A A . 43 GLN H 1 1 8 6393 1 1 43 GLN HA H -6.815 4.302 -4.141 1.00 . A A . 43 GLN HA 1 1 8 6394 1 1 43 GLN HB2 H -6.717 5.429 -6.260 1.00 . A A . 43 GLN HB2 1 1 8 6395 1 1 43 GLN HB3 H -5.100 5.353 -5.565 1.00 . A A . 43 GLN HB3 1 1 8 6396 1 1 43 GLN HE21 H -6.919 5.125 -9.010 1.00 . A A . 43 GLN HE21 1 1 8 6397 1 1 43 GLN HE22 H -5.845 6.201 -9.843 1.00 . A A . 43 GLN HE22 1 1 8 6398 1 1 43 GLN HG2 H -4.485 3.576 -7.064 1.00 . A A . 43 GLN HG2 1 1 8 6399 1 1 43 GLN HG3 H -6.134 3.474 -7.682 1.00 . A A . 43 GLN HG3 1 1 8 6400 1 1 43 GLN N N -5.276 2.942 -4.421 1.00 . A A . 43 GLN N 1 1 8 6401 1 1 43 GLN NE2 N -6.032 5.534 -9.148 1.00 . A A . 43 GLN NE2 1 1 8 6402 1 1 43 GLN O O -8.239 3.387 -6.411 1.00 . A A . 43 GLN O 1 1 8 6403 1 1 43 GLN OE1 O -3.908 5.632 -8.444 1.00 . A A . 43 GLN OE1 1 1 8 6404 1 1 44 TYR C C -9.090 -0.189 -4.973 1.00 . A A . 44 TYR C 1 1 8 6405 1 1 44 TYR CA C -8.403 0.740 -5.931 1.00 . A A . 44 TYR CA 1 1 8 6406 1 1 44 TYR CB C -7.628 -0.026 -7.006 1.00 . A A . 44 TYR CB 1 1 8 6407 1 1 44 TYR CD1 C -8.962 0.389 -9.101 1.00 . A A . 44 TYR CD1 1 1 8 6408 1 1 44 TYR CD2 C -8.743 -1.858 -8.339 1.00 . A A . 44 TYR CD2 1 1 8 6409 1 1 44 TYR CE1 C -9.716 -0.041 -10.174 1.00 . A A . 44 TYR CE1 1 1 8 6410 1 1 44 TYR CE2 C -9.494 -2.297 -9.412 1.00 . A A . 44 TYR CE2 1 1 8 6411 1 1 44 TYR CG C -8.466 -0.509 -8.165 1.00 . A A . 44 TYR CG 1 1 8 6412 1 1 44 TYR CZ C -9.978 -1.385 -10.324 1.00 . A A . 44 TYR CZ 1 1 8 6413 1 1 44 TYR H H -6.979 1.297 -4.486 1.00 . A A . 44 TYR H 1 1 8 6414 1 1 44 TYR HA H -9.168 1.334 -6.398 1.00 . A A . 44 TYR HA 1 1 8 6415 1 1 44 TYR HB2 H -6.859 0.617 -7.406 1.00 . A A . 44 TYR HB2 1 1 8 6416 1 1 44 TYR HB3 H -7.161 -0.889 -6.551 1.00 . A A . 44 TYR HB3 1 1 8 6417 1 1 44 TYR HD1 H -8.754 1.442 -8.980 1.00 . A A . 44 TYR HD1 1 1 8 6418 1 1 44 TYR HD2 H -8.366 -2.570 -7.620 1.00 . A A . 44 TYR HD2 1 1 8 6419 1 1 44 TYR HE1 H -10.096 0.674 -10.890 1.00 . A A . 44 TYR HE1 1 1 8 6420 1 1 44 TYR HE2 H -9.700 -3.351 -9.531 1.00 . A A . 44 TYR HE2 1 1 8 6421 1 1 44 TYR HH H -10.421 -1.366 -12.194 1.00 . A A . 44 TYR HH 1 1 8 6422 1 1 44 TYR N N -7.514 1.634 -5.236 1.00 . A A . 44 TYR N 1 1 8 6423 1 1 44 TYR O O -8.641 -1.304 -4.720 1.00 . A A . 44 TYR O 1 1 8 6424 1 1 44 TYR OH O -10.727 -1.817 -11.395 1.00 . A A . 44 TYR OH 1 1 8 6425 1 1 45 ARG C C -10.697 -0.848 -2.308 1.00 . A A . 45 ARG C 1 1 8 6426 1 1 45 ARG CA C -11.135 -0.524 -3.722 1.00 . A A . 45 ARG CA 1 1 8 6427 1 1 45 ARG CB C -11.331 -1.820 -4.497 1.00 . A A . 45 ARG CB 1 1 8 6428 1 1 45 ARG CD C -11.801 -0.656 -6.708 1.00 . A A . 45 ARG CD 1 1 8 6429 1 1 45 ARG CG C -12.255 -1.716 -5.712 1.00 . A A . 45 ARG CG 1 1 8 6430 1 1 45 ARG CZ C -13.189 1.192 -7.575 1.00 . A A . 45 ARG CZ 1 1 8 6431 1 1 45 ARG H H -10.358 1.278 -4.506 1.00 . A A . 45 ARG H 1 1 8 6432 1 1 45 ARG HA H -12.074 0.001 -3.686 1.00 . A A . 45 ARG HA 1 1 8 6433 1 1 45 ARG HB2 H -10.346 -2.134 -4.841 1.00 . A A . 45 ARG HB2 1 1 8 6434 1 1 45 ARG HB3 H -11.727 -2.570 -3.825 1.00 . A A . 45 ARG HB3 1 1 8 6435 1 1 45 ARG HD2 H -10.747 -0.440 -6.532 1.00 . A A . 45 ARG HD2 1 1 8 6436 1 1 45 ARG HD3 H -11.930 -1.040 -7.710 1.00 . A A . 45 ARG HD3 1 1 8 6437 1 1 45 ARG HE H -12.584 1.009 -5.671 1.00 . A A . 45 ARG HE 1 1 8 6438 1 1 45 ARG HG2 H -12.281 -2.670 -6.212 1.00 . A A . 45 ARG HG2 1 1 8 6439 1 1 45 ARG HG3 H -13.248 -1.466 -5.366 1.00 . A A . 45 ARG HG3 1 1 8 6440 1 1 45 ARG HH11 H -12.824 -0.291 -8.914 1.00 . A A . 45 ARG HH11 1 1 8 6441 1 1 45 ARG HH12 H -13.736 1.057 -9.526 1.00 . A A . 45 ARG HH12 1 1 8 6442 1 1 45 ARG HH21 H -13.785 2.790 -6.470 1.00 . A A . 45 ARG HH21 1 1 8 6443 1 1 45 ARG HH22 H -14.273 2.812 -8.141 1.00 . A A . 45 ARG HH22 1 1 8 6444 1 1 45 ARG N N -10.183 0.309 -4.427 1.00 . A A . 45 ARG N 1 1 8 6445 1 1 45 ARG NE N -12.558 0.590 -6.569 1.00 . A A . 45 ARG NE 1 1 8 6446 1 1 45 ARG NH1 N -13.251 0.609 -8.765 1.00 . A A . 45 ARG NH1 1 1 8 6447 1 1 45 ARG NH2 N -13.795 2.356 -7.380 1.00 . A A . 45 ARG NH2 1 1 8 6448 1 1 45 ARG O O -9.564 -0.586 -1.887 1.00 . A A . 45 ARG O 1 1 8 6449 1 1 46 ASP C C -10.934 -3.257 -0.120 1.00 . A A . 46 ASP C 1 1 8 6450 1 1 46 ASP CA C -11.444 -1.832 -0.211 1.00 . A A . 46 ASP CA 1 1 8 6451 1 1 46 ASP CB C -12.775 -1.737 0.543 1.00 . A A . 46 ASP CB 1 1 8 6452 1 1 46 ASP CG C -13.445 -0.381 0.450 1.00 . A A . 46 ASP CG 1 1 8 6453 1 1 46 ASP H H -12.449 -1.723 -2.057 1.00 . A A . 46 ASP H 1 1 8 6454 1 1 46 ASP HA H -10.726 -1.160 0.234 1.00 . A A . 46 ASP HA 1 1 8 6455 1 1 46 ASP HB2 H -13.456 -2.474 0.144 1.00 . A A . 46 ASP HB2 1 1 8 6456 1 1 46 ASP HB3 H -12.599 -1.954 1.587 1.00 . A A . 46 ASP HB3 1 1 8 6457 1 1 46 ASP N N -11.618 -1.474 -1.605 1.00 . A A . 46 ASP N 1 1 8 6458 1 1 46 ASP O O -11.358 -4.020 0.749 1.00 . A A . 46 ASP O 1 1 8 6459 1 1 46 ASP OD1 O -14.024 -0.074 -0.612 1.00 . A A . 46 ASP OD1 1 1 8 6460 1 1 46 ASP OD2 O -13.369 0.393 1.426 1.00 . A A . 46 ASP OD2 1 1 8 6461 1 1 47 LEU C C -8.989 -5.563 0.142 1.00 . A A . 47 LEU C 1 1 8 6462 1 1 47 LEU CA C -9.522 -4.980 -1.172 1.00 . A A . 47 LEU CA 1 1 8 6463 1 1 47 LEU CB C -8.419 -5.019 -2.235 1.00 . A A . 47 LEU CB 1 1 8 6464 1 1 47 LEU CD1 C -7.671 -4.642 -4.599 1.00 . A A . 47 LEU CD1 1 1 8 6465 1 1 47 LEU CD2 C -9.991 -5.446 -4.148 1.00 . A A . 47 LEU CD2 1 1 8 6466 1 1 47 LEU CG C -8.847 -4.581 -3.637 1.00 . A A . 47 LEU CG 1 1 8 6467 1 1 47 LEU H H -9.694 -2.917 -1.649 1.00 . A A . 47 LEU H 1 1 8 6468 1 1 47 LEU HA H -10.343 -5.593 -1.508 1.00 . A A . 47 LEU HA 1 1 8 6469 1 1 47 LEU HB2 H -7.613 -4.376 -1.911 1.00 . A A . 47 LEU HB2 1 1 8 6470 1 1 47 LEU HB3 H -8.047 -6.030 -2.298 1.00 . A A . 47 LEU HB3 1 1 8 6471 1 1 47 LEU HD11 H -8.002 -4.371 -5.590 1.00 . A A . 47 LEU HD11 1 1 8 6472 1 1 47 LEU HD12 H -6.904 -3.954 -4.275 1.00 . A A . 47 LEU HD12 1 1 8 6473 1 1 47 LEU HD13 H -7.270 -5.645 -4.614 1.00 . A A . 47 LEU HD13 1 1 8 6474 1 1 47 LEU HD21 H -10.838 -5.354 -3.485 1.00 . A A . 47 LEU HD21 1 1 8 6475 1 1 47 LEU HD22 H -10.272 -5.124 -5.139 1.00 . A A . 47 LEU HD22 1 1 8 6476 1 1 47 LEU HD23 H -9.673 -6.479 -4.182 1.00 . A A . 47 LEU HD23 1 1 8 6477 1 1 47 LEU HG H -9.193 -3.557 -3.596 1.00 . A A . 47 LEU HG 1 1 8 6478 1 1 47 LEU N N -10.026 -3.608 -1.028 1.00 . A A . 47 LEU N 1 1 8 6479 1 1 47 LEU O O -8.815 -6.767 0.265 1.00 . A A . 47 LEU O 1 1 8 6480 1 1 48 LYS C C -9.294 -5.421 3.415 1.00 . A A . 48 LYS C 1 1 8 6481 1 1 48 LYS CA C -8.204 -5.170 2.390 1.00 . A A . 48 LYS CA 1 1 8 6482 1 1 48 LYS CB C -7.173 -4.189 2.921 1.00 . A A . 48 LYS CB 1 1 8 6483 1 1 48 LYS CD C -6.395 -1.811 2.892 1.00 . A A . 48 LYS CD 1 1 8 6484 1 1 48 LYS CE C -5.650 -1.762 1.552 1.00 . A A . 48 LYS CE 1 1 8 6485 1 1 48 LYS CG C -7.606 -2.740 2.904 1.00 . A A . 48 LYS CG 1 1 8 6486 1 1 48 LYS H H -8.950 -3.771 0.987 1.00 . A A . 48 LYS H 1 1 8 6487 1 1 48 LYS HA H -7.706 -6.098 2.207 1.00 . A A . 48 LYS HA 1 1 8 6488 1 1 48 LYS HB2 H -6.941 -4.452 3.942 1.00 . A A . 48 LYS HB2 1 1 8 6489 1 1 48 LYS HB3 H -6.276 -4.278 2.328 1.00 . A A . 48 LYS HB3 1 1 8 6490 1 1 48 LYS HD2 H -6.720 -0.813 3.137 1.00 . A A . 48 LYS HD2 1 1 8 6491 1 1 48 LYS HD3 H -5.710 -2.158 3.651 1.00 . A A . 48 LYS HD3 1 1 8 6492 1 1 48 LYS HE2 H -6.275 -1.280 0.796 1.00 . A A . 48 LYS HE2 1 1 8 6493 1 1 48 LYS HE3 H -4.759 -1.168 1.689 1.00 . A A . 48 LYS HE3 1 1 8 6494 1 1 48 LYS HG2 H -8.227 -2.558 2.045 1.00 . A A . 48 LYS HG2 1 1 8 6495 1 1 48 LYS HG3 H -8.178 -2.545 3.799 1.00 . A A . 48 LYS HG3 1 1 8 6496 1 1 48 LYS HZ1 H -6.080 -3.699 0.877 1.00 . A A . 48 LYS HZ1 1 1 8 6497 1 1 48 LYS HZ2 H -4.683 -3.607 1.822 1.00 . A A . 48 LYS HZ2 1 1 8 6498 1 1 48 LYS HZ3 H -4.664 -3.051 0.221 1.00 . A A . 48 LYS HZ3 1 1 8 6499 1 1 48 LYS N N -8.742 -4.713 1.118 1.00 . A A . 48 LYS N 1 1 8 6500 1 1 48 LYS NZ N -5.244 -3.120 1.082 1.00 . A A . 48 LYS NZ 1 1 8 6501 1 1 48 LYS O O -9.389 -6.509 3.968 1.00 . A A . 48 LYS O 1 1 8 6502 1 1 49 TRP C C -12.497 -4.994 4.153 1.00 . A A . 49 TRP C 1 1 8 6503 1 1 49 TRP CA C -11.139 -4.566 4.705 1.00 . A A . 49 TRP CA 1 1 8 6504 1 1 49 TRP CB C -11.288 -3.272 5.496 1.00 . A A . 49 TRP CB 1 1 8 6505 1 1 49 TRP CD1 C -12.121 -4.161 7.742 1.00 . A A . 49 TRP CD1 1 1 8 6506 1 1 49 TRP CD2 C -13.502 -2.692 6.769 1.00 . A A . 49 TRP CD2 1 1 8 6507 1 1 49 TRP CE2 C -14.074 -3.111 7.983 1.00 . A A . 49 TRP CE2 1 1 8 6508 1 1 49 TRP CE3 C -14.192 -1.767 5.982 1.00 . A A . 49 TRP CE3 1 1 8 6509 1 1 49 TRP CG C -12.255 -3.382 6.630 1.00 . A A . 49 TRP CG 1 1 8 6510 1 1 49 TRP CH2 C -15.955 -1.727 7.642 1.00 . A A . 49 TRP CH2 1 1 8 6511 1 1 49 TRP CZ2 C -15.301 -2.635 8.431 1.00 . A A . 49 TRP CZ2 1 1 8 6512 1 1 49 TRP CZ3 C -15.411 -1.293 6.430 1.00 . A A . 49 TRP CZ3 1 1 8 6513 1 1 49 TRP H H -10.021 -3.578 3.177 1.00 . A A . 49 TRP H 1 1 8 6514 1 1 49 TRP HA H -10.799 -5.336 5.380 1.00 . A A . 49 TRP HA 1 1 8 6515 1 1 49 TRP HB2 H -10.329 -2.996 5.904 1.00 . A A . 49 TRP HB2 1 1 8 6516 1 1 49 TRP HB3 H -11.634 -2.491 4.835 1.00 . A A . 49 TRP HB3 1 1 8 6517 1 1 49 TRP HD1 H -11.275 -4.804 7.936 1.00 . A A . 49 TRP HD1 1 1 8 6518 1 1 49 TRP HE1 H -13.352 -4.469 9.415 1.00 . A A . 49 TRP HE1 1 1 8 6519 1 1 49 TRP HE3 H -13.788 -1.420 5.042 1.00 . A A . 49 TRP HE3 1 1 8 6520 1 1 49 TRP HH2 H -16.908 -1.329 7.953 1.00 . A A . 49 TRP HH2 1 1 8 6521 1 1 49 TRP HZ2 H -15.732 -2.961 9.367 1.00 . A A . 49 TRP HZ2 1 1 8 6522 1 1 49 TRP HZ3 H -15.959 -0.574 5.837 1.00 . A A . 49 TRP HZ3 1 1 8 6523 1 1 49 TRP N N -10.118 -4.425 3.671 1.00 . A A . 49 TRP N 1 1 8 6524 1 1 49 TRP NE1 N -13.212 -4.009 8.557 1.00 . A A . 49 TRP NE1 1 1 8 6525 1 1 49 TRP O O -13.073 -5.981 4.605 1.00 . A A . 49 TRP O 1 1 8 6526 1 1 50 TRP C C -14.599 -5.379 1.627 1.00 . A A . 50 TRP C 1 1 8 6527 1 1 50 TRP CA C -14.414 -4.426 2.804 1.00 . A A . 50 TRP CA 1 1 8 6528 1 1 50 TRP CB C -15.042 -3.064 2.496 1.00 . A A . 50 TRP CB 1 1 8 6529 1 1 50 TRP CD1 C -16.988 -3.272 0.840 1.00 . A A . 50 TRP CD1 1 1 8 6530 1 1 50 TRP CD2 C -17.618 -3.078 2.978 1.00 . A A . 50 TRP CD2 1 1 8 6531 1 1 50 TRP CE2 C -18.771 -3.185 2.176 1.00 . A A . 50 TRP CE2 1 1 8 6532 1 1 50 TRP CE3 C -17.773 -2.945 4.360 1.00 . A A . 50 TRP CE3 1 1 8 6533 1 1 50 TRP CG C -16.487 -3.139 2.103 1.00 . A A . 50 TRP CG 1 1 8 6534 1 1 50 TRP CH2 C -20.177 -3.035 4.063 1.00 . A A . 50 TRP CH2 1 1 8 6535 1 1 50 TRP CZ2 C -20.055 -3.164 2.708 1.00 . A A . 50 TRP CZ2 1 1 8 6536 1 1 50 TRP CZ3 C -19.050 -2.925 4.889 1.00 . A A . 50 TRP CZ3 1 1 8 6537 1 1 50 TRP H H -12.449 -3.617 2.708 1.00 . A A . 50 TRP H 1 1 8 6538 1 1 50 TRP HA H -14.925 -4.847 3.658 1.00 . A A . 50 TRP HA 1 1 8 6539 1 1 50 TRP HB2 H -14.969 -2.439 3.372 1.00 . A A . 50 TRP HB2 1 1 8 6540 1 1 50 TRP HB3 H -14.500 -2.602 1.685 1.00 . A A . 50 TRP HB3 1 1 8 6541 1 1 50 TRP HD1 H -16.382 -3.343 -0.049 1.00 . A A . 50 TRP HD1 1 1 8 6542 1 1 50 TRP HE1 H -18.949 -3.401 0.097 1.00 . A A . 50 TRP HE1 1 1 8 6543 1 1 50 TRP HE3 H -16.914 -2.862 5.012 1.00 . A A . 50 TRP HE3 1 1 8 6544 1 1 50 TRP HH2 H -21.156 -3.014 4.517 1.00 . A A . 50 TRP HH2 1 1 8 6545 1 1 50 TRP HZ2 H -20.934 -3.249 2.084 1.00 . A A . 50 TRP HZ2 1 1 8 6546 1 1 50 TRP HZ3 H -19.188 -2.825 5.954 1.00 . A A . 50 TRP HZ3 1 1 8 6547 1 1 50 TRP N N -13.013 -4.263 3.183 1.00 . A A . 50 TRP N 1 1 8 6548 1 1 50 TRP NE1 N -18.359 -3.306 0.877 1.00 . A A . 50 TRP NE1 1 1 8 6549 1 1 50 TRP O O -15.448 -6.265 1.677 1.00 . A A . 50 TRP O 1 1 8 6550 1 1 51 GLU C C -13.673 -7.398 -0.549 1.00 . A A . 51 GLU C 1 1 8 6551 1 1 51 GLU CA C -14.040 -5.929 -0.668 1.00 . A A . 51 GLU CA 1 1 8 6552 1 1 51 GLU CB C -13.264 -5.275 -1.817 1.00 . A A . 51 GLU CB 1 1 8 6553 1 1 51 GLU CD C -15.269 -4.074 -2.750 1.00 . A A . 51 GLU CD 1 1 8 6554 1 1 51 GLU CG C -13.847 -3.947 -2.245 1.00 . A A . 51 GLU CG 1 1 8 6555 1 1 51 GLU H H -13.033 -4.611 0.650 1.00 . A A . 51 GLU H 1 1 8 6556 1 1 51 GLU HA H -15.093 -5.860 -0.886 1.00 . A A . 51 GLU HA 1 1 8 6557 1 1 51 GLU HB2 H -12.243 -5.103 -1.505 1.00 . A A . 51 GLU HB2 1 1 8 6558 1 1 51 GLU HB3 H -13.266 -5.939 -2.670 1.00 . A A . 51 GLU HB3 1 1 8 6559 1 1 51 GLU HG2 H -13.837 -3.287 -1.390 1.00 . A A . 51 GLU HG2 1 1 8 6560 1 1 51 GLU HG3 H -13.232 -3.533 -3.032 1.00 . A A . 51 GLU HG3 1 1 8 6561 1 1 51 GLU N N -13.806 -5.212 0.578 1.00 . A A . 51 GLU N 1 1 8 6562 1 1 51 GLU O O -14.414 -8.270 -0.999 1.00 . A A . 51 GLU O 1 1 8 6563 1 1 51 GLU OE1 O -15.477 -4.706 -3.805 1.00 . A A . 51 GLU OE1 1 1 8 6564 1 1 51 GLU OE2 O -16.185 -3.544 -2.098 1.00 . A A . 51 GLU OE2 1 1 8 6565 1 1 52 LEU C C -12.054 -9.474 1.648 1.00 . A A . 52 LEU C 1 1 8 6566 1 1 52 LEU CA C -12.069 -9.041 0.195 1.00 . A A . 52 LEU CA 1 1 8 6567 1 1 52 LEU CB C -10.671 -9.153 -0.395 1.00 . A A . 52 LEU CB 1 1 8 6568 1 1 52 LEU CD1 C -9.081 -8.695 -2.274 1.00 . A A . 52 LEU CD1 1 1 8 6569 1 1 52 LEU CD2 C -11.478 -9.216 -2.771 1.00 . A A . 52 LEU CD2 1 1 8 6570 1 1 52 LEU CG C -10.517 -8.554 -1.790 1.00 . A A . 52 LEU CG 1 1 8 6571 1 1 52 LEU H H -12.005 -6.944 0.431 1.00 . A A . 52 LEU H 1 1 8 6572 1 1 52 LEU HA H -12.737 -9.679 -0.355 1.00 . A A . 52 LEU HA 1 1 8 6573 1 1 52 LEU HB2 H -9.988 -8.641 0.271 1.00 . A A . 52 LEU HB2 1 1 8 6574 1 1 52 LEU HB3 H -10.400 -10.196 -0.438 1.00 . A A . 52 LEU HB3 1 1 8 6575 1 1 52 LEU HD11 H -8.415 -8.205 -1.580 1.00 . A A . 52 LEU HD11 1 1 8 6576 1 1 52 LEU HD12 H -8.826 -9.741 -2.338 1.00 . A A . 52 LEU HD12 1 1 8 6577 1 1 52 LEU HD13 H -8.983 -8.240 -3.249 1.00 . A A . 52 LEU HD13 1 1 8 6578 1 1 52 LEU HD21 H -11.270 -10.275 -2.816 1.00 . A A . 52 LEU HD21 1 1 8 6579 1 1 52 LEU HD22 H -12.495 -9.063 -2.440 1.00 . A A . 52 LEU HD22 1 1 8 6580 1 1 52 LEU HD23 H -11.348 -8.782 -3.750 1.00 . A A . 52 LEU HD23 1 1 8 6581 1 1 52 LEU HG H -10.761 -7.495 -1.737 1.00 . A A . 52 LEU HG 1 1 8 6582 1 1 52 LEU N N -12.541 -7.673 0.066 1.00 . A A . 52 LEU N 1 1 8 6583 1 1 52 LEU O O -12.468 -10.589 1.975 1.00 . A A . 52 LEU O 1 1 8 6584 1 1 53 ARG C C -10.330 -9.896 4.139 1.00 . A A . 53 ARG C 1 1 8 6585 1 1 53 ARG CA C -11.409 -8.827 3.930 1.00 . A A . 53 ARG CA 1 1 8 6586 1 1 53 ARG CB C -12.724 -9.250 4.610 1.00 . A A . 53 ARG CB 1 1 8 6587 1 1 53 ARG CD C -11.665 -9.180 6.902 1.00 . A A . 53 ARG CD 1 1 8 6588 1 1 53 ARG CG C -12.856 -8.765 6.052 1.00 . A A . 53 ARG CG 1 1 8 6589 1 1 53 ARG CZ C -10.719 -7.765 8.687 1.00 . A A . 53 ARG CZ 1 1 8 6590 1 1 53 ARG H H -11.385 -7.673 2.152 1.00 . A A . 53 ARG H 1 1 8 6591 1 1 53 ARG HA H -11.067 -7.907 4.382 1.00 . A A . 53 ARG HA 1 1 8 6592 1 1 53 ARG HB2 H -13.552 -8.850 4.043 1.00 . A A . 53 ARG HB2 1 1 8 6593 1 1 53 ARG HB3 H -12.785 -10.328 4.608 1.00 . A A . 53 ARG HB3 1 1 8 6594 1 1 53 ARG HD2 H -11.679 -10.252 7.014 1.00 . A A . 53 ARG HD2 1 1 8 6595 1 1 53 ARG HD3 H -10.759 -8.886 6.390 1.00 . A A . 53 ARG HD3 1 1 8 6596 1 1 53 ARG HE H -12.435 -8.797 8.825 1.00 . A A . 53 ARG HE 1 1 8 6597 1 1 53 ARG HG2 H -12.927 -7.687 6.054 1.00 . A A . 53 ARG HG2 1 1 8 6598 1 1 53 ARG HG3 H -13.755 -9.187 6.481 1.00 . A A . 53 ARG HG3 1 1 8 6599 1 1 53 ARG HH11 H -9.695 -7.719 6.941 1.00 . A A . 53 ARG HH11 1 1 8 6600 1 1 53 ARG HH12 H -8.998 -6.788 8.234 1.00 . A A . 53 ARG HH12 1 1 8 6601 1 1 53 ARG HH21 H -11.504 -7.605 10.555 1.00 . A A . 53 ARG HH21 1 1 8 6602 1 1 53 ARG HH22 H -10.027 -6.725 10.286 1.00 . A A . 53 ARG HH22 1 1 8 6603 1 1 53 ARG N N -11.601 -8.565 2.499 1.00 . A A . 53 ARG N 1 1 8 6604 1 1 53 ARG NE N -11.680 -8.569 8.230 1.00 . A A . 53 ARG NE 1 1 8 6605 1 1 53 ARG NH1 N -9.727 -7.395 7.889 1.00 . A A . 53 ARG NH1 1 1 8 6606 1 1 53 ARG NH2 N -10.753 -7.328 9.941 1.00 . A A . 53 ARG NH2 1 1 8 6607 1 1 53 ARG O O -10.635 -11.099 4.000 1.00 . A A . 53 ARG O 1 1 8 6608 1 1 53 ARG OXT O -9.185 -9.526 4.464 1.00 . A A . 53 ARG OXT 1 1 9 6609 1 1 1 ASN C C 12.735 -6.990 3.057 1.00 . A A . 1 ASN C 1 1 9 6610 1 1 1 ASN CA C 14.213 -7.277 3.275 1.00 . A A . 1 ASN CA 1 1 9 6611 1 1 1 ASN CB C 14.961 -6.010 3.712 1.00 . A A . 1 ASN CB 1 1 9 6612 1 1 1 ASN CG C 16.435 -6.271 3.975 1.00 . A A . 1 ASN CG 1 1 9 6613 1 1 1 ASN H1 H 14.376 -8.740 1.801 1.00 . A A . 1 ASN H1 1 1 9 6614 1 1 1 ASN H2 H 15.830 -7.943 2.139 1.00 . A A . 1 ASN H2 1 1 9 6615 1 1 1 ASN H3 H 14.627 -7.164 1.236 1.00 . A A . 1 ASN H3 1 1 9 6616 1 1 1 ASN HA H 14.310 -8.027 4.048 1.00 . A A . 1 ASN HA 1 1 9 6617 1 1 1 ASN HB2 H 14.880 -5.264 2.934 1.00 . A A . 1 ASN HB2 1 1 9 6618 1 1 1 ASN HB3 H 14.514 -5.628 4.618 1.00 . A A . 1 ASN HB3 1 1 9 6619 1 1 1 ASN HD21 H 16.480 -4.859 5.380 1.00 . A A . 1 ASN HD21 1 1 9 6620 1 1 1 ASN HD22 H 17.972 -5.696 5.090 1.00 . A A . 1 ASN HD22 1 1 9 6621 1 1 1 ASN N N 14.802 -7.818 2.029 1.00 . A A . 1 ASN N 1 1 9 6622 1 1 1 ASN ND2 N 17.020 -5.537 4.905 1.00 . A A . 1 ASN ND2 1 1 9 6623 1 1 1 ASN O O 12.256 -5.876 3.294 1.00 . A A . 1 ASN O 1 1 9 6624 1 1 1 ASN OD1 O 17.048 -7.132 3.348 1.00 . A A . 1 ASN OD1 1 1 9 6625 1 1 2 SER C C 9.779 -7.301 3.329 1.00 . A A . 2 SER C 1 1 9 6626 1 1 2 SER CA C 10.624 -7.939 2.229 1.00 . A A . 2 SER CA 1 1 9 6627 1 1 2 SER CB C 10.114 -9.349 1.948 1.00 . A A . 2 SER CB 1 1 9 6628 1 1 2 SER H H 12.494 -8.868 2.442 1.00 . A A . 2 SER H 1 1 9 6629 1 1 2 SER HA H 10.533 -7.351 1.329 1.00 . A A . 2 SER HA 1 1 9 6630 1 1 2 SER HB2 H 9.877 -9.836 2.881 1.00 . A A . 2 SER HB2 1 1 9 6631 1 1 2 SER HB3 H 9.227 -9.292 1.335 1.00 . A A . 2 SER HB3 1 1 9 6632 1 1 2 SER HG H 10.655 -10.720 0.646 1.00 . A A . 2 SER HG 1 1 9 6633 1 1 2 SER N N 12.036 -8.015 2.579 1.00 . A A . 2 SER N 1 1 9 6634 1 1 2 SER O O 9.828 -7.730 4.486 1.00 . A A . 2 SER O 1 1 9 6635 1 1 2 SER OG O 11.095 -10.112 1.265 1.00 . A A . 2 SER OG 1 1 9 6636 1 1 3 ASP C C 8.636 -5.387 5.227 1.00 . A A . 3 ASP C 1 1 9 6637 1 1 3 ASP CA C 8.072 -5.580 3.819 1.00 . A A . 3 ASP CA 1 1 9 6638 1 1 3 ASP CB C 6.741 -6.332 3.860 1.00 . A A . 3 ASP CB 1 1 9 6639 1 1 3 ASP CG C 5.656 -5.601 4.630 1.00 . A A . 3 ASP CG 1 1 9 6640 1 1 3 ASP H H 9.037 -6.030 1.978 1.00 . A A . 3 ASP H 1 1 9 6641 1 1 3 ASP HA H 7.900 -4.608 3.389 1.00 . A A . 3 ASP HA 1 1 9 6642 1 1 3 ASP HB2 H 6.399 -6.474 2.849 1.00 . A A . 3 ASP HB2 1 1 9 6643 1 1 3 ASP HB3 H 6.896 -7.297 4.321 1.00 . A A . 3 ASP HB3 1 1 9 6644 1 1 3 ASP N N 9.008 -6.288 2.933 1.00 . A A . 3 ASP N 1 1 9 6645 1 1 3 ASP O O 8.164 -5.991 6.197 1.00 . A A . 3 ASP O 1 1 9 6646 1 1 3 ASP OD1 O 5.648 -4.349 4.608 1.00 . A A . 3 ASP OD1 1 1 9 6647 1 1 3 ASP OD2 O 4.828 -6.265 5.284 1.00 . A A . 3 ASP OD2 1 1 9 6648 1 1 4 SER C C 10.878 -2.885 6.682 1.00 . A A . 4 SER C 1 1 9 6649 1 1 4 SER CA C 10.320 -4.305 6.609 1.00 . A A . 4 SER CA 1 1 9 6650 1 1 4 SER CB C 11.441 -5.324 6.845 1.00 . A A . 4 SER CB 1 1 9 6651 1 1 4 SER H H 9.980 -4.099 4.528 1.00 . A A . 4 SER H 1 1 9 6652 1 1 4 SER HA H 9.578 -4.424 7.383 1.00 . A A . 4 SER HA 1 1 9 6653 1 1 4 SER HB2 H 12.147 -5.276 6.029 1.00 . A A . 4 SER HB2 1 1 9 6654 1 1 4 SER HB3 H 11.945 -5.095 7.773 1.00 . A A . 4 SER HB3 1 1 9 6655 1 1 4 SER HG H 10.255 -6.760 6.230 1.00 . A A . 4 SER HG 1 1 9 6656 1 1 4 SER N N 9.664 -4.559 5.330 1.00 . A A . 4 SER N 1 1 9 6657 1 1 4 SER O O 10.398 -2.061 7.460 1.00 . A A . 4 SER O 1 1 9 6658 1 1 4 SER OG O 10.925 -6.642 6.920 1.00 . A A . 4 SER OG 1 1 9 6659 1 1 5 GLU C C 12.115 -0.450 4.714 1.00 . A A . 5 GLU C 1 1 9 6660 1 1 5 GLU CA C 12.545 -1.299 5.897 1.00 . A A . 5 GLU CA 1 1 9 6661 1 1 5 GLU CB C 14.061 -1.461 5.864 1.00 . A A . 5 GLU CB 1 1 9 6662 1 1 5 GLU CD C 16.135 -2.334 6.955 1.00 . A A . 5 GLU CD 1 1 9 6663 1 1 5 GLU CG C 14.638 -2.173 7.069 1.00 . A A . 5 GLU CG 1 1 9 6664 1 1 5 GLU H H 12.197 -3.275 5.233 1.00 . A A . 5 GLU H 1 1 9 6665 1 1 5 GLU HA H 12.261 -0.799 6.812 1.00 . A A . 5 GLU HA 1 1 9 6666 1 1 5 GLU HB2 H 14.333 -2.023 4.983 1.00 . A A . 5 GLU HB2 1 1 9 6667 1 1 5 GLU HB3 H 14.512 -0.480 5.807 1.00 . A A . 5 GLU HB3 1 1 9 6668 1 1 5 GLU HG2 H 14.414 -1.598 7.957 1.00 . A A . 5 GLU HG2 1 1 9 6669 1 1 5 GLU HG3 H 14.185 -3.153 7.150 1.00 . A A . 5 GLU HG3 1 1 9 6670 1 1 5 GLU N N 11.890 -2.600 5.871 1.00 . A A . 5 GLU N 1 1 9 6671 1 1 5 GLU O O 11.771 -0.982 3.656 1.00 . A A . 5 GLU O 1 1 9 6672 1 1 5 GLU OE1 O 16.588 -3.324 6.340 1.00 . A A . 5 GLU OE1 1 1 9 6673 1 1 5 GLU OE2 O 16.866 -1.487 7.501 1.00 . A A . 5 GLU OE2 1 1 9 6674 1 1 6 CYS C C 11.763 3.236 4.436 1.00 . A A . 6 CYS C 1 1 9 6675 1 1 6 CYS CA C 11.846 1.828 3.854 1.00 . A A . 6 CYS CA 1 1 9 6676 1 1 6 CYS CB C 10.531 1.480 3.149 1.00 . A A . 6 CYS CB 1 1 9 6677 1 1 6 CYS H H 12.394 1.209 5.802 1.00 . A A . 6 CYS H 1 1 9 6678 1 1 6 CYS HA H 12.651 1.798 3.135 1.00 . A A . 6 CYS HA 1 1 9 6679 1 1 6 CYS HB2 H 10.334 2.222 2.389 1.00 . A A . 6 CYS HB2 1 1 9 6680 1 1 6 CYS HB3 H 10.630 0.514 2.679 1.00 . A A . 6 CYS HB3 1 1 9 6681 1 1 6 CYS N N 12.150 0.867 4.907 1.00 . A A . 6 CYS N 1 1 9 6682 1 1 6 CYS O O 11.023 3.477 5.393 1.00 . A A . 6 CYS O 1 1 9 6683 1 1 6 CYS SG S 9.083 1.419 4.245 1.00 . A A . 6 CYS SG 1 1 9 6684 1 1 7 PRO C C 11.139 6.212 4.149 1.00 . A A . 7 PRO C 1 1 9 6685 1 1 7 PRO CA C 12.521 5.581 4.301 1.00 . A A . 7 PRO CA 1 1 9 6686 1 1 7 PRO CB C 13.522 6.260 3.358 1.00 . A A . 7 PRO CB 1 1 9 6687 1 1 7 PRO CD C 13.510 3.944 2.792 1.00 . A A . 7 PRO CD 1 1 9 6688 1 1 7 PRO CG C 14.391 5.160 2.859 1.00 . A A . 7 PRO CG 1 1 9 6689 1 1 7 PRO HA H 12.855 5.688 5.323 1.00 . A A . 7 PRO HA 1 1 9 6690 1 1 7 PRO HB2 H 12.989 6.739 2.549 1.00 . A A . 7 PRO HB2 1 1 9 6691 1 1 7 PRO HB3 H 14.093 6.994 3.904 1.00 . A A . 7 PRO HB3 1 1 9 6692 1 1 7 PRO HD2 H 13.015 3.890 1.834 1.00 . A A . 7 PRO HD2 1 1 9 6693 1 1 7 PRO HD3 H 14.087 3.049 2.974 1.00 . A A . 7 PRO HD3 1 1 9 6694 1 1 7 PRO HG2 H 14.765 5.408 1.876 1.00 . A A . 7 PRO HG2 1 1 9 6695 1 1 7 PRO HG3 H 15.208 4.994 3.544 1.00 . A A . 7 PRO HG3 1 1 9 6696 1 1 7 PRO N N 12.540 4.177 3.875 1.00 . A A . 7 PRO N 1 1 9 6697 1 1 7 PRO O O 10.383 5.861 3.238 1.00 . A A . 7 PRO O 1 1 9 6698 1 1 8 LEU C C 9.165 8.575 3.822 1.00 . A A . 8 LEU C 1 1 9 6699 1 1 8 LEU CA C 9.521 7.823 5.105 1.00 . A A . 8 LEU CA 1 1 9 6700 1 1 8 LEU CB C 9.460 8.800 6.283 1.00 . A A . 8 LEU CB 1 1 9 6701 1 1 8 LEU CD1 C 10.883 7.728 8.072 1.00 . A A . 8 LEU CD1 1 1 9 6702 1 1 8 LEU CD2 C 8.921 9.148 8.702 1.00 . A A . 8 LEU CD2 1 1 9 6703 1 1 8 LEU CG C 9.478 8.172 7.681 1.00 . A A . 8 LEU CG 1 1 9 6704 1 1 8 LEU H H 11.533 7.450 5.667 1.00 . A A . 8 LEU H 1 1 9 6705 1 1 8 LEU HA H 8.785 7.052 5.264 1.00 . A A . 8 LEU HA 1 1 9 6706 1 1 8 LEU HB2 H 10.301 9.474 6.207 1.00 . A A . 8 LEU HB2 1 1 9 6707 1 1 8 LEU HB3 H 8.554 9.376 6.188 1.00 . A A . 8 LEU HB3 1 1 9 6708 1 1 8 LEU HD11 H 11.233 6.983 7.375 1.00 . A A . 8 LEU HD11 1 1 9 6709 1 1 8 LEU HD12 H 11.548 8.579 8.057 1.00 . A A . 8 LEU HD12 1 1 9 6710 1 1 8 LEU HD13 H 10.861 7.307 9.068 1.00 . A A . 8 LEU HD13 1 1 9 6711 1 1 8 LEU HD21 H 8.945 8.693 9.682 1.00 . A A . 8 LEU HD21 1 1 9 6712 1 1 8 LEU HD22 H 9.518 10.046 8.708 1.00 . A A . 8 LEU HD22 1 1 9 6713 1 1 8 LEU HD23 H 7.901 9.395 8.446 1.00 . A A . 8 LEU HD23 1 1 9 6714 1 1 8 LEU HG H 8.844 7.299 7.679 1.00 . A A . 8 LEU HG 1 1 9 6715 1 1 8 LEU N N 10.840 7.171 5.032 1.00 . A A . 8 LEU N 1 1 9 6716 1 1 8 LEU O O 8.061 9.102 3.680 1.00 . A A . 8 LEU O 1 1 9 6717 1 1 9 SER C C 9.171 8.605 0.648 1.00 . A A . 9 SER C 1 1 9 6718 1 1 9 SER CA C 9.968 9.369 1.685 1.00 . A A . 9 SER CA 1 1 9 6719 1 1 9 SER CB C 11.362 9.680 1.146 1.00 . A A . 9 SER CB 1 1 9 6720 1 1 9 SER H H 10.878 8.045 3.016 1.00 . A A . 9 SER H 1 1 9 6721 1 1 9 SER HA H 9.462 10.291 1.919 1.00 . A A . 9 SER HA 1 1 9 6722 1 1 9 SER HB2 H 11.280 10.076 0.145 1.00 . A A . 9 SER HB2 1 1 9 6723 1 1 9 SER HB3 H 11.838 10.407 1.785 1.00 . A A . 9 SER HB3 1 1 9 6724 1 1 9 SER HG H 13.095 8.753 1.178 1.00 . A A . 9 SER HG 1 1 9 6725 1 1 9 SER N N 10.094 8.599 2.895 1.00 . A A . 9 SER N 1 1 9 6726 1 1 9 SER O O 8.503 9.196 -0.186 1.00 . A A . 9 SER O 1 1 9 6727 1 1 9 SER OG O 12.160 8.504 1.113 1.00 . A A . 9 SER OG 1 1 9 6728 1 1 10 HIS C C 7.157 6.154 0.070 1.00 . A A . 10 HIS C 1 1 9 6729 1 1 10 HIS CA C 8.605 6.440 -0.278 1.00 . A A . 10 HIS CA 1 1 9 6730 1 1 10 HIS CB C 9.380 5.132 -0.434 1.00 . A A . 10 HIS CB 1 1 9 6731 1 1 10 HIS CD2 C 11.071 4.700 -2.347 1.00 . A A . 10 HIS CD2 1 1 9 6732 1 1 10 HIS CE1 C 12.666 6.046 -1.689 1.00 . A A . 10 HIS CE1 1 1 9 6733 1 1 10 HIS CG C 10.659 5.284 -1.199 1.00 . A A . 10 HIS CG 1 1 9 6734 1 1 10 HIS H H 9.688 6.869 1.489 1.00 . A A . 10 HIS H 1 1 9 6735 1 1 10 HIS HA H 8.634 6.975 -1.214 1.00 . A A . 10 HIS HA 1 1 9 6736 1 1 10 HIS HB2 H 9.620 4.745 0.544 1.00 . A A . 10 HIS HB2 1 1 9 6737 1 1 10 HIS HB3 H 8.762 4.417 -0.957 1.00 . A A . 10 HIS HB3 1 1 9 6738 1 1 10 HIS HD1 H 11.679 6.717 -0.030 1.00 . A A . 10 HIS HD1 1 1 9 6739 1 1 10 HIS HD2 H 10.514 3.986 -2.936 1.00 . A A . 10 HIS HD2 1 1 9 6740 1 1 10 HIS HE1 H 13.598 6.593 -1.641 1.00 . A A . 10 HIS HE1 1 1 9 6741 1 1 10 HIS HE2 H 12.763 5.119 -3.516 1.00 . A A . 10 HIS HE2 1 1 9 6742 1 1 10 HIS N N 9.228 7.283 0.727 1.00 . A A . 10 HIS N 1 1 9 6743 1 1 10 HIS ND1 N 11.683 6.123 -0.811 1.00 . A A . 10 HIS ND1 1 1 9 6744 1 1 10 HIS NE2 N 12.320 5.190 -2.631 1.00 . A A . 10 HIS NE2 1 1 9 6745 1 1 10 HIS O O 6.311 6.027 -0.814 1.00 . A A . 10 HIS O 1 1 9 6746 1 1 11 ASP C C 4.804 7.181 1.937 1.00 . A A . 11 ASP C 1 1 9 6747 1 1 11 ASP CA C 5.514 5.842 1.819 1.00 . A A . 11 ASP CA 1 1 9 6748 1 1 11 ASP CB C 5.514 5.098 3.158 1.00 . A A . 11 ASP CB 1 1 9 6749 1 1 11 ASP CG C 6.023 5.935 4.306 1.00 . A A . 11 ASP CG 1 1 9 6750 1 1 11 ASP H H 7.593 6.156 2.021 1.00 . A A . 11 ASP H 1 1 9 6751 1 1 11 ASP HA H 5.007 5.243 1.079 1.00 . A A . 11 ASP HA 1 1 9 6752 1 1 11 ASP HB2 H 4.510 4.777 3.388 1.00 . A A . 11 ASP HB2 1 1 9 6753 1 1 11 ASP HB3 H 6.155 4.232 3.069 1.00 . A A . 11 ASP HB3 1 1 9 6754 1 1 11 ASP N N 6.873 6.062 1.359 1.00 . A A . 11 ASP N 1 1 9 6755 1 1 11 ASP O O 3.607 7.289 1.692 1.00 . A A . 11 ASP O 1 1 9 6756 1 1 11 ASP OD1 O 7.229 6.236 4.326 1.00 . A A . 11 ASP OD1 1 1 9 6757 1 1 11 ASP OD2 O 5.225 6.272 5.204 1.00 . A A . 11 ASP OD2 1 1 9 6758 1 1 12 GLY C C 4.841 10.114 0.929 1.00 . A A . 12 GLY C 1 1 9 6759 1 1 12 GLY CA C 5.053 9.554 2.318 1.00 . A A . 12 GLY CA 1 1 9 6760 1 1 12 GLY H H 6.506 8.040 2.505 1.00 . A A . 12 GLY H 1 1 9 6761 1 1 12 GLY HA2 H 4.110 9.550 2.848 1.00 . A A . 12 GLY HA2 1 1 9 6762 1 1 12 GLY HA3 H 5.750 10.185 2.849 1.00 . A A . 12 GLY HA3 1 1 9 6763 1 1 12 GLY N N 5.574 8.207 2.273 1.00 . A A . 12 GLY N 1 1 9 6764 1 1 12 GLY O O 4.008 11.002 0.730 1.00 . A A . 12 GLY O 1 1 9 6765 1 1 13 TYR C C 4.147 9.325 -1.984 1.00 . A A . 13 TYR C 1 1 9 6766 1 1 13 TYR CA C 5.413 9.970 -1.436 1.00 . A A . 13 TYR CA 1 1 9 6767 1 1 13 TYR CB C 6.610 9.529 -2.284 1.00 . A A . 13 TYR CB 1 1 9 6768 1 1 13 TYR CD1 C 6.579 11.146 -4.212 1.00 . A A . 13 TYR CD1 1 1 9 6769 1 1 13 TYR CD2 C 6.227 8.836 -4.678 1.00 . A A . 13 TYR CD2 1 1 9 6770 1 1 13 TYR CE1 C 6.462 11.441 -5.553 1.00 . A A . 13 TYR CE1 1 1 9 6771 1 1 13 TYR CE2 C 6.108 9.122 -6.022 1.00 . A A . 13 TYR CE2 1 1 9 6772 1 1 13 TYR CG C 6.464 9.843 -3.752 1.00 . A A . 13 TYR CG 1 1 9 6773 1 1 13 TYR CZ C 6.166 10.417 -6.452 1.00 . A A . 13 TYR CZ 1 1 9 6774 1 1 13 TYR H H 6.351 9.001 0.213 1.00 . A A . 13 TYR H 1 1 9 6775 1 1 13 TYR HA H 5.315 11.043 -1.493 1.00 . A A . 13 TYR HA 1 1 9 6776 1 1 13 TYR HB2 H 7.497 10.022 -1.925 1.00 . A A . 13 TYR HB2 1 1 9 6777 1 1 13 TYR HB3 H 6.735 8.462 -2.185 1.00 . A A . 13 TYR HB3 1 1 9 6778 1 1 13 TYR HD1 H 6.765 11.938 -3.502 1.00 . A A . 13 TYR HD1 1 1 9 6779 1 1 13 TYR HD2 H 6.134 7.818 -4.332 1.00 . A A . 13 TYR HD2 1 1 9 6780 1 1 13 TYR HE1 H 6.555 12.462 -5.892 1.00 . A A . 13 TYR HE1 1 1 9 6781 1 1 13 TYR HE2 H 5.922 8.327 -6.729 1.00 . A A . 13 TYR HE2 1 1 9 6782 1 1 13 TYR HH H 5.365 10.219 -8.170 1.00 . A A . 13 TYR HH 1 1 9 6783 1 1 13 TYR N N 5.611 9.610 -0.032 1.00 . A A . 13 TYR N 1 1 9 6784 1 1 13 TYR O O 3.574 9.789 -2.973 1.00 . A A . 13 TYR O 1 1 9 6785 1 1 13 TYR OH O 6.114 10.716 -7.797 1.00 . A A . 13 TYR OH 1 1 9 6786 1 1 14 CYS C C 1.263 8.279 -1.609 1.00 . A A . 14 CYS C 1 1 9 6787 1 1 14 CYS CA C 2.571 7.492 -1.805 1.00 . A A . 14 CYS CA 1 1 9 6788 1 1 14 CYS CB C 2.536 6.114 -1.131 1.00 . A A . 14 CYS CB 1 1 9 6789 1 1 14 CYS H H 4.170 7.980 -0.515 1.00 . A A . 14 CYS H 1 1 9 6790 1 1 14 CYS HA H 2.708 7.345 -2.869 1.00 . A A . 14 CYS HA 1 1 9 6791 1 1 14 CYS HB2 H 3.476 5.614 -1.317 1.00 . A A . 14 CYS HB2 1 1 9 6792 1 1 14 CYS HB3 H 2.413 6.238 -0.061 1.00 . A A . 14 CYS HB3 1 1 9 6793 1 1 14 CYS N N 3.713 8.255 -1.334 1.00 . A A . 14 CYS N 1 1 9 6794 1 1 14 CYS O O 1.286 9.420 -1.150 1.00 . A A . 14 CYS O 1 1 9 6795 1 1 14 CYS SG S 1.207 5.012 -1.733 1.00 . A A . 14 CYS SG 1 1 9 6796 1 1 15 LEU C C -1.976 8.574 -0.961 1.00 . A A . 15 LEU C 1 1 9 6797 1 1 15 LEU CA C -1.079 8.435 -2.186 1.00 . A A . 15 LEU CA 1 1 9 6798 1 1 15 LEU CB C -1.840 7.788 -3.348 1.00 . A A . 15 LEU CB 1 1 9 6799 1 1 15 LEU CD1 C -1.752 6.757 -5.631 1.00 . A A . 15 LEU CD1 1 1 9 6800 1 1 15 LEU CD2 C -0.669 8.970 -5.224 1.00 . A A . 15 LEU CD2 1 1 9 6801 1 1 15 LEU CG C -1.010 7.614 -4.621 1.00 . A A . 15 LEU CG 1 1 9 6802 1 1 15 LEU H H 0.095 6.694 -1.954 1.00 . A A . 15 LEU H 1 1 9 6803 1 1 15 LEU HA H -0.775 9.421 -2.492 1.00 . A A . 15 LEU HA 1 1 9 6804 1 1 15 LEU HB2 H -2.186 6.816 -3.029 1.00 . A A . 15 LEU HB2 1 1 9 6805 1 1 15 LEU HB3 H -2.696 8.402 -3.583 1.00 . A A . 15 LEU HB3 1 1 9 6806 1 1 15 LEU HD11 H -1.152 6.648 -6.521 1.00 . A A . 15 LEU HD11 1 1 9 6807 1 1 15 LEU HD12 H -1.944 5.783 -5.203 1.00 . A A . 15 LEU HD12 1 1 9 6808 1 1 15 LEU HD13 H -2.690 7.230 -5.883 1.00 . A A . 15 LEU HD13 1 1 9 6809 1 1 15 LEU HD21 H -0.107 8.828 -6.137 1.00 . A A . 15 LEU HD21 1 1 9 6810 1 1 15 LEU HD22 H -1.580 9.507 -5.443 1.00 . A A . 15 LEU HD22 1 1 9 6811 1 1 15 LEU HD23 H -0.075 9.536 -4.522 1.00 . A A . 15 LEU HD23 1 1 9 6812 1 1 15 LEU HG H -0.084 7.112 -4.373 1.00 . A A . 15 LEU HG 1 1 9 6813 1 1 15 LEU N N 0.131 7.674 -1.924 1.00 . A A . 15 LEU N 1 1 9 6814 1 1 15 LEU O O -1.838 9.523 -0.184 1.00 . A A . 15 LEU O 1 1 9 6815 1 1 16 HIS C C -3.601 7.180 1.548 1.00 . A A . 16 HIS C 1 1 9 6816 1 1 16 HIS CA C -3.952 7.779 0.195 1.00 . A A . 16 HIS CA 1 1 9 6817 1 1 16 HIS CB C -5.245 7.159 -0.352 1.00 . A A . 16 HIS CB 1 1 9 6818 1 1 16 HIS CD2 C -6.891 8.080 1.449 1.00 . A A . 16 HIS CD2 1 1 9 6819 1 1 16 HIS CE1 C -8.510 8.693 0.113 1.00 . A A . 16 HIS CE1 1 1 9 6820 1 1 16 HIS CG C -6.502 7.788 0.182 1.00 . A A . 16 HIS CG 1 1 9 6821 1 1 16 HIS H H -2.745 6.744 -1.221 1.00 . A A . 16 HIS H 1 1 9 6822 1 1 16 HIS HA H -4.101 8.839 0.322 1.00 . A A . 16 HIS HA 1 1 9 6823 1 1 16 HIS HB2 H -5.255 7.262 -1.425 1.00 . A A . 16 HIS HB2 1 1 9 6824 1 1 16 HIS HB3 H -5.265 6.110 -0.096 1.00 . A A . 16 HIS HB3 1 1 9 6825 1 1 16 HIS HD1 H -7.572 8.108 -1.615 1.00 . A A . 16 HIS HD1 1 1 9 6826 1 1 16 HIS HD2 H -6.321 7.903 2.351 1.00 . A A . 16 HIS HD2 1 1 9 6827 1 1 16 HIS HE1 H -9.445 9.090 -0.254 1.00 . A A . 16 HIS HE1 1 1 9 6828 1 1 16 HIS HE2 H -8.735 8.810 2.145 1.00 . A A . 16 HIS HE2 1 1 9 6829 1 1 16 HIS N N -2.856 7.605 -0.753 1.00 . A A . 16 HIS N 1 1 9 6830 1 1 16 HIS ND1 N -7.544 8.187 -0.628 1.00 . A A . 16 HIS ND1 1 1 9 6831 1 1 16 HIS NE2 N -8.140 8.638 1.375 1.00 . A A . 16 HIS NE2 1 1 9 6832 1 1 16 HIS O O -4.474 6.711 2.274 1.00 . A A . 16 HIS O 1 1 9 6833 1 1 17 ASP C C -0.277 6.458 2.944 1.00 . A A . 17 ASP C 1 1 9 6834 1 1 17 ASP CA C -1.742 6.789 3.133 1.00 . A A . 17 ASP CA 1 1 9 6835 1 1 17 ASP CB C -2.448 5.564 3.715 1.00 . A A . 17 ASP CB 1 1 9 6836 1 1 17 ASP CG C -2.163 5.378 5.192 1.00 . A A . 17 ASP CG 1 1 9 6837 1 1 17 ASP H H -1.696 7.530 1.154 1.00 . A A . 17 ASP H 1 1 9 6838 1 1 17 ASP HA H -1.830 7.616 3.812 1.00 . A A . 17 ASP HA 1 1 9 6839 1 1 17 ASP HB2 H -3.513 5.677 3.586 1.00 . A A . 17 ASP HB2 1 1 9 6840 1 1 17 ASP HB3 H -2.118 4.681 3.187 1.00 . A A . 17 ASP HB3 1 1 9 6841 1 1 17 ASP N N -2.306 7.201 1.840 1.00 . A A . 17 ASP N 1 1 9 6842 1 1 17 ASP O O 0.586 6.963 3.657 1.00 . A A . 17 ASP O 1 1 9 6843 1 1 17 ASP OD1 O -1.148 4.746 5.537 1.00 . A A . 17 ASP OD1 1 1 9 6844 1 1 17 ASP OD2 O -2.969 5.862 6.016 1.00 . A A . 17 ASP OD2 1 1 9 6845 1 1 18 GLY C C 2.024 4.393 2.726 1.00 . A A . 18 GLY C 1 1 9 6846 1 1 18 GLY CA C 1.332 5.208 1.638 1.00 . A A . 18 GLY CA 1 1 9 6847 1 1 18 GLY H H -0.758 5.359 1.352 1.00 . A A . 18 GLY H 1 1 9 6848 1 1 18 GLY HA2 H 1.294 4.602 0.745 1.00 . A A . 18 GLY HA2 1 1 9 6849 1 1 18 GLY HA3 H 1.933 6.084 1.432 1.00 . A A . 18 GLY HA3 1 1 9 6850 1 1 18 GLY N N -0.018 5.639 1.938 1.00 . A A . 18 GLY N 1 1 9 6851 1 1 18 GLY O O 2.284 4.874 3.827 1.00 . A A . 18 GLY O 1 1 9 6852 1 1 19 VAL C C 4.146 1.574 2.222 1.00 . A A . 19 VAL C 1 1 9 6853 1 1 19 VAL CA C 3.200 2.282 3.183 1.00 . A A . 19 VAL CA 1 1 9 6854 1 1 19 VAL CB C 2.401 1.241 4.009 1.00 . A A . 19 VAL CB 1 1 9 6855 1 1 19 VAL CG1 C 3.328 0.215 4.650 1.00 . A A . 19 VAL CG1 1 1 9 6856 1 1 19 VAL CG2 C 1.570 1.937 5.081 1.00 . A A . 19 VAL CG2 1 1 9 6857 1 1 19 VAL H H 1.975 2.807 1.541 1.00 . A A . 19 VAL H 1 1 9 6858 1 1 19 VAL HA H 3.776 2.901 3.859 1.00 . A A . 19 VAL HA 1 1 9 6859 1 1 19 VAL HB H 1.727 0.723 3.343 1.00 . A A . 19 VAL HB 1 1 9 6860 1 1 19 VAL HG11 H 2.743 -0.502 5.207 1.00 . A A . 19 VAL HG11 1 1 9 6861 1 1 19 VAL HG12 H 3.887 -0.299 3.881 1.00 . A A . 19 VAL HG12 1 1 9 6862 1 1 19 VAL HG13 H 4.013 0.716 5.319 1.00 . A A . 19 VAL HG13 1 1 9 6863 1 1 19 VAL HG21 H 1.029 1.201 5.656 1.00 . A A . 19 VAL HG21 1 1 9 6864 1 1 19 VAL HG22 H 2.222 2.497 5.736 1.00 . A A . 19 VAL HG22 1 1 9 6865 1 1 19 VAL HG23 H 0.867 2.613 4.612 1.00 . A A . 19 VAL HG23 1 1 9 6866 1 1 19 VAL N N 2.336 3.153 2.381 1.00 . A A . 19 VAL N 1 1 9 6867 1 1 19 VAL O O 3.714 1.106 1.184 1.00 . A A . 19 VAL O 1 1 9 6868 1 1 20 CYS C C 6.868 -0.298 1.555 1.00 . A A . 20 CYS C 1 1 9 6869 1 1 20 CYS CA C 6.414 1.159 1.537 1.00 . A A . 20 CYS CA 1 1 9 6870 1 1 20 CYS CB C 7.609 2.099 1.694 1.00 . A A . 20 CYS CB 1 1 9 6871 1 1 20 CYS H H 5.689 1.569 3.486 1.00 . A A . 20 CYS H 1 1 9 6872 1 1 20 CYS HA H 5.958 1.355 0.579 1.00 . A A . 20 CYS HA 1 1 9 6873 1 1 20 CYS HB2 H 8.513 1.568 1.429 1.00 . A A . 20 CYS HB2 1 1 9 6874 1 1 20 CYS HB3 H 7.487 2.944 1.032 1.00 . A A . 20 CYS HB3 1 1 9 6875 1 1 20 CYS N N 5.416 1.466 2.552 1.00 . A A . 20 CYS N 1 1 9 6876 1 1 20 CYS O O 7.372 -0.807 2.556 1.00 . A A . 20 CYS O 1 1 9 6877 1 1 20 CYS SG S 7.820 2.744 3.385 1.00 . A A . 20 CYS SG 1 1 9 6878 1 1 21 MET C C 7.805 -2.361 -1.188 1.00 . A A . 21 MET C 1 1 9 6879 1 1 21 MET CA C 7.115 -2.320 0.171 1.00 . A A . 21 MET CA 1 1 9 6880 1 1 21 MET CB C 5.927 -3.280 0.166 1.00 . A A . 21 MET CB 1 1 9 6881 1 1 21 MET CE C 2.758 -3.422 0.104 1.00 . A A . 21 MET CE 1 1 9 6882 1 1 21 MET CG C 5.168 -3.335 1.477 1.00 . A A . 21 MET CG 1 1 9 6883 1 1 21 MET H H 6.166 -0.499 -0.305 1.00 . A A . 21 MET H 1 1 9 6884 1 1 21 MET HA H 7.814 -2.599 0.946 1.00 . A A . 21 MET HA 1 1 9 6885 1 1 21 MET HB2 H 5.241 -2.962 -0.601 1.00 . A A . 21 MET HB2 1 1 9 6886 1 1 21 MET HB3 H 6.279 -4.274 -0.065 1.00 . A A . 21 MET HB3 1 1 9 6887 1 1 21 MET HE1 H 1.817 -3.918 -0.087 1.00 . A A . 21 MET HE1 1 1 9 6888 1 1 21 MET HE2 H 2.572 -2.418 0.450 1.00 . A A . 21 MET HE2 1 1 9 6889 1 1 21 MET HE3 H 3.337 -3.388 -0.806 1.00 . A A . 21 MET HE3 1 1 9 6890 1 1 21 MET HG2 H 5.810 -3.766 2.232 1.00 . A A . 21 MET HG2 1 1 9 6891 1 1 21 MET HG3 H 4.901 -2.329 1.763 1.00 . A A . 21 MET HG3 1 1 9 6892 1 1 21 MET N N 6.659 -0.955 0.414 1.00 . A A . 21 MET N 1 1 9 6893 1 1 21 MET O O 7.237 -1.897 -2.173 1.00 . A A . 21 MET O 1 1 9 6894 1 1 21 MET SD S 3.664 -4.326 1.358 1.00 . A A . 21 MET SD 1 1 9 6895 1 1 22 TYR C C 11.075 -3.660 -2.407 1.00 . A A . 22 TYR C 1 1 9 6896 1 1 22 TYR CA C 9.813 -2.800 -2.447 1.00 . A A . 22 TYR CA 1 1 9 6897 1 1 22 TYR CB C 10.075 -1.316 -2.686 1.00 . A A . 22 TYR CB 1 1 9 6898 1 1 22 TYR CD1 C 12.330 -1.249 -3.786 1.00 . A A . 22 TYR CD1 1 1 9 6899 1 1 22 TYR CD2 C 12.060 -0.009 -1.769 1.00 . A A . 22 TYR CD2 1 1 9 6900 1 1 22 TYR CE1 C 13.651 -0.863 -3.856 1.00 . A A . 22 TYR CE1 1 1 9 6901 1 1 22 TYR CE2 C 13.385 0.382 -1.829 1.00 . A A . 22 TYR CE2 1 1 9 6902 1 1 22 TYR CG C 11.511 -0.828 -2.750 1.00 . A A . 22 TYR CG 1 1 9 6903 1 1 22 TYR CZ C 14.099 0.175 -2.858 1.00 . A A . 22 TYR CZ 1 1 9 6904 1 1 22 TYR H H 9.350 -3.400 -0.529 1.00 . A A . 22 TYR H 1 1 9 6905 1 1 22 TYR HA H 9.216 -3.162 -3.247 1.00 . A A . 22 TYR HA 1 1 9 6906 1 1 22 TYR HB2 H 9.616 -1.078 -3.601 1.00 . A A . 22 TYR HB2 1 1 9 6907 1 1 22 TYR HB3 H 9.581 -0.756 -1.903 1.00 . A A . 22 TYR HB3 1 1 9 6908 1 1 22 TYR HD1 H 11.918 -1.885 -4.556 1.00 . A A . 22 TYR HD1 1 1 9 6909 1 1 22 TYR HD2 H 11.437 0.330 -0.953 1.00 . A A . 22 TYR HD2 1 1 9 6910 1 1 22 TYR HE1 H 14.269 -1.197 -4.676 1.00 . A A . 22 TYR HE1 1 1 9 6911 1 1 22 TYR HE2 H 13.797 1.018 -1.060 1.00 . A A . 22 TYR HE2 1 1 9 6912 1 1 22 TYR HH H 15.743 0.421 -3.879 1.00 . A A . 22 TYR HH 1 1 9 6913 1 1 22 TYR N N 9.015 -2.909 -1.257 1.00 . A A . 22 TYR N 1 1 9 6914 1 1 22 TYR O O 11.315 -4.463 -3.304 1.00 . A A . 22 TYR O 1 1 9 6915 1 1 22 TYR OH O 15.492 0.327 -2.947 1.00 . A A . 22 TYR OH 1 1 9 6916 1 1 23 ILE C C 12.805 -5.739 -0.797 1.00 . A A . 23 ILE C 1 1 9 6917 1 1 23 ILE CA C 13.093 -4.299 -1.220 1.00 . A A . 23 ILE CA 1 1 9 6918 1 1 23 ILE CB C 14.032 -3.679 -0.191 1.00 . A A . 23 ILE CB 1 1 9 6919 1 1 23 ILE CD1 C 13.979 -2.552 2.095 1.00 . A A . 23 ILE CD1 1 1 9 6920 1 1 23 ILE CG1 C 13.264 -3.444 1.100 1.00 . A A . 23 ILE CG1 1 1 9 6921 1 1 23 ILE CG2 C 14.654 -2.397 -0.725 1.00 . A A . 23 ILE CG2 1 1 9 6922 1 1 23 ILE H H 11.607 -2.846 -0.713 1.00 . A A . 23 ILE H 1 1 9 6923 1 1 23 ILE HA H 13.597 -4.311 -2.175 1.00 . A A . 23 ILE HA 1 1 9 6924 1 1 23 ILE HB H 14.822 -4.384 -0.015 1.00 . A A . 23 ILE HB 1 1 9 6925 1 1 23 ILE HD11 H 14.138 -1.579 1.654 1.00 . A A . 23 ILE HD11 1 1 9 6926 1 1 23 ILE HD12 H 13.374 -2.449 2.984 1.00 . A A . 23 ILE HD12 1 1 9 6927 1 1 23 ILE HD13 H 14.932 -2.989 2.356 1.00 . A A . 23 ILE HD13 1 1 9 6928 1 1 23 ILE HG12 H 12.313 -3.001 0.850 1.00 . A A . 23 ILE HG12 1 1 9 6929 1 1 23 ILE HG13 H 13.089 -4.398 1.578 1.00 . A A . 23 ILE HG13 1 1 9 6930 1 1 23 ILE HG21 H 15.265 -1.947 0.043 1.00 . A A . 23 ILE HG21 1 1 9 6931 1 1 23 ILE HG22 H 15.265 -2.624 -1.587 1.00 . A A . 23 ILE HG22 1 1 9 6932 1 1 23 ILE HG23 H 13.870 -1.709 -1.010 1.00 . A A . 23 ILE HG23 1 1 9 6933 1 1 23 ILE N N 11.855 -3.512 -1.374 1.00 . A A . 23 ILE N 1 1 9 6934 1 1 23 ILE O O 13.360 -6.257 0.175 1.00 . A A . 23 ILE O 1 1 9 6935 1 1 24 GLU C C 12.417 -8.804 -1.679 1.00 . A A . 24 GLU C 1 1 9 6936 1 1 24 GLU CA C 11.452 -7.703 -1.270 1.00 . A A . 24 GLU CA 1 1 9 6937 1 1 24 GLU CB C 10.165 -7.851 -2.048 1.00 . A A . 24 GLU CB 1 1 9 6938 1 1 24 GLU CD C 8.075 -7.368 -0.703 1.00 . A A . 24 GLU CD 1 1 9 6939 1 1 24 GLU CG C 9.114 -6.821 -1.653 1.00 . A A . 24 GLU CG 1 1 9 6940 1 1 24 GLU H H 11.686 -5.945 -2.406 1.00 . A A . 24 GLU H 1 1 9 6941 1 1 24 GLU HA H 11.245 -7.766 -0.214 1.00 . A A . 24 GLU HA 1 1 9 6942 1 1 24 GLU HB2 H 10.402 -7.724 -3.106 1.00 . A A . 24 GLU HB2 1 1 9 6943 1 1 24 GLU HB3 H 9.762 -8.839 -1.887 1.00 . A A . 24 GLU HB3 1 1 9 6944 1 1 24 GLU HG2 H 9.608 -5.994 -1.157 1.00 . A A . 24 GLU HG2 1 1 9 6945 1 1 24 GLU HG3 H 8.620 -6.466 -2.546 1.00 . A A . 24 GLU HG3 1 1 9 6946 1 1 24 GLU N N 11.973 -6.382 -1.573 1.00 . A A . 24 GLU N 1 1 9 6947 1 1 24 GLU O O 12.080 -9.987 -1.609 1.00 . A A . 24 GLU O 1 1 9 6948 1 1 24 GLU OE1 O 7.104 -7.989 -1.177 1.00 . A A . 24 GLU OE1 1 1 9 6949 1 1 24 GLU OE2 O 8.228 -7.163 0.514 1.00 . A A . 24 GLU OE2 1 1 9 6950 1 1 25 ALA C C 14.009 -9.875 -4.049 1.00 . A A . 25 ALA C 1 1 9 6951 1 1 25 ALA CA C 14.564 -9.324 -2.741 1.00 . A A . 25 ALA CA 1 1 9 6952 1 1 25 ALA CB C 14.939 -10.447 -1.782 1.00 . A A . 25 ALA CB 1 1 9 6953 1 1 25 ALA H H 13.834 -7.452 -2.072 1.00 . A A . 25 ALA H 1 1 9 6954 1 1 25 ALA HA H 15.460 -8.758 -2.958 1.00 . A A . 25 ALA HA 1 1 9 6955 1 1 25 ALA HB1 H 14.064 -11.036 -1.557 1.00 . A A . 25 ALA HB1 1 1 9 6956 1 1 25 ALA HB2 H 15.689 -11.075 -2.239 1.00 . A A . 25 ALA HB2 1 1 9 6957 1 1 25 ALA HB3 H 15.332 -10.024 -0.868 1.00 . A A . 25 ALA HB3 1 1 9 6958 1 1 25 ALA N N 13.600 -8.404 -2.140 1.00 . A A . 25 ALA N 1 1 9 6959 1 1 25 ALA O O 14.606 -10.744 -4.683 1.00 . A A . 25 ALA O 1 1 9 6960 1 1 26 LEU C C 12.222 -8.451 -6.561 1.00 . A A . 26 LEU C 1 1 9 6961 1 1 26 LEU CA C 12.241 -9.691 -5.707 1.00 . A A . 26 LEU CA 1 1 9 6962 1 1 26 LEU CB C 10.821 -10.233 -5.520 1.00 . A A . 26 LEU CB 1 1 9 6963 1 1 26 LEU CD1 C 9.258 -11.938 -4.563 1.00 . A A . 26 LEU CD1 1 1 9 6964 1 1 26 LEU CD2 C 11.485 -12.656 -5.459 1.00 . A A . 26 LEU CD2 1 1 9 6965 1 1 26 LEU CG C 10.718 -11.548 -4.744 1.00 . A A . 26 LEU CG 1 1 9 6966 1 1 26 LEU H H 12.395 -8.725 -3.850 1.00 . A A . 26 LEU H 1 1 9 6967 1 1 26 LEU HA H 12.851 -10.433 -6.185 1.00 . A A . 26 LEU HA 1 1 9 6968 1 1 26 LEU HB2 H 10.240 -9.487 -4.997 1.00 . A A . 26 LEU HB2 1 1 9 6969 1 1 26 LEU HB3 H 10.386 -10.384 -6.496 1.00 . A A . 26 LEU HB3 1 1 9 6970 1 1 26 LEU HD11 H 8.796 -12.061 -5.531 1.00 . A A . 26 LEU HD11 1 1 9 6971 1 1 26 LEU HD12 H 9.200 -12.865 -4.014 1.00 . A A . 26 LEU HD12 1 1 9 6972 1 1 26 LEU HD13 H 8.745 -11.161 -4.015 1.00 . A A . 26 LEU HD13 1 1 9 6973 1 1 26 LEU HD21 H 12.523 -12.371 -5.554 1.00 . A A . 26 LEU HD21 1 1 9 6974 1 1 26 LEU HD22 H 11.415 -13.570 -4.888 1.00 . A A . 26 LEU HD22 1 1 9 6975 1 1 26 LEU HD23 H 11.062 -12.811 -6.439 1.00 . A A . 26 LEU HD23 1 1 9 6976 1 1 26 LEU HG H 11.153 -11.415 -3.763 1.00 . A A . 26 LEU HG 1 1 9 6977 1 1 26 LEU N N 12.850 -9.357 -4.439 1.00 . A A . 26 LEU N 1 1 9 6978 1 1 26 LEU O O 11.761 -8.457 -7.704 1.00 . A A . 26 LEU O 1 1 9 6979 1 1 27 ASP C C 11.542 -5.501 -6.875 1.00 . A A . 27 ASP C 1 1 9 6980 1 1 27 ASP CA C 12.895 -6.097 -6.610 1.00 . A A . 27 ASP CA 1 1 9 6981 1 1 27 ASP CB C 13.706 -6.258 -7.901 1.00 . A A . 27 ASP CB 1 1 9 6982 1 1 27 ASP CG C 14.254 -4.938 -8.413 1.00 . A A . 27 ASP CG 1 1 9 6983 1 1 27 ASP H H 12.846 -7.423 -4.966 1.00 . A A . 27 ASP H 1 1 9 6984 1 1 27 ASP HA H 13.432 -5.450 -5.929 1.00 . A A . 27 ASP HA 1 1 9 6985 1 1 27 ASP HB2 H 14.536 -6.923 -7.710 1.00 . A A . 27 ASP HB2 1 1 9 6986 1 1 27 ASP HB3 H 13.074 -6.686 -8.665 1.00 . A A . 27 ASP HB3 1 1 9 6987 1 1 27 ASP N N 12.691 -7.371 -5.939 1.00 . A A . 27 ASP N 1 1 9 6988 1 1 27 ASP O O 11.142 -5.259 -8.012 1.00 . A A . 27 ASP O 1 1 9 6989 1 1 27 ASP OD1 O 15.269 -4.450 -7.872 1.00 . A A . 27 ASP OD1 1 1 9 6990 1 1 27 ASP OD2 O 13.668 -4.376 -9.364 1.00 . A A . 27 ASP OD2 1 1 9 6991 1 1 28 LYS C C 9.305 -3.389 -5.609 1.00 . A A . 28 LYS C 1 1 9 6992 1 1 28 LYS CA C 9.448 -4.878 -5.870 1.00 . A A . 28 LYS CA 1 1 9 6993 1 1 28 LYS CB C 8.577 -5.716 -4.928 1.00 . A A . 28 LYS CB 1 1 9 6994 1 1 28 LYS CD C 7.596 -7.995 -4.433 1.00 . A A . 28 LYS CD 1 1 9 6995 1 1 28 LYS CE C 6.195 -7.444 -4.228 1.00 . A A . 28 LYS CE 1 1 9 6996 1 1 28 LYS CG C 8.410 -7.154 -5.404 1.00 . A A . 28 LYS CG 1 1 9 6997 1 1 28 LYS H H 11.266 -5.403 -4.888 1.00 . A A . 28 LYS H 1 1 9 6998 1 1 28 LYS HA H 9.123 -5.065 -6.884 1.00 . A A . 28 LYS HA 1 1 9 6999 1 1 28 LYS HB2 H 9.032 -5.731 -3.949 1.00 . A A . 28 LYS HB2 1 1 9 7000 1 1 28 LYS HB3 H 7.599 -5.264 -4.860 1.00 . A A . 28 LYS HB3 1 1 9 7001 1 1 28 LYS HD2 H 7.519 -9.001 -4.822 1.00 . A A . 28 LYS HD2 1 1 9 7002 1 1 28 LYS HD3 H 8.107 -8.018 -3.480 1.00 . A A . 28 LYS HD3 1 1 9 7003 1 1 28 LYS HE2 H 6.266 -6.410 -3.917 1.00 . A A . 28 LYS HE2 1 1 9 7004 1 1 28 LYS HE3 H 5.653 -7.503 -5.161 1.00 . A A . 28 LYS HE3 1 1 9 7005 1 1 28 LYS HG2 H 7.910 -7.149 -6.360 1.00 . A A . 28 LYS HG2 1 1 9 7006 1 1 28 LYS HG3 H 9.390 -7.598 -5.512 1.00 . A A . 28 LYS HG3 1 1 9 7007 1 1 28 LYS HZ1 H 5.971 -8.164 -2.276 1.00 . A A . 28 LYS HZ1 1 1 9 7008 1 1 28 LYS HZ2 H 5.370 -9.213 -3.473 1.00 . A A . 28 LYS HZ2 1 1 9 7009 1 1 28 LYS HZ3 H 4.502 -7.814 -3.059 1.00 . A A . 28 LYS HZ3 1 1 9 7010 1 1 28 LYS N N 10.832 -5.286 -5.792 1.00 . A A . 28 LYS N 1 1 9 7011 1 1 28 LYS NZ N 5.456 -8.211 -3.190 1.00 . A A . 28 LYS NZ 1 1 9 7012 1 1 28 LYS O O 10.279 -2.705 -5.313 1.00 . A A . 28 LYS O 1 1 9 7013 1 1 29 TYR C C 6.313 -1.278 -5.627 1.00 . A A . 29 TYR C 1 1 9 7014 1 1 29 TYR CA C 7.810 -1.475 -5.771 1.00 . A A . 29 TYR CA 1 1 9 7015 1 1 29 TYR CB C 8.299 -0.789 -7.050 1.00 . A A . 29 TYR CB 1 1 9 7016 1 1 29 TYR CD1 C 9.465 1.310 -6.260 1.00 . A A . 29 TYR CD1 1 1 9 7017 1 1 29 TYR CD2 C 10.773 -0.372 -7.325 1.00 . A A . 29 TYR CD2 1 1 9 7018 1 1 29 TYR CE1 C 10.593 2.096 -6.106 1.00 . A A . 29 TYR CE1 1 1 9 7019 1 1 29 TYR CE2 C 11.904 0.407 -7.174 1.00 . A A . 29 TYR CE2 1 1 9 7020 1 1 29 TYR CG C 9.537 0.063 -6.870 1.00 . A A . 29 TYR CG 1 1 9 7021 1 1 29 TYR CZ C 11.810 1.640 -6.565 1.00 . A A . 29 TYR CZ 1 1 9 7022 1 1 29 TYR H H 7.362 -3.519 -5.891 1.00 . A A . 29 TYR H 1 1 9 7023 1 1 29 TYR HA H 8.310 -1.043 -4.919 1.00 . A A . 29 TYR HA 1 1 9 7024 1 1 29 TYR HB2 H 8.525 -1.545 -7.788 1.00 . A A . 29 TYR HB2 1 1 9 7025 1 1 29 TYR HB3 H 7.511 -0.154 -7.429 1.00 . A A . 29 TYR HB3 1 1 9 7026 1 1 29 TYR HD1 H 8.510 1.665 -5.898 1.00 . A A . 29 TYR HD1 1 1 9 7027 1 1 29 TYR HD2 H 10.846 -1.337 -7.801 1.00 . A A . 29 TYR HD2 1 1 9 7028 1 1 29 TYR HE1 H 10.516 3.062 -5.630 1.00 . A A . 29 TYR HE1 1 1 9 7029 1 1 29 TYR HE2 H 12.858 0.049 -7.534 1.00 . A A . 29 TYR HE2 1 1 9 7030 1 1 29 TYR HH H 13.469 2.365 -7.216 1.00 . A A . 29 TYR HH 1 1 9 7031 1 1 29 TYR N N 8.103 -2.896 -5.797 1.00 . A A . 29 TYR N 1 1 9 7032 1 1 29 TYR O O 5.556 -1.442 -6.585 1.00 . A A . 29 TYR O 1 1 9 7033 1 1 29 TYR OH O 12.936 2.420 -6.414 1.00 . A A . 29 TYR OH 1 1 9 7034 1 1 30 ALA C C 4.342 0.048 -2.847 1.00 . A A . 30 ALA C 1 1 9 7035 1 1 30 ALA CA C 4.491 -0.745 -4.128 1.00 . A A . 30 ALA CA 1 1 9 7036 1 1 30 ALA CB C 3.774 -2.085 -4.009 1.00 . A A . 30 ALA CB 1 1 9 7037 1 1 30 ALA H H 6.549 -0.826 -3.703 1.00 . A A . 30 ALA H 1 1 9 7038 1 1 30 ALA HA H 4.049 -0.192 -4.942 1.00 . A A . 30 ALA HA 1 1 9 7039 1 1 30 ALA HB1 H 2.719 -1.916 -3.849 1.00 . A A . 30 ALA HB1 1 1 9 7040 1 1 30 ALA HB2 H 3.911 -2.649 -4.921 1.00 . A A . 30 ALA HB2 1 1 9 7041 1 1 30 ALA HB3 H 4.180 -2.641 -3.177 1.00 . A A . 30 ALA HB3 1 1 9 7042 1 1 30 ALA N N 5.893 -0.940 -4.425 1.00 . A A . 30 ALA N 1 1 9 7043 1 1 30 ALA O O 5.301 0.213 -2.087 1.00 . A A . 30 ALA O 1 1 9 7044 1 1 31 CYS C C 1.443 1.059 -0.978 1.00 . A A . 31 CYS C 1 1 9 7045 1 1 31 CYS CA C 2.883 1.284 -1.401 1.00 . A A . 31 CYS CA 1 1 9 7046 1 1 31 CYS CB C 3.197 2.771 -1.586 1.00 . A A . 31 CYS CB 1 1 9 7047 1 1 31 CYS H H 2.420 0.385 -3.237 1.00 . A A . 31 CYS H 1 1 9 7048 1 1 31 CYS HA H 3.529 0.888 -0.630 1.00 . A A . 31 CYS HA 1 1 9 7049 1 1 31 CYS HB2 H 3.045 3.281 -0.648 1.00 . A A . 31 CYS HB2 1 1 9 7050 1 1 31 CYS HB3 H 4.232 2.875 -1.880 1.00 . A A . 31 CYS HB3 1 1 9 7051 1 1 31 CYS N N 3.149 0.544 -2.606 1.00 . A A . 31 CYS N 1 1 9 7052 1 1 31 CYS O O 0.523 1.286 -1.749 1.00 . A A . 31 CYS O 1 1 9 7053 1 1 31 CYS SG S 2.182 3.618 -2.836 1.00 . A A . 31 CYS SG 1 1 9 7054 1 1 32 ASN C C -0.723 1.253 1.479 1.00 . A A . 32 ASN C 1 1 9 7055 1 1 32 ASN CA C -0.022 0.154 0.720 1.00 . A A . 32 ASN CA 1 1 9 7056 1 1 32 ASN CB C 0.190 -1.065 1.617 1.00 . A A . 32 ASN CB 1 1 9 7057 1 1 32 ASN CG C -1.097 -1.810 1.937 1.00 . A A . 32 ASN CG 1 1 9 7058 1 1 32 ASN H H 1.993 0.708 0.894 1.00 . A A . 32 ASN H 1 1 9 7059 1 1 32 ASN HA H -0.611 -0.125 -0.140 1.00 . A A . 32 ASN HA 1 1 9 7060 1 1 32 ASN HB2 H 0.862 -1.750 1.118 1.00 . A A . 32 ASN HB2 1 1 9 7061 1 1 32 ASN HB3 H 0.640 -0.744 2.546 1.00 . A A . 32 ASN HB3 1 1 9 7062 1 1 32 ASN HD21 H -0.062 -3.464 2.289 1.00 . A A . 32 ASN HD21 1 1 9 7063 1 1 32 ASN HD22 H -1.776 -3.598 2.484 1.00 . A A . 32 ASN HD22 1 1 9 7064 1 1 32 ASN N N 1.255 0.652 0.261 1.00 . A A . 32 ASN N 1 1 9 7065 1 1 32 ASN ND2 N -0.965 -3.084 2.267 1.00 . A A . 32 ASN ND2 1 1 9 7066 1 1 32 ASN O O -0.359 1.600 2.596 1.00 . A A . 32 ASN O 1 1 9 7067 1 1 32 ASN OD1 O -2.194 -1.250 1.899 1.00 . A A . 32 ASN OD1 1 1 9 7068 1 1 33 CYS C C -3.420 2.631 2.401 1.00 . A A . 33 CYS C 1 1 9 7069 1 1 33 CYS CA C -2.408 2.972 1.317 1.00 . A A . 33 CYS CA 1 1 9 7070 1 1 33 CYS CB C -3.101 3.652 0.151 1.00 . A A . 33 CYS CB 1 1 9 7071 1 1 33 CYS H H -1.947 1.457 -0.053 1.00 . A A . 33 CYS H 1 1 9 7072 1 1 33 CYS HA H -1.682 3.653 1.729 1.00 . A A . 33 CYS HA 1 1 9 7073 1 1 33 CYS HB2 H -3.507 2.880 -0.503 1.00 . A A . 33 CYS HB2 1 1 9 7074 1 1 33 CYS HB3 H -3.904 4.275 0.518 1.00 . A A . 33 CYS HB3 1 1 9 7075 1 1 33 CYS N N -1.701 1.821 0.819 1.00 . A A . 33 CYS N 1 1 9 7076 1 1 33 CYS O O -3.065 2.424 3.557 1.00 . A A . 33 CYS O 1 1 9 7077 1 1 33 CYS SG S -2.003 4.677 -0.860 1.00 . A A . 33 CYS SG 1 1 9 7078 1 1 34 VAL C C -6.591 1.260 2.657 1.00 . A A . 34 VAL C 1 1 9 7079 1 1 34 VAL CA C -5.749 2.476 2.973 1.00 . A A . 34 VAL CA 1 1 9 7080 1 1 34 VAL CB C -6.601 3.773 2.933 1.00 . A A . 34 VAL CB 1 1 9 7081 1 1 34 VAL CG1 C -7.302 3.925 1.591 1.00 . A A . 34 VAL CG1 1 1 9 7082 1 1 34 VAL CG2 C -7.604 3.823 4.079 1.00 . A A . 34 VAL CG2 1 1 9 7083 1 1 34 VAL H H -4.893 2.508 1.057 1.00 . A A . 34 VAL H 1 1 9 7084 1 1 34 VAL HA H -5.321 2.369 3.960 1.00 . A A . 34 VAL HA 1 1 9 7085 1 1 34 VAL HB H -5.926 4.612 3.046 1.00 . A A . 34 VAL HB 1 1 9 7086 1 1 34 VAL HG11 H -7.951 3.079 1.426 1.00 . A A . 34 VAL HG11 1 1 9 7087 1 1 34 VAL HG12 H -7.888 4.833 1.590 1.00 . A A . 34 VAL HG12 1 1 9 7088 1 1 34 VAL HG13 H -6.564 3.971 0.802 1.00 . A A . 34 VAL HG13 1 1 9 7089 1 1 34 VAL HG21 H -8.275 2.979 4.006 1.00 . A A . 34 VAL HG21 1 1 9 7090 1 1 34 VAL HG22 H -7.077 3.783 5.023 1.00 . A A . 34 VAL HG22 1 1 9 7091 1 1 34 VAL HG23 H -8.172 4.739 4.023 1.00 . A A . 34 VAL HG23 1 1 9 7092 1 1 34 VAL N N -4.677 2.554 2.015 1.00 . A A . 34 VAL N 1 1 9 7093 1 1 34 VAL O O -6.605 0.798 1.509 1.00 . A A . 34 VAL O 1 1 9 7094 1 1 35 VAL C C -9.304 -0.256 2.616 1.00 . A A . 35 VAL C 1 1 9 7095 1 1 35 VAL CA C -8.082 -0.471 3.510 1.00 . A A . 35 VAL CA 1 1 9 7096 1 1 35 VAL CB C -8.548 -1.005 4.874 1.00 . A A . 35 VAL CB 1 1 9 7097 1 1 35 VAL CG1 C -7.359 -1.495 5.687 1.00 . A A . 35 VAL CG1 1 1 9 7098 1 1 35 VAL CG2 C -9.324 0.059 5.642 1.00 . A A . 35 VAL CG2 1 1 9 7099 1 1 35 VAL H H -7.228 1.167 4.548 1.00 . A A . 35 VAL H 1 1 9 7100 1 1 35 VAL HA H -7.456 -1.227 3.058 1.00 . A A . 35 VAL HA 1 1 9 7101 1 1 35 VAL HB H -9.208 -1.842 4.697 1.00 . A A . 35 VAL HB 1 1 9 7102 1 1 35 VAL HG11 H -6.657 -0.686 5.826 1.00 . A A . 35 VAL HG11 1 1 9 7103 1 1 35 VAL HG12 H -7.704 -1.841 6.652 1.00 . A A . 35 VAL HG12 1 1 9 7104 1 1 35 VAL HG13 H -6.876 -2.308 5.165 1.00 . A A . 35 VAL HG13 1 1 9 7105 1 1 35 VAL HG21 H -8.687 0.915 5.818 1.00 . A A . 35 VAL HG21 1 1 9 7106 1 1 35 VAL HG22 H -10.184 0.365 5.062 1.00 . A A . 35 VAL HG22 1 1 9 7107 1 1 35 VAL HG23 H -9.652 -0.347 6.587 1.00 . A A . 35 VAL HG23 1 1 9 7108 1 1 35 VAL N N -7.277 0.734 3.660 1.00 . A A . 35 VAL N 1 1 9 7109 1 1 35 VAL O O -10.319 -0.931 2.767 1.00 . A A . 35 VAL O 1 1 9 7110 1 1 36 GLY C C -9.765 1.386 -0.583 1.00 . A A . 36 GLY C 1 1 9 7111 1 1 36 GLY CA C -10.263 0.998 0.784 1.00 . A A . 36 GLY CA 1 1 9 7112 1 1 36 GLY H H -8.278 1.047 1.500 1.00 . A A . 36 GLY H 1 1 9 7113 1 1 36 GLY HA2 H -10.937 0.158 0.692 1.00 . A A . 36 GLY HA2 1 1 9 7114 1 1 36 GLY HA3 H -10.793 1.834 1.215 1.00 . A A . 36 GLY HA3 1 1 9 7115 1 1 36 GLY N N -9.164 0.636 1.647 1.00 . A A . 36 GLY N 1 1 9 7116 1 1 36 GLY O O -10.545 1.693 -1.481 1.00 . A A . 36 GLY O 1 1 9 7117 1 1 37 TYR C C -6.465 0.979 -2.111 1.00 . A A . 37 TYR C 1 1 9 7118 1 1 37 TYR CA C -7.800 1.699 -1.980 1.00 . A A . 37 TYR CA 1 1 9 7119 1 1 37 TYR CB C -7.540 3.210 -2.055 1.00 . A A . 37 TYR CB 1 1 9 7120 1 1 37 TYR CD1 C -9.398 4.122 -3.505 1.00 . A A . 37 TYR CD1 1 1 9 7121 1 1 37 TYR CD2 C -9.317 4.801 -1.221 1.00 . A A . 37 TYR CD2 1 1 9 7122 1 1 37 TYR CE1 C -10.528 4.891 -3.698 1.00 . A A . 37 TYR CE1 1 1 9 7123 1 1 37 TYR CE2 C -10.446 5.573 -1.406 1.00 . A A . 37 TYR CE2 1 1 9 7124 1 1 37 TYR CG C -8.772 4.064 -2.266 1.00 . A A . 37 TYR CG 1 1 9 7125 1 1 37 TYR CZ C -11.019 5.653 -2.662 1.00 . A A . 37 TYR CZ 1 1 9 7126 1 1 37 TYR H H -7.898 1.033 -0.003 1.00 . A A . 37 TYR H 1 1 9 7127 1 1 37 TYR HA H -8.446 1.404 -2.797 1.00 . A A . 37 TYR HA 1 1 9 7128 1 1 37 TYR HB2 H -7.078 3.528 -1.134 1.00 . A A . 37 TYR HB2 1 1 9 7129 1 1 37 TYR HB3 H -6.858 3.400 -2.876 1.00 . A A . 37 TYR HB3 1 1 9 7130 1 1 37 TYR HD1 H -8.988 3.555 -4.328 1.00 . A A . 37 TYR HD1 1 1 9 7131 1 1 37 TYR HD2 H -8.842 4.768 -0.251 1.00 . A A . 37 TYR HD2 1 1 9 7132 1 1 37 TYR HE1 H -11.000 4.927 -4.670 1.00 . A A . 37 TYR HE1 1 1 9 7133 1 1 37 TYR HE2 H -10.853 6.139 -0.581 1.00 . A A . 37 TYR HE2 1 1 9 7134 1 1 37 TYR HH H -12.044 7.256 -2.444 1.00 . A A . 37 TYR HH 1 1 9 7135 1 1 37 TYR N N -8.445 1.341 -0.738 1.00 . A A . 37 TYR N 1 1 9 7136 1 1 37 TYR O O -5.489 1.335 -1.455 1.00 . A A . 37 TYR O 1 1 9 7137 1 1 37 TYR OH O -12.180 6.375 -2.830 1.00 . A A . 37 TYR OH 1 1 9 7138 1 1 38 ILE C C -5.345 -0.963 -4.894 1.00 . A A . 38 ILE C 1 1 9 7139 1 1 38 ILE CA C -5.195 -0.621 -3.408 1.00 . A A . 38 ILE CA 1 1 9 7140 1 1 38 ILE CB C -4.730 -1.849 -2.579 1.00 . A A . 38 ILE CB 1 1 9 7141 1 1 38 ILE CD1 C -2.777 -2.675 -1.163 1.00 . A A . 38 ILE CD1 1 1 9 7142 1 1 38 ILE CG1 C -3.302 -1.607 -2.101 1.00 . A A . 38 ILE CG1 1 1 9 7143 1 1 38 ILE CG2 C -4.810 -3.154 -3.367 1.00 . A A . 38 ILE CG2 1 1 9 7144 1 1 38 ILE H H -7.288 -0.476 -3.195 1.00 . A A . 38 ILE H 1 1 9 7145 1 1 38 ILE HA H -4.449 0.155 -3.300 1.00 . A A . 38 ILE HA 1 1 9 7146 1 1 38 ILE HB H -5.372 -1.936 -1.723 1.00 . A A . 38 ILE HB 1 1 9 7147 1 1 38 ILE HD11 H -2.809 -3.635 -1.657 1.00 . A A . 38 ILE HD11 1 1 9 7148 1 1 38 ILE HD12 H -1.760 -2.444 -0.888 1.00 . A A . 38 ILE HD12 1 1 9 7149 1 1 38 ILE HD13 H -3.390 -2.710 -0.274 1.00 . A A . 38 ILE HD13 1 1 9 7150 1 1 38 ILE HG12 H -2.648 -1.573 -2.960 1.00 . A A . 38 ILE HG12 1 1 9 7151 1 1 38 ILE HG13 H -3.264 -0.656 -1.589 1.00 . A A . 38 ILE HG13 1 1 9 7152 1 1 38 ILE HG21 H -4.493 -3.973 -2.736 1.00 . A A . 38 ILE HG21 1 1 9 7153 1 1 38 ILE HG22 H -5.827 -3.319 -3.687 1.00 . A A . 38 ILE HG22 1 1 9 7154 1 1 38 ILE HG23 H -4.163 -3.094 -4.231 1.00 . A A . 38 ILE HG23 1 1 9 7155 1 1 38 ILE N N -6.441 -0.060 -2.925 1.00 . A A . 38 ILE N 1 1 9 7156 1 1 38 ILE O O -6.293 -1.601 -5.297 1.00 . A A . 38 ILE O 1 1 9 7157 1 1 39 GLY C C -3.254 -0.598 -7.800 1.00 . A A . 39 GLY C 1 1 9 7158 1 1 39 GLY CA C -4.588 -0.689 -7.140 1.00 . A A . 39 GLY CA 1 1 9 7159 1 1 39 GLY H H -3.684 0.014 -5.362 1.00 . A A . 39 GLY H 1 1 9 7160 1 1 39 GLY HA2 H -5.008 -1.669 -7.314 1.00 . A A . 39 GLY HA2 1 1 9 7161 1 1 39 GLY HA3 H -5.245 0.061 -7.557 1.00 . A A . 39 GLY HA3 1 1 9 7162 1 1 39 GLY N N -4.455 -0.474 -5.714 1.00 . A A . 39 GLY N 1 1 9 7163 1 1 39 GLY O O -2.704 0.501 -7.927 1.00 . A A . 39 GLY O 1 1 9 7164 1 1 40 GLU C C -0.432 -1.748 -7.394 1.00 . A A . 40 GLU C 1 1 9 7165 1 1 40 GLU CA C -1.329 -1.905 -8.600 1.00 . A A . 40 GLU CA 1 1 9 7166 1 1 40 GLU CB C -0.979 -0.879 -9.682 1.00 . A A . 40 GLU CB 1 1 9 7167 1 1 40 GLU CD C 0.930 -2.241 -10.646 1.00 . A A . 40 GLU CD 1 1 9 7168 1 1 40 GLU CG C 0.487 -0.897 -10.096 1.00 . A A . 40 GLU CG 1 1 9 7169 1 1 40 GLU H H -3.248 -2.574 -8.053 1.00 . A A . 40 GLU H 1 1 9 7170 1 1 40 GLU HA H -1.212 -2.898 -8.991 1.00 . A A . 40 GLU HA 1 1 9 7171 1 1 40 GLU HB2 H -1.583 -1.075 -10.555 1.00 . A A . 40 GLU HB2 1 1 9 7172 1 1 40 GLU HB3 H -1.216 0.110 -9.303 1.00 . A A . 40 GLU HB3 1 1 9 7173 1 1 40 GLU HG2 H 0.640 -0.148 -10.858 1.00 . A A . 40 GLU HG2 1 1 9 7174 1 1 40 GLU HG3 H 1.093 -0.662 -9.229 1.00 . A A . 40 GLU HG3 1 1 9 7175 1 1 40 GLU N N -2.708 -1.763 -8.148 1.00 . A A . 40 GLU N 1 1 9 7176 1 1 40 GLU O O 0.451 -2.557 -7.122 1.00 . A A . 40 GLU O 1 1 9 7177 1 1 40 GLU OE1 O 0.292 -2.736 -11.600 1.00 . A A . 40 GLU OE1 1 1 9 7178 1 1 40 GLU OE2 O 1.920 -2.805 -10.133 1.00 . A A . 40 GLU OE2 1 1 9 7179 1 1 41 ARG C C -1.038 0.229 -4.428 1.00 . A A . 41 ARG C 1 1 9 7180 1 1 41 ARG CA C -0.067 -0.429 -5.418 1.00 . A A . 41 ARG CA 1 1 9 7181 1 1 41 ARG CB C 1.191 0.410 -5.660 1.00 . A A . 41 ARG CB 1 1 9 7182 1 1 41 ARG CD C 0.418 2.792 -6.072 1.00 . A A . 41 ARG CD 1 1 9 7183 1 1 41 ARG CG C 1.013 1.531 -6.677 1.00 . A A . 41 ARG CG 1 1 9 7184 1 1 41 ARG CZ C 0.975 4.893 -7.251 1.00 . A A . 41 ARG CZ 1 1 9 7185 1 1 41 ARG H H -1.356 -0.055 -7.023 1.00 . A A . 41 ARG H 1 1 9 7186 1 1 41 ARG HA H 0.233 -1.382 -5.010 1.00 . A A . 41 ARG HA 1 1 9 7187 1 1 41 ARG HB2 H 1.510 0.842 -4.725 1.00 . A A . 41 ARG HB2 1 1 9 7188 1 1 41 ARG HB3 H 1.964 -0.250 -6.029 1.00 . A A . 41 ARG HB3 1 1 9 7189 1 1 41 ARG HD2 H -0.530 2.545 -5.613 1.00 . A A . 41 ARG HD2 1 1 9 7190 1 1 41 ARG HD3 H 1.096 3.175 -5.322 1.00 . A A . 41 ARG HD3 1 1 9 7191 1 1 41 ARG HE H -0.564 3.685 -7.706 1.00 . A A . 41 ARG HE 1 1 9 7192 1 1 41 ARG HG2 H 1.977 1.773 -7.096 1.00 . A A . 41 ARG HG2 1 1 9 7193 1 1 41 ARG HG3 H 0.357 1.180 -7.463 1.00 . A A . 41 ARG HG3 1 1 9 7194 1 1 41 ARG HH11 H 2.202 4.484 -5.692 1.00 . A A . 41 ARG HH11 1 1 9 7195 1 1 41 ARG HH12 H 2.589 5.926 -6.583 1.00 . A A . 41 ARG HH12 1 1 9 7196 1 1 41 ARG HH21 H -0.049 5.599 -8.853 1.00 . A A . 41 ARG HH21 1 1 9 7197 1 1 41 ARG HH22 H 1.312 6.554 -8.359 1.00 . A A . 41 ARG HH22 1 1 9 7198 1 1 41 ARG N N -0.704 -0.692 -6.672 1.00 . A A . 41 ARG N 1 1 9 7199 1 1 41 ARG NE N 0.203 3.818 -7.090 1.00 . A A . 41 ARG NE 1 1 9 7200 1 1 41 ARG NH1 N 2.000 5.117 -6.438 1.00 . A A . 41 ARG NH1 1 1 9 7201 1 1 41 ARG NH2 N 0.722 5.751 -8.231 1.00 . A A . 41 ARG NH2 1 1 9 7202 1 1 41 ARG O O -0.987 -0.065 -3.247 1.00 . A A . 41 ARG O 1 1 9 7203 1 1 42 CYS C C -3.820 2.677 -4.847 1.00 . A A . 42 CYS C 1 1 9 7204 1 1 42 CYS CA C -2.794 1.873 -4.050 1.00 . A A . 42 CYS CA 1 1 9 7205 1 1 42 CYS CB C -1.900 2.829 -3.251 1.00 . A A . 42 CYS CB 1 1 9 7206 1 1 42 CYS H H -2.144 1.089 -5.862 1.00 . A A . 42 CYS H 1 1 9 7207 1 1 42 CYS HA H -3.315 1.219 -3.367 1.00 . A A . 42 CYS HA 1 1 9 7208 1 1 42 CYS HB2 H -1.549 2.322 -2.364 1.00 . A A . 42 CYS HB2 1 1 9 7209 1 1 42 CYS HB3 H -1.051 3.106 -3.858 1.00 . A A . 42 CYS HB3 1 1 9 7210 1 1 42 CYS N N -1.976 1.051 -4.917 1.00 . A A . 42 CYS N 1 1 9 7211 1 1 42 CYS O O -3.443 3.608 -5.556 1.00 . A A . 42 CYS O 1 1 9 7212 1 1 42 CYS SG S -2.721 4.368 -2.721 1.00 . A A . 42 CYS SG 1 1 9 7213 1 1 43 GLN C C -7.373 2.294 -5.776 1.00 . A A . 43 GLN C 1 1 9 7214 1 1 43 GLN CA C -6.294 3.017 -5.005 1.00 . A A . 43 GLN CA 1 1 9 7215 1 1 43 GLN CB C -6.041 4.397 -5.593 1.00 . A A . 43 GLN CB 1 1 9 7216 1 1 43 GLN CD C -5.305 6.764 -5.066 1.00 . A A . 43 GLN CD 1 1 9 7217 1 1 43 GLN CG C -5.657 5.391 -4.522 1.00 . A A . 43 GLN CG 1 1 9 7218 1 1 43 GLN H H -5.199 1.215 -4.743 1.00 . A A . 43 GLN H 1 1 9 7219 1 1 43 GLN HA H -6.683 3.162 -4.005 1.00 . A A . 43 GLN HA 1 1 9 7220 1 1 43 GLN HB2 H -5.232 4.337 -6.304 1.00 . A A . 43 GLN HB2 1 1 9 7221 1 1 43 GLN HB3 H -6.932 4.747 -6.086 1.00 . A A . 43 GLN HB3 1 1 9 7222 1 1 43 GLN HE21 H -4.768 5.978 -6.809 1.00 . A A . 43 GLN HE21 1 1 9 7223 1 1 43 GLN HE22 H -4.617 7.699 -6.681 1.00 . A A . 43 GLN HE22 1 1 9 7224 1 1 43 GLN HG2 H -6.487 5.496 -3.837 1.00 . A A . 43 GLN HG2 1 1 9 7225 1 1 43 GLN HG3 H -4.808 4.985 -3.993 1.00 . A A . 43 GLN HG3 1 1 9 7226 1 1 43 GLN N N -5.079 2.192 -4.829 1.00 . A A . 43 GLN N 1 1 9 7227 1 1 43 GLN NE2 N -4.853 6.818 -6.309 1.00 . A A . 43 GLN NE2 1 1 9 7228 1 1 43 GLN O O -7.893 2.789 -6.770 1.00 . A A . 43 GLN O 1 1 9 7229 1 1 43 GLN OE1 O -5.462 7.772 -4.378 1.00 . A A . 43 GLN OE1 1 1 9 7230 1 1 44 TYR C C -9.265 -0.685 -4.724 1.00 . A A . 44 TYR C 1 1 9 7231 1 1 44 TYR CA C -8.870 0.378 -5.739 1.00 . A A . 44 TYR CA 1 1 9 7232 1 1 44 TYR CB C -8.630 -0.261 -7.114 1.00 . A A . 44 TYR CB 1 1 9 7233 1 1 44 TYR CD1 C -10.835 0.228 -8.245 1.00 . A A . 44 TYR CD1 1 1 9 7234 1 1 44 TYR CD2 C -8.843 1.074 -9.241 1.00 . A A . 44 TYR CD2 1 1 9 7235 1 1 44 TYR CE1 C -11.586 0.786 -9.262 1.00 . A A . 44 TYR CE1 1 1 9 7236 1 1 44 TYR CE2 C -9.585 1.637 -10.260 1.00 . A A . 44 TYR CE2 1 1 9 7237 1 1 44 TYR CG C -9.454 0.362 -8.217 1.00 . A A . 44 TYR CG 1 1 9 7238 1 1 44 TYR CZ C -10.988 1.525 -10.222 1.00 . A A . 44 TYR CZ 1 1 9 7239 1 1 44 TYR H H -7.103 0.699 -4.613 1.00 . A A . 44 TYR H 1 1 9 7240 1 1 44 TYR HA H -9.687 1.083 -5.818 1.00 . A A . 44 TYR HA 1 1 9 7241 1 1 44 TYR HB2 H -7.588 -0.151 -7.375 1.00 . A A . 44 TYR HB2 1 1 9 7242 1 1 44 TYR HB3 H -8.877 -1.312 -7.063 1.00 . A A . 44 TYR HB3 1 1 9 7243 1 1 44 TYR HD1 H -11.324 -0.325 -7.455 1.00 . A A . 44 TYR HD1 1 1 9 7244 1 1 44 TYR HD2 H -7.771 1.188 -9.233 1.00 . A A . 44 TYR HD2 1 1 9 7245 1 1 44 TYR HE1 H -12.659 0.671 -9.266 1.00 . A A . 44 TYR HE1 1 1 9 7246 1 1 44 TYR HE2 H -9.091 2.186 -11.048 1.00 . A A . 44 TYR HE2 1 1 9 7247 1 1 44 TYR HH H -11.333 1.753 -12.145 1.00 . A A . 44 TYR HH 1 1 9 7248 1 1 44 TYR N N -7.695 1.109 -5.287 1.00 . A A . 44 TYR N 1 1 9 7249 1 1 44 TYR O O -8.439 -1.433 -4.233 1.00 . A A . 44 TYR O 1 1 9 7250 1 1 44 TYR OH O -11.698 2.043 -11.290 1.00 . A A . 44 TYR OH 1 1 9 7251 1 1 45 ARG C C -10.667 -1.752 -2.111 1.00 . A A . 45 ARG C 1 1 9 7252 1 1 45 ARG CA C -11.059 -1.813 -3.572 1.00 . A A . 45 ARG CA 1 1 9 7253 1 1 45 ARG CB C -10.656 -3.185 -4.131 1.00 . A A . 45 ARG CB 1 1 9 7254 1 1 45 ARG CD C -10.308 -3.135 -6.614 1.00 . A A . 45 ARG CD 1 1 9 7255 1 1 45 ARG CG C -11.250 -3.519 -5.487 1.00 . A A . 45 ARG CG 1 1 9 7256 1 1 45 ARG CZ C -8.476 -4.347 -7.736 1.00 . A A . 45 ARG CZ 1 1 9 7257 1 1 45 ARG H H -11.131 -0.009 -4.679 1.00 . A A . 45 ARG H 1 1 9 7258 1 1 45 ARG HA H -12.116 -1.725 -3.609 1.00 . A A . 45 ARG HA 1 1 9 7259 1 1 45 ARG HB2 H -9.573 -3.197 -4.232 1.00 . A A . 45 ARG HB2 1 1 9 7260 1 1 45 ARG HB3 H -10.953 -3.950 -3.429 1.00 . A A . 45 ARG HB3 1 1 9 7261 1 1 45 ARG HD2 H -10.820 -3.261 -7.555 1.00 . A A . 45 ARG HD2 1 1 9 7262 1 1 45 ARG HD3 H -10.029 -2.095 -6.490 1.00 . A A . 45 ARG HD3 1 1 9 7263 1 1 45 ARG HE H -8.700 -4.190 -5.752 1.00 . A A . 45 ARG HE 1 1 9 7264 1 1 45 ARG HG2 H -11.440 -4.580 -5.537 1.00 . A A . 45 ARG HG2 1 1 9 7265 1 1 45 ARG HG3 H -12.177 -2.977 -5.606 1.00 . A A . 45 ARG HG3 1 1 9 7266 1 1 45 ARG HH11 H -9.858 -3.542 -8.997 1.00 . A A . 45 ARG HH11 1 1 9 7267 1 1 45 ARG HH12 H -8.528 -4.358 -9.762 1.00 . A A . 45 ARG HH12 1 1 9 7268 1 1 45 ARG HH21 H -6.965 -5.275 -6.745 1.00 . A A . 45 ARG HH21 1 1 9 7269 1 1 45 ARG HH22 H -6.883 -5.366 -8.487 1.00 . A A . 45 ARG HH22 1 1 9 7270 1 1 45 ARG N N -10.525 -0.728 -4.381 1.00 . A A . 45 ARG N 1 1 9 7271 1 1 45 ARG NE N -9.091 -3.945 -6.623 1.00 . A A . 45 ARG NE 1 1 9 7272 1 1 45 ARG NH1 N -8.993 -4.061 -8.928 1.00 . A A . 45 ARG NH1 1 1 9 7273 1 1 45 ARG NH2 N -7.354 -5.049 -7.651 1.00 . A A . 45 ARG NH2 1 1 9 7274 1 1 45 ARG O O -9.548 -1.384 -1.729 1.00 . A A . 45 ARG O 1 1 9 7275 1 1 46 ASP C C -11.128 -3.757 0.444 1.00 . A A . 46 ASP C 1 1 9 7276 1 1 46 ASP CA C -11.443 -2.305 0.121 1.00 . A A . 46 ASP CA 1 1 9 7277 1 1 46 ASP CB C -12.732 -1.885 0.830 1.00 . A A . 46 ASP CB 1 1 9 7278 1 1 46 ASP CG C -13.204 -0.497 0.438 1.00 . A A . 46 ASP CG 1 1 9 7279 1 1 46 ASP H H -12.473 -2.459 -1.699 1.00 . A A . 46 ASP H 1 1 9 7280 1 1 46 ASP HA H -10.625 -1.671 0.432 1.00 . A A . 46 ASP HA 1 1 9 7281 1 1 46 ASP HB2 H -13.515 -2.589 0.583 1.00 . A A . 46 ASP HB2 1 1 9 7282 1 1 46 ASP HB3 H -12.567 -1.899 1.897 1.00 . A A . 46 ASP HB3 1 1 9 7283 1 1 46 ASP N N -11.611 -2.191 -1.307 1.00 . A A . 46 ASP N 1 1 9 7284 1 1 46 ASP O O -11.438 -4.248 1.523 1.00 . A A . 46 ASP O 1 1 9 7285 1 1 46 ASP OD1 O -13.597 -0.308 -0.728 1.00 . A A . 46 ASP OD1 1 1 9 7286 1 1 46 ASP OD2 O -13.171 0.413 1.293 1.00 . A A . 46 ASP OD2 1 1 9 7287 1 1 47 LEU C C -9.527 -6.361 0.724 1.00 . A A . 47 LEU C 1 1 9 7288 1 1 47 LEU CA C -10.269 -5.871 -0.521 1.00 . A A . 47 LEU CA 1 1 9 7289 1 1 47 LEU CB C -9.531 -6.282 -1.821 1.00 . A A . 47 LEU CB 1 1 9 7290 1 1 47 LEU CD1 C -7.850 -4.356 -1.727 1.00 . A A . 47 LEU CD1 1 1 9 7291 1 1 47 LEU CD2 C -7.094 -6.689 -1.203 1.00 . A A . 47 LEU CD2 1 1 9 7292 1 1 47 LEU CG C -8.058 -5.835 -2.018 1.00 . A A . 47 LEU CG 1 1 9 7293 1 1 47 LEU H H -10.167 -3.912 -1.297 1.00 . A A . 47 LEU H 1 1 9 7294 1 1 47 LEU HA H -11.243 -6.340 -0.527 1.00 . A A . 47 LEU HA 1 1 9 7295 1 1 47 LEU HB2 H -9.558 -7.359 -1.887 1.00 . A A . 47 LEU HB2 1 1 9 7296 1 1 47 LEU HB3 H -10.099 -5.883 -2.652 1.00 . A A . 47 LEU HB3 1 1 9 7297 1 1 47 LEU HD11 H -8.479 -3.769 -2.378 1.00 . A A . 47 LEU HD11 1 1 9 7298 1 1 47 LEU HD12 H -8.108 -4.152 -0.699 1.00 . A A . 47 LEU HD12 1 1 9 7299 1 1 47 LEU HD13 H -6.815 -4.096 -1.896 1.00 . A A . 47 LEU HD13 1 1 9 7300 1 1 47 LEU HD21 H -7.184 -7.723 -1.504 1.00 . A A . 47 LEU HD21 1 1 9 7301 1 1 47 LEU HD22 H -6.082 -6.351 -1.370 1.00 . A A . 47 LEU HD22 1 1 9 7302 1 1 47 LEU HD23 H -7.333 -6.598 -0.153 1.00 . A A . 47 LEU HD23 1 1 9 7303 1 1 47 LEU HG H -7.809 -5.981 -3.058 1.00 . A A . 47 LEU HG 1 1 9 7304 1 1 47 LEU N N -10.496 -4.421 -0.525 1.00 . A A . 47 LEU N 1 1 9 7305 1 1 47 LEU O O -9.493 -7.550 1.017 1.00 . A A . 47 LEU O 1 1 9 7306 1 1 48 LYS C C -9.108 -5.818 3.869 1.00 . A A . 48 LYS C 1 1 9 7307 1 1 48 LYS CA C -8.197 -5.769 2.651 1.00 . A A . 48 LYS CA 1 1 9 7308 1 1 48 LYS CB C -7.091 -4.735 2.837 1.00 . A A . 48 LYS CB 1 1 9 7309 1 1 48 LYS CD C -6.088 -2.608 1.917 1.00 . A A . 48 LYS CD 1 1 9 7310 1 1 48 LYS CE C -5.883 -1.950 0.558 1.00 . A A . 48 LYS CE 1 1 9 7311 1 1 48 LYS CG C -7.249 -3.586 1.870 1.00 . A A . 48 LYS CG 1 1 9 7312 1 1 48 LYS H H -9.057 -4.507 1.203 1.00 . A A . 48 LYS H 1 1 9 7313 1 1 48 LYS HA H -7.750 -6.741 2.506 1.00 . A A . 48 LYS HA 1 1 9 7314 1 1 48 LYS HB2 H -7.127 -4.351 3.846 1.00 . A A . 48 LYS HB2 1 1 9 7315 1 1 48 LYS HB3 H -6.131 -5.201 2.664 1.00 . A A . 48 LYS HB3 1 1 9 7316 1 1 48 LYS HD2 H -6.300 -1.844 2.650 1.00 . A A . 48 LYS HD2 1 1 9 7317 1 1 48 LYS HD3 H -5.190 -3.141 2.190 1.00 . A A . 48 LYS HD3 1 1 9 7318 1 1 48 LYS HE2 H -5.231 -1.095 0.671 1.00 . A A . 48 LYS HE2 1 1 9 7319 1 1 48 LYS HE3 H -5.422 -2.664 -0.108 1.00 . A A . 48 LYS HE3 1 1 9 7320 1 1 48 LYS HG2 H -7.322 -3.984 0.869 1.00 . A A . 48 LYS HG2 1 1 9 7321 1 1 48 LYS HG3 H -8.169 -3.070 2.120 1.00 . A A . 48 LYS HG3 1 1 9 7322 1 1 48 LYS HZ1 H -6.978 -0.976 -0.923 1.00 . A A . 48 LYS HZ1 1 1 9 7323 1 1 48 LYS HZ2 H -7.652 -0.852 0.621 1.00 . A A . 48 LYS HZ2 1 1 9 7324 1 1 48 LYS HZ3 H -7.776 -2.298 -0.242 1.00 . A A . 48 LYS HZ3 1 1 9 7325 1 1 48 LYS N N -8.955 -5.439 1.460 1.00 . A A . 48 LYS N 1 1 9 7326 1 1 48 LYS NZ N -7.162 -1.487 -0.037 1.00 . A A . 48 LYS NZ 1 1 9 7327 1 1 48 LYS O O -9.241 -6.854 4.501 1.00 . A A . 48 LYS O 1 1 9 7328 1 1 49 TRP C C -12.078 -4.867 5.074 1.00 . A A . 49 TRP C 1 1 9 7329 1 1 49 TRP CA C -10.596 -4.644 5.378 1.00 . A A . 49 TRP CA 1 1 9 7330 1 1 49 TRP CB C -10.420 -3.315 6.109 1.00 . A A . 49 TRP CB 1 1 9 7331 1 1 49 TRP CD1 C -12.228 -2.237 7.566 1.00 . A A . 49 TRP CD1 1 1 9 7332 1 1 49 TRP CD2 C -11.284 -4.054 8.465 1.00 . A A . 49 TRP CD2 1 1 9 7333 1 1 49 TRP CE2 C -12.252 -3.563 9.358 1.00 . A A . 49 TRP CE2 1 1 9 7334 1 1 49 TRP CE3 C -10.561 -5.197 8.815 1.00 . A A . 49 TRP CE3 1 1 9 7335 1 1 49 TRP CG C -11.281 -3.188 7.328 1.00 . A A . 49 TRP CG 1 1 9 7336 1 1 49 TRP CH2 C -11.793 -5.289 10.896 1.00 . A A . 49 TRP CH2 1 1 9 7337 1 1 49 TRP CZ2 C -12.516 -4.174 10.579 1.00 . A A . 49 TRP CZ2 1 1 9 7338 1 1 49 TRP CZ3 C -10.822 -5.802 10.029 1.00 . A A . 49 TRP CZ3 1 1 9 7339 1 1 49 TRP H H -9.639 -3.904 3.625 1.00 . A A . 49 TRP H 1 1 9 7340 1 1 49 TRP HA H -10.270 -5.434 6.036 1.00 . A A . 49 TRP HA 1 1 9 7341 1 1 49 TRP HB2 H -9.392 -3.215 6.419 1.00 . A A . 49 TRP HB2 1 1 9 7342 1 1 49 TRP HB3 H -10.671 -2.505 5.438 1.00 . A A . 49 TRP HB3 1 1 9 7343 1 1 49 TRP HD1 H -12.467 -1.435 6.886 1.00 . A A . 49 TRP HD1 1 1 9 7344 1 1 49 TRP HE1 H -13.527 -1.902 9.189 1.00 . A A . 49 TRP HE1 1 1 9 7345 1 1 49 TRP HE3 H -9.808 -5.604 8.158 1.00 . A A . 49 TRP HE3 1 1 9 7346 1 1 49 TRP HH2 H -11.964 -5.796 11.836 1.00 . A A . 49 TRP HH2 1 1 9 7347 1 1 49 TRP HZ2 H -13.263 -3.791 11.260 1.00 . A A . 49 TRP HZ2 1 1 9 7348 1 1 49 TRP HZ3 H -10.273 -6.684 10.320 1.00 . A A . 49 TRP HZ3 1 1 9 7349 1 1 49 TRP N N -9.746 -4.700 4.189 1.00 . A A . 49 TRP N 1 1 9 7350 1 1 49 TRP NE1 N -12.816 -2.455 8.787 1.00 . A A . 49 TRP NE1 1 1 9 7351 1 1 49 TRP O O -12.736 -5.639 5.756 1.00 . A A . 49 TRP O 1 1 9 7352 1 1 50 TRP C C -14.593 -5.132 2.897 1.00 . A A . 50 TRP C 1 1 9 7353 1 1 50 TRP CA C -14.055 -4.106 3.899 1.00 . A A . 50 TRP CA 1 1 9 7354 1 1 50 TRP CB C -14.439 -2.689 3.471 1.00 . A A . 50 TRP CB 1 1 9 7355 1 1 50 TRP CD1 C -16.836 -2.572 2.565 1.00 . A A . 50 TRP CD1 1 1 9 7356 1 1 50 TRP CD2 C -16.612 -1.906 4.692 1.00 . A A . 50 TRP CD2 1 1 9 7357 1 1 50 TRP CE2 C -17.966 -1.792 4.326 1.00 . A A . 50 TRP CE2 1 1 9 7358 1 1 50 TRP CE3 C -16.231 -1.545 5.987 1.00 . A A . 50 TRP CE3 1 1 9 7359 1 1 50 TRP CG C -15.907 -2.409 3.553 1.00 . A A . 50 TRP CG 1 1 9 7360 1 1 50 TRP CH2 C -18.534 -0.983 6.469 1.00 . A A . 50 TRP CH2 1 1 9 7361 1 1 50 TRP CZ2 C -18.938 -1.330 5.211 1.00 . A A . 50 TRP CZ2 1 1 9 7362 1 1 50 TRP CZ3 C -17.195 -1.085 6.861 1.00 . A A . 50 TRP CZ3 1 1 9 7363 1 1 50 TRP H H -12.015 -3.751 3.417 1.00 . A A . 50 TRP H 1 1 9 7364 1 1 50 TRP HA H -14.505 -4.305 4.861 1.00 . A A . 50 TRP HA 1 1 9 7365 1 1 50 TRP HB2 H -13.931 -1.981 4.110 1.00 . A A . 50 TRP HB2 1 1 9 7366 1 1 50 TRP HB3 H -14.124 -2.531 2.450 1.00 . A A . 50 TRP HB3 1 1 9 7367 1 1 50 TRP HD1 H -16.613 -2.940 1.573 1.00 . A A . 50 TRP HD1 1 1 9 7368 1 1 50 TRP HE1 H -18.916 -2.233 2.498 1.00 . A A . 50 TRP HE1 1 1 9 7369 1 1 50 TRP HE3 H -15.201 -1.619 6.306 1.00 . A A . 50 TRP HE3 1 1 9 7370 1 1 50 TRP HH2 H -19.255 -0.619 7.187 1.00 . A A . 50 TRP HH2 1 1 9 7371 1 1 50 TRP HZ2 H -19.975 -1.244 4.924 1.00 . A A . 50 TRP HZ2 1 1 9 7372 1 1 50 TRP HZ3 H -16.920 -0.801 7.866 1.00 . A A . 50 TRP HZ3 1 1 9 7373 1 1 50 TRP N N -12.604 -4.188 4.068 1.00 . A A . 50 TRP N 1 1 9 7374 1 1 50 TRP NE1 N -18.078 -2.204 3.023 1.00 . A A . 50 TRP NE1 1 1 9 7375 1 1 50 TRP O O -15.598 -5.798 3.156 1.00 . A A . 50 TRP O 1 1 9 7376 1 1 51 GLU C C -14.290 -7.564 0.983 1.00 . A A . 51 GLU C 1 1 9 7377 1 1 51 GLU CA C -14.430 -6.087 0.671 1.00 . A A . 51 GLU CA 1 1 9 7378 1 1 51 GLU CB C -13.702 -5.756 -0.638 1.00 . A A . 51 GLU CB 1 1 9 7379 1 1 51 GLU CD C -15.628 -4.541 -1.700 1.00 . A A . 51 GLU CD 1 1 9 7380 1 1 51 GLU CG C -14.172 -4.475 -1.292 1.00 . A A . 51 GLU CG 1 1 9 7381 1 1 51 GLU H H -13.045 -4.832 1.668 1.00 . A A . 51 GLU H 1 1 9 7382 1 1 51 GLU HA H -15.478 -5.858 0.552 1.00 . A A . 51 GLU HA 1 1 9 7383 1 1 51 GLU HB2 H -12.648 -5.648 -0.434 1.00 . A A . 51 GLU HB2 1 1 9 7384 1 1 51 GLU HB3 H -13.848 -6.566 -1.334 1.00 . A A . 51 GLU HB3 1 1 9 7385 1 1 51 GLU HG2 H -14.035 -3.663 -0.593 1.00 . A A . 51 GLU HG2 1 1 9 7386 1 1 51 GLU HG3 H -13.573 -4.294 -2.173 1.00 . A A . 51 GLU HG3 1 1 9 7387 1 1 51 GLU N N -13.920 -5.269 1.763 1.00 . A A . 51 GLU N 1 1 9 7388 1 1 51 GLU O O -15.249 -8.324 0.880 1.00 . A A . 51 GLU O 1 1 9 7389 1 1 51 GLU OE1 O -15.931 -5.151 -2.745 1.00 . A A . 51 GLU OE1 1 1 9 7390 1 1 51 GLU OE2 O -16.476 -3.975 -0.979 1.00 . A A . 51 GLU OE2 1 1 9 7391 1 1 52 LEU C C -12.629 -9.630 3.090 1.00 . A A . 52 LEU C 1 1 9 7392 1 1 52 LEU CA C -12.807 -9.363 1.610 1.00 . A A . 52 LEU CA 1 1 9 7393 1 1 52 LEU CB C -11.543 -9.754 0.859 1.00 . A A . 52 LEU CB 1 1 9 7394 1 1 52 LEU CD1 C -10.218 -9.793 -1.264 1.00 . A A . 52 LEU CD1 1 1 9 7395 1 1 52 LEU CD2 C -12.711 -9.909 -1.352 1.00 . A A . 52 LEU CD2 1 1 9 7396 1 1 52 LEU CG C -11.513 -9.341 -0.609 1.00 . A A . 52 LEU CG 1 1 9 7397 1 1 52 LEU H H -12.391 -7.299 1.505 1.00 . A A . 52 LEU H 1 1 9 7398 1 1 52 LEU HA H -13.634 -9.946 1.242 1.00 . A A . 52 LEU HA 1 1 9 7399 1 1 52 LEU HB2 H -10.705 -9.285 1.356 1.00 . A A . 52 LEU HB2 1 1 9 7400 1 1 52 LEU HB3 H -11.427 -10.826 0.913 1.00 . A A . 52 LEU HB3 1 1 9 7401 1 1 52 LEU HD11 H -10.235 -9.540 -2.314 1.00 . A A . 52 LEU HD11 1 1 9 7402 1 1 52 LEU HD12 H -9.385 -9.299 -0.788 1.00 . A A . 52 LEU HD12 1 1 9 7403 1 1 52 LEU HD13 H -10.115 -10.862 -1.152 1.00 . A A . 52 LEU HD13 1 1 9 7404 1 1 52 LEU HD21 H -12.688 -10.987 -1.301 1.00 . A A . 52 LEU HD21 1 1 9 7405 1 1 52 LEU HD22 H -13.621 -9.545 -0.898 1.00 . A A . 52 LEU HD22 1 1 9 7406 1 1 52 LEU HD23 H -12.675 -9.597 -2.385 1.00 . A A . 52 LEU HD23 1 1 9 7407 1 1 52 LEU HG H -11.563 -8.258 -0.662 1.00 . A A . 52 LEU HG 1 1 9 7408 1 1 52 LEU N N -13.097 -7.961 1.373 1.00 . A A . 52 LEU N 1 1 9 7409 1 1 52 LEU O O -13.007 -10.690 3.585 1.00 . A A . 52 LEU O 1 1 9 7410 1 1 53 ARG C C -10.667 -9.828 5.430 1.00 . A A . 53 ARG C 1 1 9 7411 1 1 53 ARG CA C -11.747 -8.769 5.211 1.00 . A A . 53 ARG CA 1 1 9 7412 1 1 53 ARG CB C -12.995 -9.124 6.042 1.00 . A A . 53 ARG CB 1 1 9 7413 1 1 53 ARG CD C -15.290 -8.461 6.827 1.00 . A A . 53 ARG CD 1 1 9 7414 1 1 53 ARG CG C -14.159 -8.162 5.857 1.00 . A A . 53 ARG CG 1 1 9 7415 1 1 53 ARG CZ C -15.419 -8.860 9.261 1.00 . A A . 53 ARG CZ 1 1 9 7416 1 1 53 ARG H H -11.804 -7.819 3.304 1.00 . A A . 53 ARG H 1 1 9 7417 1 1 53 ARG HA H -11.365 -7.815 5.542 1.00 . A A . 53 ARG HA 1 1 9 7418 1 1 53 ARG HB2 H -13.328 -10.112 5.760 1.00 . A A . 53 ARG HB2 1 1 9 7419 1 1 53 ARG HB3 H -12.725 -9.131 7.089 1.00 . A A . 53 ARG HB3 1 1 9 7420 1 1 53 ARG HD2 H -16.136 -7.835 6.577 1.00 . A A . 53 ARG HD2 1 1 9 7421 1 1 53 ARG HD3 H -15.570 -9.498 6.722 1.00 . A A . 53 ARG HD3 1 1 9 7422 1 1 53 ARG HE H -14.239 -7.506 8.379 1.00 . A A . 53 ARG HE 1 1 9 7423 1 1 53 ARG HG2 H -13.813 -7.155 6.026 1.00 . A A . 53 ARG HG2 1 1 9 7424 1 1 53 ARG HG3 H -14.530 -8.253 4.847 1.00 . A A . 53 ARG HG3 1 1 9 7425 1 1 53 ARG HH11 H -16.592 -10.078 8.139 1.00 . A A . 53 ARG HH11 1 1 9 7426 1 1 53 ARG HH12 H -16.696 -10.314 9.862 1.00 . A A . 53 ARG HH12 1 1 9 7427 1 1 53 ARG HH21 H -14.388 -7.818 10.664 1.00 . A A . 53 ARG HH21 1 1 9 7428 1 1 53 ARG HH22 H -15.424 -9.067 11.273 1.00 . A A . 53 ARG HH22 1 1 9 7429 1 1 53 ARG N N -12.053 -8.650 3.780 1.00 . A A . 53 ARG N 1 1 9 7430 1 1 53 ARG NE N -14.907 -8.207 8.218 1.00 . A A . 53 ARG NE 1 1 9 7431 1 1 53 ARG NH1 N -16.304 -9.826 9.070 1.00 . A A . 53 ARG NH1 1 1 9 7432 1 1 53 ARG NH2 N -15.052 -8.550 10.497 1.00 . A A . 53 ARG NH2 1 1 9 7433 1 1 53 ARG O O -11.010 -10.980 5.766 1.00 . A A . 53 ARG O 1 1 9 7434 1 1 53 ARG OXT O -9.479 -9.513 5.231 1.00 . A A . 53 ARG OXT 1 1 10 7435 1 1 1 ASN C C 10.383 -9.016 3.972 1.00 . A A . 1 ASN C 1 1 10 7436 1 1 1 ASN CA C 11.330 -10.163 3.641 1.00 . A A . 1 ASN CA 1 1 10 7437 1 1 1 ASN CB C 11.444 -10.340 2.124 1.00 . A A . 1 ASN CB 1 1 10 7438 1 1 1 ASN CG C 12.641 -11.177 1.723 1.00 . A A . 1 ASN CG 1 1 10 7439 1 1 1 ASN H1 H 9.941 -11.696 3.916 1.00 . A A . 1 ASN H1 1 1 10 7440 1 1 1 ASN H2 H 10.799 -11.281 5.317 1.00 . A A . 1 ASN H2 1 1 10 7441 1 1 1 ASN H3 H 11.555 -12.188 4.102 1.00 . A A . 1 ASN H3 1 1 10 7442 1 1 1 ASN HA H 12.306 -9.921 4.038 1.00 . A A . 1 ASN HA 1 1 10 7443 1 1 1 ASN HB2 H 10.550 -10.825 1.758 1.00 . A A . 1 ASN HB2 1 1 10 7444 1 1 1 ASN HB3 H 11.534 -9.367 1.662 1.00 . A A . 1 ASN HB3 1 1 10 7445 1 1 1 ASN HD21 H 13.753 -9.543 1.475 1.00 . A A . 1 ASN HD21 1 1 10 7446 1 1 1 ASN HD22 H 14.548 -11.050 1.162 1.00 . A A . 1 ASN HD22 1 1 10 7447 1 1 1 ASN N N 10.876 -11.418 4.285 1.00 . A A . 1 ASN N 1 1 10 7448 1 1 1 ASN ND2 N 13.756 -10.523 1.424 1.00 . A A . 1 ASN ND2 1 1 10 7449 1 1 1 ASN O O 10.012 -8.843 5.136 1.00 . A A . 1 ASN O 1 1 10 7450 1 1 1 ASN OD1 O 12.563 -12.401 1.669 1.00 . A A . 1 ASN OD1 1 1 10 7451 1 1 2 SER C C 10.056 -6.086 4.024 1.00 . A A . 2 SER C 1 1 10 7452 1 1 2 SER CA C 9.217 -7.020 3.174 1.00 . A A . 2 SER CA 1 1 10 7453 1 1 2 SER CB C 7.869 -7.334 3.829 1.00 . A A . 2 SER CB 1 1 10 7454 1 1 2 SER H H 10.242 -8.481 2.042 1.00 . A A . 2 SER H 1 1 10 7455 1 1 2 SER HA H 9.049 -6.557 2.213 1.00 . A A . 2 SER HA 1 1 10 7456 1 1 2 SER HB2 H 8.035 -7.800 4.791 1.00 . A A . 2 SER HB2 1 1 10 7457 1 1 2 SER HB3 H 7.308 -6.420 3.960 1.00 . A A . 2 SER HB3 1 1 10 7458 1 1 2 SER HG H 6.827 -8.972 3.540 1.00 . A A . 2 SER HG 1 1 10 7459 1 1 2 SER N N 9.992 -8.237 2.954 1.00 . A A . 2 SER N 1 1 10 7460 1 1 2 SER O O 9.691 -5.705 5.137 1.00 . A A . 2 SER O 1 1 10 7461 1 1 2 SER OG O 7.122 -8.217 3.012 1.00 . A A . 2 SER OG 1 1 10 7462 1 1 3 ASP C C 12.513 -3.709 3.780 1.00 . A A . 3 ASP C 1 1 10 7463 1 1 3 ASP CA C 12.283 -5.139 4.220 1.00 . A A . 3 ASP CA 1 1 10 7464 1 1 3 ASP CB C 13.552 -5.986 4.043 1.00 . A A . 3 ASP CB 1 1 10 7465 1 1 3 ASP CG C 13.950 -6.186 2.589 1.00 . A A . 3 ASP CG 1 1 10 7466 1 1 3 ASP H H 11.300 -5.835 2.484 1.00 . A A . 3 ASP H 1 1 10 7467 1 1 3 ASP HA H 12.004 -5.141 5.262 1.00 . A A . 3 ASP HA 1 1 10 7468 1 1 3 ASP HB2 H 14.373 -5.501 4.553 1.00 . A A . 3 ASP HB2 1 1 10 7469 1 1 3 ASP HB3 H 13.388 -6.957 4.486 1.00 . A A . 3 ASP HB3 1 1 10 7470 1 1 3 ASP N N 11.194 -5.730 3.464 1.00 . A A . 3 ASP N 1 1 10 7471 1 1 3 ASP O O 11.684 -3.157 3.068 1.00 . A A . 3 ASP O 1 1 10 7472 1 1 3 ASP OD1 O 13.053 -6.441 1.767 1.00 . A A . 3 ASP OD1 1 1 10 7473 1 1 3 ASP OD2 O 15.150 -6.049 2.257 1.00 . A A . 3 ASP OD2 1 1 10 7474 1 1 4 SER C C 12.891 -0.821 4.666 1.00 . A A . 4 SER C 1 1 10 7475 1 1 4 SER CA C 13.914 -1.708 3.945 1.00 . A A . 4 SER CA 1 1 10 7476 1 1 4 SER CB C 13.941 -1.464 2.426 1.00 . A A . 4 SER CB 1 1 10 7477 1 1 4 SER H H 14.272 -3.638 4.733 1.00 . A A . 4 SER H 1 1 10 7478 1 1 4 SER HA H 14.894 -1.496 4.349 1.00 . A A . 4 SER HA 1 1 10 7479 1 1 4 SER HB2 H 14.813 -1.945 2.012 1.00 . A A . 4 SER HB2 1 1 10 7480 1 1 4 SER HB3 H 13.054 -1.897 1.984 1.00 . A A . 4 SER HB3 1 1 10 7481 1 1 4 SER HG H 13.203 0.121 1.536 1.00 . A A . 4 SER HG 1 1 10 7482 1 1 4 SER N N 13.627 -3.115 4.215 1.00 . A A . 4 SER N 1 1 10 7483 1 1 4 SER O O 12.027 -1.322 5.391 1.00 . A A . 4 SER O 1 1 10 7484 1 1 4 SER OG O 13.989 -0.086 2.084 1.00 . A A . 4 SER OG 1 1 10 7485 1 1 5 GLU C C 11.749 2.587 4.334 1.00 . A A . 5 GLU C 1 1 10 7486 1 1 5 GLU CA C 12.133 1.412 5.220 1.00 . A A . 5 GLU CA 1 1 10 7487 1 1 5 GLU CB C 12.826 1.930 6.483 1.00 . A A . 5 GLU CB 1 1 10 7488 1 1 5 GLU CD C 14.000 1.363 8.634 1.00 . A A . 5 GLU CD 1 1 10 7489 1 1 5 GLU CG C 13.142 0.848 7.502 1.00 . A A . 5 GLU CG 1 1 10 7490 1 1 5 GLU H H 13.673 0.840 3.886 1.00 . A A . 5 GLU H 1 1 10 7491 1 1 5 GLU HA H 11.240 0.878 5.501 1.00 . A A . 5 GLU HA 1 1 10 7492 1 1 5 GLU HB2 H 13.754 2.404 6.200 1.00 . A A . 5 GLU HB2 1 1 10 7493 1 1 5 GLU HB3 H 12.189 2.662 6.954 1.00 . A A . 5 GLU HB3 1 1 10 7494 1 1 5 GLU HG2 H 12.216 0.471 7.911 1.00 . A A . 5 GLU HG2 1 1 10 7495 1 1 5 GLU HG3 H 13.670 0.046 7.005 1.00 . A A . 5 GLU HG3 1 1 10 7496 1 1 5 GLU N N 13.004 0.489 4.510 1.00 . A A . 5 GLU N 1 1 10 7497 1 1 5 GLU O O 12.603 3.194 3.689 1.00 . A A . 5 GLU O 1 1 10 7498 1 1 5 GLU OE1 O 15.231 1.452 8.464 1.00 . A A . 5 GLU OE1 1 1 10 7499 1 1 5 GLU OE2 O 13.441 1.671 9.706 1.00 . A A . 5 GLU OE2 1 1 10 7500 1 1 6 CYS C C 9.786 5.235 4.528 1.00 . A A . 6 CYS C 1 1 10 7501 1 1 6 CYS CA C 9.965 4.054 3.585 1.00 . A A . 6 CYS CA 1 1 10 7502 1 1 6 CYS CB C 8.634 3.735 2.914 1.00 . A A . 6 CYS CB 1 1 10 7503 1 1 6 CYS H H 9.823 2.314 4.776 1.00 . A A . 6 CYS H 1 1 10 7504 1 1 6 CYS HA H 10.689 4.315 2.826 1.00 . A A . 6 CYS HA 1 1 10 7505 1 1 6 CYS HB2 H 8.040 3.133 3.586 1.00 . A A . 6 CYS HB2 1 1 10 7506 1 1 6 CYS HB3 H 8.113 4.661 2.717 1.00 . A A . 6 CYS HB3 1 1 10 7507 1 1 6 CYS N N 10.463 2.893 4.304 1.00 . A A . 6 CYS N 1 1 10 7508 1 1 6 CYS O O 9.068 5.136 5.522 1.00 . A A . 6 CYS O 1 1 10 7509 1 1 6 CYS SG S 8.764 2.831 1.341 1.00 . A A . 6 CYS SG 1 1 10 7510 1 1 7 PRO C C 9.270 8.538 4.424 1.00 . A A . 7 PRO C 1 1 10 7511 1 1 7 PRO CA C 10.320 7.585 5.010 1.00 . A A . 7 PRO CA 1 1 10 7512 1 1 7 PRO CB C 11.719 8.209 4.922 1.00 . A A . 7 PRO CB 1 1 10 7513 1 1 7 PRO CD C 11.469 6.516 3.199 1.00 . A A . 7 PRO CD 1 1 10 7514 1 1 7 PRO CG C 12.447 7.475 3.827 1.00 . A A . 7 PRO CG 1 1 10 7515 1 1 7 PRO HA H 10.081 7.381 6.041 1.00 . A A . 7 PRO HA 1 1 10 7516 1 1 7 PRO HB2 H 11.629 9.261 4.692 1.00 . A A . 7 PRO HB2 1 1 10 7517 1 1 7 PRO HB3 H 12.220 8.091 5.872 1.00 . A A . 7 PRO HB3 1 1 10 7518 1 1 7 PRO HD2 H 11.038 6.944 2.306 1.00 . A A . 7 PRO HD2 1 1 10 7519 1 1 7 PRO HD3 H 11.949 5.574 2.978 1.00 . A A . 7 PRO HD3 1 1 10 7520 1 1 7 PRO HG2 H 12.801 8.178 3.089 1.00 . A A . 7 PRO HG2 1 1 10 7521 1 1 7 PRO HG3 H 13.280 6.932 4.249 1.00 . A A . 7 PRO HG3 1 1 10 7522 1 1 7 PRO N N 10.464 6.358 4.246 1.00 . A A . 7 PRO N 1 1 10 7523 1 1 7 PRO O O 8.535 8.187 3.495 1.00 . A A . 7 PRO O 1 1 10 7524 1 1 8 LEU C C 8.359 11.056 3.000 1.00 . A A . 8 LEU C 1 1 10 7525 1 1 8 LEU CA C 8.266 10.770 4.506 1.00 . A A . 8 LEU CA 1 1 10 7526 1 1 8 LEU CB C 8.510 12.058 5.292 1.00 . A A . 8 LEU CB 1 1 10 7527 1 1 8 LEU CD1 C 6.118 12.619 5.802 1.00 . A A . 8 LEU CD1 1 1 10 7528 1 1 8 LEU CD2 C 7.855 14.410 5.855 1.00 . A A . 8 LEU CD2 1 1 10 7529 1 1 8 LEU CG C 7.413 13.120 5.184 1.00 . A A . 8 LEU CG 1 1 10 7530 1 1 8 LEU H H 9.888 9.997 5.634 1.00 . A A . 8 LEU H 1 1 10 7531 1 1 8 LEU HA H 7.279 10.402 4.736 1.00 . A A . 8 LEU HA 1 1 10 7532 1 1 8 LEU HB2 H 8.631 11.795 6.328 1.00 . A A . 8 LEU HB2 1 1 10 7533 1 1 8 LEU HB3 H 9.434 12.496 4.940 1.00 . A A . 8 LEU HB3 1 1 10 7534 1 1 8 LEU HD11 H 5.358 13.382 5.712 1.00 . A A . 8 LEU HD11 1 1 10 7535 1 1 8 LEU HD12 H 5.795 11.727 5.288 1.00 . A A . 8 LEU HD12 1 1 10 7536 1 1 8 LEU HD13 H 6.278 12.394 6.846 1.00 . A A . 8 LEU HD13 1 1 10 7537 1 1 8 LEU HD21 H 7.073 15.149 5.765 1.00 . A A . 8 LEU HD21 1 1 10 7538 1 1 8 LEU HD22 H 8.052 14.222 6.902 1.00 . A A . 8 LEU HD22 1 1 10 7539 1 1 8 LEU HD23 H 8.754 14.775 5.381 1.00 . A A . 8 LEU HD23 1 1 10 7540 1 1 8 LEU HG H 7.227 13.331 4.141 1.00 . A A . 8 LEU HG 1 1 10 7541 1 1 8 LEU N N 9.241 9.762 4.934 1.00 . A A . 8 LEU N 1 1 10 7542 1 1 8 LEU O O 7.523 11.752 2.429 1.00 . A A . 8 LEU O 1 1 10 7543 1 1 9 SER C C 9.019 9.664 0.076 1.00 . A A . 9 SER C 1 1 10 7544 1 1 9 SER CA C 9.641 10.741 0.964 1.00 . A A . 9 SER CA 1 1 10 7545 1 1 9 SER CB C 11.151 10.789 0.755 1.00 . A A . 9 SER CB 1 1 10 7546 1 1 9 SER H H 9.935 9.861 2.850 1.00 . A A . 9 SER H 1 1 10 7547 1 1 9 SER HA H 9.217 11.698 0.704 1.00 . A A . 9 SER HA 1 1 10 7548 1 1 9 SER HB2 H 11.373 10.733 -0.300 1.00 . A A . 9 SER HB2 1 1 10 7549 1 1 9 SER HB3 H 11.540 11.711 1.160 1.00 . A A . 9 SER HB3 1 1 10 7550 1 1 9 SER HG H 12.545 10.023 1.914 1.00 . A A . 9 SER HG 1 1 10 7551 1 1 9 SER N N 9.368 10.491 2.365 1.00 . A A . 9 SER N 1 1 10 7552 1 1 9 SER O O 8.416 9.972 -0.948 1.00 . A A . 9 SER O 1 1 10 7553 1 1 9 SER OG O 11.773 9.699 1.416 1.00 . A A . 9 SER OG 1 1 10 7554 1 1 10 HIS C C 7.291 6.869 -0.049 1.00 . A A . 10 HIS C 1 1 10 7555 1 1 10 HIS CA C 8.723 7.287 -0.358 1.00 . A A . 10 HIS CA 1 1 10 7556 1 1 10 HIS CB C 9.678 6.097 -0.204 1.00 . A A . 10 HIS CB 1 1 10 7557 1 1 10 HIS CD2 C 12.085 7.058 -0.386 1.00 . A A . 10 HIS CD2 1 1 10 7558 1 1 10 HIS CE1 C 12.659 6.134 -2.284 1.00 . A A . 10 HIS CE1 1 1 10 7559 1 1 10 HIS CG C 11.030 6.324 -0.815 1.00 . A A . 10 HIS CG 1 1 10 7560 1 1 10 HIS H H 9.516 8.226 1.378 1.00 . A A . 10 HIS H 1 1 10 7561 1 1 10 HIS HA H 8.763 7.630 -1.379 1.00 . A A . 10 HIS HA 1 1 10 7562 1 1 10 HIS HB2 H 9.820 5.893 0.847 1.00 . A A . 10 HIS HB2 1 1 10 7563 1 1 10 HIS HB3 H 9.238 5.232 -0.677 1.00 . A A . 10 HIS HB3 1 1 10 7564 1 1 10 HIS HD1 H 10.874 5.158 -2.572 1.00 . A A . 10 HIS HD1 1 1 10 7565 1 1 10 HIS HD2 H 12.128 7.643 0.524 1.00 . A A . 10 HIS HD2 1 1 10 7566 1 1 10 HIS HE1 H 13.227 5.843 -3.158 1.00 . A A . 10 HIS HE1 1 1 10 7567 1 1 10 HIS HE2 H 14.024 7.212 -1.188 1.00 . A A . 10 HIS HE2 1 1 10 7568 1 1 10 HIS N N 9.146 8.404 0.487 1.00 . A A . 10 HIS N 1 1 10 7569 1 1 10 HIS ND1 N 11.425 5.758 -2.008 1.00 . A A . 10 HIS ND1 1 1 10 7570 1 1 10 HIS NE2 N 13.082 6.924 -1.317 1.00 . A A . 10 HIS NE2 1 1 10 7571 1 1 10 HIS O O 6.409 7.010 -0.894 1.00 . A A . 10 HIS O 1 1 10 7572 1 1 11 ASP C C 4.917 7.375 1.665 1.00 . A A . 11 ASP C 1 1 10 7573 1 1 11 ASP CA C 5.699 6.073 1.613 1.00 . A A . 11 ASP CA 1 1 10 7574 1 1 11 ASP CB C 5.708 5.396 2.993 1.00 . A A . 11 ASP CB 1 1 10 7575 1 1 11 ASP CG C 5.676 6.369 4.159 1.00 . A A . 11 ASP CG 1 1 10 7576 1 1 11 ASP H H 7.812 6.082 1.709 1.00 . A A . 11 ASP H 1 1 10 7577 1 1 11 ASP HA H 5.230 5.415 0.897 1.00 . A A . 11 ASP HA 1 1 10 7578 1 1 11 ASP HB2 H 4.854 4.743 3.074 1.00 . A A . 11 ASP HB2 1 1 10 7579 1 1 11 ASP HB3 H 6.611 4.808 3.078 1.00 . A A . 11 ASP HB3 1 1 10 7580 1 1 11 ASP N N 7.059 6.346 1.149 1.00 . A A . 11 ASP N 1 1 10 7581 1 1 11 ASP O O 3.707 7.405 1.440 1.00 . A A . 11 ASP O 1 1 10 7582 1 1 11 ASP OD1 O 4.585 6.838 4.525 1.00 . A A . 11 ASP OD1 1 1 10 7583 1 1 11 ASP OD2 O 6.742 6.660 4.715 1.00 . A A . 11 ASP OD2 1 1 10 7584 1 1 12 GLY C C 4.630 10.180 0.511 1.00 . A A . 12 GLY C 1 1 10 7585 1 1 12 GLY CA C 5.041 9.772 1.913 1.00 . A A . 12 GLY CA 1 1 10 7586 1 1 12 GLY H H 6.572 8.343 2.211 1.00 . A A . 12 GLY H 1 1 10 7587 1 1 12 GLY HA2 H 4.167 9.780 2.547 1.00 . A A . 12 GLY HA2 1 1 10 7588 1 1 12 GLY HA3 H 5.755 10.487 2.292 1.00 . A A . 12 GLY HA3 1 1 10 7589 1 1 12 GLY N N 5.633 8.453 1.948 1.00 . A A . 12 GLY N 1 1 10 7590 1 1 12 GLY O O 3.826 11.098 0.337 1.00 . A A . 12 GLY O 1 1 10 7591 1 1 13 TYR C C 3.675 8.842 -2.297 1.00 . A A . 13 TYR C 1 1 10 7592 1 1 13 TYR CA C 4.820 9.761 -1.880 1.00 . A A . 13 TYR CA 1 1 10 7593 1 1 13 TYR CB C 6.022 9.571 -2.812 1.00 . A A . 13 TYR CB 1 1 10 7594 1 1 13 TYR CD1 C 5.936 11.459 -4.491 1.00 . A A . 13 TYR CD1 1 1 10 7595 1 1 13 TYR CD2 C 5.453 9.252 -5.251 1.00 . A A . 13 TYR CD2 1 1 10 7596 1 1 13 TYR CE1 C 5.747 11.946 -5.770 1.00 . A A . 13 TYR CE1 1 1 10 7597 1 1 13 TYR CE2 C 5.259 9.732 -6.532 1.00 . A A . 13 TYR CE2 1 1 10 7598 1 1 13 TYR CG C 5.794 10.106 -4.209 1.00 . A A . 13 TYR CG 1 1 10 7599 1 1 13 TYR CZ C 5.344 11.103 -6.768 1.00 . A A . 13 TYR CZ 1 1 10 7600 1 1 13 TYR H H 5.874 8.832 -0.295 1.00 . A A . 13 TYR H 1 1 10 7601 1 1 13 TYR HA H 4.482 10.785 -1.948 1.00 . A A . 13 TYR HA 1 1 10 7602 1 1 13 TYR HB2 H 6.877 10.081 -2.395 1.00 . A A . 13 TYR HB2 1 1 10 7603 1 1 13 TYR HB3 H 6.242 8.516 -2.892 1.00 . A A . 13 TYR HB3 1 1 10 7604 1 1 13 TYR HD1 H 6.201 12.135 -3.691 1.00 . A A . 13 TYR HD1 1 1 10 7605 1 1 13 TYR HD2 H 5.335 8.197 -5.049 1.00 . A A . 13 TYR HD2 1 1 10 7606 1 1 13 TYR HE1 H 5.861 13.001 -5.968 1.00 . A A . 13 TYR HE1 1 1 10 7607 1 1 13 TYR HE2 H 4.993 9.051 -7.327 1.00 . A A . 13 TYR HE2 1 1 10 7608 1 1 13 TYR HH H 5.973 12.113 -8.313 1.00 . A A . 13 TYR HH 1 1 10 7609 1 1 13 TYR N N 5.190 9.509 -0.493 1.00 . A A . 13 TYR N 1 1 10 7610 1 1 13 TYR O O 3.002 9.088 -3.302 1.00 . A A . 13 TYR O 1 1 10 7611 1 1 13 TYR OH O 5.220 11.559 -8.065 1.00 . A A . 13 TYR OH 1 1 10 7612 1 1 14 CYS C C 1.011 7.724 -1.479 1.00 . A A . 14 CYS C 1 1 10 7613 1 1 14 CYS CA C 2.301 6.915 -1.743 1.00 . A A . 14 CYS CA 1 1 10 7614 1 1 14 CYS CB C 2.388 5.659 -0.863 1.00 . A A . 14 CYS CB 1 1 10 7615 1 1 14 CYS H H 4.074 7.582 -0.794 1.00 . A A . 14 CYS H 1 1 10 7616 1 1 14 CYS HA H 2.310 6.619 -2.782 1.00 . A A . 14 CYS HA 1 1 10 7617 1 1 14 CYS HB2 H 2.433 5.970 0.175 1.00 . A A . 14 CYS HB2 1 1 10 7618 1 1 14 CYS HB3 H 1.507 5.055 -1.017 1.00 . A A . 14 CYS HB3 1 1 10 7619 1 1 14 CYS N N 3.453 7.782 -1.524 1.00 . A A . 14 CYS N 1 1 10 7620 1 1 14 CYS O O 1.093 8.866 -1.026 1.00 . A A . 14 CYS O 1 1 10 7621 1 1 14 CYS SG S 3.854 4.595 -1.155 1.00 . A A . 14 CYS SG 1 1 10 7622 1 1 15 LEU C C -2.168 8.359 -0.758 1.00 . A A . 15 LEU C 1 1 10 7623 1 1 15 LEU CA C -1.330 8.006 -1.983 1.00 . A A . 15 LEU CA 1 1 10 7624 1 1 15 LEU CB C -2.212 7.375 -3.056 1.00 . A A . 15 LEU CB 1 1 10 7625 1 1 15 LEU CD1 C -2.490 6.620 -5.426 1.00 . A A . 15 LEU CD1 1 1 10 7626 1 1 15 LEU CD2 C -0.816 8.381 -4.882 1.00 . A A . 15 LEU CD2 1 1 10 7627 1 1 15 LEU CG C -1.505 7.120 -4.386 1.00 . A A . 15 LEU CG 1 1 10 7628 1 1 15 LEU H H -0.278 6.192 -1.630 1.00 . A A . 15 LEU H 1 1 10 7629 1 1 15 LEU HA H -0.946 8.928 -2.383 1.00 . A A . 15 LEU HA 1 1 10 7630 1 1 15 LEU HB2 H -2.583 6.433 -2.679 1.00 . A A . 15 LEU HB2 1 1 10 7631 1 1 15 LEU HB3 H -3.048 8.029 -3.239 1.00 . A A . 15 LEU HB3 1 1 10 7632 1 1 15 LEU HD11 H -1.975 6.467 -6.362 1.00 . A A . 15 LEU HD11 1 1 10 7633 1 1 15 LEU HD12 H -2.922 5.687 -5.095 1.00 . A A . 15 LEU HD12 1 1 10 7634 1 1 15 LEU HD13 H -3.272 7.351 -5.561 1.00 . A A . 15 LEU HD13 1 1 10 7635 1 1 15 LEU HD21 H -0.063 8.684 -4.169 1.00 . A A . 15 LEU HD21 1 1 10 7636 1 1 15 LEU HD22 H -0.350 8.183 -5.836 1.00 . A A . 15 LEU HD22 1 1 10 7637 1 1 15 LEU HD23 H -1.545 9.169 -4.994 1.00 . A A . 15 LEU HD23 1 1 10 7638 1 1 15 LEU HG H -0.752 6.358 -4.239 1.00 . A A . 15 LEU HG 1 1 10 7639 1 1 15 LEU N N -0.169 7.159 -1.705 1.00 . A A . 15 LEU N 1 1 10 7640 1 1 15 LEU O O -1.905 9.360 -0.089 1.00 . A A . 15 LEU O 1 1 10 7641 1 1 16 HIS C C -3.962 7.460 1.874 1.00 . A A . 16 HIS C 1 1 10 7642 1 1 16 HIS CA C -4.227 7.954 0.464 1.00 . A A . 16 HIS CA 1 1 10 7643 1 1 16 HIS CB C -5.595 7.485 -0.037 1.00 . A A . 16 HIS CB 1 1 10 7644 1 1 16 HIS CD2 C -8.001 8.464 -0.091 1.00 . A A . 16 HIS CD2 1 1 10 7645 1 1 16 HIS CE1 C -7.507 10.567 0.250 1.00 . A A . 16 HIS CE1 1 1 10 7646 1 1 16 HIS CG C -6.657 8.547 0.036 1.00 . A A . 16 HIS CG 1 1 10 7647 1 1 16 HIS H H -3.171 6.632 -0.832 1.00 . A A . 16 HIS H 1 1 10 7648 1 1 16 HIS HA H -4.220 9.032 0.486 1.00 . A A . 16 HIS HA 1 1 10 7649 1 1 16 HIS HB2 H -5.507 7.174 -1.066 1.00 . A A . 16 HIS HB2 1 1 10 7650 1 1 16 HIS HB3 H -5.920 6.648 0.562 1.00 . A A . 16 HIS HB3 1 1 10 7651 1 1 16 HIS HD1 H -5.482 10.274 0.369 1.00 . A A . 16 HIS HD1 1 1 10 7652 1 1 16 HIS HD2 H -8.572 7.562 -0.265 1.00 . A A . 16 HIS HD2 1 1 10 7653 1 1 16 HIS HE1 H -7.596 11.635 0.397 1.00 . A A . 16 HIS HE1 1 1 10 7654 1 1 16 HIS HE2 H -9.415 10.014 -0.239 1.00 . A A . 16 HIS HE2 1 1 10 7655 1 1 16 HIS N N -3.165 7.538 -0.455 1.00 . A A . 16 HIS N 1 1 10 7656 1 1 16 HIS ND1 N -6.381 9.880 0.247 1.00 . A A . 16 HIS ND1 1 1 10 7657 1 1 16 HIS NE2 N -8.508 9.734 0.043 1.00 . A A . 16 HIS NE2 1 1 10 7658 1 1 16 HIS O O -4.885 7.218 2.651 1.00 . A A . 16 HIS O 1 1 10 7659 1 1 17 ASP C C -0.690 6.560 3.262 1.00 . A A . 17 ASP C 1 1 10 7660 1 1 17 ASP CA C -2.128 6.985 3.460 1.00 . A A . 17 ASP CA 1 1 10 7661 1 1 17 ASP CB C -2.901 5.878 4.180 1.00 . A A . 17 ASP CB 1 1 10 7662 1 1 17 ASP CG C -2.413 5.663 5.600 1.00 . A A . 17 ASP CG 1 1 10 7663 1 1 17 ASP H H -2.054 7.422 1.409 1.00 . A A . 17 ASP H 1 1 10 7664 1 1 17 ASP HA H -2.144 7.885 4.046 1.00 . A A . 17 ASP HA 1 1 10 7665 1 1 17 ASP HB2 H -3.946 6.141 4.215 1.00 . A A . 17 ASP HB2 1 1 10 7666 1 1 17 ASP HB3 H -2.783 4.952 3.635 1.00 . A A . 17 ASP HB3 1 1 10 7667 1 1 17 ASP N N -2.680 7.301 2.145 1.00 . A A . 17 ASP N 1 1 10 7668 1 1 17 ASP O O 0.201 6.971 3.994 1.00 . A A . 17 ASP O 1 1 10 7669 1 1 17 ASP OD1 O -2.824 6.435 6.496 1.00 . A A . 17 ASP OD1 1 1 10 7670 1 1 17 ASP OD2 O -1.626 4.722 5.830 1.00 . A A . 17 ASP OD2 1 1 10 7671 1 1 18 GLY C C 1.786 4.807 2.734 1.00 . A A . 18 GLY C 1 1 10 7672 1 1 18 GLY CA C 0.801 5.376 1.729 1.00 . A A . 18 GLY CA 1 1 10 7673 1 1 18 GLY H H -1.300 5.412 1.757 1.00 . A A . 18 GLY H 1 1 10 7674 1 1 18 GLY HA2 H 0.653 4.629 0.959 1.00 . A A . 18 GLY HA2 1 1 10 7675 1 1 18 GLY HA3 H 1.247 6.249 1.268 1.00 . A A . 18 GLY HA3 1 1 10 7676 1 1 18 GLY N N -0.505 5.751 2.227 1.00 . A A . 18 GLY N 1 1 10 7677 1 1 18 GLY O O 2.346 5.522 3.553 1.00 . A A . 18 GLY O 1 1 10 7678 1 1 19 VAL C C 3.706 1.823 2.344 1.00 . A A . 19 VAL C 1 1 10 7679 1 1 19 VAL CA C 3.114 2.844 3.305 1.00 . A A . 19 VAL CA 1 1 10 7680 1 1 19 VAL CB C 2.683 2.127 4.607 1.00 . A A . 19 VAL CB 1 1 10 7681 1 1 19 VAL CG1 C 3.849 1.354 5.204 1.00 . A A . 19 VAL CG1 1 1 10 7682 1 1 19 VAL CG2 C 2.144 3.121 5.616 1.00 . A A . 19 VAL CG2 1 1 10 7683 1 1 19 VAL H H 1.391 2.965 2.099 1.00 . A A . 19 VAL H 1 1 10 7684 1 1 19 VAL HA H 3.862 3.587 3.542 1.00 . A A . 19 VAL HA 1 1 10 7685 1 1 19 VAL HB H 1.898 1.426 4.365 1.00 . A A . 19 VAL HB 1 1 10 7686 1 1 19 VAL HG11 H 3.521 0.836 6.094 1.00 . A A . 19 VAL HG11 1 1 10 7687 1 1 19 VAL HG12 H 4.213 0.637 4.483 1.00 . A A . 19 VAL HG12 1 1 10 7688 1 1 19 VAL HG13 H 4.643 2.041 5.459 1.00 . A A . 19 VAL HG13 1 1 10 7689 1 1 19 VAL HG21 H 1.290 3.634 5.198 1.00 . A A . 19 VAL HG21 1 1 10 7690 1 1 19 VAL HG22 H 1.847 2.599 6.513 1.00 . A A . 19 VAL HG22 1 1 10 7691 1 1 19 VAL HG23 H 2.912 3.841 5.856 1.00 . A A . 19 VAL HG23 1 1 10 7692 1 1 19 VAL N N 2.004 3.506 2.635 1.00 . A A . 19 VAL N 1 1 10 7693 1 1 19 VAL O O 3.010 0.905 1.919 1.00 . A A . 19 VAL O 1 1 10 7694 1 1 20 CYS C C 6.513 0.140 1.646 1.00 . A A . 20 CYS C 1 1 10 7695 1 1 20 CYS CA C 5.560 1.101 0.993 1.00 . A A . 20 CYS CA 1 1 10 7696 1 1 20 CYS CB C 6.252 1.871 -0.140 1.00 . A A . 20 CYS CB 1 1 10 7697 1 1 20 CYS H H 5.533 2.635 2.426 1.00 . A A . 20 CYS H 1 1 10 7698 1 1 20 CYS HA H 4.754 0.521 0.566 1.00 . A A . 20 CYS HA 1 1 10 7699 1 1 20 CYS HB2 H 6.998 1.233 -0.590 1.00 . A A . 20 CYS HB2 1 1 10 7700 1 1 20 CYS HB3 H 5.513 2.127 -0.885 1.00 . A A . 20 CYS HB3 1 1 10 7701 1 1 20 CYS N N 4.971 1.976 1.984 1.00 . A A . 20 CYS N 1 1 10 7702 1 1 20 CYS O O 7.345 0.522 2.466 1.00 . A A . 20 CYS O 1 1 10 7703 1 1 20 CYS SG S 7.085 3.410 0.359 1.00 . A A . 20 CYS SG 1 1 10 7704 1 1 21 MET C C 6.878 -3.454 1.044 1.00 . A A . 21 MET C 1 1 10 7705 1 1 21 MET CA C 7.195 -2.166 1.796 1.00 . A A . 21 MET CA 1 1 10 7706 1 1 21 MET CB C 7.057 -2.361 3.311 1.00 . A A . 21 MET CB 1 1 10 7707 1 1 21 MET CE C 5.906 -1.561 6.163 1.00 . A A . 21 MET CE 1 1 10 7708 1 1 21 MET CG C 5.709 -2.917 3.753 1.00 . A A . 21 MET CG 1 1 10 7709 1 1 21 MET H H 5.523 -1.362 0.810 1.00 . A A . 21 MET H 1 1 10 7710 1 1 21 MET HA H 8.204 -1.864 1.565 1.00 . A A . 21 MET HA 1 1 10 7711 1 1 21 MET HB2 H 7.825 -3.027 3.644 1.00 . A A . 21 MET HB2 1 1 10 7712 1 1 21 MET HB3 H 7.197 -1.405 3.793 1.00 . A A . 21 MET HB3 1 1 10 7713 1 1 21 MET HE1 H 5.919 -1.591 7.243 1.00 . A A . 21 MET HE1 1 1 10 7714 1 1 21 MET HE2 H 6.853 -1.192 5.800 1.00 . A A . 21 MET HE2 1 1 10 7715 1 1 21 MET HE3 H 5.113 -0.907 5.832 1.00 . A A . 21 MET HE3 1 1 10 7716 1 1 21 MET HG2 H 4.939 -2.208 3.485 1.00 . A A . 21 MET HG2 1 1 10 7717 1 1 21 MET HG3 H 5.533 -3.848 3.239 1.00 . A A . 21 MET HG3 1 1 10 7718 1 1 21 MET N N 6.307 -1.122 1.350 1.00 . A A . 21 MET N 1 1 10 7719 1 1 21 MET O O 5.706 -3.830 0.929 1.00 . A A . 21 MET O 1 1 10 7720 1 1 21 MET SD S 5.624 -3.212 5.528 1.00 . A A . 21 MET SD 1 1 10 7721 1 1 22 TYR C C 9.126 -5.730 -0.711 1.00 . A A . 22 TYR C 1 1 10 7722 1 1 22 TYR CA C 7.817 -5.399 -0.067 1.00 . A A . 22 TYR CA 1 1 10 7723 1 1 22 TYR CB C 6.726 -5.560 -1.110 1.00 . A A . 22 TYR CB 1 1 10 7724 1 1 22 TYR CD1 C 5.708 -7.361 0.337 1.00 . A A . 22 TYR CD1 1 1 10 7725 1 1 22 TYR CD2 C 4.304 -6.262 -1.241 1.00 . A A . 22 TYR CD2 1 1 10 7726 1 1 22 TYR CE1 C 4.644 -8.143 0.745 1.00 . A A . 22 TYR CE1 1 1 10 7727 1 1 22 TYR CE2 C 3.235 -7.037 -0.839 1.00 . A A . 22 TYR CE2 1 1 10 7728 1 1 22 TYR CG C 5.556 -6.407 -0.661 1.00 . A A . 22 TYR CG 1 1 10 7729 1 1 22 TYR CZ C 3.404 -7.956 0.177 1.00 . A A . 22 TYR CZ 1 1 10 7730 1 1 22 TYR H H 8.753 -3.615 0.340 1.00 . A A . 22 TYR H 1 1 10 7731 1 1 22 TYR HA H 7.647 -6.072 0.745 1.00 . A A . 22 TYR HA 1 1 10 7732 1 1 22 TYR HB2 H 6.349 -4.587 -1.384 1.00 . A A . 22 TYR HB2 1 1 10 7733 1 1 22 TYR HB3 H 7.168 -6.026 -1.968 1.00 . A A . 22 TYR HB3 1 1 10 7734 1 1 22 TYR HD1 H 6.676 -7.487 0.798 1.00 . A A . 22 TYR HD1 1 1 10 7735 1 1 22 TYR HD2 H 4.170 -5.523 -2.020 1.00 . A A . 22 TYR HD2 1 1 10 7736 1 1 22 TYR HE1 H 4.782 -8.878 1.522 1.00 . A A . 22 TYR HE1 1 1 10 7737 1 1 22 TYR HE2 H 2.269 -6.907 -1.304 1.00 . A A . 22 TYR HE2 1 1 10 7738 1 1 22 TYR HH H 2.325 -8.789 1.524 1.00 . A A . 22 TYR HH 1 1 10 7739 1 1 22 TYR N N 7.903 -4.075 0.461 1.00 . A A . 22 TYR N 1 1 10 7740 1 1 22 TYR O O 9.490 -5.097 -1.678 1.00 . A A . 22 TYR O 1 1 10 7741 1 1 22 TYR OH O 2.345 -8.752 0.553 1.00 . A A . 22 TYR OH 1 1 10 7742 1 1 23 ILE C C 11.868 -6.171 -1.439 1.00 . A A . 23 ILE C 1 1 10 7743 1 1 23 ILE CA C 11.067 -7.234 -0.685 1.00 . A A . 23 ILE CA 1 1 10 7744 1 1 23 ILE CB C 10.733 -8.390 -1.621 1.00 . A A . 23 ILE CB 1 1 10 7745 1 1 23 ILE CD1 C 9.022 -9.831 -0.357 1.00 . A A . 23 ILE CD1 1 1 10 7746 1 1 23 ILE CG1 C 9.266 -8.775 -1.418 1.00 . A A . 23 ILE CG1 1 1 10 7747 1 1 23 ILE CG2 C 11.666 -9.566 -1.375 1.00 . A A . 23 ILE CG2 1 1 10 7748 1 1 23 ILE H H 9.460 -7.096 0.661 1.00 . A A . 23 ILE H 1 1 10 7749 1 1 23 ILE HA H 11.656 -7.610 0.133 1.00 . A A . 23 ILE HA 1 1 10 7750 1 1 23 ILE HB H 10.869 -8.044 -2.624 1.00 . A A . 23 ILE HB 1 1 10 7751 1 1 23 ILE HD11 H 9.405 -9.484 0.590 1.00 . A A . 23 ILE HD11 1 1 10 7752 1 1 23 ILE HD12 H 7.962 -10.017 -0.272 1.00 . A A . 23 ILE HD12 1 1 10 7753 1 1 23 ILE HD13 H 9.527 -10.742 -0.639 1.00 . A A . 23 ILE HD13 1 1 10 7754 1 1 23 ILE HG12 H 8.740 -7.870 -1.099 1.00 . A A . 23 ILE HG12 1 1 10 7755 1 1 23 ILE HG13 H 8.851 -9.124 -2.353 1.00 . A A . 23 ILE HG13 1 1 10 7756 1 1 23 ILE HG21 H 12.686 -9.259 -1.550 1.00 . A A . 23 ILE HG21 1 1 10 7757 1 1 23 ILE HG22 H 11.562 -9.901 -0.353 1.00 . A A . 23 ILE HG22 1 1 10 7758 1 1 23 ILE HG23 H 11.414 -10.372 -2.048 1.00 . A A . 23 ILE HG23 1 1 10 7759 1 1 23 ILE N N 9.823 -6.693 -0.136 1.00 . A A . 23 ILE N 1 1 10 7760 1 1 23 ILE O O 12.108 -6.264 -2.634 1.00 . A A . 23 ILE O 1 1 10 7761 1 1 24 GLU C C 14.271 -4.073 -1.575 1.00 . A A . 24 GLU C 1 1 10 7762 1 1 24 GLU CA C 12.801 -3.943 -1.257 1.00 . A A . 24 GLU CA 1 1 10 7763 1 1 24 GLU CB C 12.591 -2.864 -0.236 1.00 . A A . 24 GLU CB 1 1 10 7764 1 1 24 GLU CD C 10.944 -1.255 0.821 1.00 . A A . 24 GLU CD 1 1 10 7765 1 1 24 GLU CG C 11.130 -2.537 0.025 1.00 . A A . 24 GLU CG 1 1 10 7766 1 1 24 GLU H H 12.314 -5.308 0.246 1.00 . A A . 24 GLU H 1 1 10 7767 1 1 24 GLU HA H 12.250 -3.709 -2.155 1.00 . A A . 24 GLU HA 1 1 10 7768 1 1 24 GLU HB2 H 13.018 -3.228 0.679 1.00 . A A . 24 GLU HB2 1 1 10 7769 1 1 24 GLU HB3 H 13.103 -1.964 -0.545 1.00 . A A . 24 GLU HB3 1 1 10 7770 1 1 24 GLU HG2 H 10.621 -2.434 -0.922 1.00 . A A . 24 GLU HG2 1 1 10 7771 1 1 24 GLU HG3 H 10.693 -3.361 0.587 1.00 . A A . 24 GLU HG3 1 1 10 7772 1 1 24 GLU N N 12.297 -5.185 -0.707 1.00 . A A . 24 GLU N 1 1 10 7773 1 1 24 GLU O O 14.835 -3.297 -2.345 1.00 . A A . 24 GLU O 1 1 10 7774 1 1 24 GLU OE1 O 11.722 -0.294 0.606 1.00 . A A . 24 GLU OE1 1 1 10 7775 1 1 24 GLU OE2 O 10.016 -1.204 1.651 1.00 . A A . 24 GLU OE2 1 1 10 7776 1 1 25 ALA C C 16.137 -6.279 -2.597 1.00 . A A . 25 ALA C 1 1 10 7777 1 1 25 ALA CA C 16.222 -5.473 -1.328 1.00 . A A . 25 ALA CA 1 1 10 7778 1 1 25 ALA CB C 16.875 -6.274 -0.215 1.00 . A A . 25 ALA CB 1 1 10 7779 1 1 25 ALA H H 14.380 -5.607 -0.331 1.00 . A A . 25 ALA H 1 1 10 7780 1 1 25 ALA HA H 16.803 -4.578 -1.507 1.00 . A A . 25 ALA HA 1 1 10 7781 1 1 25 ALA HB1 H 16.304 -7.174 -0.037 1.00 . A A . 25 ALA HB1 1 1 10 7782 1 1 25 ALA HB2 H 17.881 -6.539 -0.503 1.00 . A A . 25 ALA HB2 1 1 10 7783 1 1 25 ALA HB3 H 16.904 -5.681 0.687 1.00 . A A . 25 ALA HB3 1 1 10 7784 1 1 25 ALA N N 14.875 -5.088 -0.988 1.00 . A A . 25 ALA N 1 1 10 7785 1 1 25 ALA O O 17.140 -6.677 -3.186 1.00 . A A . 25 ALA O 1 1 10 7786 1 1 26 LEU C C 14.000 -6.074 -5.161 1.00 . A A . 26 LEU C 1 1 10 7787 1 1 26 LEU CA C 14.644 -7.108 -4.292 1.00 . A A . 26 LEU CA 1 1 10 7788 1 1 26 LEU CB C 13.792 -8.375 -4.201 1.00 . A A . 26 LEU CB 1 1 10 7789 1 1 26 LEU CD1 C 13.667 -10.845 -3.760 1.00 . A A . 26 LEU CD1 1 1 10 7790 1 1 26 LEU CD2 C 15.890 -9.764 -4.123 1.00 . A A . 26 LEU CD2 1 1 10 7791 1 1 26 LEU CG C 14.488 -9.581 -3.556 1.00 . A A . 26 LEU CG 1 1 10 7792 1 1 26 LEU H H 14.128 -6.220 -2.458 1.00 . A A . 26 LEU H 1 1 10 7793 1 1 26 LEU HA H 15.583 -7.345 -4.708 1.00 . A A . 26 LEU HA 1 1 10 7794 1 1 26 LEU HB2 H 12.908 -8.142 -3.625 1.00 . A A . 26 LEU HB2 1 1 10 7795 1 1 26 LEU HB3 H 13.489 -8.652 -5.198 1.00 . A A . 26 LEU HB3 1 1 10 7796 1 1 26 LEU HD11 H 14.205 -11.692 -3.358 1.00 . A A . 26 LEU HD11 1 1 10 7797 1 1 26 LEU HD12 H 12.720 -10.746 -3.250 1.00 . A A . 26 LEU HD12 1 1 10 7798 1 1 26 LEU HD13 H 13.494 -10.997 -4.813 1.00 . A A . 26 LEU HD13 1 1 10 7799 1 1 26 LEU HD21 H 16.469 -8.871 -3.948 1.00 . A A . 26 LEU HD21 1 1 10 7800 1 1 26 LEU HD22 H 16.365 -10.604 -3.638 1.00 . A A . 26 LEU HD22 1 1 10 7801 1 1 26 LEU HD23 H 15.826 -9.951 -5.185 1.00 . A A . 26 LEU HD23 1 1 10 7802 1 1 26 LEU HG H 14.578 -9.409 -2.494 1.00 . A A . 26 LEU HG 1 1 10 7803 1 1 26 LEU N N 14.898 -6.513 -3.015 1.00 . A A . 26 LEU N 1 1 10 7804 1 1 26 LEU O O 13.536 -6.358 -6.265 1.00 . A A . 26 LEU O 1 1 10 7805 1 1 27 ASP C C 12.071 -3.852 -5.699 1.00 . A A . 27 ASP C 1 1 10 7806 1 1 27 ASP CA C 13.533 -3.697 -5.341 1.00 . A A . 27 ASP CA 1 1 10 7807 1 1 27 ASP CB C 14.435 -3.511 -6.547 1.00 . A A . 27 ASP CB 1 1 10 7808 1 1 27 ASP CG C 14.148 -2.250 -7.341 1.00 . A A . 27 ASP CG 1 1 10 7809 1 1 27 ASP H H 14.275 -4.756 -3.688 1.00 . A A . 27 ASP H 1 1 10 7810 1 1 27 ASP HA H 13.639 -2.844 -4.687 1.00 . A A . 27 ASP HA 1 1 10 7811 1 1 27 ASP HB2 H 15.451 -3.476 -6.181 1.00 . A A . 27 ASP HB2 1 1 10 7812 1 1 27 ASP HB3 H 14.326 -4.364 -7.203 1.00 . A A . 27 ASP HB3 1 1 10 7813 1 1 27 ASP N N 13.978 -4.862 -4.619 1.00 . A A . 27 ASP N 1 1 10 7814 1 1 27 ASP O O 11.617 -3.520 -6.789 1.00 . A A . 27 ASP O 1 1 10 7815 1 1 27 ASP OD1 O 14.398 -1.147 -6.818 1.00 . A A . 27 ASP OD1 1 1 10 7816 1 1 27 ASP OD2 O 13.666 -2.351 -8.491 1.00 . A A . 27 ASP OD2 1 1 10 7817 1 1 28 LYS C C 9.254 -3.413 -4.031 1.00 . A A . 28 LYS C 1 1 10 7818 1 1 28 LYS CA C 9.897 -4.514 -4.868 1.00 . A A . 28 LYS CA 1 1 10 7819 1 1 28 LYS CB C 9.437 -5.884 -4.365 1.00 . A A . 28 LYS CB 1 1 10 7820 1 1 28 LYS CD C 9.861 -7.565 -6.236 1.00 . A A . 28 LYS CD 1 1 10 7821 1 1 28 LYS CE C 9.975 -6.518 -7.338 1.00 . A A . 28 LYS CE 1 1 10 7822 1 1 28 LYS CG C 10.295 -7.055 -4.856 1.00 . A A . 28 LYS CG 1 1 10 7823 1 1 28 LYS H H 11.799 -4.781 -3.952 1.00 . A A . 28 LYS H 1 1 10 7824 1 1 28 LYS HA H 9.622 -4.391 -5.903 1.00 . A A . 28 LYS HA 1 1 10 7825 1 1 28 LYS HB2 H 9.459 -5.872 -3.275 1.00 . A A . 28 LYS HB2 1 1 10 7826 1 1 28 LYS HB3 H 8.421 -6.047 -4.691 1.00 . A A . 28 LYS HB3 1 1 10 7827 1 1 28 LYS HD2 H 10.484 -8.404 -6.502 1.00 . A A . 28 LYS HD2 1 1 10 7828 1 1 28 LYS HD3 H 8.833 -7.893 -6.172 1.00 . A A . 28 LYS HD3 1 1 10 7829 1 1 28 LYS HE2 H 9.339 -6.812 -8.157 1.00 . A A . 28 LYS HE2 1 1 10 7830 1 1 28 LYS HE3 H 9.636 -5.569 -6.947 1.00 . A A . 28 LYS HE3 1 1 10 7831 1 1 28 LYS HG2 H 11.338 -6.741 -4.891 1.00 . A A . 28 LYS HG2 1 1 10 7832 1 1 28 LYS HG3 H 10.199 -7.864 -4.143 1.00 . A A . 28 LYS HG3 1 1 10 7833 1 1 28 LYS HZ1 H 11.387 -5.698 -8.644 1.00 . A A . 28 LYS HZ1 1 1 10 7834 1 1 28 LYS HZ2 H 11.738 -7.286 -8.161 1.00 . A A . 28 LYS HZ2 1 1 10 7835 1 1 28 LYS HZ3 H 11.985 -6.000 -7.088 1.00 . A A . 28 LYS HZ3 1 1 10 7836 1 1 28 LYS N N 11.341 -4.403 -4.751 1.00 . A A . 28 LYS N 1 1 10 7837 1 1 28 LYS NZ N 11.366 -6.364 -7.840 1.00 . A A . 28 LYS NZ 1 1 10 7838 1 1 28 LYS O O 9.932 -2.786 -3.220 1.00 . A A . 28 LYS O 1 1 10 7839 1 1 29 TYR C C 5.773 -2.194 -3.626 1.00 . A A . 29 TYR C 1 1 10 7840 1 1 29 TYR CA C 7.288 -2.108 -3.484 1.00 . A A . 29 TYR CA 1 1 10 7841 1 1 29 TYR CB C 7.769 -0.709 -3.920 1.00 . A A . 29 TYR CB 1 1 10 7842 1 1 29 TYR CD1 C 8.092 -0.776 -6.436 1.00 . A A . 29 TYR CD1 1 1 10 7843 1 1 29 TYR CD2 C 6.311 0.544 -5.558 1.00 . A A . 29 TYR CD2 1 1 10 7844 1 1 29 TYR CE1 C 7.738 -0.402 -7.720 1.00 . A A . 29 TYR CE1 1 1 10 7845 1 1 29 TYR CE2 C 5.950 0.920 -6.838 1.00 . A A . 29 TYR CE2 1 1 10 7846 1 1 29 TYR CG C 7.386 -0.309 -5.333 1.00 . A A . 29 TYR CG 1 1 10 7847 1 1 29 TYR CZ C 6.665 0.445 -7.916 1.00 . A A . 29 TYR CZ 1 1 10 7848 1 1 29 TYR H H 7.460 -3.694 -4.880 1.00 . A A . 29 TYR H 1 1 10 7849 1 1 29 TYR HA H 7.539 -2.248 -2.445 1.00 . A A . 29 TYR HA 1 1 10 7850 1 1 29 TYR HB2 H 7.345 0.025 -3.253 1.00 . A A . 29 TYR HB2 1 1 10 7851 1 1 29 TYR HB3 H 8.848 -0.671 -3.846 1.00 . A A . 29 TYR HB3 1 1 10 7852 1 1 29 TYR HD1 H 8.929 -1.442 -6.281 1.00 . A A . 29 TYR HD1 1 1 10 7853 1 1 29 TYR HD2 H 5.754 0.917 -4.713 1.00 . A A . 29 TYR HD2 1 1 10 7854 1 1 29 TYR HE1 H 8.299 -0.775 -8.564 1.00 . A A . 29 TYR HE1 1 1 10 7855 1 1 29 TYR HE2 H 5.111 1.584 -6.988 1.00 . A A . 29 TYR HE2 1 1 10 7856 1 1 29 TYR HH H 6.119 1.773 -9.210 1.00 . A A . 29 TYR HH 1 1 10 7857 1 1 29 TYR N N 7.967 -3.157 -4.236 1.00 . A A . 29 TYR N 1 1 10 7858 1 1 29 TYR O O 5.242 -2.261 -4.733 1.00 . A A . 29 TYR O 1 1 10 7859 1 1 29 TYR OH O 6.306 0.819 -9.193 1.00 . A A . 29 TYR OH 1 1 10 7860 1 1 30 ALA C C 3.318 -0.867 -1.529 1.00 . A A . 30 ALA C 1 1 10 7861 1 1 30 ALA CA C 3.651 -2.004 -2.486 1.00 . A A . 30 ALA CA 1 1 10 7862 1 1 30 ALA CB C 2.906 -3.270 -2.091 1.00 . A A . 30 ALA CB 1 1 10 7863 1 1 30 ALA H H 5.545 -2.454 -1.662 1.00 . A A . 30 ALA H 1 1 10 7864 1 1 30 ALA HA H 3.344 -1.726 -3.484 1.00 . A A . 30 ALA HA 1 1 10 7865 1 1 30 ALA HB1 H 1.843 -3.080 -2.096 1.00 . A A . 30 ALA HB1 1 1 10 7866 1 1 30 ALA HB2 H 3.136 -4.058 -2.794 1.00 . A A . 30 ALA HB2 1 1 10 7867 1 1 30 ALA HB3 H 3.214 -3.573 -1.101 1.00 . A A . 30 ALA HB3 1 1 10 7868 1 1 30 ALA N N 5.084 -2.232 -2.502 1.00 . A A . 30 ALA N 1 1 10 7869 1 1 30 ALA O O 3.923 -0.761 -0.466 1.00 . A A . 30 ALA O 1 1 10 7870 1 1 31 CYS C C 0.606 0.679 -0.424 1.00 . A A . 31 CYS C 1 1 10 7871 1 1 31 CYS CA C 1.929 1.069 -1.040 1.00 . A A . 31 CYS CA 1 1 10 7872 1 1 31 CYS CB C 1.761 2.408 -1.789 1.00 . A A . 31 CYS CB 1 1 10 7873 1 1 31 CYS H H 1.899 -0.172 -2.744 1.00 . A A . 31 CYS H 1 1 10 7874 1 1 31 CYS HA H 2.662 1.186 -0.254 1.00 . A A . 31 CYS HA 1 1 10 7875 1 1 31 CYS HB2 H 1.080 2.259 -2.612 1.00 . A A . 31 CYS HB2 1 1 10 7876 1 1 31 CYS HB3 H 1.328 3.131 -1.110 1.00 . A A . 31 CYS HB3 1 1 10 7877 1 1 31 CYS N N 2.361 -0.024 -1.901 1.00 . A A . 31 CYS N 1 1 10 7878 1 1 31 CYS O O -0.417 0.595 -1.107 1.00 . A A . 31 CYS O 1 1 10 7879 1 1 31 CYS SG S 3.289 3.141 -2.476 1.00 . A A . 31 CYS SG 1 1 10 7880 1 1 32 ASN C C -1.124 1.149 2.322 1.00 . A A . 32 ASN C 1 1 10 7881 1 1 32 ASN CA C -0.542 -0.020 1.555 1.00 . A A . 32 ASN CA 1 1 10 7882 1 1 32 ASN CB C -0.177 -1.176 2.485 1.00 . A A . 32 ASN CB 1 1 10 7883 1 1 32 ASN CG C -1.394 -1.813 3.132 1.00 . A A . 32 ASN CG 1 1 10 7884 1 1 32 ASN H H 1.469 0.551 1.354 1.00 . A A . 32 ASN H 1 1 10 7885 1 1 32 ASN HA H -1.259 -0.358 0.823 1.00 . A A . 32 ASN HA 1 1 10 7886 1 1 32 ASN HB2 H 0.342 -1.929 1.903 1.00 . A A . 32 ASN HB2 1 1 10 7887 1 1 32 ASN HB3 H 0.478 -0.814 3.264 1.00 . A A . 32 ASN HB3 1 1 10 7888 1 1 32 ASN HD21 H -0.341 -2.245 4.764 1.00 . A A . 32 ASN HD21 1 1 10 7889 1 1 32 ASN HD22 H -1.999 -2.742 4.782 1.00 . A A . 32 ASN HD22 1 1 10 7890 1 1 32 ASN N N 0.632 0.428 0.859 1.00 . A A . 32 ASN N 1 1 10 7891 1 1 32 ASN ND2 N -1.231 -2.313 4.348 1.00 . A A . 32 ASN ND2 1 1 10 7892 1 1 32 ASN O O -0.609 1.560 3.357 1.00 . A A . 32 ASN O 1 1 10 7893 1 1 32 ASN OD1 O -2.475 -1.846 2.546 1.00 . A A . 32 ASN OD1 1 1 10 7894 1 1 33 CYS C C -3.877 2.623 3.301 1.00 . A A . 33 CYS C 1 1 10 7895 1 1 33 CYS CA C -2.793 2.908 2.278 1.00 . A A . 33 CYS CA 1 1 10 7896 1 1 33 CYS CB C -3.365 3.719 1.122 1.00 . A A . 33 CYS CB 1 1 10 7897 1 1 33 CYS H H -2.546 1.294 0.955 1.00 . A A . 33 CYS H 1 1 10 7898 1 1 33 CYS HA H -2.018 3.488 2.752 1.00 . A A . 33 CYS HA 1 1 10 7899 1 1 33 CYS HB2 H -3.949 3.059 0.483 1.00 . A A . 33 CYS HB2 1 1 10 7900 1 1 33 CYS HB3 H -4.001 4.500 1.512 1.00 . A A . 33 CYS HB3 1 1 10 7901 1 1 33 CYS N N -2.183 1.699 1.761 1.00 . A A . 33 CYS N 1 1 10 7902 1 1 33 CYS O O -3.609 2.554 4.497 1.00 . A A . 33 CYS O 1 1 10 7903 1 1 33 CYS SG S -2.086 4.498 0.091 1.00 . A A . 33 CYS SG 1 1 10 7904 1 1 34 VAL C C -7.171 1.311 3.263 1.00 . A A . 34 VAL C 1 1 10 7905 1 1 34 VAL CA C -6.229 2.403 3.721 1.00 . A A . 34 VAL CA 1 1 10 7906 1 1 34 VAL CB C -6.926 3.786 3.733 1.00 . A A . 34 VAL CB 1 1 10 7907 1 1 34 VAL CG1 C -7.666 4.042 2.432 1.00 . A A . 34 VAL CG1 1 1 10 7908 1 1 34 VAL CG2 C -7.857 3.925 4.928 1.00 . A A . 34 VAL CG2 1 1 10 7909 1 1 34 VAL H H -5.242 2.257 1.871 1.00 . A A . 34 VAL H 1 1 10 7910 1 1 34 VAL HA H -5.877 2.178 4.719 1.00 . A A . 34 VAL HA 1 1 10 7911 1 1 34 VAL HB H -6.151 4.542 3.820 1.00 . A A . 34 VAL HB 1 1 10 7912 1 1 34 VAL HG11 H -8.395 3.262 2.269 1.00 . A A . 34 VAL HG11 1 1 10 7913 1 1 34 VAL HG12 H -8.164 4.998 2.483 1.00 . A A . 34 VAL HG12 1 1 10 7914 1 1 34 VAL HG13 H -6.959 4.048 1.614 1.00 . A A . 34 VAL HG13 1 1 10 7915 1 1 34 VAL HG21 H -8.638 3.183 4.865 1.00 . A A . 34 VAL HG21 1 1 10 7916 1 1 34 VAL HG22 H -7.295 3.780 5.840 1.00 . A A . 34 VAL HG22 1 1 10 7917 1 1 34 VAL HG23 H -8.296 4.911 4.927 1.00 . A A . 34 VAL HG23 1 1 10 7918 1 1 34 VAL N N -5.097 2.426 2.834 1.00 . A A . 34 VAL N 1 1 10 7919 1 1 34 VAL O O -7.140 0.931 2.088 1.00 . A A . 34 VAL O 1 1 10 7920 1 1 35 VAL C C -10.033 0.046 3.009 1.00 . A A . 35 VAL C 1 1 10 7921 1 1 35 VAL CA C -8.844 -0.352 3.884 1.00 . A A . 35 VAL CA 1 1 10 7922 1 1 35 VAL CB C -9.317 -1.037 5.175 1.00 . A A . 35 VAL CB 1 1 10 7923 1 1 35 VAL CG1 C -8.113 -1.452 6.004 1.00 . A A . 35 VAL CG1 1 1 10 7924 1 1 35 VAL CG2 C -10.230 -0.134 5.991 1.00 . A A . 35 VAL CG2 1 1 10 7925 1 1 35 VAL H H -7.982 1.168 5.080 1.00 . A A . 35 VAL H 1 1 10 7926 1 1 35 VAL HA H -8.252 -1.068 3.330 1.00 . A A . 35 VAL HA 1 1 10 7927 1 1 35 VAL HB H -9.864 -1.929 4.900 1.00 . A A . 35 VAL HB 1 1 10 7928 1 1 35 VAL HG11 H -7.503 -2.137 5.433 1.00 . A A . 35 VAL HG11 1 1 10 7929 1 1 35 VAL HG12 H -7.533 -0.577 6.256 1.00 . A A . 35 VAL HG12 1 1 10 7930 1 1 35 VAL HG13 H -8.447 -1.936 6.910 1.00 . A A . 35 VAL HG13 1 1 10 7931 1 1 35 VAL HG21 H -9.698 0.766 6.259 1.00 . A A . 35 VAL HG21 1 1 10 7932 1 1 35 VAL HG22 H -11.101 0.120 5.404 1.00 . A A . 35 VAL HG22 1 1 10 7933 1 1 35 VAL HG23 H -10.539 -0.652 6.887 1.00 . A A . 35 VAL HG23 1 1 10 7934 1 1 35 VAL N N -7.976 0.785 4.176 1.00 . A A . 35 VAL N 1 1 10 7935 1 1 35 VAL O O -11.176 -0.344 3.245 1.00 . A A . 35 VAL O 1 1 10 7936 1 1 36 GLY C C -10.053 1.799 -0.203 1.00 . A A . 36 GLY C 1 1 10 7937 1 1 36 GLY CA C -10.701 1.308 1.064 1.00 . A A . 36 GLY CA 1 1 10 7938 1 1 36 GLY H H -8.758 0.938 1.789 1.00 . A A . 36 GLY H 1 1 10 7939 1 1 36 GLY HA2 H -11.418 0.534 0.823 1.00 . A A . 36 GLY HA2 1 1 10 7940 1 1 36 GLY HA3 H -11.212 2.129 1.541 1.00 . A A . 36 GLY HA3 1 1 10 7941 1 1 36 GLY N N -9.712 0.774 1.965 1.00 . A A . 36 GLY N 1 1 10 7942 1 1 36 GLY O O -10.715 2.331 -1.094 1.00 . A A . 36 GLY O 1 1 10 7943 1 1 37 TYR C C -6.732 1.139 -1.551 1.00 . A A . 37 TYR C 1 1 10 7944 1 1 37 TYR CA C -7.956 2.029 -1.408 1.00 . A A . 37 TYR CA 1 1 10 7945 1 1 37 TYR CB C -7.500 3.490 -1.270 1.00 . A A . 37 TYR CB 1 1 10 7946 1 1 37 TYR CD1 C -8.917 5.009 -2.701 1.00 . A A . 37 TYR CD1 1 1 10 7947 1 1 37 TYR CD2 C -9.297 5.007 -0.352 1.00 . A A . 37 TYR CD2 1 1 10 7948 1 1 37 TYR CE1 C -9.920 5.939 -2.868 1.00 . A A . 37 TYR CE1 1 1 10 7949 1 1 37 TYR CE2 C -10.301 5.942 -0.510 1.00 . A A . 37 TYR CE2 1 1 10 7950 1 1 37 TYR CG C -8.588 4.526 -1.444 1.00 . A A . 37 TYR CG 1 1 10 7951 1 1 37 TYR CZ C -10.564 6.452 -1.759 1.00 . A A . 37 TYR CZ 1 1 10 7952 1 1 37 TYR H H -8.307 1.073 0.408 1.00 . A A . 37 TYR H 1 1 10 7953 1 1 37 TYR HA H -8.576 1.922 -2.297 1.00 . A A . 37 TYR HA 1 1 10 7954 1 1 37 TYR HB2 H -7.078 3.631 -0.287 1.00 . A A . 37 TYR HB2 1 1 10 7955 1 1 37 TYR HB3 H -6.738 3.687 -2.009 1.00 . A A . 37 TYR HB3 1 1 10 7956 1 1 37 TYR HD1 H -8.375 4.644 -3.561 1.00 . A A . 37 TYR HD1 1 1 10 7957 1 1 37 TYR HD2 H -9.053 4.644 0.637 1.00 . A A . 37 TYR HD2 1 1 10 7958 1 1 37 TYR HE1 H -10.160 6.302 -3.857 1.00 . A A . 37 TYR HE1 1 1 10 7959 1 1 37 TYR HE2 H -10.843 6.305 0.353 1.00 . A A . 37 TYR HE2 1 1 10 7960 1 1 37 TYR HH H -11.526 8.031 -1.284 1.00 . A A . 37 TYR HH 1 1 10 7961 1 1 37 TYR N N -8.741 1.593 -0.280 1.00 . A A . 37 TYR N 1 1 10 7962 1 1 37 TYR O O -5.752 1.276 -0.812 1.00 . A A . 37 TYR O 1 1 10 7963 1 1 37 TYR OH O -11.618 7.321 -1.942 1.00 . A A . 37 TYR OH 1 1 10 7964 1 1 38 ILE C C -5.797 -0.747 -4.432 1.00 . A A . 38 ILE C 1 1 10 7965 1 1 38 ILE CA C -5.665 -0.528 -2.930 1.00 . A A . 38 ILE CA 1 1 10 7966 1 1 38 ILE CB C -5.499 -1.869 -2.167 1.00 . A A . 38 ILE CB 1 1 10 7967 1 1 38 ILE CD1 C -3.042 -2.063 -2.868 1.00 . A A . 38 ILE CD1 1 1 10 7968 1 1 38 ILE CG1 C -4.041 -2.038 -1.732 1.00 . A A . 38 ILE CG1 1 1 10 7969 1 1 38 ILE CG2 C -5.956 -3.070 -2.988 1.00 . A A . 38 ILE CG2 1 1 10 7970 1 1 38 ILE H H -7.683 0.006 -2.872 1.00 . A A . 38 ILE H 1 1 10 7971 1 1 38 ILE HA H -4.795 0.078 -2.739 1.00 . A A . 38 ILE HA 1 1 10 7972 1 1 38 ILE HB H -6.117 -1.823 -1.284 1.00 . A A . 38 ILE HB 1 1 10 7973 1 1 38 ILE HD11 H -3.272 -2.884 -3.531 1.00 . A A . 38 ILE HD11 1 1 10 7974 1 1 38 ILE HD12 H -3.095 -1.133 -3.416 1.00 . A A . 38 ILE HD12 1 1 10 7975 1 1 38 ILE HD13 H -2.047 -2.190 -2.469 1.00 . A A . 38 ILE HD13 1 1 10 7976 1 1 38 ILE HG12 H -3.780 -1.216 -1.079 1.00 . A A . 38 ILE HG12 1 1 10 7977 1 1 38 ILE HG13 H -3.946 -2.965 -1.186 1.00 . A A . 38 ILE HG13 1 1 10 7978 1 1 38 ILE HG21 H -6.994 -2.941 -3.269 1.00 . A A . 38 ILE HG21 1 1 10 7979 1 1 38 ILE HG22 H -5.351 -3.150 -3.879 1.00 . A A . 38 ILE HG22 1 1 10 7980 1 1 38 ILE HG23 H -5.854 -3.969 -2.400 1.00 . A A . 38 ILE HG23 1 1 10 7981 1 1 38 ILE N N -6.809 0.215 -2.486 1.00 . A A . 38 ILE N 1 1 10 7982 1 1 38 ILE O O -6.870 -1.064 -4.920 1.00 . A A . 38 ILE O 1 1 10 7983 1 1 39 GLY C C -3.263 -0.487 -7.054 1.00 . A A . 39 GLY C 1 1 10 7984 1 1 39 GLY CA C -4.668 -0.723 -6.564 1.00 . A A . 39 GLY CA 1 1 10 7985 1 1 39 GLY H H -4.006 0.048 -4.727 1.00 . A A . 39 GLY H 1 1 10 7986 1 1 39 GLY HA2 H -4.936 -1.760 -6.720 1.00 . A A . 39 GLY HA2 1 1 10 7987 1 1 39 GLY HA3 H -5.348 -0.089 -7.111 1.00 . A A . 39 GLY HA3 1 1 10 7988 1 1 39 GLY N N -4.749 -0.414 -5.155 1.00 . A A . 39 GLY N 1 1 10 7989 1 1 39 GLY O O -2.879 0.665 -7.262 1.00 . A A . 39 GLY O 1 1 10 7990 1 1 40 GLU C C -0.285 -0.969 -6.362 1.00 . A A . 40 GLU C 1 1 10 7991 1 1 40 GLU CA C -1.078 -1.520 -7.544 1.00 . A A . 40 GLU CA 1 1 10 7992 1 1 40 GLU CB C -0.835 -0.668 -8.797 1.00 . A A . 40 GLU CB 1 1 10 7993 1 1 40 GLU CD C 1.124 -1.973 -9.708 1.00 . A A . 40 GLU CD 1 1 10 7994 1 1 40 GLU CG C 0.619 -0.626 -9.236 1.00 . A A . 40 GLU CG 1 1 10 7995 1 1 40 GLU H H -2.905 -2.450 -7.068 1.00 . A A . 40 GLU H 1 1 10 7996 1 1 40 GLU HA H -0.751 -2.533 -7.737 1.00 . A A . 40 GLU HA 1 1 10 7997 1 1 40 GLU HB2 H -1.421 -1.070 -9.611 1.00 . A A . 40 GLU HB2 1 1 10 7998 1 1 40 GLU HB3 H -1.159 0.344 -8.596 1.00 . A A . 40 GLU HB3 1 1 10 7999 1 1 40 GLU HG2 H 0.716 0.082 -10.045 1.00 . A A . 40 GLU HG2 1 1 10 8000 1 1 40 GLU HG3 H 1.225 -0.301 -8.402 1.00 . A A . 40 GLU HG3 1 1 10 8001 1 1 40 GLU N N -2.498 -1.572 -7.205 1.00 . A A . 40 GLU N 1 1 10 8002 1 1 40 GLU O O 0.647 -1.599 -5.860 1.00 . A A . 40 GLU O 1 1 10 8003 1 1 40 GLU OE1 O 1.362 -2.859 -8.865 1.00 . A A . 40 GLU OE1 1 1 10 8004 1 1 40 GLU OE2 O 1.288 -2.155 -10.934 1.00 . A A . 40 GLU OE2 1 1 10 8005 1 1 41 ARG C C -1.042 1.760 -4.075 1.00 . A A . 41 ARG C 1 1 10 8006 1 1 41 ARG CA C -0.040 0.905 -4.834 1.00 . A A . 41 ARG CA 1 1 10 8007 1 1 41 ARG CB C 1.090 1.734 -5.429 1.00 . A A . 41 ARG CB 1 1 10 8008 1 1 41 ARG CD C -0.173 3.673 -6.487 1.00 . A A . 41 ARG CD 1 1 10 8009 1 1 41 ARG CG C 0.708 2.453 -6.720 1.00 . A A . 41 ARG CG 1 1 10 8010 1 1 41 ARG CZ C -0.211 5.508 -8.136 1.00 . A A . 41 ARG CZ 1 1 10 8011 1 1 41 ARG H H -1.492 0.610 -6.329 1.00 . A A . 41 ARG H 1 1 10 8012 1 1 41 ARG HA H 0.371 0.175 -4.160 1.00 . A A . 41 ARG HA 1 1 10 8013 1 1 41 ARG HB2 H 1.415 2.469 -4.706 1.00 . A A . 41 ARG HB2 1 1 10 8014 1 1 41 ARG HB3 H 1.905 1.063 -5.650 1.00 . A A . 41 ARG HB3 1 1 10 8015 1 1 41 ARG HD2 H -1.057 3.367 -5.945 1.00 . A A . 41 ARG HD2 1 1 10 8016 1 1 41 ARG HD3 H 0.380 4.395 -5.904 1.00 . A A . 41 ARG HD3 1 1 10 8017 1 1 41 ARG HE H -1.146 3.754 -8.348 1.00 . A A . 41 ARG HE 1 1 10 8018 1 1 41 ARG HG2 H 1.608 2.766 -7.226 1.00 . A A . 41 ARG HG2 1 1 10 8019 1 1 41 ARG HG3 H 0.168 1.754 -7.345 1.00 . A A . 41 ARG HG3 1 1 10 8020 1 1 41 ARG HH11 H 0.827 5.924 -6.450 1.00 . A A . 41 ARG HH11 1 1 10 8021 1 1 41 ARG HH12 H 0.810 7.195 -7.634 1.00 . A A . 41 ARG HH12 1 1 10 8022 1 1 41 ARG HH21 H -1.171 5.394 -9.914 1.00 . A A . 41 ARG HH21 1 1 10 8023 1 1 41 ARG HH22 H -0.320 6.887 -9.623 1.00 . A A . 41 ARG HH22 1 1 10 8024 1 1 41 ARG N N -0.702 0.197 -5.905 1.00 . A A . 41 ARG N 1 1 10 8025 1 1 41 ARG NE N -0.576 4.288 -7.750 1.00 . A A . 41 ARG NE 1 1 10 8026 1 1 41 ARG NH1 N 0.537 6.265 -7.342 1.00 . A A . 41 ARG NH1 1 1 10 8027 1 1 41 ARG NH2 N -0.598 5.966 -9.317 1.00 . A A . 41 ARG NH2 1 1 10 8028 1 1 41 ARG O O -0.742 2.870 -3.640 1.00 . A A . 41 ARG O 1 1 10 8029 1 1 42 CYS C C -4.007 2.884 -4.130 1.00 . A A . 42 CYS C 1 1 10 8030 1 1 42 CYS CA C -3.364 1.812 -3.256 1.00 . A A . 42 CYS CA 1 1 10 8031 1 1 42 CYS CB C -2.990 2.372 -1.869 1.00 . A A . 42 CYS CB 1 1 10 8032 1 1 42 CYS H H -2.339 0.281 -4.257 1.00 . A A . 42 CYS H 1 1 10 8033 1 1 42 CYS HA H -4.094 1.038 -3.114 1.00 . A A . 42 CYS HA 1 1 10 8034 1 1 42 CYS HB2 H -3.780 2.136 -1.174 1.00 . A A . 42 CYS HB2 1 1 10 8035 1 1 42 CYS HB3 H -2.079 1.895 -1.537 1.00 . A A . 42 CYS HB3 1 1 10 8036 1 1 42 CYS N N -2.228 1.185 -3.918 1.00 . A A . 42 CYS N 1 1 10 8037 1 1 42 CYS O O -3.402 3.911 -4.412 1.00 . A A . 42 CYS O 1 1 10 8038 1 1 42 CYS SG S -2.724 4.178 -1.794 1.00 . A A . 42 CYS SG 1 1 10 8039 1 1 43 GLN C C -7.410 3.084 -5.652 1.00 . A A . 43 GLN C 1 1 10 8040 1 1 43 GLN CA C -6.063 3.635 -5.214 1.00 . A A . 43 GLN CA 1 1 10 8041 1 1 43 GLN CB C -5.380 4.325 -6.402 1.00 . A A . 43 GLN CB 1 1 10 8042 1 1 43 GLN CD C -4.311 4.129 -8.678 1.00 . A A . 43 GLN CD 1 1 10 8043 1 1 43 GLN CG C -5.008 3.395 -7.545 1.00 . A A . 43 GLN CG 1 1 10 8044 1 1 43 GLN H H -5.517 1.655 -4.634 1.00 . A A . 43 GLN H 1 1 10 8045 1 1 43 GLN HA H -6.237 4.376 -4.446 1.00 . A A . 43 GLN HA 1 1 10 8046 1 1 43 GLN HB2 H -6.041 5.085 -6.787 1.00 . A A . 43 GLN HB2 1 1 10 8047 1 1 43 GLN HB3 H -4.478 4.797 -6.044 1.00 . A A . 43 GLN HB3 1 1 10 8048 1 1 43 GLN HE21 H -5.046 2.855 -10.011 1.00 . A A . 43 GLN HE21 1 1 10 8049 1 1 43 GLN HE22 H -4.042 4.110 -10.642 1.00 . A A . 43 GLN HE22 1 1 10 8050 1 1 43 GLN HG2 H -4.342 2.630 -7.169 1.00 . A A . 43 GLN HG2 1 1 10 8051 1 1 43 GLN HG3 H -5.906 2.935 -7.928 1.00 . A A . 43 GLN HG3 1 1 10 8052 1 1 43 GLN N N -5.212 2.594 -4.625 1.00 . A A . 43 GLN N 1 1 10 8053 1 1 43 GLN NE2 N -4.486 3.648 -9.898 1.00 . A A . 43 GLN NE2 1 1 10 8054 1 1 43 GLN O O -8.133 3.732 -6.406 1.00 . A A . 43 GLN O 1 1 10 8055 1 1 43 GLN OE1 O -3.624 5.124 -8.457 1.00 . A A . 43 GLN OE1 1 1 10 8056 1 1 44 TYR C C -9.605 0.536 -4.448 1.00 . A A . 44 TYR C 1 1 10 8057 1 1 44 TYR CA C -8.999 1.266 -5.587 1.00 . A A . 44 TYR CA 1 1 10 8058 1 1 44 TYR CB C -8.742 0.304 -6.753 1.00 . A A . 44 TYR CB 1 1 10 8059 1 1 44 TYR CD1 C -9.378 1.801 -8.679 1.00 . A A . 44 TYR CD1 1 1 10 8060 1 1 44 TYR CD2 C -7.210 0.813 -8.694 1.00 . A A . 44 TYR CD2 1 1 10 8061 1 1 44 TYR CE1 C -9.106 2.422 -9.882 1.00 . A A . 44 TYR CE1 1 1 10 8062 1 1 44 TYR CE2 C -6.931 1.431 -9.896 1.00 . A A . 44 TYR CE2 1 1 10 8063 1 1 44 TYR CG C -8.437 0.989 -8.065 1.00 . A A . 44 TYR CG 1 1 10 8064 1 1 44 TYR CZ C -7.869 2.266 -10.467 1.00 . A A . 44 TYR CZ 1 1 10 8065 1 1 44 TYR H H -7.196 1.439 -4.504 1.00 . A A . 44 TYR H 1 1 10 8066 1 1 44 TYR HA H -9.712 2.001 -5.901 1.00 . A A . 44 TYR HA 1 1 10 8067 1 1 44 TYR HB2 H -7.894 -0.321 -6.506 1.00 . A A . 44 TYR HB2 1 1 10 8068 1 1 44 TYR HB3 H -9.613 -0.319 -6.895 1.00 . A A . 44 TYR HB3 1 1 10 8069 1 1 44 TYR HD1 H -10.335 1.948 -8.203 1.00 . A A . 44 TYR HD1 1 1 10 8070 1 1 44 TYR HD2 H -6.466 0.183 -8.227 1.00 . A A . 44 TYR HD2 1 1 10 8071 1 1 44 TYR HE1 H -9.852 3.051 -10.343 1.00 . A A . 44 TYR HE1 1 1 10 8072 1 1 44 TYR HE2 H -5.971 1.283 -10.370 1.00 . A A . 44 TYR HE2 1 1 10 8073 1 1 44 TYR HH H -7.256 2.187 -12.314 1.00 . A A . 44 TYR HH 1 1 10 8074 1 1 44 TYR N N -7.765 1.902 -5.173 1.00 . A A . 44 TYR N 1 1 10 8075 1 1 44 TYR O O -9.321 0.802 -3.310 1.00 . A A . 44 TYR O 1 1 10 8076 1 1 44 TYR OH O -7.616 2.843 -11.689 1.00 . A A . 44 TYR OH 1 1 10 8077 1 1 45 ARG C C -10.572 -1.508 -2.611 1.00 . A A . 45 ARG C 1 1 10 8078 1 1 45 ARG CA C -11.107 -1.332 -4.034 1.00 . A A . 45 ARG CA 1 1 10 8079 1 1 45 ARG CB C -10.884 -2.613 -4.823 1.00 . A A . 45 ARG CB 1 1 10 8080 1 1 45 ARG CD C -10.318 -2.985 -7.244 1.00 . A A . 45 ARG CD 1 1 10 8081 1 1 45 ARG CG C -11.382 -2.530 -6.258 1.00 . A A . 45 ARG CG 1 1 10 8082 1 1 45 ARG CZ C -9.227 -5.084 -7.954 1.00 . A A . 45 ARG CZ 1 1 10 8083 1 1 45 ARG H H -10.969 -0.013 -5.680 1.00 . A A . 45 ARG H 1 1 10 8084 1 1 45 ARG HA H -12.144 -1.151 -3.941 1.00 . A A . 45 ARG HA 1 1 10 8085 1 1 45 ARG HB2 H -9.817 -2.812 -4.846 1.00 . A A . 45 ARG HB2 1 1 10 8086 1 1 45 ARG HB3 H -11.390 -3.428 -4.328 1.00 . A A . 45 ARG HB3 1 1 10 8087 1 1 45 ARG HD2 H -10.628 -2.712 -8.243 1.00 . A A . 45 ARG HD2 1 1 10 8088 1 1 45 ARG HD3 H -9.387 -2.480 -7.003 1.00 . A A . 45 ARG HD3 1 1 10 8089 1 1 45 ARG HE H -10.652 -4.948 -6.555 1.00 . A A . 45 ARG HE 1 1 10 8090 1 1 45 ARG HG2 H -12.251 -3.163 -6.365 1.00 . A A . 45 ARG HG2 1 1 10 8091 1 1 45 ARG HG3 H -11.651 -1.507 -6.477 1.00 . A A . 45 ARG HG3 1 1 10 8092 1 1 45 ARG HH11 H -8.588 -3.433 -8.954 1.00 . A A . 45 ARG HH11 1 1 10 8093 1 1 45 ARG HH12 H -7.838 -4.933 -9.424 1.00 . A A . 45 ARG HH12 1 1 10 8094 1 1 45 ARG HH21 H -9.662 -6.910 -7.188 1.00 . A A . 45 ARG HH21 1 1 10 8095 1 1 45 ARG HH22 H -8.427 -6.891 -8.410 1.00 . A A . 45 ARG HH22 1 1 10 8096 1 1 45 ARG N N -10.560 -0.228 -4.815 1.00 . A A . 45 ARG N 1 1 10 8097 1 1 45 ARG NE N -10.100 -4.432 -7.190 1.00 . A A . 45 ARG NE 1 1 10 8098 1 1 45 ARG NH1 N -8.491 -4.430 -8.843 1.00 . A A . 45 ARG NH1 1 1 10 8099 1 1 45 ARG NH2 N -9.098 -6.399 -7.840 1.00 . A A . 45 ARG NH2 1 1 10 8100 1 1 45 ARG O O -9.364 -1.523 -2.344 1.00 . A A . 45 ARG O 1 1 10 8101 1 1 46 ASP C C -10.822 -3.319 0.012 1.00 . A A . 46 ASP C 1 1 10 8102 1 1 46 ASP CA C -11.281 -1.902 -0.299 1.00 . A A . 46 ASP CA 1 1 10 8103 1 1 46 ASP CB C -12.578 -1.613 0.478 1.00 . A A . 46 ASP CB 1 1 10 8104 1 1 46 ASP CG C -13.401 -0.457 -0.080 1.00 . A A . 46 ASP CG 1 1 10 8105 1 1 46 ASP H H -12.429 -1.958 -2.056 1.00 . A A . 46 ASP H 1 1 10 8106 1 1 46 ASP HA H -10.515 -1.200 -0.015 1.00 . A A . 46 ASP HA 1 1 10 8107 1 1 46 ASP HB2 H -13.196 -2.497 0.463 1.00 . A A . 46 ASP HB2 1 1 10 8108 1 1 46 ASP HB3 H -12.323 -1.382 1.503 1.00 . A A . 46 ASP HB3 1 1 10 8109 1 1 46 ASP N N -11.520 -1.787 -1.728 1.00 . A A . 46 ASP N 1 1 10 8110 1 1 46 ASP O O -11.133 -3.868 1.068 1.00 . A A . 46 ASP O 1 1 10 8111 1 1 46 ASP OD1 O -13.964 -0.595 -1.190 1.00 . A A . 46 ASP OD1 1 1 10 8112 1 1 46 ASP OD2 O -13.507 0.585 0.593 1.00 . A A . 46 ASP OD2 1 1 10 8113 1 1 47 LEU C C -9.212 -5.809 0.395 1.00 . A A . 47 LEU C 1 1 10 8114 1 1 47 LEU CA C -9.735 -5.310 -0.942 1.00 . A A . 47 LEU CA 1 1 10 8115 1 1 47 LEU CB C -8.691 -5.596 -2.024 1.00 . A A . 47 LEU CB 1 1 10 8116 1 1 47 LEU CD1 C -8.015 -5.633 -4.435 1.00 . A A . 47 LEU CD1 1 1 10 8117 1 1 47 LEU CD2 C -10.412 -5.948 -3.817 1.00 . A A . 47 LEU CD2 1 1 10 8118 1 1 47 LEU CG C -9.111 -5.251 -3.454 1.00 . A A . 47 LEU CG 1 1 10 8119 1 1 47 LEU H H -9.716 -3.317 -1.645 1.00 . A A . 47 LEU H 1 1 10 8120 1 1 47 LEU HA H -10.637 -5.853 -1.183 1.00 . A A . 47 LEU HA 1 1 10 8121 1 1 47 LEU HB2 H -7.800 -5.034 -1.789 1.00 . A A . 47 LEU HB2 1 1 10 8122 1 1 47 LEU HB3 H -8.450 -6.648 -1.991 1.00 . A A . 47 LEU HB3 1 1 10 8123 1 1 47 LEU HD11 H -7.110 -5.095 -4.192 1.00 . A A . 47 LEU HD11 1 1 10 8124 1 1 47 LEU HD12 H -7.830 -6.695 -4.373 1.00 . A A . 47 LEU HD12 1 1 10 8125 1 1 47 LEU HD13 H -8.326 -5.379 -5.438 1.00 . A A . 47 LEU HD13 1 1 10 8126 1 1 47 LEU HD21 H -10.282 -7.017 -3.737 1.00 . A A . 47 LEU HD21 1 1 10 8127 1 1 47 LEU HD22 H -11.194 -5.629 -3.143 1.00 . A A . 47 LEU HD22 1 1 10 8128 1 1 47 LEU HD23 H -10.686 -5.694 -4.831 1.00 . A A . 47 LEU HD23 1 1 10 8129 1 1 47 LEU HG H -9.269 -4.185 -3.529 1.00 . A A . 47 LEU HG 1 1 10 8130 1 1 47 LEU N N -10.067 -3.887 -0.925 1.00 . A A . 47 LEU N 1 1 10 8131 1 1 47 LEU O O -9.521 -6.920 0.804 1.00 . A A . 47 LEU O 1 1 10 8132 1 1 48 LYS C C -8.668 -5.858 3.386 1.00 . A A . 48 LYS C 1 1 10 8133 1 1 48 LYS CA C -7.734 -5.416 2.260 1.00 . A A . 48 LYS CA 1 1 10 8134 1 1 48 LYS CB C -6.778 -4.316 2.722 1.00 . A A . 48 LYS CB 1 1 10 8135 1 1 48 LYS CD C -6.208 -1.870 2.738 1.00 . A A . 48 LYS CD 1 1 10 8136 1 1 48 LYS CE C -5.317 -1.573 1.535 1.00 . A A . 48 LYS CE 1 1 10 8137 1 1 48 LYS CG C -7.275 -2.910 2.437 1.00 . A A . 48 LYS CG 1 1 10 8138 1 1 48 LYS H H -8.419 -4.034 0.823 1.00 . A A . 48 LYS H 1 1 10 8139 1 1 48 LYS HA H -7.143 -6.267 1.964 1.00 . A A . 48 LYS HA 1 1 10 8140 1 1 48 LYS HB2 H -6.629 -4.411 3.787 1.00 . A A . 48 LYS HB2 1 1 10 8141 1 1 48 LYS HB3 H -5.829 -4.447 2.222 1.00 . A A . 48 LYS HB3 1 1 10 8142 1 1 48 LYS HD2 H -6.689 -0.956 3.048 1.00 . A A . 48 LYS HD2 1 1 10 8143 1 1 48 LYS HD3 H -5.593 -2.245 3.543 1.00 . A A . 48 LYS HD3 1 1 10 8144 1 1 48 LYS HE2 H -5.930 -1.223 0.695 1.00 . A A . 48 LYS HE2 1 1 10 8145 1 1 48 LYS HE3 H -4.627 -0.789 1.814 1.00 . A A . 48 LYS HE3 1 1 10 8146 1 1 48 LYS HG2 H -7.547 -2.839 1.393 1.00 . A A . 48 LYS HG2 1 1 10 8147 1 1 48 LYS HG3 H -8.143 -2.712 3.050 1.00 . A A . 48 LYS HG3 1 1 10 8148 1 1 48 LYS HZ1 H -5.153 -3.604 1.022 1.00 . A A . 48 LYS HZ1 1 1 10 8149 1 1 48 LYS HZ2 H -3.810 -2.988 1.850 1.00 . A A . 48 LYS HZ2 1 1 10 8150 1 1 48 LYS HZ3 H -4.051 -2.600 0.227 1.00 . A A . 48 LYS HZ3 1 1 10 8151 1 1 48 LYS N N -8.460 -4.973 1.086 1.00 . A A . 48 LYS N 1 1 10 8152 1 1 48 LYS NZ N -4.532 -2.772 1.129 1.00 . A A . 48 LYS NZ 1 1 10 8153 1 1 48 LYS O O -8.707 -7.033 3.727 1.00 . A A . 48 LYS O 1 1 10 8154 1 1 49 TRP C C -11.767 -5.402 4.656 1.00 . A A . 49 TRP C 1 1 10 8155 1 1 49 TRP CA C -10.305 -5.267 5.069 1.00 . A A . 49 TRP CA 1 1 10 8156 1 1 49 TRP CB C -10.172 -4.246 6.191 1.00 . A A . 49 TRP CB 1 1 10 8157 1 1 49 TRP CD1 C -7.717 -4.836 6.657 1.00 . A A . 49 TRP CD1 1 1 10 8158 1 1 49 TRP CD2 C -8.937 -4.446 8.497 1.00 . A A . 49 TRP CD2 1 1 10 8159 1 1 49 TRP CE2 C -7.620 -4.759 8.887 1.00 . A A . 49 TRP CE2 1 1 10 8160 1 1 49 TRP CE3 C -9.884 -4.161 9.489 1.00 . A A . 49 TRP CE3 1 1 10 8161 1 1 49 TRP CG C -8.978 -4.502 7.066 1.00 . A A . 49 TRP CG 1 1 10 8162 1 1 49 TRP CH2 C -8.175 -4.513 11.169 1.00 . A A . 49 TRP CH2 1 1 10 8163 1 1 49 TRP CZ2 C -7.231 -4.797 10.224 1.00 . A A . 49 TRP CZ2 1 1 10 8164 1 1 49 TRP CZ3 C -9.490 -4.199 10.814 1.00 . A A . 49 TRP CZ3 1 1 10 8165 1 1 49 TRP H H -9.360 -4.007 3.653 1.00 . A A . 49 TRP H 1 1 10 8166 1 1 49 TRP HA H -9.981 -6.225 5.451 1.00 . A A . 49 TRP HA 1 1 10 8167 1 1 49 TRP HB2 H -10.077 -3.258 5.758 1.00 . A A . 49 TRP HB2 1 1 10 8168 1 1 49 TRP HB3 H -11.055 -4.282 6.812 1.00 . A A . 49 TRP HB3 1 1 10 8169 1 1 49 TRP HD1 H -7.424 -4.959 5.624 1.00 . A A . 49 TRP HD1 1 1 10 8170 1 1 49 TRP HE1 H -5.941 -5.240 7.707 1.00 . A A . 49 TRP HE1 1 1 10 8171 1 1 49 TRP HE3 H -10.904 -3.917 9.235 1.00 . A A . 49 TRP HE3 1 1 10 8172 1 1 49 TRP HH2 H -7.916 -4.531 12.217 1.00 . A A . 49 TRP HH2 1 1 10 8173 1 1 49 TRP HZ2 H -6.219 -5.040 10.516 1.00 . A A . 49 TRP HZ2 1 1 10 8174 1 1 49 TRP HZ3 H -10.206 -3.982 11.594 1.00 . A A . 49 TRP HZ3 1 1 10 8175 1 1 49 TRP N N -9.410 -4.930 3.966 1.00 . A A . 49 TRP N 1 1 10 8176 1 1 49 TRP NE1 N -6.896 -4.995 7.745 1.00 . A A . 49 TRP NE1 1 1 10 8177 1 1 49 TRP O O -12.512 -6.181 5.247 1.00 . A A . 49 TRP O 1 1 10 8178 1 1 50 TRP C C -14.099 -5.411 2.292 1.00 . A A . 50 TRP C 1 1 10 8179 1 1 50 TRP CA C -13.617 -4.492 3.410 1.00 . A A . 50 TRP CA 1 1 10 8180 1 1 50 TRP CB C -13.965 -3.037 3.094 1.00 . A A . 50 TRP CB 1 1 10 8181 1 1 50 TRP CD1 C -16.188 -2.722 1.853 1.00 . A A . 50 TRP CD1 1 1 10 8182 1 1 50 TRP CD2 C -16.345 -2.591 4.082 1.00 . A A . 50 TRP CD2 1 1 10 8183 1 1 50 TRP CE2 C -17.625 -2.407 3.530 1.00 . A A . 50 TRP CE2 1 1 10 8184 1 1 50 TRP CE3 C -16.198 -2.548 5.473 1.00 . A A . 50 TRP CE3 1 1 10 8185 1 1 50 TRP CG C -15.439 -2.790 2.993 1.00 . A A . 50 TRP CG 1 1 10 8186 1 1 50 TRP CH2 C -18.577 -2.152 5.675 1.00 . A A . 50 TRP CH2 1 1 10 8187 1 1 50 TRP CZ2 C -18.750 -2.188 4.318 1.00 . A A . 50 TRP CZ2 1 1 10 8188 1 1 50 TRP CZ3 C -17.317 -2.329 6.253 1.00 . A A . 50 TRP CZ3 1 1 10 8189 1 1 50 TRP H H -11.546 -4.168 3.094 1.00 . A A . 50 TRP H 1 1 10 8190 1 1 50 TRP HA H -14.124 -4.770 4.320 1.00 . A A . 50 TRP HA 1 1 10 8191 1 1 50 TRP HB2 H -13.574 -2.404 3.876 1.00 . A A . 50 TRP HB2 1 1 10 8192 1 1 50 TRP HB3 H -13.512 -2.762 2.152 1.00 . A A . 50 TRP HB3 1 1 10 8193 1 1 50 TRP HD1 H -15.792 -2.835 0.854 1.00 . A A . 50 TRP HD1 1 1 10 8194 1 1 50 TRP HE1 H -18.244 -2.409 1.522 1.00 . A A . 50 TRP HE1 1 1 10 8195 1 1 50 TRP HE3 H -15.233 -2.682 5.936 1.00 . A A . 50 TRP HE3 1 1 10 8196 1 1 50 TRP HH2 H -19.424 -1.980 6.324 1.00 . A A . 50 TRP HH2 1 1 10 8197 1 1 50 TRP HZ2 H -19.731 -2.048 3.886 1.00 . A A . 50 TRP HZ2 1 1 10 8198 1 1 50 TRP HZ3 H -17.223 -2.291 7.328 1.00 . A A . 50 TRP HZ3 1 1 10 8199 1 1 50 TRP N N -12.193 -4.628 3.670 1.00 . A A . 50 TRP N 1 1 10 8200 1 1 50 TRP NE1 N -17.505 -2.494 2.170 1.00 . A A . 50 TRP NE1 1 1 10 8201 1 1 50 TRP O O -15.031 -6.193 2.482 1.00 . A A . 50 TRP O 1 1 10 8202 1 1 51 GLU C C -13.646 -7.505 0.029 1.00 . A A . 51 GLU C 1 1 10 8203 1 1 51 GLU CA C -13.938 -6.018 -0.055 1.00 . A A . 51 GLU CA 1 1 10 8204 1 1 51 GLU CB C -13.304 -5.420 -1.315 1.00 . A A . 51 GLU CB 1 1 10 8205 1 1 51 GLU CD C -15.267 -4.007 -2.043 1.00 . A A . 51 GLU CD 1 1 10 8206 1 1 51 GLU CG C -13.807 -4.033 -1.644 1.00 . A A . 51 GLU CG 1 1 10 8207 1 1 51 GLU H H -12.643 -4.778 1.073 1.00 . A A . 51 GLU H 1 1 10 8208 1 1 51 GLU HA H -15.009 -5.881 -0.106 1.00 . A A . 51 GLU HA 1 1 10 8209 1 1 51 GLU HB2 H -12.235 -5.350 -1.175 1.00 . A A . 51 GLU HB2 1 1 10 8210 1 1 51 GLU HB3 H -13.512 -6.067 -2.153 1.00 . A A . 51 GLU HB3 1 1 10 8211 1 1 51 GLU HG2 H -13.667 -3.408 -0.776 1.00 . A A . 51 GLU HG2 1 1 10 8212 1 1 51 GLU HG3 H -13.220 -3.640 -2.463 1.00 . A A . 51 GLU HG3 1 1 10 8213 1 1 51 GLU N N -13.462 -5.319 1.132 1.00 . A A . 51 GLU N 1 1 10 8214 1 1 51 GLU O O -14.538 -8.333 -0.137 1.00 . A A . 51 GLU O 1 1 10 8215 1 1 51 GLU OE1 O -16.135 -4.309 -1.198 1.00 . A A . 51 GLU OE1 1 1 10 8216 1 1 51 GLU OE2 O -15.554 -3.688 -3.214 1.00 . A A . 51 GLU OE2 1 1 10 8217 1 1 52 LEU C C -11.845 -9.677 1.799 1.00 . A A . 52 LEU C 1 1 10 8218 1 1 52 LEU CA C -11.987 -9.229 0.356 1.00 . A A . 52 LEU CA 1 1 10 8219 1 1 52 LEU CB C -10.663 -9.415 -0.377 1.00 . A A . 52 LEU CB 1 1 10 8220 1 1 52 LEU CD1 C -9.276 -9.126 -2.437 1.00 . A A . 52 LEU CD1 1 1 10 8221 1 1 52 LEU CD2 C -11.746 -9.440 -2.640 1.00 . A A . 52 LEU CD2 1 1 10 8222 1 1 52 LEU CG C -10.626 -8.852 -1.795 1.00 . A A . 52 LEU CG 1 1 10 8223 1 1 52 LEU H H -11.737 -7.131 0.463 1.00 . A A . 52 LEU H 1 1 10 8224 1 1 52 LEU HA H -12.747 -9.824 -0.123 1.00 . A A . 52 LEU HA 1 1 10 8225 1 1 52 LEU HB2 H -9.895 -8.921 0.201 1.00 . A A . 52 LEU HB2 1 1 10 8226 1 1 52 LEU HB3 H -10.441 -10.470 -0.422 1.00 . A A . 52 LEU HB3 1 1 10 8227 1 1 52 LEU HD11 H -9.102 -10.191 -2.467 1.00 . A A . 52 LEU HD11 1 1 10 8228 1 1 52 LEU HD12 H -9.267 -8.730 -3.442 1.00 . A A . 52 LEU HD12 1 1 10 8229 1 1 52 LEU HD13 H -8.499 -8.650 -1.856 1.00 . A A . 52 LEU HD13 1 1 10 8230 1 1 52 LEU HD21 H -11.633 -10.512 -2.691 1.00 . A A . 52 LEU HD21 1 1 10 8231 1 1 52 LEU HD22 H -12.700 -9.199 -2.192 1.00 . A A . 52 LEU HD22 1 1 10 8232 1 1 52 LEU HD23 H -11.702 -9.025 -3.635 1.00 . A A . 52 LEU HD23 1 1 10 8233 1 1 52 LEU HG H -10.766 -7.778 -1.748 1.00 . A A . 52 LEU HG 1 1 10 8234 1 1 52 LEU N N -12.398 -7.837 0.298 1.00 . A A . 52 LEU N 1 1 10 8235 1 1 52 LEU O O -12.359 -10.728 2.188 1.00 . A A . 52 LEU O 1 1 10 8236 1 1 53 ARG C C -10.020 -10.391 4.117 1.00 . A A . 53 ARG C 1 1 10 8237 1 1 53 ARG CA C -10.874 -9.130 3.979 1.00 . A A . 53 ARG CA 1 1 10 8238 1 1 53 ARG CB C -12.167 -9.274 4.788 1.00 . A A . 53 ARG CB 1 1 10 8239 1 1 53 ARG CD C -13.250 -9.556 7.037 1.00 . A A . 53 ARG CD 1 1 10 8240 1 1 53 ARG CG C -11.941 -9.372 6.289 1.00 . A A . 53 ARG CG 1 1 10 8241 1 1 53 ARG CZ C -13.886 -10.186 9.341 1.00 . A A . 53 ARG CZ 1 1 10 8242 1 1 53 ARG H H -10.837 -8.007 2.179 1.00 . A A . 53 ARG H 1 1 10 8243 1 1 53 ARG HA H -10.311 -8.292 4.368 1.00 . A A . 53 ARG HA 1 1 10 8244 1 1 53 ARG HB2 H -12.796 -8.418 4.595 1.00 . A A . 53 ARG HB2 1 1 10 8245 1 1 53 ARG HB3 H -12.682 -10.167 4.466 1.00 . A A . 53 ARG HB3 1 1 10 8246 1 1 53 ARG HD2 H -13.910 -8.739 6.786 1.00 . A A . 53 ARG HD2 1 1 10 8247 1 1 53 ARG HD3 H -13.700 -10.488 6.726 1.00 . A A . 53 ARG HD3 1 1 10 8248 1 1 53 ARG HE H -12.270 -9.116 8.843 1.00 . A A . 53 ARG HE 1 1 10 8249 1 1 53 ARG HG2 H -11.298 -10.215 6.495 1.00 . A A . 53 ARG HG2 1 1 10 8250 1 1 53 ARG HG3 H -11.466 -8.464 6.632 1.00 . A A . 53 ARG HG3 1 1 10 8251 1 1 53 ARG HH11 H -15.156 -10.859 7.908 1.00 . A A . 53 ARG HH11 1 1 10 8252 1 1 53 ARG HH12 H -15.572 -11.298 9.541 1.00 . A A . 53 ARG HH12 1 1 10 8253 1 1 53 ARG HH21 H -12.809 -9.678 10.983 1.00 . A A . 53 ARG HH21 1 1 10 8254 1 1 53 ARG HH22 H -14.259 -10.593 11.299 1.00 . A A . 53 ARG HH22 1 1 10 8255 1 1 53 ARG N N -11.162 -8.846 2.573 1.00 . A A . 53 ARG N 1 1 10 8256 1 1 53 ARG NE N -13.059 -9.583 8.487 1.00 . A A . 53 ARG NE 1 1 10 8257 1 1 53 ARG NH1 N -14.956 -10.828 8.898 1.00 . A A . 53 ARG NH1 1 1 10 8258 1 1 53 ARG NH2 N -13.628 -10.155 10.643 1.00 . A A . 53 ARG NH2 1 1 10 8259 1 1 53 ARG O O -8.778 -10.279 4.060 1.00 . A A . 53 ARG O 1 1 10 8260 1 1 53 ARG OXT O -10.590 -11.491 4.278 1.00 . A A . 53 ARG OXT 1 1 stop_ save_
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