NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
611939 | 5tcz | 30181 | cing | 4-filtered-FRED | STAR | entry | full | 322 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5tcz # This FRED archive file contains, for PDB entry <5tcz>: # # - 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_5tcz _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5tcz _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3853.65 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $Beta_omega_theraphotoxin_Tp2a A . 1 1 stop_ save_ save_Beta_omega_theraphotoxin_Tp2a _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Beta omega theraphotoxin Tp2a" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GPYCQKWMQTCDSERKCCEGMVCRLWCKKKLL _Entity.Number_of_monomers 32 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 GLY . 1 1 2 PRO . 1 1 3 TYR . 1 1 4 CYS . 1 1 5 GLN . 1 1 6 LYS . 1 1 7 TRP . 1 1 8 MET . 1 1 9 GLN . 1 1 10 THR . 1 1 11 CYS . 1 1 12 ASP . 1 1 13 SER . 1 1 14 GLU . 1 1 15 ARG . 1 1 16 LYS . 1 1 17 CYS . 1 1 18 CYS . 1 1 19 GLU . 1 1 20 GLY . 1 1 21 MET . 1 1 22 VAL . 1 1 23 CYS . 1 1 24 ARG . 1 1 25 LEU . 1 1 26 TRP . 1 1 27 CYS . 1 1 28 LYS . 1 1 29 LYS . 1 1 30 LYS . 1 1 31 LEU . 1 1 32 LEU . 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 GLY 1 1 1 1 PRO 2 2 1 1 TYR 3 3 1 1 CYS 4 4 1 1 GLN 5 5 1 1 LYS 6 6 1 1 TRP 7 7 1 1 MET 8 8 1 1 GLN 9 9 1 1 THR 10 10 1 1 CYS 11 11 1 1 ASP 12 12 1 1 SER 13 13 1 1 GLU 14 14 1 1 ARG 15 15 1 1 LYS 16 16 1 1 CYS 17 17 1 1 CYS 18 18 1 1 GLU 19 19 1 1 GLY 20 20 1 1 MET 21 21 1 1 VAL 22 22 1 1 CYS 23 23 1 1 ARG 24 24 1 1 LEU 25 25 1 1 TRP 26 26 1 1 CYS 27 27 1 1 LYS 28 28 1 1 LYS 29 29 1 1 LYS 30 30 1 1 LEU 31 31 1 1 LEU 32 32 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 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 3 TYR HA . 3 TYR HA 1 1 1 1 2 1 1 4 CYS H . 4 CYSS H 1 1 2 1 1 1 1 3 TYR HA . 3 TYR HA 1 1 2 1 2 1 1 4 CYS HA . 4 CYSS HA 1 1 3 1 1 1 1 4 CYS H . 4 CYSS H 1 1 3 1 2 1 1 4 CYS QB . 4 CYSS HB3 1 1 4 1 1 1 1 4 CYS HA . 4 CYSS HA 1 1 4 1 2 1 1 5 GLN HA . 5 GLN HA 1 1 5 1 1 1 1 4 CYS HA . 4 CYSS HA 1 1 5 1 2 1 1 5 GLN QB . 5 GLN HB3 1 1 6 1 1 1 1 4 CYS HA . 4 CYSS HA 1 1 6 1 2 1 1 7 TRP HA . 7 TRP HA 1 1 7 1 1 1 1 4 CYS HA . 4 CYSS HA 1 1 7 1 2 1 1 7 TRP QB . 7 TRP HB2 1 1 8 1 1 1 1 4 CYS HA . 4 CYSS HA 1 1 8 1 2 1 1 8 MET H . 8 MET H 1 1 9 1 1 1 1 4 CYS HA . 4 CYSS HA 1 1 9 1 2 1 1 9 GLN HA . 9 GLN HA 1 1 10 1 1 1 1 4 CYS HA . 4 CYSS HA 1 1 10 1 2 1 1 9 GLN QB . 9 GLN HB2 1 1 11 1 1 1 1 4 CYS QB . 4 CYSS HB3 1 1 11 1 2 1 1 5 GLN H . 5 GLN H 1 1 12 1 1 1 1 4 CYS QB . 4 CYSS HB3 1 1 12 1 2 1 1 9 GLN HA . 9 GLN HA 1 1 13 1 1 1 1 4 CYS QB . 4 CYSS HB3 1 1 13 1 2 1 1 9 GLN QG . 9 GLN QG 1 1 14 1 1 1 1 4 CYS QB . 4 CYSS HB3 1 1 14 1 2 1 1 18 CYS H . 18 CYSS H 1 1 15 1 1 1 1 4 CYS QB . 4 CYSS HB2 1 1 15 1 2 1 1 18 CYS HA . 18 CYSS HA 1 1 16 1 1 1 1 4 CYS QB . 4 CYSS HB2 1 1 16 1 2 1 1 18 CYS QB . 18 CYSS QB 1 1 17 1 1 1 1 5 GLN H . 5 GLN H 1 1 17 1 2 1 1 5 GLN QB . 5 GLN HB2 1 1 18 1 1 1 1 5 GLN H . 5 GLN H 1 1 18 1 2 1 1 6 LYS HA . 6 LYS HA 1 1 19 1 1 1 1 5 GLN H . 5 GLN H 1 1 19 1 2 1 1 6 LYS QB . 6 LYS HB3 1 1 20 1 1 1 1 5 GLN H . 5 GLN H 1 1 20 1 2 1 1 17 CYS HA . 17 CYSS HA 1 1 21 1 1 1 1 5 GLN H . 5 GLN H 1 1 21 1 2 1 1 18 CYS HA . 18 CYSS HA 1 1 22 1 1 1 1 5 GLN H . 5 GLN H 1 1 22 1 2 1 1 19 GLU QG . 19 GLU QG 1 1 23 1 1 1 1 5 GLN H . 5 GLN H 1 1 23 1 2 1 1 27 CYS QB . 27 CYSS HB3 1 1 24 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 24 1 2 1 1 6 LYS HA . 6 LYS HA 1 1 25 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 25 1 2 1 1 8 MET HA . 8 MET HA 1 1 26 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 26 1 2 1 1 9 GLN QE . 9 GLN HE21 1 1 27 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 27 1 2 1 1 9 GLN QG . 9 GLN HG2 1 1 28 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 28 1 2 1 1 17 CYS HA . 17 CYSS HA 1 1 29 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 29 1 2 1 1 27 CYS H . 27 CYSS H 1 1 30 1 1 1 1 5 GLN HA . 5 GLN HA 1 1 30 1 2 1 1 27 CYS QB . 27 CYSS HB2 1 1 31 1 1 1 1 5 GLN QB . 5 GLN HB2 1 1 31 1 2 1 1 5 GLN QE . 5 GLN HE22 1 1 32 1 1 1 1 5 GLN QB . 5 GLN HB3 1 1 32 1 2 1 1 6 LYS H . 6 LYS H 1 1 33 1 1 1 1 5 GLN QB . 5 GLN HB3 1 1 33 1 2 1 1 17 CYS HA . 17 CYSS HA 1 1 34 1 1 1 1 5 GLN QB . 5 GLN HB3 1 1 34 1 2 1 1 18 CYS H . 18 CYSS H 1 1 35 1 1 1 1 5 GLN QB . 5 GLN HB2 1 1 35 1 2 1 1 19 GLU QG . 19 GLU QG 1 1 36 1 1 1 1 5 GLN QB . 5 GLN HB2 1 1 36 1 2 1 1 27 CYS QB . 27 CYSS HB3 1 1 37 1 1 1 1 5 GLN QE . 5 GLN HE21 1 1 37 1 2 1 1 6 LYS QB . 6 LYS HB2 1 1 38 1 1 1 1 5 GLN QE . 5 GLN HE21 1 1 38 1 2 1 1 18 CYS QB . 18 CYSS QB 1 1 39 1 1 1 1 5 GLN QE . 5 GLN HE21 1 1 39 1 2 1 1 19 GLU HG2 . 19 GLU HG2 1 1 40 1 1 1 1 5 GLN QE . 5 GLN HE21 1 1 40 1 2 1 1 19 GLU HG3 . 19 GLU HG3 1 1 41 1 1 1 1 6 LYS H . 6 LYS H 1 1 41 1 2 1 1 6 LYS QB . 6 LYS HB3 1 1 42 1 1 1 1 6 LYS H . 6 LYS H 1 1 42 1 2 1 1 6 LYS HG2 . 6 LYS HG2 1 1 43 1 1 1 1 6 LYS H . 6 LYS H 1 1 43 1 2 1 1 6 LYS QG . 6 LYS QG 1 1 44 1 1 1 1 6 LYS H . 6 LYS H 1 1 44 1 2 1 1 6 LYS HG3 . 6 LYS HG3 1 1 45 1 1 1 1 6 LYS H . 6 LYS H 1 1 45 1 2 1 1 8 MET H . 8 MET H 1 1 46 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 46 1 2 1 1 6 LYS QD . 6 LYS QD 1 1 47 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 47 1 2 1 1 6 LYS HG2 . 6 LYS HG2 1 1 48 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 48 1 2 1 1 6 LYS QG . 6 LYS QG 1 1 49 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 49 1 2 1 1 6 LYS HG3 . 6 LYS HG3 1 1 50 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 50 1 2 1 1 7 TRP QB . 7 TRP HB2 1 1 51 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 51 1 2 1 1 8 MET H . 8 MET H 1 1 52 1 1 1 1 6 LYS QB . 6 LYS HB3 1 1 52 1 2 1 1 6 LYS QD . 6 LYS QD 1 1 53 1 1 1 1 6 LYS QB . 6 LYS HB3 1 1 53 1 2 1 1 7 TRP HA . 7 TRP HA 1 1 54 1 1 1 1 6 LYS QB . 6 LYS HB3 1 1 54 1 2 1 1 7 TRP QB . 7 TRP HB2 1 1 55 1 1 1 1 6 LYS QB . 6 LYS HB3 1 1 55 1 2 1 1 8 MET H . 8 MET H 1 1 56 1 1 1 1 6 LYS QG . 6 LYS QG 1 1 56 1 2 1 1 7 TRP HA . 7 TRP HA 1 1 57 1 1 1 1 7 TRP HA . 7 TRP HA 1 1 57 1 2 1 1 8 MET QG . 8 MET QG 1 1 58 1 1 1 1 7 TRP QB . 7 TRP HB2 1 1 58 1 2 1 1 8 MET H . 8 MET H 1 1 59 1 1 1 1 8 MET H . 8 MET H 1 1 59 1 2 1 1 8 MET HG2 . 8 MET HG2 1 1 60 1 1 1 1 8 MET H . 8 MET H 1 1 60 1 2 1 1 8 MET QG . 8 MET QG 1 1 61 1 1 1 1 8 MET H . 8 MET H 1 1 61 1 2 1 1 8 MET HG3 . 8 MET HG3 1 1 62 1 1 1 1 8 MET H . 8 MET H 1 1 62 1 2 1 1 9 GLN H . 9 GLN H 1 1 63 1 1 1 1 8 MET H . 8 MET H 1 1 63 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 64 1 1 1 1 8 MET H . 8 MET H 1 1 64 1 2 1 1 26 TRP QB . 26 TRP HB3 1 1 65 1 1 1 1 8 MET HA . 8 MET HA 1 1 65 1 2 1 1 8 MET HG2 . 8 MET HG2 1 1 66 1 1 1 1 8 MET HA . 8 MET HA 1 1 66 1 2 1 1 8 MET QG . 8 MET QG 1 1 67 1 1 1 1 8 MET HA . 8 MET HA 1 1 67 1 2 1 1 8 MET HG3 . 8 MET HG3 1 1 68 1 1 1 1 8 MET HA . 8 MET HA 1 1 68 1 2 1 1 10 THR H . 10 THR H 1 1 69 1 1 1 1 8 MET HA . 8 MET HA 1 1 69 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 70 1 1 1 1 8 MET HA . 8 MET HA 1 1 70 1 2 1 1 26 TRP QB . 26 TRP HB3 1 1 71 1 1 1 1 8 MET HA . 8 MET HA 1 1 71 1 2 1 1 27 CYS H . 27 CYSS H 1 1 72 1 1 1 1 8 MET HA . 8 MET HA 1 1 72 1 2 1 1 27 CYS QB . 27 CYSS HB2 1 1 73 1 1 1 1 8 MET QB . 8 MET HB3 1 1 73 1 2 1 1 9 GLN HA . 9 GLN HA 1 1 74 1 1 1 1 8 MET QB . 8 MET HB3 1 1 74 1 2 1 1 10 THR H . 10 THR H 1 1 75 1 1 1 1 8 MET QB . 8 MET HB3 1 1 75 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 76 1 1 1 1 8 MET QB . 8 MET HB3 1 1 76 1 2 1 1 26 TRP QB . 26 TRP HB3 1 1 77 1 1 1 1 8 MET QB . 8 MET HB3 1 1 77 1 2 1 1 26 TRP HE1 . 26 TRP HE1 1 1 78 1 1 1 1 9 GLN H . 9 GLN H 1 1 78 1 2 1 1 9 GLN HA . 9 GLN HA 1 1 79 1 1 1 1 9 GLN H . 9 GLN H 1 1 79 1 2 1 1 9 GLN QB . 9 GLN HB2 1 1 80 1 1 1 1 9 GLN H . 9 GLN H 1 1 80 1 2 1 1 9 GLN QG . 9 GLN HG2 1 1 81 1 1 1 1 9 GLN H . 9 GLN H 1 1 81 1 2 1 1 27 CYS QB . 27 CYSS HB2 1 1 82 1 1 1 1 9 GLN HA . 9 GLN HA 1 1 82 1 2 1 1 9 GLN QG . 9 GLN QG 1 1 83 1 1 1 1 9 GLN HA . 9 GLN HA 1 1 83 1 2 1 1 10 THR HB . 10 THR HB 1 1 84 1 1 1 1 9 GLN HA . 9 GLN HA 1 1 84 1 2 1 1 15 ARG QD . 15 ARG HD2 1 1 85 1 1 1 1 9 GLN QB . 9 GLN HB2 1 1 85 1 2 1 1 9 GLN QE . 9 GLN HE21 1 1 86 1 1 1 1 9 GLN QB . 9 GLN HB2 1 1 86 1 2 1 1 10 THR H . 10 THR H 1 1 87 1 1 1 1 9 GLN QB . 9 GLN HB2 1 1 87 1 2 1 1 11 CYS HA . 11 CYSS HA 1 1 88 1 1 1 1 9 GLN QB . 9 GLN HB2 1 1 88 1 2 1 1 15 ARG QD . 15 ARG HD2 1 1 89 1 1 1 1 9 GLN QB . 9 GLN HB2 1 1 89 1 2 1 1 17 CYS HA . 17 CYSS HA 1 1 90 1 1 1 1 9 GLN QB . 9 GLN HB2 1 1 90 1 2 1 1 18 CYS H . 18 CYSS H 1 1 91 1 1 1 1 9 GLN QB . 9 GLN HB2 1 1 91 1 2 1 1 27 CYS H . 27 CYSS H 1 1 92 1 1 1 1 9 GLN QE . 9 GLN HE21 1 1 92 1 2 1 1 15 ARG QB . 15 ARG HB3 1 1 93 1 1 1 1 9 GLN QE . 9 GLN HE21 1 1 93 1 2 1 1 15 ARG QD . 15 ARG HD2 1 1 94 1 1 1 1 9 GLN QG . 9 GLN HG3 1 1 94 1 2 1 1 10 THR H . 10 THR H 1 1 95 1 1 1 1 9 GLN QG . 9 GLN QG 1 1 95 1 2 1 1 15 ARG QD . 15 ARG HD2 1 1 96 1 1 1 1 9 GLN QG . 9 GLN HG3 1 1 96 1 2 1 1 27 CYS H . 27 CYSS H 1 1 97 1 1 1 1 9 GLN QG . 9 GLN QG 1 1 97 1 2 1 1 27 CYS QB . 27 CYSS HB2 1 1 98 1 1 1 1 10 THR H . 10 THR H 1 1 98 1 2 1 1 10 THR HB . 10 THR HB 1 1 99 1 1 1 1 10 THR H . 10 THR H 1 1 99 1 2 1 1 15 ARG QG . 15 ARG QG 1 1 100 1 1 1 1 10 THR H . 10 THR H 1 1 100 1 2 1 1 15 ARG HH11 . 15 ARG HH11 1 1 101 1 1 1 1 10 THR H . 10 THR H 1 1 101 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 102 1 1 1 1 10 THR H . 10 THR H 1 1 102 1 2 1 1 26 TRP QB . 26 TRP HB3 1 1 103 1 1 1 1 10 THR H . 10 THR H 1 1 103 1 2 1 1 27 CYS QB . 27 CYSS HB2 1 1 104 1 1 1 1 10 THR HA . 10 THR HA 1 1 104 1 2 1 1 11 CYS H . 11 CYSS H 1 1 105 1 1 1 1 10 THR HA . 10 THR HA 1 1 105 1 2 1 1 11 CYS HA . 11 CYSS HA 1 1 106 1 1 1 1 10 THR HA . 10 THR HA 1 1 106 1 2 1 1 15 ARG HH11 . 15 ARG HH11 1 1 107 1 1 1 1 10 THR HA . 10 THR HA 1 1 107 1 2 1 1 25 LEU HA . 25 LEU HA 1 1 108 1 1 1 1 10 THR HA . 10 THR HA 1 1 108 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 109 1 1 1 1 10 THR HA . 10 THR HA 1 1 109 1 2 1 1 26 TRP QB . 26 TRP HB3 1 1 110 1 1 1 1 10 THR HA . 10 THR HA 1 1 110 1 2 1 1 26 TRP HE1 . 26 TRP HE1 1 1 111 1 1 1 1 10 THR HA . 10 THR HA 1 1 111 1 2 1 1 27 CYS H . 27 CYSS H 1 1 112 1 1 1 1 11 CYS H . 11 CYSS H 1 1 112 1 2 1 1 15 ARG QG . 15 ARG QG 1 1 113 1 1 1 1 11 CYS H . 11 CYSS H 1 1 113 1 2 1 1 25 LEU HA . 25 LEU HA 1 1 114 1 1 1 1 11 CYS H . 11 CYSS H 1 1 114 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 115 1 1 1 1 11 CYS H . 11 CYSS H 1 1 115 1 2 1 1 26 TRP QB . 26 TRP HB3 1 1 116 1 1 1 1 11 CYS HA . 11 CYSS HA 1 1 116 1 2 1 1 12 ASP H . 12 ASP H 1 1 117 1 1 1 1 11 CYS HA . 11 CYSS HA 1 1 117 1 2 1 1 12 ASP HA . 12 ASP HA 1 1 118 1 1 1 1 11 CYS HA . 11 CYSS HA 1 1 118 1 2 1 1 15 ARG H . 15 ARG H 1 1 119 1 1 1 1 11 CYS HA . 11 CYSS HA 1 1 119 1 2 1 1 15 ARG QB . 15 ARG HB3 1 1 120 1 1 1 1 11 CYS HA . 11 CYSS HA 1 1 120 1 2 1 1 15 ARG QD . 15 ARG HD3 1 1 121 1 1 1 1 11 CYS HA . 11 CYSS HA 1 1 121 1 2 1 1 15 ARG QG . 15 ARG QG 1 1 122 1 1 1 1 11 CYS HA . 11 CYSS HA 1 1 122 1 2 1 1 23 CYS HA . 23 CYSS HA 1 1 123 1 1 1 1 11 CYS HA . 11 CYSS HA 1 1 123 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 124 1 1 1 1 11 CYS QB . 11 CYSS HB3 1 1 124 1 2 1 1 12 ASP H . 12 ASP H 1 1 125 1 1 1 1 11 CYS QB . 11 CYSS HB3 1 1 125 1 2 1 1 12 ASP HA . 12 ASP HA 1 1 126 1 1 1 1 11 CYS QB . 11 CYSS HB3 1 1 126 1 2 1 1 15 ARG QB . 15 ARG HB3 1 1 127 1 1 1 1 11 CYS QB . 11 CYSS HB3 1 1 127 1 2 1 1 17 CYS QB . 17 CYSS QB 1 1 128 1 1 1 1 11 CYS QB . 11 CYSS HB3 1 1 128 1 2 1 1 23 CYS H . 23 CYSS H 1 1 129 1 1 1 1 11 CYS QB . 11 CYSS HB2 1 1 129 1 2 1 1 26 TRP H . 26 TRP H 1 1 130 1 1 1 1 11 CYS QB . 11 CYSS HB2 1 1 130 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 131 1 1 1 1 12 ASP H . 12 ASP H 1 1 131 1 2 1 1 12 ASP QB . 12 ASP HB3 1 1 132 1 1 1 1 12 ASP H . 12 ASP H 1 1 132 1 2 1 1 15 ARG H . 15 ARG H 1 1 133 1 1 1 1 12 ASP H . 12 ASP H 1 1 133 1 2 1 1 15 ARG QB . 15 ARG HB3 1 1 134 1 1 1 1 12 ASP H . 12 ASP H 1 1 134 1 2 1 1 15 ARG QD . 15 ARG HD2 1 1 135 1 1 1 1 12 ASP H . 12 ASP H 1 1 135 1 2 1 1 15 ARG QG . 15 ARG QG 1 1 136 1 1 1 1 12 ASP HA . 12 ASP HA 1 1 136 1 2 1 1 12 ASP QB . 12 ASP HB3 1 1 137 1 1 1 1 12 ASP HA . 12 ASP HA 1 1 137 1 2 1 1 13 SER H . 13 SER H 1 1 138 1 1 1 1 12 ASP HA . 12 ASP HA 1 1 138 1 2 1 1 13 SER HA . 13 SER HA 1 1 139 1 1 1 1 12 ASP QB . 12 ASP HB3 1 1 139 1 2 1 1 13 SER H . 13 SER H 1 1 140 1 1 1 1 12 ASP QB . 12 ASP HB3 1 1 140 1 2 1 1 13 SER HA . 13 SER HA 1 1 141 1 1 1 1 12 ASP QB . 12 ASP HB3 1 1 141 1 2 1 1 13 SER HB2 . 13 SER HB2 1 1 142 1 1 1 1 12 ASP QB . 12 ASP HB3 1 1 142 1 2 1 1 13 SER QB . 13 SER QB 1 1 143 1 1 1 1 12 ASP QB . 12 ASP HB3 1 1 143 1 2 1 1 13 SER HB3 . 13 SER HB3 1 1 144 1 1 1 1 12 ASP QB . 12 ASP HB3 1 1 144 1 2 1 1 14 GLU H . 14 GLU H 1 1 145 1 1 1 1 13 SER H . 13 SER H 1 1 145 1 2 1 1 13 SER HB2 . 13 SER HB2 1 1 146 1 1 1 1 13 SER H . 13 SER H 1 1 146 1 2 1 1 13 SER HB3 . 13 SER HB3 1 1 147 1 1 1 1 13 SER HA . 13 SER HA 1 1 147 1 2 1 1 13 SER QB . 13 SER QB 1 1 148 1 1 1 1 13 SER QB . 13 SER QB 1 1 148 1 2 1 1 14 GLU H . 14 GLU H 1 1 149 1 1 1 1 13 SER HB2 . 13 SER HB2 1 1 149 1 2 1 1 14 GLU H . 14 GLU H 1 1 150 1 1 1 1 13 SER HB3 . 13 SER HB3 1 1 150 1 2 1 1 14 GLU H . 14 GLU H 1 1 151 1 1 1 1 14 GLU H . 14 GLU H 1 1 151 1 2 1 1 14 GLU QB . 14 GLU QB 1 1 152 1 1 1 1 14 GLU H . 14 GLU H 1 1 152 1 2 1 1 14 GLU HG2 . 14 GLU HG2 1 1 153 1 1 1 1 14 GLU H . 14 GLU H 1 1 153 1 2 1 1 14 GLU HG3 . 14 GLU HG3 1 1 154 1 1 1 1 14 GLU H . 14 GLU H 1 1 154 1 2 1 1 15 ARG H . 15 ARG H 1 1 155 1 1 1 1 14 GLU H . 14 GLU H 1 1 155 1 2 1 1 15 ARG HA . 15 ARG HA 1 1 156 1 1 1 1 14 GLU H . 14 GLU H 1 1 156 1 2 1 1 15 ARG QB . 15 ARG HB3 1 1 157 1 1 1 1 14 GLU H . 14 GLU H 1 1 157 1 2 1 1 15 ARG QG . 15 ARG QG 1 1 158 1 1 1 1 14 GLU HA . 14 GLU HA 1 1 158 1 2 1 1 14 GLU HG2 . 14 GLU HG2 1 1 159 1 1 1 1 14 GLU HA . 14 GLU HA 1 1 159 1 2 1 1 14 GLU QG . 14 GLU QG 1 1 160 1 1 1 1 14 GLU HA . 14 GLU HA 1 1 160 1 2 1 1 14 GLU HG3 . 14 GLU HG3 1 1 161 1 1 1 1 14 GLU QB . 14 GLU QB 1 1 161 1 2 1 1 14 GLU QG . 14 GLU QG 1 1 162 1 1 1 1 14 GLU QB . 14 GLU QB 1 1 162 1 2 1 1 15 ARG H . 15 ARG H 1 1 163 1 1 1 1 14 GLU HB2 . 14 GLU HB2 1 1 163 1 2 1 1 15 ARG H . 15 ARG H 1 1 164 1 1 1 1 14 GLU HB3 . 14 GLU HB3 1 1 164 1 2 1 1 15 ARG H . 15 ARG H 1 1 165 1 1 1 1 15 ARG H . 15 ARG H 1 1 165 1 2 1 1 15 ARG QB . 15 ARG HB3 1 1 166 1 1 1 1 15 ARG HA . 15 ARG HA 1 1 166 1 2 1 1 15 ARG HG2 . 15 ARG HG2 1 1 167 1 1 1 1 15 ARG HA . 15 ARG HA 1 1 167 1 2 1 1 15 ARG QG . 15 ARG QG 1 1 168 1 1 1 1 15 ARG HA . 15 ARG HA 1 1 168 1 2 1 1 15 ARG HG3 . 15 ARG HG3 1 1 169 1 1 1 1 15 ARG HA . 15 ARG HA 1 1 169 1 2 1 1 15 ARG HH11 . 15 ARG HH11 1 1 170 1 1 1 1 15 ARG HA . 15 ARG HA 1 1 170 1 2 1 1 16 LYS H . 16 LYS H 1 1 171 1 1 1 1 15 ARG HA . 15 ARG HA 1 1 171 1 2 1 1 16 LYS HA . 16 LYS HA 1 1 172 1 1 1 1 15 ARG QB . 15 ARG HB3 1 1 172 1 2 1 1 15 ARG HH11 . 15 ARG HH11 1 1 173 1 1 1 1 15 ARG QB . 15 ARG HB3 1 1 173 1 2 1 1 16 LYS H . 16 LYS H 1 1 174 1 1 1 1 15 ARG QB . 15 ARG HB3 1 1 174 1 2 1 1 17 CYS H . 17 CYSS H 1 1 175 1 1 1 1 15 ARG QD . 15 ARG HD2 1 1 175 1 2 1 1 16 LYS H . 16 LYS H 1 1 176 1 1 1 1 15 ARG QD . 15 ARG HD2 1 1 176 1 2 1 1 17 CYS H . 17 CYSS H 1 1 177 1 1 1 1 15 ARG QD . 15 ARG HD3 1 1 177 1 2 1 1 17 CYS HA . 17 CYSS HA 1 1 178 1 1 1 1 15 ARG QD . 15 ARG HD3 1 1 178 1 2 1 1 18 CYS H . 18 CYSS H 1 1 179 1 1 1 1 15 ARG QG . 15 ARG QG 1 1 179 1 2 1 1 15 ARG HH11 . 15 ARG HH11 1 1 180 1 1 1 1 15 ARG QG . 15 ARG QG 1 1 180 1 2 1 1 16 LYS H . 16 LYS H 1 1 181 1 1 1 1 15 ARG QG . 15 ARG QG 1 1 181 1 2 1 1 17 CYS H . 17 CYSS H 1 1 182 1 1 1 1 15 ARG HG2 . 15 ARG HG2 1 1 182 1 2 1 1 15 ARG HH11 . 15 ARG HH11 1 1 183 1 1 1 1 15 ARG HG3 . 15 ARG HG3 1 1 183 1 2 1 1 15 ARG HH11 . 15 ARG HH11 1 1 184 1 1 1 1 16 LYS H . 16 LYS H 1 1 184 1 2 1 1 16 LYS QB . 16 LYS QB 1 1 185 1 1 1 1 16 LYS H . 16 LYS H 1 1 185 1 2 1 1 16 LYS QG . 16 LYS QG 1 1 186 1 1 1 1 16 LYS HA . 16 LYS HA 1 1 186 1 2 1 1 16 LYS QG . 16 LYS QG 1 1 187 1 1 1 1 16 LYS HA . 16 LYS HA 1 1 187 1 2 1 1 17 CYS H . 17 CYSS H 1 1 188 1 1 1 1 16 LYS HA . 16 LYS HA 1 1 188 1 2 1 1 17 CYS HA . 17 CYSS HA 1 1 189 1 1 1 1 16 LYS HA . 16 LYS HA 1 1 189 1 2 1 1 17 CYS QB . 17 CYSS QB 1 1 190 1 1 1 1 16 LYS QB . 16 LYS QB 1 1 190 1 2 1 1 17 CYS HA . 17 CYSS HA 1 1 191 1 1 1 1 16 LYS QG . 16 LYS QG 1 1 191 1 2 1 1 17 CYS H . 17 CYSS H 1 1 192 1 1 1 1 17 CYS H . 17 CYSS H 1 1 192 1 2 1 1 17 CYS QB . 17 CYSS QB 1 1 193 1 1 1 1 17 CYS HA . 17 CYSS HA 1 1 193 1 2 1 1 18 CYS H . 18 CYSS H 1 1 194 1 1 1 1 17 CYS HA . 17 CYSS HA 1 1 194 1 2 1 1 18 CYS HA . 18 CYSS HA 1 1 195 1 1 1 1 17 CYS HA . 17 CYSS HA 1 1 195 1 2 1 1 19 GLU H . 19 GLU H 1 1 196 1 1 1 1 18 CYS H . 18 CYSS H 1 1 196 1 2 1 1 18 CYS QB . 18 CYSS QB 1 1 197 1 1 1 1 18 CYS H . 18 CYSS H 1 1 197 1 2 1 1 27 CYS QB . 27 CYSS HB3 1 1 198 1 1 1 1 19 GLU H . 19 GLU H 1 1 198 1 2 1 1 27 CYS QB . 27 CYSS HB3 1 1 199 1 1 1 1 21 MET H . 21 MET H 1 1 199 1 2 1 1 21 MET QB . 21 MET HB3 1 1 200 1 1 1 1 21 MET H . 21 MET H 1 1 200 1 2 1 1 21 MET QG . 21 MET QG 1 1 201 1 1 1 1 21 MET H . 21 MET H 1 1 201 1 2 1 1 29 LYS QG . 29 LYS HG2 1 1 202 1 1 1 1 21 MET H . 21 MET H 1 1 202 1 2 1 1 31 LEU QB . 31 LEU HB2 1 1 203 1 1 1 1 21 MET HA . 21 MET HA 1 1 203 1 2 1 1 21 MET QG . 21 MET QG 1 1 204 1 1 1 1 21 MET HA . 21 MET HA 1 1 204 1 2 1 1 22 VAL H . 22 VAL H 1 1 205 1 1 1 1 21 MET HA . 21 MET HA 1 1 205 1 2 1 1 22 VAL HA . 22 VAL HA 1 1 206 1 1 1 1 21 MET HA . 21 MET HA 1 1 206 1 2 1 1 28 LYS H . 28 LYS H 1 1 207 1 1 1 1 21 MET HA . 21 MET HA 1 1 207 1 2 1 1 29 LYS HA . 29 LYS HA 1 1 208 1 1 1 1 21 MET HA . 21 MET HA 1 1 208 1 2 1 1 29 LYS QG . 29 LYS QG 1 1 209 1 1 1 1 21 MET HA . 21 MET HA 1 1 209 1 2 1 1 30 LYS H . 30 LYS H 1 1 210 1 1 1 1 21 MET HA . 21 MET HA 1 1 210 1 2 1 1 31 LEU H . 31 LEU H 1 1 211 1 1 1 1 21 MET HA . 21 MET HA 1 1 211 1 2 1 1 31 LEU QB . 31 LEU HB2 1 1 212 1 1 1 1 21 MET QB . 21 MET HB3 1 1 212 1 2 1 1 22 VAL H . 22 VAL H 1 1 213 1 1 1 1 21 MET QB . 21 MET HB2 1 1 213 1 2 1 1 28 LYS H . 28 LYS H 1 1 214 1 1 1 1 21 MET QB . 21 MET HB2 1 1 214 1 2 1 1 29 LYS H . 29 LYS H 1 1 215 1 1 1 1 21 MET QB . 21 MET HB2 1 1 215 1 2 1 1 29 LYS HA . 29 LYS HA 1 1 216 1 1 1 1 21 MET QB . 21 MET HB3 1 1 216 1 2 1 1 29 LYS QG . 29 LYS HG2 1 1 217 1 1 1 1 21 MET QB . 21 MET HB2 1 1 217 1 2 1 1 30 LYS H . 30 LYS H 1 1 218 1 1 1 1 21 MET QG . 21 MET QG 1 1 218 1 2 1 1 27 CYS HA . 27 CYSS HA 1 1 219 1 1 1 1 21 MET QG . 21 MET QG 1 1 219 1 2 1 1 27 CYS QB . 27 CYSS HB2 1 1 220 1 1 1 1 21 MET QG . 21 MET QG 1 1 220 1 2 1 1 28 LYS H . 28 LYS H 1 1 221 1 1 1 1 21 MET QG . 21 MET QG 1 1 221 1 2 1 1 29 LYS H . 29 LYS H 1 1 222 1 1 1 1 21 MET QG . 21 MET QG 1 1 222 1 2 1 1 29 LYS HA . 29 LYS HA 1 1 223 1 1 1 1 22 VAL H . 22 VAL H 1 1 223 1 2 1 1 22 VAL HB . 22 VAL HB 1 1 224 1 1 1 1 22 VAL H . 22 VAL H 1 1 224 1 2 1 1 29 LYS HA . 29 LYS HA 1 1 225 1 1 1 1 22 VAL H . 22 VAL H 1 1 225 1 2 1 1 30 LYS HA . 30 LYS HA 1 1 226 1 1 1 1 22 VAL H . 22 VAL H 1 1 226 1 2 1 1 30 LYS QB . 30 LYS QB 1 1 227 1 1 1 1 22 VAL HA . 22 VAL HA 1 1 227 1 2 1 1 22 VAL HB . 22 VAL HB 1 1 228 1 1 1 1 22 VAL HA . 22 VAL HA 1 1 228 1 2 1 1 23 CYS H . 23 CYSS H 1 1 229 1 1 1 1 22 VAL HA . 22 VAL HA 1 1 229 1 2 1 1 23 CYS QB . 23 CYSS QB 1 1 230 1 1 1 1 22 VAL HA . 22 VAL HA 1 1 230 1 2 1 1 24 ARG QD . 24 ARG QD 1 1 231 1 1 1 1 22 VAL HB . 22 VAL HB 1 1 231 1 2 1 1 23 CYS H . 23 CYSS H 1 1 232 1 1 1 1 22 VAL HB . 22 VAL HB 1 1 232 1 2 1 1 24 ARG QD . 24 ARG QD 1 1 233 1 1 1 1 23 CYS H . 23 CYSS H 1 1 233 1 2 1 1 24 ARG QB . 24 ARG HB2 1 1 234 1 1 1 1 23 CYS H . 23 CYSS H 1 1 234 1 2 1 1 24 ARG QD . 24 ARG QD 1 1 235 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 235 1 2 1 1 24 ARG H . 24 ARG H 1 1 236 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 236 1 2 1 1 24 ARG QD . 24 ARG QD 1 1 237 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 237 1 2 1 1 24 ARG QH1 . 24 ARG HH11 1 1 238 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 238 1 2 1 1 25 LEU H . 25 LEU H 1 1 239 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 239 1 2 1 1 26 TRP H . 26 TRP H 1 1 240 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 240 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 241 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 241 1 2 1 1 27 CYS HA . 27 CYSS HA 1 1 242 1 1 1 1 23 CYS HA . 23 CYSS HA 1 1 242 1 2 1 1 28 LYS H . 28 LYS H 1 1 243 1 1 1 1 23 CYS QB . 23 CYSS QB 1 1 243 1 2 1 1 24 ARG H . 24 ARG H 1 1 244 1 1 1 1 23 CYS QB . 23 CYSS QB 1 1 244 1 2 1 1 24 ARG QB . 24 ARG HB2 1 1 245 1 1 1 1 23 CYS QB . 23 CYSS QB 1 1 245 1 2 1 1 24 ARG QD . 24 ARG QD 1 1 246 1 1 1 1 23 CYS QB . 23 CYSS QB 1 1 246 1 2 1 1 24 ARG HG3 . 24 ARG HG3 1 1 247 1 1 1 1 23 CYS QB . 23 CYSS QB 1 1 247 1 2 1 1 24 ARG QH1 . 24 ARG HH11 1 1 248 1 1 1 1 24 ARG H . 24 ARG H 1 1 248 1 2 1 1 24 ARG QB . 24 ARG HB3 1 1 249 1 1 1 1 24 ARG H . 24 ARG H 1 1 249 1 2 1 1 24 ARG QD . 24 ARG QD 1 1 250 1 1 1 1 24 ARG H . 24 ARG H 1 1 250 1 2 1 1 24 ARG HG2 . 24 ARG HG2 1 1 251 1 1 1 1 24 ARG H . 24 ARG H 1 1 251 1 2 1 1 24 ARG HG3 . 24 ARG HG3 1 1 252 1 1 1 1 24 ARG H . 24 ARG H 1 1 252 1 2 1 1 25 LEU HA . 25 LEU HA 1 1 253 1 1 1 1 24 ARG H . 24 ARG H 1 1 253 1 2 1 1 26 TRP HA . 26 TRP HA 1 1 254 1 1 1 1 24 ARG H . 24 ARG H 1 1 254 1 2 1 1 27 CYS HA . 27 CYSS HA 1 1 255 1 1 1 1 24 ARG HA . 24 ARG HA 1 1 255 1 2 1 1 24 ARG QD . 24 ARG QD 1 1 256 1 1 1 1 24 ARG HA . 24 ARG HA 1 1 256 1 2 1 1 24 ARG HG2 . 24 ARG HG2 1 1 257 1 1 1 1 24 ARG HA . 24 ARG HA 1 1 257 1 2 1 1 24 ARG HG3 . 24 ARG HG3 1 1 258 1 1 1 1 24 ARG HA . 24 ARG HA 1 1 258 1 2 1 1 25 LEU H . 25 LEU H 1 1 259 1 1 1 1 24 ARG HA . 24 ARG HA 1 1 259 1 2 1 1 25 LEU HA . 25 LEU HA 1 1 260 1 1 1 1 24 ARG HA . 24 ARG HA 1 1 260 1 2 1 1 26 TRP H . 26 TRP H 1 1 261 1 1 1 1 24 ARG QB . 24 ARG HB2 1 1 261 1 2 1 1 24 ARG HD2 . 24 ARG HD2 1 1 262 1 1 1 1 24 ARG QB . 24 ARG HB2 1 1 262 1 2 1 1 24 ARG QD . 24 ARG QD 1 1 263 1 1 1 1 24 ARG QB . 24 ARG HB2 1 1 263 1 2 1 1 24 ARG HD3 . 24 ARG HD3 1 1 264 1 1 1 1 24 ARG QB . 24 ARG HB3 1 1 264 1 2 1 1 25 LEU H . 25 LEU H 1 1 265 1 1 1 1 24 ARG QB . 24 ARG HB2 1 1 265 1 2 1 1 26 TRP H . 26 TRP H 1 1 266 1 1 1 1 24 ARG QD . 24 ARG QD 1 1 266 1 2 1 1 25 LEU H . 25 LEU H 1 1 267 1 1 1 1 24 ARG HG3 . 24 ARG HG3 1 1 267 1 2 1 1 25 LEU H . 25 LEU H 1 1 268 1 1 1 1 25 LEU H . 25 LEU H 1 1 268 1 2 1 1 25 LEU HA . 25 LEU HA 1 1 269 1 1 1 1 25 LEU H . 25 LEU H 1 1 269 1 2 1 1 25 LEU HG . 25 LEU HG 1 1 270 1 1 1 1 25 LEU HA . 25 LEU HA 1 1 270 1 2 1 1 25 LEU HG . 25 LEU HG 1 1 271 1 1 1 1 25 LEU QB . 25 LEU QB 1 1 271 1 2 1 1 25 LEU HG . 25 LEU HG 1 1 272 1 1 1 1 25 LEU QB . 25 LEU QB 1 1 272 1 2 1 1 26 TRP H . 26 TRP H 1 1 273 1 1 1 1 25 LEU QB . 25 LEU QB 1 1 273 1 2 1 1 26 TRP QB . 26 TRP HB2 1 1 274 1 1 1 1 25 LEU HB2 . 25 LEU HB2 1 1 274 1 2 1 1 26 TRP H . 26 TRP H 1 1 275 1 1 1 1 25 LEU HB3 . 25 LEU HB3 1 1 275 1 2 1 1 26 TRP H . 26 TRP H 1 1 276 1 1 1 1 26 TRP H . 26 TRP H 1 1 276 1 2 1 1 26 TRP QB . 26 TRP HB2 1 1 277 1 1 1 1 26 TRP HA . 26 TRP HA 1 1 277 1 2 1 1 27 CYS H . 27 CYSS H 1 1 278 1 1 1 1 26 TRP HA . 26 TRP HA 1 1 278 1 2 1 1 27 CYS QB . 27 CYSS HB2 1 1 279 1 1 1 1 26 TRP QB . 26 TRP HB3 1 1 279 1 2 1 1 27 CYS H . 27 CYSS H 1 1 280 1 1 1 1 27 CYS H . 27 CYSS H 1 1 280 1 2 1 1 27 CYS QB . 27 CYSS HB2 1 1 281 1 1 1 1 27 CYS HA . 27 CYSS HA 1 1 281 1 2 1 1 28 LYS H . 28 LYS H 1 1 282 1 1 1 1 27 CYS QB . 27 CYSS HB2 1 1 282 1 2 1 1 28 LYS H . 28 LYS H 1 1 283 1 1 1 1 28 LYS H . 28 LYS H 1 1 283 1 2 1 1 28 LYS HB2 . 28 LYS HB2 1 1 284 1 1 1 1 28 LYS H . 28 LYS H 1 1 284 1 2 1 1 28 LYS HB3 . 28 LYS HB3 1 1 285 1 1 1 1 28 LYS H . 28 LYS H 1 1 285 1 2 1 1 28 LYS QD . 28 LYS HD3 1 1 286 1 1 1 1 28 LYS H . 28 LYS H 1 1 286 1 2 1 1 28 LYS QG . 28 LYS QG 1 1 287 1 1 1 1 28 LYS H . 28 LYS H 1 1 287 1 2 1 1 29 LYS HA . 29 LYS HA 1 1 288 1 1 1 1 28 LYS HA . 28 LYS HA 1 1 288 1 2 1 1 28 LYS QD . 28 LYS HD2 1 1 289 1 1 1 1 28 LYS HA . 28 LYS HA 1 1 289 1 2 1 1 29 LYS H . 29 LYS H 1 1 290 1 1 1 1 28 LYS HA . 28 LYS HA 1 1 290 1 2 1 1 29 LYS HA . 29 LYS HA 1 1 291 1 1 1 1 28 LYS HA . 28 LYS HA 1 1 291 1 2 1 1 29 LYS QG . 29 LYS QG 1 1 292 1 1 1 1 28 LYS QB . 28 LYS QB 1 1 292 1 2 1 1 28 LYS QD . 28 LYS QD 1 1 293 1 1 1 1 28 LYS QB . 28 LYS QB 1 1 293 1 2 1 1 29 LYS H . 29 LYS H 1 1 294 1 1 1 1 28 LYS QD . 28 LYS QD 1 1 294 1 2 1 1 29 LYS H . 29 LYS H 1 1 295 1 1 1 1 28 LYS QG . 28 LYS QG 1 1 295 1 2 1 1 29 LYS H . 29 LYS H 1 1 296 1 1 1 1 29 LYS H . 29 LYS H 1 1 296 1 2 1 1 29 LYS QB . 29 LYS HB3 1 1 297 1 1 1 1 29 LYS H . 29 LYS H 1 1 297 1 2 1 1 29 LYS QD . 29 LYS QD 1 1 298 1 1 1 1 29 LYS H . 29 LYS H 1 1 298 1 2 1 1 30 LYS QB . 30 LYS QB 1 1 299 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 299 1 2 1 1 29 LYS QD . 29 LYS QD 1 1 300 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 300 1 2 1 1 29 LYS QG . 29 LYS QG 1 1 301 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 301 1 2 1 1 30 LYS H . 30 LYS H 1 1 302 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 302 1 2 1 1 30 LYS HA . 30 LYS HA 1 1 303 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 303 1 2 1 1 30 LYS QB . 30 LYS QB 1 1 304 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 304 1 2 1 1 31 LEU H . 31 LEU H 1 1 305 1 1 1 1 29 LYS QB . 29 LYS HB3 1 1 305 1 2 1 1 30 LYS H . 30 LYS H 1 1 306 1 1 1 1 29 LYS QB . 29 LYS HB3 1 1 306 1 2 1 1 31 LEU H . 31 LEU H 1 1 307 1 1 1 1 29 LYS QG . 29 LYS QG 1 1 307 1 2 1 1 30 LYS H . 30 LYS H 1 1 308 1 1 1 1 30 LYS H . 30 LYS H 1 1 308 1 2 1 1 30 LYS HB2 . 30 LYS HB2 1 1 309 1 1 1 1 30 LYS H . 30 LYS H 1 1 309 1 2 1 1 30 LYS HB3 . 30 LYS HB3 1 1 310 1 1 1 1 30 LYS H . 30 LYS H 1 1 310 1 2 1 1 31 LEU QB . 31 LEU HB3 1 1 311 1 1 1 1 30 LYS HA . 30 LYS HA 1 1 311 1 2 1 1 30 LYS QG . 30 LYS QG 1 1 312 1 1 1 1 30 LYS HA . 30 LYS HA 1 1 312 1 2 1 1 31 LEU H . 31 LEU H 1 1 313 1 1 1 1 30 LYS HA . 30 LYS HA 1 1 313 1 2 1 1 31 LEU HA . 31 LEU HA 1 1 314 1 1 1 1 30 LYS QB . 30 LYS QB 1 1 314 1 2 1 1 31 LEU H . 31 LEU H 1 1 315 1 1 1 1 31 LEU H . 31 LEU H 1 1 315 1 2 1 1 31 LEU QB . 31 LEU HB3 1 1 316 1 1 1 1 31 LEU H . 31 LEU H 1 1 316 1 2 1 1 31 LEU HG . 31 LEU HG 1 1 317 1 1 1 1 31 LEU HA . 31 LEU HA 1 1 317 1 2 1 1 31 LEU HG . 31 LEU HG 1 1 318 1 1 1 1 31 LEU HA . 31 LEU HA 1 1 318 1 2 1 1 32 LEU H . 32 LEU H 1 1 319 1 1 1 1 31 LEU HA . 31 LEU HA 1 1 319 1 2 1 1 32 LEU HA . 32 LEU HA 1 1 320 1 1 1 1 31 LEU QB . 31 LEU HB2 1 1 320 1 2 1 1 32 LEU H . 32 LEU H 1 1 321 1 1 1 1 31 LEU QB . 31 LEU HB3 1 1 321 1 2 1 1 32 LEU HA . 32 LEU HA 1 1 322 1 1 1 1 32 LEU H . 32 LEU H 1 1 322 1 2 1 1 32 LEU HG . 32 LEU HG 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.95 1 1 2 1 . . . . . . . 4.68 1 1 3 1 . . . . . . . 3.85 1 1 4 1 . . . . . . . 5.5 1 1 5 1 . . . . . . . 5.5 1 1 6 1 . . . . . . . 5.5 1 1 7 1 . . . . . . . 3.95 1 1 8 1 . . . . . . . 5.5 1 1 9 1 . . . . . . . 5.5 1 1 10 1 . . . . . . . 5.5 1 1 11 1 . . . . . . . 3.62 1 1 12 1 . . . . . . . 4.38 1 1 13 1 . . . . . . . 4.25 1 1 14 1 . . . . . . . 3.62 1 1 15 1 . . . . . . . 4.4 1 1 16 1 . . . . . . . 4.92 1 1 17 1 . . . . . . . 3.43 1 1 18 1 . . . . . . . 5.5 1 1 19 1 . . . . . . . 5.5 1 1 20 1 . . . . . . . 5.49 1 1 21 1 . . . . . . . 5.5 1 1 22 1 . . . . . . . 4.13 1 1 23 1 . . . . . . . 4.85 1 1 24 1 . . . . . . . 5.5 1 1 25 1 . . . . . . . 5.01 1 1 26 1 . . . . . . . 5.5 1 1 27 1 . . . . . . . 4.01 1 1 28 1 . . . . . . . 5.5 1 1 29 1 . . . . . . . 4.29 1 1 30 1 . . . . . . . 3.44 1 1 31 1 . . . . . . . 3.46 1 1 32 1 . . . . . . . 5.5 1 1 33 1 . . . . . . . 5.5 1 1 34 1 . . . . . . . 4.06 1 1 35 1 . . . . . . . 2.68 1 1 36 1 . . . . . . . 3.33 1 1 37 1 . . . . . . . 4.43 1 1 38 1 . . . . . . . 4.21 1 1 39 1 . . . . . . . 3.46 1 1 40 1 . . . . . . . 3.46 1 1 41 1 . . . . . . . 3.2 1 1 42 1 . . . . . . . 5.14 1 1 43 1 . . . . . . . 4.52 1 1 44 1 . . . . . . . 5.14 1 1 45 1 . . . . . . . 5.5 1 1 46 1 . . . . . . . 4.8 1 1 47 1 . . . . . . . 3.27 1 1 48 1 . . . . . . . 2.77 1 1 49 1 . . . . . . . 3.27 1 1 50 1 . . . . . . . 5.5 1 1 51 1 . . . . . . . 4.52 1 1 52 1 . . . . . . . 3.0 1 1 53 1 . . . . . . . 5.33 1 1 54 1 . . . . . . . 4.41 1 1 55 1 . . . . . . . 5.5 1 1 56 1 . . . . . . . 5.28 1 1 57 1 . . . . . . . 4.21 1 1 58 1 . . . . . . . 4.49 1 1 59 1 . . . . . . . 3.95 1 1 60 1 . . . . . . . 3.42 1 1 61 1 . . . . . . . 3.95 1 1 62 1 . . . . . . . 4.45 1 1 63 1 . . . . . . . 5.5 1 1 64 1 . . . . . . . 5.34 1 1 65 1 . . . . . . . 3.55 1 1 66 1 . . . . . . . 2.83 1 1 67 1 . . . . . . . 3.55 1 1 68 1 . . . . . . . 4.74 1 1 69 1 . . . . . . . 4.69 1 1 70 1 . . . . . . . 3.17 1 1 71 1 . . . . . . . 4.23 1 1 72 1 . . . . . . . 5.19 1 1 73 1 . . . . . . . 5.5 1 1 74 1 . . . . . . . 4.11 1 1 75 1 . . . . . . . 4.93 1 1 76 1 . . . . . . . 4.28 1 1 77 1 . . . . . . . 4.64 1 1 78 1 . . . . . . . 2.82 1 1 79 1 . . . . . . . 3.59 1 1 80 1 . . . . . . . 2.75 1 1 81 1 . . . . . . . 4.79 1 1 82 1 . . . . . . . 3.48 1 1 83 1 . . . . . . . 4.86 1 1 84 1 . . . . . . . 5.5 1 1 85 1 . . . . . . . 3.3 1 1 86 1 . . . . . . . 4.06 1 1 87 1 . . . . . . . 5.41 1 1 88 1 . . . . . . . 3.48 1 1 89 1 . . . . . . . 4.99 1 1 90 1 . . . . . . . 5.5 1 1 91 1 . . . . . . . 5.44 1 1 92 1 . . . . . . . 5.17 1 1 93 1 . . . . . . . 3.42 1 1 94 1 . . . . . . . 3.58 1 1 95 1 . . . . . . . 3.39 1 1 96 1 . . . . . . . 3.45 1 1 97 1 . . . . . . . 3.85 1 1 98 1 . . . . . . . 3.88 1 1 99 1 . . . . . . . 5.34 1 1 100 1 . . . . . . . 5.5 1 1 101 1 . . . . . . . 5.5 1 1 102 1 . . . . . . . 4.54 1 1 103 1 . . . . . . . 5.5 1 1 104 1 . . . . . . . 2.64 1 1 105 1 . . . . . . . 4.94 1 1 106 1 . . . . . . . 5.5 1 1 107 1 . . . . . . . 4.7 1 1 108 1 . . . . . . . 2.91 1 1 109 1 . . . . . . . 3.85 1 1 110 1 . . . . . . . 5.5 1 1 111 1 . . . . . . . 5.05 1 1 112 1 . . . . . . . 5.34 1 1 113 1 . . . . . . . 5.17 1 1 114 1 . . . . . . . 3.25 1 1 115 1 . . . . . . . 4.75 1 1 116 1 . . . . . . . 3.04 1 1 117 1 . . . . . . . 4.51 1 1 118 1 . . . . . . . 5.05 1 1 119 1 . . . . . . . 3.36 1 1 120 1 . . . . . . . 4.45 1 1 121 1 . . . . . . . 3.31 1 1 122 1 . . . . . . . 5.32 1 1 123 1 . . . . . . . 4.98 1 1 124 1 . . . . . . . 4.31 1 1 125 1 . . . . . . . 4.32 1 1 126 1 . . . . . . . 5.25 1 1 127 1 . . . . . . . 5.34 1 1 128 1 . . . . . . . 5.5 1 1 129 1 . . . . . . . 5.5 1 1 130 1 . . . . . . . 5.43 1 1 131 1 . . . . . . . 3.92 1 1 132 1 . . . . . . . 5.5 1 1 133 1 . . . . . . . 3.31 1 1 134 1 . . . . . . . 5.31 1 1 135 1 . . . . . . . 3.6 1 1 136 1 . . . . . . . 2.76 1 1 137 1 . . . . . . . 3.02 1 1 138 1 . . . . . . . 5.5 1 1 139 1 . . . . . . . 2.49 1 1 140 1 . . . . . . . 4.52 1 1 141 1 . . . . . . . 4.61 1 1 142 1 . . . . . . . 4.03 1 1 143 1 . . . . . . . 4.61 1 1 144 1 . . . . . . . 3.93 1 1 145 1 . . . . . . . 3.6 1 1 146 1 . . . . . . . 3.6 1 1 147 1 . . . . . . . 2.52 1 1 148 1 . . . . . . . 4.04 1 1 149 1 . . . . . . . 4.6 1 1 150 1 . . . . . . . 4.6 1 1 151 1 . . . . . . . 3.11 1 1 152 1 . . . . . . . 4.84 1 1 153 1 . . . . . . . 4.84 1 1 154 1 . . . . . . . 2.4 1 1 155 1 . . . . . . . 4.53 1 1 156 1 . . . . . . . 4.22 1 1 157 1 . . . . . . . 5.34 1 1 158 1 . . . . . . . 4.11 1 1 159 1 . . . . . . . 3.56 1 1 160 1 . . . . . . . 4.11 1 1 161 1 . . . . . . . 2.31 1 1 162 1 . . . . . . . 4.22 1 1 163 1 . . . . . . . 4.9 1 1 164 1 . . . . . . . 4.9 1 1 165 1 . . . . . . . 3.2 1 1 166 1 . . . . . . . 3.96 1 1 167 1 . . . . . . . 3.3 1 1 168 1 . . . . . . . 3.96 1 1 169 1 . . . . . . . 5.5 1 1 170 1 . . . . . . . 2.59 1 1 171 1 . . . . . . . 4.56 1 1 172 1 . . . . . . . 5.5 1 1 173 1 . . . . . . . 4.02 1 1 174 1 . . . . . . . 4.37 1 1 175 1 . . . . . . . 4.13 1 1 176 1 . . . . . . . 4.41 1 1 177 1 . . . . . . . 3.68 1 1 178 1 . . . . . . . 5.16 1 1 179 1 . . . . . . . 3.27 1 1 180 1 . . . . . . . 4.17 1 1 181 1 . . . . . . . 5.34 1 1 182 1 . . . . . . . 3.98 1 1 183 1 . . . . . . . 3.98 1 1 184 1 . . . . . . . 3.32 1 1 185 1 . . . . . . . 3.4 1 1 186 1 . . . . . . . 3.22 1 1 187 1 . . . . . . . 2.77 1 1 188 1 . . . . . . . 4.87 1 1 189 1 . . . . . . . 4.91 1 1 190 1 . . . . . . . 5.34 1 1 191 1 . . . . . . . 4.88 1 1 192 1 . . . . . . . 3.35 1 1 193 1 . . . . . . . 2.89 1 1 194 1 . . . . . . . 4.43 1 1 195 1 . . . . . . . 5.5 1 1 196 1 . . . . . . . 3.07 1 1 197 1 . . . . . . . 4.73 1 1 198 1 . . . . . . . 5.34 1 1 199 1 . . . . . . . 3.7 1 1 200 1 . . . . . . . 3.61 1 1 201 1 . . . . . . . 5.5 1 1 202 1 . . . . . . . 5.5 1 1 203 1 . . . . . . . 3.64 1 1 204 1 . . . . . . . 2.93 1 1 205 1 . . . . . . . 4.37 1 1 206 1 . . . . . . . 5.5 1 1 207 1 . . . . . . . 3.9 1 1 208 1 . . . . . . . 5.34 1 1 209 1 . . . . . . . 3.42 1 1 210 1 . . . . . . . 5.5 1 1 211 1 . . . . . . . 5.5 1 1 212 1 . . . . . . . 3.34 1 1 213 1 . . . . . . . 4.03 1 1 214 1 . . . . . . . 4.27 1 1 215 1 . . . . . . . 3.47 1 1 216 1 . . . . . . . 3.63 1 1 217 1 . . . . . . . 4.95 1 1 218 1 . . . . . . . 5.05 1 1 219 1 . . . . . . . 3.53 1 1 220 1 . . . . . . . 4.8 1 1 221 1 . . . . . . . 5.34 1 1 222 1 . . . . . . . 4.02 1 1 223 1 . . . . . . . 2.83 1 1 224 1 . . . . . . . 4.59 1 1 225 1 . . . . . . . 5.5 1 1 226 1 . . . . . . . 4.88 1 1 227 1 . . . . . . . 2.92 1 1 228 1 . . . . . . . 2.87 1 1 229 1 . . . . . . . 4.95 1 1 230 1 . . . . . . . 4.86 1 1 231 1 . . . . . . . 3.98 1 1 232 1 . . . . . . . 5.34 1 1 233 1 . . . . . . . 4.8 1 1 234 1 . . . . . . . 2.96 1 1 235 1 . . . . . . . 3.23 1 1 236 1 . . . . . . . 4.56 1 1 237 1 . . . . . . . 5.31 1 1 238 1 . . . . . . . 5.5 1 1 239 1 . . . . . . . 5.5 1 1 240 1 . . . . . . . 5.5 1 1 241 1 . . . . . . . 5.5 1 1 242 1 . . . . . . . 5.5 1 1 243 1 . . . . . . . 4.36 1 1 244 1 . . . . . . . 5.34 1 1 245 1 . . . . . . . 3.89 1 1 246 1 . . . . . . . 5.32 1 1 247 1 . . . . . . . 5.29 1 1 248 1 . . . . . . . 3.17 1 1 249 1 . . . . . . . 3.86 1 1 250 1 . . . . . . . 5.5 1 1 251 1 . . . . . . . 4.45 1 1 252 1 . . . . . . . 5.5 1 1 253 1 . . . . . . . 5.5 1 1 254 1 . . . . . . . 4.18 1 1 255 1 . . . . . . . 3.39 1 1 256 1 . . . . . . . 3.63 1 1 257 1 . . . . . . . 3.51 1 1 258 1 . . . . . . . 2.69 1 1 259 1 . . . . . . . 5.17 1 1 260 1 . . . . . . . 4.72 1 1 261 1 . . . . . . . 3.41 1 1 262 1 . . . . . . . 2.9 1 1 263 1 . . . . . . . 3.41 1 1 264 1 . . . . . . . 4.15 1 1 265 1 . . . . . . . 5.39 1 1 266 1 . . . . . . . 5.34 1 1 267 1 . . . . . . . 5.0 1 1 268 1 . . . . . . . 2.54 1 1 269 1 . . . . . . . 3.53 1 1 270 1 . . . . . . . 3.28 1 1 271 1 . . . . . . . 2.53 1 1 272 1 . . . . . . . 4.23 1 1 273 1 . . . . . . . 5.16 1 1 274 1 . . . . . . . 4.82 1 1 275 1 . . . . . . . 4.82 1 1 276 1 . . . . . . . 3.89 1 1 277 1 . . . . . . . 2.94 1 1 278 1 . . . . . . . 5.47 1 1 279 1 . . . . . . . 3.24 1 1 280 1 . . . . . . . 3.19 1 1 281 1 . . . . . . . 2.69 1 1 282 1 . . . . . . . 4.02 1 1 283 1 . . . . . . . 3.81 1 1 284 1 . . . . . . . 3.81 1 1 285 1 . . . . . . . 3.98 1 1 286 1 . . . . . . . 4.59 1 1 287 1 . . . . . . . 5.22 1 1 288 1 . . . . . . . 4.04 1 1 289 1 . . . . . . . 3.53 1 1 290 1 . . . . . . . 5.33 1 1 291 1 . . . . . . . 5.34 1 1 292 1 . . . . . . . 2.92 1 1 293 1 . . . . . . . 2.97 1 1 294 1 . . . . . . . 4.43 1 1 295 1 . . . . . . . 5.34 1 1 296 1 . . . . . . . 3.17 1 1 297 1 . . . . . . . 5.34 1 1 298 1 . . . . . . . 5.34 1 1 299 1 . . . . . . . 4.5 1 1 300 1 . . . . . . . 3.1 1 1 301 1 . . . . . . . 2.68 1 1 302 1 . . . . . . . 5.5 1 1 303 1 . . . . . . . 4.45 1 1 304 1 . . . . . . . 4.35 1 1 305 1 . . . . . . . 3.77 1 1 306 1 . . . . . . . 3.93 1 1 307 1 . . . . . . . 3.98 1 1 308 1 . . . . . . . 3.33 1 1 309 1 . . . . . . . 3.33 1 1 310 1 . . . . . . . 3.57 1 1 311 1 . . . . . . . 2.96 1 1 312 1 . . . . . . . 3.03 1 1 313 1 . . . . . . . 5.5 1 1 314 1 . . . . . . . 4.26 1 1 315 1 . . . . . . . 3.11 1 1 316 1 . . . . . . . 5.5 1 1 317 1 . . . . . . . 3.61 1 1 318 1 . . . . . . . 3.01 1 1 319 1 . . . . . . . 5.5 1 1 320 1 . . . . . . . 4.02 1 1 321 1 . . . . . . . 5.38 1 1 322 1 . . . . . . . 3.32 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 GLY C C 2.308 -1.783 -1.908 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 3.049 -0.660 -1.196 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 2.613 1.113 -0.262 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 1.700 0.810 -1.612 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 1.394 0.000 -0.204 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 3.790 -0.248 -1.878 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 3.548 -1.056 -0.314 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 2.118 0.402 -0.787 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 1.236 -1.526 -2.450 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 PRO C C 0.980 -4.749 -2.048 1.00 . A A . 2 PRO C 1 1 1 11 1 1 2 PRO CA C 2.290 -4.186 -2.616 1.00 . A A . 2 PRO CA 1 1 1 12 1 1 2 PRO CB C 3.390 -5.255 -2.553 1.00 . A A . 2 PRO CB 1 1 1 13 1 1 2 PRO CD C 4.156 -3.343 -1.382 1.00 . A A . 2 PRO CD 1 1 1 14 1 1 2 PRO CG C 4.229 -4.862 -1.343 1.00 . A A . 2 PRO CG 1 1 1 15 1 1 2 PRO HA H 2.106 -3.929 -3.658 1.00 . A A . 2 PRO HA 1 1 1 16 1 1 2 PRO HB2 H 2.990 -6.262 -2.436 1.00 . A A . 2 PRO HB2 1 1 1 17 1 1 2 PRO HB3 H 4.000 -5.202 -3.452 1.00 . A A . 2 PRO HB3 1 1 1 18 1 1 2 PRO HD2 H 4.297 -2.935 -0.384 1.00 . A A . 2 PRO HD2 1 1 1 19 1 1 2 PRO HD3 H 4.920 -2.960 -2.058 1.00 . A A . 2 PRO HD3 1 1 1 20 1 1 2 PRO HG2 H 3.758 -5.222 -0.430 1.00 . A A . 2 PRO HG2 1 1 1 21 1 1 2 PRO HG3 H 5.254 -5.224 -1.421 1.00 . A A . 2 PRO HG3 1 1 1 22 1 1 2 PRO N N 2.847 -3.017 -1.917 1.00 . A A . 2 PRO N 1 1 1 23 1 1 2 PRO O O 0.406 -5.658 -2.646 1.00 . A A . 2 PRO O 1 1 1 24 1 1 3 TYR C C -1.548 -3.670 0.448 1.00 . A A . 3 TYR C 1 1 1 25 1 1 3 TYR CA C -0.734 -4.744 -0.270 1.00 . A A . 3 TYR CA 1 1 1 26 1 1 3 TYR CB C -0.562 -6.063 0.500 1.00 . A A . 3 TYR CB 1 1 1 27 1 1 3 TYR CD1 C 1.778 -7.025 0.583 1.00 . A A . 3 TYR CD1 1 1 1 28 1 1 3 TYR CD2 C 1.004 -5.674 2.460 1.00 . A A . 3 TYR CD2 1 1 1 29 1 1 3 TYR CE1 C 2.997 -7.255 1.249 1.00 . A A . 3 TYR CE1 1 1 1 30 1 1 3 TYR CE2 C 2.235 -5.877 3.114 1.00 . A A . 3 TYR CE2 1 1 1 31 1 1 3 TYR CG C 0.775 -6.245 1.194 1.00 . A A . 3 TYR CG 1 1 1 32 1 1 3 TYR CZ C 3.233 -6.670 2.511 1.00 . A A . 3 TYR CZ 1 1 1 33 1 1 3 TYR H H 1.011 -3.534 -0.435 1.00 . A A . 3 TYR H 1 1 1 34 1 1 3 TYR HA H -1.379 -5.032 -1.102 1.00 . A A . 3 TYR HA 1 1 1 35 1 1 3 TYR HB2 H -1.363 -6.160 1.235 1.00 . A A . 3 TYR HB2 1 1 1 36 1 1 3 TYR HB3 H -0.688 -6.884 -0.208 1.00 . A A . 3 TYR HB3 1 1 1 37 1 1 3 TYR HD1 H 1.611 -7.456 -0.397 1.00 . A A . 3 TYR HD1 1 1 1 38 1 1 3 TYR HD2 H 0.234 -5.079 2.933 1.00 . A A . 3 TYR HD2 1 1 1 39 1 1 3 TYR HE1 H 3.767 -7.860 0.790 1.00 . A A . 3 TYR HE1 1 1 1 40 1 1 3 TYR HE2 H 2.414 -5.439 4.084 1.00 . A A . 3 TYR HE2 1 1 1 41 1 1 3 TYR HH H 4.634 -6.167 3.752 1.00 . A A . 3 TYR HH 1 1 1 42 1 1 3 TYR N N 0.506 -4.278 -0.895 1.00 . A A . 3 TYR N 1 1 1 43 1 1 3 TYR O O -1.189 -3.216 1.536 1.00 . A A . 3 TYR O 1 1 1 44 1 1 3 TYR OH O 4.400 -6.908 3.164 1.00 . A A . 3 TYR OH 1 1 1 45 1 1 4 CYS C C -4.823 -2.069 -0.294 1.00 . A A . 4 CYS C 1 1 1 46 1 1 4 CYS CA C -3.378 -2.041 0.230 1.00 . A A . 4 CYS CA 1 1 1 47 1 1 4 CYS CB C -2.635 -0.748 -0.139 1.00 . A A . 4 CYS CB 1 1 1 48 1 1 4 CYS H H -2.787 -3.571 -1.134 1.00 . A A . 4 CYS H 1 1 1 49 1 1 4 CYS HA H -3.449 -2.078 1.318 1.00 . A A . 4 CYS HA 1 1 1 50 1 1 4 CYS HB2 H -3.321 0.082 -0.031 1.00 . A A . 4 CYS HB2 1 1 1 51 1 1 4 CYS HB3 H -1.833 -0.593 0.584 1.00 . A A . 4 CYS HB3 1 1 1 52 1 1 4 CYS N N -2.599 -3.192 -0.218 1.00 . A A . 4 CYS N 1 1 1 53 1 1 4 CYS O O -5.738 -2.364 0.474 1.00 . A A . 4 CYS O 1 1 1 54 1 1 4 CYS SG S -1.900 -0.655 -1.794 1.00 . A A . 4 CYS SG 1 1 1 55 1 1 5 GLN C C -7.050 -3.214 -2.060 1.00 . A A . 5 GLN C 1 1 1 56 1 1 5 GLN CA C -6.386 -1.833 -2.196 1.00 . A A . 5 GLN CA 1 1 1 57 1 1 5 GLN CB C -6.296 -1.316 -3.644 1.00 . A A . 5 GLN CB 1 1 1 58 1 1 5 GLN CD C -7.807 -2.470 -5.408 1.00 . A A . 5 GLN CD 1 1 1 59 1 1 5 GLN CG C -7.632 -1.319 -4.416 1.00 . A A . 5 GLN CG 1 1 1 60 1 1 5 GLN H H -4.257 -1.573 -2.173 1.00 . A A . 5 GLN H 1 1 1 61 1 1 5 GLN HA H -7.013 -1.134 -1.638 1.00 . A A . 5 GLN HA 1 1 1 62 1 1 5 GLN HB2 H -5.951 -0.283 -3.597 1.00 . A A . 5 GLN HB2 1 1 1 63 1 1 5 GLN HB3 H -5.542 -1.883 -4.190 1.00 . A A . 5 GLN HB3 1 1 1 64 1 1 5 GLN HE21 H -6.039 -2.183 -6.422 1.00 . A A . 5 GLN HE21 1 1 1 65 1 1 5 GLN HE22 H -7.041 -3.523 -6.905 1.00 . A A . 5 GLN HE22 1 1 1 66 1 1 5 GLN HG2 H -8.467 -1.316 -3.715 1.00 . A A . 5 GLN HG2 1 1 1 67 1 1 5 GLN HG3 H -7.697 -0.395 -4.986 1.00 . A A . 5 GLN HG3 1 1 1 68 1 1 5 GLN N N -5.043 -1.829 -1.593 1.00 . A A . 5 GLN N 1 1 1 69 1 1 5 GLN NE2 N -6.866 -2.756 -6.282 1.00 . A A . 5 GLN NE2 1 1 1 70 1 1 5 GLN O O -7.977 -3.376 -1.266 1.00 . A A . 5 GLN O 1 1 1 71 1 1 5 GLN OE1 O -8.776 -3.215 -5.363 1.00 . A A . 5 GLN OE1 1 1 1 72 1 1 6 LYS C C -6.327 -6.254 -1.074 1.00 . A A . 6 LYS C 1 1 1 73 1 1 6 LYS CA C -6.837 -5.671 -2.411 1.00 . A A . 6 LYS CA 1 1 1 74 1 1 6 LYS CB C -6.519 -6.523 -3.657 1.00 . A A . 6 LYS CB 1 1 1 75 1 1 6 LYS CD C -7.417 -8.447 -5.095 1.00 . A A . 6 LYS CD 1 1 1 76 1 1 6 LYS CE C -6.071 -8.989 -5.577 1.00 . A A . 6 LYS CE 1 1 1 77 1 1 6 LYS CG C -7.344 -7.830 -3.693 1.00 . A A . 6 LYS CG 1 1 1 78 1 1 6 LYS H H -5.658 -4.089 -3.250 1.00 . A A . 6 LYS H 1 1 1 79 1 1 6 LYS HA H -7.925 -5.669 -2.315 1.00 . A A . 6 LYS HA 1 1 1 80 1 1 6 LYS HB2 H -6.773 -5.937 -4.542 1.00 . A A . 6 LYS HB2 1 1 1 81 1 1 6 LYS HB3 H -5.452 -6.752 -3.691 1.00 . A A . 6 LYS HB3 1 1 1 82 1 1 6 LYS HD2 H -8.141 -9.263 -5.087 1.00 . A A . 6 LYS HD2 1 1 1 83 1 1 6 LYS HD3 H -7.772 -7.693 -5.799 1.00 . A A . 6 LYS HD3 1 1 1 84 1 1 6 LYS HE2 H -6.126 -9.130 -6.660 1.00 . A A . 6 LYS HE2 1 1 1 85 1 1 6 LYS HE3 H -5.292 -8.253 -5.368 1.00 . A A . 6 LYS HE3 1 1 1 86 1 1 6 LYS HG2 H -6.930 -8.562 -3.000 1.00 . A A . 6 LYS HG2 1 1 1 87 1 1 6 LYS HG3 H -8.364 -7.611 -3.379 1.00 . A A . 6 LYS HG3 1 1 1 88 1 1 6 LYS HZ1 H -6.452 -10.977 -5.196 1.00 . A A . 6 LYS HZ1 1 1 1 89 1 1 6 LYS HZ2 H -5.687 -10.240 -3.935 1.00 . A A . 6 LYS HZ2 1 1 1 90 1 1 6 LYS HZ3 H -4.864 -10.653 -5.311 1.00 . A A . 6 LYS HZ3 1 1 1 91 1 1 6 LYS N N -6.439 -4.264 -2.633 1.00 . A A . 6 LYS N 1 1 1 92 1 1 6 LYS NZ N -5.741 -10.287 -4.947 1.00 . A A . 6 LYS NZ 1 1 1 93 1 1 6 LYS O O -5.982 -7.424 -0.974 1.00 . A A . 6 LYS O 1 1 1 94 1 1 7 TRP C C -6.965 -4.922 2.319 1.00 . A A . 7 TRP C 1 1 1 95 1 1 7 TRP CA C -6.140 -5.832 1.378 1.00 . A A . 7 TRP CA 1 1 1 96 1 1 7 TRP CB C -4.643 -5.891 1.735 1.00 . A A . 7 TRP CB 1 1 1 97 1 1 7 TRP CD1 C -4.671 -7.770 3.471 1.00 . A A . 7 TRP CD1 1 1 1 98 1 1 7 TRP CD2 C -3.257 -6.115 4.008 1.00 . A A . 7 TRP CD2 1 1 1 99 1 1 7 TRP CE2 C -3.091 -7.139 4.987 1.00 . A A . 7 TRP CE2 1 1 1 100 1 1 7 TRP CE3 C -2.460 -4.961 4.160 1.00 . A A . 7 TRP CE3 1 1 1 101 1 1 7 TRP CG C -4.246 -6.561 3.026 1.00 . A A . 7 TRP CG 1 1 1 102 1 1 7 TRP CH2 C -1.363 -5.894 6.134 1.00 . A A . 7 TRP CH2 1 1 1 103 1 1 7 TRP CZ2 C -2.147 -7.053 6.018 1.00 . A A . 7 TRP CZ2 1 1 1 104 1 1 7 TRP CZ3 C -1.529 -4.848 5.211 1.00 . A A . 7 TRP CZ3 1 1 1 105 1 1 7 TRP H H -6.531 -4.461 -0.215 1.00 . A A . 7 TRP H 1 1 1 106 1 1 7 TRP HA H -6.550 -6.836 1.488 1.00 . A A . 7 TRP HA 1 1 1 107 1 1 7 TRP HB2 H -4.120 -6.419 0.935 1.00 . A A . 7 TRP HB2 1 1 1 108 1 1 7 TRP HB3 H -4.259 -4.870 1.747 1.00 . A A . 7 TRP HB3 1 1 1 109 1 1 7 TRP HD1 H -5.401 -8.396 2.967 1.00 . A A . 7 TRP HD1 1 1 1 110 1 1 7 TRP HE1 H -4.186 -8.952 5.179 1.00 . A A . 7 TRP HE1 1 1 1 111 1 1 7 TRP HE3 H -2.574 -4.154 3.455 1.00 . A A . 7 TRP HE3 1 1 1 112 1 1 7 TRP HH2 H -0.638 -5.804 6.932 1.00 . A A . 7 TRP HH2 1 1 1 113 1 1 7 TRP HZ2 H -2.030 -7.870 6.714 1.00 . A A . 7 TRP HZ2 1 1 1 114 1 1 7 TRP HZ3 H -0.927 -3.954 5.302 1.00 . A A . 7 TRP HZ3 1 1 1 115 1 1 7 TRP N N -6.296 -5.426 -0.029 1.00 . A A . 7 TRP N 1 1 1 116 1 1 7 TRP NE1 N -4.016 -8.099 4.645 1.00 . A A . 7 TRP NE1 1 1 1 117 1 1 7 TRP O O -6.872 -5.037 3.539 1.00 . A A . 7 TRP O 1 1 1 118 1 1 8 MET C C -8.225 -2.289 3.501 1.00 . A A . 8 MET C 1 1 1 119 1 1 8 MET CA C -8.833 -3.262 2.476 1.00 . A A . 8 MET CA 1 1 1 120 1 1 8 MET CB C -9.983 -4.155 2.976 1.00 . A A . 8 MET CB 1 1 1 121 1 1 8 MET CE C -10.744 -7.329 2.164 1.00 . A A . 8 MET CE 1 1 1 122 1 1 8 MET CG C -10.835 -4.573 1.770 1.00 . A A . 8 MET CG 1 1 1 123 1 1 8 MET H H -7.859 -4.010 0.747 1.00 . A A . 8 MET H 1 1 1 124 1 1 8 MET HA H -9.272 -2.606 1.725 1.00 . A A . 8 MET HA 1 1 1 125 1 1 8 MET HB2 H -9.572 -5.031 3.474 1.00 . A A . 8 MET HB2 1 1 1 126 1 1 8 MET HB3 H -10.616 -3.622 3.684 1.00 . A A . 8 MET HB3 1 1 1 127 1 1 8 MET HE1 H -11.274 -8.274 2.281 1.00 . A A . 8 MET HE1 1 1 1 128 1 1 8 MET HE2 H -10.120 -7.379 1.272 1.00 . A A . 8 MET HE2 1 1 1 129 1 1 8 MET HE3 H -10.113 -7.171 3.039 1.00 . A A . 8 MET HE3 1 1 1 130 1 1 8 MET HG2 H -11.437 -3.712 1.478 1.00 . A A . 8 MET HG2 1 1 1 131 1 1 8 MET HG3 H -10.181 -4.821 0.933 1.00 . A A . 8 MET HG3 1 1 1 132 1 1 8 MET N N -7.843 -4.075 1.757 1.00 . A A . 8 MET N 1 1 1 133 1 1 8 MET O O -8.578 -2.261 4.675 1.00 . A A . 8 MET O 1 1 1 134 1 1 8 MET SD S -11.947 -5.979 2.005 1.00 . A A . 8 MET SD 1 1 1 135 1 1 9 GLN C C -7.187 0.704 4.477 1.00 . A A . 9 GLN C 1 1 1 136 1 1 9 GLN CA C -6.506 -0.425 3.653 1.00 . A A . 9 GLN CA 1 1 1 137 1 1 9 GLN CB C -5.563 0.158 2.581 1.00 . A A . 9 GLN CB 1 1 1 138 1 1 9 GLN CD C -5.398 1.531 0.408 1.00 . A A . 9 GLN CD 1 1 1 139 1 1 9 GLN CG C -6.313 0.834 1.407 1.00 . A A . 9 GLN CG 1 1 1 140 1 1 9 GLN H H -7.087 -1.627 2.022 1.00 . A A . 9 GLN H 1 1 1 141 1 1 9 GLN HA H -5.885 -0.966 4.369 1.00 . A A . 9 GLN HA 1 1 1 142 1 1 9 GLN HB2 H -4.887 0.866 3.052 1.00 . A A . 9 GLN HB2 1 1 1 143 1 1 9 GLN HB3 H -4.940 -0.644 2.194 1.00 . A A . 9 GLN HB3 1 1 1 144 1 1 9 GLN HE21 H -4.083 2.144 1.814 1.00 . A A . 9 GLN HE21 1 1 1 145 1 1 9 GLN HE22 H -3.750 2.674 0.185 1.00 . A A . 9 GLN HE22 1 1 1 146 1 1 9 GLN HG2 H -6.903 0.094 0.867 1.00 . A A . 9 GLN HG2 1 1 1 147 1 1 9 GLN HG3 H -6.995 1.586 1.801 1.00 . A A . 9 GLN HG3 1 1 1 148 1 1 9 GLN N N -7.344 -1.432 2.983 1.00 . A A . 9 GLN N 1 1 1 149 1 1 9 GLN NE2 N -4.342 2.183 0.842 1.00 . A A . 9 GLN NE2 1 1 1 150 1 1 9 GLN O O -6.761 1.855 4.390 1.00 . A A . 9 GLN O 1 1 1 151 1 1 9 GLN OE1 O -5.633 1.535 -0.788 1.00 . A A . 9 GLN OE1 1 1 1 152 1 1 10 THR C C -8.537 2.740 6.329 1.00 . A A . 10 THR C 1 1 1 153 1 1 10 THR CA C -8.509 1.212 6.537 1.00 . A A . 10 THR CA 1 1 1 154 1 1 10 THR CB C -7.571 0.813 7.695 1.00 . A A . 10 THR CB 1 1 1 155 1 1 10 THR CG2 C -8.153 1.203 9.051 1.00 . A A . 10 THR CG2 1 1 1 156 1 1 10 THR H H -8.459 -0.561 5.359 1.00 . A A . 10 THR H 1 1 1 157 1 1 10 THR HA H -9.508 0.929 6.849 1.00 . A A . 10 THR HA 1 1 1 158 1 1 10 THR HB H -6.589 1.269 7.561 1.00 . A A . 10 THR HB 1 1 1 159 1 1 10 THR HG1 H -6.621 -0.798 8.247 1.00 . A A . 10 THR HG1 1 1 1 160 1 1 10 THR HG21 H -9.146 0.771 9.167 1.00 . A A . 10 THR HG21 1 1 1 161 1 1 10 THR HG22 H -8.223 2.286 9.124 1.00 . A A . 10 THR HG22 1 1 1 162 1 1 10 THR HG23 H -7.504 0.842 9.846 1.00 . A A . 10 THR HG23 1 1 1 163 1 1 10 THR N N -8.175 0.415 5.327 1.00 . A A . 10 THR N 1 1 1 164 1 1 10 THR O O -7.679 3.449 6.859 1.00 . A A . 10 THR O 1 1 1 165 1 1 10 THR OG1 O -7.413 -0.589 7.719 1.00 . A A . 10 THR OG1 1 1 1 166 1 1 11 CYS C C -9.635 5.763 5.693 1.00 . A A . 11 CYS C 1 1 1 167 1 1 11 CYS CA C -9.151 4.575 4.835 1.00 . A A . 11 CYS CA 1 1 1 168 1 1 11 CYS CB C -9.643 4.607 3.389 1.00 . A A . 11 CYS CB 1 1 1 169 1 1 11 CYS H H -10.088 2.654 5.020 1.00 . A A . 11 CYS H 1 1 1 170 1 1 11 CYS HA H -8.069 4.684 4.758 1.00 . A A . 11 CYS HA 1 1 1 171 1 1 11 CYS HB2 H -9.332 3.677 2.915 1.00 . A A . 11 CYS HB2 1 1 1 172 1 1 11 CYS HB3 H -10.733 4.654 3.372 1.00 . A A . 11 CYS HB3 1 1 1 173 1 1 11 CYS N N -9.379 3.248 5.422 1.00 . A A . 11 CYS N 1 1 1 174 1 1 11 CYS O O -10.714 5.742 6.283 1.00 . A A . 11 CYS O 1 1 1 175 1 1 11 CYS SG S -8.955 5.950 2.384 1.00 . A A . 11 CYS SG 1 1 1 176 1 1 12 ASP C C -8.497 9.224 5.478 1.00 . A A . 12 ASP C 1 1 1 177 1 1 12 ASP CA C -8.891 8.073 6.439 1.00 . A A . 12 ASP CA 1 1 1 178 1 1 12 ASP CB C -7.864 8.034 7.590 1.00 . A A . 12 ASP CB 1 1 1 179 1 1 12 ASP CG C -7.969 6.886 8.604 1.00 . A A . 12 ASP CG 1 1 1 180 1 1 12 ASP H H -8.055 6.782 5.025 1.00 . A A . 12 ASP H 1 1 1 181 1 1 12 ASP HA H -9.898 8.231 6.831 1.00 . A A . 12 ASP HA 1 1 1 182 1 1 12 ASP HB2 H -6.868 7.995 7.146 1.00 . A A . 12 ASP HB2 1 1 1 183 1 1 12 ASP HB3 H -7.941 8.970 8.136 1.00 . A A . 12 ASP HB3 1 1 1 184 1 1 12 ASP N N -8.814 6.816 5.688 1.00 . A A . 12 ASP N 1 1 1 185 1 1 12 ASP O O -7.844 8.967 4.464 1.00 . A A . 12 ASP O 1 1 1 186 1 1 12 ASP OD1 O -6.917 6.440 9.119 1.00 . A A . 12 ASP OD1 1 1 1 187 1 1 12 ASP OD2 O -9.084 6.506 9.017 1.00 . A A . 12 ASP OD2 1 1 1 188 1 1 13 SER C C -6.721 11.888 5.010 1.00 . A A . 13 SER C 1 1 1 189 1 1 13 SER CA C -8.256 11.679 5.043 1.00 . A A . 13 SER CA 1 1 1 190 1 1 13 SER CB C -8.993 12.952 5.500 1.00 . A A . 13 SER CB 1 1 1 191 1 1 13 SER H H -9.169 10.680 6.723 1.00 . A A . 13 SER H 1 1 1 192 1 1 13 SER HA H -8.551 11.493 4.010 1.00 . A A . 13 SER HA 1 1 1 193 1 1 13 SER HB2 H -10.066 12.822 5.361 1.00 . A A . 13 SER HB2 1 1 1 194 1 1 13 SER HB3 H -8.804 13.114 6.560 1.00 . A A . 13 SER HB3 1 1 1 195 1 1 13 SER HG H -7.587 13.988 4.700 1.00 . A A . 13 SER HG 1 1 1 196 1 1 13 SER N N -8.701 10.502 5.843 1.00 . A A . 13 SER N 1 1 1 197 1 1 13 SER O O -6.211 12.956 4.655 1.00 . A A . 13 SER O 1 1 1 198 1 1 13 SER OG O -8.557 14.094 4.777 1.00 . A A . 13 SER OG 1 1 1 199 1 1 14 GLU C C -3.950 9.538 4.930 1.00 . A A . 14 GLU C 1 1 1 200 1 1 14 GLU CA C -4.518 10.832 5.540 1.00 . A A . 14 GLU CA 1 1 1 201 1 1 14 GLU CB C -4.131 10.984 7.019 1.00 . A A . 14 GLU CB 1 1 1 202 1 1 14 GLU CD C -4.228 9.975 9.371 1.00 . A A . 14 GLU CD 1 1 1 203 1 1 14 GLU CG C -4.733 9.899 7.930 1.00 . A A . 14 GLU CG 1 1 1 204 1 1 14 GLU H H -6.481 10.056 5.722 1.00 . A A . 14 GLU H 1 1 1 205 1 1 14 GLU HA H -4.079 11.661 4.982 1.00 . A A . 14 GLU HA 1 1 1 206 1 1 14 GLU HB2 H -3.049 10.977 7.086 1.00 . A A . 14 GLU HB2 1 1 1 207 1 1 14 GLU HB3 H -4.476 11.952 7.376 1.00 . A A . 14 GLU HB3 1 1 1 208 1 1 14 GLU HG2 H -5.816 10.007 7.935 1.00 . A A . 14 GLU HG2 1 1 1 209 1 1 14 GLU HG3 H -4.493 8.913 7.529 1.00 . A A . 14 GLU HG3 1 1 1 210 1 1 14 GLU N N -5.975 10.885 5.449 1.00 . A A . 14 GLU N 1 1 1 211 1 1 14 GLU O O -2.741 9.298 5.002 1.00 . A A . 14 GLU O 1 1 1 212 1 1 14 GLU OE1 O -4.963 9.558 10.295 1.00 . A A . 14 GLU OE1 1 1 1 213 1 1 14 GLU OE2 O -3.089 10.439 9.617 1.00 . A A . 14 GLU OE2 1 1 1 214 1 1 15 ARG C C -4.102 7.329 2.449 1.00 . A A . 15 ARG C 1 1 1 215 1 1 15 ARG CA C -4.450 7.322 3.933 1.00 . A A . 15 ARG CA 1 1 1 216 1 1 15 ARG CB C -5.558 6.309 4.275 1.00 . A A . 15 ARG CB 1 1 1 217 1 1 15 ARG CD C -4.636 4.096 3.391 1.00 . A A . 15 ARG CD 1 1 1 218 1 1 15 ARG CG C -4.997 4.926 4.651 1.00 . A A . 15 ARG CG 1 1 1 219 1 1 15 ARG CZ C -3.230 2.491 4.701 1.00 . A A . 15 ARG CZ 1 1 1 220 1 1 15 ARG H H -5.784 8.964 4.268 1.00 . A A . 15 ARG H 1 1 1 221 1 1 15 ARG HA H -3.556 7.041 4.491 1.00 . A A . 15 ARG HA 1 1 1 222 1 1 15 ARG HB2 H -6.086 6.672 5.158 1.00 . A A . 15 ARG HB2 1 1 1 223 1 1 15 ARG HB3 H -6.279 6.230 3.461 1.00 . A A . 15 ARG HB3 1 1 1 224 1 1 15 ARG HD2 H -5.449 3.421 3.170 1.00 . A A . 15 ARG HD2 1 1 1 225 1 1 15 ARG HD3 H -4.453 4.734 2.545 1.00 . A A . 15 ARG HD3 1 1 1 226 1 1 15 ARG HE H -2.590 3.420 3.077 1.00 . A A . 15 ARG HE 1 1 1 227 1 1 15 ARG HG2 H -4.139 5.061 5.311 1.00 . A A . 15 ARG HG2 1 1 1 228 1 1 15 ARG HG3 H -5.764 4.381 5.197 1.00 . A A . 15 ARG HG3 1 1 1 229 1 1 15 ARG HH11 H -5.164 2.338 5.221 1.00 . A A . 15 ARG HH11 1 1 1 230 1 1 15 ARG HH12 H -3.989 1.569 6.285 1.00 . A A . 15 ARG HH12 1 1 1 231 1 1 15 ARG HH21 H -1.215 2.307 4.535 1.00 . A A . 15 ARG HH21 1 1 1 232 1 1 15 ARG HH22 H -2.007 1.374 5.793 1.00 . A A . 15 ARG HH22 1 1 1 233 1 1 15 ARG N N -4.818 8.666 4.388 1.00 . A A . 15 ARG N 1 1 1 234 1 1 15 ARG NE N -3.397 3.334 3.692 1.00 . A A . 15 ARG NE 1 1 1 235 1 1 15 ARG NH1 N -4.211 2.082 5.442 1.00 . A A . 15 ARG NH1 1 1 1 236 1 1 15 ARG NH2 N -2.060 2.018 5.013 1.00 . A A . 15 ARG NH2 1 1 1 237 1 1 15 ARG O O -4.858 7.794 1.597 1.00 . A A . 15 ARG O 1 1 1 238 1 1 16 LYS C C -3.132 5.499 -0.040 1.00 . A A . 16 LYS C 1 1 1 239 1 1 16 LYS CA C -2.362 6.513 0.829 1.00 . A A . 16 LYS CA 1 1 1 240 1 1 16 LYS CB C -0.863 6.196 1.045 1.00 . A A . 16 LYS CB 1 1 1 241 1 1 16 LYS CD C -0.418 7.832 3.022 1.00 . A A . 16 LYS CD 1 1 1 242 1 1 16 LYS CE C 0.548 8.836 3.640 1.00 . A A . 16 LYS CE 1 1 1 243 1 1 16 LYS CG C -0.022 7.370 1.605 1.00 . A A . 16 LYS CG 1 1 1 244 1 1 16 LYS H H -2.470 6.306 2.931 1.00 . A A . 16 LYS H 1 1 1 245 1 1 16 LYS HA H -2.417 7.468 0.299 1.00 . A A . 16 LYS HA 1 1 1 246 1 1 16 LYS HB2 H -0.762 5.348 1.721 1.00 . A A . 16 LYS HB2 1 1 1 247 1 1 16 LYS HB3 H -0.427 5.899 0.091 1.00 . A A . 16 LYS HB3 1 1 1 248 1 1 16 LYS HD2 H -1.376 8.345 2.968 1.00 . A A . 16 LYS HD2 1 1 1 249 1 1 16 LYS HD3 H -0.494 6.964 3.678 1.00 . A A . 16 LYS HD3 1 1 1 250 1 1 16 LYS HE2 H 1.555 8.412 3.680 1.00 . A A . 16 LYS HE2 1 1 1 251 1 1 16 LYS HE3 H 0.576 9.724 3.001 1.00 . A A . 16 LYS HE3 1 1 1 252 1 1 16 LYS HG2 H 1.020 7.049 1.630 1.00 . A A . 16 LYS HG2 1 1 1 253 1 1 16 LYS HG3 H -0.098 8.216 0.922 1.00 . A A . 16 LYS HG3 1 1 1 254 1 1 16 LYS HZ1 H 0.656 10.013 5.325 1.00 . A A . 16 LYS HZ1 1 1 1 255 1 1 16 LYS HZ2 H 0.234 8.476 5.674 1.00 . A A . 16 LYS HZ2 1 1 1 256 1 1 16 LYS HZ3 H -0.878 9.495 5.009 1.00 . A A . 16 LYS HZ3 1 1 1 257 1 1 16 LYS N N -2.988 6.667 2.146 1.00 . A A . 16 LYS N 1 1 1 258 1 1 16 LYS NZ N 0.104 9.225 5.000 1.00 . A A . 16 LYS NZ 1 1 1 259 1 1 16 LYS O O -2.689 4.372 -0.264 1.00 . A A . 16 LYS O 1 1 1 260 1 1 17 CYS C C -4.886 4.618 -2.421 1.00 . A A . 17 CYS C 1 1 1 261 1 1 17 CYS CA C -5.380 5.011 -1.023 1.00 . A A . 17 CYS CA 1 1 1 262 1 1 17 CYS CB C -6.697 5.797 -1.085 1.00 . A A . 17 CYS CB 1 1 1 263 1 1 17 CYS H H -4.679 6.769 -0.057 1.00 . A A . 17 CYS H 1 1 1 264 1 1 17 CYS HA H -5.554 4.115 -0.433 1.00 . A A . 17 CYS HA 1 1 1 265 1 1 17 CYS HB2 H -6.962 6.126 -0.078 1.00 . A A . 17 CYS HB2 1 1 1 266 1 1 17 CYS HB3 H -6.537 6.694 -1.687 1.00 . A A . 17 CYS HB3 1 1 1 267 1 1 17 CYS N N -4.382 5.848 -0.355 1.00 . A A . 17 CYS N 1 1 1 268 1 1 17 CYS O O -4.824 5.462 -3.315 1.00 . A A . 17 CYS O 1 1 1 269 1 1 17 CYS SG S -8.126 4.914 -1.770 1.00 . A A . 17 CYS SG 1 1 1 270 1 1 18 CYS C C -4.328 3.041 -5.114 1.00 . A A . 18 CYS C 1 1 1 271 1 1 18 CYS CA C -3.654 2.928 -3.735 1.00 . A A . 18 CYS CA 1 1 1 272 1 1 18 CYS CB C -3.184 1.495 -3.467 1.00 . A A . 18 CYS CB 1 1 1 273 1 1 18 CYS H H -4.676 2.682 -1.878 1.00 . A A . 18 CYS H 1 1 1 274 1 1 18 CYS HA H -2.772 3.570 -3.768 1.00 . A A . 18 CYS HA 1 1 1 275 1 1 18 CYS HB2 H -4.042 0.889 -3.176 1.00 . A A . 18 CYS HB2 1 1 1 276 1 1 18 CYS HB3 H -2.781 1.082 -4.395 1.00 . A A . 18 CYS HB3 1 1 1 277 1 1 18 CYS N N -4.496 3.358 -2.613 1.00 . A A . 18 CYS N 1 1 1 278 1 1 18 CYS O O -3.632 3.028 -6.126 1.00 . A A . 18 CYS O 1 1 1 279 1 1 18 CYS SG S -1.894 1.338 -2.203 1.00 . A A . 18 CYS SG 1 1 1 280 1 1 19 GLU C C -7.397 4.584 -6.362 1.00 . A A . 19 GLU C 1 1 1 281 1 1 19 GLU CA C -6.430 3.381 -6.393 1.00 . A A . 19 GLU CA 1 1 1 282 1 1 19 GLU CB C -7.168 2.066 -6.713 1.00 . A A . 19 GLU CB 1 1 1 283 1 1 19 GLU CD C -5.406 1.098 -8.307 1.00 . A A . 19 GLU CD 1 1 1 284 1 1 19 GLU CG C -6.270 0.871 -7.064 1.00 . A A . 19 GLU CG 1 1 1 285 1 1 19 GLU H H -6.149 3.183 -4.282 1.00 . A A . 19 GLU H 1 1 1 286 1 1 19 GLU HA H -5.743 3.605 -7.209 1.00 . A A . 19 GLU HA 1 1 1 287 1 1 19 GLU HB2 H -7.772 1.792 -5.848 1.00 . A A . 19 GLU HB2 1 1 1 288 1 1 19 GLU HB3 H -7.833 2.228 -7.554 1.00 . A A . 19 GLU HB3 1 1 1 289 1 1 19 GLU HG2 H -5.632 0.634 -6.210 1.00 . A A . 19 GLU HG2 1 1 1 290 1 1 19 GLU HG3 H -6.911 0.007 -7.245 1.00 . A A . 19 GLU HG3 1 1 1 291 1 1 19 GLU N N -5.654 3.203 -5.159 1.00 . A A . 19 GLU N 1 1 1 292 1 1 19 GLU O O -8.175 4.782 -7.298 1.00 . A A . 19 GLU O 1 1 1 293 1 1 19 GLU OE1 O -5.641 2.069 -9.064 1.00 . A A . 19 GLU OE1 1 1 1 294 1 1 19 GLU OE2 O -4.427 0.341 -8.485 1.00 . A A . 19 GLU OE2 1 1 1 295 1 1 20 GLY C C -9.735 6.352 -5.043 1.00 . A A . 20 GLY C 1 1 1 296 1 1 20 GLY CA C -8.215 6.579 -5.119 1.00 . A A . 20 GLY CA 1 1 1 297 1 1 20 GLY H H -6.643 5.229 -4.606 1.00 . A A . 20 GLY H 1 1 1 298 1 1 20 GLY HA2 H -7.912 7.074 -4.197 1.00 . A A . 20 GLY HA2 1 1 1 299 1 1 20 GLY HA3 H -8.020 7.256 -5.951 1.00 . A A . 20 GLY HA3 1 1 1 300 1 1 20 GLY N N -7.379 5.380 -5.284 1.00 . A A . 20 GLY N 1 1 1 301 1 1 20 GLY O O -10.501 7.303 -5.217 1.00 . A A . 20 GLY O 1 1 1 302 1 1 21 MET C C -12.176 4.291 -3.597 1.00 . A A . 21 MET C 1 1 1 303 1 1 21 MET CA C -11.570 4.655 -4.960 1.00 . A A . 21 MET CA 1 1 1 304 1 1 21 MET CB C -11.688 3.497 -5.970 1.00 . A A . 21 MET CB 1 1 1 305 1 1 21 MET CE C -10.537 1.763 -8.446 1.00 . A A . 21 MET CE 1 1 1 306 1 1 21 MET CG C -10.717 2.337 -5.698 1.00 . A A . 21 MET CG 1 1 1 307 1 1 21 MET H H -9.483 4.395 -4.676 1.00 . A A . 21 MET H 1 1 1 308 1 1 21 MET HA H -12.161 5.473 -5.367 1.00 . A A . 21 MET HA 1 1 1 309 1 1 21 MET HB2 H -12.712 3.120 -5.966 1.00 . A A . 21 MET HB2 1 1 1 310 1 1 21 MET HB3 H -11.481 3.895 -6.962 1.00 . A A . 21 MET HB3 1 1 1 311 1 1 21 MET HE1 H -9.738 2.499 -8.392 1.00 . A A . 21 MET HE1 1 1 1 312 1 1 21 MET HE2 H -10.300 1.026 -9.214 1.00 . A A . 21 MET HE2 1 1 1 313 1 1 21 MET HE3 H -11.457 2.276 -8.715 1.00 . A A . 21 MET HE3 1 1 1 314 1 1 21 MET HG2 H -9.707 2.736 -5.709 1.00 . A A . 21 MET HG2 1 1 1 315 1 1 21 MET HG3 H -10.907 1.942 -4.701 1.00 . A A . 21 MET HG3 1 1 1 316 1 1 21 MET N N -10.175 5.103 -4.855 1.00 . A A . 21 MET N 1 1 1 317 1 1 21 MET O O -11.650 3.437 -2.884 1.00 . A A . 21 MET O 1 1 1 318 1 1 21 MET SD S -10.756 0.934 -6.848 1.00 . A A . 21 MET SD 1 1 1 319 1 1 22 VAL C C -13.360 4.595 -0.761 1.00 . A A . 22 VAL C 1 1 1 320 1 1 22 VAL CA C -14.133 4.651 -2.081 1.00 . A A . 22 VAL CA 1 1 1 321 1 1 22 VAL CB C -15.073 3.439 -2.268 1.00 . A A . 22 VAL CB 1 1 1 322 1 1 22 VAL CG1 C -16.212 3.464 -1.240 1.00 . A A . 22 VAL CG1 1 1 1 323 1 1 22 VAL CG2 C -15.723 3.382 -3.655 1.00 . A A . 22 VAL CG2 1 1 1 324 1 1 22 VAL H H -13.644 5.627 -3.913 1.00 . A A . 22 VAL H 1 1 1 325 1 1 22 VAL HA H -14.789 5.516 -1.991 1.00 . A A . 22 VAL HA 1 1 1 326 1 1 22 VAL HB H -14.507 2.517 -2.135 1.00 . A A . 22 VAL HB 1 1 1 327 1 1 22 VAL HG11 H -16.904 2.653 -1.441 1.00 . A A . 22 VAL HG11 1 1 1 328 1 1 22 VAL HG12 H -15.813 3.331 -0.236 1.00 . A A . 22 VAL HG12 1 1 1 329 1 1 22 VAL HG13 H -16.752 4.408 -1.295 1.00 . A A . 22 VAL HG13 1 1 1 330 1 1 22 VAL HG21 H -16.360 4.251 -3.803 1.00 . A A . 22 VAL HG21 1 1 1 331 1 1 22 VAL HG22 H -14.968 3.352 -4.438 1.00 . A A . 22 VAL HG22 1 1 1 332 1 1 22 VAL HG23 H -16.309 2.468 -3.720 1.00 . A A . 22 VAL HG23 1 1 1 333 1 1 22 VAL N N -13.306 4.924 -3.267 1.00 . A A . 22 VAL N 1 1 1 334 1 1 22 VAL O O -13.260 3.538 -0.143 1.00 . A A . 22 VAL O 1 1 1 335 1 1 23 CYS C C -13.287 5.835 2.179 1.00 . A A . 23 CYS C 1 1 1 336 1 1 23 CYS CA C -12.250 5.900 1.031 1.00 . A A . 23 CYS CA 1 1 1 337 1 1 23 CYS CB C -11.400 7.180 1.031 1.00 . A A . 23 CYS CB 1 1 1 338 1 1 23 CYS H H -12.938 6.575 -0.872 1.00 . A A . 23 CYS H 1 1 1 339 1 1 23 CYS HA H -11.568 5.060 1.165 1.00 . A A . 23 CYS HA 1 1 1 340 1 1 23 CYS HB2 H -10.760 7.171 0.148 1.00 . A A . 23 CYS HB2 1 1 1 341 1 1 23 CYS HB3 H -12.070 8.037 0.947 1.00 . A A . 23 CYS HB3 1 1 1 342 1 1 23 CYS N N -12.878 5.748 -0.286 1.00 . A A . 23 CYS N 1 1 1 343 1 1 23 CYS O O -13.460 6.782 2.952 1.00 . A A . 23 CYS O 1 1 1 344 1 1 23 CYS SG S -10.335 7.435 2.480 1.00 . A A . 23 CYS SG 1 1 1 345 1 1 24 ARG C C -14.627 3.035 3.922 1.00 . A A . 24 ARG C 1 1 1 346 1 1 24 ARG CA C -14.985 4.393 3.331 1.00 . A A . 24 ARG CA 1 1 1 347 1 1 24 ARG CB C -16.448 4.430 2.842 1.00 . A A . 24 ARG CB 1 1 1 348 1 1 24 ARG CD C -16.755 6.460 1.389 1.00 . A A . 24 ARG CD 1 1 1 349 1 1 24 ARG CG C -17.056 5.841 2.767 1.00 . A A . 24 ARG CG 1 1 1 350 1 1 24 ARG CZ C -17.880 8.516 0.544 1.00 . A A . 24 ARG CZ 1 1 1 351 1 1 24 ARG H H -13.816 3.992 1.590 1.00 . A A . 24 ARG H 1 1 1 352 1 1 24 ARG HA H -14.882 5.121 4.134 1.00 . A A . 24 ARG HA 1 1 1 353 1 1 24 ARG HB2 H -16.550 3.911 1.889 1.00 . A A . 24 ARG HB2 1 1 1 354 1 1 24 ARG HB3 H -17.047 3.879 3.568 1.00 . A A . 24 ARG HB3 1 1 1 355 1 1 24 ARG HD2 H -15.700 6.488 1.204 1.00 . A A . 24 ARG HD2 1 1 1 356 1 1 24 ARG HD3 H -17.262 5.900 0.625 1.00 . A A . 24 ARG HD3 1 1 1 357 1 1 24 ARG HE H -17.098 8.350 2.337 1.00 . A A . 24 ARG HE 1 1 1 358 1 1 24 ARG HG2 H -18.138 5.767 2.886 1.00 . A A . 24 ARG HG2 1 1 1 359 1 1 24 ARG HG3 H -16.655 6.462 3.571 1.00 . A A . 24 ARG HG3 1 1 1 360 1 1 24 ARG HH11 H -17.697 7.218 -1.001 1.00 . A A . 24 ARG HH11 1 1 1 361 1 1 24 ARG HH12 H -18.563 8.677 -1.339 1.00 . A A . 24 ARG HH12 1 1 1 362 1 1 24 ARG HH21 H -18.365 9.959 1.836 1.00 . A A . 24 ARG HH21 1 1 1 363 1 1 24 ARG HH22 H -18.785 10.249 0.146 1.00 . A A . 24 ARG HH22 1 1 1 364 1 1 24 ARG N N -14.030 4.725 2.264 1.00 . A A . 24 ARG N 1 1 1 365 1 1 24 ARG NE N -17.272 7.826 1.487 1.00 . A A . 24 ARG NE 1 1 1 366 1 1 24 ARG NH1 N -18.027 8.120 -0.689 1.00 . A A . 24 ARG NH1 1 1 1 367 1 1 24 ARG NH2 N -18.368 9.672 0.862 1.00 . A A . 24 ARG NH2 1 1 1 368 1 1 24 ARG O O -14.725 2.029 3.232 1.00 . A A . 24 ARG O 1 1 1 369 1 1 25 LEU C C -12.356 1.167 5.259 1.00 . A A . 25 LEU C 1 1 1 370 1 1 25 LEU CA C -13.560 1.890 5.908 1.00 . A A . 25 LEU CA 1 1 1 371 1 1 25 LEU CB C -14.660 0.879 6.292 1.00 . A A . 25 LEU CB 1 1 1 372 1 1 25 LEU CD1 C -16.990 1.927 6.248 1.00 . A A . 25 LEU CD1 1 1 1 373 1 1 25 LEU CD2 C -16.369 0.386 8.066 1.00 . A A . 25 LEU CD2 1 1 1 374 1 1 25 LEU CG C -15.822 1.459 7.123 1.00 . A A . 25 LEU CG 1 1 1 375 1 1 25 LEU H H -14.215 3.909 5.661 1.00 . A A . 25 LEU H 1 1 1 376 1 1 25 LEU HA H -13.174 2.298 6.844 1.00 . A A . 25 LEU HA 1 1 1 377 1 1 25 LEU HB2 H -15.057 0.409 5.392 1.00 . A A . 25 LEU HB2 1 1 1 378 1 1 25 LEU HB3 H -14.177 0.095 6.876 1.00 . A A . 25 LEU HB3 1 1 1 379 1 1 25 LEU HD11 H -16.686 2.761 5.628 1.00 . A A . 25 LEU HD11 1 1 1 380 1 1 25 LEU HD12 H -17.802 2.285 6.874 1.00 . A A . 25 LEU HD12 1 1 1 381 1 1 25 LEU HD13 H -17.338 1.115 5.610 1.00 . A A . 25 LEU HD13 1 1 1 382 1 1 25 LEU HD21 H -16.731 -0.462 7.489 1.00 . A A . 25 LEU HD21 1 1 1 383 1 1 25 LEU HD22 H -17.173 0.802 8.670 1.00 . A A . 25 LEU HD22 1 1 1 384 1 1 25 LEU HD23 H -15.578 0.054 8.739 1.00 . A A . 25 LEU HD23 1 1 1 385 1 1 25 LEU HG H -15.459 2.289 7.728 1.00 . A A . 25 LEU HG 1 1 1 386 1 1 25 LEU N N -14.131 3.031 5.162 1.00 . A A . 25 LEU N 1 1 1 387 1 1 25 LEU O O -11.617 0.484 5.964 1.00 . A A . 25 LEU O 1 1 1 388 1 1 26 TRP C C -10.885 1.501 1.824 1.00 . A A . 26 TRP C 1 1 1 389 1 1 26 TRP CA C -11.087 0.693 3.124 1.00 . A A . 26 TRP CA 1 1 1 390 1 1 26 TRP CB C -11.416 -0.801 2.887 1.00 . A A . 26 TRP CB 1 1 1 391 1 1 26 TRP CD1 C -13.285 -1.922 4.168 1.00 . A A . 26 TRP CD1 1 1 1 392 1 1 26 TRP CD2 C -14.027 -0.927 2.301 1.00 . A A . 26 TRP CD2 1 1 1 393 1 1 26 TRP CE2 C -15.161 -1.500 2.952 1.00 . A A . 26 TRP CE2 1 1 1 394 1 1 26 TRP CE3 C -14.280 -0.189 1.124 1.00 . A A . 26 TRP CE3 1 1 1 395 1 1 26 TRP CG C -12.832 -1.264 3.077 1.00 . A A . 26 TRP CG 1 1 1 396 1 1 26 TRP CH2 C -16.671 -0.701 1.247 1.00 . A A . 26 TRP CH2 1 1 1 397 1 1 26 TRP CZ2 C -16.460 -1.413 2.437 1.00 . A A . 26 TRP CZ2 1 1 1 398 1 1 26 TRP CZ3 C -15.585 -0.079 0.603 1.00 . A A . 26 TRP CZ3 1 1 1 399 1 1 26 TRP H H -12.846 1.807 3.433 1.00 . A A . 26 TRP H 1 1 1 400 1 1 26 TRP HA H -10.141 0.741 3.658 1.00 . A A . 26 TRP HA 1 1 1 401 1 1 26 TRP HB2 H -11.084 -1.142 1.910 1.00 . A A . 26 TRP HB2 1 1 1 402 1 1 26 TRP HB3 H -10.816 -1.342 3.615 1.00 . A A . 26 TRP HB3 1 1 1 403 1 1 26 TRP HD1 H -12.663 -2.267 4.987 1.00 . A A . 26 TRP HD1 1 1 1 404 1 1 26 TRP HE1 H -15.198 -2.557 4.796 1.00 . A A . 26 TRP HE1 1 1 1 405 1 1 26 TRP HE3 H -13.466 0.325 0.633 1.00 . A A . 26 TRP HE3 1 1 1 406 1 1 26 TRP HH2 H -17.672 -0.608 0.851 1.00 . A A . 26 TRP HH2 1 1 1 407 1 1 26 TRP HZ2 H -17.293 -1.852 2.968 1.00 . A A . 26 TRP HZ2 1 1 1 408 1 1 26 TRP HZ3 H -15.745 0.505 -0.291 1.00 . A A . 26 TRP HZ3 1 1 1 409 1 1 26 TRP N N -12.131 1.311 3.953 1.00 . A A . 26 TRP N 1 1 1 410 1 1 26 TRP NE1 N -14.650 -2.076 4.089 1.00 . A A . 26 TRP NE1 1 1 1 411 1 1 26 TRP O O -11.278 2.660 1.789 1.00 . A A . 26 TRP O 1 1 1 412 1 1 27 CYS C C -10.769 0.239 -1.537 1.00 . A A . 27 CYS C 1 1 1 413 1 1 27 CYS CA C -10.401 1.409 -0.612 1.00 . A A . 27 CYS CA 1 1 1 414 1 1 27 CYS CB C -9.113 2.109 -1.072 1.00 . A A . 27 CYS CB 1 1 1 415 1 1 27 CYS H H -9.989 -0.036 0.866 1.00 . A A . 27 CYS H 1 1 1 416 1 1 27 CYS HA H -11.207 2.142 -0.669 1.00 . A A . 27 CYS HA 1 1 1 417 1 1 27 CYS HB2 H -8.264 1.439 -0.940 1.00 . A A . 27 CYS HB2 1 1 1 418 1 1 27 CYS HB3 H -9.219 2.308 -2.139 1.00 . A A . 27 CYS HB3 1 1 1 419 1 1 27 CYS N N -10.301 0.917 0.769 1.00 . A A . 27 CYS N 1 1 1 420 1 1 27 CYS O O -10.100 -0.797 -1.511 1.00 . A A . 27 CYS O 1 1 1 421 1 1 27 CYS SG S -8.766 3.692 -0.265 1.00 . A A . 27 CYS SG 1 1 1 422 1 1 28 LYS C C -13.257 0.011 -4.285 1.00 . A A . 28 LYS C 1 1 1 423 1 1 28 LYS CA C -12.545 -0.657 -3.099 1.00 . A A . 28 LYS CA 1 1 1 424 1 1 28 LYS CB C -13.583 -1.415 -2.238 1.00 . A A . 28 LYS CB 1 1 1 425 1 1 28 LYS CD C -12.369 -3.577 -1.544 1.00 . A A . 28 LYS CD 1 1 1 426 1 1 28 LYS CE C -13.371 -4.726 -1.726 1.00 . A A . 28 LYS CE 1 1 1 427 1 1 28 LYS CG C -13.033 -2.270 -1.080 1.00 . A A . 28 LYS CG 1 1 1 428 1 1 28 LYS H H -12.293 1.304 -2.294 1.00 . A A . 28 LYS H 1 1 1 429 1 1 28 LYS HA H -11.804 -1.353 -3.495 1.00 . A A . 28 LYS HA 1 1 1 430 1 1 28 LYS HB2 H -14.267 -0.678 -1.820 1.00 . A A . 28 LYS HB2 1 1 1 431 1 1 28 LYS HB3 H -14.173 -2.064 -2.882 1.00 . A A . 28 LYS HB3 1 1 1 432 1 1 28 LYS HD2 H -11.844 -3.409 -2.485 1.00 . A A . 28 LYS HD2 1 1 1 433 1 1 28 LYS HD3 H -11.618 -3.876 -0.816 1.00 . A A . 28 LYS HD3 1 1 1 434 1 1 28 LYS HE2 H -14.163 -4.415 -2.415 1.00 . A A . 28 LYS HE2 1 1 1 435 1 1 28 LYS HE3 H -12.841 -5.556 -2.198 1.00 . A A . 28 LYS HE3 1 1 1 436 1 1 28 LYS HG2 H -12.318 -1.692 -0.499 1.00 . A A . 28 LYS HG2 1 1 1 437 1 1 28 LYS HG3 H -13.856 -2.512 -0.408 1.00 . A A . 28 LYS HG3 1 1 1 438 1 1 28 LYS HZ1 H -13.222 -5.452 0.214 1.00 . A A . 28 LYS HZ1 1 1 1 439 1 1 28 LYS HZ2 H -14.488 -6.058 -0.592 1.00 . A A . 28 LYS HZ2 1 1 1 440 1 1 28 LYS HZ3 H -14.552 -4.516 -0.007 1.00 . A A . 28 LYS HZ3 1 1 1 441 1 1 28 LYS N N -11.867 0.380 -2.289 1.00 . A A . 28 LYS N 1 1 1 442 1 1 28 LYS NZ N -13.951 -5.203 -0.443 1.00 . A A . 28 LYS NZ 1 1 1 443 1 1 28 LYS O O -13.597 1.187 -4.200 1.00 . A A . 28 LYS O 1 1 1 444 1 1 29 LYS C C -15.667 0.118 -6.432 1.00 . A A . 29 LYS C 1 1 1 445 1 1 29 LYS CA C -14.145 -0.053 -6.579 1.00 . A A . 29 LYS CA 1 1 1 446 1 1 29 LYS CB C -13.794 -0.829 -7.861 1.00 . A A . 29 LYS CB 1 1 1 447 1 1 29 LYS CD C -13.811 -0.655 -10.418 1.00 . A A . 29 LYS CD 1 1 1 448 1 1 29 LYS CE C -15.171 -1.280 -10.719 1.00 . A A . 29 LYS CE 1 1 1 449 1 1 29 LYS CG C -13.894 0.096 -9.087 1.00 . A A . 29 LYS CG 1 1 1 450 1 1 29 LYS H H -13.260 -1.664 -5.437 1.00 . A A . 29 LYS H 1 1 1 451 1 1 29 LYS HA H -13.708 0.944 -6.673 1.00 . A A . 29 LYS HA 1 1 1 452 1 1 29 LYS HB2 H -12.770 -1.204 -7.799 1.00 . A A . 29 LYS HB2 1 1 1 453 1 1 29 LYS HB3 H -14.465 -1.683 -7.966 1.00 . A A . 29 LYS HB3 1 1 1 454 1 1 29 LYS HD2 H -13.561 0.052 -11.209 1.00 . A A . 29 LYS HD2 1 1 1 455 1 1 29 LYS HD3 H -13.033 -1.416 -10.379 1.00 . A A . 29 LYS HD3 1 1 1 456 1 1 29 LYS HE2 H -15.436 -1.991 -9.931 1.00 . A A . 29 LYS HE2 1 1 1 457 1 1 29 LYS HE3 H -15.919 -0.484 -10.728 1.00 . A A . 29 LYS HE3 1 1 1 458 1 1 29 LYS HG2 H -14.827 0.660 -9.066 1.00 . A A . 29 LYS HG2 1 1 1 459 1 1 29 LYS HG3 H -13.078 0.813 -9.046 1.00 . A A . 29 LYS HG3 1 1 1 460 1 1 29 LYS HZ1 H -14.856 -1.347 -12.773 1.00 . A A . 29 LYS HZ1 1 1 1 461 1 1 29 LYS HZ2 H -16.112 -2.274 -12.264 1.00 . A A . 29 LYS HZ2 1 1 1 462 1 1 29 LYS HZ3 H -14.575 -2.780 -12.016 1.00 . A A . 29 LYS HZ3 1 1 1 463 1 1 29 LYS N N -13.522 -0.688 -5.397 1.00 . A A . 29 LYS N 1 1 1 464 1 1 29 LYS NZ N -15.175 -1.959 -12.025 1.00 . A A . 29 LYS NZ 1 1 1 465 1 1 29 LYS O O -16.364 -0.852 -6.130 1.00 . A A . 29 LYS O 1 1 1 466 1 1 30 LYS C C -17.709 2.635 -8.174 1.00 . A A . 30 LYS C 1 1 1 467 1 1 30 LYS CA C -17.615 1.593 -7.053 1.00 . A A . 30 LYS CA 1 1 1 468 1 1 30 LYS CB C -18.254 2.099 -5.744 1.00 . A A . 30 LYS CB 1 1 1 469 1 1 30 LYS CD C -20.156 3.472 -4.742 1.00 . A A . 30 LYS CD 1 1 1 470 1 1 30 LYS CE C -19.945 2.984 -3.306 1.00 . A A . 30 LYS CE 1 1 1 471 1 1 30 LYS CG C -19.740 2.486 -5.849 1.00 . A A . 30 LYS CG 1 1 1 472 1 1 30 LYS H H -15.528 2.039 -6.982 1.00 . A A . 30 LYS H 1 1 1 473 1 1 30 LYS HA H -18.144 0.693 -7.376 1.00 . A A . 30 LYS HA 1 1 1 474 1 1 30 LYS HB2 H -18.141 1.341 -4.969 1.00 . A A . 30 LYS HB2 1 1 1 475 1 1 30 LYS HB3 H -17.704 2.981 -5.432 1.00 . A A . 30 LYS HB3 1 1 1 476 1 1 30 LYS HD2 H -19.575 4.385 -4.857 1.00 . A A . 30 LYS HD2 1 1 1 477 1 1 30 LYS HD3 H -21.205 3.736 -4.884 1.00 . A A . 30 LYS HD3 1 1 1 478 1 1 30 LYS HE2 H -18.896 2.719 -3.155 1.00 . A A . 30 LYS HE2 1 1 1 479 1 1 30 LYS HE3 H -20.179 3.810 -2.628 1.00 . A A . 30 LYS HE3 1 1 1 480 1 1 30 LYS HG2 H -19.927 2.981 -6.801 1.00 . A A . 30 LYS HG2 1 1 1 481 1 1 30 LYS HG3 H -20.358 1.589 -5.809 1.00 . A A . 30 LYS HG3 1 1 1 482 1 1 30 LYS HZ1 H -20.535 0.992 -3.477 1.00 . A A . 30 LYS HZ1 1 1 1 483 1 1 30 LYS HZ2 H -21.774 2.037 -3.230 1.00 . A A . 30 LYS HZ2 1 1 1 484 1 1 30 LYS HZ3 H -20.772 1.650 -1.981 1.00 . A A . 30 LYS HZ3 1 1 1 485 1 1 30 LYS N N -16.186 1.294 -6.808 1.00 . A A . 30 LYS N 1 1 1 486 1 1 30 LYS NZ N -20.813 1.836 -2.977 1.00 . A A . 30 LYS NZ 1 1 1 487 1 1 30 LYS O O -17.454 3.818 -7.919 1.00 . A A . 30 LYS O 1 1 1 488 1 1 31 LEU C C -18.637 2.515 -11.800 1.00 . A A . 31 LEU C 1 1 1 489 1 1 31 LEU CA C -17.775 3.018 -10.626 1.00 . A A . 31 LEU CA 1 1 1 490 1 1 31 LEU CB C -16.268 3.090 -10.973 1.00 . A A . 31 LEU CB 1 1 1 491 1 1 31 LEU CD1 C -14.630 4.594 -12.186 1.00 . A A . 31 LEU CD1 1 1 1 492 1 1 31 LEU CD2 C -15.686 2.764 -13.431 1.00 . A A . 31 LEU CD2 1 1 1 493 1 1 31 LEU CG C -15.916 3.781 -12.310 1.00 . A A . 31 LEU CG 1 1 1 494 1 1 31 LEU H H -18.119 1.208 -9.541 1.00 . A A . 31 LEU H 1 1 1 495 1 1 31 LEU HA H -18.118 4.024 -10.397 1.00 . A A . 31 LEU HA 1 1 1 496 1 1 31 LEU HB2 H -15.773 3.628 -10.163 1.00 . A A . 31 LEU HB2 1 1 1 497 1 1 31 LEU HB3 H -15.853 2.081 -10.983 1.00 . A A . 31 LEU HB3 1 1 1 498 1 1 31 LEU HD11 H -13.795 3.944 -11.926 1.00 . A A . 31 LEU HD11 1 1 1 499 1 1 31 LEU HD12 H -14.743 5.359 -11.419 1.00 . A A . 31 LEU HD12 1 1 1 500 1 1 31 LEU HD13 H -14.414 5.081 -13.136 1.00 . A A . 31 LEU HD13 1 1 1 501 1 1 31 LEU HD21 H -14.806 2.157 -13.215 1.00 . A A . 31 LEU HD21 1 1 1 502 1 1 31 LEU HD22 H -15.520 3.284 -14.375 1.00 . A A . 31 LEU HD22 1 1 1 503 1 1 31 LEU HD23 H -16.541 2.101 -13.532 1.00 . A A . 31 LEU HD23 1 1 1 504 1 1 31 LEU HG H -16.713 4.467 -12.595 1.00 . A A . 31 LEU HG 1 1 1 505 1 1 31 LEU N N -17.920 2.195 -9.414 1.00 . A A . 31 LEU N 1 1 1 506 1 1 31 LEU O O -18.711 1.316 -12.048 1.00 . A A . 31 LEU O 1 1 1 507 1 1 32 LEU C C -18.730 3.080 -14.962 1.00 . A A . 32 LEU C 1 1 1 508 1 1 32 LEU CA C -19.810 3.089 -13.885 1.00 . A A . 32 LEU CA 1 1 1 509 1 1 32 LEU CB C -20.897 4.153 -14.193 1.00 . A A . 32 LEU CB 1 1 1 510 1 1 32 LEU CD1 C -20.195 5.757 -16.072 1.00 . A A . 32 LEU CD1 1 1 1 511 1 1 32 LEU CD2 C -21.220 6.650 -14.012 1.00 . A A . 32 LEU CD2 1 1 1 512 1 1 32 LEU CG C -20.305 5.543 -14.552 1.00 . A A . 32 LEU CG 1 1 1 513 1 1 32 LEU H H -19.109 4.411 -12.332 1.00 . A A . 32 LEU H 1 1 1 514 1 1 32 LEU HA H -20.277 2.112 -13.842 1.00 . A A . 32 LEU HA 1 1 1 515 1 1 32 LEU HB2 H -21.519 3.797 -15.016 1.00 . A A . 32 LEU HB2 1 1 1 516 1 1 32 LEU HB3 H -21.536 4.230 -13.312 1.00 . A A . 32 LEU HB3 1 1 1 517 1 1 32 LEU HD11 H -21.182 5.708 -16.535 1.00 . A A . 32 LEU HD11 1 1 1 518 1 1 32 LEU HD12 H -19.558 5.008 -16.537 1.00 . A A . 32 LEU HD12 1 1 1 519 1 1 32 LEU HD13 H -19.762 6.738 -16.277 1.00 . A A . 32 LEU HD13 1 1 1 520 1 1 32 LEU HD21 H -22.215 6.565 -14.451 1.00 . A A . 32 LEU HD21 1 1 1 521 1 1 32 LEU HD22 H -20.798 7.624 -14.262 1.00 . A A . 32 LEU HD22 1 1 1 522 1 1 32 LEU HD23 H -21.301 6.571 -12.928 1.00 . A A . 32 LEU HD23 1 1 1 523 1 1 32 LEU HG H -19.321 5.676 -14.100 1.00 . A A . 32 LEU HG 1 1 1 524 1 1 32 LEU N N -19.196 3.429 -12.591 1.00 . A A . 32 LEU N 1 1 1 525 1 1 32 LEU O O -18.607 2.168 -15.742 1.00 . A A . 32 LEU O 1 1 1 526 1 1 32 LEU OXT O -18.059 3.901 -15.007 1.00 . A A . 32 LEU OXT 1 1 2 527 1 1 1 GLY C C 2.790 -3.070 -2.343 1.00 . A A . 1 GLY C 1 1 2 528 1 1 1 GLY CA C 3.847 -2.420 -3.218 1.00 . A A . 1 GLY CA 1 1 2 529 1 1 1 GLY H1 H 4.898 -2.861 -4.928 1.00 . A A . 1 GLY H1 1 1 2 530 1 1 1 GLY H2 H 4.278 -4.186 -4.174 1.00 . A A . 1 GLY H2 1 1 2 531 1 1 1 GLY H3 H 3.290 -3.191 -5.032 1.00 . A A . 1 GLY H3 1 1 2 532 1 1 1 GLY HA2 H 4.766 -2.348 -2.642 1.00 . A A . 1 GLY HA2 1 1 2 533 1 1 1 GLY HA3 H 3.513 -1.424 -3.503 1.00 . A A . 1 GLY HA3 1 1 2 534 1 1 1 GLY N N 4.100 -3.221 -4.423 1.00 . A A . 1 GLY N 1 1 2 535 1 1 1 GLY O O 2.295 -4.145 -2.687 1.00 . A A . 1 GLY O 1 1 2 536 1 1 2 PRO C C 0.082 -3.032 -0.688 1.00 . A A . 2 PRO C 1 1 2 537 1 1 2 PRO CA C 1.540 -3.046 -0.214 1.00 . A A . 2 PRO CA 1 1 2 538 1 1 2 PRO CB C 1.734 -2.197 1.043 1.00 . A A . 2 PRO CB 1 1 2 539 1 1 2 PRO CD C 2.948 -1.177 -0.720 1.00 . A A . 2 PRO CD 1 1 2 540 1 1 2 PRO CG C 2.090 -0.817 0.491 1.00 . A A . 2 PRO CG 1 1 2 541 1 1 2 PRO HA H 1.836 -4.075 -0.001 1.00 . A A . 2 PRO HA 1 1 2 542 1 1 2 PRO HB2 H 0.844 -2.169 1.672 1.00 . A A . 2 PRO HB2 1 1 2 543 1 1 2 PRO HB3 H 2.589 -2.589 1.592 1.00 . A A . 2 PRO HB3 1 1 2 544 1 1 2 PRO HD2 H 2.868 -0.401 -1.484 1.00 . A A . 2 PRO HD2 1 1 2 545 1 1 2 PRO HD3 H 3.982 -1.292 -0.398 1.00 . A A . 2 PRO HD3 1 1 2 546 1 1 2 PRO HG2 H 1.188 -0.295 0.169 1.00 . A A . 2 PRO HG2 1 1 2 547 1 1 2 PRO HG3 H 2.643 -0.217 1.214 1.00 . A A . 2 PRO HG3 1 1 2 548 1 1 2 PRO N N 2.448 -2.461 -1.196 1.00 . A A . 2 PRO N 1 1 2 549 1 1 2 PRO O O -0.421 -2.007 -1.151 1.00 . A A . 2 PRO O 1 1 2 550 1 1 3 TYR C C -2.998 -3.299 -0.015 1.00 . A A . 3 TYR C 1 1 2 551 1 1 3 TYR CA C -2.058 -4.221 -0.807 1.00 . A A . 3 TYR CA 1 1 2 552 1 1 3 TYR CB C -2.558 -5.670 -0.860 1.00 . A A . 3 TYR CB 1 1 2 553 1 1 3 TYR CD1 C -1.306 -7.626 -1.875 1.00 . A A . 3 TYR CD1 1 1 2 554 1 1 3 TYR CD2 C -2.528 -6.127 -3.357 1.00 . A A . 3 TYR CD2 1 1 2 555 1 1 3 TYR CE1 C -0.949 -8.426 -2.978 1.00 . A A . 3 TYR CE1 1 1 2 556 1 1 3 TYR CE2 C -2.168 -6.921 -4.460 1.00 . A A . 3 TYR CE2 1 1 2 557 1 1 3 TYR CG C -2.108 -6.483 -2.060 1.00 . A A . 3 TYR CG 1 1 2 558 1 1 3 TYR CZ C -1.386 -8.083 -4.275 1.00 . A A . 3 TYR CZ 1 1 2 559 1 1 3 TYR H H -0.188 -4.960 -0.094 1.00 . A A . 3 TYR H 1 1 2 560 1 1 3 TYR HA H -2.122 -3.860 -1.835 1.00 . A A . 3 TYR HA 1 1 2 561 1 1 3 TYR HB2 H -2.283 -6.178 0.066 1.00 . A A . 3 TYR HB2 1 1 2 562 1 1 3 TYR HB3 H -3.646 -5.646 -0.901 1.00 . A A . 3 TYR HB3 1 1 2 563 1 1 3 TYR HD1 H -0.963 -7.897 -0.885 1.00 . A A . 3 TYR HD1 1 1 2 564 1 1 3 TYR HD2 H -3.123 -5.241 -3.514 1.00 . A A . 3 TYR HD2 1 1 2 565 1 1 3 TYR HE1 H -0.340 -9.304 -2.831 1.00 . A A . 3 TYR HE1 1 1 2 566 1 1 3 TYR HE2 H -2.487 -6.636 -5.449 1.00 . A A . 3 TYR HE2 1 1 2 567 1 1 3 TYR HH H -1.454 -8.527 -6.165 1.00 . A A . 3 TYR HH 1 1 2 568 1 1 3 TYR N N -0.638 -4.136 -0.480 1.00 . A A . 3 TYR N 1 1 2 569 1 1 3 TYR O O -2.908 -3.213 1.214 1.00 . A A . 3 TYR O 1 1 2 570 1 1 3 TYR OH O -1.080 -8.885 -5.332 1.00 . A A . 3 TYR OH 1 1 2 571 1 1 4 CYS C C -6.209 -1.487 -0.838 1.00 . A A . 4 CYS C 1 1 2 572 1 1 4 CYS CA C -4.846 -1.666 -0.131 1.00 . A A . 4 CYS CA 1 1 2 573 1 1 4 CYS CB C -4.085 -0.336 -0.028 1.00 . A A . 4 CYS CB 1 1 2 574 1 1 4 CYS H H -3.854 -2.693 -1.720 1.00 . A A . 4 CYS H 1 1 2 575 1 1 4 CYS HA H -5.092 -2.002 0.876 1.00 . A A . 4 CYS HA 1 1 2 576 1 1 4 CYS HB2 H -4.812 0.464 0.065 1.00 . A A . 4 CYS HB2 1 1 2 577 1 1 4 CYS HB3 H -3.522 -0.365 0.902 1.00 . A A . 4 CYS HB3 1 1 2 578 1 1 4 CYS N N -3.937 -2.657 -0.719 1.00 . A A . 4 CYS N 1 1 2 579 1 1 4 CYS O O -7.180 -1.045 -0.223 1.00 . A A . 4 CYS O 1 1 2 580 1 1 4 CYS SG S -2.906 0.140 -1.328 1.00 . A A . 4 CYS SG 1 1 2 581 1 1 5 GLN C C -7.978 -3.545 -2.785 1.00 . A A . 5 GLN C 1 1 2 582 1 1 5 GLN CA C -7.557 -2.068 -2.849 1.00 . A A . 5 GLN CA 1 1 2 583 1 1 5 GLN CB C -7.382 -1.481 -4.268 1.00 . A A . 5 GLN CB 1 1 2 584 1 1 5 GLN CD C -7.586 -3.242 -6.109 1.00 . A A . 5 GLN CD 1 1 2 585 1 1 5 GLN CG C -8.244 -2.062 -5.398 1.00 . A A . 5 GLN CG 1 1 2 586 1 1 5 GLN H H -5.443 -2.027 -2.615 1.00 . A A . 5 GLN H 1 1 2 587 1 1 5 GLN HA H -8.353 -1.508 -2.360 1.00 . A A . 5 GLN HA 1 1 2 588 1 1 5 GLN HB2 H -7.624 -0.421 -4.197 1.00 . A A . 5 GLN HB2 1 1 2 589 1 1 5 GLN HB3 H -6.335 -1.550 -4.568 1.00 . A A . 5 GLN HB3 1 1 2 590 1 1 5 GLN HE21 H -6.099 -2.098 -6.915 1.00 . A A . 5 GLN HE21 1 1 2 591 1 1 5 GLN HE22 H -6.035 -3.847 -7.188 1.00 . A A . 5 GLN HE22 1 1 2 592 1 1 5 GLN HG2 H -9.223 -2.350 -5.017 1.00 . A A . 5 GLN HG2 1 1 2 593 1 1 5 GLN HG3 H -8.402 -1.280 -6.142 1.00 . A A . 5 GLN HG3 1 1 2 594 1 1 5 GLN N N -6.303 -1.862 -2.116 1.00 . A A . 5 GLN N 1 1 2 595 1 1 5 GLN NE2 N -6.521 -3.035 -6.854 1.00 . A A . 5 GLN NE2 1 1 2 596 1 1 5 GLN O O -9.143 -3.872 -2.568 1.00 . A A . 5 GLN O 1 1 2 597 1 1 5 GLN OE1 O -7.854 -4.395 -5.809 1.00 . A A . 5 GLN OE1 1 1 2 598 1 1 6 LYS C C -7.311 -6.347 -1.157 1.00 . A A . 6 LYS C 1 1 2 599 1 1 6 LYS CA C -7.185 -5.896 -2.630 1.00 . A A . 6 LYS CA 1 1 2 600 1 1 6 LYS CB C -6.024 -6.597 -3.361 1.00 . A A . 6 LYS CB 1 1 2 601 1 1 6 LYS CD C -5.300 -8.624 -4.709 1.00 . A A . 6 LYS CD 1 1 2 602 1 1 6 LYS CE C -5.801 -9.938 -5.310 1.00 . A A . 6 LYS CE 1 1 2 603 1 1 6 LYS CG C -6.400 -8.003 -3.838 1.00 . A A . 6 LYS CG 1 1 2 604 1 1 6 LYS H H -6.064 -4.120 -2.986 1.00 . A A . 6 LYS H 1 1 2 605 1 1 6 LYS HA H -8.117 -6.158 -3.132 1.00 . A A . 6 LYS HA 1 1 2 606 1 1 6 LYS HB2 H -5.753 -6.012 -4.243 1.00 . A A . 6 LYS HB2 1 1 2 607 1 1 6 LYS HB3 H -5.158 -6.655 -2.701 1.00 . A A . 6 LYS HB3 1 1 2 608 1 1 6 LYS HD2 H -5.050 -7.943 -5.523 1.00 . A A . 6 LYS HD2 1 1 2 609 1 1 6 LYS HD3 H -4.401 -8.797 -4.117 1.00 . A A . 6 LYS HD3 1 1 2 610 1 1 6 LYS HE2 H -6.738 -9.741 -5.839 1.00 . A A . 6 LYS HE2 1 1 2 611 1 1 6 LYS HE3 H -5.074 -10.303 -6.041 1.00 . A A . 6 LYS HE3 1 1 2 612 1 1 6 LYS HG2 H -6.584 -8.646 -2.981 1.00 . A A . 6 LYS HG2 1 1 2 613 1 1 6 LYS HG3 H -7.315 -7.940 -4.427 1.00 . A A . 6 LYS HG3 1 1 2 614 1 1 6 LYS HZ1 H -5.152 -11.416 -3.990 1.00 . A A . 6 LYS HZ1 1 1 2 615 1 1 6 LYS HZ2 H -6.624 -11.709 -4.639 1.00 . A A . 6 LYS HZ2 1 1 2 616 1 1 6 LYS HZ3 H -6.494 -10.614 -3.458 1.00 . A A . 6 LYS HZ3 1 1 2 617 1 1 6 LYS N N -6.993 -4.450 -2.789 1.00 . A A . 6 LYS N 1 1 2 618 1 1 6 LYS NZ N -6.025 -10.972 -4.274 1.00 . A A . 6 LYS NZ 1 1 2 619 1 1 6 LYS O O -7.492 -7.539 -0.905 1.00 . A A . 6 LYS O 1 1 2 620 1 1 7 TRP C C -7.414 -4.531 2.096 1.00 . A A . 7 TRP C 1 1 2 621 1 1 7 TRP CA C -6.924 -5.708 1.237 1.00 . A A . 7 TRP CA 1 1 2 622 1 1 7 TRP CB C -5.412 -5.901 1.410 1.00 . A A . 7 TRP CB 1 1 2 623 1 1 7 TRP CD1 C -4.616 -5.620 3.813 1.00 . A A . 7 TRP CD1 1 1 2 624 1 1 7 TRP CD2 C -4.781 -7.768 3.190 1.00 . A A . 7 TRP CD2 1 1 2 625 1 1 7 TRP CE2 C -4.253 -7.760 4.515 1.00 . A A . 7 TRP CE2 1 1 2 626 1 1 7 TRP CE3 C -5.010 -9.029 2.595 1.00 . A A . 7 TRP CE3 1 1 2 627 1 1 7 TRP CG C -4.904 -6.386 2.733 1.00 . A A . 7 TRP CG 1 1 2 628 1 1 7 TRP CH2 C -4.148 -10.180 4.571 1.00 . A A . 7 TRP CH2 1 1 2 629 1 1 7 TRP CZ2 C -3.918 -8.941 5.190 1.00 . A A . 7 TRP CZ2 1 1 2 630 1 1 7 TRP CZ3 C -4.700 -10.221 3.279 1.00 . A A . 7 TRP CZ3 1 1 2 631 1 1 7 TRP H H -7.173 -4.463 -0.461 1.00 . A A . 7 TRP H 1 1 2 632 1 1 7 TRP HA H -7.439 -6.612 1.552 1.00 . A A . 7 TRP HA 1 1 2 633 1 1 7 TRP HB2 H -5.081 -6.632 0.672 1.00 . A A . 7 TRP HB2 1 1 2 634 1 1 7 TRP HB3 H -4.918 -4.960 1.176 1.00 . A A . 7 TRP HB3 1 1 2 635 1 1 7 TRP HD1 H -4.662 -4.538 3.838 1.00 . A A . 7 TRP HD1 1 1 2 636 1 1 7 TRP HE1 H -3.917 -6.063 5.766 1.00 . A A . 7 TRP HE1 1 1 2 637 1 1 7 TRP HE3 H -5.403 -9.075 1.590 1.00 . A A . 7 TRP HE3 1 1 2 638 1 1 7 TRP HH2 H -3.901 -11.101 5.084 1.00 . A A . 7 TRP HH2 1 1 2 639 1 1 7 TRP HZ2 H -3.478 -8.893 6.172 1.00 . A A . 7 TRP HZ2 1 1 2 640 1 1 7 TRP HZ3 H -4.864 -11.177 2.804 1.00 . A A . 7 TRP HZ3 1 1 2 641 1 1 7 TRP N N -7.171 -5.434 -0.190 1.00 . A A . 7 TRP N 1 1 2 642 1 1 7 TRP NE1 N -4.203 -6.424 4.859 1.00 . A A . 7 TRP NE1 1 1 2 643 1 1 7 TRP O O -7.348 -3.386 1.651 1.00 . A A . 7 TRP O 1 1 2 644 1 1 8 MET C C -7.291 -2.778 4.771 1.00 . A A . 8 MET C 1 1 2 645 1 1 8 MET CA C -8.385 -3.716 4.221 1.00 . A A . 8 MET CA 1 1 2 646 1 1 8 MET CB C -9.199 -4.333 5.368 1.00 . A A . 8 MET CB 1 1 2 647 1 1 8 MET CE C -12.766 -4.381 6.278 1.00 . A A . 8 MET CE 1 1 2 648 1 1 8 MET CG C -10.460 -5.046 4.879 1.00 . A A . 8 MET CG 1 1 2 649 1 1 8 MET H H -7.873 -5.727 3.670 1.00 . A A . 8 MET H 1 1 2 650 1 1 8 MET HA H -9.070 -3.096 3.642 1.00 . A A . 8 MET HA 1 1 2 651 1 1 8 MET HB2 H -8.580 -5.040 5.922 1.00 . A A . 8 MET HB2 1 1 2 652 1 1 8 MET HB3 H -9.505 -3.536 6.048 1.00 . A A . 8 MET HB3 1 1 2 653 1 1 8 MET HE1 H -13.340 -4.417 5.352 1.00 . A A . 8 MET HE1 1 1 2 654 1 1 8 MET HE2 H -13.436 -4.560 7.119 1.00 . A A . 8 MET HE2 1 1 2 655 1 1 8 MET HE3 H -12.309 -3.398 6.384 1.00 . A A . 8 MET HE3 1 1 2 656 1 1 8 MET HG2 H -11.052 -4.364 4.266 1.00 . A A . 8 MET HG2 1 1 2 657 1 1 8 MET HG3 H -10.175 -5.893 4.258 1.00 . A A . 8 MET HG3 1 1 2 658 1 1 8 MET N N -7.865 -4.772 3.333 1.00 . A A . 8 MET N 1 1 2 659 1 1 8 MET O O -6.786 -2.969 5.879 1.00 . A A . 8 MET O 1 1 2 660 1 1 8 MET SD S -11.476 -5.653 6.247 1.00 . A A . 8 MET SD 1 1 2 661 1 1 9 GLN C C -6.342 0.212 5.579 1.00 . A A . 9 GLN C 1 1 2 662 1 1 9 GLN CA C -5.964 -0.710 4.403 1.00 . A A . 9 GLN CA 1 1 2 663 1 1 9 GLN CB C -5.578 0.131 3.170 1.00 . A A . 9 GLN CB 1 1 2 664 1 1 9 GLN CD C -6.088 2.104 1.600 1.00 . A A . 9 GLN CD 1 1 2 665 1 1 9 GLN CG C -6.635 1.126 2.647 1.00 . A A . 9 GLN CG 1 1 2 666 1 1 9 GLN H H -7.352 -1.684 3.086 1.00 . A A . 9 GLN H 1 1 2 667 1 1 9 GLN HA H -5.073 -1.254 4.719 1.00 . A A . 9 GLN HA 1 1 2 668 1 1 9 GLN HB2 H -4.676 0.686 3.432 1.00 . A A . 9 GLN HB2 1 1 2 669 1 1 9 GLN HB3 H -5.319 -0.549 2.370 1.00 . A A . 9 GLN HB3 1 1 2 670 1 1 9 GLN HE21 H -4.500 2.635 2.744 1.00 . A A . 9 GLN HE21 1 1 2 671 1 1 9 GLN HE22 H -4.607 3.408 1.177 1.00 . A A . 9 GLN HE22 1 1 2 672 1 1 9 GLN HG2 H -7.470 0.574 2.218 1.00 . A A . 9 GLN HG2 1 1 2 673 1 1 9 GLN HG3 H -7.008 1.721 3.476 1.00 . A A . 9 GLN HG3 1 1 2 674 1 1 9 GLN N N -6.979 -1.711 4.028 1.00 . A A . 9 GLN N 1 1 2 675 1 1 9 GLN NE2 N -4.988 2.775 1.876 1.00 . A A . 9 GLN NE2 1 1 2 676 1 1 9 GLN O O -5.562 1.100 5.909 1.00 . A A . 9 GLN O 1 1 2 677 1 1 9 GLN OE1 O -6.545 2.170 0.467 1.00 . A A . 9 GLN OE1 1 1 2 678 1 1 10 THR C C -8.070 2.522 6.468 1.00 . A A . 10 THR C 1 1 2 679 1 1 10 THR CA C -8.174 1.104 7.027 1.00 . A A . 10 THR CA 1 1 2 680 1 1 10 THR CB C -7.690 0.992 8.474 1.00 . A A . 10 THR CB 1 1 2 681 1 1 10 THR CG2 C -8.727 1.624 9.405 1.00 . A A . 10 THR CG2 1 1 2 682 1 1 10 THR H H -8.153 -0.643 5.808 1.00 . A A . 10 THR H 1 1 2 683 1 1 10 THR HA H -9.234 0.873 7.080 1.00 . A A . 10 THR HA 1 1 2 684 1 1 10 THR HB H -6.724 1.479 8.589 1.00 . A A . 10 THR HB 1 1 2 685 1 1 10 THR HG1 H -6.601 -0.544 8.780 1.00 . A A . 10 THR HG1 1 1 2 686 1 1 10 THR HG21 H -8.389 1.570 10.438 1.00 . A A . 10 THR HG21 1 1 2 687 1 1 10 THR HG22 H -9.685 1.112 9.323 1.00 . A A . 10 THR HG22 1 1 2 688 1 1 10 THR HG23 H -8.870 2.676 9.155 1.00 . A A . 10 THR HG23 1 1 2 689 1 1 10 THR N N -7.565 0.118 6.112 1.00 . A A . 10 THR N 1 1 2 690 1 1 10 THR O O -7.301 3.366 6.940 1.00 . A A . 10 THR O 1 1 2 691 1 1 10 THR OG1 O -7.565 -0.365 8.830 1.00 . A A . 10 THR OG1 1 1 2 692 1 1 11 CYS C C -9.579 5.091 5.437 1.00 . A A . 11 CYS C 1 1 2 693 1 1 11 CYS CA C -8.838 4.003 4.636 1.00 . A A . 11 CYS CA 1 1 2 694 1 1 11 CYS CB C -9.397 3.767 3.223 1.00 . A A . 11 CYS CB 1 1 2 695 1 1 11 CYS H H -9.349 1.969 5.030 1.00 . A A . 11 CYS H 1 1 2 696 1 1 11 CYS HA H -7.809 4.344 4.512 1.00 . A A . 11 CYS HA 1 1 2 697 1 1 11 CYS HB2 H -9.095 2.779 2.879 1.00 . A A . 11 CYS HB2 1 1 2 698 1 1 11 CYS HB3 H -10.487 3.804 3.234 1.00 . A A . 11 CYS HB3 1 1 2 699 1 1 11 CYS N N -8.790 2.741 5.366 1.00 . A A . 11 CYS N 1 1 2 700 1 1 11 CYS O O -10.773 5.337 5.258 1.00 . A A . 11 CYS O 1 1 2 701 1 1 11 CYS SG S -8.765 4.958 2.020 1.00 . A A . 11 CYS SG 1 1 2 702 1 1 12 ASP C C -8.870 8.180 5.924 1.00 . A A . 12 ASP C 1 1 2 703 1 1 12 ASP CA C -9.121 7.033 6.915 1.00 . A A . 12 ASP CA 1 1 2 704 1 1 12 ASP CB C -8.323 7.220 8.212 1.00 . A A . 12 ASP CB 1 1 2 705 1 1 12 ASP CG C -8.959 6.461 9.373 1.00 . A A . 12 ASP CG 1 1 2 706 1 1 12 ASP H H -7.942 5.315 6.565 1.00 . A A . 12 ASP H 1 1 2 707 1 1 12 ASP HA H -10.179 7.078 7.180 1.00 . A A . 12 ASP HA 1 1 2 708 1 1 12 ASP HB2 H -7.290 6.898 8.064 1.00 . A A . 12 ASP HB2 1 1 2 709 1 1 12 ASP HB3 H -8.310 8.280 8.465 1.00 . A A . 12 ASP HB3 1 1 2 710 1 1 12 ASP N N -8.852 5.707 6.365 1.00 . A A . 12 ASP N 1 1 2 711 1 1 12 ASP O O -7.915 8.120 5.153 1.00 . A A . 12 ASP O 1 1 2 712 1 1 12 ASP OD1 O -8.405 5.427 9.810 1.00 . A A . 12 ASP OD1 1 1 2 713 1 1 12 ASP OD2 O -10.024 6.927 9.835 1.00 . A A . 12 ASP OD2 1 1 2 714 1 1 13 SER C C -8.404 11.301 5.039 1.00 . A A . 13 SER C 1 1 2 715 1 1 13 SER CA C -9.633 10.357 4.977 1.00 . A A . 13 SER CA 1 1 2 716 1 1 13 SER CB C -10.966 11.113 5.022 1.00 . A A . 13 SER CB 1 1 2 717 1 1 13 SER H H -10.392 9.278 6.669 1.00 . A A . 13 SER H 1 1 2 718 1 1 13 SER HA H -9.584 9.881 3.996 1.00 . A A . 13 SER HA 1 1 2 719 1 1 13 SER HB2 H -11.777 10.395 4.932 1.00 . A A . 13 SER HB2 1 1 2 720 1 1 13 SER HB3 H -11.068 11.629 5.976 1.00 . A A . 13 SER HB3 1 1 2 721 1 1 13 SER HG H -10.273 12.612 4.024 1.00 . A A . 13 SER HG 1 1 2 722 1 1 13 SER N N -9.657 9.261 5.974 1.00 . A A . 13 SER N 1 1 2 723 1 1 13 SER O O -8.411 12.406 4.491 1.00 . A A . 13 SER O 1 1 2 724 1 1 13 SER OG O -11.060 12.044 3.962 1.00 . A A . 13 SER OG 1 1 2 725 1 1 14 GLU C C -5.008 10.591 4.712 1.00 . A A . 14 GLU C 1 1 2 726 1 1 14 GLU CA C -5.964 11.446 5.573 1.00 . A A . 14 GLU CA 1 1 2 727 1 1 14 GLU CB C -5.394 11.656 6.988 1.00 . A A . 14 GLU CB 1 1 2 728 1 1 14 GLU CD C -4.644 10.579 9.184 1.00 . A A . 14 GLU CD 1 1 2 729 1 1 14 GLU CG C -5.268 10.355 7.801 1.00 . A A . 14 GLU CG 1 1 2 730 1 1 14 GLU H H -7.388 9.943 6.084 1.00 . A A . 14 GLU H 1 1 2 731 1 1 14 GLU HA H -6.019 12.421 5.091 1.00 . A A . 14 GLU HA 1 1 2 732 1 1 14 GLU HB2 H -4.414 12.121 6.897 1.00 . A A . 14 GLU HB2 1 1 2 733 1 1 14 GLU HB3 H -6.039 12.348 7.529 1.00 . A A . 14 GLU HB3 1 1 2 734 1 1 14 GLU HG2 H -6.256 9.905 7.919 1.00 . A A . 14 GLU HG2 1 1 2 735 1 1 14 GLU HG3 H -4.644 9.647 7.253 1.00 . A A . 14 GLU HG3 1 1 2 736 1 1 14 GLU N N -7.315 10.863 5.670 1.00 . A A . 14 GLU N 1 1 2 737 1 1 14 GLU O O -3.858 10.974 4.486 1.00 . A A . 14 GLU O 1 1 2 738 1 1 14 GLU OE1 O -5.109 9.947 10.162 1.00 . A A . 14 GLU OE1 1 1 2 739 1 1 14 GLU OE2 O -3.662 11.344 9.316 1.00 . A A . 14 GLU OE2 1 1 2 740 1 1 15 ARG C C -4.580 8.356 2.196 1.00 . A A . 15 ARG C 1 1 2 741 1 1 15 ARG CA C -4.615 8.338 3.724 1.00 . A A . 15 ARG CA 1 1 2 742 1 1 15 ARG CB C -5.120 6.987 4.261 1.00 . A A . 15 ARG CB 1 1 2 743 1 1 15 ARG CD C -4.676 4.638 4.870 1.00 . A A . 15 ARG CD 1 1 2 744 1 1 15 ARG CG C -4.045 5.890 4.234 1.00 . A A . 15 ARG CG 1 1 2 745 1 1 15 ARG CZ C -3.463 3.385 6.611 1.00 . A A . 15 ARG CZ 1 1 2 746 1 1 15 ARG H H -6.427 9.163 4.463 1.00 . A A . 15 ARG H 1 1 2 747 1 1 15 ARG HA H -3.599 8.492 4.087 1.00 . A A . 15 ARG HA 1 1 2 748 1 1 15 ARG HB2 H -5.424 7.126 5.300 1.00 . A A . 15 ARG HB2 1 1 2 749 1 1 15 ARG HB3 H -5.995 6.667 3.688 1.00 . A A . 15 ARG HB3 1 1 2 750 1 1 15 ARG HD2 H -5.311 4.950 5.690 1.00 . A A . 15 ARG HD2 1 1 2 751 1 1 15 ARG HD3 H -5.225 4.089 4.119 1.00 . A A . 15 ARG HD3 1 1 2 752 1 1 15 ARG HE H -2.720 3.743 4.787 1.00 . A A . 15 ARG HE 1 1 2 753 1 1 15 ARG HG2 H -3.721 5.666 3.221 1.00 . A A . 15 ARG HG2 1 1 2 754 1 1 15 ARG HG3 H -3.184 6.225 4.810 1.00 . A A . 15 ARG HG3 1 1 2 755 1 1 15 ARG HH11 H -5.404 3.494 7.017 1.00 . A A . 15 ARG HH11 1 1 2 756 1 1 15 ARG HH12 H -4.371 3.069 8.350 1.00 . A A . 15 ARG HH12 1 1 2 757 1 1 15 ARG HH21 H -1.492 2.914 6.623 1.00 . A A . 15 ARG HH21 1 1 2 758 1 1 15 ARG HH22 H -2.395 2.586 8.085 1.00 . A A . 15 ARG HH22 1 1 2 759 1 1 15 ARG N N -5.454 9.400 4.287 1.00 . A A . 15 ARG N 1 1 2 760 1 1 15 ARG NE N -3.546 3.838 5.372 1.00 . A A . 15 ARG NE 1 1 2 761 1 1 15 ARG NH1 N -4.478 3.408 7.407 1.00 . A A . 15 ARG NH1 1 1 2 762 1 1 15 ARG NH2 N -2.375 2.901 7.130 1.00 . A A . 15 ARG NH2 1 1 2 763 1 1 15 ARG O O -5.575 8.651 1.528 1.00 . A A . 15 ARG O 1 1 2 764 1 1 16 LYS C C -4.230 6.115 0.078 1.00 . A A . 16 LYS C 1 1 2 765 1 1 16 LYS CA C -3.347 7.357 0.283 1.00 . A A . 16 LYS CA 1 1 2 766 1 1 16 LYS CB C -1.863 7.158 -0.089 1.00 . A A . 16 LYS CB 1 1 2 767 1 1 16 LYS CD C 0.487 6.325 0.552 1.00 . A A . 16 LYS CD 1 1 2 768 1 1 16 LYS CE C 1.123 7.723 0.453 1.00 . A A . 16 LYS CE 1 1 2 769 1 1 16 LYS CG C -1.013 6.325 0.897 1.00 . A A . 16 LYS CG 1 1 2 770 1 1 16 LYS H H -2.681 7.735 2.277 1.00 . A A . 16 LYS H 1 1 2 771 1 1 16 LYS HA H -3.729 8.124 -0.392 1.00 . A A . 16 LYS HA 1 1 2 772 1 1 16 LYS HB2 H -1.807 6.700 -1.079 1.00 . A A . 16 LYS HB2 1 1 2 773 1 1 16 LYS HB3 H -1.431 8.155 -0.165 1.00 . A A . 16 LYS HB3 1 1 2 774 1 1 16 LYS HD2 H 1.018 5.745 1.309 1.00 . A A . 16 LYS HD2 1 1 2 775 1 1 16 LYS HD3 H 0.623 5.818 -0.405 1.00 . A A . 16 LYS HD3 1 1 2 776 1 1 16 LYS HE2 H 2.181 7.609 0.202 1.00 . A A . 16 LYS HE2 1 1 2 777 1 1 16 LYS HE3 H 0.650 8.267 -0.368 1.00 . A A . 16 LYS HE3 1 1 2 778 1 1 16 LYS HG2 H -1.130 6.709 1.910 1.00 . A A . 16 LYS HG2 1 1 2 779 1 1 16 LYS HG3 H -1.361 5.292 0.891 1.00 . A A . 16 LYS HG3 1 1 2 780 1 1 16 LYS HZ1 H 0.033 8.568 2.039 1.00 . A A . 16 LYS HZ1 1 1 2 781 1 1 16 LYS HZ2 H 1.313 9.462 1.585 1.00 . A A . 16 LYS HZ2 1 1 2 782 1 1 16 LYS HZ3 H 1.543 8.098 2.460 1.00 . A A . 16 LYS HZ3 1 1 2 783 1 1 16 LYS N N -3.467 7.863 1.654 1.00 . A A . 16 LYS N 1 1 2 784 1 1 16 LYS NZ N 0.992 8.505 1.707 1.00 . A A . 16 LYS NZ 1 1 2 785 1 1 16 LYS O O -3.848 4.983 0.373 1.00 . A A . 16 LYS O 1 1 2 786 1 1 17 CYS C C -5.586 4.643 -2.149 1.00 . A A . 17 CYS C 1 1 2 787 1 1 17 CYS CA C -6.311 5.317 -0.980 1.00 . A A . 17 CYS CA 1 1 2 788 1 1 17 CYS CB C -7.599 5.962 -1.492 1.00 . A A . 17 CYS CB 1 1 2 789 1 1 17 CYS H H -5.722 7.312 -0.523 1.00 . A A . 17 CYS H 1 1 2 790 1 1 17 CYS HA H -6.560 4.573 -0.224 1.00 . A A . 17 CYS HA 1 1 2 791 1 1 17 CYS HB2 H -8.198 6.298 -0.646 1.00 . A A . 17 CYS HB2 1 1 2 792 1 1 17 CYS HB3 H -7.338 6.840 -2.085 1.00 . A A . 17 CYS HB3 1 1 2 793 1 1 17 CYS N N -5.453 6.346 -0.398 1.00 . A A . 17 CYS N 1 1 2 794 1 1 17 CYS O O -5.045 5.338 -3.012 1.00 . A A . 17 CYS O 1 1 2 795 1 1 17 CYS SG S -8.611 4.885 -2.539 1.00 . A A . 17 CYS SG 1 1 2 796 1 1 18 CYS C C -4.661 2.948 -4.536 1.00 . A A . 18 CYS C 1 1 2 797 1 1 18 CYS CA C -4.757 2.510 -3.063 1.00 . A A . 18 CYS CA 1 1 2 798 1 1 18 CYS CB C -5.213 1.056 -2.991 1.00 . A A . 18 CYS CB 1 1 2 799 1 1 18 CYS H H -6.115 2.840 -1.450 1.00 . A A . 18 CYS H 1 1 2 800 1 1 18 CYS HA H -3.755 2.579 -2.636 1.00 . A A . 18 CYS HA 1 1 2 801 1 1 18 CYS HB2 H -5.739 0.894 -2.051 1.00 . A A . 18 CYS HB2 1 1 2 802 1 1 18 CYS HB3 H -5.913 0.867 -3.802 1.00 . A A . 18 CYS HB3 1 1 2 803 1 1 18 CYS N N -5.642 3.313 -2.216 1.00 . A A . 18 CYS N 1 1 2 804 1 1 18 CYS O O -3.551 3.141 -5.030 1.00 . A A . 18 CYS O 1 1 2 805 1 1 18 CYS SG S -3.870 -0.147 -3.094 1.00 . A A . 18 CYS SG 1 1 2 806 1 1 19 GLU C C -6.288 5.118 -6.729 1.00 . A A . 19 GLU C 1 1 2 807 1 1 19 GLU CA C -5.828 3.650 -6.615 1.00 . A A . 19 GLU CA 1 1 2 808 1 1 19 GLU CB C -6.742 2.761 -7.485 1.00 . A A . 19 GLU CB 1 1 2 809 1 1 19 GLU CD C -5.338 0.577 -7.359 1.00 . A A . 19 GLU CD 1 1 2 810 1 1 19 GLU CG C -6.711 1.244 -7.213 1.00 . A A . 19 GLU CG 1 1 2 811 1 1 19 GLU H H -6.672 2.972 -4.760 1.00 . A A . 19 GLU H 1 1 2 812 1 1 19 GLU HA H -4.826 3.604 -7.040 1.00 . A A . 19 GLU HA 1 1 2 813 1 1 19 GLU HB2 H -7.768 3.099 -7.360 1.00 . A A . 19 GLU HB2 1 1 2 814 1 1 19 GLU HB3 H -6.486 2.932 -8.530 1.00 . A A . 19 GLU HB3 1 1 2 815 1 1 19 GLU HG2 H -7.096 1.056 -6.209 1.00 . A A . 19 GLU HG2 1 1 2 816 1 1 19 GLU HG3 H -7.396 0.763 -7.914 1.00 . A A . 19 GLU HG3 1 1 2 817 1 1 19 GLU N N -5.794 3.167 -5.218 1.00 . A A . 19 GLU N 1 1 2 818 1 1 19 GLU O O -6.188 5.722 -7.803 1.00 . A A . 19 GLU O 1 1 2 819 1 1 19 GLU OE1 O -4.385 1.198 -7.895 1.00 . A A . 19 GLU OE1 1 1 2 820 1 1 19 GLU OE2 O -5.209 -0.596 -6.943 1.00 . A A . 19 GLU OE2 1 1 2 821 1 1 20 GLY C C -8.904 7.131 -5.753 1.00 . A A . 20 GLY C 1 1 2 822 1 1 20 GLY CA C -7.379 7.049 -5.594 1.00 . A A . 20 GLY CA 1 1 2 823 1 1 20 GLY H H -6.727 5.196 -4.768 1.00 . A A . 20 GLY H 1 1 2 824 1 1 20 GLY HA2 H -7.133 7.485 -4.626 1.00 . A A . 20 GLY HA2 1 1 2 825 1 1 20 GLY HA3 H -6.930 7.670 -6.368 1.00 . A A . 20 GLY HA3 1 1 2 826 1 1 20 GLY N N -6.798 5.702 -5.639 1.00 . A A . 20 GLY N 1 1 2 827 1 1 20 GLY O O -9.411 8.185 -6.144 1.00 . A A . 20 GLY O 1 1 2 828 1 1 21 MET C C -11.587 6.629 -4.027 1.00 . A A . 21 MET C 1 1 2 829 1 1 21 MET CA C -11.106 6.072 -5.388 1.00 . A A . 21 MET CA 1 1 2 830 1 1 21 MET CB C -11.727 4.702 -5.716 1.00 . A A . 21 MET CB 1 1 2 831 1 1 21 MET CE C -10.366 1.806 -6.840 1.00 . A A . 21 MET CE 1 1 2 832 1 1 21 MET CG C -11.257 3.538 -4.838 1.00 . A A . 21 MET CG 1 1 2 833 1 1 21 MET H H -9.172 5.199 -5.216 1.00 . A A . 21 MET H 1 1 2 834 1 1 21 MET HA H -11.467 6.757 -6.148 1.00 . A A . 21 MET HA 1 1 2 835 1 1 21 MET HB2 H -12.807 4.789 -5.618 1.00 . A A . 21 MET HB2 1 1 2 836 1 1 21 MET HB3 H -11.533 4.464 -6.759 1.00 . A A . 21 MET HB3 1 1 2 837 1 1 21 MET HE1 H -9.555 1.239 -7.296 1.00 . A A . 21 MET HE1 1 1 2 838 1 1 21 MET HE2 H -11.136 1.110 -6.514 1.00 . A A . 21 MET HE2 1 1 2 839 1 1 21 MET HE3 H -10.774 2.493 -7.581 1.00 . A A . 21 MET HE3 1 1 2 840 1 1 21 MET HG2 H -11.113 3.897 -3.819 1.00 . A A . 21 MET HG2 1 1 2 841 1 1 21 MET HG3 H -12.045 2.786 -4.810 1.00 . A A . 21 MET HG3 1 1 2 842 1 1 21 MET N N -9.641 6.041 -5.511 1.00 . A A . 21 MET N 1 1 2 843 1 1 21 MET O O -10.777 7.037 -3.194 1.00 . A A . 21 MET O 1 1 2 844 1 1 21 MET SD S -9.737 2.728 -5.409 1.00 . A A . 21 MET SD 1 1 2 845 1 1 22 VAL C C -13.185 6.294 -1.413 1.00 . A A . 22 VAL C 1 1 2 846 1 1 22 VAL CA C -13.526 7.224 -2.585 1.00 . A A . 22 VAL CA 1 1 2 847 1 1 22 VAL CB C -15.056 7.375 -2.702 1.00 . A A . 22 VAL CB 1 1 2 848 1 1 22 VAL CG1 C -15.394 8.738 -3.313 1.00 . A A . 22 VAL CG1 1 1 2 849 1 1 22 VAL CG2 C -15.766 6.286 -3.511 1.00 . A A . 22 VAL CG2 1 1 2 850 1 1 22 VAL H H -13.521 6.462 -4.584 1.00 . A A . 22 VAL H 1 1 2 851 1 1 22 VAL HA H -13.113 8.205 -2.372 1.00 . A A . 22 VAL HA 1 1 2 852 1 1 22 VAL HB H -15.473 7.367 -1.698 1.00 . A A . 22 VAL HB 1 1 2 853 1 1 22 VAL HG11 H -15.034 8.793 -4.341 1.00 . A A . 22 VAL HG11 1 1 2 854 1 1 22 VAL HG12 H -16.472 8.891 -3.294 1.00 . A A . 22 VAL HG12 1 1 2 855 1 1 22 VAL HG13 H -14.925 9.527 -2.727 1.00 . A A . 22 VAL HG13 1 1 2 856 1 1 22 VAL HG21 H -16.844 6.431 -3.434 1.00 . A A . 22 VAL HG21 1 1 2 857 1 1 22 VAL HG22 H -15.469 6.342 -4.556 1.00 . A A . 22 VAL HG22 1 1 2 858 1 1 22 VAL HG23 H -15.517 5.305 -3.107 1.00 . A A . 22 VAL HG23 1 1 2 859 1 1 22 VAL N N -12.908 6.701 -3.817 1.00 . A A . 22 VAL N 1 1 2 860 1 1 22 VAL O O -13.621 5.146 -1.335 1.00 . A A . 22 VAL O 1 1 2 861 1 1 23 CYS C C -12.930 5.969 1.805 1.00 . A A . 23 CYS C 1 1 2 862 1 1 23 CYS CA C -11.864 6.184 0.709 1.00 . A A . 23 CYS CA 1 1 2 863 1 1 23 CYS CB C -10.737 7.133 1.152 1.00 . A A . 23 CYS CB 1 1 2 864 1 1 23 CYS H H -12.093 7.783 -0.666 1.00 . A A . 23 CYS H 1 1 2 865 1 1 23 CYS HA H -11.438 5.221 0.426 1.00 . A A . 23 CYS HA 1 1 2 866 1 1 23 CYS HB2 H -10.085 7.297 0.293 1.00 . A A . 23 CYS HB2 1 1 2 867 1 1 23 CYS HB3 H -11.189 8.097 1.391 1.00 . A A . 23 CYS HB3 1 1 2 868 1 1 23 CYS N N -12.423 6.841 -0.472 1.00 . A A . 23 CYS N 1 1 2 869 1 1 23 CYS O O -13.500 6.947 2.290 1.00 . A A . 23 CYS O 1 1 2 870 1 1 23 CYS SG S -9.668 6.699 2.544 1.00 . A A . 23 CYS SG 1 1 2 871 1 1 24 ARG C C -13.740 3.079 4.013 1.00 . A A . 24 ARG C 1 1 2 872 1 1 24 ARG CA C -14.160 4.367 3.303 1.00 . A A . 24 ARG CA 1 1 2 873 1 1 24 ARG CB C -15.626 4.202 2.837 1.00 . A A . 24 ARG CB 1 1 2 874 1 1 24 ARG CD C -16.339 5.659 0.972 1.00 . A A . 24 ARG CD 1 1 2 875 1 1 24 ARG CG C -16.396 5.483 2.497 1.00 . A A . 24 ARG CG 1 1 2 876 1 1 24 ARG CZ C -16.697 8.073 0.630 1.00 . A A . 24 ARG CZ 1 1 2 877 1 1 24 ARG H H -12.806 3.954 1.673 1.00 . A A . 24 ARG H 1 1 2 878 1 1 24 ARG HA H -14.135 5.160 4.054 1.00 . A A . 24 ARG HA 1 1 2 879 1 1 24 ARG HB2 H -15.676 3.489 2.011 1.00 . A A . 24 ARG HB2 1 1 2 880 1 1 24 ARG HB3 H -16.169 3.750 3.666 1.00 . A A . 24 ARG HB3 1 1 2 881 1 1 24 ARG HD2 H -15.326 5.796 0.640 1.00 . A A . 24 ARG HD2 1 1 2 882 1 1 24 ARG HD3 H -16.776 4.800 0.491 1.00 . A A . 24 ARG HD3 1 1 2 883 1 1 24 ARG HE H -18.141 6.699 0.493 1.00 . A A . 24 ARG HE 1 1 2 884 1 1 24 ARG HG2 H -17.437 5.358 2.799 1.00 . A A . 24 ARG HG2 1 1 2 885 1 1 24 ARG HG3 H -15.976 6.339 3.026 1.00 . A A . 24 ARG HG3 1 1 2 886 1 1 24 ARG HH11 H -14.889 7.755 1.471 1.00 . A A . 24 ARG HH11 1 1 2 887 1 1 24 ARG HH12 H -15.189 9.369 0.873 1.00 . A A . 24 ARG HH12 1 1 2 888 1 1 24 ARG HH21 H -18.395 8.786 -0.101 1.00 . A A . 24 ARG HH21 1 1 2 889 1 1 24 ARG HH22 H -17.095 9.964 0.114 1.00 . A A . 24 ARG HH22 1 1 2 890 1 1 24 ARG N N -13.238 4.717 2.188 1.00 . A A . 24 ARG N 1 1 2 891 1 1 24 ARG NE N -17.153 6.835 0.674 1.00 . A A . 24 ARG NE 1 1 2 892 1 1 24 ARG NH1 N -15.508 8.417 1.018 1.00 . A A . 24 ARG NH1 1 1 2 893 1 1 24 ARG NH2 N -17.447 9.019 0.165 1.00 . A A . 24 ARG NH2 1 1 2 894 1 1 24 ARG O O -14.212 2.004 3.656 1.00 . A A . 24 ARG O 1 1 2 895 1 1 25 LEU C C -11.376 1.027 4.727 1.00 . A A . 25 LEU C 1 1 2 896 1 1 25 LEU CA C -12.132 2.018 5.640 1.00 . A A . 25 LEU CA 1 1 2 897 1 1 25 LEU CB C -13.116 1.281 6.572 1.00 . A A . 25 LEU CB 1 1 2 898 1 1 25 LEU CD1 C -14.778 1.312 8.434 1.00 . A A . 25 LEU CD1 1 1 2 899 1 1 25 LEU CD2 C -12.786 2.775 8.608 1.00 . A A . 25 LEU CD2 1 1 2 900 1 1 25 LEU CG C -13.796 2.164 7.634 1.00 . A A . 25 LEU CG 1 1 2 901 1 1 25 LEU H H -12.471 4.087 5.183 1.00 . A A . 25 LEU H 1 1 2 902 1 1 25 LEU HA H -11.366 2.451 6.280 1.00 . A A . 25 LEU HA 1 1 2 903 1 1 25 LEU HB2 H -13.888 0.809 5.963 1.00 . A A . 25 LEU HB2 1 1 2 904 1 1 25 LEU HB3 H -12.574 0.483 7.082 1.00 . A A . 25 LEU HB3 1 1 2 905 1 1 25 LEU HD11 H -14.256 0.470 8.882 1.00 . A A . 25 LEU HD11 1 1 2 906 1 1 25 LEU HD12 H -15.555 0.934 7.770 1.00 . A A . 25 LEU HD12 1 1 2 907 1 1 25 LEU HD13 H -15.242 1.907 9.219 1.00 . A A . 25 LEU HD13 1 1 2 908 1 1 25 LEU HD21 H -13.313 3.296 9.406 1.00 . A A . 25 LEU HD21 1 1 2 909 1 1 25 LEU HD22 H -12.161 3.504 8.095 1.00 . A A . 25 LEU HD22 1 1 2 910 1 1 25 LEU HD23 H -12.158 1.997 9.040 1.00 . A A . 25 LEU HD23 1 1 2 911 1 1 25 LEU HG H -14.355 2.962 7.147 1.00 . A A . 25 LEU HG 1 1 2 912 1 1 25 LEU N N -12.792 3.155 4.951 1.00 . A A . 25 LEU N 1 1 2 913 1 1 25 LEU O O -10.450 0.350 5.168 1.00 . A A . 25 LEU O 1 1 2 914 1 1 26 TRP C C -10.935 1.204 1.071 1.00 . A A . 26 TRP C 1 1 2 915 1 1 26 TRP CA C -10.881 0.390 2.367 1.00 . A A . 26 TRP CA 1 1 2 916 1 1 26 TRP CB C -11.445 -1.037 2.198 1.00 . A A . 26 TRP CB 1 1 2 917 1 1 26 TRP CD1 C -13.359 -1.771 3.686 1.00 . A A . 26 TRP CD1 1 1 2 918 1 1 26 TRP CD2 C -14.097 -0.709 1.857 1.00 . A A . 26 TRP CD2 1 1 2 919 1 1 26 TRP CE2 C -15.247 -1.078 2.621 1.00 . A A . 26 TRP CE2 1 1 2 920 1 1 26 TRP CE3 C -14.333 0.082 0.706 1.00 . A A . 26 TRP CE3 1 1 2 921 1 1 26 TRP CG C -12.903 -1.246 2.524 1.00 . A A . 26 TRP CG 1 1 2 922 1 1 26 TRP CH2 C -16.745 0.059 1.094 1.00 . A A . 26 TRP CH2 1 1 2 923 1 1 26 TRP CZ2 C -16.552 -0.726 2.243 1.00 . A A . 26 TRP CZ2 1 1 2 924 1 1 26 TRP CZ3 C -15.636 0.462 0.330 1.00 . A A . 26 TRP CZ3 1 1 2 925 1 1 26 TRP H H -12.434 1.571 3.130 1.00 . A A . 26 TRP H 1 1 2 926 1 1 26 TRP HA H -9.830 0.304 2.639 1.00 . A A . 26 TRP HA 1 1 2 927 1 1 26 TRP HB2 H -11.253 -1.408 1.193 1.00 . A A . 26 TRP HB2 1 1 2 928 1 1 26 TRP HB3 H -10.868 -1.681 2.863 1.00 . A A . 26 TRP HB3 1 1 2 929 1 1 26 TRP HD1 H -12.729 -2.162 4.474 1.00 . A A . 26 TRP HD1 1 1 2 930 1 1 26 TRP HE1 H -15.291 -2.078 4.504 1.00 . A A . 26 TRP HE1 1 1 2 931 1 1 26 TRP HE3 H -13.498 0.451 0.135 1.00 . A A . 26 TRP HE3 1 1 2 932 1 1 26 TRP HH2 H -17.740 0.388 0.823 1.00 . A A . 26 TRP HH2 1 1 2 933 1 1 26 TRP HZ2 H -17.390 -1.037 2.851 1.00 . A A . 26 TRP HZ2 1 1 2 934 1 1 26 TRP HZ3 H -15.780 1.100 -0.532 1.00 . A A . 26 TRP HZ3 1 1 2 935 1 1 26 TRP N N -11.597 1.082 3.425 1.00 . A A . 26 TRP N 1 1 2 936 1 1 26 TRP NE1 N -14.738 -1.741 3.715 1.00 . A A . 26 TRP NE1 1 1 2 937 1 1 26 TRP O O -11.678 2.183 0.978 1.00 . A A . 26 TRP O 1 1 2 938 1 1 27 CYS C C -10.820 -0.160 -2.185 1.00 . A A . 27 CYS C 1 1 2 939 1 1 27 CYS CA C -10.466 1.086 -1.351 1.00 . A A . 27 CYS CA 1 1 2 940 1 1 27 CYS CB C -9.317 1.977 -1.831 1.00 . A A . 27 CYS CB 1 1 2 941 1 1 27 CYS H H -9.579 -0.032 0.215 1.00 . A A . 27 CYS H 1 1 2 942 1 1 27 CYS HA H -11.365 1.703 -1.405 1.00 . A A . 27 CYS HA 1 1 2 943 1 1 27 CYS HB2 H -8.359 1.587 -1.484 1.00 . A A . 27 CYS HB2 1 1 2 944 1 1 27 CYS HB3 H -9.315 1.992 -2.916 1.00 . A A . 27 CYS HB3 1 1 2 945 1 1 27 CYS N N -10.241 0.715 0.045 1.00 . A A . 27 CYS N 1 1 2 946 1 1 27 CYS O O -10.344 -0.354 -3.301 1.00 . A A . 27 CYS O 1 1 2 947 1 1 27 CYS SG S -9.563 3.669 -1.228 1.00 . A A . 27 CYS SG 1 1 2 948 1 1 28 LYS C C -12.356 -2.553 -3.431 1.00 . A A . 28 LYS C 1 1 2 949 1 1 28 LYS CA C -12.075 -2.374 -1.935 1.00 . A A . 28 LYS CA 1 1 2 950 1 1 28 LYS CB C -13.258 -2.759 -1.021 1.00 . A A . 28 LYS CB 1 1 2 951 1 1 28 LYS CD C -14.743 -4.609 -0.097 1.00 . A A . 28 LYS CD 1 1 2 952 1 1 28 LYS CE C -14.948 -6.129 -0.039 1.00 . A A . 28 LYS CE 1 1 2 953 1 1 28 LYS CG C -13.732 -4.205 -1.181 1.00 . A A . 28 LYS CG 1 1 2 954 1 1 28 LYS H H -12.013 -0.682 -0.680 1.00 . A A . 28 LYS H 1 1 2 955 1 1 28 LYS HA H -11.244 -3.038 -1.700 1.00 . A A . 28 LYS HA 1 1 2 956 1 1 28 LYS HB2 H -12.943 -2.625 0.012 1.00 . A A . 28 LYS HB2 1 1 2 957 1 1 28 LYS HB3 H -14.101 -2.090 -1.201 1.00 . A A . 28 LYS HB3 1 1 2 958 1 1 28 LYS HD2 H -14.373 -4.288 0.879 1.00 . A A . 28 LYS HD2 1 1 2 959 1 1 28 LYS HD3 H -15.697 -4.111 -0.277 1.00 . A A . 28 LYS HD3 1 1 2 960 1 1 28 LYS HE2 H -13.987 -6.611 0.164 1.00 . A A . 28 LYS HE2 1 1 2 961 1 1 28 LYS HE3 H -15.615 -6.355 0.796 1.00 . A A . 28 LYS HE3 1 1 2 962 1 1 28 LYS HG2 H -14.182 -4.325 -2.163 1.00 . A A . 28 LYS HG2 1 1 2 963 1 1 28 LYS HG3 H -12.869 -4.858 -1.106 1.00 . A A . 28 LYS HG3 1 1 2 964 1 1 28 LYS HZ1 H -15.720 -7.679 -1.181 1.00 . A A . 28 LYS HZ1 1 1 2 965 1 1 28 LYS HZ2 H -14.879 -6.603 -2.074 1.00 . A A . 28 LYS HZ2 1 1 2 966 1 1 28 LYS HZ3 H -16.404 -6.248 -1.533 1.00 . A A . 28 LYS HZ3 1 1 2 967 1 1 28 LYS N N -11.680 -1.001 -1.576 1.00 . A A . 28 LYS N 1 1 2 968 1 1 28 LYS NZ N -15.521 -6.684 -1.288 1.00 . A A . 28 LYS NZ 1 1 2 969 1 1 28 LYS O O -11.608 -3.255 -4.111 1.00 . A A . 28 LYS O 1 1 2 970 1 1 29 LYS C C -14.330 -0.046 -5.384 1.00 . A A . 29 LYS C 1 1 2 971 1 1 29 LYS CA C -13.229 -1.107 -5.269 1.00 . A A . 29 LYS CA 1 1 2 972 1 1 29 LYS CB C -13.366 -2.111 -6.434 1.00 . A A . 29 LYS CB 1 1 2 973 1 1 29 LYS CD C -12.581 -2.517 -8.842 1.00 . A A . 29 LYS CD 1 1 2 974 1 1 29 LYS CE C -12.600 -4.042 -8.693 1.00 . A A . 29 LYS CE 1 1 2 975 1 1 29 LYS CG C -12.362 -1.741 -7.539 1.00 . A A . 29 LYS CG 1 1 2 976 1 1 29 LYS H H -13.955 -1.361 -3.296 1.00 . A A . 29 LYS H 1 1 2 977 1 1 29 LYS HA H -12.256 -0.613 -5.321 1.00 . A A . 29 LYS HA 1 1 2 978 1 1 29 LYS HB2 H -13.164 -3.128 -6.098 1.00 . A A . 29 LYS HB2 1 1 2 979 1 1 29 LYS HB3 H -14.383 -2.091 -6.832 1.00 . A A . 29 LYS HB3 1 1 2 980 1 1 29 LYS HD2 H -13.529 -2.199 -9.277 1.00 . A A . 29 LYS HD2 1 1 2 981 1 1 29 LYS HD3 H -11.802 -2.245 -9.549 1.00 . A A . 29 LYS HD3 1 1 2 982 1 1 29 LYS HE2 H -13.468 -4.329 -8.093 1.00 . A A . 29 LYS HE2 1 1 2 983 1 1 29 LYS HE3 H -12.743 -4.469 -9.690 1.00 . A A . 29 LYS HE3 1 1 2 984 1 1 29 LYS HG2 H -12.453 -0.679 -7.770 1.00 . A A . 29 LYS HG2 1 1 2 985 1 1 29 LYS HG3 H -11.351 -1.921 -7.173 1.00 . A A . 29 LYS HG3 1 1 2 986 1 1 29 LYS HZ1 H -10.533 -4.150 -8.500 1.00 . A A . 29 LYS HZ1 1 1 2 987 1 1 29 LYS HZ2 H -11.320 -5.596 -8.226 1.00 . A A . 29 LYS HZ2 1 1 2 988 1 1 29 LYS HZ3 H -11.314 -4.439 -7.091 1.00 . A A . 29 LYS HZ3 1 1 2 989 1 1 29 LYS N N -13.306 -1.768 -3.954 1.00 . A A . 29 LYS N 1 1 2 990 1 1 29 LYS NZ N -11.359 -4.587 -8.093 1.00 . A A . 29 LYS NZ 1 1 2 991 1 1 29 LYS O O -15.415 -0.221 -4.829 1.00 . A A . 29 LYS O 1 1 2 992 1 1 30 LYS C C -14.614 2.743 -7.850 1.00 . A A . 30 LYS C 1 1 2 993 1 1 30 LYS CA C -15.097 1.995 -6.601 1.00 . A A . 30 LYS CA 1 1 2 994 1 1 30 LYS CB C -15.491 2.944 -5.442 1.00 . A A . 30 LYS CB 1 1 2 995 1 1 30 LYS CD C -17.015 4.693 -6.691 1.00 . A A . 30 LYS CD 1 1 2 996 1 1 30 LYS CE C -18.439 5.252 -6.778 1.00 . A A . 30 LYS CE 1 1 2 997 1 1 30 LYS CG C -16.871 3.611 -5.606 1.00 . A A . 30 LYS CG 1 1 2 998 1 1 30 LYS H H -13.146 1.103 -6.533 1.00 . A A . 30 LYS H 1 1 2 999 1 1 30 LYS HA H -15.989 1.435 -6.888 1.00 . A A . 30 LYS HA 1 1 2 1000 1 1 30 LYS HB2 H -15.541 2.367 -4.518 1.00 . A A . 30 LYS HB2 1 1 2 1001 1 1 30 LYS HB3 H -14.731 3.708 -5.288 1.00 . A A . 30 LYS HB3 1 1 2 1002 1 1 30 LYS HD2 H -16.310 5.505 -6.510 1.00 . A A . 30 LYS HD2 1 1 2 1003 1 1 30 LYS HD3 H -16.801 4.257 -7.665 1.00 . A A . 30 LYS HD3 1 1 2 1004 1 1 30 LYS HE2 H -18.486 5.966 -7.606 1.00 . A A . 30 LYS HE2 1 1 2 1005 1 1 30 LYS HE3 H -19.114 4.428 -7.024 1.00 . A A . 30 LYS HE3 1 1 2 1006 1 1 30 LYS HG2 H -17.611 2.834 -5.795 1.00 . A A . 30 LYS HG2 1 1 2 1007 1 1 30 LYS HG3 H -17.101 4.069 -4.647 1.00 . A A . 30 LYS HG3 1 1 2 1008 1 1 30 LYS HZ1 H -18.882 5.278 -4.735 1.00 . A A . 30 LYS HZ1 1 1 2 1009 1 1 30 LYS HZ2 H -19.895 6.153 -5.658 1.00 . A A . 30 LYS HZ2 1 1 2 1010 1 1 30 LYS HZ3 H -18.424 6.778 -5.339 1.00 . A A . 30 LYS HZ3 1 1 2 1011 1 1 30 LYS N N -14.077 1.022 -6.153 1.00 . A A . 30 LYS N 1 1 2 1012 1 1 30 LYS NZ N -18.915 5.907 -5.536 1.00 . A A . 30 LYS NZ 1 1 2 1013 1 1 30 LYS O O -14.282 3.925 -7.786 1.00 . A A . 30 LYS O 1 1 2 1014 1 1 31 LEU C C -14.902 1.716 -11.375 1.00 . A A . 31 LEU C 1 1 2 1015 1 1 31 LEU CA C -14.285 2.618 -10.301 1.00 . A A . 31 LEU CA 1 1 2 1016 1 1 31 LEU CB C -12.767 2.834 -10.483 1.00 . A A . 31 LEU CB 1 1 2 1017 1 1 31 LEU CD1 C -12.430 2.846 -13.038 1.00 . A A . 31 LEU CD1 1 1 2 1018 1 1 31 LEU CD2 C -12.983 4.967 -11.894 1.00 . A A . 31 LEU CD2 1 1 2 1019 1 1 31 LEU CG C -12.295 3.615 -11.729 1.00 . A A . 31 LEU CG 1 1 2 1020 1 1 31 LEU H H -14.793 1.062 -8.960 1.00 . A A . 31 LEU H 1 1 2 1021 1 1 31 LEU HA H -14.773 3.588 -10.348 1.00 . A A . 31 LEU HA 1 1 2 1022 1 1 31 LEU HB2 H -12.407 3.383 -9.615 1.00 . A A . 31 LEU HB2 1 1 2 1023 1 1 31 LEU HB3 H -12.268 1.864 -10.474 1.00 . A A . 31 LEU HB3 1 1 2 1024 1 1 31 LEU HD11 H -11.884 3.369 -13.824 1.00 . A A . 31 LEU HD11 1 1 2 1025 1 1 31 LEU HD12 H -13.467 2.765 -13.337 1.00 . A A . 31 LEU HD12 1 1 2 1026 1 1 31 LEU HD13 H -12.012 1.850 -12.920 1.00 . A A . 31 LEU HD13 1 1 2 1027 1 1 31 LEU HD21 H -12.510 5.518 -12.708 1.00 . A A . 31 LEU HD21 1 1 2 1028 1 1 31 LEU HD22 H -12.877 5.547 -10.980 1.00 . A A . 31 LEU HD22 1 1 2 1029 1 1 31 LEU HD23 H -14.039 4.840 -12.128 1.00 . A A . 31 LEU HD23 1 1 2 1030 1 1 31 LEU HG H -11.232 3.810 -11.591 1.00 . A A . 31 LEU HG 1 1 2 1031 1 1 31 LEU N N -14.541 2.038 -8.979 1.00 . A A . 31 LEU N 1 1 2 1032 1 1 31 LEU O O -14.549 0.543 -11.460 1.00 . A A . 31 LEU O 1 1 2 1033 1 1 32 LEU C C -15.688 0.738 -14.162 1.00 . A A . 32 LEU C 1 1 2 1034 1 1 32 LEU CA C -16.595 1.427 -13.141 1.00 . A A . 32 LEU CA 1 1 2 1035 1 1 32 LEU CB C -17.662 2.339 -13.808 1.00 . A A . 32 LEU CB 1 1 2 1036 1 1 32 LEU CD1 C -15.990 4.219 -14.556 1.00 . A A . 32 LEU CD1 1 1 2 1037 1 1 32 LEU CD2 C -17.022 2.725 -16.294 1.00 . A A . 32 LEU CD2 1 1 2 1038 1 1 32 LEU CG C -17.201 3.345 -14.899 1.00 . A A . 32 LEU CG 1 1 2 1039 1 1 32 LEU H H -16.139 3.193 -11.993 1.00 . A A . 32 LEU H 1 1 2 1040 1 1 32 LEU HA H -17.119 0.651 -12.596 1.00 . A A . 32 LEU HA 1 1 2 1041 1 1 32 LEU HB2 H -18.424 1.690 -14.241 1.00 . A A . 32 LEU HB2 1 1 2 1042 1 1 32 LEU HB3 H -18.151 2.904 -13.013 1.00 . A A . 32 LEU HB3 1 1 2 1043 1 1 32 LEU HD11 H -16.129 4.690 -13.585 1.00 . A A . 32 LEU HD11 1 1 2 1044 1 1 32 LEU HD12 H -15.888 5.009 -15.299 1.00 . A A . 32 LEU HD12 1 1 2 1045 1 1 32 LEU HD13 H -15.074 3.635 -14.559 1.00 . A A . 32 LEU HD13 1 1 2 1046 1 1 32 LEU HD21 H -17.883 2.109 -16.548 1.00 . A A . 32 LEU HD21 1 1 2 1047 1 1 32 LEU HD22 H -16.122 2.122 -16.368 1.00 . A A . 32 LEU HD22 1 1 2 1048 1 1 32 LEU HD23 H -16.951 3.520 -17.037 1.00 . A A . 32 LEU HD23 1 1 2 1049 1 1 32 LEU HG H -18.037 4.040 -15.004 1.00 . A A . 32 LEU HG 1 1 2 1050 1 1 32 LEU N N -15.827 2.240 -12.176 1.00 . A A . 32 LEU N 1 1 2 1051 1 1 32 LEU O O -15.671 -0.467 -14.286 1.00 . A A . 32 LEU O 1 1 2 1052 1 1 32 LEU OXT O -15.002 1.330 -14.710 1.00 . A A . 32 LEU OXT 1 1 3 1053 1 1 1 GLY C C 0.452 -5.694 2.826 1.00 . A A . 1 GLY C 1 1 3 1054 1 1 1 GLY CA C -0.101 -5.622 4.239 1.00 . A A . 1 GLY CA 1 1 3 1055 1 1 1 GLY H1 H 0.346 -4.671 6.003 1.00 . A A . 1 GLY H1 1 1 3 1056 1 1 1 GLY H2 H 1.669 -5.089 5.123 1.00 . A A . 1 GLY H2 1 1 3 1057 1 1 1 GLY H3 H 0.763 -3.803 4.657 1.00 . A A . 1 GLY H3 1 1 3 1058 1 1 1 GLY HA2 H -0.112 -6.617 4.682 1.00 . A A . 1 GLY HA2 1 1 3 1059 1 1 1 GLY HA3 H -1.114 -5.229 4.192 1.00 . A A . 1 GLY HA3 1 1 3 1060 1 1 1 GLY N N 0.726 -4.728 5.066 1.00 . A A . 1 GLY N 1 1 3 1061 1 1 1 GLY O O 0.864 -4.660 2.306 1.00 . A A . 1 GLY O 1 1 3 1062 1 1 2 PRO C C 0.317 -6.301 -0.297 1.00 . A A . 2 PRO C 1 1 3 1063 1 1 2 PRO CA C 1.032 -7.069 0.830 1.00 . A A . 2 PRO CA 1 1 3 1064 1 1 2 PRO CB C 0.960 -8.584 0.601 1.00 . A A . 2 PRO CB 1 1 3 1065 1 1 2 PRO CD C -0.101 -8.119 2.674 1.00 . A A . 2 PRO CD 1 1 3 1066 1 1 2 PRO CG C -0.220 -9.035 1.461 1.00 . A A . 2 PRO CG 1 1 3 1067 1 1 2 PRO HA H 2.078 -6.760 0.836 1.00 . A A . 2 PRO HA 1 1 3 1068 1 1 2 PRO HB2 H 0.822 -8.844 -0.450 1.00 . A A . 2 PRO HB2 1 1 3 1069 1 1 2 PRO HB3 H 1.871 -9.041 0.985 1.00 . A A . 2 PRO HB3 1 1 3 1070 1 1 2 PRO HD2 H -1.078 -7.970 3.128 1.00 . A A . 2 PRO HD2 1 1 3 1071 1 1 2 PRO HD3 H 0.587 -8.561 3.395 1.00 . A A . 2 PRO HD3 1 1 3 1072 1 1 2 PRO HG2 H -1.160 -8.839 0.946 1.00 . A A . 2 PRO HG2 1 1 3 1073 1 1 2 PRO HG3 H -0.146 -10.085 1.739 1.00 . A A . 2 PRO HG3 1 1 3 1074 1 1 2 PRO N N 0.451 -6.870 2.169 1.00 . A A . 2 PRO N 1 1 3 1075 1 1 2 PRO O O 0.908 -6.030 -1.345 1.00 . A A . 2 PRO O 1 1 3 1076 1 1 3 TYR C C -2.327 -3.867 -0.165 1.00 . A A . 3 TYR C 1 1 3 1077 1 1 3 TYR CA C -1.744 -5.060 -0.939 1.00 . A A . 3 TYR CA 1 1 3 1078 1 1 3 TYR CB C -2.769 -5.944 -1.685 1.00 . A A . 3 TYR CB 1 1 3 1079 1 1 3 TYR CD1 C -1.856 -8.280 -2.083 1.00 . A A . 3 TYR CD1 1 1 3 1080 1 1 3 TYR CD2 C -1.746 -6.662 -3.894 1.00 . A A . 3 TYR CD2 1 1 3 1081 1 1 3 TYR CE1 C -1.128 -9.202 -2.860 1.00 . A A . 3 TYR CE1 1 1 3 1082 1 1 3 TYR CE2 C -1.019 -7.581 -4.674 1.00 . A A . 3 TYR CE2 1 1 3 1083 1 1 3 TYR CG C -2.134 -6.992 -2.584 1.00 . A A . 3 TYR CG 1 1 3 1084 1 1 3 TYR CZ C -0.695 -8.851 -4.155 1.00 . A A . 3 TYR CZ 1 1 3 1085 1 1 3 TYR H H -1.318 -6.099 0.850 1.00 . A A . 3 TYR H 1 1 3 1086 1 1 3 TYR HA H -1.100 -4.618 -1.694 1.00 . A A . 3 TYR HA 1 1 3 1087 1 1 3 TYR HB2 H -3.404 -6.455 -0.966 1.00 . A A . 3 TYR HB2 1 1 3 1088 1 1 3 TYR HB3 H -3.409 -5.309 -2.299 1.00 . A A . 3 TYR HB3 1 1 3 1089 1 1 3 TYR HD1 H -2.168 -8.554 -1.085 1.00 . A A . 3 TYR HD1 1 1 3 1090 1 1 3 TYR HD2 H -1.962 -5.682 -4.291 1.00 . A A . 3 TYR HD2 1 1 3 1091 1 1 3 TYR HE1 H -0.861 -10.164 -2.452 1.00 . A A . 3 TYR HE1 1 1 3 1092 1 1 3 TYR HE2 H -0.683 -7.301 -5.662 1.00 . A A . 3 TYR HE2 1 1 3 1093 1 1 3 TYR HH H 0.506 -9.285 -5.609 1.00 . A A . 3 TYR HH 1 1 3 1094 1 1 3 TYR N N -0.927 -5.890 -0.056 1.00 . A A . 3 TYR N 1 1 3 1095 1 1 3 TYR O O -2.136 -3.776 1.051 1.00 . A A . 3 TYR O 1 1 3 1096 1 1 3 TYR OH O 0.010 -9.739 -4.904 1.00 . A A . 3 TYR OH 1 1 3 1097 1 1 4 CYS C C -5.238 -1.792 -0.472 1.00 . A A . 4 CYS C 1 1 3 1098 1 1 4 CYS CA C -3.731 -1.844 -0.166 1.00 . A A . 4 CYS CA 1 1 3 1099 1 1 4 CYS CB C -2.969 -0.512 -0.332 1.00 . A A . 4 CYS CB 1 1 3 1100 1 1 4 CYS H H -3.097 -3.029 -1.837 1.00 . A A . 4 CYS H 1 1 3 1101 1 1 4 CYS HA H -3.709 -2.039 0.904 1.00 . A A . 4 CYS HA 1 1 3 1102 1 1 4 CYS HB2 H -3.681 0.302 -0.242 1.00 . A A . 4 CYS HB2 1 1 3 1103 1 1 4 CYS HB3 H -2.307 -0.423 0.530 1.00 . A A . 4 CYS HB3 1 1 3 1104 1 1 4 CYS N N -3.045 -2.958 -0.833 1.00 . A A . 4 CYS N 1 1 3 1105 1 1 4 CYS O O -6.056 -2.097 0.400 1.00 . A A . 4 CYS O 1 1 3 1106 1 1 4 CYS SG S -1.929 -0.171 -1.791 1.00 . A A . 4 CYS SG 1 1 3 1107 1 1 5 GLN C C -7.660 -2.959 -1.929 1.00 . A A . 5 GLN C 1 1 3 1108 1 1 5 GLN CA C -7.010 -1.593 -2.187 1.00 . A A . 5 GLN CA 1 1 3 1109 1 1 5 GLN CB C -7.063 -1.121 -3.657 1.00 . A A . 5 GLN CB 1 1 3 1110 1 1 5 GLN CD C -7.638 -3.053 -5.291 1.00 . A A . 5 GLN CD 1 1 3 1111 1 1 5 GLN CG C -8.102 -1.777 -4.586 1.00 . A A . 5 GLN CG 1 1 3 1112 1 1 5 GLN H H -4.897 -1.335 -2.408 1.00 . A A . 5 GLN H 1 1 3 1113 1 1 5 GLN HA H -7.573 -0.872 -1.592 1.00 . A A . 5 GLN HA 1 1 3 1114 1 1 5 GLN HB2 H -7.281 -0.052 -3.627 1.00 . A A . 5 GLN HB2 1 1 3 1115 1 1 5 GLN HB3 H -6.079 -1.226 -4.112 1.00 . A A . 5 GLN HB3 1 1 3 1116 1 1 5 GLN HE21 H -5.821 -2.333 -5.835 1.00 . A A . 5 GLN HE21 1 1 3 1117 1 1 5 GLN HE22 H -6.194 -3.980 -6.283 1.00 . A A . 5 GLN HE22 1 1 3 1118 1 1 5 GLN HG2 H -9.008 -1.993 -4.024 1.00 . A A . 5 GLN HG2 1 1 3 1119 1 1 5 GLN HG3 H -8.359 -1.059 -5.363 1.00 . A A . 5 GLN HG3 1 1 3 1120 1 1 5 GLN N N -5.612 -1.569 -1.733 1.00 . A A . 5 GLN N 1 1 3 1121 1 1 5 GLN NE2 N -6.405 -3.169 -5.725 1.00 . A A . 5 GLN NE2 1 1 3 1122 1 1 5 GLN O O -8.609 -3.074 -1.151 1.00 . A A . 5 GLN O 1 1 3 1123 1 1 5 GLN OE1 O -8.421 -3.956 -5.541 1.00 . A A . 5 GLN OE1 1 1 3 1124 1 1 6 LYS C C -7.215 -5.980 -0.849 1.00 . A A . 6 LYS C 1 1 3 1125 1 1 6 LYS CA C -7.424 -5.423 -2.271 1.00 . A A . 6 LYS CA 1 1 3 1126 1 1 6 LYS CB C -6.689 -6.266 -3.334 1.00 . A A . 6 LYS CB 1 1 3 1127 1 1 6 LYS CD C -6.759 -8.332 -4.789 1.00 . A A . 6 LYS CD 1 1 3 1128 1 1 6 LYS CE C -7.629 -9.431 -5.412 1.00 . A A . 6 LYS CE 1 1 3 1129 1 1 6 LYS CG C -7.550 -7.439 -3.824 1.00 . A A . 6 LYS CG 1 1 3 1130 1 1 6 LYS H H -6.242 -3.832 -3.058 1.00 . A A . 6 LYS H 1 1 3 1131 1 1 6 LYS HA H -8.497 -5.473 -2.468 1.00 . A A . 6 LYS HA 1 1 3 1132 1 1 6 LYS HB2 H -6.455 -5.648 -4.202 1.00 . A A . 6 LYS HB2 1 1 3 1133 1 1 6 LYS HB3 H -5.750 -6.639 -2.920 1.00 . A A . 6 LYS HB3 1 1 3 1134 1 1 6 LYS HD2 H -6.349 -7.722 -5.596 1.00 . A A . 6 LYS HD2 1 1 3 1135 1 1 6 LYS HD3 H -5.926 -8.790 -4.255 1.00 . A A . 6 LYS HD3 1 1 3 1136 1 1 6 LYS HE2 H -8.403 -8.969 -6.031 1.00 . A A . 6 LYS HE2 1 1 3 1137 1 1 6 LYS HE3 H -6.998 -10.032 -6.074 1.00 . A A . 6 LYS HE3 1 1 3 1138 1 1 6 LYS HG2 H -7.883 -8.034 -2.976 1.00 . A A . 6 LYS HG2 1 1 3 1139 1 1 6 LYS HG3 H -8.429 -7.045 -4.334 1.00 . A A . 6 LYS HG3 1 1 3 1140 1 1 6 LYS HZ1 H -8.908 -9.811 -3.813 1.00 . A A . 6 LYS HZ1 1 1 3 1141 1 1 6 LYS HZ2 H -7.538 -10.704 -3.778 1.00 . A A . 6 LYS HZ2 1 1 3 1142 1 1 6 LYS HZ3 H -8.734 -11.087 -4.844 1.00 . A A . 6 LYS HZ3 1 1 3 1143 1 1 6 LYS N N -7.011 -4.019 -2.429 1.00 . A A . 6 LYS N 1 1 3 1144 1 1 6 LYS NZ N -8.251 -10.310 -4.392 1.00 . A A . 6 LYS NZ 1 1 3 1145 1 1 6 LYS O O -7.423 -7.168 -0.623 1.00 . A A . 6 LYS O 1 1 3 1146 1 1 7 TRP C C -7.244 -4.795 2.574 1.00 . A A . 7 TRP C 1 1 3 1147 1 1 7 TRP CA C -6.443 -5.512 1.478 1.00 . A A . 7 TRP CA 1 1 3 1148 1 1 7 TRP CB C -4.929 -5.275 1.579 1.00 . A A . 7 TRP CB 1 1 3 1149 1 1 7 TRP CD1 C -3.990 -4.769 3.890 1.00 . A A . 7 TRP CD1 1 1 3 1150 1 1 7 TRP CD2 C -3.854 -6.938 3.347 1.00 . A A . 7 TRP CD2 1 1 3 1151 1 1 7 TRP CE2 C -3.325 -6.803 4.666 1.00 . A A . 7 TRP CE2 1 1 3 1152 1 1 7 TRP CE3 C -3.914 -8.242 2.808 1.00 . A A . 7 TRP CE3 1 1 3 1153 1 1 7 TRP CG C -4.217 -5.613 2.855 1.00 . A A . 7 TRP CG 1 1 3 1154 1 1 7 TRP CH2 C -2.921 -9.177 4.835 1.00 . A A . 7 TRP CH2 1 1 3 1155 1 1 7 TRP CZ2 C -2.852 -7.895 5.403 1.00 . A A . 7 TRP CZ2 1 1 3 1156 1 1 7 TRP CZ3 C -3.460 -9.349 3.549 1.00 . A A . 7 TRP CZ3 1 1 3 1157 1 1 7 TRP H H -6.771 -4.157 -0.128 1.00 . A A . 7 TRP H 1 1 3 1158 1 1 7 TRP HA H -6.623 -6.578 1.631 1.00 . A A . 7 TRP HA 1 1 3 1159 1 1 7 TRP HB2 H -4.453 -5.856 0.796 1.00 . A A . 7 TRP HB2 1 1 3 1160 1 1 7 TRP HB3 H -4.745 -4.223 1.366 1.00 . A A . 7 TRP HB3 1 1 3 1161 1 1 7 TRP HD1 H -4.251 -3.718 3.897 1.00 . A A . 7 TRP HD1 1 1 3 1162 1 1 7 TRP HE1 H -3.255 -5.050 5.858 1.00 . A A . 7 TRP HE1 1 1 3 1163 1 1 7 TRP HE3 H -4.311 -8.391 1.815 1.00 . A A . 7 TRP HE3 1 1 3 1164 1 1 7 TRP HH2 H -2.562 -10.034 5.383 1.00 . A A . 7 TRP HH2 1 1 3 1165 1 1 7 TRP HZ2 H -2.447 -7.757 6.395 1.00 . A A . 7 TRP HZ2 1 1 3 1166 1 1 7 TRP HZ3 H -3.516 -10.342 3.127 1.00 . A A . 7 TRP HZ3 1 1 3 1167 1 1 7 TRP N N -6.851 -5.134 0.118 1.00 . A A . 7 TRP N 1 1 3 1168 1 1 7 TRP NE1 N -3.428 -5.460 4.945 1.00 . A A . 7 TRP NE1 1 1 3 1169 1 1 7 TRP O O -7.075 -5.098 3.749 1.00 . A A . 7 TRP O 1 1 3 1170 1 1 8 MET C C -7.932 -2.224 4.091 1.00 . A A . 8 MET C 1 1 3 1171 1 1 8 MET CA C -8.873 -3.028 3.176 1.00 . A A . 8 MET CA 1 1 3 1172 1 1 8 MET CB C -9.922 -3.848 3.952 1.00 . A A . 8 MET CB 1 1 3 1173 1 1 8 MET CE C -11.834 -6.389 4.847 1.00 . A A . 8 MET CE 1 1 3 1174 1 1 8 MET CG C -10.919 -4.515 3.002 1.00 . A A . 8 MET CG 1 1 3 1175 1 1 8 MET H H -8.271 -3.694 1.223 1.00 . A A . 8 MET H 1 1 3 1176 1 1 8 MET HA H -9.421 -2.287 2.595 1.00 . A A . 8 MET HA 1 1 3 1177 1 1 8 MET HB2 H -9.441 -4.607 4.567 1.00 . A A . 8 MET HB2 1 1 3 1178 1 1 8 MET HB3 H -10.466 -3.178 4.618 1.00 . A A . 8 MET HB3 1 1 3 1179 1 1 8 MET HE1 H -11.103 -5.999 5.555 1.00 . A A . 8 MET HE1 1 1 3 1180 1 1 8 MET HE2 H -12.659 -6.837 5.401 1.00 . A A . 8 MET HE2 1 1 3 1181 1 1 8 MET HE3 H -11.369 -7.156 4.230 1.00 . A A . 8 MET HE3 1 1 3 1182 1 1 8 MET HG2 H -11.177 -3.800 2.223 1.00 . A A . 8 MET HG2 1 1 3 1183 1 1 8 MET HG3 H -10.445 -5.375 2.527 1.00 . A A . 8 MET HG3 1 1 3 1184 1 1 8 MET N N -8.140 -3.866 2.212 1.00 . A A . 8 MET N 1 1 3 1185 1 1 8 MET O O -8.007 -2.300 5.315 1.00 . A A . 8 MET O 1 1 3 1186 1 1 8 MET SD S -12.457 -5.048 3.791 1.00 . A A . 8 MET SD 1 1 3 1187 1 1 9 GLN C C -6.400 0.529 5.041 1.00 . A A . 9 GLN C 1 1 3 1188 1 1 9 GLN CA C -5.996 -0.577 4.029 1.00 . A A . 9 GLN CA 1 1 3 1189 1 1 9 GLN CB C -5.251 0.042 2.835 1.00 . A A . 9 GLN CB 1 1 3 1190 1 1 9 GLN CD C -5.465 1.825 1.006 1.00 . A A . 9 GLN CD 1 1 3 1191 1 1 9 GLN CG C -6.195 0.911 1.970 1.00 . A A . 9 GLN CG 1 1 3 1192 1 1 9 GLN H H -7.044 -1.517 2.457 1.00 . A A . 9 GLN H 1 1 3 1193 1 1 9 GLN HA H -5.298 -1.229 4.557 1.00 . A A . 9 GLN HA 1 1 3 1194 1 1 9 GLN HB2 H -4.413 0.632 3.208 1.00 . A A . 9 GLN HB2 1 1 3 1195 1 1 9 GLN HB3 H -4.828 -0.751 2.228 1.00 . A A . 9 GLN HB3 1 1 3 1196 1 1 9 GLN HE21 H -4.273 2.562 2.455 1.00 . A A . 9 GLN HE21 1 1 3 1197 1 1 9 GLN HE22 H -4.082 3.283 0.865 1.00 . A A . 9 GLN HE22 1 1 3 1198 1 1 9 GLN HG2 H -6.870 0.273 1.400 1.00 . A A . 9 GLN HG2 1 1 3 1199 1 1 9 GLN HG3 H -6.803 1.552 2.608 1.00 . A A . 9 GLN HG3 1 1 3 1200 1 1 9 GLN N N -7.059 -1.431 3.465 1.00 . A A . 9 GLN N 1 1 3 1201 1 1 9 GLN NE2 N -4.510 2.593 1.478 1.00 . A A . 9 GLN NE2 1 1 3 1202 1 1 9 GLN O O -5.818 1.615 5.026 1.00 . A A . 9 GLN O 1 1 3 1203 1 1 9 GLN OE1 O -5.664 1.765 -0.199 1.00 . A A . 9 GLN OE1 1 1 3 1204 1 1 10 THR C C -7.948 2.658 6.567 1.00 . A A . 10 THR C 1 1 3 1205 1 1 10 THR CA C -7.785 1.192 7.005 1.00 . A A . 10 THR CA 1 1 3 1206 1 1 10 THR CB C -6.834 1.001 8.209 1.00 . A A . 10 THR CB 1 1 3 1207 1 1 10 THR CG2 C -7.620 0.994 9.513 1.00 . A A . 10 THR CG2 1 1 3 1208 1 1 10 THR H H -7.864 -0.590 5.836 1.00 . A A . 10 THR H 1 1 3 1209 1 1 10 THR HA H -8.774 0.869 7.330 1.00 . A A . 10 THR HA 1 1 3 1210 1 1 10 THR HB H -6.087 1.792 8.232 1.00 . A A . 10 THR HB 1 1 3 1211 1 1 10 THR HG1 H -6.792 -0.951 8.194 1.00 . A A . 10 THR HG1 1 1 3 1212 1 1 10 THR HG21 H -8.344 0.182 9.488 1.00 . A A . 10 THR HG21 1 1 3 1213 1 1 10 THR HG22 H -8.128 1.948 9.636 1.00 . A A . 10 THR HG22 1 1 3 1214 1 1 10 THR HG23 H -6.961 0.821 10.360 1.00 . A A . 10 THR HG23 1 1 3 1215 1 1 10 THR N N -7.416 0.317 5.876 1.00 . A A . 10 THR N 1 1 3 1216 1 1 10 THR O O -7.214 3.551 6.999 1.00 . A A . 10 THR O 1 1 3 1217 1 1 10 THR OG1 O -6.133 -0.226 8.201 1.00 . A A . 10 THR OG1 1 1 3 1218 1 1 11 CYS C C -9.534 5.242 5.363 1.00 . A A . 11 CYS C 1 1 3 1219 1 1 11 CYS CA C -8.875 4.023 4.684 1.00 . A A . 11 CYS CA 1 1 3 1220 1 1 11 CYS CB C -9.497 3.613 3.338 1.00 . A A . 11 CYS CB 1 1 3 1221 1 1 11 CYS H H -9.360 2.044 5.302 1.00 . A A . 11 CYS H 1 1 3 1222 1 1 11 CYS HA H -7.846 4.305 4.470 1.00 . A A . 11 CYS HA 1 1 3 1223 1 1 11 CYS HB2 H -9.346 2.544 3.193 1.00 . A A . 11 CYS HB2 1 1 3 1224 1 1 11 CYS HB3 H -10.571 3.804 3.341 1.00 . A A . 11 CYS HB3 1 1 3 1225 1 1 11 CYS N N -8.802 2.849 5.557 1.00 . A A . 11 CYS N 1 1 3 1226 1 1 11 CYS O O -10.673 5.605 5.081 1.00 . A A . 11 CYS O 1 1 3 1227 1 1 11 CYS SG S -8.735 4.438 1.919 1.00 . A A . 11 CYS SG 1 1 3 1228 1 1 12 ASP C C -9.054 8.340 6.338 1.00 . A A . 12 ASP C 1 1 3 1229 1 1 12 ASP CA C -9.090 7.003 7.109 1.00 . A A . 12 ASP CA 1 1 3 1230 1 1 12 ASP CB C -8.112 7.006 8.291 1.00 . A A . 12 ASP CB 1 1 3 1231 1 1 12 ASP CG C -8.544 6.143 9.468 1.00 . A A . 12 ASP CG 1 1 3 1232 1 1 12 ASP H H -7.949 5.314 6.558 1.00 . A A . 12 ASP H 1 1 3 1233 1 1 12 ASP HA H -10.103 6.929 7.509 1.00 . A A . 12 ASP HA 1 1 3 1234 1 1 12 ASP HB2 H -7.137 6.667 7.941 1.00 . A A . 12 ASP HB2 1 1 3 1235 1 1 12 ASP HB3 H -7.991 8.014 8.661 1.00 . A A . 12 ASP HB3 1 1 3 1236 1 1 12 ASP N N -8.822 5.781 6.347 1.00 . A A . 12 ASP N 1 1 3 1237 1 1 12 ASP O O -8.714 8.370 5.156 1.00 . A A . 12 ASP O 1 1 3 1238 1 1 12 ASP OD1 O -9.718 6.212 9.902 1.00 . A A . 12 ASP OD1 1 1 3 1239 1 1 12 ASP OD2 O -7.687 5.423 10.019 1.00 . A A . 12 ASP OD2 1 1 3 1240 1 1 13 SER C C -8.074 11.243 5.724 1.00 . A A . 13 SER C 1 1 3 1241 1 1 13 SER CA C -9.398 10.799 6.350 1.00 . A A . 13 SER CA 1 1 3 1242 1 1 13 SER CB C -9.878 11.859 7.343 1.00 . A A . 13 SER CB 1 1 3 1243 1 1 13 SER H H -9.608 9.401 7.975 1.00 . A A . 13 SER H 1 1 3 1244 1 1 13 SER HA H -10.128 10.761 5.543 1.00 . A A . 13 SER HA 1 1 3 1245 1 1 13 SER HB2 H -10.901 11.622 7.623 1.00 . A A . 13 SER HB2 1 1 3 1246 1 1 13 SER HB3 H -9.259 11.817 8.235 1.00 . A A . 13 SER HB3 1 1 3 1247 1 1 13 SER HG H -9.161 13.262 6.139 1.00 . A A . 13 SER HG 1 1 3 1248 1 1 13 SER N N -9.356 9.470 6.995 1.00 . A A . 13 SER N 1 1 3 1249 1 1 13 SER O O -8.102 11.977 4.743 1.00 . A A . 13 SER O 1 1 3 1250 1 1 13 SER OG O -9.858 13.182 6.818 1.00 . A A . 13 SER OG 1 1 3 1251 1 1 14 GLU C C -5.354 10.180 4.371 1.00 . A A . 14 GLU C 1 1 3 1252 1 1 14 GLU CA C -5.627 11.106 5.573 1.00 . A A . 14 GLU CA 1 1 3 1253 1 1 14 GLU CB C -4.506 10.907 6.609 1.00 . A A . 14 GLU CB 1 1 3 1254 1 1 14 GLU CD C -3.457 13.203 6.736 1.00 . A A . 14 GLU CD 1 1 3 1255 1 1 14 GLU CG C -3.255 11.745 6.327 1.00 . A A . 14 GLU CG 1 1 3 1256 1 1 14 GLU H H -6.917 10.277 7.082 1.00 . A A . 14 GLU H 1 1 3 1257 1 1 14 GLU HA H -5.624 12.137 5.223 1.00 . A A . 14 GLU HA 1 1 3 1258 1 1 14 GLU HB2 H -4.873 11.154 7.603 1.00 . A A . 14 GLU HB2 1 1 3 1259 1 1 14 GLU HB3 H -4.216 9.857 6.613 1.00 . A A . 14 GLU HB3 1 1 3 1260 1 1 14 GLU HG2 H -2.428 11.338 6.912 1.00 . A A . 14 GLU HG2 1 1 3 1261 1 1 14 GLU HG3 H -2.979 11.677 5.274 1.00 . A A . 14 GLU HG3 1 1 3 1262 1 1 14 GLU N N -6.914 10.818 6.226 1.00 . A A . 14 GLU N 1 1 3 1263 1 1 14 GLU O O -4.476 10.456 3.546 1.00 . A A . 14 GLU O 1 1 3 1264 1 1 14 GLU OE1 O -3.184 14.107 5.917 1.00 . A A . 14 GLU OE1 1 1 3 1265 1 1 14 GLU OE2 O -3.837 13.479 7.895 1.00 . A A . 14 GLU OE2 1 1 3 1266 1 1 15 ARG C C -5.263 7.502 2.526 1.00 . A A . 15 ARG C 1 1 3 1267 1 1 15 ARG CA C -5.233 7.754 4.031 1.00 . A A . 15 ARG CA 1 1 3 1268 1 1 15 ARG CB C -5.787 6.584 4.865 1.00 . A A . 15 ARG CB 1 1 3 1269 1 1 15 ARG CD C -4.409 4.593 4.129 1.00 . A A . 15 ARG CD 1 1 3 1270 1 1 15 ARG CG C -4.696 5.585 5.279 1.00 . A A . 15 ARG CG 1 1 3 1271 1 1 15 ARG CZ C -2.819 3.276 5.540 1.00 . A A . 15 ARG CZ 1 1 3 1272 1 1 15 ARG H H -6.780 8.873 4.964 1.00 . A A . 15 ARG H 1 1 3 1273 1 1 15 ARG HA H -4.192 7.895 4.322 1.00 . A A . 15 ARG HA 1 1 3 1274 1 1 15 ARG HB2 H -6.191 6.990 5.792 1.00 . A A . 15 ARG HB2 1 1 3 1275 1 1 15 ARG HB3 H -6.604 6.086 4.346 1.00 . A A . 15 ARG HB3 1 1 3 1276 1 1 15 ARG HD2 H -5.206 3.864 4.084 1.00 . A A . 15 ARG HD2 1 1 3 1277 1 1 15 ARG HD3 H -4.298 5.134 3.199 1.00 . A A . 15 ARG HD3 1 1 3 1278 1 1 15 ARG HE H -2.314 4.145 3.843 1.00 . A A . 15 ARG HE 1 1 3 1279 1 1 15 ARG HG2 H -3.792 6.125 5.564 1.00 . A A . 15 ARG HG2 1 1 3 1280 1 1 15 ARG HG3 H -5.054 5.037 6.147 1.00 . A A . 15 ARG HG3 1 1 3 1281 1 1 15 ARG HH11 H -4.651 2.671 6.015 1.00 . A A . 15 ARG HH11 1 1 3 1282 1 1 15 ARG HH12 H -3.392 2.333 7.199 1.00 . A A . 15 ARG HH12 1 1 3 1283 1 1 15 ARG HH21 H -0.853 3.338 5.216 1.00 . A A . 15 ARG HH21 1 1 3 1284 1 1 15 ARG HH22 H -1.376 2.540 6.698 1.00 . A A . 15 ARG HH22 1 1 3 1285 1 1 15 ARG N N -5.945 8.979 4.396 1.00 . A A . 15 ARG N 1 1 3 1286 1 1 15 ARG NE N -3.115 3.942 4.434 1.00 . A A . 15 ARG NE 1 1 3 1287 1 1 15 ARG NH1 N -3.704 2.790 6.352 1.00 . A A . 15 ARG NH1 1 1 3 1288 1 1 15 ARG NH2 N -1.582 3.063 5.863 1.00 . A A . 15 ARG NH2 1 1 3 1289 1 1 15 ARG O O -6.234 6.989 1.979 1.00 . A A . 15 ARG O 1 1 3 1290 1 1 16 LYS C C -4.335 6.063 0.010 1.00 . A A . 16 LYS C 1 1 3 1291 1 1 16 LYS CA C -3.760 7.396 0.506 1.00 . A A . 16 LYS CA 1 1 3 1292 1 1 16 LYS CB C -2.225 7.463 0.356 1.00 . A A . 16 LYS CB 1 1 3 1293 1 1 16 LYS CD C 0.030 6.944 1.446 1.00 . A A . 16 LYS CD 1 1 3 1294 1 1 16 LYS CE C 0.809 6.390 0.254 1.00 . A A . 16 LYS CE 1 1 3 1295 1 1 16 LYS CG C -1.449 6.583 1.365 1.00 . A A . 16 LYS CG 1 1 3 1296 1 1 16 LYS H H -3.372 8.131 2.466 1.00 . A A . 16 LYS H 1 1 3 1297 1 1 16 LYS HA H -4.187 8.178 -0.122 1.00 . A A . 16 LYS HA 1 1 3 1298 1 1 16 LYS HB2 H -1.948 7.181 -0.661 1.00 . A A . 16 LYS HB2 1 1 3 1299 1 1 16 LYS HB3 H -1.924 8.500 0.502 1.00 . A A . 16 LYS HB3 1 1 3 1300 1 1 16 LYS HD2 H 0.143 8.028 1.507 1.00 . A A . 16 LYS HD2 1 1 3 1301 1 1 16 LYS HD3 H 0.415 6.500 2.362 1.00 . A A . 16 LYS HD3 1 1 3 1302 1 1 16 LYS HE2 H 0.668 5.306 0.214 1.00 . A A . 16 LYS HE2 1 1 3 1303 1 1 16 LYS HE3 H 0.416 6.821 -0.672 1.00 . A A . 16 LYS HE3 1 1 3 1304 1 1 16 LYS HG2 H -1.854 6.707 2.368 1.00 . A A . 16 LYS HG2 1 1 3 1305 1 1 16 LYS HG3 H -1.533 5.529 1.103 1.00 . A A . 16 LYS HG3 1 1 3 1306 1 1 16 LYS HZ1 H 2.412 7.689 0.249 1.00 . A A . 16 LYS HZ1 1 1 3 1307 1 1 16 LYS HZ2 H 2.770 6.177 -0.325 1.00 . A A . 16 LYS HZ2 1 1 3 1308 1 1 16 LYS HZ3 H 2.596 6.428 1.299 1.00 . A A . 16 LYS HZ3 1 1 3 1309 1 1 16 LYS N N -4.099 7.700 1.905 1.00 . A A . 16 LYS N 1 1 3 1310 1 1 16 LYS NZ N 2.248 6.694 0.382 1.00 . A A . 16 LYS NZ 1 1 3 1311 1 1 16 LYS O O -3.773 4.996 0.259 1.00 . A A . 16 LYS O 1 1 3 1312 1 1 17 CYS C C -5.069 4.456 -2.526 1.00 . A A . 17 CYS C 1 1 3 1313 1 1 17 CYS CA C -5.967 4.903 -1.365 1.00 . A A . 17 CYS CA 1 1 3 1314 1 1 17 CYS CB C -7.428 5.065 -1.784 1.00 . A A . 17 CYS CB 1 1 3 1315 1 1 17 CYS H H -5.902 6.993 -0.872 1.00 . A A . 17 CYS H 1 1 3 1316 1 1 17 CYS HA H -5.959 4.119 -0.612 1.00 . A A . 17 CYS HA 1 1 3 1317 1 1 17 CYS HB2 H -8.034 5.158 -0.883 1.00 . A A . 17 CYS HB2 1 1 3 1318 1 1 17 CYS HB3 H -7.550 5.972 -2.375 1.00 . A A . 17 CYS HB3 1 1 3 1319 1 1 17 CYS N N -5.436 6.109 -0.741 1.00 . A A . 17 CYS N 1 1 3 1320 1 1 17 CYS O O -4.780 5.243 -3.430 1.00 . A A . 17 CYS O 1 1 3 1321 1 1 17 CYS SG S -8.015 3.646 -2.752 1.00 . A A . 17 CYS SG 1 1 3 1322 1 1 18 CYS C C -4.187 2.874 -4.970 1.00 . A A . 18 CYS C 1 1 3 1323 1 1 18 CYS CA C -3.930 2.425 -3.514 1.00 . A A . 18 CYS CA 1 1 3 1324 1 1 18 CYS CB C -4.328 0.948 -3.340 1.00 . A A . 18 CYS CB 1 1 3 1325 1 1 18 CYS H H -5.020 2.636 -1.710 1.00 . A A . 18 CYS H 1 1 3 1326 1 1 18 CYS HA H -2.869 2.545 -3.289 1.00 . A A . 18 CYS HA 1 1 3 1327 1 1 18 CYS HB2 H -4.797 0.830 -2.365 1.00 . A A . 18 CYS HB2 1 1 3 1328 1 1 18 CYS HB3 H -5.091 0.724 -4.081 1.00 . A A . 18 CYS HB3 1 1 3 1329 1 1 18 CYS N N -4.719 3.167 -2.522 1.00 . A A . 18 CYS N 1 1 3 1330 1 1 18 CYS O O -3.252 3.256 -5.671 1.00 . A A . 18 CYS O 1 1 3 1331 1 1 18 CYS SG S -3.082 -0.362 -3.461 1.00 . A A . 18 CYS SG 1 1 3 1332 1 1 19 GLU C C -6.707 4.632 -6.749 1.00 . A A . 19 GLU C 1 1 3 1333 1 1 19 GLU CA C -5.929 3.301 -6.719 1.00 . A A . 19 GLU CA 1 1 3 1334 1 1 19 GLU CB C -6.831 2.201 -7.324 1.00 . A A . 19 GLU CB 1 1 3 1335 1 1 19 GLU CD C -5.273 0.130 -7.221 1.00 . A A . 19 GLU CD 1 1 3 1336 1 1 19 GLU CG C -6.621 0.756 -6.855 1.00 . A A . 19 GLU CG 1 1 3 1337 1 1 19 GLU H H -6.169 2.639 -4.705 1.00 . A A . 19 GLU H 1 1 3 1338 1 1 19 GLU HA H -5.064 3.423 -7.365 1.00 . A A . 19 GLU HA 1 1 3 1339 1 1 19 GLU HB2 H -7.860 2.443 -7.071 1.00 . A A . 19 GLU HB2 1 1 3 1340 1 1 19 GLU HB3 H -6.754 2.241 -8.412 1.00 . A A . 19 GLU HB3 1 1 3 1341 1 1 19 GLU HG2 H -6.755 0.719 -5.775 1.00 . A A . 19 GLU HG2 1 1 3 1342 1 1 19 GLU HG3 H -7.416 0.146 -7.285 1.00 . A A . 19 GLU HG3 1 1 3 1343 1 1 19 GLU N N -5.468 2.932 -5.368 1.00 . A A . 19 GLU N 1 1 3 1344 1 1 19 GLU O O -7.190 5.046 -7.804 1.00 . A A . 19 GLU O 1 1 3 1345 1 1 19 GLU OE1 O -4.455 0.746 -7.944 1.00 . A A . 19 GLU OE1 1 1 3 1346 1 1 19 GLU OE2 O -5.025 -1.006 -6.756 1.00 . A A . 19 GLU OE2 1 1 3 1347 1 1 20 GLY C C -9.255 6.290 -5.674 1.00 . A A . 20 GLY C 1 1 3 1348 1 1 20 GLY CA C -7.742 6.497 -5.515 1.00 . A A . 20 GLY CA 1 1 3 1349 1 1 20 GLY H H -6.386 5.007 -4.789 1.00 . A A . 20 GLY H 1 1 3 1350 1 1 20 GLY HA2 H -7.565 6.977 -4.554 1.00 . A A . 20 GLY HA2 1 1 3 1351 1 1 20 GLY HA3 H -7.431 7.180 -6.301 1.00 . A A . 20 GLY HA3 1 1 3 1352 1 1 20 GLY N N -6.915 5.289 -5.604 1.00 . A A . 20 GLY N 1 1 3 1353 1 1 20 GLY O O -9.945 7.218 -6.087 1.00 . A A . 20 GLY O 1 1 3 1354 1 1 21 MET C C -11.858 5.516 -4.107 1.00 . A A . 21 MET C 1 1 3 1355 1 1 21 MET CA C -11.239 4.854 -5.356 1.00 . A A . 21 MET CA 1 1 3 1356 1 1 21 MET CB C -11.553 3.342 -5.380 1.00 . A A . 21 MET CB 1 1 3 1357 1 1 21 MET CE C -10.493 4.139 -8.753 1.00 . A A . 21 MET CE 1 1 3 1358 1 1 21 MET CG C -10.920 2.571 -6.537 1.00 . A A . 21 MET CG 1 1 3 1359 1 1 21 MET H H -9.169 4.372 -5.066 1.00 . A A . 21 MET H 1 1 3 1360 1 1 21 MET HA H -11.708 5.313 -6.228 1.00 . A A . 21 MET HA 1 1 3 1361 1 1 21 MET HB2 H -11.210 2.883 -4.459 1.00 . A A . 21 MET HB2 1 1 3 1362 1 1 21 MET HB3 H -12.632 3.194 -5.433 1.00 . A A . 21 MET HB3 1 1 3 1363 1 1 21 MET HE1 H -10.561 5.047 -8.156 1.00 . A A . 21 MET HE1 1 1 3 1364 1 1 21 MET HE2 H -9.480 3.741 -8.695 1.00 . A A . 21 MET HE2 1 1 3 1365 1 1 21 MET HE3 H -10.710 4.381 -9.790 1.00 . A A . 21 MET HE3 1 1 3 1366 1 1 21 MET HG2 H -9.857 2.787 -6.580 1.00 . A A . 21 MET HG2 1 1 3 1367 1 1 21 MET HG3 H -11.010 1.508 -6.320 1.00 . A A . 21 MET HG3 1 1 3 1368 1 1 21 MET N N -9.784 5.089 -5.415 1.00 . A A . 21 MET N 1 1 3 1369 1 1 21 MET O O -11.157 6.121 -3.292 1.00 . A A . 21 MET O 1 1 3 1370 1 1 21 MET SD S -11.668 2.892 -8.153 1.00 . A A . 21 MET SD 1 1 3 1371 1 1 22 VAL C C -13.206 5.103 -1.448 1.00 . A A . 22 VAL C 1 1 3 1372 1 1 22 VAL CA C -13.896 5.692 -2.682 1.00 . A A . 22 VAL CA 1 1 3 1373 1 1 22 VAL CB C -15.358 5.201 -2.750 1.00 . A A . 22 VAL CB 1 1 3 1374 1 1 22 VAL CG1 C -16.156 5.556 -1.491 1.00 . A A . 22 VAL CG1 1 1 3 1375 1 1 22 VAL CG2 C -16.089 5.806 -3.949 1.00 . A A . 22 VAL CG2 1 1 3 1376 1 1 22 VAL H H -13.691 4.895 -4.648 1.00 . A A . 22 VAL H 1 1 3 1377 1 1 22 VAL HA H -13.906 6.779 -2.595 1.00 . A A . 22 VAL HA 1 1 3 1378 1 1 22 VAL HB H -15.365 4.117 -2.869 1.00 . A A . 22 VAL HB 1 1 3 1379 1 1 22 VAL HG11 H -16.131 6.632 -1.321 1.00 . A A . 22 VAL HG11 1 1 3 1380 1 1 22 VAL HG12 H -17.193 5.241 -1.609 1.00 . A A . 22 VAL HG12 1 1 3 1381 1 1 22 VAL HG13 H -15.747 5.030 -0.629 1.00 . A A . 22 VAL HG13 1 1 3 1382 1 1 22 VAL HG21 H -16.134 6.892 -3.855 1.00 . A A . 22 VAL HG21 1 1 3 1383 1 1 22 VAL HG22 H -15.581 5.546 -4.871 1.00 . A A . 22 VAL HG22 1 1 3 1384 1 1 22 VAL HG23 H -17.098 5.401 -3.991 1.00 . A A . 22 VAL HG23 1 1 3 1385 1 1 22 VAL N N -13.165 5.326 -3.906 1.00 . A A . 22 VAL N 1 1 3 1386 1 1 22 VAL O O -13.189 3.888 -1.264 1.00 . A A . 22 VAL O 1 1 3 1387 1 1 23 CYS C C -12.742 6.002 1.844 1.00 . A A . 23 CYS C 1 1 3 1388 1 1 23 CYS CA C -11.914 5.652 0.603 1.00 . A A . 23 CYS CA 1 1 3 1389 1 1 23 CYS CB C -10.598 6.439 0.534 1.00 . A A . 23 CYS CB 1 1 3 1390 1 1 23 CYS H H -12.662 6.953 -0.888 1.00 . A A . 23 CYS H 1 1 3 1391 1 1 23 CYS HA H -11.675 4.589 0.617 1.00 . A A . 23 CYS HA 1 1 3 1392 1 1 23 CYS HB2 H -10.053 6.126 -0.356 1.00 . A A . 23 CYS HB2 1 1 3 1393 1 1 23 CYS HB3 H -10.840 7.496 0.408 1.00 . A A . 23 CYS HB3 1 1 3 1394 1 1 23 CYS N N -12.677 5.983 -0.597 1.00 . A A . 23 CYS N 1 1 3 1395 1 1 23 CYS O O -13.033 7.186 2.050 1.00 . A A . 23 CYS O 1 1 3 1396 1 1 23 CYS SG S -9.478 6.330 1.956 1.00 . A A . 23 CYS SG 1 1 3 1397 1 1 24 ARG C C -13.687 3.733 4.651 1.00 . A A . 24 ARG C 1 1 3 1398 1 1 24 ARG CA C -13.867 5.062 3.905 1.00 . A A . 24 ARG CA 1 1 3 1399 1 1 24 ARG CB C -15.385 5.344 3.793 1.00 . A A . 24 ARG CB 1 1 3 1400 1 1 24 ARG CD C -16.234 6.609 1.842 1.00 . A A . 24 ARG CD 1 1 3 1401 1 1 24 ARG CG C -15.853 6.734 3.330 1.00 . A A . 24 ARG CG 1 1 3 1402 1 1 24 ARG CZ C -16.212 8.809 0.697 1.00 . A A . 24 ARG CZ 1 1 3 1403 1 1 24 ARG H H -12.974 4.050 2.245 1.00 . A A . 24 ARG H 1 1 3 1404 1 1 24 ARG HA H -13.406 5.849 4.507 1.00 . A A . 24 ARG HA 1 1 3 1405 1 1 24 ARG HB2 H -15.836 4.578 3.161 1.00 . A A . 24 ARG HB2 1 1 3 1406 1 1 24 ARG HB3 H -15.803 5.208 4.792 1.00 . A A . 24 ARG HB3 1 1 3 1407 1 1 24 ARG HD2 H -15.367 6.361 1.257 1.00 . A A . 24 ARG HD2 1 1 3 1408 1 1 24 ARG HD3 H -16.989 5.847 1.729 1.00 . A A . 24 ARG HD3 1 1 3 1409 1 1 24 ARG HE H -17.749 8.115 1.767 1.00 . A A . 24 ARG HE 1 1 3 1410 1 1 24 ARG HG2 H -16.743 7.008 3.897 1.00 . A A . 24 ARG HG2 1 1 3 1411 1 1 24 ARG HG3 H -15.084 7.487 3.502 1.00 . A A . 24 ARG HG3 1 1 3 1412 1 1 24 ARG HH11 H -14.370 8.072 0.884 1.00 . A A . 24 ARG HH11 1 1 3 1413 1 1 24 ARG HH12 H -14.563 9.398 -0.270 1.00 . A A . 24 ARG HH12 1 1 3 1414 1 1 24 ARG HH21 H -17.872 9.919 0.421 1.00 . A A . 24 ARG HH21 1 1 3 1415 1 1 24 ARG HH22 H -16.384 10.602 -0.191 1.00 . A A . 24 ARG HH22 1 1 3 1416 1 1 24 ARG N N -13.195 4.982 2.588 1.00 . A A . 24 ARG N 1 1 3 1417 1 1 24 ARG NE N -16.812 7.896 1.439 1.00 . A A . 24 ARG NE 1 1 3 1418 1 1 24 ARG NH1 N -14.951 8.731 0.388 1.00 . A A . 24 ARG NH1 1 1 3 1419 1 1 24 ARG NH2 N -16.875 9.832 0.248 1.00 . A A . 24 ARG NH2 1 1 3 1420 1 1 24 ARG O O -14.420 2.780 4.379 1.00 . A A . 24 ARG O 1 1 3 1421 1 1 25 LEU C C -11.627 1.305 5.282 1.00 . A A . 25 LEU C 1 1 3 1422 1 1 25 LEU CA C -12.235 2.378 6.211 1.00 . A A . 25 LEU CA 1 1 3 1423 1 1 25 LEU CB C -13.360 1.787 7.094 1.00 . A A . 25 LEU CB 1 1 3 1424 1 1 25 LEU CD1 C -15.264 2.120 8.718 1.00 . A A . 25 LEU CD1 1 1 3 1425 1 1 25 LEU CD2 C -13.215 3.498 8.953 1.00 . A A . 25 LEU CD2 1 1 3 1426 1 1 25 LEU CG C -14.135 2.805 7.951 1.00 . A A . 25 LEU CG 1 1 3 1427 1 1 25 LEU H H -12.129 4.459 5.672 1.00 . A A . 25 LEU H 1 1 3 1428 1 1 25 LEU HA H -11.431 2.669 6.888 1.00 . A A . 25 LEU HA 1 1 3 1429 1 1 25 LEU HB2 H -14.077 1.277 6.449 1.00 . A A . 25 LEU HB2 1 1 3 1430 1 1 25 LEU HB3 H -12.928 1.028 7.746 1.00 . A A . 25 LEU HB3 1 1 3 1431 1 1 25 LEU HD11 H -15.935 1.631 8.013 1.00 . A A . 25 LEU HD11 1 1 3 1432 1 1 25 LEU HD12 H -15.834 2.862 9.276 1.00 . A A . 25 LEU HD12 1 1 3 1433 1 1 25 LEU HD13 H -14.859 1.386 9.411 1.00 . A A . 25 LEU HD13 1 1 3 1434 1 1 25 LEU HD21 H -12.430 4.047 8.435 1.00 . A A . 25 LEU HD21 1 1 3 1435 1 1 25 LEU HD22 H -12.781 2.757 9.619 1.00 . A A . 25 LEU HD22 1 1 3 1436 1 1 25 LEU HD23 H -13.789 4.210 9.536 1.00 . A A . 25 LEU HD23 1 1 3 1437 1 1 25 LEU HG H -14.598 3.547 7.307 1.00 . A A . 25 LEU HG 1 1 3 1438 1 1 25 LEU N N -12.681 3.618 5.524 1.00 . A A . 25 LEU N 1 1 3 1439 1 1 25 LEU O O -10.614 0.689 5.607 1.00 . A A . 25 LEU O 1 1 3 1440 1 1 26 TRP C C -11.657 1.190 1.609 1.00 . A A . 26 TRP C 1 1 3 1441 1 1 26 TRP CA C -11.584 0.426 2.942 1.00 . A A . 26 TRP CA 1 1 3 1442 1 1 26 TRP CB C -12.259 -0.955 2.916 1.00 . A A . 26 TRP CB 1 1 3 1443 1 1 26 TRP CD1 C -14.225 -1.331 4.476 1.00 . A A . 26 TRP CD1 1 1 3 1444 1 1 26 TRP CD2 C -14.865 -0.496 2.497 1.00 . A A . 26 TRP CD2 1 1 3 1445 1 1 26 TRP CE2 C -16.042 -0.634 3.294 1.00 . A A . 26 TRP CE2 1 1 3 1446 1 1 26 TRP CE3 C -15.030 0.085 1.219 1.00 . A A . 26 TRP CE3 1 1 3 1447 1 1 26 TRP CG C -13.723 -1.009 3.259 1.00 . A A . 26 TRP CG 1 1 3 1448 1 1 26 TRP CH2 C -17.443 0.306 1.560 1.00 . A A . 26 TRP CH2 1 1 3 1449 1 1 26 TRP CZ2 C -17.314 -0.255 2.841 1.00 . A A . 26 TRP CZ2 1 1 3 1450 1 1 26 TRP CZ3 C -16.303 0.473 0.754 1.00 . A A . 26 TRP CZ3 1 1 3 1451 1 1 26 TRP H H -12.969 1.722 3.865 1.00 . A A . 26 TRP H 1 1 3 1452 1 1 26 TRP HA H -10.523 0.254 3.121 1.00 . A A . 26 TRP HA 1 1 3 1453 1 1 26 TRP HB2 H -12.101 -1.427 1.950 1.00 . A A . 26 TRP HB2 1 1 3 1454 1 1 26 TRP HB3 H -11.736 -1.569 3.648 1.00 . A A . 26 TRP HB3 1 1 3 1455 1 1 26 TRP HD1 H -13.635 -1.671 5.322 1.00 . A A . 26 TRP HD1 1 1 3 1456 1 1 26 TRP HE1 H -16.189 -1.394 5.270 1.00 . A A . 26 TRP HE1 1 1 3 1457 1 1 26 TRP HE3 H -14.165 0.261 0.601 1.00 . A A . 26 TRP HE3 1 1 3 1458 1 1 26 TRP HH2 H -18.409 0.642 1.205 1.00 . A A . 26 TRP HH2 1 1 3 1459 1 1 26 TRP HZ2 H -18.171 -0.358 3.491 1.00 . A A . 26 TRP HZ2 1 1 3 1460 1 1 26 TRP HZ3 H -16.402 0.938 -0.218 1.00 . A A . 26 TRP HZ3 1 1 3 1461 1 1 26 TRP N N -12.109 1.218 4.049 1.00 . A A . 26 TRP N 1 1 3 1462 1 1 26 TRP NE1 N -15.595 -1.172 4.478 1.00 . A A . 26 TRP NE1 1 1 3 1463 1 1 26 TRP O O -12.138 2.322 1.571 1.00 . A A . 26 TRP O 1 1 3 1464 1 1 27 CYS C C -10.989 0.166 -1.908 1.00 . A A . 27 CYS C 1 1 3 1465 1 1 27 CYS CA C -11.055 1.232 -0.791 1.00 . A A . 27 CYS CA 1 1 3 1466 1 1 27 CYS CB C -9.860 2.196 -0.824 1.00 . A A . 27 CYS CB 1 1 3 1467 1 1 27 CYS H H -10.654 -0.284 0.641 1.00 . A A . 27 CYS H 1 1 3 1468 1 1 27 CYS HA H -11.964 1.813 -0.937 1.00 . A A . 27 CYS HA 1 1 3 1469 1 1 27 CYS HB2 H -9.843 2.769 0.099 1.00 . A A . 27 CYS HB2 1 1 3 1470 1 1 27 CYS HB3 H -8.931 1.627 -0.892 1.00 . A A . 27 CYS HB3 1 1 3 1471 1 1 27 CYS N N -11.100 0.613 0.537 1.00 . A A . 27 CYS N 1 1 3 1472 1 1 27 CYS O O -9.906 -0.197 -2.358 1.00 . A A . 27 CYS O 1 1 3 1473 1 1 27 CYS SG S -9.936 3.379 -2.180 1.00 . A A . 27 CYS SG 1 1 3 1474 1 1 28 LYS C C -12.150 -1.210 -4.668 1.00 . A A . 28 LYS C 1 1 3 1475 1 1 28 LYS CA C -12.233 -1.591 -3.182 1.00 . A A . 28 LYS CA 1 1 3 1476 1 1 28 LYS CB C -13.476 -2.468 -2.895 1.00 . A A . 28 LYS CB 1 1 3 1477 1 1 28 LYS CD C -13.556 -2.760 -0.329 1.00 . A A . 28 LYS CD 1 1 3 1478 1 1 28 LYS CE C -13.529 -3.796 0.803 1.00 . A A . 28 LYS CE 1 1 3 1479 1 1 28 LYS CG C -13.371 -3.424 -1.698 1.00 . A A . 28 LYS CG 1 1 3 1480 1 1 28 LYS H H -12.993 -0.065 -1.865 1.00 . A A . 28 LYS H 1 1 3 1481 1 1 28 LYS HA H -11.353 -2.218 -3.018 1.00 . A A . 28 LYS HA 1 1 3 1482 1 1 28 LYS HB2 H -14.363 -1.841 -2.787 1.00 . A A . 28 LYS HB2 1 1 3 1483 1 1 28 LYS HB3 H -13.636 -3.107 -3.766 1.00 . A A . 28 LYS HB3 1 1 3 1484 1 1 28 LYS HD2 H -12.746 -2.052 -0.172 1.00 . A A . 28 LYS HD2 1 1 3 1485 1 1 28 LYS HD3 H -14.500 -2.217 -0.305 1.00 . A A . 28 LYS HD3 1 1 3 1486 1 1 28 LYS HE2 H -12.643 -4.424 0.679 1.00 . A A . 28 LYS HE2 1 1 3 1487 1 1 28 LYS HE3 H -13.446 -3.274 1.760 1.00 . A A . 28 LYS HE3 1 1 3 1488 1 1 28 LYS HG2 H -14.157 -4.166 -1.817 1.00 . A A . 28 LYS HG2 1 1 3 1489 1 1 28 LYS HG3 H -12.410 -3.941 -1.729 1.00 . A A . 28 LYS HG3 1 1 3 1490 1 1 28 LYS HZ1 H -14.645 -5.388 1.534 1.00 . A A . 28 LYS HZ1 1 1 3 1491 1 1 28 LYS HZ2 H -14.915 -5.112 -0.052 1.00 . A A . 28 LYS HZ2 1 1 3 1492 1 1 28 LYS HZ3 H -15.569 -4.115 1.068 1.00 . A A . 28 LYS HZ3 1 1 3 1493 1 1 28 LYS N N -12.141 -0.433 -2.263 1.00 . A A . 28 LYS N 1 1 3 1494 1 1 28 LYS NZ N -14.736 -4.653 0.835 1.00 . A A . 28 LYS NZ 1 1 3 1495 1 1 28 LYS O O -11.099 -1.331 -5.296 1.00 . A A . 28 LYS O 1 1 3 1496 1 1 29 LYS C C -14.701 0.365 -6.878 1.00 . A A . 29 LYS C 1 1 3 1497 1 1 29 LYS CA C -13.391 -0.386 -6.669 1.00 . A A . 29 LYS CA 1 1 3 1498 1 1 29 LYS CB C -13.285 -1.595 -7.620 1.00 . A A . 29 LYS CB 1 1 3 1499 1 1 29 LYS CD C -11.724 -2.522 -9.427 1.00 . A A . 29 LYS CD 1 1 3 1500 1 1 29 LYS CE C -10.330 -2.808 -8.836 1.00 . A A . 29 LYS CE 1 1 3 1501 1 1 29 LYS CG C -12.412 -1.275 -8.849 1.00 . A A . 29 LYS CG 1 1 3 1502 1 1 29 LYS H H -14.134 -0.843 -4.722 1.00 . A A . 29 LYS H 1 1 3 1503 1 1 29 LYS HA H -12.571 0.297 -6.867 1.00 . A A . 29 LYS HA 1 1 3 1504 1 1 29 LYS HB2 H -12.851 -2.433 -7.082 1.00 . A A . 29 LYS HB2 1 1 3 1505 1 1 29 LYS HB3 H -14.275 -1.918 -7.949 1.00 . A A . 29 LYS HB3 1 1 3 1506 1 1 29 LYS HD2 H -12.368 -3.393 -9.301 1.00 . A A . 29 LYS HD2 1 1 3 1507 1 1 29 LYS HD3 H -11.596 -2.365 -10.498 1.00 . A A . 29 LYS HD3 1 1 3 1508 1 1 29 LYS HE2 H -9.902 -3.652 -9.384 1.00 . A A . 29 LYS HE2 1 1 3 1509 1 1 29 LYS HE3 H -9.686 -1.940 -9.009 1.00 . A A . 29 LYS HE3 1 1 3 1510 1 1 29 LYS HG2 H -13.051 -0.832 -9.614 1.00 . A A . 29 LYS HG2 1 1 3 1511 1 1 29 LYS HG3 H -11.639 -0.548 -8.597 1.00 . A A . 29 LYS HG3 1 1 3 1512 1 1 29 LYS HZ1 H -10.587 -2.325 -6.814 1.00 . A A . 29 LYS HZ1 1 1 3 1513 1 1 29 LYS HZ2 H -9.485 -3.508 -7.049 1.00 . A A . 29 LYS HZ2 1 1 3 1514 1 1 29 LYS HZ3 H -11.069 -3.841 -7.188 1.00 . A A . 29 LYS HZ3 1 1 3 1515 1 1 29 LYS N N -13.284 -0.829 -5.269 1.00 . A A . 29 LYS N 1 1 3 1516 1 1 29 LYS NZ N -10.365 -3.133 -7.389 1.00 . A A . 29 LYS NZ 1 1 3 1517 1 1 29 LYS O O -15.727 -0.048 -6.334 1.00 . A A . 29 LYS O 1 1 3 1518 1 1 30 LYS C C -15.497 3.314 -9.076 1.00 . A A . 30 LYS C 1 1 3 1519 1 1 30 LYS CA C -15.792 2.349 -7.913 1.00 . A A . 30 LYS CA 1 1 3 1520 1 1 30 LYS CB C -16.249 3.073 -6.620 1.00 . A A . 30 LYS CB 1 1 3 1521 1 1 30 LYS CD C -18.753 2.495 -6.699 1.00 . A A . 30 LYS CD 1 1 3 1522 1 1 30 LYS CE C -19.890 2.838 -7.669 1.00 . A A . 30 LYS CE 1 1 3 1523 1 1 30 LYS CG C -17.693 3.606 -6.677 1.00 . A A . 30 LYS CG 1 1 3 1524 1 1 30 LYS H H -13.736 1.749 -7.979 1.00 . A A . 30 LYS H 1 1 3 1525 1 1 30 LYS HA H -16.596 1.700 -8.259 1.00 . A A . 30 LYS HA 1 1 3 1526 1 1 30 LYS HB2 H -16.188 2.403 -5.762 1.00 . A A . 30 LYS HB2 1 1 3 1527 1 1 30 LYS HB3 H -15.566 3.899 -6.424 1.00 . A A . 30 LYS HB3 1 1 3 1528 1 1 30 LYS HD2 H -18.302 1.548 -6.992 1.00 . A A . 30 LYS HD2 1 1 3 1529 1 1 30 LYS HD3 H -19.155 2.366 -5.694 1.00 . A A . 30 LYS HD3 1 1 3 1530 1 1 30 LYS HE2 H -20.563 3.562 -7.200 1.00 . A A . 30 LYS HE2 1 1 3 1531 1 1 30 LYS HE3 H -19.466 3.302 -8.564 1.00 . A A . 30 LYS HE3 1 1 3 1532 1 1 30 LYS HG2 H -17.872 4.214 -5.794 1.00 . A A . 30 LYS HG2 1 1 3 1533 1 1 30 LYS HG3 H -17.813 4.245 -7.549 1.00 . A A . 30 LYS HG3 1 1 3 1534 1 1 30 LYS HZ1 H -21.358 1.809 -8.735 1.00 . A A . 30 LYS HZ1 1 1 3 1535 1 1 30 LYS HZ2 H -21.013 1.147 -7.250 1.00 . A A . 30 LYS HZ2 1 1 3 1536 1 1 30 LYS HZ3 H -19.977 0.967 -8.517 1.00 . A A . 30 LYS HZ3 1 1 3 1537 1 1 30 LYS N N -14.640 1.484 -7.609 1.00 . A A . 30 LYS N 1 1 3 1538 1 1 30 LYS NZ N -20.620 1.615 -8.064 1.00 . A A . 30 LYS NZ 1 1 3 1539 1 1 30 LYS O O -15.771 4.512 -8.976 1.00 . A A . 30 LYS O 1 1 3 1540 1 1 31 LEU C C -14.476 2.723 -12.601 1.00 . A A . 31 LEU C 1 1 3 1541 1 1 31 LEU CA C -14.565 3.616 -11.355 1.00 . A A . 31 LEU CA 1 1 3 1542 1 1 31 LEU CB C -13.253 4.397 -11.117 1.00 . A A . 31 LEU CB 1 1 3 1543 1 1 31 LEU CD1 C -13.993 6.582 -12.173 1.00 . A A . 31 LEU CD1 1 1 3 1544 1 1 31 LEU CD2 C -11.577 6.134 -11.831 1.00 . A A . 31 LEU CD2 1 1 3 1545 1 1 31 LEU CG C -12.923 5.488 -12.155 1.00 . A A . 31 LEU CG 1 1 3 1546 1 1 31 LEU H H -14.726 1.832 -10.209 1.00 . A A . 31 LEU H 1 1 3 1547 1 1 31 LEU HA H -15.379 4.322 -11.517 1.00 . A A . 31 LEU HA 1 1 3 1548 1 1 31 LEU HB2 H -13.294 4.872 -10.136 1.00 . A A . 31 LEU HB2 1 1 3 1549 1 1 31 LEU HB3 H -12.434 3.676 -11.106 1.00 . A A . 31 LEU HB3 1 1 3 1550 1 1 31 LEU HD11 H -13.669 7.386 -12.827 1.00 . A A . 31 LEU HD11 1 1 3 1551 1 1 31 LEU HD12 H -14.147 6.972 -11.167 1.00 . A A . 31 LEU HD12 1 1 3 1552 1 1 31 LEU HD13 H -14.932 6.193 -12.562 1.00 . A A . 31 LEU HD13 1 1 3 1553 1 1 31 LEU HD21 H -11.338 6.890 -12.577 1.00 . A A . 31 LEU HD21 1 1 3 1554 1 1 31 LEU HD22 H -10.793 5.378 -11.861 1.00 . A A . 31 LEU HD22 1 1 3 1555 1 1 31 LEU HD23 H -11.599 6.591 -10.841 1.00 . A A . 31 LEU HD23 1 1 3 1556 1 1 31 LEU HG H -12.843 5.051 -13.148 1.00 . A A . 31 LEU HG 1 1 3 1557 1 1 31 LEU N N -14.883 2.828 -10.155 1.00 . A A . 31 LEU N 1 1 3 1558 1 1 31 LEU O O -14.268 1.517 -12.487 1.00 . A A . 31 LEU O 1 1 3 1559 1 1 32 LEU C C -13.413 3.521 -15.844 1.00 . A A . 32 LEU C 1 1 3 1560 1 1 32 LEU CA C -14.401 2.644 -15.079 1.00 . A A . 32 LEU CA 1 1 3 1561 1 1 32 LEU CB C -15.732 2.646 -15.871 1.00 . A A . 32 LEU CB 1 1 3 1562 1 1 32 LEU CD1 C -17.720 2.497 -14.277 1.00 . A A . 32 LEU CD1 1 1 3 1563 1 1 32 LEU CD2 C -17.631 1.043 -16.277 1.00 . A A . 32 LEU CD2 1 1 3 1564 1 1 32 LEU CG C -16.770 1.718 -15.199 1.00 . A A . 32 LEU CG 1 1 3 1565 1 1 32 LEU H H -14.801 4.292 -13.832 1.00 . A A . 32 LEU H 1 1 3 1566 1 1 32 LEU HA H -14.011 1.640 -14.982 1.00 . A A . 32 LEU HA 1 1 3 1567 1 1 32 LEU HB2 H -16.128 3.659 -15.960 1.00 . A A . 32 LEU HB2 1 1 3 1568 1 1 32 LEU HB3 H -15.511 2.278 -16.875 1.00 . A A . 32 LEU HB3 1 1 3 1569 1 1 32 LEU HD11 H -18.446 1.815 -13.839 1.00 . A A . 32 LEU HD11 1 1 3 1570 1 1 32 LEU HD12 H -18.250 3.264 -14.845 1.00 . A A . 32 LEU HD12 1 1 3 1571 1 1 32 LEU HD13 H -17.174 2.971 -13.465 1.00 . A A . 32 LEU HD13 1 1 3 1572 1 1 32 LEU HD21 H -18.359 0.379 -15.811 1.00 . A A . 32 LEU HD21 1 1 3 1573 1 1 32 LEU HD22 H -17.000 0.446 -16.936 1.00 . A A . 32 LEU HD22 1 1 3 1574 1 1 32 LEU HD23 H -18.149 1.798 -16.872 1.00 . A A . 32 LEU HD23 1 1 3 1575 1 1 32 LEU HG H -16.263 0.938 -14.627 1.00 . A A . 32 LEU HG 1 1 3 1576 1 1 32 LEU N N -14.629 3.300 -13.786 1.00 . A A . 32 LEU N 1 1 3 1577 1 1 32 LEU O O -13.642 4.690 -16.052 1.00 . A A . 32 LEU O 1 1 3 1578 1 1 32 LEU OXT O -12.501 3.096 -16.177 1.00 . A A . 32 LEU OXT 1 1 4 1579 1 1 1 GLY C C 1.442 -0.919 -1.543 1.00 . A A . 1 GLY C 1 1 4 1580 1 1 1 GLY CA C 2.543 -0.559 -0.559 1.00 . A A . 1 GLY CA 1 1 4 1581 1 1 1 GLY H1 H 1.931 1.333 -0.078 1.00 . A A . 1 GLY H1 1 1 4 1582 1 1 1 GLY H2 H 1.288 0.166 0.906 1.00 . A A . 1 GLY H2 1 1 4 1583 1 1 1 GLY H3 H 2.854 0.621 1.082 1.00 . A A . 1 GLY H3 1 1 4 1584 1 1 1 GLY HA2 H 3.384 -0.166 -1.120 1.00 . A A . 1 GLY HA2 1 1 4 1585 1 1 1 GLY HA3 H 2.850 -1.454 -0.020 1.00 . A A . 1 GLY HA3 1 1 4 1586 1 1 1 GLY N N 2.117 0.465 0.408 1.00 . A A . 1 GLY N 1 1 4 1587 1 1 1 GLY O O 0.466 -0.173 -1.652 1.00 . A A . 1 GLY O 1 1 4 1588 1 1 2 PRO C C -0.525 -3.269 -2.998 1.00 . A A . 2 PRO C 1 1 4 1589 1 1 2 PRO CA C 0.697 -2.420 -3.388 1.00 . A A . 2 PRO CA 1 1 4 1590 1 1 2 PRO CB C 1.638 -3.177 -4.320 1.00 . A A . 2 PRO CB 1 1 4 1591 1 1 2 PRO CD C 2.682 -2.987 -2.183 1.00 . A A . 2 PRO CD 1 1 4 1592 1 1 2 PRO CG C 2.513 -3.965 -3.347 1.00 . A A . 2 PRO CG 1 1 4 1593 1 1 2 PRO HA H 0.337 -1.524 -3.896 1.00 . A A . 2 PRO HA 1 1 4 1594 1 1 2 PRO HB2 H 1.116 -3.827 -5.020 1.00 . A A . 2 PRO HB2 1 1 4 1595 1 1 2 PRO HB3 H 2.247 -2.451 -4.856 1.00 . A A . 2 PRO HB3 1 1 4 1596 1 1 2 PRO HD2 H 2.676 -3.530 -1.237 1.00 . A A . 2 PRO HD2 1 1 4 1597 1 1 2 PRO HD3 H 3.623 -2.450 -2.305 1.00 . A A . 2 PRO HD3 1 1 4 1598 1 1 2 PRO HG2 H 1.981 -4.856 -3.010 1.00 . A A . 2 PRO HG2 1 1 4 1599 1 1 2 PRO HG3 H 3.471 -4.237 -3.790 1.00 . A A . 2 PRO HG3 1 1 4 1600 1 1 2 PRO N N 1.561 -2.054 -2.259 1.00 . A A . 2 PRO N 1 1 4 1601 1 1 2 PRO O O -1.349 -3.611 -3.847 1.00 . A A . 2 PRO O 1 1 4 1602 1 1 3 TYR C C -2.676 -3.649 -0.202 1.00 . A A . 3 TYR C 1 1 4 1603 1 1 3 TYR CA C -1.731 -4.410 -1.130 1.00 . A A . 3 TYR CA 1 1 4 1604 1 1 3 TYR CB C -1.279 -5.807 -0.680 1.00 . A A . 3 TYR CB 1 1 4 1605 1 1 3 TYR CD1 C 1.108 -6.628 -0.801 1.00 . A A . 3 TYR CD1 1 1 4 1606 1 1 3 TYR CD2 C 0.461 -5.229 1.084 1.00 . A A . 3 TYR CD2 1 1 4 1607 1 1 3 TYR CE1 C 2.424 -6.685 -0.312 1.00 . A A . 3 TYR CE1 1 1 4 1608 1 1 3 TYR CE2 C 1.781 -5.276 1.573 1.00 . A A . 3 TYR CE2 1 1 4 1609 1 1 3 TYR CG C 0.126 -5.890 -0.114 1.00 . A A . 3 TYR CG 1 1 4 1610 1 1 3 TYR CZ C 2.770 -5.991 0.865 1.00 . A A . 3 TYR CZ 1 1 4 1611 1 1 3 TYR H H 0.085 -3.327 -1.084 1.00 . A A . 3 TYR H 1 1 4 1612 1 1 3 TYR HA H -2.390 -4.655 -1.963 1.00 . A A . 3 TYR HA 1 1 4 1613 1 1 3 TYR HB2 H -1.978 -6.174 0.069 1.00 . A A . 3 TYR HB2 1 1 4 1614 1 1 3 TYR HB3 H -1.348 -6.477 -1.538 1.00 . A A . 3 TYR HB3 1 1 4 1615 1 1 3 TYR HD1 H 0.858 -7.145 -1.719 1.00 . A A . 3 TYR HD1 1 1 4 1616 1 1 3 TYR HD2 H -0.292 -4.670 1.623 1.00 . A A . 3 TYR HD2 1 1 4 1617 1 1 3 TYR HE1 H 3.176 -7.245 -0.848 1.00 . A A . 3 TYR HE1 1 1 4 1618 1 1 3 TYR HE2 H 2.042 -4.754 2.482 1.00 . A A . 3 TYR HE2 1 1 4 1619 1 1 3 TYR HH H 4.204 -5.333 1.988 1.00 . A A . 3 TYR HH 1 1 4 1620 1 1 3 TYR N N -0.656 -3.607 -1.712 1.00 . A A . 3 TYR N 1 1 4 1621 1 1 3 TYR O O -2.578 -3.725 1.023 1.00 . A A . 3 TYR O 1 1 4 1622 1 1 3 TYR OH O 4.047 -6.031 1.322 1.00 . A A . 3 TYR OH 1 1 4 1623 1 1 4 CYS C C -5.850 -1.919 -0.520 1.00 . A A . 4 CYS C 1 1 4 1624 1 1 4 CYS CA C -4.375 -1.861 -0.099 1.00 . A A . 4 CYS CA 1 1 4 1625 1 1 4 CYS CB C -3.774 -0.451 -0.186 1.00 . A A . 4 CYS CB 1 1 4 1626 1 1 4 CYS H H -3.427 -2.712 -1.810 1.00 . A A . 4 CYS H 1 1 4 1627 1 1 4 CYS HA H -4.380 -2.134 0.957 1.00 . A A . 4 CYS HA 1 1 4 1628 1 1 4 CYS HB2 H -4.593 0.257 -0.180 1.00 . A A . 4 CYS HB2 1 1 4 1629 1 1 4 CYS HB3 H -3.217 -0.284 0.735 1.00 . A A . 4 CYS HB3 1 1 4 1630 1 1 4 CYS N N -3.527 -2.817 -0.810 1.00 . A A . 4 CYS N 1 1 4 1631 1 1 4 CYS O O -6.691 -2.318 0.280 1.00 . A A . 4 CYS O 1 1 4 1632 1 1 4 CYS SG S -2.679 0.011 -1.565 1.00 . A A . 4 CYS SG 1 1 4 1633 1 1 5 GLN C C -7.730 -3.510 -2.478 1.00 . A A . 5 GLN C 1 1 4 1634 1 1 5 GLN CA C -7.422 -1.995 -2.458 1.00 . A A . 5 GLN CA 1 1 4 1635 1 1 5 GLN CB C -7.365 -1.315 -3.844 1.00 . A A . 5 GLN CB 1 1 4 1636 1 1 5 GLN CD C -7.715 -2.925 -5.823 1.00 . A A . 5 GLN CD 1 1 4 1637 1 1 5 GLN CG C -8.304 -1.822 -4.943 1.00 . A A . 5 GLN CG 1 1 4 1638 1 1 5 GLN H H -5.393 -1.355 -2.396 1.00 . A A . 5 GLN H 1 1 4 1639 1 1 5 GLN HA H -8.220 -1.528 -1.882 1.00 . A A . 5 GLN HA 1 1 4 1640 1 1 5 GLN HB2 H -7.604 -0.264 -3.681 1.00 . A A . 5 GLN HB2 1 1 4 1641 1 1 5 GLN HB3 H -6.346 -1.356 -4.228 1.00 . A A . 5 GLN HB3 1 1 4 1642 1 1 5 GLN HE21 H -6.039 -1.888 -6.410 1.00 . A A . 5 GLN HE21 1 1 4 1643 1 1 5 GLN HE22 H -6.211 -3.544 -6.971 1.00 . A A . 5 GLN HE22 1 1 4 1644 1 1 5 GLN HG2 H -9.233 -2.164 -4.490 1.00 . A A . 5 GLN HG2 1 1 4 1645 1 1 5 GLN HG3 H -8.537 -0.985 -5.598 1.00 . A A . 5 GLN HG3 1 1 4 1646 1 1 5 GLN N N -6.136 -1.697 -1.804 1.00 . A A . 5 GLN N 1 1 4 1647 1 1 5 GLN NE2 N -6.558 -2.774 -6.429 1.00 . A A . 5 GLN NE2 1 1 4 1648 1 1 5 GLN O O -8.882 -3.940 -2.414 1.00 . A A . 5 GLN O 1 1 4 1649 1 1 5 GLN OE1 O -8.276 -4.004 -5.936 1.00 . A A . 5 GLN OE1 1 1 4 1650 1 1 6 LYS C C -6.855 -6.192 -0.698 1.00 . A A . 6 LYS C 1 1 4 1651 1 1 6 LYS CA C -6.639 -5.751 -2.156 1.00 . A A . 6 LYS CA 1 1 4 1652 1 1 6 LYS CB C -5.287 -6.283 -2.692 1.00 . A A . 6 LYS CB 1 1 4 1653 1 1 6 LYS CD C -5.834 -8.441 -3.873 1.00 . A A . 6 LYS CD 1 1 4 1654 1 1 6 LYS CE C -6.183 -9.093 -5.211 1.00 . A A . 6 LYS CE 1 1 4 1655 1 1 6 LYS CG C -5.436 -6.972 -4.056 1.00 . A A . 6 LYS CG 1 1 4 1656 1 1 6 LYS H H -5.766 -3.851 -2.479 1.00 . A A . 6 LYS H 1 1 4 1657 1 1 6 LYS HA H -7.459 -6.208 -2.714 1.00 . A A . 6 LYS HA 1 1 4 1658 1 1 6 LYS HB2 H -4.577 -5.462 -2.797 1.00 . A A . 6 LYS HB2 1 1 4 1659 1 1 6 LYS HB3 H -4.842 -6.986 -1.985 1.00 . A A . 6 LYS HB3 1 1 4 1660 1 1 6 LYS HD2 H -4.997 -8.969 -3.414 1.00 . A A . 6 LYS HD2 1 1 4 1661 1 1 6 LYS HD3 H -6.693 -8.517 -3.205 1.00 . A A . 6 LYS HD3 1 1 4 1662 1 1 6 LYS HE2 H -7.177 -8.751 -5.516 1.00 . A A . 6 LYS HE2 1 1 4 1663 1 1 6 LYS HE3 H -5.459 -8.784 -5.970 1.00 . A A . 6 LYS HE3 1 1 4 1664 1 1 6 LYS HG2 H -6.176 -6.446 -4.661 1.00 . A A . 6 LYS HG2 1 1 4 1665 1 1 6 LYS HG3 H -4.481 -6.934 -4.580 1.00 . A A . 6 LYS HG3 1 1 4 1666 1 1 6 LYS HZ1 H -5.221 -10.928 -5.178 1.00 . A A . 6 LYS HZ1 1 1 4 1667 1 1 6 LYS HZ2 H -6.758 -11.003 -5.795 1.00 . A A . 6 LYS HZ2 1 1 4 1668 1 1 6 LYS HZ3 H -6.527 -10.855 -4.183 1.00 . A A . 6 LYS HZ3 1 1 4 1669 1 1 6 LYS N N -6.659 -4.306 -2.396 1.00 . A A . 6 LYS N 1 1 4 1670 1 1 6 LYS NZ N -6.169 -10.566 -5.088 1.00 . A A . 6 LYS NZ 1 1 4 1671 1 1 6 LYS O O -7.007 -7.393 -0.493 1.00 . A A . 6 LYS O 1 1 4 1672 1 1 7 TRP C C -7.100 -4.698 2.756 1.00 . A A . 7 TRP C 1 1 4 1673 1 1 7 TRP CA C -6.616 -5.727 1.714 1.00 . A A . 7 TRP CA 1 1 4 1674 1 1 7 TRP CB C -5.154 -6.137 1.950 1.00 . A A . 7 TRP CB 1 1 4 1675 1 1 7 TRP CD1 C -4.444 -6.784 4.318 1.00 . A A . 7 TRP CD1 1 1 4 1676 1 1 7 TRP CD2 C -5.498 -8.428 3.220 1.00 . A A . 7 TRP CD2 1 1 4 1677 1 1 7 TRP CE2 C -5.161 -8.943 4.503 1.00 . A A . 7 TRP CE2 1 1 4 1678 1 1 7 TRP CE3 C -6.267 -9.261 2.379 1.00 . A A . 7 TRP CE3 1 1 4 1679 1 1 7 TRP CG C -4.957 -7.077 3.100 1.00 . A A . 7 TRP CG 1 1 4 1680 1 1 7 TRP CH2 C -6.276 -11.042 4.048 1.00 . A A . 7 TRP CH2 1 1 4 1681 1 1 7 TRP CZ2 C -5.519 -10.234 4.910 1.00 . A A . 7 TRP CZ2 1 1 4 1682 1 1 7 TRP CZ3 C -6.669 -10.542 2.796 1.00 . A A . 7 TRP CZ3 1 1 4 1683 1 1 7 TRP H H -6.719 -4.317 0.094 1.00 . A A . 7 TRP H 1 1 4 1684 1 1 7 TRP HA H -7.241 -6.609 1.859 1.00 . A A . 7 TRP HA 1 1 4 1685 1 1 7 TRP HB2 H -4.778 -6.635 1.060 1.00 . A A . 7 TRP HB2 1 1 4 1686 1 1 7 TRP HB3 H -4.548 -5.241 2.095 1.00 . A A . 7 TRP HB3 1 1 4 1687 1 1 7 TRP HD1 H -4.037 -5.821 4.609 1.00 . A A . 7 TRP HD1 1 1 4 1688 1 1 7 TRP HE1 H -4.049 -7.974 6.031 1.00 . A A . 7 TRP HE1 1 1 4 1689 1 1 7 TRP HE3 H -6.546 -8.908 1.399 1.00 . A A . 7 TRP HE3 1 1 4 1690 1 1 7 TRP HH2 H -6.548 -12.046 4.341 1.00 . A A . 7 TRP HH2 1 1 4 1691 1 1 7 TRP HZ2 H -5.209 -10.606 5.869 1.00 . A A . 7 TRP HZ2 1 1 4 1692 1 1 7 TRP HZ3 H -7.249 -11.157 2.127 1.00 . A A . 7 TRP HZ3 1 1 4 1693 1 1 7 TRP N N -6.757 -5.303 0.306 1.00 . A A . 7 TRP N 1 1 4 1694 1 1 7 TRP NE1 N -4.483 -7.912 5.112 1.00 . A A . 7 TRP NE1 1 1 4 1695 1 1 7 TRP O O -6.532 -4.572 3.842 1.00 . A A . 7 TRP O 1 1 4 1696 1 1 8 MET C C -8.014 -2.191 4.281 1.00 . A A . 8 MET C 1 1 4 1697 1 1 8 MET CA C -8.897 -3.108 3.405 1.00 . A A . 8 MET CA 1 1 4 1698 1 1 8 MET CB C -9.893 -3.953 4.225 1.00 . A A . 8 MET CB 1 1 4 1699 1 1 8 MET CE C -11.452 -6.820 4.979 1.00 . A A . 8 MET CE 1 1 4 1700 1 1 8 MET CG C -10.949 -4.621 3.334 1.00 . A A . 8 MET CG 1 1 4 1701 1 1 8 MET H H -8.604 -4.120 1.552 1.00 . A A . 8 MET H 1 1 4 1702 1 1 8 MET HA H -9.475 -2.444 2.775 1.00 . A A . 8 MET HA 1 1 4 1703 1 1 8 MET HB2 H -9.352 -4.714 4.790 1.00 . A A . 8 MET HB2 1 1 4 1704 1 1 8 MET HB3 H -10.411 -3.304 4.932 1.00 . A A . 8 MET HB3 1 1 4 1705 1 1 8 MET HE1 H -10.964 -7.414 4.206 1.00 . A A . 8 MET HE1 1 1 4 1706 1 1 8 MET HE2 H -10.704 -6.456 5.684 1.00 . A A . 8 MET HE2 1 1 4 1707 1 1 8 MET HE3 H -12.172 -7.442 5.511 1.00 . A A . 8 MET HE3 1 1 4 1708 1 1 8 MET HG2 H -11.379 -3.858 2.683 1.00 . A A . 8 MET HG2 1 1 4 1709 1 1 8 MET HG3 H -10.465 -5.365 2.702 1.00 . A A . 8 MET HG3 1 1 4 1710 1 1 8 MET N N -8.163 -3.955 2.454 1.00 . A A . 8 MET N 1 1 4 1711 1 1 8 MET O O -8.023 -2.276 5.507 1.00 . A A . 8 MET O 1 1 4 1712 1 1 8 MET SD S -12.317 -5.418 4.220 1.00 . A A . 8 MET SD 1 1 4 1713 1 1 9 GLN C C -6.192 0.306 5.385 1.00 . A A . 9 GLN C 1 1 4 1714 1 1 9 GLN CA C -6.018 -0.649 4.175 1.00 . A A . 9 GLN CA 1 1 4 1715 1 1 9 GLN CB C -5.363 0.118 3.007 1.00 . A A . 9 GLN CB 1 1 4 1716 1 1 9 GLN CD C -5.523 2.128 1.412 1.00 . A A . 9 GLN CD 1 1 4 1717 1 1 9 GLN CG C -6.177 1.344 2.546 1.00 . A A . 9 GLN CG 1 1 4 1718 1 1 9 GLN H H -7.258 -1.399 2.625 1.00 . A A . 9 GLN H 1 1 4 1719 1 1 9 GLN HA H -5.321 -1.423 4.501 1.00 . A A . 9 GLN HA 1 1 4 1720 1 1 9 GLN HB2 H -4.364 0.439 3.307 1.00 . A A . 9 GLN HB2 1 1 4 1721 1 1 9 GLN HB3 H -5.255 -0.561 2.169 1.00 . A A . 9 GLN HB3 1 1 4 1722 1 1 9 GLN HE21 H -3.776 2.485 2.414 1.00 . A A . 9 GLN HE21 1 1 4 1723 1 1 9 GLN HE22 H -3.937 3.202 0.822 1.00 . A A . 9 GLN HE22 1 1 4 1724 1 1 9 GLN HG2 H -7.162 1.018 2.210 1.00 . A A . 9 GLN HG2 1 1 4 1725 1 1 9 GLN HG3 H -6.321 2.028 3.379 1.00 . A A . 9 GLN HG3 1 1 4 1726 1 1 9 GLN N N -7.207 -1.343 3.633 1.00 . A A . 9 GLN N 1 1 4 1727 1 1 9 GLN NE2 N -4.318 2.632 1.573 1.00 . A A . 9 GLN NE2 1 1 4 1728 1 1 9 GLN O O -5.265 1.068 5.670 1.00 . A A . 9 GLN O 1 1 4 1729 1 1 9 GLN OE1 O -5.985 2.105 0.282 1.00 . A A . 9 GLN OE1 1 1 4 1730 1 1 10 THR C C -7.730 2.811 6.180 1.00 . A A . 10 THR C 1 1 4 1731 1 1 10 THR CA C -7.780 1.472 6.909 1.00 . A A . 10 THR CA 1 1 4 1732 1 1 10 THR CB C -7.006 1.522 8.235 1.00 . A A . 10 THR CB 1 1 4 1733 1 1 10 THR CG2 C -7.735 2.400 9.248 1.00 . A A . 10 THR CG2 1 1 4 1734 1 1 10 THR H H -8.032 -0.367 5.845 1.00 . A A . 10 THR H 1 1 4 1735 1 1 10 THR HA H -8.816 1.295 7.184 1.00 . A A . 10 THR HA 1 1 4 1736 1 1 10 THR HB H -5.995 1.900 8.074 1.00 . A A . 10 THR HB 1 1 4 1737 1 1 10 THR HG1 H -6.321 0.347 9.574 1.00 . A A . 10 THR HG1 1 1 4 1738 1 1 10 THR HG21 H -8.717 1.984 9.475 1.00 . A A . 10 THR HG21 1 1 4 1739 1 1 10 THR HG22 H -7.859 3.411 8.861 1.00 . A A . 10 THR HG22 1 1 4 1740 1 1 10 THR HG23 H -7.149 2.455 10.158 1.00 . A A . 10 THR HG23 1 1 4 1741 1 1 10 THR N N -7.360 0.370 6.026 1.00 . A A . 10 THR N 1 1 4 1742 1 1 10 THR O O -6.829 3.621 6.394 1.00 . A A . 10 THR O 1 1 4 1743 1 1 10 THR OG1 O -6.928 0.248 8.817 1.00 . A A . 10 THR OG1 1 1 4 1744 1 1 11 CYS C C -9.470 5.394 5.599 1.00 . A A . 11 CYS C 1 1 4 1745 1 1 11 CYS CA C -8.831 4.368 4.648 1.00 . A A . 11 CYS CA 1 1 4 1746 1 1 11 CYS CB C -9.458 4.265 3.251 1.00 . A A . 11 CYS CB 1 1 4 1747 1 1 11 CYS H H -9.398 2.355 5.144 1.00 . A A . 11 CYS H 1 1 4 1748 1 1 11 CYS HA H -7.822 4.728 4.470 1.00 . A A . 11 CYS HA 1 1 4 1749 1 1 11 CYS HB2 H -9.312 3.254 2.876 1.00 . A A . 11 CYS HB2 1 1 4 1750 1 1 11 CYS HB3 H -10.530 4.463 3.287 1.00 . A A . 11 CYS HB3 1 1 4 1751 1 1 11 CYS N N -8.686 3.059 5.285 1.00 . A A . 11 CYS N 1 1 4 1752 1 1 11 CYS O O -10.643 5.741 5.477 1.00 . A A . 11 CYS O 1 1 4 1753 1 1 11 CYS SG S -8.651 5.381 2.068 1.00 . A A . 11 CYS SG 1 1 4 1754 1 1 12 ASP C C -8.674 8.262 6.227 1.00 . A A . 12 ASP C 1 1 4 1755 1 1 12 ASP CA C -8.804 7.116 7.248 1.00 . A A . 12 ASP CA 1 1 4 1756 1 1 12 ASP CB C -7.691 7.268 8.305 1.00 . A A . 12 ASP CB 1 1 4 1757 1 1 12 ASP CG C -7.747 6.272 9.468 1.00 . A A . 12 ASP CG 1 1 4 1758 1 1 12 ASP H H -7.775 5.363 6.656 1.00 . A A . 12 ASP H 1 1 4 1759 1 1 12 ASP HA H -9.780 7.184 7.733 1.00 . A A . 12 ASP HA 1 1 4 1760 1 1 12 ASP HB2 H -6.723 7.186 7.807 1.00 . A A . 12 ASP HB2 1 1 4 1761 1 1 12 ASP HB3 H -7.753 8.270 8.724 1.00 . A A . 12 ASP HB3 1 1 4 1762 1 1 12 ASP N N -8.677 5.815 6.591 1.00 . A A . 12 ASP N 1 1 4 1763 1 1 12 ASP O O -8.048 8.094 5.181 1.00 . A A . 12 ASP O 1 1 4 1764 1 1 12 ASP OD1 O -6.686 5.681 9.785 1.00 . A A . 12 ASP OD1 1 1 4 1765 1 1 12 ASP OD2 O -8.824 6.136 10.093 1.00 . A A . 12 ASP OD2 1 1 4 1766 1 1 13 SER C C -7.437 10.959 5.399 1.00 . A A . 13 SER C 1 1 4 1767 1 1 13 SER CA C -8.913 10.674 5.737 1.00 . A A . 13 SER CA 1 1 4 1768 1 1 13 SER CB C -9.593 11.868 6.420 1.00 . A A . 13 SER CB 1 1 4 1769 1 1 13 SER H H -9.614 9.576 7.449 1.00 . A A . 13 SER H 1 1 4 1770 1 1 13 SER HA H -9.421 10.505 4.787 1.00 . A A . 13 SER HA 1 1 4 1771 1 1 13 SER HB2 H -10.671 11.792 6.283 1.00 . A A . 13 SER HB2 1 1 4 1772 1 1 13 SER HB3 H -9.389 11.811 7.489 1.00 . A A . 13 SER HB3 1 1 4 1773 1 1 13 SER HG H -9.097 13.179 5.001 1.00 . A A . 13 SER HG 1 1 4 1774 1 1 13 SER N N -9.112 9.476 6.577 1.00 . A A . 13 SER N 1 1 4 1775 1 1 13 SER O O -7.130 11.388 4.287 1.00 . A A . 13 SER O 1 1 4 1776 1 1 13 SER OG O -9.143 13.135 5.976 1.00 . A A . 13 SER OG 1 1 4 1777 1 1 14 GLU C C -4.441 9.632 5.243 1.00 . A A . 14 GLU C 1 1 4 1778 1 1 14 GLU CA C -5.057 10.781 6.074 1.00 . A A . 14 GLU CA 1 1 4 1779 1 1 14 GLU CB C -4.344 10.898 7.433 1.00 . A A . 14 GLU CB 1 1 4 1780 1 1 14 GLU CD C -4.289 12.137 9.690 1.00 . A A . 14 GLU CD 1 1 4 1781 1 1 14 GLU CG C -4.771 12.145 8.233 1.00 . A A . 14 GLU CG 1 1 4 1782 1 1 14 GLU H H -6.815 10.300 7.198 1.00 . A A . 14 GLU H 1 1 4 1783 1 1 14 GLU HA H -4.871 11.700 5.516 1.00 . A A . 14 GLU HA 1 1 4 1784 1 1 14 GLU HB2 H -4.559 9.996 8.002 1.00 . A A . 14 GLU HB2 1 1 4 1785 1 1 14 GLU HB3 H -3.267 10.945 7.278 1.00 . A A . 14 GLU HB3 1 1 4 1786 1 1 14 GLU HG2 H -4.386 13.033 7.728 1.00 . A A . 14 GLU HG2 1 1 4 1787 1 1 14 GLU HG3 H -5.860 12.217 8.249 1.00 . A A . 14 GLU HG3 1 1 4 1788 1 1 14 GLU N N -6.506 10.644 6.302 1.00 . A A . 14 GLU N 1 1 4 1789 1 1 14 GLU O O -3.239 9.644 4.961 1.00 . A A . 14 GLU O 1 1 4 1790 1 1 14 GLU OE1 O -3.614 11.176 10.134 1.00 . A A . 14 GLU OE1 1 1 4 1791 1 1 14 GLU OE2 O -4.616 13.090 10.429 1.00 . A A . 14 GLU OE2 1 1 4 1792 1 1 15 ARG C C -4.626 7.702 2.654 1.00 . A A . 15 ARG C 1 1 4 1793 1 1 15 ARG CA C -4.693 7.428 4.154 1.00 . A A . 15 ARG CA 1 1 4 1794 1 1 15 ARG CB C -5.516 6.164 4.451 1.00 . A A . 15 ARG CB 1 1 4 1795 1 1 15 ARG CD C -3.898 4.251 5.221 1.00 . A A . 15 ARG CD 1 1 4 1796 1 1 15 ARG CG C -4.757 4.865 4.075 1.00 . A A . 15 ARG CG 1 1 4 1797 1 1 15 ARG CZ C -3.913 5.579 7.322 1.00 . A A . 15 ARG CZ 1 1 4 1798 1 1 15 ARG H H -6.211 8.635 5.064 1.00 . A A . 15 ARG H 1 1 4 1799 1 1 15 ARG HA H -3.679 7.251 4.490 1.00 . A A . 15 ARG HA 1 1 4 1800 1 1 15 ARG HB2 H -5.836 6.138 5.492 1.00 . A A . 15 ARG HB2 1 1 4 1801 1 1 15 ARG HB3 H -6.420 6.225 3.846 1.00 . A A . 15 ARG HB3 1 1 4 1802 1 1 15 ARG HD2 H -4.501 3.539 5.761 1.00 . A A . 15 ARG HD2 1 1 4 1803 1 1 15 ARG HD3 H -3.052 3.747 4.772 1.00 . A A . 15 ARG HD3 1 1 4 1804 1 1 15 ARG HE H -2.642 5.909 5.848 1.00 . A A . 15 ARG HE 1 1 4 1805 1 1 15 ARG HG2 H -5.494 4.118 3.788 1.00 . A A . 15 ARG HG2 1 1 4 1806 1 1 15 ARG HG3 H -4.121 5.038 3.210 1.00 . A A . 15 ARG HG3 1 1 4 1807 1 1 15 ARG HH11 H -5.306 4.150 7.316 1.00 . A A . 15 ARG HH11 1 1 4 1808 1 1 15 ARG HH12 H -5.365 5.206 8.691 1.00 . A A . 15 ARG HH12 1 1 4 1809 1 1 15 ARG HH21 H -2.731 7.164 7.561 1.00 . A A . 15 ARG HH21 1 1 4 1810 1 1 15 ARG HH22 H -3.803 6.784 8.917 1.00 . A A . 15 ARG HH22 1 1 4 1811 1 1 15 ARG N N -5.210 8.589 4.890 1.00 . A A . 15 ARG N 1 1 4 1812 1 1 15 ARG NE N -3.396 5.295 6.138 1.00 . A A . 15 ARG NE 1 1 4 1813 1 1 15 ARG NH1 N -4.881 4.893 7.853 1.00 . A A . 15 ARG NH1 1 1 4 1814 1 1 15 ARG NH2 N -3.463 6.604 7.982 1.00 . A A . 15 ARG NH2 1 1 4 1815 1 1 15 ARG O O -5.600 8.109 2.021 1.00 . A A . 15 ARG O 1 1 4 1816 1 1 16 LYS C C -4.056 6.069 0.030 1.00 . A A . 16 LYS C 1 1 4 1817 1 1 16 LYS CA C -3.308 7.274 0.601 1.00 . A A . 16 LYS CA 1 1 4 1818 1 1 16 LYS CB C -1.810 7.268 0.269 1.00 . A A . 16 LYS CB 1 1 4 1819 1 1 16 LYS CD C 0.289 8.762 0.254 1.00 . A A . 16 LYS CD 1 1 4 1820 1 1 16 LYS CE C 0.689 8.345 -1.165 1.00 . A A . 16 LYS CE 1 1 4 1821 1 1 16 LYS CG C -1.208 8.652 0.566 1.00 . A A . 16 LYS CG 1 1 4 1822 1 1 16 LYS H H -2.718 7.080 2.645 1.00 . A A . 16 LYS H 1 1 4 1823 1 1 16 LYS HA H -3.742 8.159 0.134 1.00 . A A . 16 LYS HA 1 1 4 1824 1 1 16 LYS HB2 H -1.296 6.501 0.848 1.00 . A A . 16 LYS HB2 1 1 4 1825 1 1 16 LYS HB3 H -1.688 7.032 -0.785 1.00 . A A . 16 LYS HB3 1 1 4 1826 1 1 16 LYS HD2 H 0.599 9.796 0.417 1.00 . A A . 16 LYS HD2 1 1 4 1827 1 1 16 LYS HD3 H 0.839 8.138 0.960 1.00 . A A . 16 LYS HD3 1 1 4 1828 1 1 16 LYS HE2 H 1.747 8.588 -1.305 1.00 . A A . 16 LYS HE2 1 1 4 1829 1 1 16 LYS HE3 H 0.586 7.261 -1.263 1.00 . A A . 16 LYS HE3 1 1 4 1830 1 1 16 LYS HG2 H -1.748 9.402 -0.011 1.00 . A A . 16 LYS HG2 1 1 4 1831 1 1 16 LYS HG3 H -1.347 8.887 1.621 1.00 . A A . 16 LYS HG3 1 1 4 1832 1 1 16 LYS HZ1 H -1.070 8.634 -2.242 1.00 . A A . 16 LYS HZ1 1 1 4 1833 1 1 16 LYS HZ2 H 0.279 8.856 -3.124 1.00 . A A . 16 LYS HZ2 1 1 4 1834 1 1 16 LYS HZ3 H -0.211 10.009 -2.036 1.00 . A A . 16 LYS HZ3 1 1 4 1835 1 1 16 LYS N N -3.485 7.362 2.055 1.00 . A A . 16 LYS N 1 1 4 1836 1 1 16 LYS NZ N -0.124 9.012 -2.208 1.00 . A A . 16 LYS NZ 1 1 4 1837 1 1 16 LYS O O -3.557 4.944 0.072 1.00 . A A . 16 LYS O 1 1 4 1838 1 1 17 CYS C C -5.467 4.656 -2.257 1.00 . A A . 17 CYS C 1 1 4 1839 1 1 17 CYS CA C -6.131 5.254 -1.010 1.00 . A A . 17 CYS CA 1 1 4 1840 1 1 17 CYS CB C -7.504 5.836 -1.353 1.00 . A A . 17 CYS CB 1 1 4 1841 1 1 17 CYS H H -5.657 7.230 -0.346 1.00 . A A . 17 CYS H 1 1 4 1842 1 1 17 CYS HA H -6.272 4.473 -0.265 1.00 . A A . 17 CYS HA 1 1 4 1843 1 1 17 CYS HB2 H -7.933 6.268 -0.451 1.00 . A A . 17 CYS HB2 1 1 4 1844 1 1 17 CYS HB3 H -7.361 6.648 -2.065 1.00 . A A . 17 CYS HB3 1 1 4 1845 1 1 17 CYS N N -5.285 6.296 -0.432 1.00 . A A . 17 CYS N 1 1 4 1846 1 1 17 CYS O O -5.149 5.396 -3.191 1.00 . A A . 17 CYS O 1 1 4 1847 1 1 17 CYS SG S -8.704 4.660 -2.056 1.00 . A A . 17 CYS SG 1 1 4 1848 1 1 18 CYS C C -4.653 3.064 -4.698 1.00 . A A . 18 CYS C 1 1 4 1849 1 1 18 CYS CA C -4.536 2.553 -3.250 1.00 . A A . 18 CYS CA 1 1 4 1850 1 1 18 CYS CB C -5.008 1.094 -3.165 1.00 . A A . 18 CYS CB 1 1 4 1851 1 1 18 CYS H H -5.620 2.833 -1.440 1.00 . A A . 18 CYS H 1 1 4 1852 1 1 18 CYS HA H -3.486 2.603 -2.958 1.00 . A A . 18 CYS HA 1 1 4 1853 1 1 18 CYS HB2 H -5.532 0.946 -2.221 1.00 . A A . 18 CYS HB2 1 1 4 1854 1 1 18 CYS HB3 H -5.725 0.920 -3.965 1.00 . A A . 18 CYS HB3 1 1 4 1855 1 1 18 CYS N N -5.323 3.327 -2.278 1.00 . A A . 18 CYS N 1 1 4 1856 1 1 18 CYS O O -3.650 3.435 -5.297 1.00 . A A . 18 CYS O 1 1 4 1857 1 1 18 CYS SG S -3.739 -0.193 -3.285 1.00 . A A . 18 CYS SG 1 1 4 1858 1 1 19 GLU C C -7.214 5.001 -6.390 1.00 . A A . 19 GLU C 1 1 4 1859 1 1 19 GLU CA C -6.217 3.815 -6.494 1.00 . A A . 19 GLU CA 1 1 4 1860 1 1 19 GLU CB C -6.775 2.722 -7.441 1.00 . A A . 19 GLU CB 1 1 4 1861 1 1 19 GLU CD C -5.207 0.676 -7.166 1.00 . A A . 19 GLU CD 1 1 4 1862 1 1 19 GLU CG C -6.619 1.239 -7.065 1.00 . A A . 19 GLU CG 1 1 4 1863 1 1 19 GLU H H -6.655 2.969 -4.585 1.00 . A A . 19 GLU H 1 1 4 1864 1 1 19 GLU HA H -5.303 4.207 -6.947 1.00 . A A . 19 GLU HA 1 1 4 1865 1 1 19 GLU HB2 H -7.845 2.867 -7.509 1.00 . A A . 19 GLU HB2 1 1 4 1866 1 1 19 GLU HB3 H -6.384 2.892 -8.443 1.00 . A A . 19 GLU HB3 1 1 4 1867 1 1 19 GLU HG2 H -7.025 1.066 -6.065 1.00 . A A . 19 GLU HG2 1 1 4 1868 1 1 19 GLU HG3 H -7.227 0.664 -7.764 1.00 . A A . 19 GLU HG3 1 1 4 1869 1 1 19 GLU N N -5.890 3.252 -5.174 1.00 . A A . 19 GLU N 1 1 4 1870 1 1 19 GLU O O -7.943 5.285 -7.341 1.00 . A A . 19 GLU O 1 1 4 1871 1 1 19 GLU OE1 O -5.021 -0.464 -6.679 1.00 . A A . 19 GLU OE1 1 1 4 1872 1 1 19 GLU OE2 O -4.334 1.306 -7.801 1.00 . A A . 19 GLU OE2 1 1 4 1873 1 1 20 GLY C C -9.934 6.046 -4.924 1.00 . A A . 20 GLY C 1 1 4 1874 1 1 20 GLY CA C -8.481 6.565 -4.926 1.00 . A A . 20 GLY CA 1 1 4 1875 1 1 20 GLY H H -6.760 5.364 -4.458 1.00 . A A . 20 GLY H 1 1 4 1876 1 1 20 GLY HA2 H -8.295 7.026 -3.959 1.00 . A A . 20 GLY HA2 1 1 4 1877 1 1 20 GLY HA3 H -8.414 7.343 -5.680 1.00 . A A . 20 GLY HA3 1 1 4 1878 1 1 20 GLY N N -7.420 5.575 -5.198 1.00 . A A . 20 GLY N 1 1 4 1879 1 1 20 GLY O O -10.835 6.716 -4.414 1.00 . A A . 20 GLY O 1 1 4 1880 1 1 21 MET C C -12.073 3.830 -4.043 1.00 . A A . 21 MET C 1 1 4 1881 1 1 21 MET CA C -11.503 4.181 -5.434 1.00 . A A . 21 MET CA 1 1 4 1882 1 1 21 MET CB C -11.464 2.970 -6.384 1.00 . A A . 21 MET CB 1 1 4 1883 1 1 21 MET CE C -9.987 1.763 -8.973 1.00 . A A . 21 MET CE 1 1 4 1884 1 1 21 MET CG C -10.300 1.989 -6.150 1.00 . A A . 21 MET CG 1 1 4 1885 1 1 21 MET H H -9.423 4.376 -5.886 1.00 . A A . 21 MET H 1 1 4 1886 1 1 21 MET HA H -12.197 4.888 -5.887 1.00 . A A . 21 MET HA 1 1 4 1887 1 1 21 MET HB2 H -12.404 2.426 -6.309 1.00 . A A . 21 MET HB2 1 1 4 1888 1 1 21 MET HB3 H -11.389 3.368 -7.395 1.00 . A A . 21 MET HB3 1 1 4 1889 1 1 21 MET HE1 H -11.009 1.957 -9.294 1.00 . A A . 21 MET HE1 1 1 4 1890 1 1 21 MET HE2 H -9.482 2.714 -8.815 1.00 . A A . 21 MET HE2 1 1 4 1891 1 1 21 MET HE3 H -9.469 1.216 -9.759 1.00 . A A . 21 MET HE3 1 1 4 1892 1 1 21 MET HG2 H -9.379 2.548 -6.015 1.00 . A A . 21 MET HG2 1 1 4 1893 1 1 21 MET HG3 H -10.480 1.446 -5.222 1.00 . A A . 21 MET HG3 1 1 4 1894 1 1 21 MET N N -10.184 4.827 -5.403 1.00 . A A . 21 MET N 1 1 4 1895 1 1 21 MET O O -11.720 2.809 -3.456 1.00 . A A . 21 MET O 1 1 4 1896 1 1 21 MET SD S -9.990 0.766 -7.458 1.00 . A A . 21 MET SD 1 1 4 1897 1 1 22 VAL C C -13.226 4.442 -1.019 1.00 . A A . 22 VAL C 1 1 4 1898 1 1 22 VAL CA C -13.903 4.293 -2.395 1.00 . A A . 22 VAL CA 1 1 4 1899 1 1 22 VAL CB C -14.749 2.991 -2.505 1.00 . A A . 22 VAL CB 1 1 4 1900 1 1 22 VAL CG1 C -16.040 3.102 -1.690 1.00 . A A . 22 VAL CG1 1 1 4 1901 1 1 22 VAL CG2 C -15.172 2.625 -3.933 1.00 . A A . 22 VAL CG2 1 1 4 1902 1 1 22 VAL H H -13.360 5.381 -4.159 1.00 . A A . 22 VAL H 1 1 4 1903 1 1 22 VAL HA H -14.637 5.098 -2.394 1.00 . A A . 22 VAL HA 1 1 4 1904 1 1 22 VAL HB H -14.167 2.149 -2.127 1.00 . A A . 22 VAL HB 1 1 4 1905 1 1 22 VAL HG11 H -16.688 3.842 -2.153 1.00 . A A . 22 VAL HG11 1 1 4 1906 1 1 22 VAL HG12 H -16.527 2.130 -1.652 1.00 . A A . 22 VAL HG12 1 1 4 1907 1 1 22 VAL HG13 H -15.830 3.403 -0.665 1.00 . A A . 22 VAL HG13 1 1 4 1908 1 1 22 VAL HG21 H -14.305 2.318 -4.514 1.00 . A A . 22 VAL HG21 1 1 4 1909 1 1 22 VAL HG22 H -15.878 1.794 -3.918 1.00 . A A . 22 VAL HG22 1 1 4 1910 1 1 22 VAL HG23 H -15.644 3.489 -4.395 1.00 . A A . 22 VAL HG23 1 1 4 1911 1 1 22 VAL N N -13.096 4.573 -3.603 1.00 . A A . 22 VAL N 1 1 4 1912 1 1 22 VAL O O -13.396 3.565 -0.181 1.00 . A A . 22 VAL O 1 1 4 1913 1 1 23 CYS C C -12.813 5.934 1.748 1.00 . A A . 23 CYS C 1 1 4 1914 1 1 23 CYS CA C -11.835 5.721 0.571 1.00 . A A . 23 CYS CA 1 1 4 1915 1 1 23 CYS CB C -10.815 6.862 0.484 1.00 . A A . 23 CYS CB 1 1 4 1916 1 1 23 CYS H H -12.417 6.274 -1.418 1.00 . A A . 23 CYS H 1 1 4 1917 1 1 23 CYS HA H -11.267 4.818 0.777 1.00 . A A . 23 CYS HA 1 1 4 1918 1 1 23 CYS HB2 H -10.165 6.686 -0.371 1.00 . A A . 23 CYS HB2 1 1 4 1919 1 1 23 CYS HB3 H -11.352 7.794 0.309 1.00 . A A . 23 CYS HB3 1 1 4 1920 1 1 23 CYS N N -12.509 5.538 -0.730 1.00 . A A . 23 CYS N 1 1 4 1921 1 1 23 CYS O O -13.114 7.070 2.125 1.00 . A A . 23 CYS O 1 1 4 1922 1 1 23 CYS SG S -9.778 7.077 1.965 1.00 . A A . 23 CYS SG 1 1 4 1923 1 1 24 ARG C C -13.877 3.560 4.362 1.00 . A A . 24 ARG C 1 1 4 1924 1 1 24 ARG CA C -14.192 4.800 3.523 1.00 . A A . 24 ARG CA 1 1 4 1925 1 1 24 ARG CB C -15.693 4.831 3.136 1.00 . A A . 24 ARG CB 1 1 4 1926 1 1 24 ARG CD C -16.210 6.685 1.479 1.00 . A A . 24 ARG CD 1 1 4 1927 1 1 24 ARG CG C -16.297 6.238 2.954 1.00 . A A . 24 ARG CG 1 1 4 1928 1 1 24 ARG CZ C -17.547 6.179 -0.535 1.00 . A A . 24 ARG CZ 1 1 4 1929 1 1 24 ARG H H -13.077 3.957 1.881 1.00 . A A . 24 ARG H 1 1 4 1930 1 1 24 ARG HA H -13.984 5.663 4.160 1.00 . A A . 24 ARG HA 1 1 4 1931 1 1 24 ARG HB2 H -15.872 4.203 2.262 1.00 . A A . 24 ARG HB2 1 1 4 1932 1 1 24 ARG HB3 H -16.247 4.384 3.964 1.00 . A A . 24 ARG HB3 1 1 4 1933 1 1 24 ARG HD2 H -16.396 7.743 1.444 1.00 . A A . 24 ARG HD2 1 1 4 1934 1 1 24 ARG HD3 H -15.251 6.454 1.059 1.00 . A A . 24 ARG HD3 1 1 4 1935 1 1 24 ARG HE H -17.827 5.297 1.231 1.00 . A A . 24 ARG HE 1 1 4 1936 1 1 24 ARG HG2 H -17.342 6.233 3.268 1.00 . A A . 24 ARG HG2 1 1 4 1937 1 1 24 ARG HG3 H -15.767 6.944 3.590 1.00 . A A . 24 ARG HG3 1 1 4 1938 1 1 24 ARG HH11 H -16.440 7.830 -0.828 1.00 . A A . 24 ARG HH11 1 1 4 1939 1 1 24 ARG HH12 H -17.244 7.156 -2.232 1.00 . A A . 24 ARG HH12 1 1 4 1940 1 1 24 ARG HH21 H -19.117 4.915 -0.606 1.00 . A A . 24 ARG HH21 1 1 4 1941 1 1 24 ARG HH22 H -18.704 5.766 -2.088 1.00 . A A . 24 ARG HH22 1 1 4 1942 1 1 24 ARG N N -13.320 4.841 2.330 1.00 . A A . 24 ARG N 1 1 4 1943 1 1 24 ARG NE N -17.262 5.980 0.738 1.00 . A A . 24 ARG NE 1 1 4 1944 1 1 24 ARG NH1 N -16.943 7.067 -1.270 1.00 . A A . 24 ARG NH1 1 1 4 1945 1 1 24 ARG NH2 N -18.471 5.493 -1.141 1.00 . A A . 24 ARG NH2 1 1 4 1946 1 1 24 ARG O O -14.407 2.486 4.087 1.00 . A A . 24 ARG O 1 1 4 1947 1 1 25 LEU C C -11.483 1.552 5.152 1.00 . A A . 25 LEU C 1 1 4 1948 1 1 25 LEU CA C -12.259 2.563 6.019 1.00 . A A . 25 LEU CA 1 1 4 1949 1 1 25 LEU CB C -13.251 1.839 6.954 1.00 . A A . 25 LEU CB 1 1 4 1950 1 1 25 LEU CD1 C -15.065 1.899 8.683 1.00 . A A . 25 LEU CD1 1 1 4 1951 1 1 25 LEU CD2 C -13.169 3.498 8.871 1.00 . A A . 25 LEU CD2 1 1 4 1952 1 1 25 LEU CG C -14.069 2.747 7.888 1.00 . A A . 25 LEU CG 1 1 4 1953 1 1 25 LEU H H -12.505 4.595 5.401 1.00 . A A . 25 LEU H 1 1 4 1954 1 1 25 LEU HA H -11.503 3.022 6.657 1.00 . A A . 25 LEU HA 1 1 4 1955 1 1 25 LEU HB2 H -13.946 1.263 6.341 1.00 . A A . 25 LEU HB2 1 1 4 1956 1 1 25 LEU HB3 H -12.691 1.126 7.562 1.00 . A A . 25 LEU HB3 1 1 4 1957 1 1 25 LEU HD11 H -15.734 1.379 7.998 1.00 . A A . 25 LEU HD11 1 1 4 1958 1 1 25 LEU HD12 H -15.657 2.535 9.340 1.00 . A A . 25 LEU HD12 1 1 4 1959 1 1 25 LEU HD13 H -14.531 1.166 9.286 1.00 . A A . 25 LEU HD13 1 1 4 1960 1 1 25 LEU HD21 H -12.590 2.793 9.468 1.00 . A A . 25 LEU HD21 1 1 4 1961 1 1 25 LEU HD22 H -13.778 4.112 9.525 1.00 . A A . 25 LEU HD22 1 1 4 1962 1 1 25 LEU HD23 H -12.493 4.159 8.331 1.00 . A A . 25 LEU HD23 1 1 4 1963 1 1 25 LEU HG H -14.633 3.467 7.298 1.00 . A A . 25 LEU HG 1 1 4 1964 1 1 25 LEU N N -12.908 3.671 5.279 1.00 . A A . 25 LEU N 1 1 4 1965 1 1 25 LEU O O -10.547 0.919 5.630 1.00 . A A . 25 LEU O 1 1 4 1966 1 1 26 TRP C C -11.044 1.365 1.482 1.00 . A A . 26 TRP C 1 1 4 1967 1 1 26 TRP CA C -10.990 0.704 2.864 1.00 . A A . 26 TRP CA 1 1 4 1968 1 1 26 TRP CB C -11.457 -0.761 2.916 1.00 . A A . 26 TRP CB 1 1 4 1969 1 1 26 TRP CD1 C -13.347 -1.316 4.493 1.00 . A A . 26 TRP CD1 1 1 4 1970 1 1 26 TRP CD2 C -14.080 -0.816 2.435 1.00 . A A . 26 TRP CD2 1 1 4 1971 1 1 26 TRP CE2 C -15.230 -1.071 3.243 1.00 . A A . 26 TRP CE2 1 1 4 1972 1 1 26 TRP CE3 C -14.305 -0.445 1.092 1.00 . A A . 26 TRP CE3 1 1 4 1973 1 1 26 TRP CG C -12.890 -1.034 3.251 1.00 . A A . 26 TRP CG 1 1 4 1974 1 1 26 TRP CH2 C -16.720 -0.606 1.398 1.00 . A A . 26 TRP CH2 1 1 4 1975 1 1 26 TRP CZ2 C -16.533 -0.991 2.736 1.00 . A A . 26 TRP CZ2 1 1 4 1976 1 1 26 TRP CZ3 C -15.611 -0.335 0.579 1.00 . A A . 26 TRP CZ3 1 1 4 1977 1 1 26 TRP H H -12.557 1.970 3.516 1.00 . A A . 26 TRP H 1 1 4 1978 1 1 26 TRP HA H -9.935 0.709 3.139 1.00 . A A . 26 TRP HA 1 1 4 1979 1 1 26 TRP HB2 H -11.209 -1.287 1.995 1.00 . A A . 26 TRP HB2 1 1 4 1980 1 1 26 TRP HB3 H -10.876 -1.216 3.716 1.00 . A A . 26 TRP HB3 1 1 4 1981 1 1 26 TRP HD1 H -12.723 -1.469 5.366 1.00 . A A . 26 TRP HD1 1 1 4 1982 1 1 26 TRP HE1 H -15.255 -1.660 5.301 1.00 . A A . 26 TRP HE1 1 1 4 1983 1 1 26 TRP HE3 H -13.462 -0.228 0.455 1.00 . A A . 26 TRP HE3 1 1 4 1984 1 1 26 TRP HH2 H -17.718 -0.486 1.003 1.00 . A A . 26 TRP HH2 1 1 4 1985 1 1 26 TRP HZ2 H -17.382 -1.189 3.377 1.00 . A A . 26 TRP HZ2 1 1 4 1986 1 1 26 TRP HZ3 H -15.767 -0.025 -0.446 1.00 . A A . 26 TRP HZ3 1 1 4 1987 1 1 26 TRP N N -11.730 1.492 3.851 1.00 . A A . 26 TRP N 1 1 4 1988 1 1 26 TRP NE1 N -14.720 -1.385 4.481 1.00 . A A . 26 TRP NE1 1 1 4 1989 1 1 26 TRP O O -11.390 2.537 1.415 1.00 . A A . 26 TRP O 1 1 4 1990 1 1 27 CYS C C -11.164 -0.117 -1.842 1.00 . A A . 27 CYS C 1 1 4 1991 1 1 27 CYS CA C -10.777 1.099 -0.982 1.00 . A A . 27 CYS CA 1 1 4 1992 1 1 27 CYS CB C -9.458 1.741 -1.451 1.00 . A A . 27 CYS CB 1 1 4 1993 1 1 27 CYS H H -10.388 -0.302 0.544 1.00 . A A . 27 CYS H 1 1 4 1994 1 1 27 CYS HA H -11.572 1.842 -1.060 1.00 . A A . 27 CYS HA 1 1 4 1995 1 1 27 CYS HB2 H -8.646 1.026 -1.314 1.00 . A A . 27 CYS HB2 1 1 4 1996 1 1 27 CYS HB3 H -9.540 1.958 -2.515 1.00 . A A . 27 CYS HB3 1 1 4 1997 1 1 27 CYS N N -10.662 0.661 0.413 1.00 . A A . 27 CYS N 1 1 4 1998 1 1 27 CYS O O -10.628 -1.200 -1.607 1.00 . A A . 27 CYS O 1 1 4 1999 1 1 27 CYS SG S -9.021 3.279 -0.596 1.00 . A A . 27 CYS SG 1 1 4 2000 1 1 28 LYS C C -12.505 -1.016 -5.028 1.00 . A A . 28 LYS C 1 1 4 2001 1 1 28 LYS CA C -12.735 -1.101 -3.513 1.00 . A A . 28 LYS CA 1 1 4 2002 1 1 28 LYS CB C -14.202 -1.294 -3.055 1.00 . A A . 28 LYS CB 1 1 4 2003 1 1 28 LYS CD C -14.764 -3.252 -4.689 1.00 . A A . 28 LYS CD 1 1 4 2004 1 1 28 LYS CE C -15.397 -4.639 -4.855 1.00 . A A . 28 LYS CE 1 1 4 2005 1 1 28 LYS CG C -14.779 -2.714 -3.246 1.00 . A A . 28 LYS CG 1 1 4 2006 1 1 28 LYS H H -12.426 0.975 -2.966 1.00 . A A . 28 LYS H 1 1 4 2007 1 1 28 LYS HA H -12.209 -2.011 -3.214 1.00 . A A . 28 LYS HA 1 1 4 2008 1 1 28 LYS HB2 H -14.248 -1.088 -1.984 1.00 . A A . 28 LYS HB2 1 1 4 2009 1 1 28 LYS HB3 H -14.852 -0.566 -3.541 1.00 . A A . 28 LYS HB3 1 1 4 2010 1 1 28 LYS HD2 H -15.305 -2.557 -5.332 1.00 . A A . 28 LYS HD2 1 1 4 2011 1 1 28 LYS HD3 H -13.739 -3.323 -5.045 1.00 . A A . 28 LYS HD3 1 1 4 2012 1 1 28 LYS HE2 H -16.460 -4.594 -4.598 1.00 . A A . 28 LYS HE2 1 1 4 2013 1 1 28 LYS HE3 H -15.322 -4.920 -5.909 1.00 . A A . 28 LYS HE3 1 1 4 2014 1 1 28 LYS HG2 H -14.216 -3.393 -2.606 1.00 . A A . 28 LYS HG2 1 1 4 2015 1 1 28 LYS HG3 H -15.811 -2.709 -2.891 1.00 . A A . 28 LYS HG3 1 1 4 2016 1 1 28 LYS HZ1 H -15.257 -5.838 -3.176 1.00 . A A . 28 LYS HZ1 1 1 4 2017 1 1 28 LYS HZ2 H -13.777 -5.408 -3.795 1.00 . A A . 28 LYS HZ2 1 1 4 2018 1 1 28 LYS HZ3 H -14.684 -6.548 -4.558 1.00 . A A . 28 LYS HZ3 1 1 4 2019 1 1 28 LYS N N -12.105 0.028 -2.788 1.00 . A A . 28 LYS N 1 1 4 2020 1 1 28 LYS NZ N -14.732 -5.678 -4.034 1.00 . A A . 28 LYS NZ 1 1 4 2021 1 1 28 LYS O O -11.487 -1.518 -5.498 1.00 . A A . 28 LYS O 1 1 4 2022 1 1 29 LYS C C -14.489 0.693 -7.697 1.00 . A A . 29 LYS C 1 1 4 2023 1 1 29 LYS CA C -13.381 -0.260 -7.257 1.00 . A A . 29 LYS CA 1 1 4 2024 1 1 29 LYS CB C -13.438 -1.599 -8.022 1.00 . A A . 29 LYS CB 1 1 4 2025 1 1 29 LYS CD C -12.419 -2.888 -9.942 1.00 . A A . 29 LYS CD 1 1 4 2026 1 1 29 LYS CE C -11.578 -2.858 -11.221 1.00 . A A . 29 LYS CE 1 1 4 2027 1 1 29 LYS CG C -12.742 -1.492 -9.390 1.00 . A A . 29 LYS CG 1 1 4 2028 1 1 29 LYS H H -14.307 -0.164 -5.339 1.00 . A A . 29 LYS H 1 1 4 2029 1 1 29 LYS HA H -12.436 0.216 -7.470 1.00 . A A . 29 LYS HA 1 1 4 2030 1 1 29 LYS HB2 H -12.923 -2.365 -7.443 1.00 . A A . 29 LYS HB2 1 1 4 2031 1 1 29 LYS HB3 H -14.473 -1.923 -8.152 1.00 . A A . 29 LYS HB3 1 1 4 2032 1 1 29 LYS HD2 H -11.855 -3.443 -9.191 1.00 . A A . 29 LYS HD2 1 1 4 2033 1 1 29 LYS HD3 H -13.348 -3.422 -10.133 1.00 . A A . 29 LYS HD3 1 1 4 2034 1 1 29 LYS HE2 H -10.646 -2.320 -11.027 1.00 . A A . 29 LYS HE2 1 1 4 2035 1 1 29 LYS HE3 H -11.324 -3.888 -11.490 1.00 . A A . 29 LYS HE3 1 1 4 2036 1 1 29 LYS HG2 H -13.378 -0.945 -10.085 1.00 . A A . 29 LYS HG2 1 1 4 2037 1 1 29 LYS HG3 H -11.805 -0.948 -9.280 1.00 . A A . 29 LYS HG3 1 1 4 2038 1 1 29 LYS HZ1 H -12.403 -1.226 -12.218 1.00 . A A . 29 LYS HZ1 1 1 4 2039 1 1 29 LYS HZ2 H -13.218 -2.636 -12.475 1.00 . A A . 29 LYS HZ2 1 1 4 2040 1 1 29 LYS HZ3 H -11.783 -2.355 -13.214 1.00 . A A . 29 LYS HZ3 1 1 4 2041 1 1 29 LYS N N -13.465 -0.483 -5.799 1.00 . A A . 29 LYS N 1 1 4 2042 1 1 29 LYS NZ N -12.295 -2.225 -12.345 1.00 . A A . 29 LYS NZ 1 1 4 2043 1 1 29 LYS O O -15.614 0.545 -7.226 1.00 . A A . 29 LYS O 1 1 4 2044 1 1 30 LYS C C -14.923 3.648 -10.025 1.00 . A A . 30 LYS C 1 1 4 2045 1 1 30 LYS CA C -15.109 2.852 -8.722 1.00 . A A . 30 LYS CA 1 1 4 2046 1 1 30 LYS CB C -15.146 3.774 -7.484 1.00 . A A . 30 LYS CB 1 1 4 2047 1 1 30 LYS CD C -16.827 5.448 -6.536 1.00 . A A . 30 LYS CD 1 1 4 2048 1 1 30 LYS CE C -17.347 6.307 -7.694 1.00 . A A . 30 LYS CE 1 1 4 2049 1 1 30 LYS CG C -16.602 4.027 -7.060 1.00 . A A . 30 LYS CG 1 1 4 2050 1 1 30 LYS H H -13.216 1.804 -8.817 1.00 . A A . 30 LYS H 1 1 4 2051 1 1 30 LYS HA H -16.092 2.389 -8.836 1.00 . A A . 30 LYS HA 1 1 4 2052 1 1 30 LYS HB2 H -14.630 3.313 -6.644 1.00 . A A . 30 LYS HB2 1 1 4 2053 1 1 30 LYS HB3 H -14.627 4.712 -7.686 1.00 . A A . 30 LYS HB3 1 1 4 2054 1 1 30 LYS HD2 H -17.574 5.409 -5.744 1.00 . A A . 30 LYS HD2 1 1 4 2055 1 1 30 LYS HD3 H -15.906 5.862 -6.123 1.00 . A A . 30 LYS HD3 1 1 4 2056 1 1 30 LYS HE2 H -16.637 6.262 -8.523 1.00 . A A . 30 LYS HE2 1 1 4 2057 1 1 30 LYS HE3 H -18.292 5.882 -8.046 1.00 . A A . 30 LYS HE3 1 1 4 2058 1 1 30 LYS HG2 H -17.280 3.858 -7.898 1.00 . A A . 30 LYS HG2 1 1 4 2059 1 1 30 LYS HG3 H -16.872 3.306 -6.290 1.00 . A A . 30 LYS HG3 1 1 4 2060 1 1 30 LYS HZ1 H -17.918 8.242 -8.079 1.00 . A A . 30 LYS HZ1 1 1 4 2061 1 1 30 LYS HZ2 H -16.717 8.135 -6.957 1.00 . A A . 30 LYS HZ2 1 1 4 2062 1 1 30 LYS HZ3 H -18.299 7.757 -6.581 1.00 . A A . 30 LYS HZ3 1 1 4 2063 1 1 30 LYS N N -14.166 1.732 -8.486 1.00 . A A . 30 LYS N 1 1 4 2064 1 1 30 LYS NZ N -17.569 7.708 -7.286 1.00 . A A . 30 LYS NZ 1 1 4 2065 1 1 30 LYS O O -15.173 4.855 -10.065 1.00 . A A . 30 LYS O 1 1 4 2066 1 1 31 LEU C C -15.447 2.556 -13.288 1.00 . A A . 31 LEU C 1 1 4 2067 1 1 31 LEU CA C -14.487 3.425 -12.463 1.00 . A A . 31 LEU CA 1 1 4 2068 1 1 31 LEU CB C -13.060 3.395 -13.046 1.00 . A A . 31 LEU CB 1 1 4 2069 1 1 31 LEU CD1 C -12.859 5.854 -13.652 1.00 . A A . 31 LEU CD1 1 1 4 2070 1 1 31 LEU CD2 C -11.995 5.111 -11.445 1.00 . A A . 31 LEU CD2 1 1 4 2071 1 1 31 LEU CG C -12.233 4.682 -12.894 1.00 . A A . 31 LEU CG 1 1 4 2072 1 1 31 LEU H H -14.333 1.969 -10.946 1.00 . A A . 31 LEU H 1 1 4 2073 1 1 31 LEU HA H -14.877 4.442 -12.509 1.00 . A A . 31 LEU HA 1 1 4 2074 1 1 31 LEU HB2 H -12.507 2.568 -12.605 1.00 . A A . 31 LEU HB2 1 1 4 2075 1 1 31 LEU HB3 H -13.118 3.187 -14.115 1.00 . A A . 31 LEU HB3 1 1 4 2076 1 1 31 LEU HD11 H -13.757 6.209 -13.149 1.00 . A A . 31 LEU HD11 1 1 4 2077 1 1 31 LEU HD12 H -13.115 5.548 -14.664 1.00 . A A . 31 LEU HD12 1 1 4 2078 1 1 31 LEU HD13 H -12.138 6.664 -13.721 1.00 . A A . 31 LEU HD13 1 1 4 2079 1 1 31 LEU HD21 H -12.914 5.484 -11.003 1.00 . A A . 31 LEU HD21 1 1 4 2080 1 1 31 LEU HD22 H -11.250 5.906 -11.417 1.00 . A A . 31 LEU HD22 1 1 4 2081 1 1 31 LEU HD23 H -11.625 4.265 -10.869 1.00 . A A . 31 LEU HD23 1 1 4 2082 1 1 31 LEU HG H -11.266 4.477 -13.345 1.00 . A A . 31 LEU HG 1 1 4 2083 1 1 31 LEU N N -14.473 2.959 -11.072 1.00 . A A . 31 LEU N 1 1 4 2084 1 1 31 LEU O O -15.844 1.469 -12.863 1.00 . A A . 31 LEU O 1 1 4 2085 1 1 32 LEU C C -16.282 1.917 -16.594 1.00 . A A . 32 LEU C 1 1 4 2086 1 1 32 LEU CA C -16.887 2.437 -15.287 1.00 . A A . 32 LEU CA 1 1 4 2087 1 1 32 LEU CB C -17.904 3.570 -15.583 1.00 . A A . 32 LEU CB 1 1 4 2088 1 1 32 LEU CD1 C -19.501 5.252 -14.644 1.00 . A A . 32 LEU CD1 1 1 4 2089 1 1 32 LEU CD2 C -19.225 3.095 -13.429 1.00 . A A . 32 LEU CD2 1 1 4 2090 1 1 32 LEU CG C -18.499 4.150 -14.276 1.00 . A A . 32 LEU CG 1 1 4 2091 1 1 32 LEU H H -15.352 3.850 -14.842 1.00 . A A . 32 LEU H 1 1 4 2092 1 1 32 LEU HA H -17.366 1.612 -14.780 1.00 . A A . 32 LEU HA 1 1 4 2093 1 1 32 LEU HB2 H -17.407 4.364 -16.144 1.00 . A A . 32 LEU HB2 1 1 4 2094 1 1 32 LEU HB3 H -18.711 3.167 -16.197 1.00 . A A . 32 LEU HB3 1 1 4 2095 1 1 32 LEU HD11 H -19.909 5.704 -13.738 1.00 . A A . 32 LEU HD11 1 1 4 2096 1 1 32 LEU HD12 H -20.321 4.838 -15.233 1.00 . A A . 32 LEU HD12 1 1 4 2097 1 1 32 LEU HD13 H -19.005 6.032 -15.222 1.00 . A A . 32 LEU HD13 1 1 4 2098 1 1 32 LEU HD21 H -19.758 3.579 -12.610 1.00 . A A . 32 LEU HD21 1 1 4 2099 1 1 32 LEU HD22 H -18.513 2.393 -12.997 1.00 . A A . 32 LEU HD22 1 1 4 2100 1 1 32 LEU HD23 H -19.943 2.553 -14.044 1.00 . A A . 32 LEU HD23 1 1 4 2101 1 1 32 LEU HG H -17.712 4.607 -13.672 1.00 . A A . 32 LEU HG 1 1 4 2102 1 1 32 LEU N N -15.812 3.026 -14.475 1.00 . A A . 32 LEU N 1 1 4 2103 1 1 32 LEU O O -16.848 1.971 -17.665 1.00 . A A . 32 LEU O 1 1 4 2104 1 1 32 LEU OXT O -15.343 1.429 -16.525 1.00 . A A . 32 LEU OXT 1 1 5 2105 1 1 1 GLY C C 2.328 0.634 -1.248 1.00 . A A . 1 GLY C 1 1 5 2106 1 1 1 GLY CA C 3.776 0.865 -0.870 1.00 . A A . 1 GLY CA 1 1 5 2107 1 1 1 GLY H1 H 5.503 1.506 -1.756 1.00 . A A . 1 GLY H1 1 1 5 2108 1 1 1 GLY H2 H 4.549 0.635 -2.769 1.00 . A A . 1 GLY H2 1 1 5 2109 1 1 1 GLY H3 H 4.149 2.190 -2.398 1.00 . A A . 1 GLY H3 1 1 5 2110 1 1 1 GLY HA2 H 4.196 -0.060 -0.482 1.00 . A A . 1 GLY HA2 1 1 5 2111 1 1 1 GLY HA3 H 3.810 1.622 -0.089 1.00 . A A . 1 GLY HA3 1 1 5 2112 1 1 1 GLY N N 4.547 1.333 -2.035 1.00 . A A . 1 GLY N 1 1 5 2113 1 1 1 GLY O O 1.528 1.562 -1.104 1.00 . A A . 1 GLY O 1 1 5 2114 1 1 2 PRO C C -0.164 -1.702 -1.244 1.00 . A A . 2 PRO C 1 1 5 2115 1 1 2 PRO CA C 0.642 -0.879 -2.269 1.00 . A A . 2 PRO CA 1 1 5 2116 1 1 2 PRO CB C 0.982 -1.583 -3.586 1.00 . A A . 2 PRO CB 1 1 5 2117 1 1 2 PRO CD C 2.860 -1.667 -2.069 1.00 . A A . 2 PRO CD 1 1 5 2118 1 1 2 PRO CG C 2.166 -2.462 -3.178 1.00 . A A . 2 PRO CG 1 1 5 2119 1 1 2 PRO HA H 0.081 0.029 -2.495 1.00 . A A . 2 PRO HA 1 1 5 2120 1 1 2 PRO HB2 H 0.153 -2.160 -3.999 1.00 . A A . 2 PRO HB2 1 1 5 2121 1 1 2 PRO HB3 H 1.313 -0.842 -4.316 1.00 . A A . 2 PRO HB3 1 1 5 2122 1 1 2 PRO HD2 H 3.037 -2.303 -1.202 1.00 . A A . 2 PRO HD2 1 1 5 2123 1 1 2 PRO HD3 H 3.808 -1.292 -2.446 1.00 . A A . 2 PRO HD3 1 1 5 2124 1 1 2 PRO HG2 H 1.803 -3.410 -2.790 1.00 . A A . 2 PRO HG2 1 1 5 2125 1 1 2 PRO HG3 H 2.840 -2.641 -4.010 1.00 . A A . 2 PRO HG3 1 1 5 2126 1 1 2 PRO N N 1.962 -0.568 -1.729 1.00 . A A . 2 PRO N 1 1 5 2127 1 1 2 PRO O O -0.359 -1.243 -0.120 1.00 . A A . 2 PRO O 1 1 5 2128 1 1 3 TYR C C -2.609 -3.403 -0.033 1.00 . A A . 3 TYR C 1 1 5 2129 1 1 3 TYR CA C -1.317 -3.852 -0.728 1.00 . A A . 3 TYR CA 1 1 5 2130 1 1 3 TYR CB C -0.306 -4.625 0.140 1.00 . A A . 3 TYR CB 1 1 5 2131 1 1 3 TYR CD1 C 1.975 -5.169 -0.786 1.00 . A A . 3 TYR CD1 1 1 5 2132 1 1 3 TYR CD2 C 0.072 -6.512 -1.504 1.00 . A A . 3 TYR CD2 1 1 5 2133 1 1 3 TYR CE1 C 2.801 -5.821 -1.723 1.00 . A A . 3 TYR CE1 1 1 5 2134 1 1 3 TYR CE2 C 0.884 -7.134 -2.465 1.00 . A A . 3 TYR CE2 1 1 5 2135 1 1 3 TYR CG C 0.609 -5.495 -0.695 1.00 . A A . 3 TYR CG 1 1 5 2136 1 1 3 TYR CZ C 2.242 -6.784 -2.588 1.00 . A A . 3 TYR CZ 1 1 5 2137 1 1 3 TYR H H -0.425 -3.215 -2.546 1.00 . A A . 3 TYR H 1 1 5 2138 1 1 3 TYR HA H -1.707 -4.602 -1.413 1.00 . A A . 3 TYR HA 1 1 5 2139 1 1 3 TYR HB2 H 0.269 -3.924 0.748 1.00 . A A . 3 TYR HB2 1 1 5 2140 1 1 3 TYR HB3 H -0.845 -5.289 0.814 1.00 . A A . 3 TYR HB3 1 1 5 2141 1 1 3 TYR HD1 H 2.365 -4.361 -0.183 1.00 . A A . 3 TYR HD1 1 1 5 2142 1 1 3 TYR HD2 H -0.978 -6.765 -1.447 1.00 . A A . 3 TYR HD2 1 1 5 2143 1 1 3 TYR HE1 H 3.835 -5.532 -1.844 1.00 . A A . 3 TYR HE1 1 1 5 2144 1 1 3 TYR HE2 H 0.458 -7.850 -3.145 1.00 . A A . 3 TYR HE2 1 1 5 2145 1 1 3 TYR HH H 2.396 -7.345 -4.400 1.00 . A A . 3 TYR HH 1 1 5 2146 1 1 3 TYR N N -0.652 -2.891 -1.617 1.00 . A A . 3 TYR N 1 1 5 2147 1 1 3 TYR O O -2.875 -3.759 1.114 1.00 . A A . 3 TYR O 1 1 5 2148 1 1 3 TYR OH O 2.968 -7.313 -3.606 1.00 . A A . 3 TYR OH 1 1 5 2149 1 1 4 CYS C C -5.858 -1.897 -0.782 1.00 . A A . 4 CYS C 1 1 5 2150 1 1 4 CYS CA C -4.456 -1.783 -0.136 1.00 . A A . 4 CYS CA 1 1 5 2151 1 1 4 CYS CB C -3.943 -0.341 0.028 1.00 . A A . 4 CYS CB 1 1 5 2152 1 1 4 CYS H H -3.060 -2.305 -1.648 1.00 . A A . 4 CYS H 1 1 5 2153 1 1 4 CYS HA H -4.604 -2.158 0.877 1.00 . A A . 4 CYS HA 1 1 5 2154 1 1 4 CYS HB2 H -4.805 0.307 0.113 1.00 . A A . 4 CYS HB2 1 1 5 2155 1 1 4 CYS HB3 H -3.422 -0.297 0.986 1.00 . A A . 4 CYS HB3 1 1 5 2156 1 1 4 CYS N N -3.400 -2.588 -0.743 1.00 . A A . 4 CYS N 1 1 5 2157 1 1 4 CYS O O -6.811 -2.282 -0.103 1.00 . A A . 4 CYS O 1 1 5 2158 1 1 4 CYS SG S -2.811 0.410 -1.189 1.00 . A A . 4 CYS SG 1 1 5 2159 1 1 5 GLN C C -7.891 -3.202 -2.765 1.00 . A A . 5 GLN C 1 1 5 2160 1 1 5 GLN CA C -7.308 -1.782 -2.794 1.00 . A A . 5 GLN CA 1 1 5 2161 1 1 5 GLN CB C -7.170 -1.192 -4.215 1.00 . A A . 5 GLN CB 1 1 5 2162 1 1 5 GLN CD C -7.496 -3.058 -5.963 1.00 . A A . 5 GLN CD 1 1 5 2163 1 1 5 GLN CG C -8.043 -1.770 -5.344 1.00 . A A . 5 GLN CG 1 1 5 2164 1 1 5 GLN H H -5.213 -1.351 -2.620 1.00 . A A . 5 GLN H 1 1 5 2165 1 1 5 GLN HA H -8.030 -1.164 -2.259 1.00 . A A . 5 GLN HA 1 1 5 2166 1 1 5 GLN HB2 H -7.437 -0.140 -4.134 1.00 . A A . 5 GLN HB2 1 1 5 2167 1 1 5 GLN HB3 H -6.127 -1.241 -4.530 1.00 . A A . 5 GLN HB3 1 1 5 2168 1 1 5 GLN HE21 H -5.745 -2.175 -6.549 1.00 . A A . 5 GLN HE21 1 1 5 2169 1 1 5 GLN HE22 H -5.917 -3.913 -6.823 1.00 . A A . 5 GLN HE22 1 1 5 2170 1 1 5 GLN HG2 H -9.057 -1.917 -4.979 1.00 . A A . 5 GLN HG2 1 1 5 2171 1 1 5 GLN HG3 H -8.104 -1.035 -6.145 1.00 . A A . 5 GLN HG3 1 1 5 2172 1 1 5 GLN N N -6.011 -1.673 -2.092 1.00 . A A . 5 GLN N 1 1 5 2173 1 1 5 GLN NE2 N -6.279 -3.050 -6.463 1.00 . A A . 5 GLN NE2 1 1 5 2174 1 1 5 GLN O O -9.109 -3.379 -2.740 1.00 . A A . 5 GLN O 1 1 5 2175 1 1 5 GLN OE1 O -8.070 -4.134 -5.833 1.00 . A A . 5 GLN OE1 1 1 5 2176 1 1 6 LYS C C -7.844 -5.953 -1.060 1.00 . A A . 6 LYS C 1 1 5 2177 1 1 6 LYS CA C -7.405 -5.613 -2.499 1.00 . A A . 6 LYS CA 1 1 5 2178 1 1 6 LYS CB C -6.244 -6.494 -3.016 1.00 . A A . 6 LYS CB 1 1 5 2179 1 1 6 LYS CD C -5.578 -8.797 -3.939 1.00 . A A . 6 LYS CD 1 1 5 2180 1 1 6 LYS CE C -6.155 -10.199 -4.162 1.00 . A A . 6 LYS CE 1 1 5 2181 1 1 6 LYS CG C -6.616 -7.981 -3.152 1.00 . A A . 6 LYS CG 1 1 5 2182 1 1 6 LYS H H -6.038 -3.991 -2.735 1.00 . A A . 6 LYS H 1 1 5 2183 1 1 6 LYS HA H -8.271 -5.805 -3.131 1.00 . A A . 6 LYS HA 1 1 5 2184 1 1 6 LYS HB2 H -5.956 -6.130 -4.004 1.00 . A A . 6 LYS HB2 1 1 5 2185 1 1 6 LYS HB3 H -5.383 -6.399 -2.352 1.00 . A A . 6 LYS HB3 1 1 5 2186 1 1 6 LYS HD2 H -5.370 -8.327 -4.899 1.00 . A A . 6 LYS HD2 1 1 5 2187 1 1 6 LYS HD3 H -4.649 -8.853 -3.373 1.00 . A A . 6 LYS HD3 1 1 5 2188 1 1 6 LYS HE2 H -6.506 -10.569 -3.196 1.00 . A A . 6 LYS HE2 1 1 5 2189 1 1 6 LYS HE3 H -7.021 -10.129 -4.824 1.00 . A A . 6 LYS HE3 1 1 5 2190 1 1 6 LYS HG2 H -6.727 -8.420 -2.162 1.00 . A A . 6 LYS HG2 1 1 5 2191 1 1 6 LYS HG3 H -7.572 -8.057 -3.666 1.00 . A A . 6 LYS HG3 1 1 5 2192 1 1 6 LYS HZ1 H -5.578 -12.091 -4.744 1.00 . A A . 6 LYS HZ1 1 1 5 2193 1 1 6 LYS HZ2 H -4.379 -11.229 -4.062 1.00 . A A . 6 LYS HZ2 1 1 5 2194 1 1 6 LYS HZ3 H -4.830 -10.923 -5.628 1.00 . A A . 6 LYS HZ3 1 1 5 2195 1 1 6 LYS N N -7.020 -4.212 -2.674 1.00 . A A . 6 LYS N 1 1 5 2196 1 1 6 LYS NZ N -5.169 -11.163 -4.704 1.00 . A A . 6 LYS NZ 1 1 5 2197 1 1 6 LYS O O -8.499 -6.975 -0.869 1.00 . A A . 6 LYS O 1 1 5 2198 1 1 7 TRP C C -7.468 -4.630 2.433 1.00 . A A . 7 TRP C 1 1 5 2199 1 1 7 TRP CA C -7.166 -5.646 1.294 1.00 . A A . 7 TRP CA 1 1 5 2200 1 1 7 TRP CB C -5.675 -6.046 1.237 1.00 . A A . 7 TRP CB 1 1 5 2201 1 1 7 TRP CD1 C -4.762 -7.001 3.411 1.00 . A A . 7 TRP CD1 1 1 5 2202 1 1 7 TRP CD2 C -5.395 -8.587 1.959 1.00 . A A . 7 TRP CD2 1 1 5 2203 1 1 7 TRP CE2 C -4.867 -9.260 3.099 1.00 . A A . 7 TRP CE2 1 1 5 2204 1 1 7 TRP CE3 C -5.914 -9.394 0.923 1.00 . A A . 7 TRP CE3 1 1 5 2205 1 1 7 TRP CG C -5.228 -7.147 2.150 1.00 . A A . 7 TRP CG 1 1 5 2206 1 1 7 TRP CH2 C -5.312 -11.433 2.126 1.00 . A A . 7 TRP CH2 1 1 5 2207 1 1 7 TRP CZ2 C -4.822 -10.658 3.192 1.00 . A A . 7 TRP CZ2 1 1 5 2208 1 1 7 TRP CZ3 C -5.866 -10.800 0.999 1.00 . A A . 7 TRP CZ3 1 1 5 2209 1 1 7 TRP H H -7.126 -4.228 -0.291 1.00 . A A . 7 TRP H 1 1 5 2210 1 1 7 TRP HA H -7.751 -6.544 1.500 1.00 . A A . 7 TRP HA 1 1 5 2211 1 1 7 TRP HB2 H -5.436 -6.394 0.232 1.00 . A A . 7 TRP HB2 1 1 5 2212 1 1 7 TRP HB3 H -5.058 -5.163 1.402 1.00 . A A . 7 TRP HB3 1 1 5 2213 1 1 7 TRP HD1 H -4.583 -6.044 3.894 1.00 . A A . 7 TRP HD1 1 1 5 2214 1 1 7 TRP HE1 H -3.986 -8.391 4.827 1.00 . A A . 7 TRP HE1 1 1 5 2215 1 1 7 TRP HE3 H -6.340 -8.919 0.054 1.00 . A A . 7 TRP HE3 1 1 5 2216 1 1 7 TRP HH2 H -5.269 -12.513 2.178 1.00 . A A . 7 TRP HH2 1 1 5 2217 1 1 7 TRP HZ2 H -4.404 -11.134 4.068 1.00 . A A . 7 TRP HZ2 1 1 5 2218 1 1 7 TRP HZ3 H -6.252 -11.398 0.184 1.00 . A A . 7 TRP HZ3 1 1 5 2219 1 1 7 TRP N N -7.501 -5.137 -0.051 1.00 . A A . 7 TRP N 1 1 5 2220 1 1 7 TRP NE1 N -4.475 -8.245 3.944 1.00 . A A . 7 TRP NE1 1 1 5 2221 1 1 7 TRP O O -6.603 -4.325 3.249 1.00 . A A . 7 TRP O 1 1 5 2222 1 1 8 MET C C -8.378 -2.356 4.398 1.00 . A A . 8 MET C 1 1 5 2223 1 1 8 MET CA C -9.266 -3.434 3.714 1.00 . A A . 8 MET CA 1 1 5 2224 1 1 8 MET CB C -9.759 -4.513 4.697 1.00 . A A . 8 MET CB 1 1 5 2225 1 1 8 MET CE C -12.766 -7.421 4.282 1.00 . A A . 8 MET CE 1 1 5 2226 1 1 8 MET CG C -10.947 -5.322 4.163 1.00 . A A . 8 MET CG 1 1 5 2227 1 1 8 MET H H -9.339 -4.349 1.769 1.00 . A A . 8 MET H 1 1 5 2228 1 1 8 MET HA H -10.154 -2.891 3.394 1.00 . A A . 8 MET HA 1 1 5 2229 1 1 8 MET HB2 H -8.934 -5.190 4.923 1.00 . A A . 8 MET HB2 1 1 5 2230 1 1 8 MET HB3 H -10.082 -4.040 5.623 1.00 . A A . 8 MET HB3 1 1 5 2231 1 1 8 MET HE1 H -13.575 -6.695 4.272 1.00 . A A . 8 MET HE1 1 1 5 2232 1 1 8 MET HE2 H -12.473 -7.639 3.258 1.00 . A A . 8 MET HE2 1 1 5 2233 1 1 8 MET HE3 H -13.112 -8.338 4.760 1.00 . A A . 8 MET HE3 1 1 5 2234 1 1 8 MET HG2 H -11.821 -4.672 4.106 1.00 . A A . 8 MET HG2 1 1 5 2235 1 1 8 MET HG3 H -10.725 -5.677 3.158 1.00 . A A . 8 MET HG3 1 1 5 2236 1 1 8 MET N N -8.697 -4.085 2.500 1.00 . A A . 8 MET N 1 1 5 2237 1 1 8 MET O O -8.177 -2.335 5.612 1.00 . A A . 8 MET O 1 1 5 2238 1 1 8 MET SD S -11.350 -6.758 5.196 1.00 . A A . 8 MET SD 1 1 5 2239 1 1 9 GLN C C -6.760 0.546 4.894 1.00 . A A . 9 GLN C 1 1 5 2240 1 1 9 GLN CA C -6.633 -0.623 3.885 1.00 . A A . 9 GLN CA 1 1 5 2241 1 1 9 GLN CB C -6.140 -0.084 2.541 1.00 . A A . 9 GLN CB 1 1 5 2242 1 1 9 GLN CD C -6.432 2.124 1.302 1.00 . A A . 9 GLN CD 1 1 5 2243 1 1 9 GLN CG C -7.129 0.903 1.886 1.00 . A A . 9 GLN CG 1 1 5 2244 1 1 9 GLN H H -7.994 -1.604 2.608 1.00 . A A . 9 GLN H 1 1 5 2245 1 1 9 GLN HA H -5.859 -1.282 4.284 1.00 . A A . 9 GLN HA 1 1 5 2246 1 1 9 GLN HB2 H -5.162 0.380 2.678 1.00 . A A . 9 GLN HB2 1 1 5 2247 1 1 9 GLN HB3 H -6.005 -0.928 1.880 1.00 . A A . 9 GLN HB3 1 1 5 2248 1 1 9 GLN HE21 H -5.850 2.768 3.117 1.00 . A A . 9 GLN HE21 1 1 5 2249 1 1 9 GLN HE22 H -5.258 3.688 1.711 1.00 . A A . 9 GLN HE22 1 1 5 2250 1 1 9 GLN HG2 H -7.672 0.383 1.099 1.00 . A A . 9 GLN HG2 1 1 5 2251 1 1 9 GLN HG3 H -7.862 1.259 2.608 1.00 . A A . 9 GLN HG3 1 1 5 2252 1 1 9 GLN N N -7.804 -1.468 3.587 1.00 . A A . 9 GLN N 1 1 5 2253 1 1 9 GLN NE2 N -5.820 2.946 2.120 1.00 . A A . 9 GLN NE2 1 1 5 2254 1 1 9 GLN O O -6.031 1.532 4.753 1.00 . A A . 9 GLN O 1 1 5 2255 1 1 9 GLN OE1 O -6.201 2.196 0.105 1.00 . A A . 9 GLN OE1 1 1 5 2256 1 1 10 THR C C -7.698 2.966 6.453 1.00 . A A . 10 THR C 1 1 5 2257 1 1 10 THR CA C -7.840 1.503 6.929 1.00 . A A . 10 THR CA 1 1 5 2258 1 1 10 THR CB C -6.899 1.124 8.084 1.00 . A A . 10 THR CB 1 1 5 2259 1 1 10 THR CG2 C -7.200 1.869 9.379 1.00 . A A . 10 THR CG2 1 1 5 2260 1 1 10 THR H H -8.219 -0.353 5.927 1.00 . A A . 10 THR H 1 1 5 2261 1 1 10 THR HA H -8.856 1.418 7.310 1.00 . A A . 10 THR HA 1 1 5 2262 1 1 10 THR HB H -5.863 1.293 7.791 1.00 . A A . 10 THR HB 1 1 5 2263 1 1 10 THR HG1 H -6.294 -0.534 8.890 1.00 . A A . 10 THR HG1 1 1 5 2264 1 1 10 THR HG21 H -8.255 1.762 9.626 1.00 . A A . 10 THR HG21 1 1 5 2265 1 1 10 THR HG22 H -6.958 2.926 9.270 1.00 . A A . 10 THR HG22 1 1 5 2266 1 1 10 THR HG23 H -6.603 1.460 10.191 1.00 . A A . 10 THR HG23 1 1 5 2267 1 1 10 THR N N -7.698 0.512 5.839 1.00 . A A . 10 THR N 1 1 5 2268 1 1 10 THR O O -6.760 3.686 6.814 1.00 . A A . 10 THR O 1 1 5 2269 1 1 10 THR OG1 O -7.073 -0.251 8.370 1.00 . A A . 10 THR OG1 1 1 5 2270 1 1 11 CYS C C -9.069 5.784 5.678 1.00 . A A . 11 CYS C 1 1 5 2271 1 1 11 CYS CA C -8.515 4.642 4.806 1.00 . A A . 11 CYS CA 1 1 5 2272 1 1 11 CYS CB C -9.190 4.520 3.432 1.00 . A A . 11 CYS CB 1 1 5 2273 1 1 11 CYS H H -9.182 2.653 5.137 1.00 . A A . 11 CYS H 1 1 5 2274 1 1 11 CYS HA H -7.472 4.881 4.607 1.00 . A A . 11 CYS HA 1 1 5 2275 1 1 11 CYS HB2 H -8.910 3.565 2.988 1.00 . A A . 11 CYS HB2 1 1 5 2276 1 1 11 CYS HB3 H -10.275 4.541 3.539 1.00 . A A . 11 CYS HB3 1 1 5 2277 1 1 11 CYS N N -8.545 3.353 5.494 1.00 . A A . 11 CYS N 1 1 5 2278 1 1 11 CYS O O -10.237 6.164 5.592 1.00 . A A . 11 CYS O 1 1 5 2279 1 1 11 CYS SG S -8.654 5.827 2.298 1.00 . A A . 11 CYS SG 1 1 5 2280 1 1 12 ASP C C -8.257 8.822 6.438 1.00 . A A . 12 ASP C 1 1 5 2281 1 1 12 ASP CA C -8.345 7.540 7.292 1.00 . A A . 12 ASP CA 1 1 5 2282 1 1 12 ASP CB C -7.315 7.546 8.433 1.00 . A A . 12 ASP CB 1 1 5 2283 1 1 12 ASP CG C -7.710 6.638 9.593 1.00 . A A . 12 ASP CG 1 1 5 2284 1 1 12 ASP H H -7.338 5.776 6.678 1.00 . A A . 12 ASP H 1 1 5 2285 1 1 12 ASP HA H -9.339 7.555 7.742 1.00 . A A . 12 ASP HA 1 1 5 2286 1 1 12 ASP HB2 H -6.346 7.237 8.044 1.00 . A A . 12 ASP HB2 1 1 5 2287 1 1 12 ASP HB3 H -7.207 8.558 8.817 1.00 . A A . 12 ASP HB3 1 1 5 2288 1 1 12 ASP N N -8.211 6.274 6.569 1.00 . A A . 12 ASP N 1 1 5 2289 1 1 12 ASP O O -7.747 8.793 5.319 1.00 . A A . 12 ASP O 1 1 5 2290 1 1 12 ASP OD1 O -6.845 5.885 10.092 1.00 . A A . 12 ASP OD1 1 1 5 2291 1 1 12 ASP OD2 O -8.881 6.693 10.035 1.00 . A A . 12 ASP OD2 1 1 5 2292 1 1 13 SER C C -7.309 11.760 5.752 1.00 . A A . 13 SER C 1 1 5 2293 1 1 13 SER CA C -8.673 11.279 6.296 1.00 . A A . 13 SER CA 1 1 5 2294 1 1 13 SER CB C -9.302 12.314 7.237 1.00 . A A . 13 SER CB 1 1 5 2295 1 1 13 SER H H -9.167 9.899 7.858 1.00 . A A . 13 SER H 1 1 5 2296 1 1 13 SER HA H -9.337 11.189 5.436 1.00 . A A . 13 SER HA 1 1 5 2297 1 1 13 SER HB2 H -10.356 12.076 7.374 1.00 . A A . 13 SER HB2 1 1 5 2298 1 1 13 SER HB3 H -8.812 12.269 8.208 1.00 . A A . 13 SER HB3 1 1 5 2299 1 1 13 SER HG H -9.895 14.188 7.052 1.00 . A A . 13 SER HG 1 1 5 2300 1 1 13 SER N N -8.650 9.975 6.989 1.00 . A A . 13 SER N 1 1 5 2301 1 1 13 SER O O -7.238 12.348 4.670 1.00 . A A . 13 SER O 1 1 5 2302 1 1 13 SER OG O -9.169 13.621 6.720 1.00 . A A . 13 SER OG 1 1 5 2303 1 1 14 GLU C C -4.385 10.682 4.849 1.00 . A A . 14 GLU C 1 1 5 2304 1 1 14 GLU CA C -4.830 11.674 5.933 1.00 . A A . 14 GLU CA 1 1 5 2305 1 1 14 GLU CB C -3.844 11.533 7.110 1.00 . A A . 14 GLU CB 1 1 5 2306 1 1 14 GLU CD C -2.956 13.934 7.237 1.00 . A A . 14 GLU CD 1 1 5 2307 1 1 14 GLU CG C -3.699 12.801 7.955 1.00 . A A . 14 GLU CG 1 1 5 2308 1 1 14 GLU H H -6.307 10.972 7.315 1.00 . A A . 14 GLU H 1 1 5 2309 1 1 14 GLU HA H -4.747 12.673 5.502 1.00 . A A . 14 GLU HA 1 1 5 2310 1 1 14 GLU HB2 H -4.182 10.719 7.750 1.00 . A A . 14 GLU HB2 1 1 5 2311 1 1 14 GLU HB3 H -2.853 11.257 6.746 1.00 . A A . 14 GLU HB3 1 1 5 2312 1 1 14 GLU HG2 H -4.689 13.142 8.258 1.00 . A A . 14 GLU HG2 1 1 5 2313 1 1 14 GLU HG3 H -3.142 12.545 8.858 1.00 . A A . 14 GLU HG3 1 1 5 2314 1 1 14 GLU N N -6.202 11.452 6.433 1.00 . A A . 14 GLU N 1 1 5 2315 1 1 14 GLU O O -3.383 10.909 4.164 1.00 . A A . 14 GLU O 1 1 5 2316 1 1 14 GLU OE1 O -2.529 13.776 6.070 1.00 . A A . 14 GLU OE1 1 1 5 2317 1 1 14 GLU OE2 O -2.809 15.017 7.843 1.00 . A A . 14 GLU OE2 1 1 5 2318 1 1 15 ARG C C -4.617 8.016 2.873 1.00 . A A . 15 ARG C 1 1 5 2319 1 1 15 ARG CA C -4.387 8.261 4.361 1.00 . A A . 15 ARG CA 1 1 5 2320 1 1 15 ARG CB C -4.883 7.114 5.255 1.00 . A A . 15 ARG CB 1 1 5 2321 1 1 15 ARG CD C -4.375 4.819 4.397 1.00 . A A . 15 ARG CD 1 1 5 2322 1 1 15 ARG CG C -3.898 5.938 5.345 1.00 . A A . 15 ARG CG 1 1 5 2323 1 1 15 ARG CZ C -3.187 2.983 5.547 1.00 . A A . 15 ARG CZ 1 1 5 2324 1 1 15 ARG H H -5.909 9.426 5.285 1.00 . A A . 15 ARG H 1 1 5 2325 1 1 15 ARG HA H -3.316 8.367 4.522 1.00 . A A . 15 ARG HA 1 1 5 2326 1 1 15 ARG HB2 H -4.981 7.508 6.266 1.00 . A A . 15 ARG HB2 1 1 5 2327 1 1 15 ARG HB3 H -5.873 6.784 4.937 1.00 . A A . 15 ARG HB3 1 1 5 2328 1 1 15 ARG HD2 H -5.335 4.448 4.727 1.00 . A A . 15 ARG HD2 1 1 5 2329 1 1 15 ARG HD3 H -4.401 5.197 3.386 1.00 . A A . 15 ARG HD3 1 1 5 2330 1 1 15 ARG HE H -2.648 3.680 3.775 1.00 . A A . 15 ARG HE 1 1 5 2331 1 1 15 ARG HG2 H -2.886 6.256 5.093 1.00 . A A . 15 ARG HG2 1 1 5 2332 1 1 15 ARG HG3 H -3.896 5.577 6.373 1.00 . A A . 15 ARG HG3 1 1 5 2333 1 1 15 ARG HH11 H -4.920 3.361 6.523 1.00 . A A . 15 ARG HH11 1 1 5 2334 1 1 15 ARG HH12 H -3.737 2.336 7.336 1.00 . A A . 15 ARG HH12 1 1 5 2335 1 1 15 ARG HH21 H -1.496 2.215 4.812 1.00 . A A . 15 ARG HH21 1 1 5 2336 1 1 15 ARG HH22 H -1.955 1.695 6.442 1.00 . A A . 15 ARG HH22 1 1 5 2337 1 1 15 ARG N N -5.013 9.503 4.814 1.00 . A A . 15 ARG N 1 1 5 2338 1 1 15 ARG NE N -3.370 3.752 4.488 1.00 . A A . 15 ARG NE 1 1 5 2339 1 1 15 ARG NH1 N -4.005 2.924 6.561 1.00 . A A . 15 ARG NH1 1 1 5 2340 1 1 15 ARG NH2 N -2.115 2.257 5.612 1.00 . A A . 15 ARG NH2 1 1 5 2341 1 1 15 ARG O O -5.734 8.114 2.368 1.00 . A A . 15 ARG O 1 1 5 2342 1 1 16 LYS C C -4.474 6.219 0.368 1.00 . A A . 16 LYS C 1 1 5 2343 1 1 16 LYS CA C -3.548 7.384 0.732 1.00 . A A . 16 LYS CA 1 1 5 2344 1 1 16 LYS CB C -2.109 7.226 0.195 1.00 . A A . 16 LYS CB 1 1 5 2345 1 1 16 LYS CD C 0.172 6.049 0.384 1.00 . A A . 16 LYS CD 1 1 5 2346 1 1 16 LYS CE C 0.473 6.126 -1.121 1.00 . A A . 16 LYS CE 1 1 5 2347 1 1 16 LYS CG C -1.334 5.992 0.701 1.00 . A A . 16 LYS CG 1 1 5 2348 1 1 16 LYS H H -2.654 7.623 2.664 1.00 . A A . 16 LYS H 1 1 5 2349 1 1 16 LYS HA H -3.965 8.281 0.268 1.00 . A A . 16 LYS HA 1 1 5 2350 1 1 16 LYS HB2 H -2.151 7.192 -0.894 1.00 . A A . 16 LYS HB2 1 1 5 2351 1 1 16 LYS HB3 H -1.551 8.120 0.475 1.00 . A A . 16 LYS HB3 1 1 5 2352 1 1 16 LYS HD2 H 0.606 6.916 0.884 1.00 . A A . 16 LYS HD2 1 1 5 2353 1 1 16 LYS HD3 H 0.639 5.152 0.796 1.00 . A A . 16 LYS HD3 1 1 5 2354 1 1 16 LYS HE2 H 0.000 5.273 -1.618 1.00 . A A . 16 LYS HE2 1 1 5 2355 1 1 16 LYS HE3 H 0.031 7.043 -1.525 1.00 . A A . 16 LYS HE3 1 1 5 2356 1 1 16 LYS HG2 H -1.445 5.917 1.783 1.00 . A A . 16 LYS HG2 1 1 5 2357 1 1 16 LYS HG3 H -1.755 5.092 0.253 1.00 . A A . 16 LYS HG3 1 1 5 2358 1 1 16 LYS HZ1 H 2.379 5.270 -1.041 1.00 . A A . 16 LYS HZ1 1 1 5 2359 1 1 16 LYS HZ2 H 2.392 6.919 -0.985 1.00 . A A . 16 LYS HZ2 1 1 5 2360 1 1 16 LYS HZ3 H 2.125 6.135 -2.393 1.00 . A A . 16 LYS HZ3 1 1 5 2361 1 1 16 LYS N N -3.541 7.627 2.180 1.00 . A A . 16 LYS N 1 1 5 2362 1 1 16 LYS NZ N 1.933 6.115 -1.391 1.00 . A A . 16 LYS NZ 1 1 5 2363 1 1 16 LYS O O -4.360 5.119 0.913 1.00 . A A . 16 LYS O 1 1 5 2364 1 1 17 CYS C C -5.718 4.790 -2.354 1.00 . A A . 17 CYS C 1 1 5 2365 1 1 17 CYS CA C -6.296 5.455 -1.099 1.00 . A A . 17 CYS CA 1 1 5 2366 1 1 17 CYS CB C -7.654 6.119 -1.326 1.00 . A A . 17 CYS CB 1 1 5 2367 1 1 17 CYS H H -5.402 7.385 -0.980 1.00 . A A . 17 CYS H 1 1 5 2368 1 1 17 CYS HA H -6.436 4.690 -0.336 1.00 . A A . 17 CYS HA 1 1 5 2369 1 1 17 CYS HB2 H -7.939 6.634 -0.407 1.00 . A A . 17 CYS HB2 1 1 5 2370 1 1 17 CYS HB3 H -7.554 6.874 -2.107 1.00 . A A . 17 CYS HB3 1 1 5 2371 1 1 17 CYS N N -5.361 6.455 -0.594 1.00 . A A . 17 CYS N 1 1 5 2372 1 1 17 CYS O O -5.333 5.476 -3.300 1.00 . A A . 17 CYS O 1 1 5 2373 1 1 17 CYS SG S -9.006 5.003 -1.775 1.00 . A A . 17 CYS SG 1 1 5 2374 1 1 18 CYS C C -4.666 3.099 -4.669 1.00 . A A . 18 CYS C 1 1 5 2375 1 1 18 CYS CA C -4.681 2.700 -3.183 1.00 . A A . 18 CYS CA 1 1 5 2376 1 1 18 CYS CB C -5.003 1.213 -3.042 1.00 . A A . 18 CYS CB 1 1 5 2377 1 1 18 CYS H H -5.940 2.994 -1.503 1.00 . A A . 18 CYS H 1 1 5 2378 1 1 18 CYS HA H -3.681 2.873 -2.783 1.00 . A A . 18 CYS HA 1 1 5 2379 1 1 18 CYS HB2 H -5.555 1.049 -2.116 1.00 . A A . 18 CYS HB2 1 1 5 2380 1 1 18 CYS HB3 H -5.642 0.929 -3.870 1.00 . A A . 18 CYS HB3 1 1 5 2381 1 1 18 CYS N N -5.618 3.459 -2.349 1.00 . A A . 18 CYS N 1 1 5 2382 1 1 18 CYS O O -3.628 3.534 -5.162 1.00 . A A . 18 CYS O 1 1 5 2383 1 1 18 CYS SG S -3.581 0.101 -3.039 1.00 . A A . 18 CYS SG 1 1 5 2384 1 1 19 GLU C C -6.892 4.789 -6.774 1.00 . A A . 19 GLU C 1 1 5 2385 1 1 19 GLU CA C -6.004 3.521 -6.735 1.00 . A A . 19 GLU CA 1 1 5 2386 1 1 19 GLU CB C -6.547 2.407 -7.670 1.00 . A A . 19 GLU CB 1 1 5 2387 1 1 19 GLU CD C -4.906 0.423 -7.288 1.00 . A A . 19 GLU CD 1 1 5 2388 1 1 19 GLU CG C -6.345 0.944 -7.257 1.00 . A A . 19 GLU CG 1 1 5 2389 1 1 19 GLU H H -6.629 2.700 -4.865 1.00 . A A . 19 GLU H 1 1 5 2390 1 1 19 GLU HA H -5.034 3.811 -7.137 1.00 . A A . 19 GLU HA 1 1 5 2391 1 1 19 GLU HB2 H -7.621 2.519 -7.771 1.00 . A A . 19 GLU HB2 1 1 5 2392 1 1 19 GLU HB3 H -6.138 2.560 -8.668 1.00 . A A . 19 GLU HB3 1 1 5 2393 1 1 19 GLU HG2 H -6.759 0.807 -6.258 1.00 . A A . 19 GLU HG2 1 1 5 2394 1 1 19 GLU HG3 H -6.939 0.327 -7.935 1.00 . A A . 19 GLU HG3 1 1 5 2395 1 1 19 GLU N N -5.820 3.058 -5.344 1.00 . A A . 19 GLU N 1 1 5 2396 1 1 19 GLU O O -7.694 4.966 -7.687 1.00 . A A . 19 GLU O 1 1 5 2397 1 1 19 GLU OE1 O -4.706 -0.707 -6.792 1.00 . A A . 19 GLU OE1 1 1 5 2398 1 1 19 GLU OE2 O -3.981 1.110 -7.789 1.00 . A A . 19 GLU OE2 1 1 5 2399 1 1 20 GLY C C -9.309 6.265 -5.503 1.00 . A A . 20 GLY C 1 1 5 2400 1 1 20 GLY CA C -7.841 6.712 -5.550 1.00 . A A . 20 GLY CA 1 1 5 2401 1 1 20 GLY H H -6.192 5.473 -4.991 1.00 . A A . 20 GLY H 1 1 5 2402 1 1 20 GLY HA2 H -7.612 7.223 -4.615 1.00 . A A . 20 GLY HA2 1 1 5 2403 1 1 20 GLY HA3 H -7.713 7.411 -6.375 1.00 . A A . 20 GLY HA3 1 1 5 2404 1 1 20 GLY N N -6.900 5.599 -5.709 1.00 . A A . 20 GLY N 1 1 5 2405 1 1 20 GLY O O -10.185 6.936 -6.047 1.00 . A A . 20 GLY O 1 1 5 2406 1 1 21 MET C C -11.792 4.881 -3.831 1.00 . A A . 21 MET C 1 1 5 2407 1 1 21 MET CA C -10.863 4.387 -4.965 1.00 . A A . 21 MET CA 1 1 5 2408 1 1 21 MET CB C -10.584 2.871 -4.929 1.00 . A A . 21 MET CB 1 1 5 2409 1 1 21 MET CE C -10.285 1.496 -8.885 1.00 . A A . 21 MET CE 1 1 5 2410 1 1 21 MET CG C -10.056 2.352 -6.266 1.00 . A A . 21 MET CG 1 1 5 2411 1 1 21 MET H H -8.784 4.588 -4.561 1.00 . A A . 21 MET H 1 1 5 2412 1 1 21 MET HA H -11.387 4.602 -5.897 1.00 . A A . 21 MET HA 1 1 5 2413 1 1 21 MET HB2 H -9.851 2.662 -4.152 1.00 . A A . 21 MET HB2 1 1 5 2414 1 1 21 MET HB3 H -11.485 2.312 -4.706 1.00 . A A . 21 MET HB3 1 1 5 2415 1 1 21 MET HE1 H -9.546 2.227 -9.212 1.00 . A A . 21 MET HE1 1 1 5 2416 1 1 21 MET HE2 H -9.774 0.607 -8.516 1.00 . A A . 21 MET HE2 1 1 5 2417 1 1 21 MET HE3 H -10.914 1.217 -9.731 1.00 . A A . 21 MET HE3 1 1 5 2418 1 1 21 MET HG2 H -9.269 3.017 -6.608 1.00 . A A . 21 MET HG2 1 1 5 2419 1 1 21 MET HG3 H -9.624 1.365 -6.101 1.00 . A A . 21 MET HG3 1 1 5 2420 1 1 21 MET N N -9.562 5.065 -4.984 1.00 . A A . 21 MET N 1 1 5 2421 1 1 21 MET O O -11.685 6.013 -3.359 1.00 . A A . 21 MET O 1 1 5 2422 1 1 21 MET SD S -11.307 2.213 -7.571 1.00 . A A . 21 MET SD 1 1 5 2423 1 1 22 VAL C C -13.293 4.396 -0.982 1.00 . A A . 22 VAL C 1 1 5 2424 1 1 22 VAL CA C -13.797 4.331 -2.436 1.00 . A A . 22 VAL CA 1 1 5 2425 1 1 22 VAL CB C -14.981 3.343 -2.586 1.00 . A A . 22 VAL CB 1 1 5 2426 1 1 22 VAL CG1 C -16.236 3.919 -1.937 1.00 . A A . 22 VAL CG1 1 1 5 2427 1 1 22 VAL CG2 C -15.353 3.014 -4.033 1.00 . A A . 22 VAL CG2 1 1 5 2428 1 1 22 VAL H H -12.824 3.154 -3.903 1.00 . A A . 22 VAL H 1 1 5 2429 1 1 22 VAL HA H -14.185 5.324 -2.668 1.00 . A A . 22 VAL HA 1 1 5 2430 1 1 22 VAL HB H -14.734 2.396 -2.105 1.00 . A A . 22 VAL HB 1 1 5 2431 1 1 22 VAL HG11 H -16.544 4.808 -2.487 1.00 . A A . 22 VAL HG11 1 1 5 2432 1 1 22 VAL HG12 H -17.038 3.180 -1.959 1.00 . A A . 22 VAL HG12 1 1 5 2433 1 1 22 VAL HG13 H -16.019 4.193 -0.910 1.00 . A A . 22 VAL HG13 1 1 5 2434 1 1 22 VAL HG21 H -15.563 3.931 -4.583 1.00 . A A . 22 VAL HG21 1 1 5 2435 1 1 22 VAL HG22 H -14.547 2.477 -4.527 1.00 . A A . 22 VAL HG22 1 1 5 2436 1 1 22 VAL HG23 H -16.236 2.374 -4.042 1.00 . A A . 22 VAL HG23 1 1 5 2437 1 1 22 VAL N N -12.760 4.050 -3.437 1.00 . A A . 22 VAL N 1 1 5 2438 1 1 22 VAL O O -13.536 3.473 -0.214 1.00 . A A . 22 VAL O 1 1 5 2439 1 1 23 CYS C C -13.049 5.700 1.907 1.00 . A A . 23 CYS C 1 1 5 2440 1 1 23 CYS CA C -12.010 5.609 0.762 1.00 . A A . 23 CYS CA 1 1 5 2441 1 1 23 CYS CB C -11.103 6.847 0.749 1.00 . A A . 23 CYS CB 1 1 5 2442 1 1 23 CYS H H -12.373 6.164 -1.279 1.00 . A A . 23 CYS H 1 1 5 2443 1 1 23 CYS HA H -11.383 4.741 0.959 1.00 . A A . 23 CYS HA 1 1 5 2444 1 1 23 CYS HB2 H -10.394 6.768 -0.073 1.00 . A A . 23 CYS HB2 1 1 5 2445 1 1 23 CYS HB3 H -11.732 7.715 0.554 1.00 . A A . 23 CYS HB3 1 1 5 2446 1 1 23 CYS N N -12.602 5.466 -0.581 1.00 . A A . 23 CYS N 1 1 5 2447 1 1 23 CYS O O -13.473 6.803 2.267 1.00 . A A . 23 CYS O 1 1 5 2448 1 1 23 CYS SG S -10.169 7.186 2.270 1.00 . A A . 23 CYS SG 1 1 5 2449 1 1 24 ARG C C -13.715 3.096 4.471 1.00 . A A . 24 ARG C 1 1 5 2450 1 1 24 ARG CA C -14.147 4.404 3.781 1.00 . A A . 24 ARG CA 1 1 5 2451 1 1 24 ARG CB C -15.689 4.427 3.609 1.00 . A A . 24 ARG CB 1 1 5 2452 1 1 24 ARG CD C -16.530 5.487 1.518 1.00 . A A . 24 ARG CD 1 1 5 2453 1 1 24 ARG CG C -16.356 5.692 3.035 1.00 . A A . 24 ARG CG 1 1 5 2454 1 1 24 ARG CZ C -18.019 6.745 -0.031 1.00 . A A . 24 ARG CZ 1 1 5 2455 1 1 24 ARG H H -13.064 3.701 2.058 1.00 . A A . 24 ARG H 1 1 5 2456 1 1 24 ARG HA H -13.875 5.230 4.442 1.00 . A A . 24 ARG HA 1 1 5 2457 1 1 24 ARG HB2 H -16.002 3.558 3.032 1.00 . A A . 24 ARG HB2 1 1 5 2458 1 1 24 ARG HB3 H -16.111 4.296 4.604 1.00 . A A . 24 ARG HB3 1 1 5 2459 1 1 24 ARG HD2 H -15.570 5.385 1.050 1.00 . A A . 24 ARG HD2 1 1 5 2460 1 1 24 ARG HD3 H -17.128 4.610 1.353 1.00 . A A . 24 ARG HD3 1 1 5 2461 1 1 24 ARG HE H -16.890 7.588 1.368 1.00 . A A . 24 ARG HE 1 1 5 2462 1 1 24 ARG HG2 H -17.346 5.799 3.482 1.00 . A A . 24 ARG HG2 1 1 5 2463 1 1 24 ARG HG3 H -15.774 6.581 3.270 1.00 . A A . 24 ARG HG3 1 1 5 2464 1 1 24 ARG HH11 H -17.970 4.807 -0.437 1.00 . A A . 24 ARG HH11 1 1 5 2465 1 1 24 ARG HH12 H -18.779 5.799 -1.616 1.00 . A A . 24 ARG HH12 1 1 5 2466 1 1 24 ARG HH21 H -18.169 8.745 -0.027 1.00 . A A . 24 ARG HH21 1 1 5 2467 1 1 24 ARG HH22 H -19.114 7.925 -1.245 1.00 . A A . 24 ARG HH22 1 1 5 2468 1 1 24 ARG N N -13.418 4.551 2.498 1.00 . A A . 24 ARG N 1 1 5 2469 1 1 24 ARG NE N -17.206 6.687 1.008 1.00 . A A . 24 ARG NE 1 1 5 2470 1 1 24 ARG NH1 N -18.395 5.681 -0.682 1.00 . A A . 24 ARG NH1 1 1 5 2471 1 1 24 ARG NH2 N -18.466 7.879 -0.470 1.00 . A A . 24 ARG NH2 1 1 5 2472 1 1 24 ARG O O -14.323 2.048 4.254 1.00 . A A . 24 ARG O 1 1 5 2473 1 1 25 LEU C C -11.214 1.196 4.528 1.00 . A A . 25 LEU C 1 1 5 2474 1 1 25 LEU CA C -11.834 1.976 5.702 1.00 . A A . 25 LEU CA 1 1 5 2475 1 1 25 LEU CB C -12.593 1.046 6.678 1.00 . A A . 25 LEU CB 1 1 5 2476 1 1 25 LEU CD1 C -13.959 0.736 8.763 1.00 . A A . 25 LEU CD1 1 1 5 2477 1 1 25 LEU CD2 C -11.936 2.153 8.879 1.00 . A A . 25 LEU CD2 1 1 5 2478 1 1 25 LEU CG C -13.085 1.709 7.975 1.00 . A A . 25 LEU CG 1 1 5 2479 1 1 25 LEU H H -12.268 4.057 5.458 1.00 . A A . 25 LEU H 1 1 5 2480 1 1 25 LEU HA H -10.989 2.378 6.259 1.00 . A A . 25 LEU HA 1 1 5 2481 1 1 25 LEU HB2 H -13.452 0.614 6.165 1.00 . A A . 25 LEU HB2 1 1 5 2482 1 1 25 LEU HB3 H -11.934 0.219 6.945 1.00 . A A . 25 LEU HB3 1 1 5 2483 1 1 25 LEU HD11 H -14.331 1.222 9.666 1.00 . A A . 25 LEU HD11 1 1 5 2484 1 1 25 LEU HD12 H -13.385 -0.149 9.037 1.00 . A A . 25 LEU HD12 1 1 5 2485 1 1 25 LEU HD13 H -14.813 0.448 8.152 1.00 . A A . 25 LEU HD13 1 1 5 2486 1 1 25 LEU HD21 H -11.366 2.944 8.395 1.00 . A A . 25 LEU HD21 1 1 5 2487 1 1 25 LEU HD22 H -11.281 1.312 9.102 1.00 . A A . 25 LEU HD22 1 1 5 2488 1 1 25 LEU HD23 H -12.336 2.550 9.811 1.00 . A A . 25 LEU HD23 1 1 5 2489 1 1 25 LEU HG H -13.688 2.575 7.722 1.00 . A A . 25 LEU HG 1 1 5 2490 1 1 25 LEU N N -12.639 3.136 5.261 1.00 . A A . 25 LEU N 1 1 5 2491 1 1 25 LEU O O -10.006 1.268 4.317 1.00 . A A . 25 LEU O 1 1 5 2492 1 1 26 TRP C C -11.256 1.070 1.371 1.00 . A A . 26 TRP C 1 1 5 2493 1 1 26 TRP CA C -11.535 -0.016 2.426 1.00 . A A . 26 TRP CA 1 1 5 2494 1 1 26 TRP CB C -12.456 -1.147 1.920 1.00 . A A . 26 TRP CB 1 1 5 2495 1 1 26 TRP CD1 C -14.371 -1.904 3.400 1.00 . A A . 26 TRP CD1 1 1 5 2496 1 1 26 TRP CD2 C -14.948 -0.198 2.073 1.00 . A A . 26 TRP CD2 1 1 5 2497 1 1 26 TRP CE2 C -16.100 -0.532 2.846 1.00 . A A . 26 TRP CE2 1 1 5 2498 1 1 26 TRP CE3 C -15.055 0.923 1.223 1.00 . A A . 26 TRP CE3 1 1 5 2499 1 1 26 TRP CG C -13.880 -1.144 2.394 1.00 . A A . 26 TRP CG 1 1 5 2500 1 1 26 TRP CH2 C -17.383 1.279 1.879 1.00 . A A . 26 TRP CH2 1 1 5 2501 1 1 26 TRP CZ2 C -17.302 0.182 2.750 1.00 . A A . 26 TRP CZ2 1 1 5 2502 1 1 26 TRP CZ3 C -16.257 1.648 1.122 1.00 . A A . 26 TRP CZ3 1 1 5 2503 1 1 26 TRP H H -13.008 0.568 3.860 1.00 . A A . 26 TRP H 1 1 5 2504 1 1 26 TRP HA H -10.566 -0.476 2.616 1.00 . A A . 26 TRP HA 1 1 5 2505 1 1 26 TRP HB2 H -12.471 -1.161 0.831 1.00 . A A . 26 TRP HB2 1 1 5 2506 1 1 26 TRP HB3 H -12.009 -2.094 2.225 1.00 . A A . 26 TRP HB3 1 1 5 2507 1 1 26 TRP HD1 H -13.814 -2.670 3.926 1.00 . A A . 26 TRP HD1 1 1 5 2508 1 1 26 TRP HE1 H -16.286 -2.090 4.285 1.00 . A A . 26 TRP HE1 1 1 5 2509 1 1 26 TRP HE3 H -14.190 1.241 0.662 1.00 . A A . 26 TRP HE3 1 1 5 2510 1 1 26 TRP HH2 H -18.302 1.845 1.809 1.00 . A A . 26 TRP HH2 1 1 5 2511 1 1 26 TRP HZ2 H -18.146 -0.097 3.361 1.00 . A A . 26 TRP HZ2 1 1 5 2512 1 1 26 TRP HZ3 H -16.301 2.505 0.474 1.00 . A A . 26 TRP HZ3 1 1 5 2513 1 1 26 TRP N N -12.006 0.520 3.702 1.00 . A A . 26 TRP N 1 1 5 2514 1 1 26 TRP NE1 N -15.698 -1.596 3.619 1.00 . A A . 26 TRP NE1 1 1 5 2515 1 1 26 TRP O O -11.647 2.226 1.517 1.00 . A A . 26 TRP O 1 1 5 2516 1 1 27 CYS C C -10.816 0.379 -2.154 1.00 . A A . 27 CYS C 1 1 5 2517 1 1 27 CYS CA C -10.518 1.354 -1.006 1.00 . A A . 27 CYS CA 1 1 5 2518 1 1 27 CYS CB C -9.162 2.057 -1.129 1.00 . A A . 27 CYS CB 1 1 5 2519 1 1 27 CYS H H -10.311 -0.314 0.277 1.00 . A A . 27 CYS H 1 1 5 2520 1 1 27 CYS HA H -11.294 2.122 -1.049 1.00 . A A . 27 CYS HA 1 1 5 2521 1 1 27 CYS HB2 H -8.380 1.400 -0.758 1.00 . A A . 27 CYS HB2 1 1 5 2522 1 1 27 CYS HB3 H -8.948 2.252 -2.178 1.00 . A A . 27 CYS HB3 1 1 5 2523 1 1 27 CYS N N -10.629 0.642 0.272 1.00 . A A . 27 CYS N 1 1 5 2524 1 1 27 CYS O O -10.011 0.193 -3.069 1.00 . A A . 27 CYS O 1 1 5 2525 1 1 27 CYS SG S -9.111 3.641 -0.270 1.00 . A A . 27 CYS SG 1 1 5 2526 1 1 28 LYS C C -12.656 -0.734 -4.364 1.00 . A A . 28 LYS C 1 1 5 2527 1 1 28 LYS CA C -12.455 -1.327 -2.966 1.00 . A A . 28 LYS CA 1 1 5 2528 1 1 28 LYS CB C -13.755 -1.976 -2.434 1.00 . A A . 28 LYS CB 1 1 5 2529 1 1 28 LYS CD C -16.189 -1.630 -1.701 1.00 . A A . 28 LYS CD 1 1 5 2530 1 1 28 LYS CE C -17.112 -0.623 -1.002 1.00 . A A . 28 LYS CE 1 1 5 2531 1 1 28 LYS CG C -14.831 -0.968 -1.985 1.00 . A A . 28 LYS CG 1 1 5 2532 1 1 28 LYS H H -12.545 -0.091 -1.237 1.00 . A A . 28 LYS H 1 1 5 2533 1 1 28 LYS HA H -11.705 -2.114 -3.061 1.00 . A A . 28 LYS HA 1 1 5 2534 1 1 28 LYS HB2 H -14.171 -2.614 -3.216 1.00 . A A . 28 LYS HB2 1 1 5 2535 1 1 28 LYS HB3 H -13.507 -2.616 -1.586 1.00 . A A . 28 LYS HB3 1 1 5 2536 1 1 28 LYS HD2 H -16.626 -1.962 -2.642 1.00 . A A . 28 LYS HD2 1 1 5 2537 1 1 28 LYS HD3 H -16.058 -2.498 -1.058 1.00 . A A . 28 LYS HD3 1 1 5 2538 1 1 28 LYS HE2 H -16.870 -0.604 0.065 1.00 . A A . 28 LYS HE2 1 1 5 2539 1 1 28 LYS HE3 H -16.910 0.371 -1.409 1.00 . A A . 28 LYS HE3 1 1 5 2540 1 1 28 LYS HG2 H -14.484 -0.473 -1.080 1.00 . A A . 28 LYS HG2 1 1 5 2541 1 1 28 LYS HG3 H -14.975 -0.213 -2.758 1.00 . A A . 28 LYS HG3 1 1 5 2542 1 1 28 LYS HZ1 H -18.787 -0.886 -2.180 1.00 . A A . 28 LYS HZ1 1 1 5 2543 1 1 28 LYS HZ2 H -19.133 -0.228 -0.731 1.00 . A A . 28 LYS HZ2 1 1 5 2544 1 1 28 LYS HZ3 H -18.818 -1.847 -0.867 1.00 . A A . 28 LYS HZ3 1 1 5 2545 1 1 28 LYS N N -11.949 -0.326 -2.018 1.00 . A A . 28 LYS N 1 1 5 2546 1 1 28 LYS NZ N -18.548 -0.926 -1.190 1.00 . A A . 28 LYS NZ 1 1 5 2547 1 1 28 LYS O O -13.026 0.432 -4.504 1.00 . A A . 28 LYS O 1 1 5 2548 1 1 29 LYS C C -14.066 -0.669 -7.074 1.00 . A A . 29 LYS C 1 1 5 2549 1 1 29 LYS CA C -12.638 -1.164 -6.806 1.00 . A A . 29 LYS CA 1 1 5 2550 1 1 29 LYS CB C -12.289 -2.348 -7.722 1.00 . A A . 29 LYS CB 1 1 5 2551 1 1 29 LYS CD C -10.405 -3.913 -8.463 1.00 . A A . 29 LYS CD 1 1 5 2552 1 1 29 LYS CE C -11.170 -4.285 -9.738 1.00 . A A . 29 LYS CE 1 1 5 2553 1 1 29 LYS CG C -10.776 -2.515 -7.943 1.00 . A A . 29 LYS CG 1 1 5 2554 1 1 29 LYS H H -12.089 -2.479 -5.207 1.00 . A A . 29 LYS H 1 1 5 2555 1 1 29 LYS HA H -11.960 -0.349 -7.045 1.00 . A A . 29 LYS HA 1 1 5 2556 1 1 29 LYS HB2 H -12.701 -3.258 -7.284 1.00 . A A . 29 LYS HB2 1 1 5 2557 1 1 29 LYS HB3 H -12.759 -2.194 -8.695 1.00 . A A . 29 LYS HB3 1 1 5 2558 1 1 29 LYS HD2 H -9.332 -3.954 -8.656 1.00 . A A . 29 LYS HD2 1 1 5 2559 1 1 29 LYS HD3 H -10.639 -4.639 -7.684 1.00 . A A . 29 LYS HD3 1 1 5 2560 1 1 29 LYS HE2 H -12.227 -4.071 -9.573 1.00 . A A . 29 LYS HE2 1 1 5 2561 1 1 29 LYS HE3 H -10.830 -3.659 -10.568 1.00 . A A . 29 LYS HE3 1 1 5 2562 1 1 29 LYS HG2 H -10.431 -1.758 -8.647 1.00 . A A . 29 LYS HG2 1 1 5 2563 1 1 29 LYS HG3 H -10.255 -2.355 -7.003 1.00 . A A . 29 LYS HG3 1 1 5 2564 1 1 29 LYS HZ1 H -10.864 -6.294 -9.243 1.00 . A A . 29 LYS HZ1 1 1 5 2565 1 1 29 LYS HZ2 H -10.264 -5.885 -10.727 1.00 . A A . 29 LYS HZ2 1 1 5 2566 1 1 29 LYS HZ3 H -11.860 -6.079 -10.516 1.00 . A A . 29 LYS HZ3 1 1 5 2567 1 1 29 LYS N N -12.435 -1.545 -5.402 1.00 . A A . 29 LYS N 1 1 5 2568 1 1 29 LYS NZ N -11.022 -5.720 -10.068 1.00 . A A . 29 LYS NZ 1 1 5 2569 1 1 29 LYS O O -15.005 -1.463 -7.064 1.00 . A A . 29 LYS O 1 1 5 2570 1 1 30 LYS C C -15.019 2.485 -8.761 1.00 . A A . 30 LYS C 1 1 5 2571 1 1 30 LYS CA C -15.418 1.228 -7.979 1.00 . A A . 30 LYS CA 1 1 5 2572 1 1 30 LYS CB C -16.485 1.485 -6.891 1.00 . A A . 30 LYS CB 1 1 5 2573 1 1 30 LYS CD C -18.322 2.797 -8.148 1.00 . A A . 30 LYS CD 1 1 5 2574 1 1 30 LYS CE C -19.698 2.619 -8.795 1.00 . A A . 30 LYS CE 1 1 5 2575 1 1 30 LYS CG C -17.925 1.502 -7.427 1.00 . A A . 30 LYS CG 1 1 5 2576 1 1 30 LYS H H -13.393 1.209 -7.282 1.00 . A A . 30 LYS H 1 1 5 2577 1 1 30 LYS HA H -15.838 0.517 -8.692 1.00 . A A . 30 LYS HA 1 1 5 2578 1 1 30 LYS HB2 H -16.432 0.688 -6.149 1.00 . A A . 30 LYS HB2 1 1 5 2579 1 1 30 LYS HB3 H -16.285 2.424 -6.386 1.00 . A A . 30 LYS HB3 1 1 5 2580 1 1 30 LYS HD2 H -18.348 3.615 -7.425 1.00 . A A . 30 LYS HD2 1 1 5 2581 1 1 30 LYS HD3 H -17.603 3.036 -8.928 1.00 . A A . 30 LYS HD3 1 1 5 2582 1 1 30 LYS HE2 H -19.626 1.832 -9.553 1.00 . A A . 30 LYS HE2 1 1 5 2583 1 1 30 LYS HE3 H -20.408 2.292 -8.030 1.00 . A A . 30 LYS HE3 1 1 5 2584 1 1 30 LYS HG2 H -18.056 0.655 -8.098 1.00 . A A . 30 LYS HG2 1 1 5 2585 1 1 30 LYS HG3 H -18.604 1.365 -6.583 1.00 . A A . 30 LYS HG3 1 1 5 2586 1 1 30 LYS HZ1 H -20.259 4.595 -8.685 1.00 . A A . 30 LYS HZ1 1 1 5 2587 1 1 30 LYS HZ2 H -21.088 3.755 -9.826 1.00 . A A . 30 LYS HZ2 1 1 5 2588 1 1 30 LYS HZ3 H -19.518 4.211 -10.108 1.00 . A A . 30 LYS HZ3 1 1 5 2589 1 1 30 LYS N N -14.210 0.622 -7.391 1.00 . A A . 30 LYS N 1 1 5 2590 1 1 30 LYS NZ N -20.168 3.881 -9.409 1.00 . A A . 30 LYS NZ 1 1 5 2591 1 1 30 LYS O O -15.059 3.609 -8.255 1.00 . A A . 30 LYS O 1 1 5 2592 1 1 31 LEU C C -14.644 2.898 -12.363 1.00 . A A . 31 LEU C 1 1 5 2593 1 1 31 LEU CA C -14.233 3.323 -10.953 1.00 . A A . 31 LEU CA 1 1 5 2594 1 1 31 LEU CB C -12.737 3.664 -10.815 1.00 . A A . 31 LEU CB 1 1 5 2595 1 1 31 LEU CD1 C -11.147 5.581 -11.207 1.00 . A A . 31 LEU CD1 1 1 5 2596 1 1 31 LEU CD2 C -11.587 3.993 -13.058 1.00 . A A . 31 LEU CD2 1 1 5 2597 1 1 31 LEU CG C -12.210 4.685 -11.844 1.00 . A A . 31 LEU CG 1 1 5 2598 1 1 31 LEU H H -14.568 1.319 -10.331 1.00 . A A . 31 LEU H 1 1 5 2599 1 1 31 LEU HA H -14.811 4.211 -10.710 1.00 . A A . 31 LEU HA 1 1 5 2600 1 1 31 LEU HB2 H -12.586 4.061 -9.810 1.00 . A A . 31 LEU HB2 1 1 5 2601 1 1 31 LEU HB3 H -12.150 2.749 -10.893 1.00 . A A . 31 LEU HB3 1 1 5 2602 1 1 31 LEU HD11 H -10.752 6.277 -11.947 1.00 . A A . 31 LEU HD11 1 1 5 2603 1 1 31 LEU HD12 H -10.330 4.971 -10.822 1.00 . A A . 31 LEU HD12 1 1 5 2604 1 1 31 LEU HD13 H -11.579 6.146 -10.382 1.00 . A A . 31 LEU HD13 1 1 5 2605 1 1 31 LEU HD21 H -12.321 3.386 -13.581 1.00 . A A . 31 LEU HD21 1 1 5 2606 1 1 31 LEU HD22 H -10.763 3.356 -12.744 1.00 . A A . 31 LEU HD22 1 1 5 2607 1 1 31 LEU HD23 H -11.206 4.740 -13.753 1.00 . A A . 31 LEU HD23 1 1 5 2608 1 1 31 LEU HG H -13.026 5.328 -12.175 1.00 . A A . 31 LEU HG 1 1 5 2609 1 1 31 LEU N N -14.578 2.272 -9.997 1.00 . A A . 31 LEU N 1 1 5 2610 1 1 31 LEU O O -14.425 1.753 -12.748 1.00 . A A . 31 LEU O 1 1 5 2611 1 1 32 LEU C C -14.629 3.584 -15.493 1.00 . A A . 32 LEU C 1 1 5 2612 1 1 32 LEU CA C -15.749 3.418 -14.473 1.00 . A A . 32 LEU CA 1 1 5 2613 1 1 32 LEU CB C -16.902 4.381 -14.825 1.00 . A A . 32 LEU CB 1 1 5 2614 1 1 32 LEU CD1 C -19.195 5.186 -14.236 1.00 . A A . 32 LEU CD1 1 1 5 2615 1 1 32 LEU CD2 C -18.704 2.766 -13.935 1.00 . A A . 32 LEU CD2 1 1 5 2616 1 1 32 LEU CG C -18.100 4.177 -13.865 1.00 . A A . 32 LEU CG 1 1 5 2617 1 1 32 LEU H H -15.432 4.719 -12.774 1.00 . A A . 32 LEU H 1 1 5 2618 1 1 32 LEU HA H -16.087 2.391 -14.510 1.00 . A A . 32 LEU HA 1 1 5 2619 1 1 32 LEU HB2 H -16.540 5.407 -14.756 1.00 . A A . 32 LEU HB2 1 1 5 2620 1 1 32 LEU HB3 H -17.221 4.195 -15.852 1.00 . A A . 32 LEU HB3 1 1 5 2621 1 1 32 LEU HD11 H -18.813 6.202 -14.146 1.00 . A A . 32 LEU HD11 1 1 5 2622 1 1 32 LEU HD12 H -20.049 5.083 -13.566 1.00 . A A . 32 LEU HD12 1 1 5 2623 1 1 32 LEU HD13 H -19.526 5.026 -15.263 1.00 . A A . 32 LEU HD13 1 1 5 2624 1 1 32 LEU HD21 H -19.610 2.719 -13.332 1.00 . A A . 32 LEU HD21 1 1 5 2625 1 1 32 LEU HD22 H -18.006 2.028 -13.541 1.00 . A A . 32 LEU HD22 1 1 5 2626 1 1 32 LEU HD23 H -18.952 2.512 -14.967 1.00 . A A . 32 LEU HD23 1 1 5 2627 1 1 32 LEU HG H -17.793 4.377 -12.836 1.00 . A A . 32 LEU HG 1 1 5 2628 1 1 32 LEU N N -15.249 3.787 -13.137 1.00 . A A . 32 LEU N 1 1 5 2629 1 1 32 LEU O O -14.278 2.661 -16.185 1.00 . A A . 32 LEU O 1 1 5 2630 1 1 32 LEU OXT O -14.129 4.517 -15.557 1.00 . A A . 32 LEU OXT 1 1 6 2631 1 1 1 GLY C C 2.602 0.778 -1.271 1.00 . A A . 1 GLY C 1 1 6 2632 1 1 1 GLY CA C 3.952 1.433 -1.029 1.00 . A A . 1 GLY CA 1 1 6 2633 1 1 1 GLY H1 H 4.796 2.729 0.322 1.00 . A A . 1 GLY H1 1 1 6 2634 1 1 1 GLY H2 H 3.196 3.015 0.029 1.00 . A A . 1 GLY H2 1 1 6 2635 1 1 1 GLY H3 H 3.672 1.731 0.966 1.00 . A A . 1 GLY H3 1 1 6 2636 1 1 1 GLY HA2 H 4.213 2.027 -1.903 1.00 . A A . 1 GLY HA2 1 1 6 2637 1 1 1 GLY HA3 H 4.705 0.663 -0.871 1.00 . A A . 1 GLY HA3 1 1 6 2638 1 1 1 GLY N N 3.898 2.296 0.157 1.00 . A A . 1 GLY N 1 1 6 2639 1 1 1 GLY O O 1.582 1.390 -0.957 1.00 . A A . 1 GLY O 1 1 6 2640 1 1 2 PRO C C 0.541 -1.729 -1.169 1.00 . A A . 2 PRO C 1 1 6 2641 1 1 2 PRO CA C 1.338 -1.086 -2.327 1.00 . A A . 2 PRO CA 1 1 6 2642 1 1 2 PRO CB C 1.828 -2.098 -3.377 1.00 . A A . 2 PRO CB 1 1 6 2643 1 1 2 PRO CD C 3.743 -1.164 -2.321 1.00 . A A . 2 PRO CD 1 1 6 2644 1 1 2 PRO CG C 3.218 -2.483 -2.880 1.00 . A A . 2 PRO CG 1 1 6 2645 1 1 2 PRO HA H 0.681 -0.369 -2.820 1.00 . A A . 2 PRO HA 1 1 6 2646 1 1 2 PRO HB2 H 1.186 -2.972 -3.478 1.00 . A A . 2 PRO HB2 1 1 6 2647 1 1 2 PRO HB3 H 1.918 -1.599 -4.342 1.00 . A A . 2 PRO HB3 1 1 6 2648 1 1 2 PRO HD2 H 4.421 -1.357 -1.488 1.00 . A A . 2 PRO HD2 1 1 6 2649 1 1 2 PRO HD3 H 4.259 -0.614 -3.109 1.00 . A A . 2 PRO HD3 1 1 6 2650 1 1 2 PRO HG2 H 3.130 -3.214 -2.077 1.00 . A A . 2 PRO HG2 1 1 6 2651 1 1 2 PRO HG3 H 3.848 -2.863 -3.683 1.00 . A A . 2 PRO HG3 1 1 6 2652 1 1 2 PRO N N 2.569 -0.414 -1.890 1.00 . A A . 2 PRO N 1 1 6 2653 1 1 2 PRO O O 0.738 -1.415 0.007 1.00 . A A . 2 PRO O 1 1 6 2654 1 1 3 TYR C C -2.232 -2.495 0.288 1.00 . A A . 3 TYR C 1 1 6 2655 1 1 3 TYR CA C -1.254 -3.325 -0.543 1.00 . A A . 3 TYR CA 1 1 6 2656 1 1 3 TYR CB C -0.541 -4.470 0.187 1.00 . A A . 3 TYR CB 1 1 6 2657 1 1 3 TYR CD1 C 0.654 -5.970 -1.480 1.00 . A A . 3 TYR CD1 1 1 6 2658 1 1 3 TYR CD2 C -1.478 -6.689 -0.545 1.00 . A A . 3 TYR CD2 1 1 6 2659 1 1 3 TYR CE1 C 0.757 -7.191 -2.174 1.00 . A A . 3 TYR CE1 1 1 6 2660 1 1 3 TYR CE2 C -1.384 -7.900 -1.250 1.00 . A A . 3 TYR CE2 1 1 6 2661 1 1 3 TYR CG C -0.448 -5.735 -0.637 1.00 . A A . 3 TYR CG 1 1 6 2662 1 1 3 TYR CZ C -0.254 -8.168 -2.047 1.00 . A A . 3 TYR CZ 1 1 6 2663 1 1 3 TYR H H -0.514 -2.847 -2.483 1.00 . A A . 3 TYR H 1 1 6 2664 1 1 3 TYR HA H -1.950 -3.861 -1.188 1.00 . A A . 3 TYR HA 1 1 6 2665 1 1 3 TYR HB2 H 0.457 -4.150 0.491 1.00 . A A . 3 TYR HB2 1 1 6 2666 1 1 3 TYR HB3 H -1.089 -4.712 1.098 1.00 . A A . 3 TYR HB3 1 1 6 2667 1 1 3 TYR HD1 H 1.431 -5.224 -1.580 1.00 . A A . 3 TYR HD1 1 1 6 2668 1 1 3 TYR HD2 H -2.325 -6.513 0.104 1.00 . A A . 3 TYR HD2 1 1 6 2669 1 1 3 TYR HE1 H 1.611 -7.385 -2.804 1.00 . A A . 3 TYR HE1 1 1 6 2670 1 1 3 TYR HE2 H -2.159 -8.643 -1.150 1.00 . A A . 3 TYR HE2 1 1 6 2671 1 1 3 TYR HH H 0.802 -9.665 -2.666 1.00 . A A . 3 TYR HH 1 1 6 2672 1 1 3 TYR N N -0.398 -2.625 -1.504 1.00 . A A . 3 TYR N 1 1 6 2673 1 1 3 TYR O O -2.171 -2.445 1.516 1.00 . A A . 3 TYR O 1 1 6 2674 1 1 3 TYR OH O -0.128 -9.380 -2.646 1.00 . A A . 3 TYR OH 1 1 6 2675 1 1 4 CYS C C -5.609 -1.429 -0.300 1.00 . A A . 4 CYS C 1 1 6 2676 1 1 4 CYS CA C -4.208 -1.025 0.183 1.00 . A A . 4 CYS CA 1 1 6 2677 1 1 4 CYS CB C -3.878 0.474 0.048 1.00 . A A . 4 CYS CB 1 1 6 2678 1 1 4 CYS H H -3.101 -1.889 -1.418 1.00 . A A . 4 CYS H 1 1 6 2679 1 1 4 CYS HA H -4.200 -1.227 1.249 1.00 . A A . 4 CYS HA 1 1 6 2680 1 1 4 CYS HB2 H -4.795 1.022 -0.168 1.00 . A A . 4 CYS HB2 1 1 6 2681 1 1 4 CYS HB3 H -3.523 0.818 1.021 1.00 . A A . 4 CYS HB3 1 1 6 2682 1 1 4 CYS N N -3.171 -1.860 -0.411 1.00 . A A . 4 CYS N 1 1 6 2683 1 1 4 CYS O O -6.342 -2.093 0.431 1.00 . A A . 4 CYS O 1 1 6 2684 1 1 4 CYS SG S -2.616 0.960 -1.165 1.00 . A A . 4 CYS SG 1 1 6 2685 1 1 5 GLN C C -7.581 -3.000 -1.968 1.00 . A A . 5 GLN C 1 1 6 2686 1 1 5 GLN CA C -7.278 -1.500 -2.120 1.00 . A A . 5 GLN CA 1 1 6 2687 1 1 5 GLN CB C -7.353 -1.002 -3.581 1.00 . A A . 5 GLN CB 1 1 6 2688 1 1 5 GLN CD C -8.344 -2.889 -5.037 1.00 . A A . 5 GLN CD 1 1 6 2689 1 1 5 GLN CG C -8.540 -1.501 -4.433 1.00 . A A . 5 GLN CG 1 1 6 2690 1 1 5 GLN H H -5.301 -0.658 -2.144 1.00 . A A . 5 GLN H 1 1 6 2691 1 1 5 GLN HA H -8.034 -0.973 -1.544 1.00 . A A . 5 GLN HA 1 1 6 2692 1 1 5 GLN HB2 H -7.413 0.087 -3.549 1.00 . A A . 5 GLN HB2 1 1 6 2693 1 1 5 GLN HB3 H -6.425 -1.260 -4.092 1.00 . A A . 5 GLN HB3 1 1 6 2694 1 1 5 GLN HE21 H -6.887 -2.245 -6.260 1.00 . A A . 5 GLN HE21 1 1 6 2695 1 1 5 GLN HE22 H -7.182 -4.000 -6.217 1.00 . A A . 5 GLN HE22 1 1 6 2696 1 1 5 GLN HG2 H -9.451 -1.502 -3.841 1.00 . A A . 5 GLN HG2 1 1 6 2697 1 1 5 GLN HG3 H -8.689 -0.803 -5.256 1.00 . A A . 5 GLN HG3 1 1 6 2698 1 1 5 GLN N N -5.963 -1.143 -1.557 1.00 . A A . 5 GLN N 1 1 6 2699 1 1 5 GLN NE2 N -7.372 -3.069 -5.895 1.00 . A A . 5 GLN NE2 1 1 6 2700 1 1 5 GLN O O -8.612 -3.395 -1.421 1.00 . A A . 5 GLN O 1 1 6 2701 1 1 5 GLN OE1 O -8.874 -3.877 -4.560 1.00 . A A . 5 GLN OE1 1 1 6 2702 1 1 6 LYS C C -6.941 -5.877 -0.794 1.00 . A A . 6 LYS C 1 1 6 2703 1 1 6 LYS CA C -6.686 -5.303 -2.204 1.00 . A A . 6 LYS CA 1 1 6 2704 1 1 6 LYS CB C -5.406 -5.864 -2.852 1.00 . A A . 6 LYS CB 1 1 6 2705 1 1 6 LYS CD C -4.422 -7.934 -3.981 1.00 . A A . 6 LYS CD 1 1 6 2706 1 1 6 LYS CE C -4.867 -9.266 -4.590 1.00 . A A . 6 LYS CE 1 1 6 2707 1 1 6 LYS CG C -5.510 -7.375 -3.065 1.00 . A A . 6 LYS CG 1 1 6 2708 1 1 6 LYS H H -5.758 -3.450 -2.694 1.00 . A A . 6 LYS H 1 1 6 2709 1 1 6 LYS HA H -7.537 -5.608 -2.816 1.00 . A A . 6 LYS HA 1 1 6 2710 1 1 6 LYS HB2 H -5.271 -5.385 -3.823 1.00 . A A . 6 LYS HB2 1 1 6 2711 1 1 6 LYS HB3 H -4.537 -5.641 -2.229 1.00 . A A . 6 LYS HB3 1 1 6 2712 1 1 6 LYS HD2 H -4.232 -7.239 -4.798 1.00 . A A . 6 LYS HD2 1 1 6 2713 1 1 6 LYS HD3 H -3.499 -8.066 -3.419 1.00 . A A . 6 LYS HD3 1 1 6 2714 1 1 6 LYS HE2 H -5.719 -9.086 -5.250 1.00 . A A . 6 LYS HE2 1 1 6 2715 1 1 6 LYS HE3 H -4.051 -9.653 -5.204 1.00 . A A . 6 LYS HE3 1 1 6 2716 1 1 6 LYS HG2 H -5.433 -7.876 -2.105 1.00 . A A . 6 LYS HG2 1 1 6 2717 1 1 6 LYS HG3 H -6.484 -7.595 -3.498 1.00 . A A . 6 LYS HG3 1 1 6 2718 1 1 6 LYS HZ1 H -6.023 -9.967 -2.993 1.00 . A A . 6 LYS HZ1 1 1 6 2719 1 1 6 LYS HZ2 H -4.473 -10.507 -2.959 1.00 . A A . 6 LYS HZ2 1 1 6 2720 1 1 6 LYS HZ3 H -5.543 -11.132 -4.037 1.00 . A A . 6 LYS HZ3 1 1 6 2721 1 1 6 LYS N N -6.589 -3.841 -2.274 1.00 . A A . 6 LYS N 1 1 6 2722 1 1 6 LYS NZ N -5.248 -10.277 -3.574 1.00 . A A . 6 LYS NZ 1 1 6 2723 1 1 6 LYS O O -7.382 -7.020 -0.684 1.00 . A A . 6 LYS O 1 1 6 2724 1 1 7 TRP C C -7.213 -4.752 2.725 1.00 . A A . 7 TRP C 1 1 6 2725 1 1 7 TRP CA C -6.533 -5.609 1.631 1.00 . A A . 7 TRP CA 1 1 6 2726 1 1 7 TRP CB C -5.016 -5.775 1.812 1.00 . A A . 7 TRP CB 1 1 6 2727 1 1 7 TRP CD1 C -4.585 -7.971 2.988 1.00 . A A . 7 TRP CD1 1 1 6 2728 1 1 7 TRP CD2 C -4.121 -6.205 4.294 1.00 . A A . 7 TRP CD2 1 1 6 2729 1 1 7 TRP CE2 C -3.761 -7.373 5.030 1.00 . A A . 7 TRP CE2 1 1 6 2730 1 1 7 TRP CE3 C -3.951 -4.962 4.943 1.00 . A A . 7 TRP CE3 1 1 6 2731 1 1 7 TRP CG C -4.541 -6.618 2.954 1.00 . A A . 7 TRP CG 1 1 6 2732 1 1 7 TRP CH2 C -3.006 -6.059 6.912 1.00 . A A . 7 TRP CH2 1 1 6 2733 1 1 7 TRP CZ2 C -3.200 -7.315 6.312 1.00 . A A . 7 TRP CZ2 1 1 6 2734 1 1 7 TRP CZ3 C -3.410 -4.891 6.242 1.00 . A A . 7 TRP CZ3 1 1 6 2735 1 1 7 TRP H H -6.470 -4.130 0.094 1.00 . A A . 7 TRP H 1 1 6 2736 1 1 7 TRP HA H -6.983 -6.601 1.702 1.00 . A A . 7 TRP HA 1 1 6 2737 1 1 7 TRP HB2 H -4.604 -6.217 0.903 1.00 . A A . 7 TRP HB2 1 1 6 2738 1 1 7 TRP HB3 H -4.569 -4.784 1.910 1.00 . A A . 7 TRP HB3 1 1 6 2739 1 1 7 TRP HD1 H -4.928 -8.605 2.176 1.00 . A A . 7 TRP HD1 1 1 6 2740 1 1 7 TRP HE1 H -4.014 -9.404 4.455 1.00 . A A . 7 TRP HE1 1 1 6 2741 1 1 7 TRP HE3 H -4.218 -4.059 4.415 1.00 . A A . 7 TRP HE3 1 1 6 2742 1 1 7 TRP HH2 H -2.549 -5.990 7.889 1.00 . A A . 7 TRP HH2 1 1 6 2743 1 1 7 TRP HZ2 H -2.908 -8.222 6.821 1.00 . A A . 7 TRP HZ2 1 1 6 2744 1 1 7 TRP HZ3 H -3.279 -3.932 6.724 1.00 . A A . 7 TRP HZ3 1 1 6 2745 1 1 7 TRP N N -6.731 -5.092 0.268 1.00 . A A . 7 TRP N 1 1 6 2746 1 1 7 TRP NE1 N -4.087 -8.419 4.196 1.00 . A A . 7 TRP NE1 1 1 6 2747 1 1 7 TRP O O -7.067 -5.028 3.913 1.00 . A A . 7 TRP O 1 1 6 2748 1 1 8 MET C C -8.400 -2.064 4.255 1.00 . A A . 8 MET C 1 1 6 2749 1 1 8 MET CA C -8.988 -3.013 3.185 1.00 . A A . 8 MET CA 1 1 6 2750 1 1 8 MET CB C -10.123 -3.918 3.711 1.00 . A A . 8 MET CB 1 1 6 2751 1 1 8 MET CE C -13.585 -4.573 3.429 1.00 . A A . 8 MET CE 1 1 6 2752 1 1 8 MET CG C -10.945 -4.460 2.533 1.00 . A A . 8 MET CG 1 1 6 2753 1 1 8 MET H H -8.053 -3.568 1.349 1.00 . A A . 8 MET H 1 1 6 2754 1 1 8 MET HA H -9.473 -2.325 2.495 1.00 . A A . 8 MET HA 1 1 6 2755 1 1 8 MET HB2 H -9.708 -4.747 4.286 1.00 . A A . 8 MET HB2 1 1 6 2756 1 1 8 MET HB3 H -10.781 -3.341 4.362 1.00 . A A . 8 MET HB3 1 1 6 2757 1 1 8 MET HE1 H -14.479 -5.165 3.627 1.00 . A A . 8 MET HE1 1 1 6 2758 1 1 8 MET HE2 H -13.295 -4.042 4.336 1.00 . A A . 8 MET HE2 1 1 6 2759 1 1 8 MET HE3 H -13.803 -3.866 2.631 1.00 . A A . 8 MET HE3 1 1 6 2760 1 1 8 MET HG2 H -11.399 -3.617 2.013 1.00 . A A . 8 MET HG2 1 1 6 2761 1 1 8 MET HG3 H -10.262 -4.953 1.843 1.00 . A A . 8 MET HG3 1 1 6 2762 1 1 8 MET N N -8.043 -3.776 2.338 1.00 . A A . 8 MET N 1 1 6 2763 1 1 8 MET O O -9.053 -1.070 4.556 1.00 . A A . 8 MET O 1 1 6 2764 1 1 8 MET SD S -12.246 -5.664 2.906 1.00 . A A . 8 MET SD 1 1 6 2765 1 1 9 GLN C C -6.236 0.073 5.676 1.00 . A A . 9 GLN C 1 1 6 2766 1 1 9 GLN CA C -6.079 -1.131 4.723 1.00 . A A . 9 GLN CA 1 1 6 2767 1 1 9 GLN CB C -5.756 -0.596 3.322 1.00 . A A . 9 GLN CB 1 1 6 2768 1 1 9 GLN CD C -6.358 1.732 2.288 1.00 . A A . 9 GLN CD 1 1 6 2769 1 1 9 GLN CG C -6.834 0.355 2.736 1.00 . A A . 9 GLN CG 1 1 6 2770 1 1 9 GLN H H -6.743 -3.125 4.430 1.00 . A A . 9 GLN H 1 1 6 2771 1 1 9 GLN HA H -5.184 -1.644 5.075 1.00 . A A . 9 GLN HA 1 1 6 2772 1 1 9 GLN HB2 H -4.780 -0.112 3.343 1.00 . A A . 9 GLN HB2 1 1 6 2773 1 1 9 GLN HB3 H -5.662 -1.466 2.683 1.00 . A A . 9 GLN HB3 1 1 6 2774 1 1 9 GLN HE21 H -4.995 1.923 3.764 1.00 . A A . 9 GLN HE21 1 1 6 2775 1 1 9 GLN HE22 H -5.104 3.281 2.639 1.00 . A A . 9 GLN HE22 1 1 6 2776 1 1 9 GLN HG2 H -7.320 -0.138 1.895 1.00 . A A . 9 GLN HG2 1 1 6 2777 1 1 9 GLN HG3 H -7.601 0.553 3.477 1.00 . A A . 9 GLN HG3 1 1 6 2778 1 1 9 GLN N N -7.110 -2.193 4.589 1.00 . A A . 9 GLN N 1 1 6 2779 1 1 9 GLN NE2 N -5.400 2.355 2.939 1.00 . A A . 9 GLN NE2 1 1 6 2780 1 1 9 GLN O O -5.299 0.878 5.742 1.00 . A A . 9 GLN O 1 1 6 2781 1 1 9 GLN OE1 O -7.005 2.366 1.459 1.00 . A A . 9 GLN OE1 1 1 6 2782 1 1 10 THR C C -7.421 2.767 6.431 1.00 . A A . 10 THR C 1 1 6 2783 1 1 10 THR CA C -7.654 1.443 7.186 1.00 . A A . 10 THR CA 1 1 6 2784 1 1 10 THR CB C -6.865 1.365 8.512 1.00 . A A . 10 THR CB 1 1 6 2785 1 1 10 THR CG2 C -7.600 2.058 9.648 1.00 . A A . 10 THR CG2 1 1 6 2786 1 1 10 THR H H -8.143 -0.372 6.144 1.00 . A A . 10 THR H 1 1 6 2787 1 1 10 THR HA H -8.713 1.415 7.443 1.00 . A A . 10 THR HA 1 1 6 2788 1 1 10 THR HB H -5.902 1.848 8.387 1.00 . A A . 10 THR HB 1 1 6 2789 1 1 10 THR HG1 H -5.660 -0.011 9.115 1.00 . A A . 10 THR HG1 1 1 6 2790 1 1 10 THR HG21 H -7.781 3.100 9.386 1.00 . A A . 10 THR HG21 1 1 6 2791 1 1 10 THR HG22 H -6.997 2.023 10.555 1.00 . A A . 10 THR HG22 1 1 6 2792 1 1 10 THR HG23 H -8.551 1.560 9.830 1.00 . A A . 10 THR HG23 1 1 6 2793 1 1 10 THR N N -7.382 0.272 6.327 1.00 . A A . 10 THR N 1 1 6 2794 1 1 10 THR O O -6.456 3.493 6.649 1.00 . A A . 10 THR O 1 1 6 2795 1 1 10 THR OG1 O -6.617 0.031 8.920 1.00 . A A . 10 THR OG1 1 1 6 2796 1 1 11 CYS C C -8.637 5.546 5.298 1.00 . A A . 11 CYS C 1 1 6 2797 1 1 11 CYS CA C -8.168 4.249 4.590 1.00 . A A . 11 CYS CA 1 1 6 2798 1 1 11 CYS CB C -9.062 3.985 3.367 1.00 . A A . 11 CYS CB 1 1 6 2799 1 1 11 CYS H H -9.079 2.458 5.368 1.00 . A A . 11 CYS H 1 1 6 2800 1 1 11 CYS HA H -7.125 4.395 4.298 1.00 . A A . 11 CYS HA 1 1 6 2801 1 1 11 CYS HB2 H -8.729 3.031 2.993 1.00 . A A . 11 CYS HB2 1 1 6 2802 1 1 11 CYS HB3 H -10.033 3.810 3.811 1.00 . A A . 11 CYS HB3 1 1 6 2803 1 1 11 CYS N N -8.246 3.044 5.424 1.00 . A A . 11 CYS N 1 1 6 2804 1 1 11 CYS O O -9.443 6.287 4.736 1.00 . A A . 11 CYS O 1 1 6 2805 1 1 11 CYS SG S -9.168 5.263 2.084 1.00 . A A . 11 CYS SG 1 1 6 2806 1 1 12 ASP C C -7.795 8.373 6.289 1.00 . A A . 12 ASP C 1 1 6 2807 1 1 12 ASP CA C -8.225 7.152 7.121 1.00 . A A . 12 ASP CA 1 1 6 2808 1 1 12 ASP CB C -7.542 7.098 8.498 1.00 . A A . 12 ASP CB 1 1 6 2809 1 1 12 ASP CG C -8.327 6.267 9.514 1.00 . A A . 12 ASP CG 1 1 6 2810 1 1 12 ASP H H -7.437 5.184 6.871 1.00 . A A . 12 ASP H 1 1 6 2811 1 1 12 ASP HA H -9.292 7.303 7.299 1.00 . A A . 12 ASP HA 1 1 6 2812 1 1 12 ASP HB2 H -6.531 6.699 8.386 1.00 . A A . 12 ASP HB2 1 1 6 2813 1 1 12 ASP HB3 H -7.456 8.109 8.899 1.00 . A A . 12 ASP HB3 1 1 6 2814 1 1 12 ASP N N -8.079 5.855 6.462 1.00 . A A . 12 ASP N 1 1 6 2815 1 1 12 ASP O O -7.078 8.249 5.288 1.00 . A A . 12 ASP O 1 1 6 2816 1 1 12 ASP OD1 O -9.579 6.287 9.497 1.00 . A A . 12 ASP OD1 1 1 6 2817 1 1 12 ASP OD2 O -7.695 5.625 10.382 1.00 . A A . 12 ASP OD2 1 1 6 2818 1 1 13 SER C C -6.405 11.183 5.947 1.00 . A A . 13 SER C 1 1 6 2819 1 1 13 SER CA C -7.906 10.858 6.090 1.00 . A A . 13 SER CA 1 1 6 2820 1 1 13 SER CB C -8.633 11.946 6.895 1.00 . A A . 13 SER CB 1 1 6 2821 1 1 13 SER H H -8.808 9.576 7.546 1.00 . A A . 13 SER H 1 1 6 2822 1 1 13 SER HA H -8.333 10.836 5.087 1.00 . A A . 13 SER HA 1 1 6 2823 1 1 13 SER HB2 H -9.672 11.647 7.032 1.00 . A A . 13 SER HB2 1 1 6 2824 1 1 13 SER HB3 H -8.176 12.044 7.881 1.00 . A A . 13 SER HB3 1 1 6 2825 1 1 13 SER HG H -7.753 13.620 6.410 1.00 . A A . 13 SER HG 1 1 6 2826 1 1 13 SER N N -8.185 9.567 6.739 1.00 . A A . 13 SER N 1 1 6 2827 1 1 13 SER O O -6.029 12.083 5.195 1.00 . A A . 13 SER O 1 1 6 2828 1 1 13 SER OG O -8.613 13.196 6.233 1.00 . A A . 13 SER OG 1 1 6 2829 1 1 14 GLU C C -3.325 9.462 5.897 1.00 . A A . 14 GLU C 1 1 6 2830 1 1 14 GLU CA C -4.060 10.617 6.617 1.00 . A A . 14 GLU CA 1 1 6 2831 1 1 14 GLU CB C -3.567 10.787 8.062 1.00 . A A . 14 GLU CB 1 1 6 2832 1 1 14 GLU CD C -3.937 12.092 10.245 1.00 . A A . 14 GLU CD 1 1 6 2833 1 1 14 GLU CG C -4.100 12.076 8.721 1.00 . A A . 14 GLU CG 1 1 6 2834 1 1 14 GLU H H -5.906 9.737 7.242 1.00 . A A . 14 GLU H 1 1 6 2835 1 1 14 GLU HA H -3.798 11.524 6.070 1.00 . A A . 14 GLU HA 1 1 6 2836 1 1 14 GLU HB2 H -3.894 9.915 8.627 1.00 . A A . 14 GLU HB2 1 1 6 2837 1 1 14 GLU HB3 H -2.479 10.810 8.086 1.00 . A A . 14 GLU HB3 1 1 6 2838 1 1 14 GLU HG2 H -3.590 12.938 8.289 1.00 . A A . 14 GLU HG2 1 1 6 2839 1 1 14 GLU HG3 H -5.164 12.188 8.510 1.00 . A A . 14 GLU HG3 1 1 6 2840 1 1 14 GLU N N -5.527 10.455 6.641 1.00 . A A . 14 GLU N 1 1 6 2841 1 1 14 GLU O O -2.091 9.405 5.881 1.00 . A A . 14 GLU O 1 1 6 2842 1 1 14 GLU OE1 O -3.465 11.096 10.836 1.00 . A A . 14 GLU OE1 1 1 6 2843 1 1 14 GLU OE2 O -4.363 13.087 10.879 1.00 . A A . 14 GLU OE2 1 1 6 2844 1 1 15 ARG C C -3.647 7.377 3.150 1.00 . A A . 15 ARG C 1 1 6 2845 1 1 15 ARG CA C -3.597 7.285 4.672 1.00 . A A . 15 ARG CA 1 1 6 2846 1 1 15 ARG CB C -4.420 6.088 5.203 1.00 . A A . 15 ARG CB 1 1 6 2847 1 1 15 ARG CD C -3.062 4.065 5.621 1.00 . A A . 15 ARG CD 1 1 6 2848 1 1 15 ARG CG C -3.682 5.303 6.298 1.00 . A A . 15 ARG CG 1 1 6 2849 1 1 15 ARG CZ C -2.403 2.727 7.605 1.00 . A A . 15 ARG CZ 1 1 6 2850 1 1 15 ARG H H -5.083 8.670 5.324 1.00 . A A . 15 ARG H 1 1 6 2851 1 1 15 ARG HA H -2.550 7.133 4.922 1.00 . A A . 15 ARG HA 1 1 6 2852 1 1 15 ARG HB2 H -5.355 6.447 5.629 1.00 . A A . 15 ARG HB2 1 1 6 2853 1 1 15 ARG HB3 H -4.696 5.421 4.385 1.00 . A A . 15 ARG HB3 1 1 6 2854 1 1 15 ARG HD2 H -3.841 3.348 5.395 1.00 . A A . 15 ARG HD2 1 1 6 2855 1 1 15 ARG HD3 H -2.507 4.375 4.745 1.00 . A A . 15 ARG HD3 1 1 6 2856 1 1 15 ARG HE H -1.158 3.850 6.549 1.00 . A A . 15 ARG HE 1 1 6 2857 1 1 15 ARG HG2 H -2.923 5.929 6.767 1.00 . A A . 15 ARG HG2 1 1 6 2858 1 1 15 ARG HG3 H -4.385 4.986 7.067 1.00 . A A . 15 ARG HG3 1 1 6 2859 1 1 15 ARG HH11 H -4.204 2.090 6.971 1.00 . A A . 15 ARG HH11 1 1 6 2860 1 1 15 ARG HH12 H -3.635 1.404 8.471 1.00 . A A . 15 ARG HH12 1 1 6 2861 1 1 15 ARG HH21 H -0.743 3.222 8.613 1.00 . A A . 15 ARG HH21 1 1 6 2862 1 1 15 ARG HH22 H -1.814 2.143 9.422 1.00 . A A . 15 ARG HH22 1 1 6 2863 1 1 15 ARG N N -4.079 8.513 5.325 1.00 . A A . 15 ARG N 1 1 6 2864 1 1 15 ARG NE N -2.120 3.527 6.595 1.00 . A A . 15 ARG NE 1 1 6 2865 1 1 15 ARG NH1 N -3.518 2.064 7.714 1.00 . A A . 15 ARG NH1 1 1 6 2866 1 1 15 ARG NH2 N -1.529 2.585 8.554 1.00 . A A . 15 ARG NH2 1 1 6 2867 1 1 15 ARG O O -4.596 7.937 2.600 1.00 . A A . 15 ARG O 1 1 6 2868 1 1 16 LYS C C -4.157 5.492 0.835 1.00 . A A . 16 LYS C 1 1 6 2869 1 1 16 LYS CA C -2.906 6.345 1.029 1.00 . A A . 16 LYS CA 1 1 6 2870 1 1 16 LYS CB C -1.653 5.620 0.509 1.00 . A A . 16 LYS CB 1 1 6 2871 1 1 16 LYS CD C -0.104 3.623 0.734 1.00 . A A . 16 LYS CD 1 1 6 2872 1 1 16 LYS CE C 0.481 2.733 1.830 1.00 . A A . 16 LYS CE 1 1 6 2873 1 1 16 LYS CG C -1.418 4.263 1.195 1.00 . A A . 16 LYS CG 1 1 6 2874 1 1 16 LYS H H -1.940 6.307 2.946 1.00 . A A . 16 LYS H 1 1 6 2875 1 1 16 LYS HA H -3.031 7.267 0.458 1.00 . A A . 16 LYS HA 1 1 6 2876 1 1 16 LYS HB2 H -1.745 5.462 -0.567 1.00 . A A . 16 LYS HB2 1 1 6 2877 1 1 16 LYS HB3 H -0.787 6.263 0.674 1.00 . A A . 16 LYS HB3 1 1 6 2878 1 1 16 LYS HD2 H -0.310 3.016 -0.147 1.00 . A A . 16 LYS HD2 1 1 6 2879 1 1 16 LYS HD3 H 0.627 4.386 0.462 1.00 . A A . 16 LYS HD3 1 1 6 2880 1 1 16 LYS HE2 H -0.316 2.119 2.258 1.00 . A A . 16 LYS HE2 1 1 6 2881 1 1 16 LYS HE3 H 1.203 2.048 1.379 1.00 . A A . 16 LYS HE3 1 1 6 2882 1 1 16 LYS HG2 H -1.400 4.402 2.274 1.00 . A A . 16 LYS HG2 1 1 6 2883 1 1 16 LYS HG3 H -2.235 3.579 0.965 1.00 . A A . 16 LYS HG3 1 1 6 2884 1 1 16 LYS HZ1 H 1.417 2.911 3.658 1.00 . A A . 16 LYS HZ1 1 1 6 2885 1 1 16 LYS HZ2 H 0.542 4.260 3.266 1.00 . A A . 16 LYS HZ2 1 1 6 2886 1 1 16 LYS HZ3 H 1.978 3.983 2.531 1.00 . A A . 16 LYS HZ3 1 1 6 2887 1 1 16 LYS N N -2.740 6.688 2.453 1.00 . A A . 16 LYS N 1 1 6 2888 1 1 16 LYS NZ N 1.144 3.527 2.895 1.00 . A A . 16 LYS NZ 1 1 6 2889 1 1 16 LYS O O -4.669 4.871 1.770 1.00 . A A . 16 LYS O 1 1 6 2890 1 1 17 CYS C C -5.701 3.657 -1.948 1.00 . A A . 17 CYS C 1 1 6 2891 1 1 17 CYS CA C -5.777 4.480 -0.645 1.00 . A A . 17 CYS CA 1 1 6 2892 1 1 17 CYS CB C -7.071 5.309 -0.489 1.00 . A A . 17 CYS CB 1 1 6 2893 1 1 17 CYS H H -4.253 5.922 -1.147 1.00 . A A . 17 CYS H 1 1 6 2894 1 1 17 CYS HA H -5.728 3.705 0.111 1.00 . A A . 17 CYS HA 1 1 6 2895 1 1 17 CYS HB2 H -6.789 6.163 0.114 1.00 . A A . 17 CYS HB2 1 1 6 2896 1 1 17 CYS HB3 H -7.282 5.695 -1.479 1.00 . A A . 17 CYS HB3 1 1 6 2897 1 1 17 CYS N N -4.647 5.369 -0.391 1.00 . A A . 17 CYS N 1 1 6 2898 1 1 17 CYS O O -6.738 3.239 -2.461 1.00 . A A . 17 CYS O 1 1 6 2899 1 1 17 CYS SG S -8.452 4.420 0.244 1.00 . A A . 17 CYS SG 1 1 6 2900 1 1 18 CYS C C -4.526 3.395 -4.887 1.00 . A A . 18 CYS C 1 1 6 2901 1 1 18 CYS CA C -4.095 2.651 -3.622 1.00 . A A . 18 CYS CA 1 1 6 2902 1 1 18 CYS CB C -4.479 1.171 -3.588 1.00 . A A . 18 CYS CB 1 1 6 2903 1 1 18 CYS H H -3.697 3.681 -1.828 1.00 . A A . 18 CYS H 1 1 6 2904 1 1 18 CYS HA H -3.005 2.667 -3.664 1.00 . A A . 18 CYS HA 1 1 6 2905 1 1 18 CYS HB2 H -5.397 1.056 -3.019 1.00 . A A . 18 CYS HB2 1 1 6 2906 1 1 18 CYS HB3 H -4.673 0.832 -4.604 1.00 . A A . 18 CYS HB3 1 1 6 2907 1 1 18 CYS N N -4.472 3.336 -2.378 1.00 . A A . 18 CYS N 1 1 6 2908 1 1 18 CYS O O -3.731 4.191 -5.385 1.00 . A A . 18 CYS O 1 1 6 2909 1 1 18 CYS SG S -3.192 0.093 -2.918 1.00 . A A . 18 CYS SG 1 1 6 2910 1 1 19 GLU C C -7.236 5.237 -6.013 1.00 . A A . 19 GLU C 1 1 6 2911 1 1 19 GLU CA C -6.373 4.021 -6.440 1.00 . A A . 19 GLU CA 1 1 6 2912 1 1 19 GLU CB C -7.068 3.025 -7.411 1.00 . A A . 19 GLU CB 1 1 6 2913 1 1 19 GLU CD C -6.204 0.610 -6.916 1.00 . A A . 19 GLU CD 1 1 6 2914 1 1 19 GLU CG C -7.393 1.592 -6.927 1.00 . A A . 19 GLU CG 1 1 6 2915 1 1 19 GLU H H -6.432 2.805 -4.686 1.00 . A A . 19 GLU H 1 1 6 2916 1 1 19 GLU HA H -5.562 4.457 -7.022 1.00 . A A . 19 GLU HA 1 1 6 2917 1 1 19 GLU HB2 H -8.004 3.469 -7.742 1.00 . A A . 19 GLU HB2 1 1 6 2918 1 1 19 GLU HB3 H -6.460 2.943 -8.311 1.00 . A A . 19 GLU HB3 1 1 6 2919 1 1 19 GLU HG2 H -7.843 1.641 -5.932 1.00 . A A . 19 GLU HG2 1 1 6 2920 1 1 19 GLU HG3 H -8.147 1.182 -7.601 1.00 . A A . 19 GLU HG3 1 1 6 2921 1 1 19 GLU N N -5.796 3.322 -5.277 1.00 . A A . 19 GLU N 1 1 6 2922 1 1 19 GLU O O -7.252 5.610 -4.835 1.00 . A A . 19 GLU O 1 1 6 2923 1 1 19 GLU OE1 O -5.029 1.030 -7.026 1.00 . A A . 19 GLU OE1 1 1 6 2924 1 1 19 GLU OE2 O -6.437 -0.609 -6.743 1.00 . A A . 19 GLU OE2 1 1 6 2925 1 1 20 GLY C C -10.314 6.392 -6.324 1.00 . A A . 20 GLY C 1 1 6 2926 1 1 20 GLY CA C -8.923 6.946 -6.675 1.00 . A A . 20 GLY CA 1 1 6 2927 1 1 20 GLY H H -7.846 5.599 -7.917 1.00 . A A . 20 GLY H 1 1 6 2928 1 1 20 GLY HA2 H -8.605 7.571 -5.846 1.00 . A A . 20 GLY HA2 1 1 6 2929 1 1 20 GLY HA3 H -9.021 7.584 -7.552 1.00 . A A . 20 GLY HA3 1 1 6 2930 1 1 20 GLY N N -7.907 5.913 -6.953 1.00 . A A . 20 GLY N 1 1 6 2931 1 1 20 GLY O O -11.245 7.170 -6.100 1.00 . A A . 20 GLY O 1 1 6 2932 1 1 21 MET C C -12.291 4.738 -4.599 1.00 . A A . 21 MET C 1 1 6 2933 1 1 21 MET CA C -11.662 4.318 -5.933 1.00 . A A . 21 MET CA 1 1 6 2934 1 1 21 MET CB C -11.341 2.819 -5.852 1.00 . A A . 21 MET CB 1 1 6 2935 1 1 21 MET CE C -11.515 3.537 -9.460 1.00 . A A . 21 MET CE 1 1 6 2936 1 1 21 MET CG C -10.887 2.188 -7.165 1.00 . A A . 21 MET CG 1 1 6 2937 1 1 21 MET H H -9.624 4.524 -6.499 1.00 . A A . 21 MET H 1 1 6 2938 1 1 21 MET HA H -12.404 4.483 -6.715 1.00 . A A . 21 MET HA 1 1 6 2939 1 1 21 MET HB2 H -10.563 2.662 -5.103 1.00 . A A . 21 MET HB2 1 1 6 2940 1 1 21 MET HB3 H -12.230 2.292 -5.524 1.00 . A A . 21 MET HB3 1 1 6 2941 1 1 21 MET HE1 H -10.442 3.426 -9.591 1.00 . A A . 21 MET HE1 1 1 6 2942 1 1 21 MET HE2 H -11.991 3.524 -10.439 1.00 . A A . 21 MET HE2 1 1 6 2943 1 1 21 MET HE3 H -11.724 4.481 -8.957 1.00 . A A . 21 MET HE3 1 1 6 2944 1 1 21 MET HG2 H -10.002 2.703 -7.526 1.00 . A A . 21 MET HG2 1 1 6 2945 1 1 21 MET HG3 H -10.597 1.162 -6.949 1.00 . A A . 21 MET HG3 1 1 6 2946 1 1 21 MET N N -10.445 5.061 -6.275 1.00 . A A . 21 MET N 1 1 6 2947 1 1 21 MET O O -11.592 5.208 -3.698 1.00 . A A . 21 MET O 1 1 6 2948 1 1 21 MET SD S -12.127 2.150 -8.484 1.00 . A A . 21 MET SD 1 1 6 2949 1 1 22 VAL C C -13.688 4.448 -1.973 1.00 . A A . 22 VAL C 1 1 6 2950 1 1 22 VAL CA C -14.401 4.794 -3.272 1.00 . A A . 22 VAL CA 1 1 6 2951 1 1 22 VAL CB C -15.784 4.111 -3.287 1.00 . A A . 22 VAL CB 1 1 6 2952 1 1 22 VAL CG1 C -16.656 4.605 -2.125 1.00 . A A . 22 VAL CG1 1 1 6 2953 1 1 22 VAL CG2 C -16.539 4.364 -4.593 1.00 . A A . 22 VAL CG2 1 1 6 2954 1 1 22 VAL H H -14.074 4.028 -5.231 1.00 . A A . 22 VAL H 1 1 6 2955 1 1 22 VAL HA H -14.574 5.868 -3.289 1.00 . A A . 22 VAL HA 1 1 6 2956 1 1 22 VAL HB H -15.653 3.033 -3.189 1.00 . A A . 22 VAL HB 1 1 6 2957 1 1 22 VAL HG11 H -16.800 5.684 -2.191 1.00 . A A . 22 VAL HG11 1 1 6 2958 1 1 22 VAL HG12 H -17.626 4.115 -2.171 1.00 . A A . 22 VAL HG12 1 1 6 2959 1 1 22 VAL HG13 H -16.205 4.353 -1.167 1.00 . A A . 22 VAL HG13 1 1 6 2960 1 1 22 VAL HG21 H -16.661 5.437 -4.744 1.00 . A A . 22 VAL HG21 1 1 6 2961 1 1 22 VAL HG22 H -15.992 3.937 -5.429 1.00 . A A . 22 VAL HG22 1 1 6 2962 1 1 22 VAL HG23 H -17.520 3.890 -4.553 1.00 . A A . 22 VAL HG23 1 1 6 2963 1 1 22 VAL N N -13.592 4.454 -4.453 1.00 . A A . 22 VAL N 1 1 6 2964 1 1 22 VAL O O -13.402 3.279 -1.714 1.00 . A A . 22 VAL O 1 1 6 2965 1 1 23 CYS C C -14.032 5.499 1.273 1.00 . A A . 23 CYS C 1 1 6 2966 1 1 23 CYS CA C -12.939 5.268 0.216 1.00 . A A . 23 CYS CA 1 1 6 2967 1 1 23 CYS CB C -11.787 6.276 0.430 1.00 . A A . 23 CYS CB 1 1 6 2968 1 1 23 CYS H H -13.672 6.393 -1.442 1.00 . A A . 23 CYS H 1 1 6 2969 1 1 23 CYS HA H -12.578 4.247 0.321 1.00 . A A . 23 CYS HA 1 1 6 2970 1 1 23 CYS HB2 H -11.018 6.167 -0.312 1.00 . A A . 23 CYS HB2 1 1 6 2971 1 1 23 CYS HB3 H -12.179 7.286 0.468 1.00 . A A . 23 CYS HB3 1 1 6 2972 1 1 23 CYS N N -13.448 5.457 -1.134 1.00 . A A . 23 CYS N 1 1 6 2973 1 1 23 CYS O O -14.372 6.640 1.580 1.00 . A A . 23 CYS O 1 1 6 2974 1 1 23 CYS SG S -11.186 5.860 2.113 1.00 . A A . 23 CYS SG 1 1 6 2975 1 1 24 ARG C C -14.644 3.242 4.053 1.00 . A A . 24 ARG C 1 1 6 2976 1 1 24 ARG CA C -15.139 4.436 3.236 1.00 . A A . 24 ARG CA 1 1 6 2977 1 1 24 ARG CB C -16.673 4.419 3.093 1.00 . A A . 24 ARG CB 1 1 6 2978 1 1 24 ARG CD C -17.516 5.976 1.318 1.00 . A A . 24 ARG CD 1 1 6 2979 1 1 24 ARG CG C -17.318 5.793 2.834 1.00 . A A . 24 ARG CG 1 1 6 2980 1 1 24 ARG CZ C -17.549 8.447 1.030 1.00 . A A . 24 ARG CZ 1 1 6 2981 1 1 24 ARG H H -14.240 3.508 1.551 1.00 . A A . 24 ARG H 1 1 6 2982 1 1 24 ARG HA H -14.859 5.339 3.783 1.00 . A A . 24 ARG HA 1 1 6 2983 1 1 24 ARG HB2 H -16.984 3.687 2.344 1.00 . A A . 24 ARG HB2 1 1 6 2984 1 1 24 ARG HB3 H -17.068 4.082 4.046 1.00 . A A . 24 ARG HB3 1 1 6 2985 1 1 24 ARG HD2 H -16.582 5.950 0.789 1.00 . A A . 24 ARG HD2 1 1 6 2986 1 1 24 ARG HD3 H -18.176 5.208 0.948 1.00 . A A . 24 ARG HD3 1 1 6 2987 1 1 24 ARG HE H -19.168 7.336 1.238 1.00 . A A . 24 ARG HE 1 1 6 2988 1 1 24 ARG HG2 H -18.296 5.818 3.317 1.00 . A A . 24 ARG HG2 1 1 6 2989 1 1 24 ARG HG3 H -16.702 6.589 3.254 1.00 . A A . 24 ARG HG3 1 1 6 2990 1 1 24 ARG HH11 H -15.638 7.841 1.218 1.00 . A A . 24 ARG HH11 1 1 6 2991 1 1 24 ARG HH12 H -15.909 9.567 1.004 1.00 . A A . 24 ARG HH12 1 1 6 2992 1 1 24 ARG HH21 H -19.263 9.453 1.111 1.00 . A A . 24 ARG HH21 1 1 6 2993 1 1 24 ARG HH22 H -17.804 10.418 0.892 1.00 . A A . 24 ARG HH22 1 1 6 2994 1 1 24 ARG N N -14.477 4.420 1.922 1.00 . A A . 24 ARG N 1 1 6 2995 1 1 24 ARG NE N -18.159 7.283 1.161 1.00 . A A . 24 ARG NE 1 1 6 2996 1 1 24 ARG NH1 N -16.259 8.614 1.016 1.00 . A A . 24 ARG NH1 1 1 6 2997 1 1 24 ARG NH2 N -18.267 9.521 0.941 1.00 . A A . 24 ARG NH2 1 1 6 2998 1 1 24 ARG O O -14.885 2.110 3.647 1.00 . A A . 24 ARG O 1 1 6 2999 1 1 25 LEU C C -11.851 1.853 4.882 1.00 . A A . 25 LEU C 1 1 6 3000 1 1 25 LEU CA C -12.938 2.504 5.767 1.00 . A A . 25 LEU CA 1 1 6 3001 1 1 25 LEU CB C -13.773 1.448 6.531 1.00 . A A . 25 LEU CB 1 1 6 3002 1 1 25 LEU CD1 C -14.449 2.981 8.465 1.00 . A A . 25 LEU CD1 1 1 6 3003 1 1 25 LEU CD2 C -14.553 0.526 8.730 1.00 . A A . 25 LEU CD2 1 1 6 3004 1 1 25 LEU CG C -13.790 1.663 8.054 1.00 . A A . 25 LEU CG 1 1 6 3005 1 1 25 LEU H H -13.794 4.428 5.419 1.00 . A A . 25 LEU H 1 1 6 3006 1 1 25 LEU HA H -12.373 3.070 6.510 1.00 . A A . 25 LEU HA 1 1 6 3007 1 1 25 LEU HB2 H -14.801 1.427 6.168 1.00 . A A . 25 LEU HB2 1 1 6 3008 1 1 25 LEU HB3 H -13.347 0.461 6.342 1.00 . A A . 25 LEU HB3 1 1 6 3009 1 1 25 LEU HD11 H -13.928 3.819 8.006 1.00 . A A . 25 LEU HD11 1 1 6 3010 1 1 25 LEU HD12 H -14.394 3.089 9.547 1.00 . A A . 25 LEU HD12 1 1 6 3011 1 1 25 LEU HD13 H -15.492 2.992 8.155 1.00 . A A . 25 LEU HD13 1 1 6 3012 1 1 25 LEU HD21 H -15.582 0.499 8.371 1.00 . A A . 25 LEU HD21 1 1 6 3013 1 1 25 LEU HD22 H -14.554 0.669 9.810 1.00 . A A . 25 LEU HD22 1 1 6 3014 1 1 25 LEU HD23 H -14.074 -0.426 8.501 1.00 . A A . 25 LEU HD23 1 1 6 3015 1 1 25 LEU HG H -12.765 1.649 8.417 1.00 . A A . 25 LEU HG 1 1 6 3016 1 1 25 LEU N N -13.825 3.475 5.082 1.00 . A A . 25 LEU N 1 1 6 3017 1 1 25 LEU O O -10.698 1.781 5.293 1.00 . A A . 25 LEU O 1 1 6 3018 1 1 26 TRP C C -10.859 1.670 1.458 1.00 . A A . 26 TRP C 1 1 6 3019 1 1 26 TRP CA C -11.245 0.823 2.685 1.00 . A A . 26 TRP CA 1 1 6 3020 1 1 26 TRP CB C -11.827 -0.573 2.359 1.00 . A A . 26 TRP CB 1 1 6 3021 1 1 26 TRP CD1 C -14.035 -1.221 3.393 1.00 . A A . 26 TRP CD1 1 1 6 3022 1 1 26 TRP CD2 C -14.323 -0.081 1.490 1.00 . A A . 26 TRP CD2 1 1 6 3023 1 1 26 TRP CE2 C -15.621 -0.353 2.017 1.00 . A A . 26 TRP CE2 1 1 6 3024 1 1 26 TRP CE3 C -14.275 0.738 0.341 1.00 . A A . 26 TRP CE3 1 1 6 3025 1 1 26 TRP CG C -13.324 -0.707 2.363 1.00 . A A . 26 TRP CG 1 1 6 3026 1 1 26 TRP CH2 C -16.696 1.048 0.368 1.00 . A A . 26 TRP CH2 1 1 6 3027 1 1 26 TRP CZ2 C -16.793 0.169 1.456 1.00 . A A . 26 TRP CZ2 1 1 6 3028 1 1 26 TRP CZ3 C -15.443 1.301 -0.209 1.00 . A A . 26 TRP CZ3 1 1 6 3029 1 1 26 TRP H H -13.125 1.540 3.382 1.00 . A A . 26 TRP H 1 1 6 3030 1 1 26 TRP HA H -10.300 0.628 3.193 1.00 . A A . 26 TRP HA 1 1 6 3031 1 1 26 TRP HB2 H -11.445 -0.963 1.418 1.00 . A A . 26 TRP HB2 1 1 6 3032 1 1 26 TRP HB3 H -11.449 -1.246 3.130 1.00 . A A . 26 TRP HB3 1 1 6 3033 1 1 26 TRP HD1 H -13.607 -1.679 4.278 1.00 . A A . 26 TRP HD1 1 1 6 3034 1 1 26 TRP HE1 H -16.095 -1.475 3.771 1.00 . A A . 26 TRP HE1 1 1 6 3035 1 1 26 TRP HE3 H -13.327 0.962 -0.105 1.00 . A A . 26 TRP HE3 1 1 6 3036 1 1 26 TRP HH2 H -17.582 1.522 -0.030 1.00 . A A . 26 TRP HH2 1 1 6 3037 1 1 26 TRP HZ2 H -17.749 -0.060 1.899 1.00 . A A . 26 TRP HZ2 1 1 6 3038 1 1 26 TRP HZ3 H -15.378 1.942 -1.075 1.00 . A A . 26 TRP HZ3 1 1 6 3039 1 1 26 TRP N N -12.139 1.516 3.626 1.00 . A A . 26 TRP N 1 1 6 3040 1 1 26 TRP NE1 N -15.382 -1.115 3.134 1.00 . A A . 26 TRP NE1 1 1 6 3041 1 1 26 TRP O O -10.888 2.901 1.485 1.00 . A A . 26 TRP O 1 1 6 3042 1 1 27 CYS C C -11.074 0.285 -1.811 1.00 . A A . 27 CYS C 1 1 6 3043 1 1 27 CYS CA C -10.745 1.520 -0.970 1.00 . A A . 27 CYS CA 1 1 6 3044 1 1 27 CYS CB C -9.574 2.280 -1.619 1.00 . A A . 27 CYS CB 1 1 6 3045 1 1 27 CYS H H -10.226 0.065 0.437 1.00 . A A . 27 CYS H 1 1 6 3046 1 1 27 CYS HA H -11.635 2.131 -0.915 1.00 . A A . 27 CYS HA 1 1 6 3047 1 1 27 CYS HB2 H -8.618 1.949 -1.236 1.00 . A A . 27 CYS HB2 1 1 6 3048 1 1 27 CYS HB3 H -9.651 2.219 -2.699 1.00 . A A . 27 CYS HB3 1 1 6 3049 1 1 27 CYS N N -10.386 1.065 0.375 1.00 . A A . 27 CYS N 1 1 6 3050 1 1 27 CYS O O -10.369 -0.710 -1.680 1.00 . A A . 27 CYS O 1 1 6 3051 1 1 27 CYS SG S -9.889 4.041 -1.204 1.00 . A A . 27 CYS SG 1 1 6 3052 1 1 28 LYS C C -13.342 -0.431 -4.651 1.00 . A A . 28 LYS C 1 1 6 3053 1 1 28 LYS CA C -12.659 -0.845 -3.349 1.00 . A A . 28 LYS CA 1 1 6 3054 1 1 28 LYS CB C -13.615 -1.700 -2.507 1.00 . A A . 28 LYS CB 1 1 6 3055 1 1 28 LYS CD C -12.022 -3.606 -1.912 1.00 . A A . 28 LYS CD 1 1 6 3056 1 1 28 LYS CE C -11.669 -4.599 -0.803 1.00 . A A . 28 LYS CE 1 1 6 3057 1 1 28 LYS CG C -12.998 -2.545 -1.380 1.00 . A A . 28 LYS CG 1 1 6 3058 1 1 28 LYS H H -12.718 1.163 -2.626 1.00 . A A . 28 LYS H 1 1 6 3059 1 1 28 LYS HA H -11.811 -1.464 -3.640 1.00 . A A . 28 LYS HA 1 1 6 3060 1 1 28 LYS HB2 H -14.391 -1.059 -2.087 1.00 . A A . 28 LYS HB2 1 1 6 3061 1 1 28 LYS HB3 H -14.089 -2.394 -3.192 1.00 . A A . 28 LYS HB3 1 1 6 3062 1 1 28 LYS HD2 H -12.479 -4.148 -2.738 1.00 . A A . 28 LYS HD2 1 1 6 3063 1 1 28 LYS HD3 H -11.117 -3.122 -2.276 1.00 . A A . 28 LYS HD3 1 1 6 3064 1 1 28 LYS HE2 H -11.397 -4.036 0.088 1.00 . A A . 28 LYS HE2 1 1 6 3065 1 1 28 LYS HE3 H -12.552 -5.199 -0.569 1.00 . A A . 28 LYS HE3 1 1 6 3066 1 1 28 LYS HG2 H -12.494 -1.902 -0.660 1.00 . A A . 28 LYS HG2 1 1 6 3067 1 1 28 LYS HG3 H -13.811 -3.048 -0.856 1.00 . A A . 28 LYS HG3 1 1 6 3068 1 1 28 LYS HZ1 H -10.698 -5.874 -2.121 1.00 . A A . 28 LYS HZ1 1 1 6 3069 1 1 28 LYS HZ2 H -10.408 -6.231 -0.530 1.00 . A A . 28 LYS HZ2 1 1 6 3070 1 1 28 LYS HZ3 H -9.703 -4.906 -1.268 1.00 . A A . 28 LYS HZ3 1 1 6 3071 1 1 28 LYS N N -12.164 0.311 -2.584 1.00 . A A . 28 LYS N 1 1 6 3072 1 1 28 LYS NZ N -10.542 -5.472 -1.197 1.00 . A A . 28 LYS NZ 1 1 6 3073 1 1 28 LYS O O -13.862 0.680 -4.759 1.00 . A A . 28 LYS O 1 1 6 3074 1 1 29 LYS C C -14.947 -0.668 -7.412 1.00 . A A . 29 LYS C 1 1 6 3075 1 1 29 LYS CA C -13.467 -0.856 -7.064 1.00 . A A . 29 LYS CA 1 1 6 3076 1 1 29 LYS CB C -12.710 -1.758 -8.054 1.00 . A A . 29 LYS CB 1 1 6 3077 1 1 29 LYS CD C -10.316 -1.846 -8.971 1.00 . A A . 29 LYS CD 1 1 6 3078 1 1 29 LYS CE C -8.849 -1.958 -8.543 1.00 . A A . 29 LYS CE 1 1 6 3079 1 1 29 LYS CG C -11.204 -1.822 -7.723 1.00 . A A . 29 LYS CG 1 1 6 3080 1 1 29 LYS H H -12.912 -2.225 -5.504 1.00 . A A . 29 LYS H 1 1 6 3081 1 1 29 LYS HA H -13.018 0.127 -7.154 1.00 . A A . 29 LYS HA 1 1 6 3082 1 1 29 LYS HB2 H -13.127 -2.767 -8.045 1.00 . A A . 29 LYS HB2 1 1 6 3083 1 1 29 LYS HB3 H -12.844 -1.344 -9.055 1.00 . A A . 29 LYS HB3 1 1 6 3084 1 1 29 LYS HD2 H -10.589 -2.696 -9.595 1.00 . A A . 29 LYS HD2 1 1 6 3085 1 1 29 LYS HD3 H -10.465 -0.933 -9.547 1.00 . A A . 29 LYS HD3 1 1 6 3086 1 1 29 LYS HE2 H -8.586 -1.112 -7.902 1.00 . A A . 29 LYS HE2 1 1 6 3087 1 1 29 LYS HE3 H -8.731 -2.878 -7.965 1.00 . A A . 29 LYS HE3 1 1 6 3088 1 1 29 LYS HG2 H -10.917 -0.956 -7.130 1.00 . A A . 29 LYS HG2 1 1 6 3089 1 1 29 LYS HG3 H -11.012 -2.713 -7.124 1.00 . A A . 29 LYS HG3 1 1 6 3090 1 1 29 LYS HZ1 H -7.950 -1.116 -10.216 1.00 . A A . 29 LYS HZ1 1 1 6 3091 1 1 29 LYS HZ2 H -8.244 -2.722 -10.355 1.00 . A A . 29 LYS HZ2 1 1 6 3092 1 1 29 LYS HZ3 H -6.995 -2.220 -9.416 1.00 . A A . 29 LYS HZ3 1 1 6 3093 1 1 29 LYS N N -13.244 -1.281 -5.678 1.00 . A A . 29 LYS N 1 1 6 3094 1 1 29 LYS NZ N -7.941 -1.998 -9.705 1.00 . A A . 29 LYS NZ 1 1 6 3095 1 1 29 LYS O O -15.665 -1.642 -7.655 1.00 . A A . 29 LYS O 1 1 6 3096 1 1 30 LYS C C -16.421 2.458 -8.660 1.00 . A A . 30 LYS C 1 1 6 3097 1 1 30 LYS CA C -16.640 1.061 -8.058 1.00 . A A . 30 LYS CA 1 1 6 3098 1 1 30 LYS CB C -17.722 1.071 -6.955 1.00 . A A . 30 LYS CB 1 1 6 3099 1 1 30 LYS CD C -20.151 1.837 -6.638 1.00 . A A . 30 LYS CD 1 1 6 3100 1 1 30 LYS CE C -21.553 1.707 -7.247 1.00 . A A . 30 LYS CE 1 1 6 3101 1 1 30 LYS CG C -19.137 1.139 -7.553 1.00 . A A . 30 LYS CG 1 1 6 3102 1 1 30 LYS H H -14.721 1.306 -7.172 1.00 . A A . 30 LYS H 1 1 6 3103 1 1 30 LYS HA H -16.951 0.379 -8.853 1.00 . A A . 30 LYS HA 1 1 6 3104 1 1 30 LYS HB2 H -17.651 0.165 -6.352 1.00 . A A . 30 LYS HB2 1 1 6 3105 1 1 30 LYS HB3 H -17.555 1.921 -6.292 1.00 . A A . 30 LYS HB3 1 1 6 3106 1 1 30 LYS HD2 H -20.143 1.381 -5.647 1.00 . A A . 30 LYS HD2 1 1 6 3107 1 1 30 LYS HD3 H -19.878 2.891 -6.554 1.00 . A A . 30 LYS HD3 1 1 6 3108 1 1 30 LYS HE2 H -21.490 1.845 -8.330 1.00 . A A . 30 LYS HE2 1 1 6 3109 1 1 30 LYS HE3 H -21.928 0.696 -7.069 1.00 . A A . 30 LYS HE3 1 1 6 3110 1 1 30 LYS HG2 H -19.105 1.688 -8.491 1.00 . A A . 30 LYS HG2 1 1 6 3111 1 1 30 LYS HG3 H -19.473 0.122 -7.767 1.00 . A A . 30 LYS HG3 1 1 6 3112 1 1 30 LYS HZ1 H -22.496 2.722 -5.681 1.00 . A A . 30 LYS HZ1 1 1 6 3113 1 1 30 LYS HZ2 H -23.452 2.510 -7.005 1.00 . A A . 30 LYS HZ2 1 1 6 3114 1 1 30 LYS HZ3 H -22.260 3.627 -7.043 1.00 . A A . 30 LYS HZ3 1 1 6 3115 1 1 30 LYS N N -15.366 0.597 -7.494 1.00 . A A . 30 LYS N 1 1 6 3116 1 1 30 LYS NZ N -22.500 2.702 -6.697 1.00 . A A . 30 LYS NZ 1 1 6 3117 1 1 30 LYS O O -16.173 3.413 -7.921 1.00 . A A . 30 LYS O 1 1 6 3118 1 1 31 LEU C C -17.037 3.845 -12.053 1.00 . A A . 31 LEU C 1 1 6 3119 1 1 31 LEU CA C -16.250 3.828 -10.728 1.00 . A A . 31 LEU CA 1 1 6 3120 1 1 31 LEU CB C -14.745 4.125 -10.916 1.00 . A A . 31 LEU CB 1 1 6 3121 1 1 31 LEU CD1 C -14.359 6.400 -9.871 1.00 . A A . 31 LEU CD1 1 1 6 3122 1 1 31 LEU CD2 C -13.109 5.818 -11.921 1.00 . A A . 31 LEU CD2 1 1 6 3123 1 1 31 LEU CG C -14.432 5.618 -11.183 1.00 . A A . 31 LEU CG 1 1 6 3124 1 1 31 LEU H H -16.598 1.734 -10.536 1.00 . A A . 31 LEU H 1 1 6 3125 1 1 31 LEU HA H -16.671 4.622 -10.116 1.00 . A A . 31 LEU HA 1 1 6 3126 1 1 31 LEU HB2 H -14.209 3.813 -10.022 1.00 . A A . 31 LEU HB2 1 1 6 3127 1 1 31 LEU HB3 H -14.380 3.523 -11.750 1.00 . A A . 31 LEU HB3 1 1 6 3128 1 1 31 LEU HD11 H -15.341 6.420 -9.407 1.00 . A A . 31 LEU HD11 1 1 6 3129 1 1 31 LEU HD12 H -14.041 7.421 -10.061 1.00 . A A . 31 LEU HD12 1 1 6 3130 1 1 31 LEU HD13 H -13.647 5.933 -9.190 1.00 . A A . 31 LEU HD13 1 1 6 3131 1 1 31 LEU HD21 H -12.995 6.868 -12.188 1.00 . A A . 31 LEU HD21 1 1 6 3132 1 1 31 LEU HD22 H -13.108 5.232 -12.842 1.00 . A A . 31 LEU HD22 1 1 6 3133 1 1 31 LEU HD23 H -12.266 5.525 -11.301 1.00 . A A . 31 LEU HD23 1 1 6 3134 1 1 31 LEU HG H -15.211 6.068 -11.793 1.00 . A A . 31 LEU HG 1 1 6 3135 1 1 31 LEU N N -16.435 2.565 -9.990 1.00 . A A . 31 LEU N 1 1 6 3136 1 1 31 LEU O O -16.622 4.457 -13.030 1.00 . A A . 31 LEU O 1 1 6 3137 1 1 32 LEU C C -19.807 4.208 -13.632 1.00 . A A . 32 LEU C 1 1 6 3138 1 1 32 LEU CA C -18.911 2.989 -13.373 1.00 . A A . 32 LEU CA 1 1 6 3139 1 1 32 LEU CB C -19.721 1.664 -13.329 1.00 . A A . 32 LEU CB 1 1 6 3140 1 1 32 LEU CD1 C -21.925 0.891 -12.379 1.00 . A A . 32 LEU CD1 1 1 6 3141 1 1 32 LEU CD2 C -19.850 0.517 -11.056 1.00 . A A . 32 LEU CD2 1 1 6 3142 1 1 32 LEU CG C -20.550 1.476 -12.030 1.00 . A A . 32 LEU CG 1 1 6 3143 1 1 32 LEU H H -18.632 2.923 -11.241 1.00 . A A . 32 LEU H 1 1 6 3144 1 1 32 LEU HA H -18.210 2.916 -14.192 1.00 . A A . 32 LEU HA 1 1 6 3145 1 1 32 LEU HB2 H -20.375 1.657 -14.202 1.00 . A A . 32 LEU HB2 1 1 6 3146 1 1 32 LEU HB3 H -19.026 0.831 -13.447 1.00 . A A . 32 LEU HB3 1 1 6 3147 1 1 32 LEU HD11 H -22.496 0.709 -11.469 1.00 . A A . 32 LEU HD11 1 1 6 3148 1 1 32 LEU HD12 H -21.807 -0.044 -12.927 1.00 . A A . 32 LEU HD12 1 1 6 3149 1 1 32 LEU HD13 H -22.478 1.597 -12.998 1.00 . A A . 32 LEU HD13 1 1 6 3150 1 1 32 LEU HD21 H -19.698 -0.454 -11.526 1.00 . A A . 32 LEU HD21 1 1 6 3151 1 1 32 LEU HD22 H -20.465 0.382 -10.166 1.00 . A A . 32 LEU HD22 1 1 6 3152 1 1 32 LEU HD23 H -18.881 0.914 -10.763 1.00 . A A . 32 LEU HD23 1 1 6 3153 1 1 32 LEU HG H -20.717 2.429 -11.525 1.00 . A A . 32 LEU HG 1 1 6 3154 1 1 32 LEU N N -18.170 3.153 -12.114 1.00 . A A . 32 LEU N 1 1 6 3155 1 1 32 LEU O O -20.900 4.357 -13.128 1.00 . A A . 32 LEU O 1 1 6 3156 1 1 32 LEU OXT O -19.402 4.979 -14.238 1.00 . A A . 32 LEU OXT 1 1 7 3157 1 1 1 GLY C C 2.256 -7.685 0.431 1.00 . A A . 1 GLY C 1 1 7 3158 1 1 1 GLY CA C 3.666 -7.379 0.001 1.00 . A A . 1 GLY CA 1 1 7 3159 1 1 1 GLY H1 H 4.541 -6.395 -1.569 1.00 . A A . 1 GLY H1 1 1 7 3160 1 1 1 GLY H2 H 3.350 -7.428 -2.027 1.00 . A A . 1 GLY H2 1 1 7 3161 1 1 1 GLY H3 H 2.967 -5.981 -1.336 1.00 . A A . 1 GLY H3 1 1 7 3162 1 1 1 GLY HA2 H 4.240 -8.303 -0.036 1.00 . A A . 1 GLY HA2 1 1 7 3163 1 1 1 GLY HA3 H 4.121 -6.701 0.716 1.00 . A A . 1 GLY HA3 1 1 7 3164 1 1 1 GLY N N 3.627 -6.749 -1.329 1.00 . A A . 1 GLY N 1 1 7 3165 1 1 1 GLY O O 1.662 -8.637 -0.080 1.00 . A A . 1 GLY O 1 1 7 3166 1 1 2 PRO C C -0.167 -5.964 -0.252 1.00 . A A . 2 PRO C 1 1 7 3167 1 1 2 PRO CA C 0.185 -6.595 1.107 1.00 . A A . 2 PRO CA 1 1 7 3168 1 1 2 PRO CB C -0.147 -5.673 2.282 1.00 . A A . 2 PRO CB 1 1 7 3169 1 1 2 PRO CD C 2.218 -5.768 2.062 1.00 . A A . 2 PRO CD 1 1 7 3170 1 1 2 PRO CG C 1.091 -4.787 2.381 1.00 . A A . 2 PRO CG 1 1 7 3171 1 1 2 PRO HA H -0.361 -7.532 1.213 1.00 . A A . 2 PRO HA 1 1 7 3172 1 1 2 PRO HB2 H -1.053 -5.088 2.132 1.00 . A A . 2 PRO HB2 1 1 7 3173 1 1 2 PRO HB3 H -0.232 -6.281 3.182 1.00 . A A . 2 PRO HB3 1 1 7 3174 1 1 2 PRO HD2 H 3.024 -5.240 1.564 1.00 . A A . 2 PRO HD2 1 1 7 3175 1 1 2 PRO HD3 H 2.588 -6.217 2.984 1.00 . A A . 2 PRO HD3 1 1 7 3176 1 1 2 PRO HG2 H 1.050 -4.007 1.618 1.00 . A A . 2 PRO HG2 1 1 7 3177 1 1 2 PRO HG3 H 1.198 -4.348 3.372 1.00 . A A . 2 PRO HG3 1 1 7 3178 1 1 2 PRO N N 1.624 -6.804 1.219 1.00 . A A . 2 PRO N 1 1 7 3179 1 1 2 PRO O O 0.718 -5.619 -1.044 1.00 . A A . 2 PRO O 1 1 7 3180 1 1 3 TYR C C -2.720 -3.632 -0.674 1.00 . A A . 3 TYR C 1 1 7 3181 1 1 3 TYR CA C -2.029 -4.794 -1.409 1.00 . A A . 3 TYR CA 1 1 7 3182 1 1 3 TYR CB C -2.839 -5.526 -2.493 1.00 . A A . 3 TYR CB 1 1 7 3183 1 1 3 TYR CD1 C -1.935 -7.768 -3.252 1.00 . A A . 3 TYR CD1 1 1 7 3184 1 1 3 TYR CD2 C -1.248 -5.757 -4.449 1.00 . A A . 3 TYR CD2 1 1 7 3185 1 1 3 TYR CE1 C -1.128 -8.551 -4.096 1.00 . A A . 3 TYR CE1 1 1 7 3186 1 1 3 TYR CE2 C -0.442 -6.537 -5.298 1.00 . A A . 3 TYR CE2 1 1 7 3187 1 1 3 TYR CG C -1.991 -6.371 -3.422 1.00 . A A . 3 TYR CG 1 1 7 3188 1 1 3 TYR CZ C -0.382 -7.935 -5.121 1.00 . A A . 3 TYR CZ 1 1 7 3189 1 1 3 TYR H H -2.086 -6.052 0.285 1.00 . A A . 3 TYR H 1 1 7 3190 1 1 3 TYR HA H -1.201 -4.318 -1.935 1.00 . A A . 3 TYR HA 1 1 7 3191 1 1 3 TYR HB2 H -3.606 -6.142 -2.025 1.00 . A A . 3 TYR HB2 1 1 7 3192 1 1 3 TYR HB3 H -3.341 -4.791 -3.116 1.00 . A A . 3 TYR HB3 1 1 7 3193 1 1 3 TYR HD1 H -2.508 -8.244 -2.471 1.00 . A A . 3 TYR HD1 1 1 7 3194 1 1 3 TYR HD2 H -1.290 -4.685 -4.585 1.00 . A A . 3 TYR HD2 1 1 7 3195 1 1 3 TYR HE1 H -1.085 -9.621 -3.957 1.00 . A A . 3 TYR HE1 1 1 7 3196 1 1 3 TYR HE2 H 0.122 -6.064 -6.089 1.00 . A A . 3 TYR HE2 1 1 7 3197 1 1 3 TYR HH H 0.105 -9.617 -5.954 1.00 . A A . 3 TYR HH 1 1 7 3198 1 1 3 TYR N N -1.466 -5.747 -0.450 1.00 . A A . 3 TYR N 1 1 7 3199 1 1 3 TYR O O -2.342 -3.353 0.462 1.00 . A A . 3 TYR O 1 1 7 3200 1 1 3 TYR OH O 0.417 -8.687 -5.923 1.00 . A A . 3 TYR OH 1 1 7 3201 1 1 4 CYS C C -6.002 -1.908 -0.764 1.00 . A A . 4 CYS C 1 1 7 3202 1 1 4 CYS CA C -4.494 -1.969 -0.465 1.00 . A A . 4 CYS CA 1 1 7 3203 1 1 4 CYS CB C -3.748 -0.632 -0.623 1.00 . A A . 4 CYS CB 1 1 7 3204 1 1 4 CYS H H -4.032 -3.199 -2.175 1.00 . A A . 4 CYS H 1 1 7 3205 1 1 4 CYS HA H -4.445 -2.218 0.597 1.00 . A A . 4 CYS HA 1 1 7 3206 1 1 4 CYS HB2 H -4.433 0.178 -0.399 1.00 . A A . 4 CYS HB2 1 1 7 3207 1 1 4 CYS HB3 H -2.972 -0.612 0.145 1.00 . A A . 4 CYS HB3 1 1 7 3208 1 1 4 CYS N N -3.771 -3.005 -1.214 1.00 . A A . 4 CYS N 1 1 7 3209 1 1 4 CYS O O -6.820 -2.098 0.140 1.00 . A A . 4 CYS O 1 1 7 3210 1 1 4 CYS SG S -2.902 -0.246 -2.189 1.00 . A A . 4 CYS SG 1 1 7 3211 1 1 5 GLN C C -8.248 -3.451 -2.361 1.00 . A A . 5 GLN C 1 1 7 3212 1 1 5 GLN CA C -7.749 -2.009 -2.537 1.00 . A A . 5 GLN CA 1 1 7 3213 1 1 5 GLN CB C -7.799 -1.594 -4.022 1.00 . A A . 5 GLN CB 1 1 7 3214 1 1 5 GLN CD C -5.733 -2.876 -4.990 1.00 . A A . 5 GLN CD 1 1 7 3215 1 1 5 GLN CG C -7.231 -2.570 -5.072 1.00 . A A . 5 GLN CG 1 1 7 3216 1 1 5 GLN H H -5.651 -1.733 -2.732 1.00 . A A . 5 GLN H 1 1 7 3217 1 1 5 GLN HA H -8.412 -1.357 -1.970 1.00 . A A . 5 GLN HA 1 1 7 3218 1 1 5 GLN HB2 H -8.848 -1.453 -4.278 1.00 . A A . 5 GLN HB2 1 1 7 3219 1 1 5 GLN HB3 H -7.315 -0.624 -4.142 1.00 . A A . 5 GLN HB3 1 1 7 3220 1 1 5 GLN HE21 H -5.464 -2.280 -6.902 1.00 . A A . 5 GLN HE21 1 1 7 3221 1 1 5 GLN HE22 H -4.055 -2.979 -6.124 1.00 . A A . 5 GLN HE22 1 1 7 3222 1 1 5 GLN HG2 H -7.776 -3.512 -5.038 1.00 . A A . 5 GLN HG2 1 1 7 3223 1 1 5 GLN HG3 H -7.439 -2.134 -6.048 1.00 . A A . 5 GLN HG3 1 1 7 3224 1 1 5 GLN N N -6.382 -1.828 -2.036 1.00 . A A . 5 GLN N 1 1 7 3225 1 1 5 GLN NE2 N -5.030 -2.709 -6.078 1.00 . A A . 5 GLN NE2 1 1 7 3226 1 1 5 GLN O O -9.442 -3.681 -2.182 1.00 . A A . 5 GLN O 1 1 7 3227 1 1 5 GLN OE1 O -5.206 -3.332 -3.978 1.00 . A A . 5 GLN OE1 1 1 7 3228 1 1 6 LYS C C -7.112 -6.350 -0.811 1.00 . A A . 6 LYS C 1 1 7 3229 1 1 6 LYS CA C -7.554 -5.862 -2.205 1.00 . A A . 6 LYS CA 1 1 7 3230 1 1 6 LYS CB C -6.858 -6.599 -3.371 1.00 . A A . 6 LYS CB 1 1 7 3231 1 1 6 LYS CD C -6.696 -8.680 -4.804 1.00 . A A . 6 LYS CD 1 1 7 3232 1 1 6 LYS CE C -7.145 -10.140 -4.902 1.00 . A A . 6 LYS CE 1 1 7 3233 1 1 6 LYS CG C -7.390 -8.021 -3.610 1.00 . A A . 6 LYS CG 1 1 7 3234 1 1 6 LYS H H -6.393 -4.136 -2.685 1.00 . A A . 6 LYS H 1 1 7 3235 1 1 6 LYS HA H -8.626 -6.060 -2.272 1.00 . A A . 6 LYS HA 1 1 7 3236 1 1 6 LYS HB2 H -7.018 -6.033 -4.291 1.00 . A A . 6 LYS HB2 1 1 7 3237 1 1 6 LYS HB3 H -5.784 -6.637 -3.184 1.00 . A A . 6 LYS HB3 1 1 7 3238 1 1 6 LYS HD2 H -6.949 -8.146 -5.719 1.00 . A A . 6 LYS HD2 1 1 7 3239 1 1 6 LYS HD3 H -5.616 -8.635 -4.666 1.00 . A A . 6 LYS HD3 1 1 7 3240 1 1 6 LYS HE2 H -6.938 -10.639 -3.951 1.00 . A A . 6 LYS HE2 1 1 7 3241 1 1 6 LYS HE3 H -8.223 -10.173 -5.079 1.00 . A A . 6 LYS HE3 1 1 7 3242 1 1 6 LYS HG2 H -7.213 -8.639 -2.736 1.00 . A A . 6 LYS HG2 1 1 7 3243 1 1 6 LYS HG3 H -8.464 -7.981 -3.795 1.00 . A A . 6 LYS HG3 1 1 7 3244 1 1 6 LYS HZ1 H -6.754 -11.805 -6.071 1.00 . A A . 6 LYS HZ1 1 1 7 3245 1 1 6 LYS HZ2 H -5.431 -10.837 -5.820 1.00 . A A . 6 LYS HZ2 1 1 7 3246 1 1 6 LYS HZ3 H -6.590 -10.367 -6.872 1.00 . A A . 6 LYS HZ3 1 1 7 3247 1 1 6 LYS N N -7.326 -4.422 -2.396 1.00 . A A . 6 LYS N 1 1 7 3248 1 1 6 LYS NZ N -6.434 -10.845 -5.987 1.00 . A A . 6 LYS NZ 1 1 7 3249 1 1 6 LYS O O -7.088 -7.554 -0.561 1.00 . A A . 6 LYS O 1 1 7 3250 1 1 7 TRP C C -6.687 -4.821 2.541 1.00 . A A . 7 TRP C 1 1 7 3251 1 1 7 TRP CA C -6.152 -5.730 1.406 1.00 . A A . 7 TRP CA 1 1 7 3252 1 1 7 TRP CB C -4.628 -5.591 1.244 1.00 . A A . 7 TRP CB 1 1 7 3253 1 1 7 TRP CD1 C -3.440 -6.583 3.243 1.00 . A A . 7 TRP CD1 1 1 7 3254 1 1 7 TRP CD2 C -3.346 -7.930 1.458 1.00 . A A . 7 TRP CD2 1 1 7 3255 1 1 7 TRP CE2 C -2.703 -8.616 2.533 1.00 . A A . 7 TRP CE2 1 1 7 3256 1 1 7 TRP CE3 C -3.429 -8.618 0.228 1.00 . A A . 7 TRP CE3 1 1 7 3257 1 1 7 TRP CG C -3.776 -6.613 1.935 1.00 . A A . 7 TRP CG 1 1 7 3258 1 1 7 TRP CH2 C -2.264 -10.556 1.165 1.00 . A A . 7 TRP CH2 1 1 7 3259 1 1 7 TRP CZ2 C -2.188 -9.912 2.409 1.00 . A A . 7 TRP CZ2 1 1 7 3260 1 1 7 TRP CZ3 C -2.875 -9.906 0.078 1.00 . A A . 7 TRP CZ3 1 1 7 3261 1 1 7 TRP H H -6.809 -4.463 -0.192 1.00 . A A . 7 TRP H 1 1 7 3262 1 1 7 TRP HA H -6.384 -6.759 1.689 1.00 . A A . 7 TRP HA 1 1 7 3263 1 1 7 TRP HB2 H -4.382 -5.667 0.186 1.00 . A A . 7 TRP HB2 1 1 7 3264 1 1 7 TRP HB3 H -4.327 -4.596 1.574 1.00 . A A . 7 TRP HB3 1 1 7 3265 1 1 7 TRP HD1 H -3.663 -5.765 3.920 1.00 . A A . 7 TRP HD1 1 1 7 3266 1 1 7 TRP HE1 H -2.465 -7.948 4.540 1.00 . A A . 7 TRP HE1 1 1 7 3267 1 1 7 TRP HE3 H -3.933 -8.151 -0.604 1.00 . A A . 7 TRP HE3 1 1 7 3268 1 1 7 TRP HH2 H -1.883 -11.563 1.049 1.00 . A A . 7 TRP HH2 1 1 7 3269 1 1 7 TRP HZ2 H -1.781 -10.419 3.273 1.00 . A A . 7 TRP HZ2 1 1 7 3270 1 1 7 TRP HZ3 H -2.941 -10.416 -0.872 1.00 . A A . 7 TRP HZ3 1 1 7 3271 1 1 7 TRP N N -6.776 -5.428 0.100 1.00 . A A . 7 TRP N 1 1 7 3272 1 1 7 TRP NE1 N -2.790 -7.748 3.591 1.00 . A A . 7 TRP NE1 1 1 7 3273 1 1 7 TRP O O -6.242 -4.917 3.682 1.00 . A A . 7 TRP O 1 1 7 3274 1 1 8 MET C C -7.645 -2.231 4.113 1.00 . A A . 8 MET C 1 1 7 3275 1 1 8 MET CA C -8.460 -3.157 3.187 1.00 . A A . 8 MET CA 1 1 7 3276 1 1 8 MET CB C -9.488 -4.040 3.916 1.00 . A A . 8 MET CB 1 1 7 3277 1 1 8 MET CE C -12.314 -6.629 2.232 1.00 . A A . 8 MET CE 1 1 7 3278 1 1 8 MET CG C -10.454 -4.689 2.916 1.00 . A A . 8 MET CG 1 1 7 3279 1 1 8 MET H H -7.932 -3.898 1.270 1.00 . A A . 8 MET H 1 1 7 3280 1 1 8 MET HA H -9.035 -2.477 2.564 1.00 . A A . 8 MET HA 1 1 7 3281 1 1 8 MET HB2 H -8.975 -4.815 4.488 1.00 . A A . 8 MET HB2 1 1 7 3282 1 1 8 MET HB3 H -10.067 -3.425 4.606 1.00 . A A . 8 MET HB3 1 1 7 3283 1 1 8 MET HE1 H -13.017 -7.400 2.549 1.00 . A A . 8 MET HE1 1 1 7 3284 1 1 8 MET HE2 H -12.817 -5.960 1.537 1.00 . A A . 8 MET HE2 1 1 7 3285 1 1 8 MET HE3 H -11.469 -7.104 1.734 1.00 . A A . 8 MET HE3 1 1 7 3286 1 1 8 MET HG2 H -10.930 -3.912 2.318 1.00 . A A . 8 MET HG2 1 1 7 3287 1 1 8 MET HG3 H -9.884 -5.330 2.245 1.00 . A A . 8 MET HG3 1 1 7 3288 1 1 8 MET N N -7.668 -3.958 2.239 1.00 . A A . 8 MET N 1 1 7 3289 1 1 8 MET O O -7.770 -2.258 5.332 1.00 . A A . 8 MET O 1 1 7 3290 1 1 8 MET SD S -11.746 -5.693 3.680 1.00 . A A . 8 MET SD 1 1 7 3291 1 1 9 GLN C C -6.446 0.713 5.034 1.00 . A A . 9 GLN C 1 1 7 3292 1 1 9 GLN CA C -5.894 -0.415 4.108 1.00 . A A . 9 GLN CA 1 1 7 3293 1 1 9 GLN CB C -5.024 0.176 2.974 1.00 . A A . 9 GLN CB 1 1 7 3294 1 1 9 GLN CD C -5.146 2.047 1.147 1.00 . A A . 9 GLN CD 1 1 7 3295 1 1 9 GLN CG C -5.878 1.012 1.995 1.00 . A A . 9 GLN CG 1 1 7 3296 1 1 9 GLN H H -6.829 -1.422 2.489 1.00 . A A . 9 GLN H 1 1 7 3297 1 1 9 GLN HA H -5.237 -1.021 4.733 1.00 . A A . 9 GLN HA 1 1 7 3298 1 1 9 GLN HB2 H -4.241 0.790 3.420 1.00 . A A . 9 GLN HB2 1 1 7 3299 1 1 9 GLN HB3 H -4.535 -0.630 2.426 1.00 . A A . 9 GLN HB3 1 1 7 3300 1 1 9 GLN HE21 H -3.409 2.191 2.237 1.00 . A A . 9 GLN HE21 1 1 7 3301 1 1 9 GLN HE22 H -3.646 3.317 0.907 1.00 . A A . 9 GLN HE22 1 1 7 3302 1 1 9 GLN HG2 H -6.401 0.335 1.322 1.00 . A A . 9 GLN HG2 1 1 7 3303 1 1 9 GLN HG3 H -6.638 1.566 2.543 1.00 . A A . 9 GLN HG3 1 1 7 3304 1 1 9 GLN N N -6.863 -1.343 3.494 1.00 . A A . 9 GLN N 1 1 7 3305 1 1 9 GLN NE2 N -3.970 2.536 1.473 1.00 . A A . 9 GLN NE2 1 1 7 3306 1 1 9 GLN O O -5.934 1.832 4.966 1.00 . A A . 9 GLN O 1 1 7 3307 1 1 9 GLN OE1 O -5.708 2.504 0.170 1.00 . A A . 9 GLN OE1 1 1 7 3308 1 1 10 THR C C -8.118 2.877 6.395 1.00 . A A . 10 THR C 1 1 7 3309 1 1 10 THR CA C -7.971 1.430 6.908 1.00 . A A . 10 THR CA 1 1 7 3310 1 1 10 THR CB C -7.122 1.344 8.189 1.00 . A A . 10 THR CB 1 1 7 3311 1 1 10 THR CG2 C -7.774 1.987 9.412 1.00 . A A . 10 THR CG2 1 1 7 3312 1 1 10 THR H H -7.833 -0.464 5.898 1.00 . A A . 10 THR H 1 1 7 3313 1 1 10 THR HA H -8.967 1.107 7.200 1.00 . A A . 10 THR HA 1 1 7 3314 1 1 10 THR HB H -6.146 1.796 8.009 1.00 . A A . 10 THR HB 1 1 7 3315 1 1 10 THR HG1 H -6.334 -0.001 9.320 1.00 . A A . 10 THR HG1 1 1 7 3316 1 1 10 THR HG21 H -8.202 2.952 9.156 1.00 . A A . 10 THR HG21 1 1 7 3317 1 1 10 THR HG22 H -7.029 2.131 10.193 1.00 . A A . 10 THR HG22 1 1 7 3318 1 1 10 THR HG23 H -8.567 1.351 9.793 1.00 . A A . 10 THR HG23 1 1 7 3319 1 1 10 THR N N -7.476 0.487 5.863 1.00 . A A . 10 THR N 1 1 7 3320 1 1 10 THR O O -7.390 3.784 6.812 1.00 . A A . 10 THR O 1 1 7 3321 1 1 10 THR OG1 O -6.949 -0.010 8.557 1.00 . A A . 10 THR OG1 1 1 7 3322 1 1 11 CYS C C -9.775 5.391 5.254 1.00 . A A . 11 CYS C 1 1 7 3323 1 1 11 CYS CA C -8.980 4.278 4.547 1.00 . A A . 11 CYS CA 1 1 7 3324 1 1 11 CYS CB C -9.454 3.958 3.122 1.00 . A A . 11 CYS CB 1 1 7 3325 1 1 11 CYS H H -9.524 2.273 5.096 1.00 . A A . 11 CYS H 1 1 7 3326 1 1 11 CYS HA H -7.955 4.633 4.446 1.00 . A A . 11 CYS HA 1 1 7 3327 1 1 11 CYS HB2 H -9.126 2.950 2.882 1.00 . A A . 11 CYS HB2 1 1 7 3328 1 1 11 CYS HB3 H -10.544 3.990 3.077 1.00 . A A . 11 CYS HB3 1 1 7 3329 1 1 11 CYS N N -8.928 3.051 5.347 1.00 . A A . 11 CYS N 1 1 7 3330 1 1 11 CYS O O -10.985 5.531 5.070 1.00 . A A . 11 CYS O 1 1 7 3331 1 1 11 CYS SG S -8.758 5.029 1.834 1.00 . A A . 11 CYS SG 1 1 7 3332 1 1 12 ASP C C -9.011 8.592 6.330 1.00 . A A . 12 ASP C 1 1 7 3333 1 1 12 ASP CA C -9.515 7.253 6.918 1.00 . A A . 12 ASP CA 1 1 7 3334 1 1 12 ASP CB C -8.917 7.078 8.322 1.00 . A A . 12 ASP CB 1 1 7 3335 1 1 12 ASP CG C -9.081 5.705 8.978 1.00 . A A . 12 ASP CG 1 1 7 3336 1 1 12 ASP H H -8.094 5.843 6.220 1.00 . A A . 12 ASP H 1 1 7 3337 1 1 12 ASP HA H -10.605 7.256 6.979 1.00 . A A . 12 ASP HA 1 1 7 3338 1 1 12 ASP HB2 H -7.848 7.295 8.267 1.00 . A A . 12 ASP HB2 1 1 7 3339 1 1 12 ASP HB3 H -9.369 7.819 8.981 1.00 . A A . 12 ASP HB3 1 1 7 3340 1 1 12 ASP N N -9.049 6.139 6.086 1.00 . A A . 12 ASP N 1 1 7 3341 1 1 12 ASP O O -8.396 8.619 5.259 1.00 . A A . 12 ASP O 1 1 7 3342 1 1 12 ASP OD1 O -8.314 5.471 9.944 1.00 . A A . 12 ASP OD1 1 1 7 3343 1 1 12 ASP OD2 O -9.976 4.912 8.625 1.00 . A A . 12 ASP OD2 1 1 7 3344 1 1 13 SER C C -7.218 11.092 6.190 1.00 . A A . 13 SER C 1 1 7 3345 1 1 13 SER CA C -8.685 11.046 6.645 1.00 . A A . 13 SER CA 1 1 7 3346 1 1 13 SER CB C -8.859 12.032 7.806 1.00 . A A . 13 SER CB 1 1 7 3347 1 1 13 SER H H -9.662 9.641 7.942 1.00 . A A . 13 SER H 1 1 7 3348 1 1 13 SER HA H -9.298 11.392 5.812 1.00 . A A . 13 SER HA 1 1 7 3349 1 1 13 SER HB2 H -9.909 12.102 8.074 1.00 . A A . 13 SER HB2 1 1 7 3350 1 1 13 SER HB3 H -8.305 11.670 8.672 1.00 . A A . 13 SER HB3 1 1 7 3351 1 1 13 SER HG H -8.989 13.961 7.904 1.00 . A A . 13 SER HG 1 1 7 3352 1 1 13 SER N N -9.159 9.708 7.062 1.00 . A A . 13 SER N 1 1 7 3353 1 1 13 SER O O -6.902 11.725 5.183 1.00 . A A . 13 SER O 1 1 7 3354 1 1 13 SER OG O -8.391 13.321 7.469 1.00 . A A . 13 SER OG 1 1 7 3355 1 1 14 GLU C C -4.364 9.351 5.692 1.00 . A A . 14 GLU C 1 1 7 3356 1 1 14 GLU CA C -4.875 10.440 6.645 1.00 . A A . 14 GLU CA 1 1 7 3357 1 1 14 GLU CB C -4.106 10.368 7.977 1.00 . A A . 14 GLU CB 1 1 7 3358 1 1 14 GLU CD C -4.164 12.897 8.404 1.00 . A A . 14 GLU CD 1 1 7 3359 1 1 14 GLU CG C -4.442 11.499 8.954 1.00 . A A . 14 GLU CG 1 1 7 3360 1 1 14 GLU H H -6.649 9.882 7.701 1.00 . A A . 14 GLU H 1 1 7 3361 1 1 14 GLU HA H -4.636 11.385 6.162 1.00 . A A . 14 GLU HA 1 1 7 3362 1 1 14 GLU HB2 H -4.336 9.425 8.466 1.00 . A A . 14 GLU HB2 1 1 7 3363 1 1 14 GLU HB3 H -3.034 10.388 7.780 1.00 . A A . 14 GLU HB3 1 1 7 3364 1 1 14 GLU HG2 H -5.489 11.415 9.253 1.00 . A A . 14 GLU HG2 1 1 7 3365 1 1 14 GLU HG3 H -3.830 11.367 9.844 1.00 . A A . 14 GLU HG3 1 1 7 3366 1 1 14 GLU N N -6.321 10.402 6.902 1.00 . A A . 14 GLU N 1 1 7 3367 1 1 14 GLU O O -3.177 9.351 5.358 1.00 . A A . 14 GLU O 1 1 7 3368 1 1 14 GLU OE1 O -3.269 13.066 7.541 1.00 . A A . 14 GLU OE1 1 1 7 3369 1 1 14 GLU OE2 O -4.810 13.856 8.893 1.00 . A A . 14 GLU OE2 1 1 7 3370 1 1 15 ARG C C -4.809 7.623 2.937 1.00 . A A . 15 ARG C 1 1 7 3371 1 1 15 ARG CA C -4.740 7.275 4.421 1.00 . A A . 15 ARG CA 1 1 7 3372 1 1 15 ARG CB C -5.416 5.939 4.792 1.00 . A A . 15 ARG CB 1 1 7 3373 1 1 15 ARG CD C -3.493 4.336 4.700 1.00 . A A . 15 ARG CD 1 1 7 3374 1 1 15 ARG CG C -4.476 5.063 5.646 1.00 . A A . 15 ARG CG 1 1 7 3375 1 1 15 ARG CZ C -2.501 2.671 6.264 1.00 . A A . 15 ARG CZ 1 1 7 3376 1 1 15 ARG H H -6.183 8.473 5.491 1.00 . A A . 15 ARG H 1 1 7 3377 1 1 15 ARG HA H -3.674 7.156 4.614 1.00 . A A . 15 ARG HA 1 1 7 3378 1 1 15 ARG HB2 H -6.320 6.146 5.365 1.00 . A A . 15 ARG HB2 1 1 7 3379 1 1 15 ARG HB3 H -5.711 5.394 3.894 1.00 . A A . 15 ARG HB3 1 1 7 3380 1 1 15 ARG HD2 H -4.017 3.546 4.176 1.00 . A A . 15 ARG HD2 1 1 7 3381 1 1 15 ARG HD3 H -3.038 5.043 4.022 1.00 . A A . 15 ARG HD3 1 1 7 3382 1 1 15 ARG HE H -1.560 4.286 5.650 1.00 . A A . 15 ARG HE 1 1 7 3383 1 1 15 ARG HG2 H -3.943 5.685 6.367 1.00 . A A . 15 ARG HG2 1 1 7 3384 1 1 15 ARG HG3 H -5.050 4.319 6.190 1.00 . A A . 15 ARG HG3 1 1 7 3385 1 1 15 ARG HH11 H -4.327 2.074 5.703 1.00 . A A . 15 ARG HH11 1 1 7 3386 1 1 15 ARG HH12 H -3.518 1.009 6.817 1.00 . A A . 15 ARG HH12 1 1 7 3387 1 1 15 ARG HH21 H -0.709 3.012 7.036 1.00 . A A . 15 ARG HH21 1 1 7 3388 1 1 15 ARG HH22 H -1.577 1.600 7.667 1.00 . A A . 15 ARG HH22 1 1 7 3389 1 1 15 ARG N N -5.193 8.379 5.285 1.00 . A A . 15 ARG N 1 1 7 3390 1 1 15 ARG NE N -2.433 3.778 5.549 1.00 . A A . 15 ARG NE 1 1 7 3391 1 1 15 ARG NH1 N -3.512 1.858 6.259 1.00 . A A . 15 ARG NH1 1 1 7 3392 1 1 15 ARG NH2 N -1.503 2.378 7.028 1.00 . A A . 15 ARG NH2 1 1 7 3393 1 1 15 ARG O O -5.614 8.437 2.490 1.00 . A A . 15 ARG O 1 1 7 3394 1 1 16 LYS C C -4.364 6.155 -0.053 1.00 . A A . 16 LYS C 1 1 7 3395 1 1 16 LYS CA C -3.671 7.247 0.745 1.00 . A A . 16 LYS CA 1 1 7 3396 1 1 16 LYS CB C -2.158 7.300 0.482 1.00 . A A . 16 LYS CB 1 1 7 3397 1 1 16 LYS CD C -0.002 8.480 1.092 1.00 . A A . 16 LYS CD 1 1 7 3398 1 1 16 LYS CE C 0.630 9.781 1.591 1.00 . A A . 16 LYS CE 1 1 7 3399 1 1 16 LYS CG C -1.526 8.508 1.189 1.00 . A A . 16 LYS CG 1 1 7 3400 1 1 16 LYS H H -3.265 6.380 2.634 1.00 . A A . 16 LYS H 1 1 7 3401 1 1 16 LYS HA H -4.103 8.198 0.439 1.00 . A A . 16 LYS HA 1 1 7 3402 1 1 16 LYS HB2 H -1.690 6.381 0.833 1.00 . A A . 16 LYS HB2 1 1 7 3403 1 1 16 LYS HB3 H -1.977 7.377 -0.589 1.00 . A A . 16 LYS HB3 1 1 7 3404 1 1 16 LYS HD2 H 0.390 7.637 1.663 1.00 . A A . 16 LYS HD2 1 1 7 3405 1 1 16 LYS HD3 H 0.278 8.354 0.046 1.00 . A A . 16 LYS HD3 1 1 7 3406 1 1 16 LYS HE2 H 1.708 9.702 1.458 1.00 . A A . 16 LYS HE2 1 1 7 3407 1 1 16 LYS HE3 H 0.284 10.606 0.963 1.00 . A A . 16 LYS HE3 1 1 7 3408 1 1 16 LYS HG2 H -1.904 9.418 0.728 1.00 . A A . 16 LYS HG2 1 1 7 3409 1 1 16 LYS HG3 H -1.800 8.514 2.243 1.00 . A A . 16 LYS HG3 1 1 7 3410 1 1 16 LYS HZ1 H 0.793 10.952 3.263 1.00 . A A . 16 LYS HZ1 1 1 7 3411 1 1 16 LYS HZ2 H 0.672 9.367 3.642 1.00 . A A . 16 LYS HZ2 1 1 7 3412 1 1 16 LYS HZ3 H -0.664 10.224 3.151 1.00 . A A . 16 LYS HZ3 1 1 7 3413 1 1 16 LYS N N -3.891 7.024 2.179 1.00 . A A . 16 LYS N 1 1 7 3414 1 1 16 LYS NZ N 0.333 10.079 3.010 1.00 . A A . 16 LYS NZ 1 1 7 3415 1 1 16 LYS O O -3.920 5.009 0.004 1.00 . A A . 16 LYS O 1 1 7 3416 1 1 17 CYS C C -5.727 4.859 -2.549 1.00 . A A . 17 CYS C 1 1 7 3417 1 1 17 CYS CA C -6.372 5.496 -1.306 1.00 . A A . 17 CYS CA 1 1 7 3418 1 1 17 CYS CB C -7.729 6.146 -1.609 1.00 . A A . 17 CYS CB 1 1 7 3419 1 1 17 CYS H H -5.767 7.457 -0.708 1.00 . A A . 17 CYS H 1 1 7 3420 1 1 17 CYS HA H -6.552 4.713 -0.571 1.00 . A A . 17 CYS HA 1 1 7 3421 1 1 17 CYS HB2 H -7.998 6.795 -0.774 1.00 . A A . 17 CYS HB2 1 1 7 3422 1 1 17 CYS HB3 H -7.620 6.783 -2.488 1.00 . A A . 17 CYS HB3 1 1 7 3423 1 1 17 CYS N N -5.482 6.482 -0.699 1.00 . A A . 17 CYS N 1 1 7 3424 1 1 17 CYS O O -5.867 5.371 -3.659 1.00 . A A . 17 CYS O 1 1 7 3425 1 1 17 CYS SG S -9.136 5.022 -1.884 1.00 . A A . 17 CYS SG 1 1 7 3426 1 1 18 CYS C C -4.514 3.041 -4.740 1.00 . A A . 18 CYS C 1 1 7 3427 1 1 18 CYS CA C -4.500 2.726 -3.236 1.00 . A A . 18 CYS CA 1 1 7 3428 1 1 18 CYS CB C -5.259 1.416 -2.993 1.00 . A A . 18 CYS CB 1 1 7 3429 1 1 18 CYS H H -4.951 3.501 -1.337 1.00 . A A . 18 CYS H 1 1 7 3430 1 1 18 CYS HA H -3.458 2.565 -2.958 1.00 . A A . 18 CYS HA 1 1 7 3431 1 1 18 CYS HB2 H -5.441 1.299 -1.929 1.00 . A A . 18 CYS HB2 1 1 7 3432 1 1 18 CYS HB3 H -6.233 1.452 -3.478 1.00 . A A . 18 CYS HB3 1 1 7 3433 1 1 18 CYS N N -5.029 3.743 -2.321 1.00 . A A . 18 CYS N 1 1 7 3434 1 1 18 CYS O O -3.461 3.130 -5.362 1.00 . A A . 18 CYS O 1 1 7 3435 1 1 18 CYS SG S -4.374 -0.048 -3.570 1.00 . A A . 18 CYS SG 1 1 7 3436 1 1 19 GLU C C -6.971 4.303 -7.107 1.00 . A A . 19 GLU C 1 1 7 3437 1 1 19 GLU CA C -5.944 3.207 -6.788 1.00 . A A . 19 GLU CA 1 1 7 3438 1 1 19 GLU CB C -6.277 1.822 -7.386 1.00 . A A . 19 GLU CB 1 1 7 3439 1 1 19 GLU CD C -5.140 -0.396 -8.087 1.00 . A A . 19 GLU CD 1 1 7 3440 1 1 19 GLU CG C -4.995 0.983 -7.446 1.00 . A A . 19 GLU CG 1 1 7 3441 1 1 19 GLU H H -6.513 3.047 -4.745 1.00 . A A . 19 GLU H 1 1 7 3442 1 1 19 GLU HA H -5.027 3.556 -7.263 1.00 . A A . 19 GLU HA 1 1 7 3443 1 1 19 GLU HB2 H -7.036 1.325 -6.779 1.00 . A A . 19 GLU HB2 1 1 7 3444 1 1 19 GLU HB3 H -6.650 1.936 -8.404 1.00 . A A . 19 GLU HB3 1 1 7 3445 1 1 19 GLU HG2 H -4.255 1.547 -8.011 1.00 . A A . 19 GLU HG2 1 1 7 3446 1 1 19 GLU HG3 H -4.609 0.838 -6.437 1.00 . A A . 19 GLU HG3 1 1 7 3447 1 1 19 GLU N N -5.704 3.094 -5.343 1.00 . A A . 19 GLU N 1 1 7 3448 1 1 19 GLU O O -7.764 4.194 -8.039 1.00 . A A . 19 GLU O 1 1 7 3449 1 1 19 GLU OE1 O -4.096 -0.899 -8.568 1.00 . A A . 19 GLU OE1 1 1 7 3450 1 1 19 GLU OE2 O -6.224 -1.017 -8.001 1.00 . A A . 19 GLU OE2 1 1 7 3451 1 1 20 GLY C C -9.361 6.213 -6.343 1.00 . A A . 20 GLY C 1 1 7 3452 1 1 20 GLY CA C -7.864 6.515 -6.484 1.00 . A A . 20 GLY CA 1 1 7 3453 1 1 20 GLY H H -6.341 5.387 -5.511 1.00 . A A . 20 GLY H 1 1 7 3454 1 1 20 GLY HA2 H -7.588 7.255 -5.739 1.00 . A A . 20 GLY HA2 1 1 7 3455 1 1 20 GLY HA3 H -7.681 6.936 -7.470 1.00 . A A . 20 GLY HA3 1 1 7 3456 1 1 20 GLY N N -6.995 5.360 -6.292 1.00 . A A . 20 GLY N 1 1 7 3457 1 1 20 GLY O O -10.173 6.853 -7.013 1.00 . A A . 20 GLY O 1 1 7 3458 1 1 21 MET C C -11.794 5.448 -4.223 1.00 . A A . 21 MET C 1 1 7 3459 1 1 21 MET CA C -11.095 4.705 -5.383 1.00 . A A . 21 MET CA 1 1 7 3460 1 1 21 MET CB C -11.082 3.176 -5.168 1.00 . A A . 21 MET CB 1 1 7 3461 1 1 21 MET CE C -10.058 1.746 -8.982 1.00 . A A . 21 MET CE 1 1 7 3462 1 1 21 MET CG C -10.389 2.397 -6.296 1.00 . A A . 21 MET CG 1 1 7 3463 1 1 21 MET H H -8.989 4.707 -5.066 1.00 . A A . 21 MET H 1 1 7 3464 1 1 21 MET HA H -11.671 4.907 -6.286 1.00 . A A . 21 MET HA 1 1 7 3465 1 1 21 MET HB2 H -10.583 2.951 -4.229 1.00 . A A . 21 MET HB2 1 1 7 3466 1 1 21 MET HB3 H -12.106 2.813 -5.095 1.00 . A A . 21 MET HB3 1 1 7 3467 1 1 21 MET HE1 H -9.286 2.508 -9.082 1.00 . A A . 21 MET HE1 1 1 7 3468 1 1 21 MET HE2 H -9.605 0.830 -8.607 1.00 . A A . 21 MET HE2 1 1 7 3469 1 1 21 MET HE3 H -10.495 1.562 -9.963 1.00 . A A . 21 MET HE3 1 1 7 3470 1 1 21 MET HG2 H -9.413 2.833 -6.500 1.00 . A A . 21 MET HG2 1 1 7 3471 1 1 21 MET HG3 H -10.216 1.378 -5.950 1.00 . A A . 21 MET HG3 1 1 7 3472 1 1 21 MET N N -9.718 5.177 -5.579 1.00 . A A . 21 MET N 1 1 7 3473 1 1 21 MET O O -11.274 6.430 -3.681 1.00 . A A . 21 MET O 1 1 7 3474 1 1 21 MET SD S -11.342 2.322 -7.839 1.00 . A A . 21 MET SD 1 1 7 3475 1 1 22 VAL C C -12.945 5.091 -1.389 1.00 . A A . 22 VAL C 1 1 7 3476 1 1 22 VAL CA C -13.733 5.443 -2.658 1.00 . A A . 22 VAL CA 1 1 7 3477 1 1 22 VAL CB C -15.131 4.796 -2.624 1.00 . A A . 22 VAL CB 1 1 7 3478 1 1 22 VAL CG1 C -15.873 5.056 -1.312 1.00 . A A . 22 VAL CG1 1 1 7 3479 1 1 22 VAL CG2 C -15.993 5.365 -3.756 1.00 . A A . 22 VAL CG2 1 1 7 3480 1 1 22 VAL H H -13.363 4.190 -4.343 1.00 . A A . 22 VAL H 1 1 7 3481 1 1 22 VAL HA H -13.864 6.521 -2.708 1.00 . A A . 22 VAL HA 1 1 7 3482 1 1 22 VAL HB H -15.041 3.717 -2.761 1.00 . A A . 22 VAL HB 1 1 7 3483 1 1 22 VAL HG11 H -16.885 4.656 -1.372 1.00 . A A . 22 VAL HG11 1 1 7 3484 1 1 22 VAL HG12 H -15.369 4.559 -0.482 1.00 . A A . 22 VAL HG12 1 1 7 3485 1 1 22 VAL HG13 H -15.922 6.129 -1.135 1.00 . A A . 22 VAL HG13 1 1 7 3486 1 1 22 VAL HG21 H -16.999 4.951 -3.711 1.00 . A A . 22 VAL HG21 1 1 7 3487 1 1 22 VAL HG22 H -16.057 6.451 -3.670 1.00 . A A . 22 VAL HG22 1 1 7 3488 1 1 22 VAL HG23 H -15.551 5.117 -4.717 1.00 . A A . 22 VAL HG23 1 1 7 3489 1 1 22 VAL N N -12.989 4.980 -3.842 1.00 . A A . 22 VAL N 1 1 7 3490 1 1 22 VAL O O -12.572 3.936 -1.210 1.00 . A A . 22 VAL O 1 1 7 3491 1 1 23 CYS C C -12.949 5.947 1.993 1.00 . A A . 23 CYS C 1 1 7 3492 1 1 23 CYS CA C -12.019 5.900 0.767 1.00 . A A . 23 CYS CA 1 1 7 3493 1 1 23 CYS CB C -10.915 6.964 0.786 1.00 . A A . 23 CYS CB 1 1 7 3494 1 1 23 CYS H H -13.056 6.995 -0.738 1.00 . A A . 23 CYS H 1 1 7 3495 1 1 23 CYS HA H -11.526 4.927 0.766 1.00 . A A . 23 CYS HA 1 1 7 3496 1 1 23 CYS HB2 H -10.399 6.943 -0.172 1.00 . A A . 23 CYS HB2 1 1 7 3497 1 1 23 CYS HB3 H -11.394 7.940 0.871 1.00 . A A . 23 CYS HB3 1 1 7 3498 1 1 23 CYS N N -12.776 6.055 -0.479 1.00 . A A . 23 CYS N 1 1 7 3499 1 1 23 CYS O O -13.149 6.999 2.606 1.00 . A A . 23 CYS O 1 1 7 3500 1 1 23 CYS SG S -9.660 6.836 2.093 1.00 . A A . 23 CYS SG 1 1 7 3501 1 1 24 ARG C C -14.098 3.279 4.151 1.00 . A A . 24 ARG C 1 1 7 3502 1 1 24 ARG CA C -14.437 4.610 3.494 1.00 . A A . 24 ARG CA 1 1 7 3503 1 1 24 ARG CB C -15.945 4.692 3.147 1.00 . A A . 24 ARG CB 1 1 7 3504 1 1 24 ARG CD C -16.463 6.596 1.581 1.00 . A A . 24 ARG CD 1 1 7 3505 1 1 24 ARG CG C -16.517 6.120 3.046 1.00 . A A . 24 ARG CG 1 1 7 3506 1 1 24 ARG CZ C -17.269 8.787 0.675 1.00 . A A . 24 ARG CZ 1 1 7 3507 1 1 24 ARG H H -13.381 3.995 1.735 1.00 . A A . 24 ARG H 1 1 7 3508 1 1 24 ARG HA H -14.218 5.373 4.238 1.00 . A A . 24 ARG HA 1 1 7 3509 1 1 24 ARG HB2 H -16.159 4.122 2.240 1.00 . A A . 24 ARG HB2 1 1 7 3510 1 1 24 ARG HB3 H -16.487 4.205 3.959 1.00 . A A . 24 ARG HB3 1 1 7 3511 1 1 24 ARG HD2 H -15.477 6.458 1.185 1.00 . A A . 24 ARG HD2 1 1 7 3512 1 1 24 ARG HD3 H -17.188 6.060 0.998 1.00 . A A . 24 ARG HD3 1 1 7 3513 1 1 24 ARG HE H -16.490 8.537 2.464 1.00 . A A . 24 ARG HE 1 1 7 3514 1 1 24 ARG HG2 H -17.560 6.112 3.368 1.00 . A A . 24 ARG HG2 1 1 7 3515 1 1 24 ARG HG3 H -15.957 6.790 3.698 1.00 . A A . 24 ARG HG3 1 1 7 3516 1 1 24 ARG HH11 H -17.779 7.389 -0.688 1.00 . A A . 24 ARG HH11 1 1 7 3517 1 1 24 ARG HH12 H -18.220 9.013 -1.067 1.00 . A A . 24 ARG HH12 1 1 7 3518 1 1 24 ARG HH21 H -17.081 10.379 1.835 1.00 . A A . 24 ARG HH21 1 1 7 3519 1 1 24 ARG HH22 H -17.594 10.712 0.178 1.00 . A A . 24 ARG HH22 1 1 7 3520 1 1 24 ARG N N -13.582 4.810 2.308 1.00 . A A . 24 ARG N 1 1 7 3521 1 1 24 ARG NE N -16.769 8.025 1.632 1.00 . A A . 24 ARG NE 1 1 7 3522 1 1 24 ARG NH1 N -17.687 8.375 -0.486 1.00 . A A . 24 ARG NH1 1 1 7 3523 1 1 24 ARG NH2 N -17.348 10.057 0.910 1.00 . A A . 24 ARG NH2 1 1 7 3524 1 1 24 ARG O O -14.418 2.244 3.583 1.00 . A A . 24 ARG O 1 1 7 3525 1 1 25 LEU C C -11.697 1.391 5.128 1.00 . A A . 25 LEU C 1 1 7 3526 1 1 25 LEU CA C -12.757 2.142 5.961 1.00 . A A . 25 LEU CA 1 1 7 3527 1 1 25 LEU CB C -13.818 1.149 6.493 1.00 . A A . 25 LEU CB 1 1 7 3528 1 1 25 LEU CD1 C -15.947 2.472 7.076 1.00 . A A . 25 LEU CD1 1 1 7 3529 1 1 25 LEU CD2 C -15.328 0.501 8.392 1.00 . A A . 25 LEU CD2 1 1 7 3530 1 1 25 LEU CG C -14.750 1.674 7.600 1.00 . A A . 25 LEU CG 1 1 7 3531 1 1 25 LEU H H -13.146 4.214 5.647 1.00 . A A . 25 LEU H 1 1 7 3532 1 1 25 LEU HA H -12.219 2.533 6.826 1.00 . A A . 25 LEU HA 1 1 7 3533 1 1 25 LEU HB2 H -14.420 0.764 5.671 1.00 . A A . 25 LEU HB2 1 1 7 3534 1 1 25 LEU HB3 H -13.266 0.303 6.904 1.00 . A A . 25 LEU HB3 1 1 7 3535 1 1 25 LEU HD11 H -16.516 2.867 7.915 1.00 . A A . 25 LEU HD11 1 1 7 3536 1 1 25 LEU HD12 H -16.564 1.852 6.424 1.00 . A A . 25 LEU HD12 1 1 7 3537 1 1 25 LEU HD13 H -15.607 3.331 6.509 1.00 . A A . 25 LEU HD13 1 1 7 3538 1 1 25 LEU HD21 H -15.922 0.877 9.224 1.00 . A A . 25 LEU HD21 1 1 7 3539 1 1 25 LEU HD22 H -14.516 -0.096 8.806 1.00 . A A . 25 LEU HD22 1 1 7 3540 1 1 25 LEU HD23 H -15.938 -0.131 7.745 1.00 . A A . 25 LEU HD23 1 1 7 3541 1 1 25 LEU HG H -14.174 2.292 8.285 1.00 . A A . 25 LEU HG 1 1 7 3542 1 1 25 LEU N N -13.375 3.299 5.278 1.00 . A A . 25 LEU N 1 1 7 3543 1 1 25 LEU O O -10.749 0.836 5.673 1.00 . A A . 25 LEU O 1 1 7 3544 1 1 26 TRP C C -10.942 1.463 1.496 1.00 . A A . 26 TRP C 1 1 7 3545 1 1 26 TRP CA C -10.915 0.737 2.848 1.00 . A A . 26 TRP CA 1 1 7 3546 1 1 26 TRP CB C -11.305 -0.751 2.739 1.00 . A A . 26 TRP CB 1 1 7 3547 1 1 26 TRP CD1 C -13.030 -1.709 4.339 1.00 . A A . 26 TRP CD1 1 1 7 3548 1 1 26 TRP CD2 C -13.974 -0.757 2.545 1.00 . A A . 26 TRP CD2 1 1 7 3549 1 1 26 TRP CE2 C -15.034 -1.221 3.381 1.00 . A A . 26 TRP CE2 1 1 7 3550 1 1 26 TRP CE3 C -14.347 -0.023 1.398 1.00 . A A . 26 TRP CE3 1 1 7 3551 1 1 26 TRP CG C -12.698 -1.142 3.153 1.00 . A A . 26 TRP CG 1 1 7 3552 1 1 26 TRP CH2 C -16.717 -0.351 1.880 1.00 . A A . 26 TRP CH2 1 1 7 3553 1 1 26 TRP CZ2 C -16.386 -1.026 3.065 1.00 . A A . 26 TRP CZ2 1 1 7 3554 1 1 26 TRP CZ3 C -15.699 0.166 1.060 1.00 . A A . 26 TRP CZ3 1 1 7 3555 1 1 26 TRP H H -12.632 1.812 3.419 1.00 . A A . 26 TRP H 1 1 7 3556 1 1 26 TRP HA H -9.889 0.784 3.214 1.00 . A A . 26 TRP HA 1 1 7 3557 1 1 26 TRP HB2 H -11.121 -1.120 1.731 1.00 . A A . 26 TRP HB2 1 1 7 3558 1 1 26 TRP HB3 H -10.625 -1.284 3.400 1.00 . A A . 26 TRP HB3 1 1 7 3559 1 1 26 TRP HD1 H -12.325 -2.013 5.103 1.00 . A A . 26 TRP HD1 1 1 7 3560 1 1 26 TRP HE1 H -14.878 -2.232 5.246 1.00 . A A . 26 TRP HE1 1 1 7 3561 1 1 26 TRP HE3 H -13.584 0.435 0.791 1.00 . A A . 26 TRP HE3 1 1 7 3562 1 1 26 TRP HH2 H -17.753 -0.191 1.618 1.00 . A A . 26 TRP HH2 1 1 7 3563 1 1 26 TRP HZ2 H -17.160 -1.375 3.733 1.00 . A A . 26 TRP HZ2 1 1 7 3564 1 1 26 TRP HZ3 H -15.960 0.753 0.192 1.00 . A A . 26 TRP HZ3 1 1 7 3565 1 1 26 TRP N N -11.783 1.412 3.806 1.00 . A A . 26 TRP N 1 1 7 3566 1 1 26 TRP NE1 N -14.401 -1.822 4.442 1.00 . A A . 26 TRP NE1 1 1 7 3567 1 1 26 TRP O O -11.750 2.367 1.306 1.00 . A A . 26 TRP O 1 1 7 3568 1 1 27 CYS C C -10.561 0.684 -1.854 1.00 . A A . 27 CYS C 1 1 7 3569 1 1 27 CYS CA C -10.004 1.654 -0.790 1.00 . A A . 27 CYS CA 1 1 7 3570 1 1 27 CYS CB C -8.576 2.159 -1.058 1.00 . A A . 27 CYS CB 1 1 7 3571 1 1 27 CYS H H -9.430 0.329 0.774 1.00 . A A . 27 CYS H 1 1 7 3572 1 1 27 CYS HA H -10.644 2.534 -0.822 1.00 . A A . 27 CYS HA 1 1 7 3573 1 1 27 CYS HB2 H -8.236 2.730 -0.195 1.00 . A A . 27 CYS HB2 1 1 7 3574 1 1 27 CYS HB3 H -7.916 1.301 -1.182 1.00 . A A . 27 CYS HB3 1 1 7 3575 1 1 27 CYS N N -10.076 1.070 0.556 1.00 . A A . 27 CYS N 1 1 7 3576 1 1 27 CYS O O -9.897 0.403 -2.852 1.00 . A A . 27 CYS O 1 1 7 3577 1 1 27 CYS SG S -8.415 3.224 -2.517 1.00 . A A . 27 CYS SG 1 1 7 3578 1 1 28 LYS C C -12.615 -0.427 -3.831 1.00 . A A . 28 LYS C 1 1 7 3579 1 1 28 LYS CA C -12.307 -0.994 -2.441 1.00 . A A . 28 LYS CA 1 1 7 3580 1 1 28 LYS CB C -13.587 -1.587 -1.818 1.00 . A A . 28 LYS CB 1 1 7 3581 1 1 28 LYS CD C -12.710 -3.815 -0.748 1.00 . A A . 28 LYS CD 1 1 7 3582 1 1 28 LYS CE C -13.644 -4.913 -1.283 1.00 . A A . 28 LYS CE 1 1 7 3583 1 1 28 LYS CG C -13.363 -2.437 -0.555 1.00 . A A . 28 LYS CG 1 1 7 3584 1 1 28 LYS H H -12.235 0.368 -0.776 1.00 . A A . 28 LYS H 1 1 7 3585 1 1 28 LYS HA H -11.577 -1.790 -2.580 1.00 . A A . 28 LYS HA 1 1 7 3586 1 1 28 LYS HB2 H -14.255 -0.763 -1.562 1.00 . A A . 28 LYS HB2 1 1 7 3587 1 1 28 LYS HB3 H -14.104 -2.193 -2.560 1.00 . A A . 28 LYS HB3 1 1 7 3588 1 1 28 LYS HD2 H -11.828 -3.730 -1.376 1.00 . A A . 28 LYS HD2 1 1 7 3589 1 1 28 LYS HD3 H -12.370 -4.138 0.236 1.00 . A A . 28 LYS HD3 1 1 7 3590 1 1 28 LYS HE2 H -13.240 -5.881 -0.975 1.00 . A A . 28 LYS HE2 1 1 7 3591 1 1 28 LYS HE3 H -14.629 -4.813 -0.816 1.00 . A A . 28 LYS HE3 1 1 7 3592 1 1 28 LYS HG2 H -12.732 -1.870 0.126 1.00 . A A . 28 LYS HG2 1 1 7 3593 1 1 28 LYS HG3 H -14.325 -2.585 -0.063 1.00 . A A . 28 LYS HG3 1 1 7 3594 1 1 28 LYS HZ1 H -14.293 -4.115 -3.124 1.00 . A A . 28 LYS HZ1 1 1 7 3595 1 1 28 LYS HZ2 H -14.322 -5.717 -3.075 1.00 . A A . 28 LYS HZ2 1 1 7 3596 1 1 28 LYS HZ3 H -12.888 -4.905 -3.240 1.00 . A A . 28 LYS HZ3 1 1 7 3597 1 1 28 LYS N N -11.705 0.038 -1.570 1.00 . A A . 28 LYS N 1 1 7 3598 1 1 28 LYS NZ N -13.781 -4.913 -2.758 1.00 . A A . 28 LYS NZ 1 1 7 3599 1 1 28 LYS O O -13.107 0.695 -3.943 1.00 . A A . 28 LYS O 1 1 7 3600 1 1 29 LYS C C -14.036 -0.410 -6.546 1.00 . A A . 29 LYS C 1 1 7 3601 1 1 29 LYS CA C -12.568 -0.777 -6.283 1.00 . A A . 29 LYS CA 1 1 7 3602 1 1 29 LYS CB C -12.001 -1.813 -7.275 1.00 . A A . 29 LYS CB 1 1 7 3603 1 1 29 LYS CD C -9.826 -3.004 -8.043 1.00 . A A . 29 LYS CD 1 1 7 3604 1 1 29 LYS CE C -9.791 -2.594 -9.522 1.00 . A A . 29 LYS CE 1 1 7 3605 1 1 29 LYS CG C -10.473 -1.959 -7.120 1.00 . A A . 29 LYS CG 1 1 7 3606 1 1 29 LYS H H -12.041 -2.153 -4.709 1.00 . A A . 29 LYS H 1 1 7 3607 1 1 29 LYS HA H -11.995 0.136 -6.410 1.00 . A A . 29 LYS HA 1 1 7 3608 1 1 29 LYS HB2 H -12.481 -2.778 -7.102 1.00 . A A . 29 LYS HB2 1 1 7 3609 1 1 29 LYS HB3 H -12.226 -1.492 -8.294 1.00 . A A . 29 LYS HB3 1 1 7 3610 1 1 29 LYS HD2 H -8.798 -3.153 -7.711 1.00 . A A . 29 LYS HD2 1 1 7 3611 1 1 29 LYS HD3 H -10.357 -3.949 -7.932 1.00 . A A . 29 LYS HD3 1 1 7 3612 1 1 29 LYS HE2 H -10.813 -2.529 -9.906 1.00 . A A . 29 LYS HE2 1 1 7 3613 1 1 29 LYS HE3 H -9.326 -1.608 -9.602 1.00 . A A . 29 LYS HE3 1 1 7 3614 1 1 29 LYS HG2 H -9.996 -0.994 -7.289 1.00 . A A . 29 LYS HG2 1 1 7 3615 1 1 29 LYS HG3 H -10.255 -2.260 -6.096 1.00 . A A . 29 LYS HG3 1 1 7 3616 1 1 29 LYS HZ1 H -8.917 -3.252 -11.298 1.00 . A A . 29 LYS HZ1 1 1 7 3617 1 1 29 LYS HZ2 H -9.455 -4.489 -10.344 1.00 . A A . 29 LYS HZ2 1 1 7 3618 1 1 29 LYS HZ3 H -8.077 -3.673 -9.986 1.00 . A A . 29 LYS HZ3 1 1 7 3619 1 1 29 LYS N N -12.369 -1.211 -4.887 1.00 . A A . 29 LYS N 1 1 7 3620 1 1 29 LYS NZ N -9.017 -3.566 -10.332 1.00 . A A . 29 LYS NZ 1 1 7 3621 1 1 29 LYS O O -14.938 -1.130 -6.118 1.00 . A A . 29 LYS O 1 1 7 3622 1 1 30 LYS C C -15.838 2.268 -8.427 1.00 . A A . 30 LYS C 1 1 7 3623 1 1 30 LYS CA C -15.624 1.370 -7.197 1.00 . A A . 30 LYS CA 1 1 7 3624 1 1 30 LYS CB C -15.853 2.125 -5.862 1.00 . A A . 30 LYS CB 1 1 7 3625 1 1 30 LYS CD C -17.741 0.791 -4.776 1.00 . A A . 30 LYS CD 1 1 7 3626 1 1 30 LYS CE C -17.282 0.698 -3.313 1.00 . A A . 30 LYS CE 1 1 7 3627 1 1 30 LYS CG C -17.328 2.126 -5.424 1.00 . A A . 30 LYS CG 1 1 7 3628 1 1 30 LYS H H -13.486 1.321 -7.412 1.00 . A A . 30 LYS H 1 1 7 3629 1 1 30 LYS HA H -16.361 0.570 -7.284 1.00 . A A . 30 LYS HA 1 1 7 3630 1 1 30 LYS HB2 H -15.263 1.673 -5.065 1.00 . A A . 30 LYS HB2 1 1 7 3631 1 1 30 LYS HB3 H -15.501 3.151 -5.964 1.00 . A A . 30 LYS HB3 1 1 7 3632 1 1 30 LYS HD2 H -18.827 0.689 -4.821 1.00 . A A . 30 LYS HD2 1 1 7 3633 1 1 30 LYS HD3 H -17.312 -0.040 -5.338 1.00 . A A . 30 LYS HD3 1 1 7 3634 1 1 30 LYS HE2 H -17.230 -0.357 -3.026 1.00 . A A . 30 LYS HE2 1 1 7 3635 1 1 30 LYS HE3 H -16.278 1.122 -3.224 1.00 . A A . 30 LYS HE3 1 1 7 3636 1 1 30 LYS HG2 H -17.492 2.932 -4.711 1.00 . A A . 30 LYS HG2 1 1 7 3637 1 1 30 LYS HG3 H -17.958 2.325 -6.289 1.00 . A A . 30 LYS HG3 1 1 7 3638 1 1 30 LYS HZ1 H -17.886 1.544 -1.470 1.00 . A A . 30 LYS HZ1 1 1 7 3639 1 1 30 LYS HZ2 H -19.102 0.880 -2.337 1.00 . A A . 30 LYS HZ2 1 1 7 3640 1 1 30 LYS HZ3 H -18.494 2.317 -2.761 1.00 . A A . 30 LYS HZ3 1 1 7 3641 1 1 30 LYS N N -14.283 0.753 -7.159 1.00 . A A . 30 LYS N 1 1 7 3642 1 1 30 LYS NZ N -18.231 1.401 -2.419 1.00 . A A . 30 LYS NZ 1 1 7 3643 1 1 30 LYS O O -16.470 3.315 -8.329 1.00 . A A . 30 LYS O 1 1 7 3644 1 1 31 LEU C C -15.176 2.302 -12.033 1.00 . A A . 31 LEU C 1 1 7 3645 1 1 31 LEU CA C -14.926 2.883 -10.635 1.00 . A A . 31 LEU CA 1 1 7 3646 1 1 31 LEU CB C -13.471 3.340 -10.428 1.00 . A A . 31 LEU CB 1 1 7 3647 1 1 31 LEU CD1 C -13.739 5.724 -11.249 1.00 . A A . 31 LEU CD1 1 1 7 3648 1 1 31 LEU CD2 C -11.480 4.728 -10.928 1.00 . A A . 31 LEU CD2 1 1 7 3649 1 1 31 LEU CG C -12.922 4.436 -11.354 1.00 . A A . 31 LEU CG 1 1 7 3650 1 1 31 LEU H H -14.764 1.030 -9.607 1.00 . A A . 31 LEU H 1 1 7 3651 1 1 31 LEU HA H -15.574 3.755 -10.530 1.00 . A A . 31 LEU HA 1 1 7 3652 1 1 31 LEU HB2 H -13.383 3.701 -9.402 1.00 . A A . 31 LEU HB2 1 1 7 3653 1 1 31 LEU HB3 H -12.828 2.465 -10.531 1.00 . A A . 31 LEU HB3 1 1 7 3654 1 1 31 LEU HD11 H -14.679 5.601 -11.779 1.00 . A A . 31 LEU HD11 1 1 7 3655 1 1 31 LEU HD12 H -13.203 6.544 -11.721 1.00 . A A . 31 LEU HD12 1 1 7 3656 1 1 31 LEU HD13 H -13.953 5.966 -10.209 1.00 . A A . 31 LEU HD13 1 1 7 3657 1 1 31 LEU HD21 H -11.078 5.566 -11.499 1.00 . A A . 31 LEU HD21 1 1 7 3658 1 1 31 LEU HD22 H -10.864 3.854 -11.129 1.00 . A A . 31 LEU HD22 1 1 7 3659 1 1 31 LEU HD23 H -11.418 4.925 -9.861 1.00 . A A . 31 LEU HD23 1 1 7 3660 1 1 31 LEU HG H -12.920 4.093 -12.389 1.00 . A A . 31 LEU HG 1 1 7 3661 1 1 31 LEU N N -15.212 1.933 -9.557 1.00 . A A . 31 LEU N 1 1 7 3662 1 1 31 LEU O O -14.956 1.119 -12.278 1.00 . A A . 31 LEU O 1 1 7 3663 1 1 32 LEU C C -14.451 3.726 -14.988 1.00 . A A . 32 LEU C 1 1 7 3664 1 1 32 LEU CA C -15.570 2.864 -14.402 1.00 . A A . 32 LEU CA 1 1 7 3665 1 1 32 LEU CB C -16.921 3.303 -15.021 1.00 . A A . 32 LEU CB 1 1 7 3666 1 1 32 LEU CD1 C -19.402 3.010 -14.884 1.00 . A A . 32 LEU CD1 1 1 7 3667 1 1 32 LEU CD2 C -17.995 1.012 -15.346 1.00 . A A . 32 LEU CD2 1 1 7 3668 1 1 32 LEU CG C -18.051 2.345 -14.591 1.00 . A A . 32 LEU CG 1 1 7 3669 1 1 32 LEU H H -15.918 4.070 -12.655 1.00 . A A . 32 LEU H 1 1 7 3670 1 1 32 LEU HA H -15.361 1.825 -14.620 1.00 . A A . 32 LEU HA 1 1 7 3671 1 1 32 LEU HB2 H -17.160 4.311 -14.688 1.00 . A A . 32 LEU HB2 1 1 7 3672 1 1 32 LEU HB3 H -16.841 3.310 -16.110 1.00 . A A . 32 LEU HB3 1 1 7 3673 1 1 32 LEU HD11 H -19.499 3.924 -14.296 1.00 . A A . 32 LEU HD11 1 1 7 3674 1 1 32 LEU HD12 H -20.214 2.337 -14.612 1.00 . A A . 32 LEU HD12 1 1 7 3675 1 1 32 LEU HD13 H -19.481 3.258 -15.943 1.00 . A A . 32 LEU HD13 1 1 7 3676 1 1 32 LEU HD21 H -18.096 1.177 -16.420 1.00 . A A . 32 LEU HD21 1 1 7 3677 1 1 32 LEU HD22 H -18.808 0.368 -15.007 1.00 . A A . 32 LEU HD22 1 1 7 3678 1 1 32 LEU HD23 H -17.052 0.502 -15.161 1.00 . A A . 32 LEU HD23 1 1 7 3679 1 1 32 LEU HG H -17.992 2.151 -13.518 1.00 . A A . 32 LEU HG 1 1 7 3680 1 1 32 LEU N N -15.625 3.144 -12.954 1.00 . A A . 32 LEU N 1 1 7 3681 1 1 32 LEU O O -14.536 4.933 -15.062 1.00 . A A . 32 LEU O 1 1 7 3682 1 1 32 LEU OXT O -13.547 3.243 -15.264 1.00 . A A . 32 LEU OXT 1 1 8 3683 1 1 1 GLY C C 2.042 -6.975 -2.669 1.00 . A A . 1 GLY C 1 1 8 3684 1 1 1 GLY CA C 3.544 -6.833 -2.662 1.00 . A A . 1 GLY CA 1 1 8 3685 1 1 1 GLY H1 H 3.973 -8.812 -2.925 1.00 . A A . 1 GLY H1 1 1 8 3686 1 1 1 GLY H2 H 3.838 -7.974 -4.340 1.00 . A A . 1 GLY H2 1 1 8 3687 1 1 1 GLY H3 H 5.181 -7.790 -3.393 1.00 . A A . 1 GLY H3 1 1 8 3688 1 1 1 GLY HA2 H 3.919 -6.819 -1.641 1.00 . A A . 1 GLY HA2 1 1 8 3689 1 1 1 GLY HA3 H 3.798 -5.892 -3.147 1.00 . A A . 1 GLY HA3 1 1 8 3690 1 1 1 GLY N N 4.181 -7.935 -3.388 1.00 . A A . 1 GLY N 1 1 8 3691 1 1 1 GLY O O 1.471 -7.019 -3.754 1.00 . A A . 1 GLY O 1 1 8 3692 1 1 2 PRO C C -0.394 -5.271 -1.680 1.00 . A A . 2 PRO C 1 1 8 3693 1 1 2 PRO CA C -0.044 -6.741 -1.381 1.00 . A A . 2 PRO CA 1 1 8 3694 1 1 2 PRO CB C -0.389 -7.157 0.053 1.00 . A A . 2 PRO CB 1 1 8 3695 1 1 2 PRO CD C 1.989 -7.041 -0.164 1.00 . A A . 2 PRO CD 1 1 8 3696 1 1 2 PRO CG C 0.863 -6.759 0.830 1.00 . A A . 2 PRO CG 1 1 8 3697 1 1 2 PRO HA H -0.584 -7.377 -2.084 1.00 . A A . 2 PRO HA 1 1 8 3698 1 1 2 PRO HB2 H -1.279 -6.663 0.443 1.00 . A A . 2 PRO HB2 1 1 8 3699 1 1 2 PRO HB3 H -0.514 -8.239 0.088 1.00 . A A . 2 PRO HB3 1 1 8 3700 1 1 2 PRO HD2 H 2.781 -6.303 -0.041 1.00 . A A . 2 PRO HD2 1 1 8 3701 1 1 2 PRO HD3 H 2.377 -8.047 0.001 1.00 . A A . 2 PRO HD3 1 1 8 3702 1 1 2 PRO HG2 H 0.826 -5.693 1.053 1.00 . A A . 2 PRO HG2 1 1 8 3703 1 1 2 PRO HG3 H 0.976 -7.340 1.746 1.00 . A A . 2 PRO HG3 1 1 8 3704 1 1 2 PRO N N 1.391 -6.966 -1.492 1.00 . A A . 2 PRO N 1 1 8 3705 1 1 2 PRO O O 0.475 -4.429 -1.942 1.00 . A A . 2 PRO O 1 1 8 3706 1 1 3 TYR C C -3.265 -3.229 -1.123 1.00 . A A . 3 TYR C 1 1 8 3707 1 1 3 TYR CA C -2.231 -3.708 -2.148 1.00 . A A . 3 TYR CA 1 1 8 3708 1 1 3 TYR CB C -2.922 -4.001 -3.501 1.00 . A A . 3 TYR CB 1 1 8 3709 1 1 3 TYR CD1 C -2.781 -6.492 -3.960 1.00 . A A . 3 TYR CD1 1 1 8 3710 1 1 3 TYR CD2 C -1.458 -4.976 -5.338 1.00 . A A . 3 TYR CD2 1 1 8 3711 1 1 3 TYR CE1 C -2.246 -7.597 -4.646 1.00 . A A . 3 TYR CE1 1 1 8 3712 1 1 3 TYR CE2 C -0.933 -6.081 -6.036 1.00 . A A . 3 TYR CE2 1 1 8 3713 1 1 3 TYR CG C -2.380 -5.181 -4.294 1.00 . A A . 3 TYR CG 1 1 8 3714 1 1 3 TYR CZ C -1.318 -7.392 -5.685 1.00 . A A . 3 TYR CZ 1 1 8 3715 1 1 3 TYR H H -2.342 -5.648 -1.311 1.00 . A A . 3 TYR H 1 1 8 3716 1 1 3 TYR HA H -1.447 -2.960 -2.286 1.00 . A A . 3 TYR HA 1 1 8 3717 1 1 3 TYR HB2 H -3.980 -4.185 -3.332 1.00 . A A . 3 TYR HB2 1 1 8 3718 1 1 3 TYR HB3 H -2.865 -3.103 -4.116 1.00 . A A . 3 TYR HB3 1 1 8 3719 1 1 3 TYR HD1 H -3.477 -6.657 -3.154 1.00 . A A . 3 TYR HD1 1 1 8 3720 1 1 3 TYR HD2 H -1.139 -3.976 -5.595 1.00 . A A . 3 TYR HD2 1 1 8 3721 1 1 3 TYR HE1 H -2.536 -8.603 -4.387 1.00 . A A . 3 TYR HE1 1 1 8 3722 1 1 3 TYR HE2 H -0.214 -5.935 -6.825 1.00 . A A . 3 TYR HE2 1 1 8 3723 1 1 3 TYR HH H -0.635 -8.198 -7.289 1.00 . A A . 3 TYR HH 1 1 8 3724 1 1 3 TYR N N -1.683 -4.943 -1.595 1.00 . A A . 3 TYR N 1 1 8 3725 1 1 3 TYR O O -4.191 -3.955 -0.761 1.00 . A A . 3 TYR O 1 1 8 3726 1 1 3 TYR OH O -0.823 -8.455 -6.369 1.00 . A A . 3 TYR OH 1 1 8 3727 1 1 4 CYS C C -5.605 -1.456 -0.292 1.00 . A A . 4 CYS C 1 1 8 3728 1 1 4 CYS CA C -4.115 -1.148 -0.008 1.00 . A A . 4 CYS CA 1 1 8 3729 1 1 4 CYS CB C -3.836 0.342 -0.314 1.00 . A A . 4 CYS CB 1 1 8 3730 1 1 4 CYS H H -2.355 -1.453 -1.120 1.00 . A A . 4 CYS H 1 1 8 3731 1 1 4 CYS HA H -3.917 -1.340 1.046 1.00 . A A . 4 CYS HA 1 1 8 3732 1 1 4 CYS HB2 H -4.722 0.788 -0.766 1.00 . A A . 4 CYS HB2 1 1 8 3733 1 1 4 CYS HB3 H -3.703 0.825 0.651 1.00 . A A . 4 CYS HB3 1 1 8 3734 1 1 4 CYS N N -3.173 -1.946 -0.787 1.00 . A A . 4 CYS N 1 1 8 3735 1 1 4 CYS O O -6.403 -1.680 0.621 1.00 . A A . 4 CYS O 1 1 8 3736 1 1 4 CYS SG S -2.396 0.851 -1.319 1.00 . A A . 4 CYS SG 1 1 8 3737 1 1 5 GLN C C -7.740 -3.215 -1.761 1.00 . A A . 5 GLN C 1 1 8 3738 1 1 5 GLN CA C -7.327 -1.762 -2.057 1.00 . A A . 5 GLN CA 1 1 8 3739 1 1 5 GLN CB C -7.377 -1.388 -3.556 1.00 . A A . 5 GLN CB 1 1 8 3740 1 1 5 GLN CD C -8.753 -2.995 -5.031 1.00 . A A . 5 GLN CD 1 1 8 3741 1 1 5 GLN CG C -8.704 -1.661 -4.289 1.00 . A A . 5 GLN CG 1 1 8 3742 1 1 5 GLN H H -5.255 -1.291 -2.264 1.00 . A A . 5 GLN H 1 1 8 3743 1 1 5 GLN HA H -8.020 -1.117 -1.520 1.00 . A A . 5 GLN HA 1 1 8 3744 1 1 5 GLN HB2 H -7.180 -0.317 -3.627 1.00 . A A . 5 GLN HB2 1 1 8 3745 1 1 5 GLN HB3 H -6.568 -1.897 -4.084 1.00 . A A . 5 GLN HB3 1 1 8 3746 1 1 5 GLN HE21 H -7.530 -2.329 -6.481 1.00 . A A . 5 GLN HE21 1 1 8 3747 1 1 5 GLN HE22 H -8.129 -3.994 -6.658 1.00 . A A . 5 GLN HE22 1 1 8 3748 1 1 5 GLN HG2 H -9.537 -1.611 -3.592 1.00 . A A . 5 GLN HG2 1 1 8 3749 1 1 5 GLN HG3 H -8.853 -0.872 -5.027 1.00 . A A . 5 GLN HG3 1 1 8 3750 1 1 5 GLN N N -5.968 -1.482 -1.579 1.00 . A A . 5 GLN N 1 1 8 3751 1 1 5 GLN NE2 N -8.044 -3.143 -6.126 1.00 . A A . 5 GLN NE2 1 1 8 3752 1 1 5 GLN O O -8.706 -3.480 -1.041 1.00 . A A . 5 GLN O 1 1 8 3753 1 1 5 GLN OE1 O -9.220 -3.986 -4.493 1.00 . A A . 5 GLN OE1 1 1 8 3754 1 1 6 LYS C C -6.912 -6.195 -0.663 1.00 . A A . 6 LYS C 1 1 8 3755 1 1 6 LYS CA C -7.115 -5.621 -2.073 1.00 . A A . 6 LYS CA 1 1 8 3756 1 1 6 LYS CB C -6.286 -6.347 -3.152 1.00 . A A . 6 LYS CB 1 1 8 3757 1 1 6 LYS CD C -6.474 -7.310 -5.507 1.00 . A A . 6 LYS CD 1 1 8 3758 1 1 6 LYS CE C -7.354 -8.177 -6.417 1.00 . A A . 6 LYS CE 1 1 8 3759 1 1 6 LYS CG C -7.210 -6.955 -4.210 1.00 . A A . 6 LYS CG 1 1 8 3760 1 1 6 LYS H H -6.100 -3.863 -2.719 1.00 . A A . 6 LYS H 1 1 8 3761 1 1 6 LYS HA H -8.165 -5.824 -2.271 1.00 . A A . 6 LYS HA 1 1 8 3762 1 1 6 LYS HB2 H -5.619 -5.642 -3.646 1.00 . A A . 6 LYS HB2 1 1 8 3763 1 1 6 LYS HB3 H -5.681 -7.138 -2.711 1.00 . A A . 6 LYS HB3 1 1 8 3764 1 1 6 LYS HD2 H -6.190 -6.395 -6.029 1.00 . A A . 6 LYS HD2 1 1 8 3765 1 1 6 LYS HD3 H -5.564 -7.860 -5.267 1.00 . A A . 6 LYS HD3 1 1 8 3766 1 1 6 LYS HE2 H -6.796 -8.401 -7.331 1.00 . A A . 6 LYS HE2 1 1 8 3767 1 1 6 LYS HE3 H -7.544 -9.126 -5.906 1.00 . A A . 6 LYS HE3 1 1 8 3768 1 1 6 LYS HG2 H -7.685 -7.843 -3.795 1.00 . A A . 6 LYS HG2 1 1 8 3769 1 1 6 LYS HG3 H -7.981 -6.232 -4.457 1.00 . A A . 6 LYS HG3 1 1 8 3770 1 1 6 LYS HZ1 H -9.244 -8.137 -7.283 1.00 . A A . 6 LYS HZ1 1 1 8 3771 1 1 6 LYS HZ2 H -8.503 -6.670 -7.284 1.00 . A A . 6 LYS HZ2 1 1 8 3772 1 1 6 LYS HZ3 H -9.159 -7.277 -5.905 1.00 . A A . 6 LYS HZ3 1 1 8 3773 1 1 6 LYS N N -6.915 -4.167 -2.209 1.00 . A A . 6 LYS N 1 1 8 3774 1 1 6 LYS NZ N -8.642 -7.522 -6.747 1.00 . A A . 6 LYS NZ 1 1 8 3775 1 1 6 LYS O O -7.107 -7.394 -0.481 1.00 . A A . 6 LYS O 1 1 8 3776 1 1 7 TRP C C -7.333 -4.848 2.752 1.00 . A A . 7 TRP C 1 1 8 3777 1 1 7 TRP CA C -6.567 -5.733 1.755 1.00 . A A . 7 TRP CA 1 1 8 3778 1 1 7 TRP CB C -5.123 -6.062 2.173 1.00 . A A . 7 TRP CB 1 1 8 3779 1 1 7 TRP CD1 C -4.097 -8.075 0.990 1.00 . A A . 7 TRP CD1 1 1 8 3780 1 1 7 TRP CD2 C -5.260 -8.624 2.823 1.00 . A A . 7 TRP CD2 1 1 8 3781 1 1 7 TRP CE2 C -4.718 -9.834 2.305 1.00 . A A . 7 TRP CE2 1 1 8 3782 1 1 7 TRP CE3 C -6.134 -8.737 3.928 1.00 . A A . 7 TRP CE3 1 1 8 3783 1 1 7 TRP CG C -4.756 -7.506 2.025 1.00 . A A . 7 TRP CG 1 1 8 3784 1 1 7 TRP CH2 C -5.772 -11.152 4.040 1.00 . A A . 7 TRP CH2 1 1 8 3785 1 1 7 TRP CZ2 C -4.949 -11.081 2.904 1.00 . A A . 7 TRP CZ2 1 1 8 3786 1 1 7 TRP CZ3 C -6.382 -9.986 4.535 1.00 . A A . 7 TRP CZ3 1 1 8 3787 1 1 7 TRP H H -6.411 -4.402 0.088 1.00 . A A . 7 TRP H 1 1 8 3788 1 1 7 TRP HA H -7.108 -6.677 1.845 1.00 . A A . 7 TRP HA 1 1 8 3789 1 1 7 TRP HB2 H -4.428 -5.443 1.603 1.00 . A A . 7 TRP HB2 1 1 8 3790 1 1 7 TRP HB3 H -4.967 -5.807 3.221 1.00 . A A . 7 TRP HB3 1 1 8 3791 1 1 7 TRP HD1 H -3.678 -7.538 0.151 1.00 . A A . 7 TRP HD1 1 1 8 3792 1 1 7 TRP HE1 H -3.550 -10.084 0.551 1.00 . A A . 7 TRP HE1 1 1 8 3793 1 1 7 TRP HE3 H -6.603 -7.842 4.319 1.00 . A A . 7 TRP HE3 1 1 8 3794 1 1 7 TRP HH2 H -5.963 -12.110 4.512 1.00 . A A . 7 TRP HH2 1 1 8 3795 1 1 7 TRP HZ2 H -4.513 -11.978 2.487 1.00 . A A . 7 TRP HZ2 1 1 8 3796 1 1 7 TRP HZ3 H -7.045 -10.053 5.390 1.00 . A A . 7 TRP HZ3 1 1 8 3797 1 1 7 TRP N N -6.640 -5.354 0.337 1.00 . A A . 7 TRP N 1 1 8 3798 1 1 7 TRP NE1 N -4.021 -9.440 1.186 1.00 . A A . 7 TRP NE1 1 1 8 3799 1 1 7 TRP O O -7.164 -5.009 3.960 1.00 . A A . 7 TRP O 1 1 8 3800 1 1 8 MET C C -8.325 -2.300 4.200 1.00 . A A . 8 MET C 1 1 8 3801 1 1 8 MET CA C -9.100 -3.161 3.176 1.00 . A A . 8 MET CA 1 1 8 3802 1 1 8 MET CB C -10.186 -4.035 3.838 1.00 . A A . 8 MET CB 1 1 8 3803 1 1 8 MET CE C -13.924 -4.488 2.505 1.00 . A A . 8 MET CE 1 1 8 3804 1 1 8 MET CG C -11.157 -4.662 2.833 1.00 . A A . 8 MET CG 1 1 8 3805 1 1 8 MET H H -8.346 -3.878 1.290 1.00 . A A . 8 MET H 1 1 8 3806 1 1 8 MET HA H -9.620 -2.453 2.533 1.00 . A A . 8 MET HA 1 1 8 3807 1 1 8 MET HB2 H -9.733 -4.824 4.438 1.00 . A A . 8 MET HB2 1 1 8 3808 1 1 8 MET HB3 H -10.766 -3.405 4.513 1.00 . A A . 8 MET HB3 1 1 8 3809 1 1 8 MET HE1 H -13.965 -5.057 1.579 1.00 . A A . 8 MET HE1 1 1 8 3810 1 1 8 MET HE2 H -14.900 -4.511 2.986 1.00 . A A . 8 MET HE2 1 1 8 3811 1 1 8 MET HE3 H -13.667 -3.457 2.280 1.00 . A A . 8 MET HE3 1 1 8 3812 1 1 8 MET HG2 H -11.400 -3.924 2.070 1.00 . A A . 8 MET HG2 1 1 8 3813 1 1 8 MET HG3 H -10.681 -5.510 2.343 1.00 . A A . 8 MET HG3 1 1 8 3814 1 1 8 MET N N -8.232 -3.968 2.293 1.00 . A A . 8 MET N 1 1 8 3815 1 1 8 MET O O -8.536 -2.381 5.408 1.00 . A A . 8 MET O 1 1 8 3816 1 1 8 MET SD S -12.694 -5.208 3.624 1.00 . A A . 8 MET SD 1 1 8 3817 1 1 9 GLN C C -6.790 0.314 5.521 1.00 . A A . 9 GLN C 1 1 8 3818 1 1 9 GLN CA C -6.383 -0.695 4.415 1.00 . A A . 9 GLN CA 1 1 8 3819 1 1 9 GLN CB C -5.610 0.076 3.338 1.00 . A A . 9 GLN CB 1 1 8 3820 1 1 9 GLN CD C -5.770 2.082 1.744 1.00 . A A . 9 GLN CD 1 1 8 3821 1 1 9 GLN CG C -6.518 1.084 2.604 1.00 . A A . 9 GLN CG 1 1 8 3822 1 1 9 GLN H H -7.288 -1.517 2.690 1.00 . A A . 9 GLN H 1 1 8 3823 1 1 9 GLN HA H -5.697 -1.401 4.879 1.00 . A A . 9 GLN HA 1 1 8 3824 1 1 9 GLN HB2 H -4.781 0.594 3.813 1.00 . A A . 9 GLN HB2 1 1 8 3825 1 1 9 GLN HB3 H -5.188 -0.626 2.626 1.00 . A A . 9 GLN HB3 1 1 8 3826 1 1 9 GLN HE21 H -4.146 2.262 2.984 1.00 . A A . 9 GLN HE21 1 1 8 3827 1 1 9 GLN HE22 H -4.293 3.391 1.630 1.00 . A A . 9 GLN HE22 1 1 8 3828 1 1 9 GLN HG2 H -7.230 0.553 1.974 1.00 . A A . 9 GLN HG2 1 1 8 3829 1 1 9 GLN HG3 H -7.078 1.671 3.329 1.00 . A A . 9 GLN HG3 1 1 8 3830 1 1 9 GLN N N -7.417 -1.466 3.694 1.00 . A A . 9 GLN N 1 1 8 3831 1 1 9 GLN NE2 N -4.652 2.613 2.174 1.00 . A A . 9 GLN NE2 1 1 8 3832 1 1 9 GLN O O -5.950 1.121 5.927 1.00 . A A . 9 GLN O 1 1 8 3833 1 1 9 GLN OE1 O -6.206 2.405 0.653 1.00 . A A . 9 GLN OE1 1 1 8 3834 1 1 10 THR C C -8.354 2.904 5.948 1.00 . A A . 10 THR C 1 1 8 3835 1 1 10 THR CA C -8.586 1.571 6.669 1.00 . A A . 10 THR CA 1 1 8 3836 1 1 10 THR CB C -8.039 1.605 8.106 1.00 . A A . 10 THR CB 1 1 8 3837 1 1 10 THR CG2 C -8.916 2.486 8.982 1.00 . A A . 10 THR CG2 1 1 8 3838 1 1 10 THR H H -8.691 -0.355 5.694 1.00 . A A . 10 THR H 1 1 8 3839 1 1 10 THR HA H -9.659 1.458 6.757 1.00 . A A . 10 THR HA 1 1 8 3840 1 1 10 THR HB H -7.014 1.974 8.122 1.00 . A A . 10 THR HB 1 1 8 3841 1 1 10 THR HG1 H -7.127 0.065 8.826 1.00 . A A . 10 THR HG1 1 1 8 3842 1 1 10 THR HG21 H -9.938 2.114 8.981 1.00 . A A . 10 THR HG21 1 1 8 3843 1 1 10 THR HG22 H -8.903 3.511 8.618 1.00 . A A . 10 THR HG22 1 1 8 3844 1 1 10 THR HG23 H -8.518 2.476 9.991 1.00 . A A . 10 THR HG23 1 1 8 3845 1 1 10 THR N N -8.066 0.415 5.907 1.00 . A A . 10 THR N 1 1 8 3846 1 1 10 THR O O -7.482 3.684 6.320 1.00 . A A . 10 THR O 1 1 8 3847 1 1 10 THR OG1 O -8.059 0.317 8.672 1.00 . A A . 10 THR OG1 1 1 8 3848 1 1 11 CYS C C -9.481 5.605 4.746 1.00 . A A . 11 CYS C 1 1 8 3849 1 1 11 CYS CA C -8.904 4.361 4.042 1.00 . A A . 11 CYS CA 1 1 8 3850 1 1 11 CYS CB C -9.475 4.112 2.646 1.00 . A A . 11 CYS CB 1 1 8 3851 1 1 11 CYS H H -9.808 2.506 4.590 1.00 . A A . 11 CYS H 1 1 8 3852 1 1 11 CYS HA H -7.835 4.528 3.911 1.00 . A A . 11 CYS HA 1 1 8 3853 1 1 11 CYS HB2 H -9.164 3.120 2.322 1.00 . A A . 11 CYS HB2 1 1 8 3854 1 1 11 CYS HB3 H -10.560 4.142 2.709 1.00 . A A . 11 CYS HB3 1 1 8 3855 1 1 11 CYS N N -9.086 3.154 4.858 1.00 . A A . 11 CYS N 1 1 8 3856 1 1 11 CYS O O -10.643 5.977 4.568 1.00 . A A . 11 CYS O 1 1 8 3857 1 1 11 CYS SG S -8.944 5.267 1.363 1.00 . A A . 11 CYS SG 1 1 8 3858 1 1 12 ASP C C -8.869 8.661 5.558 1.00 . A A . 12 ASP C 1 1 8 3859 1 1 12 ASP CA C -9.022 7.394 6.409 1.00 . A A . 12 ASP CA 1 1 8 3860 1 1 12 ASP CB C -8.178 7.455 7.695 1.00 . A A . 12 ASP CB 1 1 8 3861 1 1 12 ASP CG C -8.613 6.419 8.734 1.00 . A A . 12 ASP CG 1 1 8 3862 1 1 12 ASP H H -7.858 5.676 5.913 1.00 . A A . 12 ASP H 1 1 8 3863 1 1 12 ASP HA H -10.070 7.379 6.712 1.00 . A A . 12 ASP HA 1 1 8 3864 1 1 12 ASP HB2 H -7.125 7.312 7.448 1.00 . A A . 12 ASP HB2 1 1 8 3865 1 1 12 ASP HB3 H -8.283 8.443 8.144 1.00 . A A . 12 ASP HB3 1 1 8 3866 1 1 12 ASP N N -8.727 6.149 5.696 1.00 . A A . 12 ASP N 1 1 8 3867 1 1 12 ASP O O -8.158 8.662 4.556 1.00 . A A . 12 ASP O 1 1 8 3868 1 1 12 ASP OD1 O -7.756 5.928 9.498 1.00 . A A . 12 ASP OD1 1 1 8 3869 1 1 12 ASP OD2 O -9.820 6.094 8.802 1.00 . A A . 12 ASP OD2 1 1 8 3870 1 1 13 SER C C -7.775 11.557 5.348 1.00 . A A . 13 SER C 1 1 8 3871 1 1 13 SER CA C -9.244 11.098 5.368 1.00 . A A . 13 SER CA 1 1 8 3872 1 1 13 SER CB C -10.127 12.121 6.091 1.00 . A A . 13 SER CB 1 1 8 3873 1 1 13 SER H H -10.003 9.743 6.846 1.00 . A A . 13 SER H 1 1 8 3874 1 1 13 SER HA H -9.580 11.024 4.334 1.00 . A A . 13 SER HA 1 1 8 3875 1 1 13 SER HB2 H -11.121 11.694 6.221 1.00 . A A . 13 SER HB2 1 1 8 3876 1 1 13 SER HB3 H -9.716 12.332 7.079 1.00 . A A . 13 SER HB3 1 1 8 3877 1 1 13 SER HG H -9.391 13.775 5.350 1.00 . A A . 13 SER HG 1 1 8 3878 1 1 13 SER N N -9.423 9.786 6.010 1.00 . A A . 13 SER N 1 1 8 3879 1 1 13 SER O O -7.412 12.419 4.548 1.00 . A A . 13 SER O 1 1 8 3880 1 1 13 SER OG O -10.251 13.323 5.353 1.00 . A A . 13 SER OG 1 1 8 3881 1 1 14 GLU C C -4.686 9.929 5.521 1.00 . A A . 14 GLU C 1 1 8 3882 1 1 14 GLU CA C -5.444 11.130 6.138 1.00 . A A . 14 GLU CA 1 1 8 3883 1 1 14 GLU CB C -4.909 11.419 7.551 1.00 . A A . 14 GLU CB 1 1 8 3884 1 1 14 GLU CD C -4.872 12.825 9.663 1.00 . A A . 14 GLU CD 1 1 8 3885 1 1 14 GLU CG C -5.572 12.577 8.315 1.00 . A A . 14 GLU CG 1 1 8 3886 1 1 14 GLU H H -7.276 10.268 6.808 1.00 . A A . 14 GLU H 1 1 8 3887 1 1 14 GLU HA H -5.197 11.996 5.522 1.00 . A A . 14 GLU HA 1 1 8 3888 1 1 14 GLU HB2 H -5.005 10.512 8.146 1.00 . A A . 14 GLU HB2 1 1 8 3889 1 1 14 GLU HB3 H -3.847 11.643 7.456 1.00 . A A . 14 GLU HB3 1 1 8 3890 1 1 14 GLU HG2 H -5.520 13.482 7.709 1.00 . A A . 14 GLU HG2 1 1 8 3891 1 1 14 GLU HG3 H -6.624 12.345 8.484 1.00 . A A . 14 GLU HG3 1 1 8 3892 1 1 14 GLU N N -6.904 10.951 6.163 1.00 . A A . 14 GLU N 1 1 8 3893 1 1 14 GLU O O -3.512 9.724 5.841 1.00 . A A . 14 GLU O 1 1 8 3894 1 1 14 GLU OE1 O -3.670 12.509 9.797 1.00 . A A . 14 GLU OE1 1 1 8 3895 1 1 14 GLU OE2 O -5.534 13.264 10.634 1.00 . A A . 14 GLU OE2 1 1 8 3896 1 1 15 ARG C C -4.673 7.861 2.607 1.00 . A A . 15 ARG C 1 1 8 3897 1 1 15 ARG CA C -4.727 7.838 4.142 1.00 . A A . 15 ARG CA 1 1 8 3898 1 1 15 ARG CB C -5.524 6.636 4.682 1.00 . A A . 15 ARG CB 1 1 8 3899 1 1 15 ARG CD C -3.603 4.913 4.839 1.00 . A A . 15 ARG CD 1 1 8 3900 1 1 15 ARG CG C -5.033 5.216 4.329 1.00 . A A . 15 ARG CG 1 1 8 3901 1 1 15 ARG CZ C -4.024 4.694 7.302 1.00 . A A . 15 ARG CZ 1 1 8 3902 1 1 15 ARG H H -6.304 9.241 4.496 1.00 . A A . 15 ARG H 1 1 8 3903 1 1 15 ARG HA H -3.704 7.746 4.500 1.00 . A A . 15 ARG HA 1 1 8 3904 1 1 15 ARG HB2 H -5.611 6.726 5.764 1.00 . A A . 15 ARG HB2 1 1 8 3905 1 1 15 ARG HB3 H -6.531 6.715 4.275 1.00 . A A . 15 ARG HB3 1 1 8 3906 1 1 15 ARG HD2 H -3.424 3.850 4.741 1.00 . A A . 15 ARG HD2 1 1 8 3907 1 1 15 ARG HD3 H -2.892 5.492 4.266 1.00 . A A . 15 ARG HD3 1 1 8 3908 1 1 15 ARG HE H -3.056 6.184 6.474 1.00 . A A . 15 ARG HE 1 1 8 3909 1 1 15 ARG HG2 H -5.711 4.489 4.765 1.00 . A A . 15 ARG HG2 1 1 8 3910 1 1 15 ARG HG3 H -5.068 5.087 3.252 1.00 . A A . 15 ARG HG3 1 1 8 3911 1 1 15 ARG HH11 H -4.893 3.063 6.459 1.00 . A A . 15 ARG HH11 1 1 8 3912 1 1 15 ARG HH12 H -5.174 3.335 8.155 1.00 . A A . 15 ARG HH12 1 1 8 3913 1 1 15 ARG HH21 H -3.479 6.210 8.468 1.00 . A A . 15 ARG HH21 1 1 8 3914 1 1 15 ARG HH22 H -4.438 4.919 9.223 1.00 . A A . 15 ARG HH22 1 1 8 3915 1 1 15 ARG N N -5.320 9.075 4.701 1.00 . A A . 15 ARG N 1 1 8 3916 1 1 15 ARG NE N -3.498 5.298 6.251 1.00 . A A . 15 ARG NE 1 1 8 3917 1 1 15 ARG NH1 N -4.671 3.563 7.305 1.00 . A A . 15 ARG NH1 1 1 8 3918 1 1 15 ARG NH2 N -3.915 5.293 8.444 1.00 . A A . 15 ARG NH2 1 1 8 3919 1 1 15 ARG O O -5.636 8.243 1.942 1.00 . A A . 15 ARG O 1 1 8 3920 1 1 16 LYS C C -4.096 5.944 0.124 1.00 . A A . 16 LYS C 1 1 8 3921 1 1 16 LYS CA C -3.338 7.184 0.598 1.00 . A A . 16 LYS CA 1 1 8 3922 1 1 16 LYS CB C -1.845 6.960 0.294 1.00 . A A . 16 LYS CB 1 1 8 3923 1 1 16 LYS CD C -0.933 9.382 0.128 1.00 . A A . 16 LYS CD 1 1 8 3924 1 1 16 LYS CE C -0.197 10.406 1.005 1.00 . A A . 16 LYS CE 1 1 8 3925 1 1 16 LYS CG C -0.871 8.018 0.817 1.00 . A A . 16 LYS CG 1 1 8 3926 1 1 16 LYS H H -2.795 7.151 2.666 1.00 . A A . 16 LYS H 1 1 8 3927 1 1 16 LYS HA H -3.705 8.038 0.037 1.00 . A A . 16 LYS HA 1 1 8 3928 1 1 16 LYS HB2 H -1.548 6.004 0.732 1.00 . A A . 16 LYS HB2 1 1 8 3929 1 1 16 LYS HB3 H -1.723 6.875 -0.781 1.00 . A A . 16 LYS HB3 1 1 8 3930 1 1 16 LYS HD2 H -0.467 9.315 -0.857 1.00 . A A . 16 LYS HD2 1 1 8 3931 1 1 16 LYS HD3 H -1.970 9.686 0.011 1.00 . A A . 16 LYS HD3 1 1 8 3932 1 1 16 LYS HE2 H -0.736 10.514 1.949 1.00 . A A . 16 LYS HE2 1 1 8 3933 1 1 16 LYS HE3 H 0.806 10.034 1.225 1.00 . A A . 16 LYS HE3 1 1 8 3934 1 1 16 LYS HG2 H -1.045 8.149 1.878 1.00 . A A . 16 LYS HG2 1 1 8 3935 1 1 16 LYS HG3 H 0.134 7.626 0.687 1.00 . A A . 16 LYS HG3 1 1 8 3936 1 1 16 LYS HZ1 H -1.009 12.050 0.030 1.00 . A A . 16 LYS HZ1 1 1 8 3937 1 1 16 LYS HZ2 H 0.488 11.647 -0.481 1.00 . A A . 16 LYS HZ2 1 1 8 3938 1 1 16 LYS HZ3 H 0.334 12.413 0.947 1.00 . A A . 16 LYS HZ3 1 1 8 3939 1 1 16 LYS N N -3.543 7.416 2.045 1.00 . A A . 16 LYS N 1 1 8 3940 1 1 16 LYS NZ N -0.098 11.720 0.345 1.00 . A A . 16 LYS NZ 1 1 8 3941 1 1 16 LYS O O -4.254 5.023 0.915 1.00 . A A . 16 LYS O 1 1 8 3942 1 1 17 CYS C C -4.050 4.184 -3.076 1.00 . A A . 17 CYS C 1 1 8 3943 1 1 17 CYS CA C -4.786 4.529 -1.766 1.00 . A A . 17 CYS CA 1 1 8 3944 1 1 17 CYS CB C -6.323 4.490 -1.869 1.00 . A A . 17 CYS CB 1 1 8 3945 1 1 17 CYS H H -4.131 6.575 -1.798 1.00 . A A . 17 CYS H 1 1 8 3946 1 1 17 CYS HA H -4.521 3.729 -1.073 1.00 . A A . 17 CYS HA 1 1 8 3947 1 1 17 CYS HB2 H -6.726 4.487 -0.853 1.00 . A A . 17 CYS HB2 1 1 8 3948 1 1 17 CYS HB3 H -6.669 5.402 -2.351 1.00 . A A . 17 CYS HB3 1 1 8 3949 1 1 17 CYS N N -4.341 5.799 -1.179 1.00 . A A . 17 CYS N 1 1 8 3950 1 1 17 CYS O O -3.674 5.045 -3.871 1.00 . A A . 17 CYS O 1 1 8 3951 1 1 17 CYS SG S -7.007 3.052 -2.757 1.00 . A A . 17 CYS SG 1 1 8 3952 1 1 18 CYS C C -3.676 2.716 -5.805 1.00 . A A . 18 CYS C 1 1 8 3953 1 1 18 CYS CA C -3.193 2.242 -4.425 1.00 . A A . 18 CYS CA 1 1 8 3954 1 1 18 CYS CB C -3.436 0.732 -4.311 1.00 . A A . 18 CYS CB 1 1 8 3955 1 1 18 CYS H H -4.178 2.261 -2.555 1.00 . A A . 18 CYS H 1 1 8 3956 1 1 18 CYS HA H -2.121 2.437 -4.360 1.00 . A A . 18 CYS HA 1 1 8 3957 1 1 18 CYS HB2 H -4.489 0.550 -4.094 1.00 . A A . 18 CYS HB2 1 1 8 3958 1 1 18 CYS HB3 H -3.234 0.281 -5.285 1.00 . A A . 18 CYS HB3 1 1 8 3959 1 1 18 CYS N N -3.879 2.877 -3.295 1.00 . A A . 18 CYS N 1 1 8 3960 1 1 18 CYS O O -2.869 2.836 -6.727 1.00 . A A . 18 CYS O 1 1 8 3961 1 1 18 CYS SG S -2.412 -0.159 -3.111 1.00 . A A . 18 CYS SG 1 1 8 3962 1 1 19 GLU C C -6.337 4.962 -6.740 1.00 . A A . 19 GLU C 1 1 8 3963 1 1 19 GLU CA C -5.584 3.666 -7.101 1.00 . A A . 19 GLU CA 1 1 8 3964 1 1 19 GLU CB C -6.453 2.688 -7.930 1.00 . A A . 19 GLU CB 1 1 8 3965 1 1 19 GLU CD C -6.199 0.211 -7.170 1.00 . A A . 19 GLU CD 1 1 8 3966 1 1 19 GLU CG C -7.081 1.475 -7.205 1.00 . A A . 19 GLU CG 1 1 8 3967 1 1 19 GLU H H -5.557 2.827 -5.138 1.00 . A A . 19 GLU H 1 1 8 3968 1 1 19 GLU HA H -4.787 3.998 -7.769 1.00 . A A . 19 GLU HA 1 1 8 3969 1 1 19 GLU HB2 H -7.267 3.266 -8.366 1.00 . A A . 19 GLU HB2 1 1 8 3970 1 1 19 GLU HB3 H -5.872 2.332 -8.778 1.00 . A A . 19 GLU HB3 1 1 8 3971 1 1 19 GLU HG2 H -7.353 1.760 -6.186 1.00 . A A . 19 GLU HG2 1 1 8 3972 1 1 19 GLU HG3 H -8.004 1.220 -7.729 1.00 . A A . 19 GLU HG3 1 1 8 3973 1 1 19 GLU N N -4.970 3.016 -5.932 1.00 . A A . 19 GLU N 1 1 8 3974 1 1 19 GLU O O -6.279 5.927 -7.501 1.00 . A A . 19 GLU O 1 1 8 3975 1 1 19 GLU OE1 O -6.683 -0.844 -6.708 1.00 . A A . 19 GLU OE1 1 1 8 3976 1 1 19 GLU OE2 O -5.017 0.252 -7.585 1.00 . A A . 19 GLU OE2 1 1 8 3977 1 1 20 GLY C C -9.140 6.199 -5.356 1.00 . A A . 20 GLY C 1 1 8 3978 1 1 20 GLY CA C -7.636 6.266 -5.090 1.00 . A A . 20 GLY CA 1 1 8 3979 1 1 20 GLY H H -6.900 4.270 -4.924 1.00 . A A . 20 GLY H 1 1 8 3980 1 1 20 GLY HA2 H -7.484 6.400 -4.022 1.00 . A A . 20 GLY HA2 1 1 8 3981 1 1 20 GLY HA3 H -7.236 7.148 -5.592 1.00 . A A . 20 GLY HA3 1 1 8 3982 1 1 20 GLY N N -6.920 5.065 -5.540 1.00 . A A . 20 GLY N 1 1 8 3983 1 1 20 GLY O O -9.673 6.966 -6.161 1.00 . A A . 20 GLY O 1 1 8 3984 1 1 21 MET C C -12.097 5.149 -3.767 1.00 . A A . 21 MET C 1 1 8 3985 1 1 21 MET CA C -11.204 4.859 -4.986 1.00 . A A . 21 MET CA 1 1 8 3986 1 1 21 MET CB C -11.256 3.383 -5.409 1.00 . A A . 21 MET CB 1 1 8 3987 1 1 21 MET CE C -11.772 3.894 -8.586 1.00 . A A . 21 MET CE 1 1 8 3988 1 1 21 MET CG C -10.190 2.984 -6.434 1.00 . A A . 21 MET CG 1 1 8 3989 1 1 21 MET H H -9.319 4.700 -4.019 1.00 . A A . 21 MET H 1 1 8 3990 1 1 21 MET HA H -11.592 5.455 -5.812 1.00 . A A . 21 MET HA 1 1 8 3991 1 1 21 MET HB2 H -11.124 2.754 -4.528 1.00 . A A . 21 MET HB2 1 1 8 3992 1 1 21 MET HB3 H -12.236 3.185 -5.839 1.00 . A A . 21 MET HB3 1 1 8 3993 1 1 21 MET HE1 H -11.807 4.439 -9.528 1.00 . A A . 21 MET HE1 1 1 8 3994 1 1 21 MET HE2 H -12.041 2.855 -8.766 1.00 . A A . 21 MET HE2 1 1 8 3995 1 1 21 MET HE3 H -12.472 4.349 -7.886 1.00 . A A . 21 MET HE3 1 1 8 3996 1 1 21 MET HG2 H -9.217 3.012 -5.946 1.00 . A A . 21 MET HG2 1 1 8 3997 1 1 21 MET HG3 H -10.370 1.954 -6.722 1.00 . A A . 21 MET HG3 1 1 8 3998 1 1 21 MET N N -9.808 5.233 -4.721 1.00 . A A . 21 MET N 1 1 8 3999 1 1 21 MET O O -11.716 5.938 -2.903 1.00 . A A . 21 MET O 1 1 8 4000 1 1 21 MET SD S -10.087 3.991 -7.937 1.00 . A A . 21 MET SD 1 1 8 4001 1 1 22 VAL C C -13.548 4.334 -1.217 1.00 . A A . 22 VAL C 1 1 8 4002 1 1 22 VAL CA C -14.202 4.759 -2.534 1.00 . A A . 22 VAL CA 1 1 8 4003 1 1 22 VAL CB C -15.565 4.071 -2.728 1.00 . A A . 22 VAL CB 1 1 8 4004 1 1 22 VAL CG1 C -16.579 4.591 -1.703 1.00 . A A . 22 VAL CG1 1 1 8 4005 1 1 22 VAL CG2 C -16.141 4.326 -4.127 1.00 . A A . 22 VAL CG2 1 1 8 4006 1 1 22 VAL H H -13.551 3.863 -4.365 1.00 . A A . 22 VAL H 1 1 8 4007 1 1 22 VAL HA H -14.397 5.830 -2.472 1.00 . A A . 22 VAL HA 1 1 8 4008 1 1 22 VAL HB H -15.449 2.995 -2.598 1.00 . A A . 22 VAL HB 1 1 8 4009 1 1 22 VAL HG11 H -16.244 4.399 -0.686 1.00 . A A . 22 VAL HG11 1 1 8 4010 1 1 22 VAL HG12 H -16.723 5.663 -1.830 1.00 . A A . 22 VAL HG12 1 1 8 4011 1 1 22 VAL HG13 H -17.524 4.066 -1.841 1.00 . A A . 22 VAL HG13 1 1 8 4012 1 1 22 VAL HG21 H -15.518 3.850 -4.883 1.00 . A A . 22 VAL HG21 1 1 8 4013 1 1 22 VAL HG22 H -17.143 3.901 -4.194 1.00 . A A . 22 VAL HG22 1 1 8 4014 1 1 22 VAL HG23 H -16.194 5.397 -4.325 1.00 . A A . 22 VAL HG23 1 1 8 4015 1 1 22 VAL N N -13.298 4.565 -3.683 1.00 . A A . 22 VAL N 1 1 8 4016 1 1 22 VAL O O -12.948 3.264 -1.164 1.00 . A A . 22 VAL O 1 1 8 4017 1 1 23 CYS C C -13.261 5.557 2.253 1.00 . A A . 23 CYS C 1 1 8 4018 1 1 23 CYS CA C -12.617 5.278 0.876 1.00 . A A . 23 CYS CA 1 1 8 4019 1 1 23 CYS CB C -11.630 6.382 0.443 1.00 . A A . 23 CYS CB 1 1 8 4020 1 1 23 CYS H H -14.181 6.016 -0.333 1.00 . A A . 23 CYS H 1 1 8 4021 1 1 23 CYS HA H -12.065 4.343 0.936 1.00 . A A . 23 CYS HA 1 1 8 4022 1 1 23 CYS HB2 H -11.193 6.096 -0.513 1.00 . A A . 23 CYS HB2 1 1 8 4023 1 1 23 CYS HB3 H -12.196 7.300 0.279 1.00 . A A . 23 CYS HB3 1 1 8 4024 1 1 23 CYS N N -13.620 5.191 -0.193 1.00 . A A . 23 CYS N 1 1 8 4025 1 1 23 CYS O O -13.565 6.712 2.563 1.00 . A A . 23 CYS O 1 1 8 4026 1 1 23 CYS SG S -10.251 6.812 1.539 1.00 . A A . 23 CYS SG 1 1 8 4027 1 1 24 ARG C C -13.666 3.045 4.964 1.00 . A A . 24 ARG C 1 1 8 4028 1 1 24 ARG CA C -13.873 4.484 4.490 1.00 . A A . 24 ARG CA 1 1 8 4029 1 1 24 ARG CB C -15.344 4.805 4.876 1.00 . A A . 24 ARG CB 1 1 8 4030 1 1 24 ARG CD C -16.632 5.449 2.859 1.00 . A A . 24 ARG CD 1 1 8 4031 1 1 24 ARG CG C -16.104 5.959 4.216 1.00 . A A . 24 ARG CG 1 1 8 4032 1 1 24 ARG CZ C -17.206 7.601 1.778 1.00 . A A . 24 ARG CZ 1 1 8 4033 1 1 24 ARG H H -13.357 3.589 2.622 1.00 . A A . 24 ARG H 1 1 8 4034 1 1 24 ARG HA H -13.203 5.155 5.031 1.00 . A A . 24 ARG HA 1 1 8 4035 1 1 24 ARG HB2 H -15.959 3.910 4.760 1.00 . A A . 24 ARG HB2 1 1 8 4036 1 1 24 ARG HB3 H -15.339 5.010 5.947 1.00 . A A . 24 ARG HB3 1 1 8 4037 1 1 24 ARG HD2 H -15.837 5.295 2.153 1.00 . A A . 24 ARG HD2 1 1 8 4038 1 1 24 ARG HD3 H -17.181 4.532 3.007 1.00 . A A . 24 ARG HD3 1 1 8 4039 1 1 24 ARG HE H -18.544 6.310 2.484 1.00 . A A . 24 ARG HE 1 1 8 4040 1 1 24 ARG HG2 H -16.957 6.208 4.848 1.00 . A A . 24 ARG HG2 1 1 8 4041 1 1 24 ARG HG3 H -15.476 6.843 4.130 1.00 . A A . 24 ARG HG3 1 1 8 4042 1 1 24 ARG HH11 H -15.225 7.433 2.034 1.00 . A A . 24 ARG HH11 1 1 8 4043 1 1 24 ARG HH12 H -15.761 8.856 1.173 1.00 . A A . 24 ARG HH12 1 1 8 4044 1 1 24 ARG HH21 H -19.099 8.160 1.569 1.00 . A A . 24 ARG HH21 1 1 8 4045 1 1 24 ARG HH22 H -17.914 9.325 0.996 1.00 . A A . 24 ARG HH22 1 1 8 4046 1 1 24 ARG N N -13.548 4.501 3.033 1.00 . A A . 24 ARG N 1 1 8 4047 1 1 24 ARG NE N -17.551 6.473 2.367 1.00 . A A . 24 ARG NE 1 1 8 4048 1 1 24 ARG NH1 N -15.967 7.950 1.579 1.00 . A A . 24 ARG NH1 1 1 8 4049 1 1 24 ARG NH2 N -18.138 8.407 1.372 1.00 . A A . 24 ARG NH2 1 1 8 4050 1 1 24 ARG O O -14.188 2.159 4.305 1.00 . A A . 24 ARG O 1 1 8 4051 1 1 25 LEU C C -11.794 0.506 5.564 1.00 . A A . 25 LEU C 1 1 8 4052 1 1 25 LEU CA C -12.563 1.423 6.557 1.00 . A A . 25 LEU CA 1 1 8 4053 1 1 25 LEU CB C -13.801 0.700 7.143 1.00 . A A . 25 LEU CB 1 1 8 4054 1 1 25 LEU CD1 C -15.335 2.536 8.097 1.00 . A A . 25 LEU CD1 1 1 8 4055 1 1 25 LEU CD2 C -15.307 0.302 9.123 1.00 . A A . 25 LEU CD2 1 1 8 4056 1 1 25 LEU CG C -14.435 1.333 8.402 1.00 . A A . 25 LEU CG 1 1 8 4057 1 1 25 LEU H H -12.540 3.566 6.543 1.00 . A A . 25 LEU H 1 1 8 4058 1 1 25 LEU HA H -11.880 1.581 7.392 1.00 . A A . 25 LEU HA 1 1 8 4059 1 1 25 LEU HB2 H -14.566 0.585 6.375 1.00 . A A . 25 LEU HB2 1 1 8 4060 1 1 25 LEU HB3 H -13.474 -0.305 7.416 1.00 . A A . 25 LEU HB3 1 1 8 4061 1 1 25 LEU HD11 H -15.871 2.836 8.996 1.00 . A A . 25 LEU HD11 1 1 8 4062 1 1 25 LEU HD12 H -16.057 2.280 7.321 1.00 . A A . 25 LEU HD12 1 1 8 4063 1 1 25 LEU HD13 H -14.736 3.385 7.780 1.00 . A A . 25 LEU HD13 1 1 8 4064 1 1 25 LEU HD21 H -14.701 -0.556 9.415 1.00 . A A . 25 LEU HD21 1 1 8 4065 1 1 25 LEU HD22 H -16.114 -0.030 8.469 1.00 . A A . 25 LEU HD22 1 1 8 4066 1 1 25 LEU HD23 H -15.733 0.742 10.024 1.00 . A A . 25 LEU HD23 1 1 8 4067 1 1 25 LEU HG H -13.646 1.631 9.089 1.00 . A A . 25 LEU HG 1 1 8 4068 1 1 25 LEU N N -12.921 2.771 6.039 1.00 . A A . 25 LEU N 1 1 8 4069 1 1 25 LEU O O -11.061 -0.391 5.977 1.00 . A A . 25 LEU O 1 1 8 4070 1 1 26 TRP C C -11.089 1.111 1.962 1.00 . A A . 26 TRP C 1 1 8 4071 1 1 26 TRP CA C -11.269 0.125 3.121 1.00 . A A . 26 TRP CA 1 1 8 4072 1 1 26 TRP CB C -12.193 -1.035 2.700 1.00 . A A . 26 TRP CB 1 1 8 4073 1 1 26 TRP CD1 C -14.368 -1.293 3.962 1.00 . A A . 26 TRP CD1 1 1 8 4074 1 1 26 TRP CD2 C -14.608 0.052 2.186 1.00 . A A . 26 TRP CD2 1 1 8 4075 1 1 26 TRP CE2 C -15.865 0.028 2.866 1.00 . A A . 26 TRP CE2 1 1 8 4076 1 1 26 TRP CE3 C -14.519 0.918 1.072 1.00 . A A . 26 TRP CE3 1 1 8 4077 1 1 26 TRP CG C -13.677 -0.843 2.888 1.00 . A A . 26 TRP CG 1 1 8 4078 1 1 26 TRP CH2 C -16.840 1.640 1.343 1.00 . A A . 26 TRP CH2 1 1 8 4079 1 1 26 TRP CZ2 C -16.965 0.800 2.461 1.00 . A A . 26 TRP CZ2 1 1 8 4080 1 1 26 TRP CZ3 C -15.620 1.684 0.647 1.00 . A A . 26 TRP CZ3 1 1 8 4081 1 1 26 TRP H H -12.532 1.501 4.025 1.00 . A A . 26 TRP H 1 1 8 4082 1 1 26 TRP HA H -10.289 -0.275 3.378 1.00 . A A . 26 TRP HA 1 1 8 4083 1 1 26 TRP HB2 H -11.996 -1.316 1.666 1.00 . A A . 26 TRP HB2 1 1 8 4084 1 1 26 TRP HB3 H -11.910 -1.890 3.308 1.00 . A A . 26 TRP HB3 1 1 8 4085 1 1 26 TRP HD1 H -13.954 -1.913 4.750 1.00 . A A . 26 TRP HD1 1 1 8 4086 1 1 26 TRP HE1 H -16.329 -0.981 4.680 1.00 . A A . 26 TRP HE1 1 1 8 4087 1 1 26 TRP HE3 H -13.583 1.019 0.548 1.00 . A A . 26 TRP HE3 1 1 8 4088 1 1 26 TRP HH2 H -17.675 2.254 1.029 1.00 . A A . 26 TRP HH2 1 1 8 4089 1 1 26 TRP HZ2 H -17.887 0.767 3.024 1.00 . A A . 26 TRP HZ2 1 1 8 4090 1 1 26 TRP HZ3 H -15.515 2.325 -0.212 1.00 . A A . 26 TRP HZ3 1 1 8 4091 1 1 26 TRP N N -11.832 0.813 4.274 1.00 . A A . 26 TRP N 1 1 8 4092 1 1 26 TRP NE1 N -15.664 -0.826 3.925 1.00 . A A . 26 TRP NE1 1 1 8 4093 1 1 26 TRP O O -11.687 2.184 1.983 1.00 . A A . 26 TRP O 1 1 8 4094 1 1 27 CYS C C -10.929 0.364 -1.392 1.00 . A A . 27 CYS C 1 1 8 4095 1 1 27 CYS CA C -10.388 1.383 -0.382 1.00 . A A . 27 CYS CA 1 1 8 4096 1 1 27 CYS CB C -9.010 1.945 -0.753 1.00 . A A . 27 CYS CB 1 1 8 4097 1 1 27 CYS H H -9.926 -0.194 0.937 1.00 . A A . 27 CYS H 1 1 8 4098 1 1 27 CYS HA H -11.067 2.227 -0.338 1.00 . A A . 27 CYS HA 1 1 8 4099 1 1 27 CYS HB2 H -8.655 2.572 0.064 1.00 . A A . 27 CYS HB2 1 1 8 4100 1 1 27 CYS HB3 H -8.310 1.117 -0.868 1.00 . A A . 27 CYS HB3 1 1 8 4101 1 1 27 CYS N N -10.347 0.723 0.924 1.00 . A A . 27 CYS N 1 1 8 4102 1 1 27 CYS O O -10.431 -0.760 -1.420 1.00 . A A . 27 CYS O 1 1 8 4103 1 1 27 CYS SG S -8.983 2.945 -2.268 1.00 . A A . 27 CYS SG 1 1 8 4104 1 1 28 LYS C C -13.076 0.392 -4.348 1.00 . A A . 28 LYS C 1 1 8 4105 1 1 28 LYS CA C -12.717 -0.258 -3.010 1.00 . A A . 28 LYS CA 1 1 8 4106 1 1 28 LYS CB C -13.978 -0.803 -2.308 1.00 . A A . 28 LYS CB 1 1 8 4107 1 1 28 LYS CD C -13.008 -2.941 -1.147 1.00 . A A . 28 LYS CD 1 1 8 4108 1 1 28 LYS CE C -13.838 -3.980 -1.905 1.00 . A A . 28 LYS CE 1 1 8 4109 1 1 28 LYS CG C -13.731 -1.594 -1.008 1.00 . A A . 28 LYS CG 1 1 8 4110 1 1 28 LYS H H -12.388 1.620 -2.011 1.00 . A A . 28 LYS H 1 1 8 4111 1 1 28 LYS HA H -12.064 -1.102 -3.235 1.00 . A A . 28 LYS HA 1 1 8 4112 1 1 28 LYS HB2 H -14.627 0.042 -2.067 1.00 . A A . 28 LYS HB2 1 1 8 4113 1 1 28 LYS HB3 H -14.524 -1.441 -3.003 1.00 . A A . 28 LYS HB3 1 1 8 4114 1 1 28 LYS HD2 H -12.053 -2.798 -1.650 1.00 . A A . 28 LYS HD2 1 1 8 4115 1 1 28 LYS HD3 H -12.807 -3.316 -0.142 1.00 . A A . 28 LYS HD3 1 1 8 4116 1 1 28 LYS HE2 H -14.843 -4.025 -1.477 1.00 . A A . 28 LYS HE2 1 1 8 4117 1 1 28 LYS HE3 H -13.922 -3.673 -2.951 1.00 . A A . 28 LYS HE3 1 1 8 4118 1 1 28 LYS HG2 H -13.142 -0.981 -0.333 1.00 . A A . 28 LYS HG2 1 1 8 4119 1 1 28 LYS HG3 H -14.693 -1.770 -0.527 1.00 . A A . 28 LYS HG3 1 1 8 4120 1 1 28 LYS HZ1 H -13.214 -5.703 -0.891 1.00 . A A . 28 LYS HZ1 1 1 8 4121 1 1 28 LYS HZ2 H -12.240 -5.278 -2.138 1.00 . A A . 28 LYS HZ2 1 1 8 4122 1 1 28 LYS HZ3 H -13.696 -5.983 -2.427 1.00 . A A . 28 LYS HZ3 1 1 8 4123 1 1 28 LYS N N -11.994 0.688 -2.135 1.00 . A A . 28 LYS N 1 1 8 4124 1 1 28 LYS NZ N -13.208 -5.316 -1.833 1.00 . A A . 28 LYS NZ 1 1 8 4125 1 1 28 LYS O O -13.522 1.541 -4.394 1.00 . A A . 28 LYS O 1 1 8 4126 1 1 29 LYS C C -14.649 0.272 -7.063 1.00 . A A . 29 LYS C 1 1 8 4127 1 1 29 LYS CA C -13.146 0.144 -6.812 1.00 . A A . 29 LYS CA 1 1 8 4128 1 1 29 LYS CB C -12.452 -0.747 -7.861 1.00 . A A . 29 LYS CB 1 1 8 4129 1 1 29 LYS CD C -10.174 -1.149 -9.052 1.00 . A A . 29 LYS CD 1 1 8 4130 1 1 29 LYS CE C -10.892 -1.648 -10.311 1.00 . A A . 29 LYS CE 1 1 8 4131 1 1 29 LYS CG C -11.016 -0.261 -8.125 1.00 . A A . 29 LYS CG 1 1 8 4132 1 1 29 LYS H H -12.620 -1.309 -5.331 1.00 . A A . 29 LYS H 1 1 8 4133 1 1 29 LYS HA H -12.737 1.149 -6.902 1.00 . A A . 29 LYS HA 1 1 8 4134 1 1 29 LYS HB2 H -12.444 -1.787 -7.526 1.00 . A A . 29 LYS HB2 1 1 8 4135 1 1 29 LYS HB3 H -13.014 -0.694 -8.793 1.00 . A A . 29 LYS HB3 1 1 8 4136 1 1 29 LYS HD2 H -9.277 -0.598 -9.344 1.00 . A A . 29 LYS HD2 1 1 8 4137 1 1 29 LYS HD3 H -9.849 -2.024 -8.486 1.00 . A A . 29 LYS HD3 1 1 8 4138 1 1 29 LYS HE2 H -10.184 -2.248 -10.888 1.00 . A A . 29 LYS HE2 1 1 8 4139 1 1 29 LYS HE3 H -11.708 -2.308 -10.007 1.00 . A A . 29 LYS HE3 1 1 8 4140 1 1 29 LYS HG2 H -11.065 0.735 -8.562 1.00 . A A . 29 LYS HG2 1 1 8 4141 1 1 29 LYS HG3 H -10.487 -0.190 -7.174 1.00 . A A . 29 LYS HG3 1 1 8 4142 1 1 29 LYS HZ1 H -12.409 -0.773 -11.410 1.00 . A A . 29 LYS HZ1 1 1 8 4143 1 1 29 LYS HZ2 H -10.904 -0.494 -12.037 1.00 . A A . 29 LYS HZ2 1 1 8 4144 1 1 29 LYS HZ3 H -11.370 0.346 -10.748 1.00 . A A . 29 LYS HZ3 1 1 8 4145 1 1 29 LYS N N -12.862 -0.333 -5.450 1.00 . A A . 29 LYS N 1 1 8 4146 1 1 29 LYS NZ N -11.436 -0.575 -11.174 1.00 . A A . 29 LYS NZ 1 1 8 4147 1 1 29 LYS O O -15.420 -0.615 -6.705 1.00 . A A . 29 LYS O 1 1 8 4148 1 1 30 LYS C C -16.558 2.671 -9.179 1.00 . A A . 30 LYS C 1 1 8 4149 1 1 30 LYS CA C -16.463 1.700 -7.986 1.00 . A A . 30 LYS CA 1 1 8 4150 1 1 30 LYS CB C -17.173 2.206 -6.708 1.00 . A A . 30 LYS CB 1 1 8 4151 1 1 30 LYS CD C -18.862 0.399 -6.110 1.00 . A A . 30 LYS CD 1 1 8 4152 1 1 30 LYS CE C -20.225 -0.202 -6.466 1.00 . A A . 30 LYS CE 1 1 8 4153 1 1 30 LYS CG C -18.657 1.813 -6.675 1.00 . A A . 30 LYS CG 1 1 8 4154 1 1 30 LYS H H -14.362 2.087 -7.881 1.00 . A A . 30 LYS H 1 1 8 4155 1 1 30 LYS HA H -16.943 0.776 -8.303 1.00 . A A . 30 LYS HA 1 1 8 4156 1 1 30 LYS HB2 H -16.694 1.795 -5.816 1.00 . A A . 30 LYS HB2 1 1 8 4157 1 1 30 LYS HB3 H -17.087 3.289 -6.645 1.00 . A A . 30 LYS HB3 1 1 8 4158 1 1 30 LYS HD2 H -18.100 -0.260 -6.522 1.00 . A A . 30 LYS HD2 1 1 8 4159 1 1 30 LYS HD3 H -18.737 0.419 -5.026 1.00 . A A . 30 LYS HD3 1 1 8 4160 1 1 30 LYS HE2 H -20.297 -0.253 -7.554 1.00 . A A . 30 LYS HE2 1 1 8 4161 1 1 30 LYS HE3 H -20.267 -1.225 -6.081 1.00 . A A . 30 LYS HE3 1 1 8 4162 1 1 30 LYS HG2 H -19.185 2.511 -6.032 1.00 . A A . 30 LYS HG2 1 1 8 4163 1 1 30 LYS HG3 H -19.074 1.885 -7.680 1.00 . A A . 30 LYS HG3 1 1 8 4164 1 1 30 LYS HZ1 H -22.245 0.075 -6.171 1.00 . A A . 30 LYS HZ1 1 1 8 4165 1 1 30 LYS HZ2 H -21.440 1.482 -6.399 1.00 . A A . 30 LYS HZ2 1 1 8 4166 1 1 30 LYS HZ3 H -21.339 0.724 -4.950 1.00 . A A . 30 LYS HZ3 1 1 8 4167 1 1 30 LYS N N -15.058 1.389 -7.671 1.00 . A A . 30 LYS N 1 1 8 4168 1 1 30 LYS NZ N -21.380 0.568 -5.954 1.00 . A A . 30 LYS NZ 1 1 8 4169 1 1 30 LYS O O -17.223 3.705 -9.103 1.00 . A A . 30 LYS O 1 1 8 4170 1 1 31 LEU C C -15.295 2.577 -12.655 1.00 . A A . 31 LEU C 1 1 8 4171 1 1 31 LEU CA C -15.512 3.332 -11.333 1.00 . A A . 31 LEU CA 1 1 8 4172 1 1 31 LEU CB C -14.310 4.239 -10.997 1.00 . A A . 31 LEU CB 1 1 8 4173 1 1 31 LEU CD1 C -15.055 6.560 -11.708 1.00 . A A . 31 LEU CD1 1 1 8 4174 1 1 31 LEU CD2 C -12.667 5.944 -11.872 1.00 . A A . 31 LEU CD2 1 1 8 4175 1 1 31 LEU CG C -14.093 5.403 -11.986 1.00 . A A . 31 LEU CG 1 1 8 4176 1 1 31 LEU H H -15.256 1.535 -10.226 1.00 . A A . 31 LEU H 1 1 8 4177 1 1 31 LEU HA H -16.391 3.962 -11.447 1.00 . A A . 31 LEU HA 1 1 8 4178 1 1 31 LEU HB2 H -14.429 4.650 -9.994 1.00 . A A . 31 LEU HB2 1 1 8 4179 1 1 31 LEU HB3 H -13.419 3.609 -11.001 1.00 . A A . 31 LEU HB3 1 1 8 4180 1 1 31 LEU HD11 H -14.905 7.345 -12.450 1.00 . A A . 31 LEU HD11 1 1 8 4181 1 1 31 LEU HD12 H -14.895 6.957 -10.706 1.00 . A A . 31 LEU HD12 1 1 8 4182 1 1 31 LEU HD13 H -16.083 6.213 -11.788 1.00 . A A . 31 LEU HD13 1 1 8 4183 1 1 31 LEU HD21 H -12.476 6.316 -10.866 1.00 . A A . 31 LEU HD21 1 1 8 4184 1 1 31 LEU HD22 H -12.513 6.737 -12.604 1.00 . A A . 31 LEU HD22 1 1 8 4185 1 1 31 LEU HD23 H -11.957 5.147 -12.093 1.00 . A A . 31 LEU HD23 1 1 8 4186 1 1 31 LEU HG H -14.235 5.057 -13.009 1.00 . A A . 31 LEU HG 1 1 8 4187 1 1 31 LEU N N -15.747 2.416 -10.211 1.00 . A A . 31 LEU N 1 1 8 4188 1 1 31 LEU O O -14.473 1.665 -12.733 1.00 . A A . 31 LEU O 1 1 8 4189 1 1 32 LEU C C -14.530 2.917 -15.716 1.00 . A A . 32 LEU C 1 1 8 4190 1 1 32 LEU CA C -15.816 2.428 -15.061 1.00 . A A . 32 LEU CA 1 1 8 4191 1 1 32 LEU CB C -17.052 2.855 -15.894 1.00 . A A . 32 LEU CB 1 1 8 4192 1 1 32 LEU CD1 C -16.400 4.822 -17.435 1.00 . A A . 32 LEU CD1 1 1 8 4193 1 1 32 LEU CD2 C -18.587 4.794 -16.305 1.00 . A A . 32 LEU CD2 1 1 8 4194 1 1 32 LEU CG C -17.117 4.386 -16.149 1.00 . A A . 32 LEU CG 1 1 8 4195 1 1 32 LEU H H -16.674 3.729 -13.576 1.00 . A A . 32 LEU H 1 1 8 4196 1 1 32 LEU HA H -15.789 1.347 -15.004 1.00 . A A . 32 LEU HA 1 1 8 4197 1 1 32 LEU HB2 H -17.049 2.324 -16.847 1.00 . A A . 32 LEU HB2 1 1 8 4198 1 1 32 LEU HB3 H -17.938 2.533 -15.344 1.00 . A A . 32 LEU HB3 1 1 8 4199 1 1 32 LEU HD11 H -15.324 4.704 -17.351 1.00 . A A . 32 LEU HD11 1 1 8 4200 1 1 32 LEU HD12 H -16.590 5.877 -17.615 1.00 . A A . 32 LEU HD12 1 1 8 4201 1 1 32 LEU HD13 H -16.762 4.250 -18.290 1.00 . A A . 32 LEU HD13 1 1 8 4202 1 1 32 LEU HD21 H -18.664 5.865 -16.499 1.00 . A A . 32 LEU HD21 1 1 8 4203 1 1 32 LEU HD22 H -19.132 4.575 -15.388 1.00 . A A . 32 LEU HD22 1 1 8 4204 1 1 32 LEU HD23 H -19.048 4.249 -17.130 1.00 . A A . 32 LEU HD23 1 1 8 4205 1 1 32 LEU HG H -16.704 4.945 -15.308 1.00 . A A . 32 LEU HG 1 1 8 4206 1 1 32 LEU N N -15.962 3.010 -13.719 1.00 . A A . 32 LEU N 1 1 8 4207 1 1 32 LEU O O -14.104 2.411 -16.727 1.00 . A A . 32 LEU O 1 1 8 4208 1 1 32 LEU OXT O -14.023 3.743 -15.284 1.00 . A A . 32 LEU OXT 1 1 9 4209 1 1 1 GLY C C 2.802 -5.765 -3.039 1.00 . A A . 1 GLY C 1 1 9 4210 1 1 1 GLY CA C 3.816 -6.468 -3.926 1.00 . A A . 1 GLY CA 1 1 9 4211 1 1 1 GLY H1 H 4.508 -8.378 -4.193 1.00 . A A . 1 GLY H1 1 1 9 4212 1 1 1 GLY H2 H 4.009 -8.060 -2.658 1.00 . A A . 1 GLY H2 1 1 9 4213 1 1 1 GLY H3 H 2.895 -8.287 -3.871 1.00 . A A . 1 GLY H3 1 1 9 4214 1 1 1 GLY HA2 H 4.803 -6.063 -3.717 1.00 . A A . 1 GLY HA2 1 1 9 4215 1 1 1 GLY HA3 H 3.569 -6.306 -4.974 1.00 . A A . 1 GLY HA3 1 1 9 4216 1 1 1 GLY N N 3.806 -7.910 -3.640 1.00 . A A . 1 GLY N 1 1 9 4217 1 1 1 GLY O O 2.768 -6.056 -1.842 1.00 . A A . 1 GLY O 1 1 9 4218 1 1 2 PRO C C -0.093 -4.901 -2.157 1.00 . A A . 2 PRO C 1 1 9 4219 1 1 2 PRO CA C 1.028 -4.061 -2.789 1.00 . A A . 2 PRO CA 1 1 9 4220 1 1 2 PRO CB C 0.482 -2.985 -3.735 1.00 . A A . 2 PRO CB 1 1 9 4221 1 1 2 PRO CD C 1.950 -4.424 -4.962 1.00 . A A . 2 PRO CD 1 1 9 4222 1 1 2 PRO CG C 0.691 -3.579 -5.125 1.00 . A A . 2 PRO CG 1 1 9 4223 1 1 2 PRO HA H 1.571 -3.551 -1.994 1.00 . A A . 2 PRO HA 1 1 9 4224 1 1 2 PRO HB2 H -0.570 -2.763 -3.551 1.00 . A A . 2 PRO HB2 1 1 9 4225 1 1 2 PRO HB3 H 1.081 -2.079 -3.634 1.00 . A A . 2 PRO HB3 1 1 9 4226 1 1 2 PRO HD2 H 1.912 -5.273 -5.643 1.00 . A A . 2 PRO HD2 1 1 9 4227 1 1 2 PRO HD3 H 2.832 -3.815 -5.160 1.00 . A A . 2 PRO HD3 1 1 9 4228 1 1 2 PRO HG2 H -0.146 -4.226 -5.384 1.00 . A A . 2 PRO HG2 1 1 9 4229 1 1 2 PRO HG3 H 0.819 -2.802 -5.877 1.00 . A A . 2 PRO HG3 1 1 9 4230 1 1 2 PRO N N 1.971 -4.852 -3.575 1.00 . A A . 2 PRO N 1 1 9 4231 1 1 2 PRO O O -0.869 -5.569 -2.848 1.00 . A A . 2 PRO O 1 1 9 4232 1 1 3 TYR C C -2.162 -4.089 0.681 1.00 . A A . 3 TYR C 1 1 9 4233 1 1 3 TYR CA C -1.392 -5.192 -0.045 1.00 . A A . 3 TYR CA 1 1 9 4234 1 1 3 TYR CB C -1.055 -6.442 0.783 1.00 . A A . 3 TYR CB 1 1 9 4235 1 1 3 TYR CD1 C -2.230 -8.305 -0.470 1.00 . A A . 3 TYR CD1 1 1 9 4236 1 1 3 TYR CD2 C 0.198 -8.384 -0.266 1.00 . A A . 3 TYR CD2 1 1 9 4237 1 1 3 TYR CE1 C -2.215 -9.523 -1.174 1.00 . A A . 3 TYR CE1 1 1 9 4238 1 1 3 TYR CE2 C 0.216 -9.611 -0.956 1.00 . A A . 3 TYR CE2 1 1 9 4239 1 1 3 TYR CG C -1.025 -7.735 -0.012 1.00 . A A . 3 TYR CG 1 1 9 4240 1 1 3 TYR CZ C -0.992 -10.186 -1.404 1.00 . A A . 3 TYR CZ 1 1 9 4241 1 1 3 TYR H H 0.450 -4.196 -0.356 1.00 . A A . 3 TYR H 1 1 9 4242 1 1 3 TYR HA H -2.131 -5.557 -0.758 1.00 . A A . 3 TYR HA 1 1 9 4243 1 1 3 TYR HB2 H -0.101 -6.290 1.292 1.00 . A A . 3 TYR HB2 1 1 9 4244 1 1 3 TYR HB3 H -1.814 -6.560 1.557 1.00 . A A . 3 TYR HB3 1 1 9 4245 1 1 3 TYR HD1 H -3.174 -7.824 -0.260 1.00 . A A . 3 TYR HD1 1 1 9 4246 1 1 3 TYR HD2 H 1.125 -7.952 0.089 1.00 . A A . 3 TYR HD2 1 1 9 4247 1 1 3 TYR HE1 H -3.136 -9.976 -1.508 1.00 . A A . 3 TYR HE1 1 1 9 4248 1 1 3 TYR HE2 H 1.151 -10.119 -1.139 1.00 . A A . 3 TYR HE2 1 1 9 4249 1 1 3 TYR HH H -0.270 -11.950 -1.689 1.00 . A A . 3 TYR HH 1 1 9 4250 1 1 3 TYR N N -0.269 -4.713 -0.849 1.00 . A A . 3 TYR N 1 1 9 4251 1 1 3 TYR O O -2.059 -3.935 1.896 1.00 . A A . 3 TYR O 1 1 9 4252 1 1 3 TYR OH O -0.983 -11.389 -2.032 1.00 . A A . 3 TYR OH 1 1 9 4253 1 1 4 CYS C C -4.936 -1.883 -0.150 1.00 . A A . 4 CYS C 1 1 9 4254 1 1 4 CYS CA C -3.482 -2.022 0.337 1.00 . A A . 4 CYS CA 1 1 9 4255 1 1 4 CYS CB C -2.575 -0.842 -0.039 1.00 . A A . 4 CYS CB 1 1 9 4256 1 1 4 CYS H H -2.826 -3.435 -1.100 1.00 . A A . 4 CYS H 1 1 9 4257 1 1 4 CYS HA H -3.532 -2.040 1.426 1.00 . A A . 4 CYS HA 1 1 9 4258 1 1 4 CYS HB2 H -3.104 0.084 0.171 1.00 . A A . 4 CYS HB2 1 1 9 4259 1 1 4 CYS HB3 H -1.698 -0.863 0.611 1.00 . A A . 4 CYS HB3 1 1 9 4260 1 1 4 CYS N N -2.868 -3.271 -0.106 1.00 . A A . 4 CYS N 1 1 9 4261 1 1 4 CYS O O -5.857 -2.155 0.624 1.00 . A A . 4 CYS O 1 1 9 4262 1 1 4 CYS SG S -1.983 -0.785 -1.755 1.00 . A A . 4 CYS SG 1 1 9 4263 1 1 5 GLN C C -7.094 -3.077 -1.893 1.00 . A A . 5 GLN C 1 1 9 4264 1 1 5 GLN CA C -6.520 -1.660 -2.013 1.00 . A A . 5 GLN CA 1 1 9 4265 1 1 5 GLN CB C -6.564 -1.101 -3.455 1.00 . A A . 5 GLN CB 1 1 9 4266 1 1 5 GLN CD C -4.459 -2.127 -4.530 1.00 . A A . 5 GLN CD 1 1 9 4267 1 1 5 GLN CG C -5.971 -1.949 -4.600 1.00 . A A . 5 GLN CG 1 1 9 4268 1 1 5 GLN H H -4.380 -1.446 -2.058 1.00 . A A . 5 GLN H 1 1 9 4269 1 1 5 GLN HA H -7.154 -1.023 -1.401 1.00 . A A . 5 GLN HA 1 1 9 4270 1 1 5 GLN HB2 H -7.612 -0.934 -3.703 1.00 . A A . 5 GLN HB2 1 1 9 4271 1 1 5 GLN HB3 H -6.090 -0.121 -3.460 1.00 . A A . 5 GLN HB3 1 1 9 4272 1 1 5 GLN HE21 H -4.132 -0.756 -5.990 1.00 . A A . 5 GLN HE21 1 1 9 4273 1 1 5 GLN HE22 H -2.707 -1.508 -5.297 1.00 . A A . 5 GLN HE22 1 1 9 4274 1 1 5 GLN HG2 H -6.450 -2.925 -4.642 1.00 . A A . 5 GLN HG2 1 1 9 4275 1 1 5 GLN HG3 H -6.214 -1.465 -5.544 1.00 . A A . 5 GLN HG3 1 1 9 4276 1 1 5 GLN N N -5.166 -1.619 -1.443 1.00 . A A . 5 GLN N 1 1 9 4277 1 1 5 GLN NE2 N -3.707 -1.358 -5.280 1.00 . A A . 5 GLN NE2 1 1 9 4278 1 1 5 GLN O O -8.101 -3.282 -1.211 1.00 . A A . 5 GLN O 1 1 9 4279 1 1 5 GLN OE1 O -3.937 -2.879 -3.711 1.00 . A A . 5 GLN OE1 1 1 9 4280 1 1 6 LYS C C -6.730 -6.091 -0.835 1.00 . A A . 6 LYS C 1 1 9 4281 1 1 6 LYS CA C -6.660 -5.518 -2.257 1.00 . A A . 6 LYS CA 1 1 9 4282 1 1 6 LYS CB C -5.700 -6.315 -3.170 1.00 . A A . 6 LYS CB 1 1 9 4283 1 1 6 LYS CD C -5.432 -7.218 -5.583 1.00 . A A . 6 LYS CD 1 1 9 4284 1 1 6 LYS CE C -4.841 -8.572 -5.172 1.00 . A A . 6 LYS CE 1 1 9 4285 1 1 6 LYS CG C -6.346 -6.547 -4.547 1.00 . A A . 6 LYS CG 1 1 9 4286 1 1 6 LYS H H -5.467 -3.831 -2.808 1.00 . A A . 6 LYS H 1 1 9 4287 1 1 6 LYS HA H -7.675 -5.644 -2.642 1.00 . A A . 6 LYS HA 1 1 9 4288 1 1 6 LYS HB2 H -4.759 -5.777 -3.288 1.00 . A A . 6 LYS HB2 1 1 9 4289 1 1 6 LYS HB3 H -5.469 -7.281 -2.723 1.00 . A A . 6 LYS HB3 1 1 9 4290 1 1 6 LYS HD2 H -5.997 -7.348 -6.508 1.00 . A A . 6 LYS HD2 1 1 9 4291 1 1 6 LYS HD3 H -4.605 -6.543 -5.800 1.00 . A A . 6 LYS HD3 1 1 9 4292 1 1 6 LYS HE2 H -4.203 -8.929 -5.986 1.00 . A A . 6 LYS HE2 1 1 9 4293 1 1 6 LYS HE3 H -4.204 -8.440 -4.294 1.00 . A A . 6 LYS HE3 1 1 9 4294 1 1 6 LYS HG2 H -7.237 -7.162 -4.416 1.00 . A A . 6 LYS HG2 1 1 9 4295 1 1 6 LYS HG3 H -6.658 -5.583 -4.952 1.00 . A A . 6 LYS HG3 1 1 9 4296 1 1 6 LYS HZ1 H -6.558 -9.689 -5.624 1.00 . A A . 6 LYS HZ1 1 1 9 4297 1 1 6 LYS HZ2 H -6.364 -9.418 -4.012 1.00 . A A . 6 LYS HZ2 1 1 9 4298 1 1 6 LYS HZ3 H -5.433 -10.512 -4.782 1.00 . A A . 6 LYS HZ3 1 1 9 4299 1 1 6 LYS N N -6.328 -4.085 -2.334 1.00 . A A . 6 LYS N 1 1 9 4300 1 1 6 LYS NZ N -5.870 -9.596 -4.884 1.00 . A A . 6 LYS NZ 1 1 9 4301 1 1 6 LYS O O -7.099 -7.252 -0.675 1.00 . A A . 6 LYS O 1 1 9 4302 1 1 7 TRP C C -7.158 -4.725 2.546 1.00 . A A . 7 TRP C 1 1 9 4303 1 1 7 TRP CA C -6.449 -5.712 1.599 1.00 . A A . 7 TRP CA 1 1 9 4304 1 1 7 TRP CB C -5.002 -6.080 1.956 1.00 . A A . 7 TRP CB 1 1 9 4305 1 1 7 TRP CD1 C -5.091 -7.820 3.784 1.00 . A A . 7 TRP CD1 1 1 9 4306 1 1 7 TRP CD2 C -4.244 -5.874 4.506 1.00 . A A . 7 TRP CD2 1 1 9 4307 1 1 7 TRP CE2 C -4.222 -6.774 5.612 1.00 . A A . 7 TRP CE2 1 1 9 4308 1 1 7 TRP CE3 C -3.794 -4.558 4.743 1.00 . A A . 7 TRP CE3 1 1 9 4309 1 1 7 TRP CG C -4.727 -6.599 3.331 1.00 . A A . 7 TRP CG 1 1 9 4310 1 1 7 TRP CH2 C -3.306 -5.089 7.077 1.00 . A A . 7 TRP CH2 1 1 9 4311 1 1 7 TRP CZ2 C -3.756 -6.403 6.879 1.00 . A A . 7 TRP CZ2 1 1 9 4312 1 1 7 TRP CZ3 C -3.323 -4.171 6.011 1.00 . A A . 7 TRP CZ3 1 1 9 4313 1 1 7 TRP H H -6.247 -4.322 -0.005 1.00 . A A . 7 TRP H 1 1 9 4314 1 1 7 TRP HA H -7.029 -6.632 1.693 1.00 . A A . 7 TRP HA 1 1 9 4315 1 1 7 TRP HB2 H -4.647 -6.824 1.242 1.00 . A A . 7 TRP HB2 1 1 9 4316 1 1 7 TRP HB3 H -4.398 -5.186 1.823 1.00 . A A . 7 TRP HB3 1 1 9 4317 1 1 7 TRP HD1 H -5.560 -8.592 3.186 1.00 . A A . 7 TRP HD1 1 1 9 4318 1 1 7 TRP HE1 H -4.881 -8.800 5.647 1.00 . A A . 7 TRP HE1 1 1 9 4319 1 1 7 TRP HE3 H -3.802 -3.846 3.933 1.00 . A A . 7 TRP HE3 1 1 9 4320 1 1 7 TRP HH2 H -2.956 -4.780 8.050 1.00 . A A . 7 TRP HH2 1 1 9 4321 1 1 7 TRP HZ2 H -3.751 -7.117 7.689 1.00 . A A . 7 TRP HZ2 1 1 9 4322 1 1 7 TRP HZ3 H -2.962 -3.165 6.164 1.00 . A A . 7 TRP HZ3 1 1 9 4323 1 1 7 TRP N N -6.470 -5.287 0.195 1.00 . A A . 7 TRP N 1 1 9 4324 1 1 7 TRP NE1 N -4.738 -7.946 5.110 1.00 . A A . 7 TRP NE1 1 1 9 4325 1 1 7 TRP O O -7.030 -4.816 3.761 1.00 . A A . 7 TRP O 1 1 9 4326 1 1 8 MET C C -8.181 -2.079 3.808 1.00 . A A . 8 MET C 1 1 9 4327 1 1 8 MET CA C -8.900 -2.965 2.770 1.00 . A A . 8 MET CA 1 1 9 4328 1 1 8 MET CB C -10.087 -3.795 3.313 1.00 . A A . 8 MET CB 1 1 9 4329 1 1 8 MET CE C -13.209 -5.338 0.941 1.00 . A A . 8 MET CE 1 1 9 4330 1 1 8 MET CG C -10.984 -4.235 2.145 1.00 . A A . 8 MET CG 1 1 9 4331 1 1 8 MET H H -8.051 -3.793 0.990 1.00 . A A . 8 MET H 1 1 9 4332 1 1 8 MET HA H -9.318 -2.256 2.058 1.00 . A A . 8 MET HA 1 1 9 4333 1 1 8 MET HB2 H -9.726 -4.671 3.852 1.00 . A A . 8 MET HB2 1 1 9 4334 1 1 8 MET HB3 H -10.675 -3.204 4.012 1.00 . A A . 8 MET HB3 1 1 9 4335 1 1 8 MET HE1 H -14.227 -5.720 1.008 1.00 . A A . 8 MET HE1 1 1 9 4336 1 1 8 MET HE2 H -13.178 -4.501 0.243 1.00 . A A . 8 MET HE2 1 1 9 4337 1 1 8 MET HE3 H -12.556 -6.133 0.578 1.00 . A A . 8 MET HE3 1 1 9 4338 1 1 8 MET HG2 H -11.095 -3.403 1.450 1.00 . A A . 8 MET HG2 1 1 9 4339 1 1 8 MET HG3 H -10.478 -5.039 1.619 1.00 . A A . 8 MET HG3 1 1 9 4340 1 1 8 MET N N -7.994 -3.830 1.999 1.00 . A A . 8 MET N 1 1 9 4341 1 1 8 MET O O -8.484 -2.107 4.995 1.00 . A A . 8 MET O 1 1 9 4342 1 1 8 MET SD S -12.652 -4.791 2.578 1.00 . A A . 8 MET SD 1 1 9 4343 1 1 9 GLN C C -6.607 0.537 5.123 1.00 . A A . 9 GLN C 1 1 9 4344 1 1 9 GLN CA C -6.192 -0.505 4.042 1.00 . A A . 9 GLN CA 1 1 9 4345 1 1 9 GLN CB C -5.261 0.148 2.993 1.00 . A A . 9 GLN CB 1 1 9 4346 1 1 9 GLN CD C -5.061 1.725 0.975 1.00 . A A . 9 GLN CD 1 1 9 4347 1 1 9 GLN CG C -5.963 1.174 2.078 1.00 . A A . 9 GLN CG 1 1 9 4348 1 1 9 GLN H H -7.026 -1.422 2.332 1.00 . A A . 9 GLN H 1 1 9 4349 1 1 9 GLN HA H -5.588 -1.239 4.575 1.00 . A A . 9 GLN HA 1 1 9 4350 1 1 9 GLN HB2 H -4.418 0.624 3.495 1.00 . A A . 9 GLN HB2 1 1 9 4351 1 1 9 GLN HB3 H -4.842 -0.639 2.378 1.00 . A A . 9 GLN HB3 1 1 9 4352 1 1 9 GLN HE21 H -3.684 2.445 2.271 1.00 . A A . 9 GLN HE21 1 1 9 4353 1 1 9 GLN HE22 H -3.360 2.723 0.574 1.00 . A A . 9 GLN HE22 1 1 9 4354 1 1 9 GLN HG2 H -6.825 0.709 1.600 1.00 . A A . 9 GLN HG2 1 1 9 4355 1 1 9 GLN HG3 H -6.322 2.009 2.678 1.00 . A A . 9 GLN HG3 1 1 9 4356 1 1 9 GLN N N -7.222 -1.282 3.316 1.00 . A A . 9 GLN N 1 1 9 4357 1 1 9 GLN NE2 N -3.947 2.341 1.309 1.00 . A A . 9 GLN NE2 1 1 9 4358 1 1 9 GLN O O -5.846 1.476 5.354 1.00 . A A . 9 GLN O 1 1 9 4359 1 1 9 GLN OE1 O -5.240 1.450 -0.202 1.00 . A A . 9 GLN OE1 1 1 9 4360 1 1 10 THR C C -8.255 2.855 6.355 1.00 . A A . 10 THR C 1 1 9 4361 1 1 10 THR CA C -8.195 1.398 6.849 1.00 . A A . 10 THR CA 1 1 9 4362 1 1 10 THR CB C -7.388 1.204 8.144 1.00 . A A . 10 THR CB 1 1 9 4363 1 1 10 THR CG2 C -7.964 1.958 9.343 1.00 . A A . 10 THR CG2 1 1 9 4364 1 1 10 THR H H -8.329 -0.381 5.638 1.00 . A A . 10 THR H 1 1 9 4365 1 1 10 THR HA H -9.216 1.137 7.117 1.00 . A A . 10 THR HA 1 1 9 4366 1 1 10 THR HB H -6.352 1.503 7.990 1.00 . A A . 10 THR HB 1 1 9 4367 1 1 10 THR HG1 H -6.802 -0.638 7.924 1.00 . A A . 10 THR HG1 1 1 9 4368 1 1 10 THR HG21 H -7.491 1.603 10.257 1.00 . A A . 10 THR HG21 1 1 9 4369 1 1 10 THR HG22 H -9.037 1.795 9.408 1.00 . A A . 10 THR HG22 1 1 9 4370 1 1 10 THR HG23 H -7.771 3.026 9.250 1.00 . A A . 10 THR HG23 1 1 9 4371 1 1 10 THR N N -7.763 0.449 5.789 1.00 . A A . 10 THR N 1 1 9 4372 1 1 10 THR O O -7.553 3.749 6.830 1.00 . A A . 10 THR O 1 1 9 4373 1 1 10 THR OG1 O -7.435 -0.161 8.507 1.00 . A A . 10 THR OG1 1 1 9 4374 1 1 11 CYS C C -10.072 5.370 5.337 1.00 . A A . 11 CYS C 1 1 9 4375 1 1 11 CYS CA C -9.169 4.362 4.606 1.00 . A A . 11 CYS CA 1 1 9 4376 1 1 11 CYS CB C -9.532 4.138 3.131 1.00 . A A . 11 CYS CB 1 1 9 4377 1 1 11 CYS H H -9.649 2.315 5.019 1.00 . A A . 11 CYS H 1 1 9 4378 1 1 11 CYS HA H -8.173 4.808 4.606 1.00 . A A . 11 CYS HA 1 1 9 4379 1 1 11 CYS HB2 H -9.212 3.138 2.844 1.00 . A A . 11 CYS HB2 1 1 9 4380 1 1 11 CYS HB3 H -10.611 4.197 2.983 1.00 . A A . 11 CYS HB3 1 1 9 4381 1 1 11 CYS N N -9.055 3.081 5.310 1.00 . A A . 11 CYS N 1 1 9 4382 1 1 11 CYS O O -11.180 5.672 4.902 1.00 . A A . 11 CYS O 1 1 9 4383 1 1 11 CYS SG S -8.685 5.289 2.017 1.00 . A A . 11 CYS SG 1 1 9 4384 1 1 12 ASP C C -9.048 8.333 6.523 1.00 . A A . 12 ASP C 1 1 9 4385 1 1 12 ASP CA C -9.907 7.164 7.050 1.00 . A A . 12 ASP CA 1 1 9 4386 1 1 12 ASP CB C -9.963 7.039 8.584 1.00 . A A . 12 ASP CB 1 1 9 4387 1 1 12 ASP CG C -11.297 6.467 9.059 1.00 . A A . 12 ASP CG 1 1 9 4388 1 1 12 ASP H H -8.711 5.433 6.793 1.00 . A A . 12 ASP H 1 1 9 4389 1 1 12 ASP HA H -10.918 7.417 6.723 1.00 . A A . 12 ASP HA 1 1 9 4390 1 1 12 ASP HB2 H -9.137 6.415 8.932 1.00 . A A . 12 ASP HB2 1 1 9 4391 1 1 12 ASP HB3 H -9.850 8.016 9.051 1.00 . A A . 12 ASP HB3 1 1 9 4392 1 1 12 ASP N N -9.570 5.861 6.468 1.00 . A A . 12 ASP N 1 1 9 4393 1 1 12 ASP O O -8.270 8.157 5.580 1.00 . A A . 12 ASP O 1 1 9 4394 1 1 12 ASP OD1 O -12.359 7.013 8.680 1.00 . A A . 12 ASP OD1 1 1 9 4395 1 1 12 ASP OD2 O -11.300 5.529 9.886 1.00 . A A . 12 ASP OD2 1 1 9 4396 1 1 13 SER C C -6.896 10.764 7.036 1.00 . A A . 13 SER C 1 1 9 4397 1 1 13 SER CA C -8.418 10.757 6.750 1.00 . A A . 13 SER CA 1 1 9 4398 1 1 13 SER CB C -9.129 11.987 7.320 1.00 . A A . 13 SER CB 1 1 9 4399 1 1 13 SER H H -9.804 9.617 7.890 1.00 . A A . 13 SER H 1 1 9 4400 1 1 13 SER HA H -8.499 10.852 5.670 1.00 . A A . 13 SER HA 1 1 9 4401 1 1 13 SER HB2 H -8.537 12.879 7.123 1.00 . A A . 13 SER HB2 1 1 9 4402 1 1 13 SER HB3 H -10.086 12.104 6.809 1.00 . A A . 13 SER HB3 1 1 9 4403 1 1 13 SER HG H -8.592 11.499 9.171 1.00 . A A . 13 SER HG 1 1 9 4404 1 1 13 SER N N -9.156 9.529 7.117 1.00 . A A . 13 SER N 1 1 9 4405 1 1 13 SER O O -6.305 11.799 7.354 1.00 . A A . 13 SER O 1 1 9 4406 1 1 13 SER OG O -9.381 11.862 8.707 1.00 . A A . 13 SER OG 1 1 9 4407 1 1 14 GLU C C -4.262 8.403 6.001 1.00 . A A . 14 GLU C 1 1 9 4408 1 1 14 GLU CA C -4.802 9.388 7.049 1.00 . A A . 14 GLU CA 1 1 9 4409 1 1 14 GLU CB C -4.464 8.925 8.489 1.00 . A A . 14 GLU CB 1 1 9 4410 1 1 14 GLU CD C -3.355 11.121 9.226 1.00 . A A . 14 GLU CD 1 1 9 4411 1 1 14 GLU CG C -4.418 10.059 9.506 1.00 . A A . 14 GLU CG 1 1 9 4412 1 1 14 GLU H H -6.806 8.829 6.571 1.00 . A A . 14 GLU H 1 1 9 4413 1 1 14 GLU HA H -4.289 10.329 6.850 1.00 . A A . 14 GLU HA 1 1 9 4414 1 1 14 GLU HB2 H -5.199 8.184 8.809 1.00 . A A . 14 GLU HB2 1 1 9 4415 1 1 14 GLU HB3 H -3.486 8.449 8.531 1.00 . A A . 14 GLU HB3 1 1 9 4416 1 1 14 GLU HG2 H -5.389 10.536 9.533 1.00 . A A . 14 GLU HG2 1 1 9 4417 1 1 14 GLU HG3 H -4.223 9.626 10.485 1.00 . A A . 14 GLU HG3 1 1 9 4418 1 1 14 GLU N N -6.246 9.608 6.901 1.00 . A A . 14 GLU N 1 1 9 4419 1 1 14 GLU O O -3.526 7.474 6.358 1.00 . A A . 14 GLU O 1 1 9 4420 1 1 14 GLU OE1 O -3.496 12.220 9.812 1.00 . A A . 14 GLU OE1 1 1 9 4421 1 1 14 GLU OE2 O -2.417 10.899 8.416 1.00 . A A . 14 GLU OE2 1 1 9 4422 1 1 15 ARG C C -3.905 7.869 2.364 1.00 . A A . 15 ARG C 1 1 9 4423 1 1 15 ARG CA C -4.381 7.435 3.754 1.00 . A A . 15 ARG CA 1 1 9 4424 1 1 15 ARG CB C -5.585 6.474 3.665 1.00 . A A . 15 ARG CB 1 1 9 4425 1 1 15 ARG CD C -5.024 4.162 4.511 1.00 . A A . 15 ARG CD 1 1 9 4426 1 1 15 ARG CG C -5.130 5.056 3.258 1.00 . A A . 15 ARG CG 1 1 9 4427 1 1 15 ARG CZ C -3.711 4.205 6.606 1.00 . A A . 15 ARG CZ 1 1 9 4428 1 1 15 ARG H H -5.312 9.256 4.471 1.00 . A A . 15 ARG H 1 1 9 4429 1 1 15 ARG HA H -3.538 6.870 4.144 1.00 . A A . 15 ARG HA 1 1 9 4430 1 1 15 ARG HB2 H -6.121 6.436 4.616 1.00 . A A . 15 ARG HB2 1 1 9 4431 1 1 15 ARG HB3 H -6.290 6.854 2.925 1.00 . A A . 15 ARG HB3 1 1 9 4432 1 1 15 ARG HD2 H -6.011 4.052 4.935 1.00 . A A . 15 ARG HD2 1 1 9 4433 1 1 15 ARG HD3 H -4.594 3.219 4.202 1.00 . A A . 15 ARG HD3 1 1 9 4434 1 1 15 ARG HE H -4.019 5.795 5.496 1.00 . A A . 15 ARG HE 1 1 9 4435 1 1 15 ARG HG2 H -5.872 4.618 2.591 1.00 . A A . 15 ARG HG2 1 1 9 4436 1 1 15 ARG HG3 H -4.174 5.076 2.736 1.00 . A A . 15 ARG HG3 1 1 9 4437 1 1 15 ARG HH11 H -4.579 2.426 6.301 1.00 . A A . 15 ARG HH11 1 1 9 4438 1 1 15 ARG HH12 H -3.667 2.569 7.776 1.00 . A A . 15 ARG HH12 1 1 9 4439 1 1 15 ARG HH21 H -2.873 5.875 7.289 1.00 . A A . 15 ARG HH21 1 1 9 4440 1 1 15 ARG HH22 H -2.706 4.429 8.312 1.00 . A A . 15 ARG HH22 1 1 9 4441 1 1 15 ARG N N -4.677 8.502 4.727 1.00 . A A . 15 ARG N 1 1 9 4442 1 1 15 ARG NE N -4.141 4.790 5.503 1.00 . A A . 15 ARG NE 1 1 9 4443 1 1 15 ARG NH1 N -3.946 2.959 6.885 1.00 . A A . 15 ARG NH1 1 1 9 4444 1 1 15 ARG NH2 N -3.025 4.892 7.466 1.00 . A A . 15 ARG NH2 1 1 9 4445 1 1 15 ARG O O -4.693 8.348 1.550 1.00 . A A . 15 ARG O 1 1 9 4446 1 1 16 LYS C C -3.210 5.793 0.063 1.00 . A A . 16 LYS C 1 1 9 4447 1 1 16 LYS CA C -2.332 6.918 0.648 1.00 . A A . 16 LYS CA 1 1 9 4448 1 1 16 LYS CB C -0.826 6.574 0.644 1.00 . A A . 16 LYS CB 1 1 9 4449 1 1 16 LYS CD C 1.117 5.151 1.565 1.00 . A A . 16 LYS CD 1 1 9 4450 1 1 16 LYS CE C 1.511 4.674 0.163 1.00 . A A . 16 LYS CE 1 1 9 4451 1 1 16 LYS CG C -0.373 5.505 1.664 1.00 . A A . 16 LYS CG 1 1 9 4452 1 1 16 LYS H H -2.118 7.081 2.768 1.00 . A A . 16 LYS H 1 1 9 4453 1 1 16 LYS HA H -2.467 7.781 -0.006 1.00 . A A . 16 LYS HA 1 1 9 4454 1 1 16 LYS HB2 H -0.574 6.239 -0.360 1.00 . A A . 16 LYS HB2 1 1 9 4455 1 1 16 LYS HB3 H -0.260 7.486 0.832 1.00 . A A . 16 LYS HB3 1 1 9 4456 1 1 16 LYS HD2 H 1.718 6.022 1.821 1.00 . A A . 16 LYS HD2 1 1 9 4457 1 1 16 LYS HD3 H 1.322 4.363 2.292 1.00 . A A . 16 LYS HD3 1 1 9 4458 1 1 16 LYS HE2 H 0.720 4.037 -0.241 1.00 . A A . 16 LYS HE2 1 1 9 4459 1 1 16 LYS HE3 H 1.607 5.549 -0.484 1.00 . A A . 16 LYS HE3 1 1 9 4460 1 1 16 LYS HG2 H -0.564 5.862 2.675 1.00 . A A . 16 LYS HG2 1 1 9 4461 1 1 16 LYS HG3 H -0.941 4.587 1.529 1.00 . A A . 16 LYS HG3 1 1 9 4462 1 1 16 LYS HZ1 H 3.135 3.726 -0.747 1.00 . A A . 16 LYS HZ1 1 1 9 4463 1 1 16 LYS HZ2 H 2.659 3.052 0.682 1.00 . A A . 16 LYS HZ2 1 1 9 4464 1 1 16 LYS HZ3 H 3.508 4.458 0.662 1.00 . A A . 16 LYS HZ3 1 1 9 4465 1 1 16 LYS N N -2.743 7.317 2.003 1.00 . A A . 16 LYS N 1 1 9 4466 1 1 16 LYS NZ N 2.784 3.930 0.186 1.00 . A A . 16 LYS NZ 1 1 9 4467 1 1 16 LYS O O -2.780 4.649 -0.081 1.00 . A A . 16 LYS O 1 1 9 4468 1 1 17 CYS C C -4.813 4.674 -2.186 1.00 . A A . 17 CYS C 1 1 9 4469 1 1 17 CYS CA C -5.396 5.118 -0.837 1.00 . A A . 17 CYS CA 1 1 9 4470 1 1 17 CYS CB C -6.780 5.750 -1.010 1.00 . A A . 17 CYS CB 1 1 9 4471 1 1 17 CYS H H -4.803 7.021 -0.023 1.00 . A A . 17 CYS H 1 1 9 4472 1 1 17 CYS HA H -5.493 4.248 -0.190 1.00 . A A . 17 CYS HA 1 1 9 4473 1 1 17 CYS HB2 H -7.105 6.147 -0.050 1.00 . A A . 17 CYS HB2 1 1 9 4474 1 1 17 CYS HB3 H -6.692 6.593 -1.694 1.00 . A A . 17 CYS HB3 1 1 9 4475 1 1 17 CYS N N -4.487 6.075 -0.200 1.00 . A A . 17 CYS N 1 1 9 4476 1 1 17 CYS O O -4.482 5.515 -3.031 1.00 . A A . 17 CYS O 1 1 9 4477 1 1 17 CYS SG S -8.078 4.644 -1.641 1.00 . A A . 17 CYS SG 1 1 9 4478 1 1 18 CYS C C -4.474 3.116 -4.869 1.00 . A A . 18 CYS C 1 1 9 4479 1 1 18 CYS CA C -3.803 2.886 -3.500 1.00 . A A . 18 CYS CA 1 1 9 4480 1 1 18 CYS CB C -3.424 1.424 -3.261 1.00 . A A . 18 CYS CB 1 1 9 4481 1 1 18 CYS H H -4.852 2.713 -1.639 1.00 . A A . 18 CYS H 1 1 9 4482 1 1 18 CYS HA H -2.873 3.456 -3.527 1.00 . A A . 18 CYS HA 1 1 9 4483 1 1 18 CYS HB2 H -4.273 0.896 -2.830 1.00 . A A . 18 CYS HB2 1 1 9 4484 1 1 18 CYS HB3 H -3.183 0.970 -4.222 1.00 . A A . 18 CYS HB3 1 1 9 4485 1 1 18 CYS N N -4.598 3.370 -2.371 1.00 . A A . 18 CYS N 1 1 9 4486 1 1 18 CYS O O -3.771 3.168 -5.875 1.00 . A A . 18 CYS O 1 1 9 4487 1 1 18 CYS SG S -1.980 1.203 -2.188 1.00 . A A . 18 CYS SG 1 1 9 4488 1 1 19 GLU C C -7.498 4.920 -5.928 1.00 . A A . 19 GLU C 1 1 9 4489 1 1 19 GLU CA C -6.550 3.715 -6.120 1.00 . A A . 19 GLU CA 1 1 9 4490 1 1 19 GLU CB C -7.360 2.460 -6.486 1.00 . A A . 19 GLU CB 1 1 9 4491 1 1 19 GLU CD C -5.443 1.141 -7.596 1.00 . A A . 19 GLU CD 1 1 9 4492 1 1 19 GLU CG C -6.578 1.141 -6.572 1.00 . A A . 19 GLU CG 1 1 9 4493 1 1 19 GLU H H -6.252 3.572 -4.030 1.00 . A A . 19 GLU H 1 1 9 4494 1 1 19 GLU HA H -5.882 3.953 -6.950 1.00 . A A . 19 GLU HA 1 1 9 4495 1 1 19 GLU HB2 H -8.120 2.322 -5.721 1.00 . A A . 19 GLU HB2 1 1 9 4496 1 1 19 GLU HB3 H -7.854 2.636 -7.440 1.00 . A A . 19 GLU HB3 1 1 9 4497 1 1 19 GLU HG2 H -6.172 0.906 -5.587 1.00 . A A . 19 GLU HG2 1 1 9 4498 1 1 19 GLU HG3 H -7.280 0.346 -6.831 1.00 . A A . 19 GLU HG3 1 1 9 4499 1 1 19 GLU N N -5.768 3.446 -4.907 1.00 . A A . 19 GLU N 1 1 9 4500 1 1 19 GLU O O -7.649 5.437 -4.821 1.00 . A A . 19 GLU O 1 1 9 4501 1 1 19 GLU OE1 O -4.515 0.307 -7.437 1.00 . A A . 19 GLU OE1 1 1 9 4502 1 1 19 GLU OE2 O -5.471 1.957 -8.549 1.00 . A A . 19 GLU OE2 1 1 9 4503 1 1 20 GLY C C -10.465 6.359 -6.667 1.00 . A A . 20 GLY C 1 1 9 4504 1 1 20 GLY CA C -8.995 6.578 -7.048 1.00 . A A . 20 GLY CA 1 1 9 4505 1 1 20 GLY H H -7.962 4.925 -7.895 1.00 . A A . 20 GLY H 1 1 9 4506 1 1 20 GLY HA2 H -8.577 7.336 -6.387 1.00 . A A . 20 GLY HA2 1 1 9 4507 1 1 20 GLY HA3 H -8.981 6.977 -8.062 1.00 . A A . 20 GLY HA3 1 1 9 4508 1 1 20 GLY N N -8.140 5.378 -7.008 1.00 . A A . 20 GLY N 1 1 9 4509 1 1 20 GLY O O -11.202 7.337 -6.512 1.00 . A A . 20 GLY O 1 1 9 4510 1 1 21 MET C C -12.511 5.075 -4.579 1.00 . A A . 21 MET C 1 1 9 4511 1 1 21 MET CA C -12.170 4.601 -6.012 1.00 . A A . 21 MET CA 1 1 9 4512 1 1 21 MET CB C -12.129 3.060 -6.122 1.00 . A A . 21 MET CB 1 1 9 4513 1 1 21 MET CE C -10.327 0.559 -7.303 1.00 . A A . 21 MET CE 1 1 9 4514 1 1 21 MET CG C -11.018 2.426 -5.261 1.00 . A A . 21 MET CG 1 1 9 4515 1 1 21 MET H H -10.218 4.391 -6.810 1.00 . A A . 21 MET H 1 1 9 4516 1 1 21 MET HA H -12.961 4.967 -6.668 1.00 . A A . 21 MET HA 1 1 9 4517 1 1 21 MET HB2 H -13.093 2.640 -5.841 1.00 . A A . 21 MET HB2 1 1 9 4518 1 1 21 MET HB3 H -11.965 2.805 -7.167 1.00 . A A . 21 MET HB3 1 1 9 4519 1 1 21 MET HE1 H -10.043 -0.461 -7.561 1.00 . A A . 21 MET HE1 1 1 9 4520 1 1 21 MET HE2 H -11.217 0.836 -7.865 1.00 . A A . 21 MET HE2 1 1 9 4521 1 1 21 MET HE3 H -9.515 1.227 -7.572 1.00 . A A . 21 MET HE3 1 1 9 4522 1 1 21 MET HG2 H -10.096 2.975 -5.425 1.00 . A A . 21 MET HG2 1 1 9 4523 1 1 21 MET HG3 H -11.281 2.558 -4.211 1.00 . A A . 21 MET HG3 1 1 9 4524 1 1 21 MET N N -10.878 5.098 -6.514 1.00 . A A . 21 MET N 1 1 9 4525 1 1 21 MET O O -11.957 6.058 -4.087 1.00 . A A . 21 MET O 1 1 9 4526 1 1 21 MET SD S -10.654 0.661 -5.523 1.00 . A A . 21 MET SD 1 1 9 4527 1 1 22 VAL C C -12.721 4.856 -1.558 1.00 . A A . 22 VAL C 1 1 9 4528 1 1 22 VAL CA C -13.894 4.749 -2.538 1.00 . A A . 22 VAL CA 1 1 9 4529 1 1 22 VAL CB C -14.973 3.784 -1.991 1.00 . A A . 22 VAL CB 1 1 9 4530 1 1 22 VAL CG1 C -15.731 4.392 -0.803 1.00 . A A . 22 VAL CG1 1 1 9 4531 1 1 22 VAL CG2 C -16.021 3.402 -3.040 1.00 . A A . 22 VAL CG2 1 1 9 4532 1 1 22 VAL H H -13.872 3.595 -4.333 1.00 . A A . 22 VAL H 1 1 9 4533 1 1 22 VAL HA H -14.365 5.729 -2.590 1.00 . A A . 22 VAL HA 1 1 9 4534 1 1 22 VAL HB H -14.490 2.863 -1.661 1.00 . A A . 22 VAL HB 1 1 9 4535 1 1 22 VAL HG11 H -16.545 3.734 -0.497 1.00 . A A . 22 VAL HG11 1 1 9 4536 1 1 22 VAL HG12 H -15.066 4.509 0.049 1.00 . A A . 22 VAL HG12 1 1 9 4537 1 1 22 VAL HG13 H -16.156 5.357 -1.082 1.00 . A A . 22 VAL HG13 1 1 9 4538 1 1 22 VAL HG21 H -15.563 2.846 -3.855 1.00 . A A . 22 VAL HG21 1 1 9 4539 1 1 22 VAL HG22 H -16.782 2.768 -2.586 1.00 . A A . 22 VAL HG22 1 1 9 4540 1 1 22 VAL HG23 H -16.494 4.303 -3.430 1.00 . A A . 22 VAL HG23 1 1 9 4541 1 1 22 VAL N N -13.472 4.420 -3.914 1.00 . A A . 22 VAL N 1 1 9 4542 1 1 22 VAL O O -11.820 4.028 -1.609 1.00 . A A . 22 VAL O 1 1 9 4543 1 1 23 CYS C C -12.823 6.098 1.811 1.00 . A A . 23 CYS C 1 1 9 4544 1 1 23 CYS CA C -11.947 5.840 0.582 1.00 . A A . 23 CYS CA 1 1 9 4545 1 1 23 CYS CB C -10.807 6.850 0.427 1.00 . A A . 23 CYS CB 1 1 9 4546 1 1 23 CYS H H -13.523 6.489 -0.695 1.00 . A A . 23 CYS H 1 1 9 4547 1 1 23 CYS HA H -11.481 4.863 0.719 1.00 . A A . 23 CYS HA 1 1 9 4548 1 1 23 CYS HB2 H -10.184 6.555 -0.418 1.00 . A A . 23 CYS HB2 1 1 9 4549 1 1 23 CYS HB3 H -11.236 7.828 0.208 1.00 . A A . 23 CYS HB3 1 1 9 4550 1 1 23 CYS N N -12.793 5.798 -0.614 1.00 . A A . 23 CYS N 1 1 9 4551 1 1 23 CYS O O -13.003 7.237 2.252 1.00 . A A . 23 CYS O 1 1 9 4552 1 1 23 CYS SG S -9.760 7.013 1.907 1.00 . A A . 23 CYS SG 1 1 9 4553 1 1 24 ARG C C -14.059 3.564 4.102 1.00 . A A . 24 ARG C 1 1 9 4554 1 1 24 ARG CA C -14.240 4.953 3.517 1.00 . A A . 24 ARG CA 1 1 9 4555 1 1 24 ARG CB C -15.744 5.240 3.317 1.00 . A A . 24 ARG CB 1 1 9 4556 1 1 24 ARG CD C -16.263 6.979 1.614 1.00 . A A . 24 ARG CD 1 1 9 4557 1 1 24 ARG CG C -16.113 6.721 3.125 1.00 . A A . 24 ARG CG 1 1 9 4558 1 1 24 ARG CZ C -17.921 8.817 1.505 1.00 . A A . 24 ARG CZ 1 1 9 4559 1 1 24 ARG H H -13.300 4.148 1.789 1.00 . A A . 24 ARG H 1 1 9 4560 1 1 24 ARG HA H -13.833 5.672 4.232 1.00 . A A . 24 ARG HA 1 1 9 4561 1 1 24 ARG HB2 H -16.137 4.629 2.503 1.00 . A A . 24 ARG HB2 1 1 9 4562 1 1 24 ARG HB3 H -16.259 4.914 4.221 1.00 . A A . 24 ARG HB3 1 1 9 4563 1 1 24 ARG HD2 H -15.320 6.835 1.118 1.00 . A A . 24 ARG HD2 1 1 9 4564 1 1 24 ARG HD3 H -17.008 6.321 1.198 1.00 . A A . 24 ARG HD3 1 1 9 4565 1 1 24 ARG HE H -15.969 9.102 1.500 1.00 . A A . 24 ARG HE 1 1 9 4566 1 1 24 ARG HG2 H -17.068 6.909 3.618 1.00 . A A . 24 ARG HG2 1 1 9 4567 1 1 24 ARG HG3 H -15.356 7.371 3.567 1.00 . A A . 24 ARG HG3 1 1 9 4568 1 1 24 ARG HH11 H -18.819 7.065 1.868 1.00 . A A . 24 ARG HH11 1 1 9 4569 1 1 24 ARG HH12 H -19.869 8.470 1.847 1.00 . A A . 24 ARG HH12 1 1 9 4570 1 1 24 ARG HH21 H -17.399 10.696 1.010 1.00 . A A . 24 ARG HH21 1 1 9 4571 1 1 24 ARG HH22 H -19.095 10.431 1.334 1.00 . A A . 24 ARG HH22 1 1 9 4572 1 1 24 ARG N N -13.474 5.026 2.268 1.00 . A A . 24 ARG N 1 1 9 4573 1 1 24 ARG NE N -16.676 8.378 1.471 1.00 . A A . 24 ARG NE 1 1 9 4574 1 1 24 ARG NH1 N -18.950 8.060 1.742 1.00 . A A . 24 ARG NH1 1 1 9 4575 1 1 24 ARG NH2 N -18.147 10.074 1.303 1.00 . A A . 24 ARG NH2 1 1 9 4576 1 1 24 ARG O O -14.459 2.601 3.457 1.00 . A A . 24 ARG O 1 1 9 4577 1 1 25 LEU C C -11.830 1.439 4.939 1.00 . A A . 25 LEU C 1 1 9 4578 1 1 25 LEU CA C -12.843 2.201 5.827 1.00 . A A . 25 LEU CA 1 1 9 4579 1 1 25 LEU CB C -13.975 1.253 6.283 1.00 . A A . 25 LEU CB 1 1 9 4580 1 1 25 LEU CD1 C -16.212 2.487 6.471 1.00 . A A . 25 LEU CD1 1 1 9 4581 1 1 25 LEU CD2 C -15.685 0.669 8.027 1.00 . A A . 25 LEU CD2 1 1 9 4582 1 1 25 LEU CG C -15.062 1.814 7.223 1.00 . A A . 25 LEU CG 1 1 9 4583 1 1 25 LEU H H -13.118 4.319 5.690 1.00 . A A . 25 LEU H 1 1 9 4584 1 1 25 LEU HA H -12.292 2.488 6.722 1.00 . A A . 25 LEU HA 1 1 9 4585 1 1 25 LEU HB2 H -14.467 0.843 5.404 1.00 . A A . 25 LEU HB2 1 1 9 4586 1 1 25 LEU HB3 H -13.488 0.419 6.791 1.00 . A A . 25 LEU HB3 1 1 9 4587 1 1 25 LEU HD11 H -15.878 3.426 6.043 1.00 . A A . 25 LEU HD11 1 1 9 4588 1 1 25 LEU HD12 H -17.008 2.726 7.168 1.00 . A A . 25 LEU HD12 1 1 9 4589 1 1 25 LEU HD13 H -16.585 1.833 5.683 1.00 . A A . 25 LEU HD13 1 1 9 4590 1 1 25 LEU HD21 H -16.113 -0.074 7.354 1.00 . A A . 25 LEU HD21 1 1 9 4591 1 1 25 LEU HD22 H -16.462 1.055 8.688 1.00 . A A . 25 LEU HD22 1 1 9 4592 1 1 25 LEU HD23 H -14.919 0.199 8.644 1.00 . A A . 25 LEU HD23 1 1 9 4593 1 1 25 LEU HG H -14.625 2.524 7.921 1.00 . A A . 25 LEU HG 1 1 9 4594 1 1 25 LEU N N -13.372 3.448 5.240 1.00 . A A . 25 LEU N 1 1 9 4595 1 1 25 LEU O O -10.875 0.862 5.448 1.00 . A A . 25 LEU O 1 1 9 4596 1 1 26 TRP C C -11.074 1.400 1.279 1.00 . A A . 26 TRP C 1 1 9 4597 1 1 26 TRP CA C -11.180 0.715 2.645 1.00 . A A . 26 TRP CA 1 1 9 4598 1 1 26 TRP CB C -11.768 -0.703 2.514 1.00 . A A . 26 TRP CB 1 1 9 4599 1 1 26 TRP CD1 C -13.599 -1.544 4.055 1.00 . A A . 26 TRP CD1 1 1 9 4600 1 1 26 TRP CD2 C -14.421 -0.386 2.320 1.00 . A A . 26 TRP CD2 1 1 9 4601 1 1 26 TRP CE2 C -15.531 -0.773 3.130 1.00 . A A . 26 TRP CE2 1 1 9 4602 1 1 26 TRP CE3 C -14.703 0.437 1.206 1.00 . A A . 26 TRP CE3 1 1 9 4603 1 1 26 TRP CG C -13.200 -0.938 2.911 1.00 . A A . 26 TRP CG 1 1 9 4604 1 1 26 TRP CH2 C -17.094 0.410 1.710 1.00 . A A . 26 TRP CH2 1 1 9 4605 1 1 26 TRP CZ2 C -16.847 -0.392 2.835 1.00 . A A . 26 TRP CZ2 1 1 9 4606 1 1 26 TRP CZ3 C -16.023 0.827 0.901 1.00 . A A . 26 TRP CZ3 1 1 9 4607 1 1 26 TRP H H -12.798 1.917 3.261 1.00 . A A . 26 TRP H 1 1 9 4608 1 1 26 TRP HA H -10.160 0.618 3.018 1.00 . A A . 26 TRP HA 1 1 9 4609 1 1 26 TRP HB2 H -11.629 -1.089 1.504 1.00 . A A . 26 TRP HB2 1 1 9 4610 1 1 26 TRP HB3 H -11.159 -1.312 3.171 1.00 . A A . 26 TRP HB3 1 1 9 4611 1 1 26 TRP HD1 H -12.936 -1.991 4.789 1.00 . A A . 26 TRP HD1 1 1 9 4612 1 1 26 TRP HE1 H -15.489 -1.918 4.934 1.00 . A A . 26 TRP HE1 1 1 9 4613 1 1 26 TRP HE3 H -13.888 0.804 0.602 1.00 . A A . 26 TRP HE3 1 1 9 4614 1 1 26 TRP HH2 H -18.104 0.732 1.488 1.00 . A A . 26 TRP HH2 1 1 9 4615 1 1 26 TRP HZ2 H -17.656 -0.674 3.489 1.00 . A A . 26 TRP HZ2 1 1 9 4616 1 1 26 TRP HZ3 H -16.211 1.477 0.059 1.00 . A A . 26 TRP HZ3 1 1 9 4617 1 1 26 TRP N N -11.954 1.482 3.617 1.00 . A A . 26 TRP N 1 1 9 4618 1 1 26 TRP NE1 N -14.975 -1.515 4.149 1.00 . A A . 26 TRP NE1 1 1 9 4619 1 1 26 TRP O O -11.792 2.362 1.016 1.00 . A A . 26 TRP O 1 1 9 4620 1 1 27 CYS C C -10.600 0.044 -1.905 1.00 . A A . 27 CYS C 1 1 9 4621 1 1 27 CYS CA C -10.126 1.202 -1.015 1.00 . A A . 27 CYS CA 1 1 9 4622 1 1 27 CYS CB C -8.693 1.664 -1.328 1.00 . A A . 27 CYS CB 1 1 9 4623 1 1 27 CYS H H -9.706 0.034 0.697 1.00 . A A . 27 CYS H 1 1 9 4624 1 1 27 CYS HA H -10.779 2.042 -1.215 1.00 . A A . 27 CYS HA 1 1 9 4625 1 1 27 CYS HB2 H -8.011 0.837 -1.149 1.00 . A A . 27 CYS HB2 1 1 9 4626 1 1 27 CYS HB3 H -8.633 1.927 -2.385 1.00 . A A . 27 CYS HB3 1 1 9 4627 1 1 27 CYS N N -10.244 0.830 0.397 1.00 . A A . 27 CYS N 1 1 9 4628 1 1 27 CYS O O -9.821 -0.856 -2.232 1.00 . A A . 27 CYS O 1 1 9 4629 1 1 27 CYS SG S -8.115 3.069 -0.348 1.00 . A A . 27 CYS SG 1 1 9 4630 1 1 28 LYS C C -13.410 -0.261 -4.190 1.00 . A A . 28 LYS C 1 1 9 4631 1 1 28 LYS CA C -12.510 -0.952 -3.163 1.00 . A A . 28 LYS CA 1 1 9 4632 1 1 28 LYS CB C -13.175 -2.131 -2.420 1.00 . A A . 28 LYS CB 1 1 9 4633 1 1 28 LYS CD C -15.602 -1.237 -2.216 1.00 . A A . 28 LYS CD 1 1 9 4634 1 1 28 LYS CE C -16.937 -1.453 -1.491 1.00 . A A . 28 LYS CE 1 1 9 4635 1 1 28 LYS CG C -14.380 -1.850 -1.506 1.00 . A A . 28 LYS CG 1 1 9 4636 1 1 28 LYS H H -12.467 0.814 -1.956 1.00 . A A . 28 LYS H 1 1 9 4637 1 1 28 LYS HA H -11.704 -1.389 -3.755 1.00 . A A . 28 LYS HA 1 1 9 4638 1 1 28 LYS HB2 H -13.483 -2.870 -3.160 1.00 . A A . 28 LYS HB2 1 1 9 4639 1 1 28 LYS HB3 H -12.409 -2.606 -1.806 1.00 . A A . 28 LYS HB3 1 1 9 4640 1 1 28 LYS HD2 H -15.447 -0.163 -2.312 1.00 . A A . 28 LYS HD2 1 1 9 4641 1 1 28 LYS HD3 H -15.692 -1.657 -3.218 1.00 . A A . 28 LYS HD3 1 1 9 4642 1 1 28 LYS HE2 H -16.873 -1.055 -0.474 1.00 . A A . 28 LYS HE2 1 1 9 4643 1 1 28 LYS HE3 H -17.705 -0.890 -2.027 1.00 . A A . 28 LYS HE3 1 1 9 4644 1 1 28 LYS HG2 H -14.667 -2.802 -1.059 1.00 . A A . 28 LYS HG2 1 1 9 4645 1 1 28 LYS HG3 H -14.061 -1.194 -0.701 1.00 . A A . 28 LYS HG3 1 1 9 4646 1 1 28 LYS HZ1 H -16.947 -3.379 -2.253 1.00 . A A . 28 LYS HZ1 1 1 9 4647 1 1 28 LYS HZ2 H -18.338 -2.976 -1.497 1.00 . A A . 28 LYS HZ2 1 1 9 4648 1 1 28 LYS HZ3 H -16.986 -3.315 -0.593 1.00 . A A . 28 LYS HZ3 1 1 9 4649 1 1 28 LYS N N -11.899 0.024 -2.238 1.00 . A A . 28 LYS N 1 1 9 4650 1 1 28 LYS NZ N -17.325 -2.881 -1.449 1.00 . A A . 28 LYS NZ 1 1 9 4651 1 1 28 LYS O O -13.804 0.894 -4.014 1.00 . A A . 28 LYS O 1 1 9 4652 1 1 29 LYS C C -15.777 0.043 -6.195 1.00 . A A . 29 LYS C 1 1 9 4653 1 1 29 LYS CA C -14.329 -0.359 -6.484 1.00 . A A . 29 LYS CA 1 1 9 4654 1 1 29 LYS CB C -14.285 -1.337 -7.667 1.00 . A A . 29 LYS CB 1 1 9 4655 1 1 29 LYS CD C -12.901 -3.031 -8.948 1.00 . A A . 29 LYS CD 1 1 9 4656 1 1 29 LYS CE C -11.532 -3.278 -9.584 1.00 . A A . 29 LYS CE 1 1 9 4657 1 1 29 LYS CG C -12.871 -1.757 -8.093 1.00 . A A . 29 LYS CG 1 1 9 4658 1 1 29 LYS H H -13.399 -1.917 -5.354 1.00 . A A . 29 LYS H 1 1 9 4659 1 1 29 LYS HA H -13.774 0.535 -6.767 1.00 . A A . 29 LYS HA 1 1 9 4660 1 1 29 LYS HB2 H -14.853 -2.218 -7.387 1.00 . A A . 29 LYS HB2 1 1 9 4661 1 1 29 LYS HB3 H -14.780 -0.882 -8.527 1.00 . A A . 29 LYS HB3 1 1 9 4662 1 1 29 LYS HD2 H -13.152 -3.876 -8.310 1.00 . A A . 29 LYS HD2 1 1 9 4663 1 1 29 LYS HD3 H -13.664 -2.953 -9.726 1.00 . A A . 29 LYS HD3 1 1 9 4664 1 1 29 LYS HE2 H -10.749 -3.005 -8.872 1.00 . A A . 29 LYS HE2 1 1 9 4665 1 1 29 LYS HE3 H -11.431 -4.342 -9.817 1.00 . A A . 29 LYS HE3 1 1 9 4666 1 1 29 LYS HG2 H -12.425 -0.940 -8.656 1.00 . A A . 29 LYS HG2 1 1 9 4667 1 1 29 LYS HG3 H -12.248 -1.954 -7.221 1.00 . A A . 29 LYS HG3 1 1 9 4668 1 1 29 LYS HZ1 H -11.918 -2.949 -11.578 1.00 . A A . 29 LYS HZ1 1 1 9 4669 1 1 29 LYS HZ2 H -10.422 -2.420 -11.128 1.00 . A A . 29 LYS HZ2 1 1 9 4670 1 1 29 LYS HZ3 H -11.735 -1.547 -10.727 1.00 . A A . 29 LYS HZ3 1 1 9 4671 1 1 29 LYS N N -13.687 -0.948 -5.302 1.00 . A A . 29 LYS N 1 1 9 4672 1 1 29 LYS NZ N -11.394 -2.499 -10.831 1.00 . A A . 29 LYS NZ 1 1 9 4673 1 1 29 LYS O O -16.582 -0.776 -5.745 1.00 . A A . 29 LYS O 1 1 9 4674 1 1 30 LYS C C -17.434 3.071 -7.542 1.00 . A A . 30 LYS C 1 1 9 4675 1 1 30 LYS CA C -17.489 1.780 -6.722 1.00 . A A . 30 LYS CA 1 1 9 4676 1 1 30 LYS CB C -18.131 2.014 -5.338 1.00 . A A . 30 LYS CB 1 1 9 4677 1 1 30 LYS CD C -20.352 0.742 -5.757 1.00 . A A . 30 LYS CD 1 1 9 4678 1 1 30 LYS CE C -19.926 -0.398 -4.825 1.00 . A A . 30 LYS CE 1 1 9 4679 1 1 30 LYS CG C -19.663 2.057 -5.369 1.00 . A A . 30 LYS CG 1 1 9 4680 1 1 30 LYS H H -15.373 1.885 -6.872 1.00 . A A . 30 LYS H 1 1 9 4681 1 1 30 LYS HA H -18.064 1.039 -7.279 1.00 . A A . 30 LYS HA 1 1 9 4682 1 1 30 LYS HB2 H -17.813 1.246 -4.633 1.00 . A A . 30 LYS HB2 1 1 9 4683 1 1 30 LYS HB3 H -17.791 2.965 -4.937 1.00 . A A . 30 LYS HB3 1 1 9 4684 1 1 30 LYS HD2 H -21.430 0.894 -5.679 1.00 . A A . 30 LYS HD2 1 1 9 4685 1 1 30 LYS HD3 H -20.121 0.487 -6.791 1.00 . A A . 30 LYS HD3 1 1 9 4686 1 1 30 LYS HE2 H -18.852 -0.574 -4.941 1.00 . A A . 30 LYS HE2 1 1 9 4687 1 1 30 LYS HE3 H -20.123 -0.098 -3.792 1.00 . A A . 30 LYS HE3 1 1 9 4688 1 1 30 LYS HG2 H -20.006 2.331 -4.371 1.00 . A A . 30 LYS HG2 1 1 9 4689 1 1 30 LYS HG3 H -19.976 2.834 -6.062 1.00 . A A . 30 LYS HG3 1 1 9 4690 1 1 30 LYS HZ1 H -20.426 -1.966 -6.066 1.00 . A A . 30 LYS HZ1 1 1 9 4691 1 1 30 LYS HZ2 H -21.665 -1.472 -5.089 1.00 . A A . 30 LYS HZ2 1 1 9 4692 1 1 30 LYS HZ3 H -20.435 -2.368 -4.467 1.00 . A A . 30 LYS HZ3 1 1 9 4693 1 1 30 LYS N N -16.117 1.281 -6.560 1.00 . A A . 30 LYS N 1 1 9 4694 1 1 30 LYS NZ N -20.663 -1.637 -5.131 1.00 . A A . 30 LYS NZ 1 1 9 4695 1 1 30 LYS O O -17.051 4.116 -7.012 1.00 . A A . 30 LYS O 1 1 9 4696 1 1 31 LEU C C -18.388 3.889 -11.071 1.00 . A A . 31 LEU C 1 1 9 4697 1 1 31 LEU CA C -17.551 4.085 -9.795 1.00 . A A . 31 LEU CA 1 1 9 4698 1 1 31 LEU CB C -16.059 4.318 -10.133 1.00 . A A . 31 LEU CB 1 1 9 4699 1 1 31 LEU CD1 C -16.170 6.851 -10.472 1.00 . A A . 31 LEU CD1 1 1 9 4700 1 1 31 LEU CD2 C -14.285 5.546 -11.430 1.00 . A A . 31 LEU CD2 1 1 9 4701 1 1 31 LEU CG C -15.775 5.503 -11.081 1.00 . A A . 31 LEU CG 1 1 9 4702 1 1 31 LEU H H -17.887 2.044 -9.212 1.00 . A A . 31 LEU H 1 1 9 4703 1 1 31 LEU HA H -17.932 4.977 -9.300 1.00 . A A . 31 LEU HA 1 1 9 4704 1 1 31 LEU HB2 H -15.505 4.483 -9.208 1.00 . A A . 31 LEU HB2 1 1 9 4705 1 1 31 LEU HB3 H -15.672 3.409 -10.596 1.00 . A A . 31 LEU HB3 1 1 9 4706 1 1 31 LEU HD11 H -15.954 7.651 -11.179 1.00 . A A . 31 LEU HD11 1 1 9 4707 1 1 31 LEU HD12 H -15.629 7.021 -9.541 1.00 . A A . 31 LEU HD12 1 1 9 4708 1 1 31 LEU HD13 H -17.241 6.870 -10.270 1.00 . A A . 31 LEU HD13 1 1 9 4709 1 1 31 LEU HD21 H -13.689 5.735 -10.536 1.00 . A A . 31 LEU HD21 1 1 9 4710 1 1 31 LEU HD22 H -14.107 6.315 -12.180 1.00 . A A . 31 LEU HD22 1 1 9 4711 1 1 31 LEU HD23 H -13.986 4.588 -11.858 1.00 . A A . 31 LEU HD23 1 1 9 4712 1 1 31 LEU HG H -16.318 5.368 -12.012 1.00 . A A . 31 LEU HG 1 1 9 4713 1 1 31 LEU N N -17.648 2.961 -8.852 1.00 . A A . 31 LEU N 1 1 9 4714 1 1 31 LEU O O -18.833 4.860 -11.675 1.00 . A A . 31 LEU O 1 1 9 4715 1 1 32 LEU C C -20.266 1.386 -12.769 1.00 . A A . 32 LEU C 1 1 9 4716 1 1 32 LEU CA C -19.116 2.384 -12.874 1.00 . A A . 32 LEU CA 1 1 9 4717 1 1 32 LEU CB C -17.972 1.745 -13.695 1.00 . A A . 32 LEU CB 1 1 9 4718 1 1 32 LEU CD1 C -15.632 2.160 -14.494 1.00 . A A . 32 LEU CD1 1 1 9 4719 1 1 32 LEU CD2 C -17.413 3.742 -15.203 1.00 . A A . 32 LEU CD2 1 1 9 4720 1 1 32 LEU CG C -16.935 2.832 -14.061 1.00 . A A . 32 LEU CG 1 1 9 4721 1 1 32 LEU H H -18.168 1.884 -11.006 1.00 . A A . 32 LEU H 1 1 9 4722 1 1 32 LEU HA H -19.485 3.273 -13.366 1.00 . A A . 32 LEU HA 1 1 9 4723 1 1 32 LEU HB2 H -17.501 0.958 -13.104 1.00 . A A . 32 LEU HB2 1 1 9 4724 1 1 32 LEU HB3 H -18.365 1.303 -14.612 1.00 . A A . 32 LEU HB3 1 1 9 4725 1 1 32 LEU HD11 H -15.246 1.534 -13.690 1.00 . A A . 32 LEU HD11 1 1 9 4726 1 1 32 LEU HD12 H -14.889 2.924 -14.723 1.00 . A A . 32 LEU HD12 1 1 9 4727 1 1 32 LEU HD13 H -15.804 1.550 -15.381 1.00 . A A . 32 LEU HD13 1 1 9 4728 1 1 32 LEU HD21 H -18.305 4.294 -14.912 1.00 . A A . 32 LEU HD21 1 1 9 4729 1 1 32 LEU HD22 H -17.633 3.149 -16.093 1.00 . A A . 32 LEU HD22 1 1 9 4730 1 1 32 LEU HD23 H -16.634 4.464 -15.452 1.00 . A A . 32 LEU HD23 1 1 9 4731 1 1 32 LEU HG H -16.702 3.447 -13.194 1.00 . A A . 32 LEU HG 1 1 9 4732 1 1 32 LEU N N -18.567 2.654 -11.531 1.00 . A A . 32 LEU N 1 1 9 4733 1 1 32 LEU O O -21.007 1.177 -13.705 1.00 . A A . 32 LEU O 1 1 9 4734 1 1 32 LEU OXT O -20.415 0.876 -11.851 1.00 . A A . 32 LEU OXT 1 1 10 4735 1 1 1 GLY C C 1.781 -5.150 -0.326 1.00 . A A . 1 GLY C 1 1 10 4736 1 1 1 GLY CA C 3.252 -4.808 -0.228 1.00 . A A . 1 GLY CA 1 1 10 4737 1 1 1 GLY H1 H 3.822 -6.419 0.920 1.00 . A A . 1 GLY H1 1 1 10 4738 1 1 1 GLY H2 H 3.891 -6.704 -0.694 1.00 . A A . 1 GLY H2 1 1 10 4739 1 1 1 GLY H3 H 5.045 -5.770 0.031 1.00 . A A . 1 GLY H3 1 1 10 4740 1 1 1 GLY HA2 H 3.402 -4.084 0.567 1.00 . A A . 1 GLY HA2 1 1 10 4741 1 1 1 GLY HA3 H 3.561 -4.362 -1.172 1.00 . A A . 1 GLY HA3 1 1 10 4742 1 1 1 GLY N N 4.063 -6.012 0.026 1.00 . A A . 1 GLY N 1 1 10 4743 1 1 1 GLY O O 1.335 -5.514 -1.416 1.00 . A A . 1 GLY O 1 1 10 4744 1 1 2 PRO C C -1.238 -4.313 0.111 1.00 . A A . 2 PRO C 1 1 10 4745 1 1 2 PRO CA C -0.401 -5.409 0.788 1.00 . A A . 2 PRO CA 1 1 10 4746 1 1 2 PRO CB C -0.742 -5.606 2.265 1.00 . A A . 2 PRO CB 1 1 10 4747 1 1 2 PRO CD C 1.436 -4.628 2.103 1.00 . A A . 2 PRO CD 1 1 10 4748 1 1 2 PRO CG C 0.188 -4.633 2.987 1.00 . A A . 2 PRO CG 1 1 10 4749 1 1 2 PRO HA H -0.559 -6.354 0.265 1.00 . A A . 2 PRO HA 1 1 10 4750 1 1 2 PRO HB2 H -1.788 -5.389 2.462 1.00 . A A . 2 PRO HB2 1 1 10 4751 1 1 2 PRO HB3 H -0.501 -6.626 2.561 1.00 . A A . 2 PRO HB3 1 1 10 4752 1 1 2 PRO HD2 H 1.862 -3.625 2.076 1.00 . A A . 2 PRO HD2 1 1 10 4753 1 1 2 PRO HD3 H 2.159 -5.335 2.503 1.00 . A A . 2 PRO HD3 1 1 10 4754 1 1 2 PRO HG2 H -0.255 -3.637 3.006 1.00 . A A . 2 PRO HG2 1 1 10 4755 1 1 2 PRO HG3 H 0.413 -4.968 4.000 1.00 . A A . 2 PRO HG3 1 1 10 4756 1 1 2 PRO N N 1.013 -5.056 0.775 1.00 . A A . 2 PRO N 1 1 10 4757 1 1 2 PRO O O -1.528 -3.267 0.692 1.00 . A A . 2 PRO O 1 1 10 4758 1 1 3 TYR C C -3.659 -3.025 -1.380 1.00 . A A . 3 TYR C 1 1 10 4759 1 1 3 TYR CA C -2.363 -3.609 -1.966 1.00 . A A . 3 TYR CA 1 1 10 4760 1 1 3 TYR CB C -2.525 -4.111 -3.405 1.00 . A A . 3 TYR CB 1 1 10 4761 1 1 3 TYR CD1 C -1.304 -2.852 -5.225 1.00 . A A . 3 TYR CD1 1 1 10 4762 1 1 3 TYR CD2 C -0.253 -4.836 -4.275 1.00 . A A . 3 TYR CD2 1 1 10 4763 1 1 3 TYR CE1 C -0.247 -2.728 -6.146 1.00 . A A . 3 TYR CE1 1 1 10 4764 1 1 3 TYR CE2 C 0.821 -4.694 -5.174 1.00 . A A . 3 TYR CE2 1 1 10 4765 1 1 3 TYR CG C -1.322 -3.921 -4.307 1.00 . A A . 3 TYR CG 1 1 10 4766 1 1 3 TYR CZ C 0.809 -3.664 -6.136 1.00 . A A . 3 TYR CZ 1 1 10 4767 1 1 3 TYR H H -1.284 -5.406 -1.577 1.00 . A A . 3 TYR H 1 1 10 4768 1 1 3 TYR HA H -1.696 -2.748 -2.048 1.00 . A A . 3 TYR HA 1 1 10 4769 1 1 3 TYR HB2 H -2.805 -5.165 -3.391 1.00 . A A . 3 TYR HB2 1 1 10 4770 1 1 3 TYR HB3 H -3.350 -3.570 -3.857 1.00 . A A . 3 TYR HB3 1 1 10 4771 1 1 3 TYR HD1 H -2.128 -2.153 -5.261 1.00 . A A . 3 TYR HD1 1 1 10 4772 1 1 3 TYR HD2 H -0.261 -5.668 -3.583 1.00 . A A . 3 TYR HD2 1 1 10 4773 1 1 3 TYR HE1 H -0.254 -1.933 -6.877 1.00 . A A . 3 TYR HE1 1 1 10 4774 1 1 3 TYR HE2 H 1.639 -5.398 -5.163 1.00 . A A . 3 TYR HE2 1 1 10 4775 1 1 3 TYR HH H 1.498 -3.115 -7.856 1.00 . A A . 3 TYR HH 1 1 10 4776 1 1 3 TYR N N -1.621 -4.561 -1.142 1.00 . A A . 3 TYR N 1 1 10 4777 1 1 3 TYR O O -4.572 -3.759 -0.999 1.00 . A A . 3 TYR O 1 1 10 4778 1 1 3 TYR OH O 1.798 -3.594 -7.063 1.00 . A A . 3 TYR OH 1 1 10 4779 1 1 4 CYS C C -6.240 -1.415 -0.966 1.00 . A A . 4 CYS C 1 1 10 4780 1 1 4 CYS CA C -4.804 -0.960 -0.656 1.00 . A A . 4 CYS CA 1 1 10 4781 1 1 4 CYS CB C -4.700 0.521 -1.022 1.00 . A A . 4 CYS CB 1 1 10 4782 1 1 4 CYS H H -2.974 -1.161 -1.705 1.00 . A A . 4 CYS H 1 1 10 4783 1 1 4 CYS HA H -4.629 -1.075 0.414 1.00 . A A . 4 CYS HA 1 1 10 4784 1 1 4 CYS HB2 H -5.052 0.646 -2.045 1.00 . A A . 4 CYS HB2 1 1 10 4785 1 1 4 CYS HB3 H -5.399 1.053 -0.383 1.00 . A A . 4 CYS HB3 1 1 10 4786 1 1 4 CYS N N -3.771 -1.694 -1.386 1.00 . A A . 4 CYS N 1 1 10 4787 1 1 4 CYS O O -7.054 -1.559 -0.055 1.00 . A A . 4 CYS O 1 1 10 4788 1 1 4 CYS SG S -3.094 1.348 -0.884 1.00 . A A . 4 CYS SG 1 1 10 4789 1 1 5 GLN C C -8.228 -3.453 -2.688 1.00 . A A . 5 GLN C 1 1 10 4790 1 1 5 GLN CA C -7.885 -1.949 -2.766 1.00 . A A . 5 GLN CA 1 1 10 4791 1 1 5 GLN CB C -8.050 -1.316 -4.165 1.00 . A A . 5 GLN CB 1 1 10 4792 1 1 5 GLN CD C -6.156 -2.518 -5.477 1.00 . A A . 5 GLN CD 1 1 10 4793 1 1 5 GLN CG C -7.623 -2.113 -5.412 1.00 . A A . 5 GLN CG 1 1 10 4794 1 1 5 GLN H H -5.790 -1.614 -2.926 1.00 . A A . 5 GLN H 1 1 10 4795 1 1 5 GLN HA H -8.590 -1.445 -2.114 1.00 . A A . 5 GLN HA 1 1 10 4796 1 1 5 GLN HB2 H -9.106 -1.092 -4.283 1.00 . A A . 5 GLN HB2 1 1 10 4797 1 1 5 GLN HB3 H -7.535 -0.354 -4.183 1.00 . A A . 5 GLN HB3 1 1 10 4798 1 1 5 GLN HE21 H -5.939 -1.763 -7.318 1.00 . A A . 5 GLN HE21 1 1 10 4799 1 1 5 GLN HE22 H -4.557 -2.688 -6.688 1.00 . A A . 5 GLN HE22 1 1 10 4800 1 1 5 GLN HG2 H -8.208 -3.024 -5.483 1.00 . A A . 5 GLN HG2 1 1 10 4801 1 1 5 GLN HG3 H -7.870 -1.512 -6.286 1.00 . A A . 5 GLN HG3 1 1 10 4802 1 1 5 GLN N N -6.543 -1.635 -2.254 1.00 . A A . 5 GLN N 1 1 10 4803 1 1 5 GLN NE2 N -5.469 -2.266 -6.561 1.00 . A A . 5 GLN NE2 1 1 10 4804 1 1 5 GLN O O -9.257 -3.911 -3.202 1.00 . A A . 5 GLN O 1 1 10 4805 1 1 5 GLN OE1 O -5.638 -3.212 -4.618 1.00 . A A . 5 GLN OE1 1 1 10 4806 1 1 6 LYS C C -6.906 -6.268 -0.705 1.00 . A A . 6 LYS C 1 1 10 4807 1 1 6 LYS CA C -7.226 -5.680 -2.092 1.00 . A A . 6 LYS CA 1 1 10 4808 1 1 6 LYS CB C -6.205 -6.003 -3.197 1.00 . A A . 6 LYS CB 1 1 10 4809 1 1 6 LYS CD C -4.953 -7.622 -4.723 1.00 . A A . 6 LYS CD 1 1 10 4810 1 1 6 LYS CE C -5.439 -7.105 -6.090 1.00 . A A . 6 LYS CE 1 1 10 4811 1 1 6 LYS CG C -5.952 -7.472 -3.556 1.00 . A A . 6 LYS CG 1 1 10 4812 1 1 6 LYS H H -6.502 -3.735 -1.722 1.00 . A A . 6 LYS H 1 1 10 4813 1 1 6 LYS HA H -8.184 -6.098 -2.392 1.00 . A A . 6 LYS HA 1 1 10 4814 1 1 6 LYS HB2 H -6.588 -5.522 -4.093 1.00 . A A . 6 LYS HB2 1 1 10 4815 1 1 6 LYS HB3 H -5.249 -5.545 -2.938 1.00 . A A . 6 LYS HB3 1 1 10 4816 1 1 6 LYS HD2 H -4.013 -7.136 -4.462 1.00 . A A . 6 LYS HD2 1 1 10 4817 1 1 6 LYS HD3 H -4.748 -8.689 -4.835 1.00 . A A . 6 LYS HD3 1 1 10 4818 1 1 6 LYS HE2 H -4.888 -7.638 -6.872 1.00 . A A . 6 LYS HE2 1 1 10 4819 1 1 6 LYS HE3 H -6.495 -7.371 -6.202 1.00 . A A . 6 LYS HE3 1 1 10 4820 1 1 6 LYS HG2 H -5.539 -7.988 -2.691 1.00 . A A . 6 LYS HG2 1 1 10 4821 1 1 6 LYS HG3 H -6.895 -7.949 -3.822 1.00 . A A . 6 LYS HG3 1 1 10 4822 1 1 6 LYS HZ1 H -5.591 -5.080 -5.520 1.00 . A A . 6 LYS HZ1 1 1 10 4823 1 1 6 LYS HZ2 H -5.730 -5.331 -7.135 1.00 . A A . 6 LYS HZ2 1 1 10 4824 1 1 6 LYS HZ3 H -4.281 -5.386 -6.457 1.00 . A A . 6 LYS HZ3 1 1 10 4825 1 1 6 LYS N N -7.319 -4.220 -2.077 1.00 . A A . 6 LYS N 1 1 10 4826 1 1 6 LYS NZ N -5.250 -5.643 -6.290 1.00 . A A . 6 LYS NZ 1 1 10 4827 1 1 6 LYS O O -6.919 -7.489 -0.572 1.00 . A A . 6 LYS O 1 1 10 4828 1 1 7 TRP C C -7.002 -5.006 2.861 1.00 . A A . 7 TRP C 1 1 10 4829 1 1 7 TRP CA C -6.430 -5.881 1.712 1.00 . A A . 7 TRP CA 1 1 10 4830 1 1 7 TRP CB C -4.908 -6.107 1.794 1.00 . A A . 7 TRP CB 1 1 10 4831 1 1 7 TRP CD1 C -4.448 -7.814 3.610 1.00 . A A . 7 TRP CD1 1 1 10 4832 1 1 7 TRP CD2 C -3.770 -5.756 4.190 1.00 . A A . 7 TRP CD2 1 1 10 4833 1 1 7 TRP CE2 C -3.414 -6.629 5.259 1.00 . A A . 7 TRP CE2 1 1 10 4834 1 1 7 TRP CE3 C -3.485 -4.383 4.364 1.00 . A A . 7 TRP CE3 1 1 10 4835 1 1 7 TRP CG C -4.330 -6.564 3.103 1.00 . A A . 7 TRP CG 1 1 10 4836 1 1 7 TRP CH2 C -2.463 -4.816 6.545 1.00 . A A . 7 TRP CH2 1 1 10 4837 1 1 7 TRP CZ2 C -2.756 -6.183 6.413 1.00 . A A . 7 TRP CZ2 1 1 10 4838 1 1 7 TRP CZ3 C -2.845 -3.918 5.532 1.00 . A A . 7 TRP CZ3 1 1 10 4839 1 1 7 TRP H H -6.785 -4.451 0.151 1.00 . A A . 7 TRP H 1 1 10 4840 1 1 7 TRP HA H -6.889 -6.859 1.857 1.00 . A A . 7 TRP HA 1 1 10 4841 1 1 7 TRP HB2 H -4.622 -6.834 1.032 1.00 . A A . 7 TRP HB2 1 1 10 4842 1 1 7 TRP HB3 H -4.415 -5.169 1.535 1.00 . A A . 7 TRP HB3 1 1 10 4843 1 1 7 TRP HD1 H -4.940 -8.644 3.111 1.00 . A A . 7 TRP HD1 1 1 10 4844 1 1 7 TRP HE1 H -3.978 -8.656 5.500 1.00 . A A . 7 TRP HE1 1 1 10 4845 1 1 7 TRP HE3 H -3.743 -3.691 3.577 1.00 . A A . 7 TRP HE3 1 1 10 4846 1 1 7 TRP HH2 H -1.949 -4.451 7.425 1.00 . A A . 7 TRP HH2 1 1 10 4847 1 1 7 TRP HZ2 H -2.465 -6.887 7.177 1.00 . A A . 7 TRP HZ2 1 1 10 4848 1 1 7 TRP HZ3 H -2.628 -2.866 5.645 1.00 . A A . 7 TRP HZ3 1 1 10 4849 1 1 7 TRP N N -6.748 -5.441 0.339 1.00 . A A . 7 TRP N 1 1 10 4850 1 1 7 TRP NE1 N -3.885 -7.862 4.870 1.00 . A A . 7 TRP NE1 1 1 10 4851 1 1 7 TRP O O -6.858 -5.354 4.030 1.00 . A A . 7 TRP O 1 1 10 4852 1 1 8 MET C C -7.461 -2.406 4.534 1.00 . A A . 8 MET C 1 1 10 4853 1 1 8 MET CA C -8.428 -3.050 3.524 1.00 . A A . 8 MET CA 1 1 10 4854 1 1 8 MET CB C -9.622 -3.742 4.217 1.00 . A A . 8 MET CB 1 1 10 4855 1 1 8 MET CE C -11.575 -6.376 4.799 1.00 . A A . 8 MET CE 1 1 10 4856 1 1 8 MET CG C -10.664 -4.249 3.217 1.00 . A A . 8 MET CG 1 1 10 4857 1 1 8 MET H H -7.979 -3.794 1.577 1.00 . A A . 8 MET H 1 1 10 4858 1 1 8 MET HA H -8.845 -2.227 2.943 1.00 . A A . 8 MET HA 1 1 10 4859 1 1 8 MET HB2 H -9.266 -4.576 4.822 1.00 . A A . 8 MET HB2 1 1 10 4860 1 1 8 MET HB3 H -10.107 -3.023 4.879 1.00 . A A . 8 MET HB3 1 1 10 4861 1 1 8 MET HE1 H -10.874 -6.080 5.579 1.00 . A A . 8 MET HE1 1 1 10 4862 1 1 8 MET HE2 H -12.408 -6.911 5.255 1.00 . A A . 8 MET HE2 1 1 10 4863 1 1 8 MET HE3 H -11.072 -7.038 4.096 1.00 . A A . 8 MET HE3 1 1 10 4864 1 1 8 MET HG2 H -10.934 -3.427 2.555 1.00 . A A . 8 MET HG2 1 1 10 4865 1 1 8 MET HG3 H -10.205 -5.030 2.616 1.00 . A A . 8 MET HG3 1 1 10 4866 1 1 8 MET N N -7.759 -3.943 2.557 1.00 . A A . 8 MET N 1 1 10 4867 1 1 8 MET O O -7.471 -2.714 5.727 1.00 . A A . 8 MET O 1 1 10 4868 1 1 8 MET SD S -12.197 -4.907 3.931 1.00 . A A . 8 MET SD 1 1 10 4869 1 1 9 GLN C C -6.055 0.013 6.116 1.00 . A A . 9 GLN C 1 1 10 4870 1 1 9 GLN CA C -5.616 -0.738 4.829 1.00 . A A . 9 GLN CA 1 1 10 4871 1 1 9 GLN CB C -4.889 0.238 3.868 1.00 . A A . 9 GLN CB 1 1 10 4872 1 1 9 GLN CD C -5.191 2.378 2.450 1.00 . A A . 9 GLN CD 1 1 10 4873 1 1 9 GLN CG C -5.639 1.572 3.666 1.00 . A A . 9 GLN CG 1 1 10 4874 1 1 9 GLN H H -6.741 -1.220 3.081 1.00 . A A . 9 GLN H 1 1 10 4875 1 1 9 GLN HA H -4.902 -1.503 5.138 1.00 . A A . 9 GLN HA 1 1 10 4876 1 1 9 GLN HB2 H -3.899 0.460 4.269 1.00 . A A . 9 GLN HB2 1 1 10 4877 1 1 9 GLN HB3 H -4.751 -0.250 2.901 1.00 . A A . 9 GLN HB3 1 1 10 4878 1 1 9 GLN HE21 H -3.289 2.716 3.137 1.00 . A A . 9 GLN HE21 1 1 10 4879 1 1 9 GLN HE22 H -3.718 3.338 1.531 1.00 . A A . 9 GLN HE22 1 1 10 4880 1 1 9 GLN HG2 H -6.705 1.372 3.552 1.00 . A A . 9 GLN HG2 1 1 10 4881 1 1 9 GLN HG3 H -5.503 2.195 4.547 1.00 . A A . 9 GLN HG3 1 1 10 4882 1 1 9 GLN N N -6.688 -1.416 4.071 1.00 . A A . 9 GLN N 1 1 10 4883 1 1 9 GLN NE2 N -3.967 2.860 2.394 1.00 . A A . 9 GLN NE2 1 1 10 4884 1 1 9 GLN O O -5.212 0.636 6.757 1.00 . A A . 9 GLN O 1 1 10 4885 1 1 9 GLN OE1 O -5.883 2.426 1.449 1.00 . A A . 9 GLN OE1 1 1 10 4886 1 1 10 THR C C -7.874 2.489 6.457 1.00 . A A . 10 THR C 1 1 10 4887 1 1 10 THR CA C -8.005 1.156 7.198 1.00 . A A . 10 THR CA 1 1 10 4888 1 1 10 THR CB C -7.545 1.248 8.658 1.00 . A A . 10 THR CB 1 1 10 4889 1 1 10 THR CG2 C -8.374 2.245 9.464 1.00 . A A . 10 THR CG2 1 1 10 4890 1 1 10 THR H H -7.960 -0.609 6.005 1.00 . A A . 10 THR H 1 1 10 4891 1 1 10 THR HA H -9.065 0.919 7.252 1.00 . A A . 10 THR HA 1 1 10 4892 1 1 10 THR HB H -6.498 1.543 8.700 1.00 . A A . 10 THR HB 1 1 10 4893 1 1 10 THR HG1 H -7.815 -0.667 8.587 1.00 . A A . 10 THR HG1 1 1 10 4894 1 1 10 THR HG21 H -9.437 2.024 9.366 1.00 . A A . 10 THR HG21 1 1 10 4895 1 1 10 THR HG22 H -8.185 3.260 9.114 1.00 . A A . 10 THR HG22 1 1 10 4896 1 1 10 THR HG23 H -8.094 2.186 10.514 1.00 . A A . 10 THR HG23 1 1 10 4897 1 1 10 THR N N -7.350 0.060 6.455 1.00 . A A . 10 THR N 1 1 10 4898 1 1 10 THR O O -6.876 3.199 6.579 1.00 . A A . 10 THR O 1 1 10 4899 1 1 10 THR OG1 O -7.704 -0.004 9.291 1.00 . A A . 10 THR OG1 1 1 10 4900 1 1 11 CYS C C -9.643 5.147 5.353 1.00 . A A . 11 CYS C 1 1 10 4901 1 1 11 CYS CA C -8.868 3.968 4.743 1.00 . A A . 11 CYS CA 1 1 10 4902 1 1 11 CYS CB C -9.323 3.545 3.344 1.00 . A A . 11 CYS CB 1 1 10 4903 1 1 11 CYS H H -9.652 2.168 5.570 1.00 . A A . 11 CYS H 1 1 10 4904 1 1 11 CYS HA H -7.836 4.300 4.630 1.00 . A A . 11 CYS HA 1 1 10 4905 1 1 11 CYS HB2 H -9.145 2.477 3.217 1.00 . A A . 11 CYS HB2 1 1 10 4906 1 1 11 CYS HB3 H -10.389 3.732 3.230 1.00 . A A . 11 CYS HB3 1 1 10 4907 1 1 11 CYS N N -8.869 2.808 5.631 1.00 . A A . 11 CYS N 1 1 10 4908 1 1 11 CYS O O -10.816 5.372 5.061 1.00 . A A . 11 CYS O 1 1 10 4909 1 1 11 CYS SG S -8.418 4.391 2.030 1.00 . A A . 11 CYS SG 1 1 10 4910 1 1 12 ASP C C -9.347 8.304 5.881 1.00 . A A . 12 ASP C 1 1 10 4911 1 1 12 ASP CA C -9.412 7.111 6.866 1.00 . A A . 12 ASP CA 1 1 10 4912 1 1 12 ASP CB C -8.541 7.399 8.099 1.00 . A A . 12 ASP CB 1 1 10 4913 1 1 12 ASP CG C -8.734 6.431 9.267 1.00 . A A . 12 ASP CG 1 1 10 4914 1 1 12 ASP H H -8.062 5.513 6.527 1.00 . A A . 12 ASP H 1 1 10 4915 1 1 12 ASP HA H -10.450 7.020 7.193 1.00 . A A . 12 ASP HA 1 1 10 4916 1 1 12 ASP HB2 H -7.490 7.412 7.800 1.00 . A A . 12 ASP HB2 1 1 10 4917 1 1 12 ASP HB3 H -8.803 8.387 8.467 1.00 . A A . 12 ASP HB3 1 1 10 4918 1 1 12 ASP N N -8.989 5.830 6.292 1.00 . A A . 12 ASP N 1 1 10 4919 1 1 12 ASP O O -8.746 8.206 4.810 1.00 . A A . 12 ASP O 1 1 10 4920 1 1 12 ASP OD1 O -9.886 6.057 9.569 1.00 . A A . 12 ASP OD1 1 1 10 4921 1 1 12 ASP OD2 O -7.729 6.093 9.939 1.00 . A A . 12 ASP OD2 1 1 10 4922 1 1 13 SER C C -8.418 11.143 4.976 1.00 . A A . 13 SER C 1 1 10 4923 1 1 13 SER CA C -9.814 10.721 5.473 1.00 . A A . 13 SER CA 1 1 10 4924 1 1 13 SER CB C -10.457 11.861 6.270 1.00 . A A . 13 SER CB 1 1 10 4925 1 1 13 SER H H -10.302 9.518 7.182 1.00 . A A . 13 SER H 1 1 10 4926 1 1 13 SER HA H -10.428 10.563 4.590 1.00 . A A . 13 SER HA 1 1 10 4927 1 1 13 SER HB2 H -11.492 11.609 6.498 1.00 . A A . 13 SER HB2 1 1 10 4928 1 1 13 SER HB3 H -9.922 11.983 7.212 1.00 . A A . 13 SER HB3 1 1 10 4929 1 1 13 SER HG H -9.952 13.720 6.137 1.00 . A A . 13 SER HG 1 1 10 4930 1 1 13 SER N N -9.836 9.484 6.287 1.00 . A A . 13 SER N 1 1 10 4931 1 1 13 SER O O -8.287 11.784 3.933 1.00 . A A . 13 SER O 1 1 10 4932 1 1 13 SER OG O -10.416 13.083 5.555 1.00 . A A . 13 SER OG 1 1 10 4933 1 1 14 GLU C C -5.250 9.961 4.541 1.00 . A A . 14 GLU C 1 1 10 4934 1 1 14 GLU CA C -5.960 11.078 5.324 1.00 . A A . 14 GLU CA 1 1 10 4935 1 1 14 GLU CB C -5.167 11.384 6.602 1.00 . A A . 14 GLU CB 1 1 10 4936 1 1 14 GLU CD C -5.185 12.606 8.794 1.00 . A A . 14 GLU CD 1 1 10 4937 1 1 14 GLU CG C -5.718 12.591 7.372 1.00 . A A . 14 GLU CG 1 1 10 4938 1 1 14 GLU H H -7.517 10.254 6.545 1.00 . A A . 14 GLU H 1 1 10 4939 1 1 14 GLU HA H -5.932 11.966 4.692 1.00 . A A . 14 GLU HA 1 1 10 4940 1 1 14 GLU HB2 H -5.195 10.503 7.242 1.00 . A A . 14 GLU HB2 1 1 10 4941 1 1 14 GLU HB3 H -4.125 11.579 6.352 1.00 . A A . 14 GLU HB3 1 1 10 4942 1 1 14 GLU HG2 H -5.424 13.509 6.870 1.00 . A A . 14 GLU HG2 1 1 10 4943 1 1 14 GLU HG3 H -6.807 12.558 7.412 1.00 . A A . 14 GLU HG3 1 1 10 4944 1 1 14 GLU N N -7.354 10.764 5.687 1.00 . A A . 14 GLU N 1 1 10 4945 1 1 14 GLU O O -4.119 10.150 4.089 1.00 . A A . 14 GLU O 1 1 10 4946 1 1 14 GLU OE1 O -3.992 12.926 9.002 1.00 . A A . 14 GLU OE1 1 1 10 4947 1 1 14 GLU OE2 O -5.967 12.259 9.708 1.00 . A A . 14 GLU OE2 1 1 10 4948 1 1 15 ARG C C -5.206 7.519 2.371 1.00 . A A . 15 ARG C 1 1 10 4949 1 1 15 ARG CA C -5.180 7.571 3.895 1.00 . A A . 15 ARG CA 1 1 10 4950 1 1 15 ARG CB C -5.785 6.310 4.533 1.00 . A A . 15 ARG CB 1 1 10 4951 1 1 15 ARG CD C -3.869 5.039 5.393 1.00 . A A . 15 ARG CD 1 1 10 4952 1 1 15 ARG CG C -5.037 5.945 5.827 1.00 . A A . 15 ARG CG 1 1 10 4953 1 1 15 ARG CZ C -3.170 3.933 7.486 1.00 . A A . 15 ARG CZ 1 1 10 4954 1 1 15 ARG H H -6.817 8.688 4.724 1.00 . A A . 15 ARG H 1 1 10 4955 1 1 15 ARG HA H -4.127 7.626 4.173 1.00 . A A . 15 ARG HA 1 1 10 4956 1 1 15 ARG HB2 H -6.833 6.491 4.759 1.00 . A A . 15 ARG HB2 1 1 10 4957 1 1 15 ARG HB3 H -5.750 5.474 3.831 1.00 . A A . 15 ARG HB3 1 1 10 4958 1 1 15 ARG HD2 H -4.253 4.085 5.055 1.00 . A A . 15 ARG HD2 1 1 10 4959 1 1 15 ARG HD3 H -3.292 5.539 4.626 1.00 . A A . 15 ARG HD3 1 1 10 4960 1 1 15 ARG HE H -2.047 5.188 6.470 1.00 . A A . 15 ARG HE 1 1 10 4961 1 1 15 ARG HG2 H -4.678 6.844 6.331 1.00 . A A . 15 ARG HG2 1 1 10 4962 1 1 15 ARG HG3 H -5.699 5.413 6.505 1.00 . A A . 15 ARG HG3 1 1 10 4963 1 1 15 ARG HH11 H -5.065 3.344 7.067 1.00 . A A . 15 ARG HH11 1 1 10 4964 1 1 15 ARG HH12 H -4.196 2.458 8.304 1.00 . A A . 15 ARG HH12 1 1 10 4965 1 1 15 ARG HH21 H -1.387 4.282 8.319 1.00 . A A . 15 ARG HH21 1 1 10 4966 1 1 15 ARG HH22 H -2.348 2.967 9.021 1.00 . A A . 15 ARG HH22 1 1 10 4967 1 1 15 ARG N N -5.843 8.766 4.439 1.00 . A A . 15 ARG N 1 1 10 4968 1 1 15 ARG NE N -3.001 4.847 6.550 1.00 . A A . 15 ARG NE 1 1 10 4969 1 1 15 ARG NH1 N -4.241 3.216 7.637 1.00 . A A . 15 ARG NH1 1 1 10 4970 1 1 15 ARG NH2 N -2.214 3.692 8.323 1.00 . A A . 15 ARG NH2 1 1 10 4971 1 1 15 ARG O O -6.252 7.689 1.751 1.00 . A A . 15 ARG O 1 1 10 4972 1 1 16 LYS C C -4.437 5.664 -0.107 1.00 . A A . 16 LYS C 1 1 10 4973 1 1 16 LYS CA C -3.943 7.060 0.299 1.00 . A A . 16 LYS CA 1 1 10 4974 1 1 16 LYS CB C -2.497 7.324 -0.180 1.00 . A A . 16 LYS CB 1 1 10 4975 1 1 16 LYS CD C -2.567 9.922 0.228 1.00 . A A . 16 LYS CD 1 1 10 4976 1 1 16 LYS CE C -2.249 10.699 -1.061 1.00 . A A . 16 LYS CE 1 1 10 4977 1 1 16 LYS CG C -1.821 8.585 0.392 1.00 . A A . 16 LYS CG 1 1 10 4978 1 1 16 LYS H H -3.230 7.099 2.319 1.00 . A A . 16 LYS H 1 1 10 4979 1 1 16 LYS HA H -4.594 7.790 -0.186 1.00 . A A . 16 LYS HA 1 1 10 4980 1 1 16 LYS HB2 H -1.871 6.474 0.098 1.00 . A A . 16 LYS HB2 1 1 10 4981 1 1 16 LYS HB3 H -2.491 7.385 -1.268 1.00 . A A . 16 LYS HB3 1 1 10 4982 1 1 16 LYS HD2 H -3.644 9.796 0.341 1.00 . A A . 16 LYS HD2 1 1 10 4983 1 1 16 LYS HD3 H -2.246 10.550 1.058 1.00 . A A . 16 LYS HD3 1 1 10 4984 1 1 16 LYS HE2 H -2.496 11.750 -0.876 1.00 . A A . 16 LYS HE2 1 1 10 4985 1 1 16 LYS HE3 H -1.174 10.649 -1.257 1.00 . A A . 16 LYS HE3 1 1 10 4986 1 1 16 LYS HG2 H -1.670 8.423 1.460 1.00 . A A . 16 LYS HG2 1 1 10 4987 1 1 16 LYS HG3 H -0.827 8.680 -0.048 1.00 . A A . 16 LYS HG3 1 1 10 4988 1 1 16 LYS HZ1 H -2.745 9.307 -2.559 1.00 . A A . 16 LYS HZ1 1 1 10 4989 1 1 16 LYS HZ2 H -2.887 10.856 -3.031 1.00 . A A . 16 LYS HZ2 1 1 10 4990 1 1 16 LYS HZ3 H -4.013 10.220 -2.031 1.00 . A A . 16 LYS HZ3 1 1 10 4991 1 1 16 LYS N N -4.057 7.225 1.756 1.00 . A A . 16 LYS N 1 1 10 4992 1 1 16 LYS NZ N -3.019 10.233 -2.240 1.00 . A A . 16 LYS NZ 1 1 10 4993 1 1 16 LYS O O -3.740 4.667 0.084 1.00 . A A . 16 LYS O 1 1 10 4994 1 1 17 CYS C C -5.284 4.333 -2.770 1.00 . A A . 17 CYS C 1 1 10 4995 1 1 17 CYS CA C -6.084 4.430 -1.456 1.00 . A A . 17 CYS CA 1 1 10 4996 1 1 17 CYS CB C -7.602 4.551 -1.651 1.00 . A A . 17 CYS CB 1 1 10 4997 1 1 17 CYS H H -6.161 6.454 -0.781 1.00 . A A . 17 CYS H 1 1 10 4998 1 1 17 CYS HA H -5.892 3.538 -0.857 1.00 . A A . 17 CYS HA 1 1 10 4999 1 1 17 CYS HB2 H -8.052 4.622 -0.664 1.00 . A A . 17 CYS HB2 1 1 10 5000 1 1 17 CYS HB3 H -7.815 5.488 -2.168 1.00 . A A . 17 CYS HB3 1 1 10 5001 1 1 17 CYS N N -5.620 5.605 -0.717 1.00 . A A . 17 CYS N 1 1 10 5002 1 1 17 CYS O O -5.254 5.281 -3.559 1.00 . A A . 17 CYS O 1 1 10 5003 1 1 17 CYS SG S -8.482 3.231 -2.538 1.00 . A A . 17 CYS SG 1 1 10 5004 1 1 18 CYS C C -3.841 3.523 -5.370 1.00 . A A . 18 CYS C 1 1 10 5005 1 1 18 CYS CA C -3.473 3.067 -3.943 1.00 . A A . 18 CYS CA 1 1 10 5006 1 1 18 CYS CB C -3.066 1.583 -3.995 1.00 . A A . 18 CYS CB 1 1 10 5007 1 1 18 CYS H H -4.573 2.555 -2.208 1.00 . A A . 18 CYS H 1 1 10 5008 1 1 18 CYS HA H -2.609 3.651 -3.619 1.00 . A A . 18 CYS HA 1 1 10 5009 1 1 18 CYS HB2 H -3.964 0.982 -4.138 1.00 . A A . 18 CYS HB2 1 1 10 5010 1 1 18 CYS HB3 H -2.454 1.443 -4.887 1.00 . A A . 18 CYS HB3 1 1 10 5011 1 1 18 CYS N N -4.561 3.225 -2.962 1.00 . A A . 18 CYS N 1 1 10 5012 1 1 18 CYS O O -3.059 4.202 -6.036 1.00 . A A . 18 CYS O 1 1 10 5013 1 1 18 CYS SG S -2.118 0.869 -2.612 1.00 . A A . 18 CYS SG 1 1 10 5014 1 1 19 GLU C C -6.408 4.806 -7.242 1.00 . A A . 19 GLU C 1 1 10 5015 1 1 19 GLU CA C -5.541 3.530 -7.185 1.00 . A A . 19 GLU CA 1 1 10 5016 1 1 19 GLU CB C -6.203 2.289 -7.807 1.00 . A A . 19 GLU CB 1 1 10 5017 1 1 19 GLU CD C -5.763 0.028 -8.889 1.00 . A A . 19 GLU CD 1 1 10 5018 1 1 19 GLU CG C -5.159 1.211 -8.127 1.00 . A A . 19 GLU CG 1 1 10 5019 1 1 19 GLU H H -5.650 2.647 -5.244 1.00 . A A . 19 GLU H 1 1 10 5020 1 1 19 GLU HA H -4.687 3.764 -7.819 1.00 . A A . 19 GLU HA 1 1 10 5021 1 1 19 GLU HB2 H -6.949 1.892 -7.117 1.00 . A A . 19 GLU HB2 1 1 10 5022 1 1 19 GLU HB3 H -6.689 2.571 -8.741 1.00 . A A . 19 GLU HB3 1 1 10 5023 1 1 19 GLU HG2 H -4.361 1.655 -8.724 1.00 . A A . 19 GLU HG2 1 1 10 5024 1 1 19 GLU HG3 H -4.716 0.845 -7.198 1.00 . A A . 19 GLU HG3 1 1 10 5025 1 1 19 GLU N N -5.047 3.194 -5.840 1.00 . A A . 19 GLU N 1 1 10 5026 1 1 19 GLU O O -7.116 5.038 -8.223 1.00 . A A . 19 GLU O 1 1 10 5027 1 1 19 GLU OE1 O -6.713 -0.602 -8.388 1.00 . A A . 19 GLU OE1 1 1 10 5028 1 1 19 GLU OE2 O -5.240 -0.327 -9.975 1.00 . A A . 19 GLU OE2 1 1 10 5029 1 1 20 GLY C C -8.594 6.811 -5.802 1.00 . A A . 20 GLY C 1 1 10 5030 1 1 20 GLY CA C -7.087 6.920 -6.076 1.00 . A A . 20 GLY CA 1 1 10 5031 1 1 20 GLY H H -5.777 5.382 -5.410 1.00 . A A . 20 GLY H 1 1 10 5032 1 1 20 GLY HA2 H -6.644 7.484 -5.257 1.00 . A A . 20 GLY HA2 1 1 10 5033 1 1 20 GLY HA3 H -6.951 7.487 -6.998 1.00 . A A . 20 GLY HA3 1 1 10 5034 1 1 20 GLY N N -6.373 5.636 -6.191 1.00 . A A . 20 GLY N 1 1 10 5035 1 1 20 GLY O O -9.273 7.823 -5.625 1.00 . A A . 20 GLY O 1 1 10 5036 1 1 21 MET C C -11.059 5.348 -4.202 1.00 . A A . 21 MET C 1 1 10 5037 1 1 21 MET CA C -10.533 5.244 -5.650 1.00 . A A . 21 MET CA 1 1 10 5038 1 1 21 MET CB C -10.767 3.865 -6.290 1.00 . A A . 21 MET CB 1 1 10 5039 1 1 21 MET CE C -9.734 1.458 -8.153 1.00 . A A . 21 MET CE 1 1 10 5040 1 1 21 MET CG C -9.908 2.766 -5.652 1.00 . A A . 21 MET CG 1 1 10 5041 1 1 21 MET H H -8.474 4.830 -5.960 1.00 . A A . 21 MET H 1 1 10 5042 1 1 21 MET HA H -11.103 5.963 -6.230 1.00 . A A . 21 MET HA 1 1 10 5043 1 1 21 MET HB2 H -11.819 3.588 -6.217 1.00 . A A . 21 MET HB2 1 1 10 5044 1 1 21 MET HB3 H -10.517 3.944 -7.348 1.00 . A A . 21 MET HB3 1 1 10 5045 1 1 21 MET HE1 H -9.548 0.518 -8.674 1.00 . A A . 21 MET HE1 1 1 10 5046 1 1 21 MET HE2 H -10.608 1.936 -8.594 1.00 . A A . 21 MET HE2 1 1 10 5047 1 1 21 MET HE3 H -8.875 2.110 -8.277 1.00 . A A . 21 MET HE3 1 1 10 5048 1 1 21 MET HG2 H -8.859 3.056 -5.688 1.00 . A A . 21 MET HG2 1 1 10 5049 1 1 21 MET HG3 H -10.198 2.672 -4.608 1.00 . A A . 21 MET HG3 1 1 10 5050 1 1 21 MET N N -9.117 5.588 -5.803 1.00 . A A . 21 MET N 1 1 10 5051 1 1 21 MET O O -10.334 5.736 -3.284 1.00 . A A . 21 MET O 1 1 10 5052 1 1 21 MET SD S -10.030 1.127 -6.394 1.00 . A A . 21 MET SD 1 1 10 5053 1 1 22 VAL C C -12.528 4.705 -1.542 1.00 . A A . 22 VAL C 1 1 10 5054 1 1 22 VAL CA C -13.146 5.314 -2.807 1.00 . A A . 22 VAL CA 1 1 10 5055 1 1 22 VAL CB C -14.628 4.933 -2.972 1.00 . A A . 22 VAL CB 1 1 10 5056 1 1 22 VAL CG1 C -15.461 5.395 -1.774 1.00 . A A . 22 VAL CG1 1 1 10 5057 1 1 22 VAL CG2 C -15.238 5.612 -4.205 1.00 . A A . 22 VAL CG2 1 1 10 5058 1 1 22 VAL H H -12.877 4.793 -4.853 1.00 . A A . 22 VAL H 1 1 10 5059 1 1 22 VAL HA H -13.168 6.387 -2.662 1.00 . A A . 22 VAL HA 1 1 10 5060 1 1 22 VAL HB H -14.719 3.853 -3.089 1.00 . A A . 22 VAL HB 1 1 10 5061 1 1 22 VAL HG11 H -15.355 6.473 -1.654 1.00 . A A . 22 VAL HG11 1 1 10 5062 1 1 22 VAL HG12 H -16.511 5.154 -1.938 1.00 . A A . 22 VAL HG12 1 1 10 5063 1 1 22 VAL HG13 H -15.135 4.908 -0.857 1.00 . A A . 22 VAL HG13 1 1 10 5064 1 1 22 VAL HG21 H -16.295 5.358 -4.284 1.00 . A A . 22 VAL HG21 1 1 10 5065 1 1 22 VAL HG22 H -15.149 6.696 -4.117 1.00 . A A . 22 VAL HG22 1 1 10 5066 1 1 22 VAL HG23 H -14.726 5.296 -5.111 1.00 . A A . 22 VAL HG23 1 1 10 5067 1 1 22 VAL N N -12.360 5.071 -4.034 1.00 . A A . 22 VAL N 1 1 10 5068 1 1 22 VAL O O -12.183 3.522 -1.524 1.00 . A A . 22 VAL O 1 1 10 5069 1 1 23 CYS C C -12.464 5.723 1.982 1.00 . A A . 23 CYS C 1 1 10 5070 1 1 23 CYS CA C -11.658 5.337 0.723 1.00 . A A . 23 CYS CA 1 1 10 5071 1 1 23 CYS CB C -10.389 6.190 0.560 1.00 . A A . 23 CYS CB 1 1 10 5072 1 1 23 CYS H H -12.767 6.482 -0.649 1.00 . A A . 23 CYS H 1 1 10 5073 1 1 23 CYS HA H -11.357 4.293 0.803 1.00 . A A . 23 CYS HA 1 1 10 5074 1 1 23 CYS HB2 H -9.853 5.849 -0.325 1.00 . A A . 23 CYS HB2 1 1 10 5075 1 1 23 CYS HB3 H -10.695 7.219 0.369 1.00 . A A . 23 CYS HB3 1 1 10 5076 1 1 23 CYS N N -12.453 5.533 -0.491 1.00 . A A . 23 CYS N 1 1 10 5077 1 1 23 CYS O O -12.489 6.891 2.383 1.00 . A A . 23 CYS O 1 1 10 5078 1 1 23 CYS SG S -9.228 6.243 1.952 1.00 . A A . 23 CYS SG 1 1 10 5079 1 1 24 ARG C C -13.917 3.643 4.647 1.00 . A A . 24 ARG C 1 1 10 5080 1 1 24 ARG CA C -13.941 4.931 3.831 1.00 . A A . 24 ARG CA 1 1 10 5081 1 1 24 ARG CB C -15.394 5.384 3.591 1.00 . A A . 24 ARG CB 1 1 10 5082 1 1 24 ARG CD C -15.705 7.095 1.744 1.00 . A A . 24 ARG CD 1 1 10 5083 1 1 24 ARG CG C -15.587 6.883 3.267 1.00 . A A . 24 ARG CG 1 1 10 5084 1 1 24 ARG CZ C -17.696 6.814 0.282 1.00 . A A . 24 ARG CZ 1 1 10 5085 1 1 24 ARG H H -13.105 3.826 2.186 1.00 . A A . 24 ARG H 1 1 10 5086 1 1 24 ARG HA H -13.451 5.694 4.442 1.00 . A A . 24 ARG HA 1 1 10 5087 1 1 24 ARG HB2 H -15.843 4.741 2.834 1.00 . A A . 24 ARG HB2 1 1 10 5088 1 1 24 ARG HB3 H -15.941 5.210 4.520 1.00 . A A . 24 ARG HB3 1 1 10 5089 1 1 24 ARG HD2 H -15.712 8.153 1.553 1.00 . A A . 24 ARG HD2 1 1 10 5090 1 1 24 ARG HD3 H -14.889 6.623 1.229 1.00 . A A . 24 ARG HD3 1 1 10 5091 1 1 24 ARG HE H -17.366 5.753 1.921 1.00 . A A . 24 ARG HE 1 1 10 5092 1 1 24 ARG HG2 H -16.501 7.242 3.745 1.00 . A A . 24 ARG HG2 1 1 10 5093 1 1 24 ARG HG3 H -14.755 7.464 3.663 1.00 . A A . 24 ARG HG3 1 1 10 5094 1 1 24 ARG HH11 H -16.573 8.365 -0.385 1.00 . A A . 24 ARG HH11 1 1 10 5095 1 1 24 ARG HH12 H -18.025 7.993 -1.293 1.00 . A A . 24 ARG HH12 1 1 10 5096 1 1 24 ARG HH21 H -19.097 5.397 0.633 1.00 . A A . 24 ARG HH21 1 1 10 5097 1 1 24 ARG HH22 H -19.369 6.453 -0.736 1.00 . A A . 24 ARG HH22 1 1 10 5098 1 1 24 ARG N N -13.186 4.764 2.572 1.00 . A A . 24 ARG N 1 1 10 5099 1 1 24 ARG NE N -16.980 6.493 1.339 1.00 . A A . 24 ARG NE 1 1 10 5100 1 1 24 ARG NH1 N -17.396 7.784 -0.535 1.00 . A A . 24 ARG NH1 1 1 10 5101 1 1 24 ARG NH2 N -18.774 6.138 0.015 1.00 . A A . 24 ARG NH2 1 1 10 5102 1 1 24 ARG O O -14.744 2.754 4.442 1.00 . A A . 24 ARG O 1 1 10 5103 1 1 25 LEU C C -11.955 1.243 5.444 1.00 . A A . 25 LEU C 1 1 10 5104 1 1 25 LEU CA C -12.544 2.365 6.323 1.00 . A A . 25 LEU CA 1 1 10 5105 1 1 25 LEU CB C -13.685 1.880 7.243 1.00 . A A . 25 LEU CB 1 1 10 5106 1 1 25 LEU CD1 C -15.551 2.345 8.850 1.00 . A A . 25 LEU CD1 1 1 10 5107 1 1 25 LEU CD2 C -13.515 3.765 8.971 1.00 . A A . 25 LEU CD2 1 1 10 5108 1 1 25 LEU CG C -14.431 2.979 8.028 1.00 . A A . 25 LEU CG 1 1 10 5109 1 1 25 LEU H H -12.327 4.358 5.604 1.00 . A A . 25 LEU H 1 1 10 5110 1 1 25 LEU HA H -11.734 2.682 6.980 1.00 . A A . 25 LEU HA 1 1 10 5111 1 1 25 LEU HB2 H -14.416 1.344 6.636 1.00 . A A . 25 LEU HB2 1 1 10 5112 1 1 25 LEU HB3 H -13.272 1.165 7.950 1.00 . A A . 25 LEU HB3 1 1 10 5113 1 1 25 LEU HD11 H -16.132 3.127 9.325 1.00 . A A . 25 LEU HD11 1 1 10 5114 1 1 25 LEU HD12 H -15.135 1.697 9.619 1.00 . A A . 25 LEU HD12 1 1 10 5115 1 1 25 LEU HD13 H -16.207 1.766 8.200 1.00 . A A . 25 LEU HD13 1 1 10 5116 1 1 25 LEU HD21 H -13.037 3.092 9.682 1.00 . A A . 25 LEU HD21 1 1 10 5117 1 1 25 LEU HD22 H -14.098 4.508 9.512 1.00 . A A . 25 LEU HD22 1 1 10 5118 1 1 25 LEU HD23 H -12.746 4.287 8.402 1.00 . A A . 25 LEU HD23 1 1 10 5119 1 1 25 LEU HG H -14.893 3.674 7.329 1.00 . A A . 25 LEU HG 1 1 10 5120 1 1 25 LEU N N -12.945 3.554 5.555 1.00 . A A . 25 LEU N 1 1 10 5121 1 1 25 LEU O O -10.835 0.801 5.690 1.00 . A A . 25 LEU O 1 1 10 5122 1 1 26 TRP C C -11.457 1.006 2.098 1.00 . A A . 26 TRP C 1 1 10 5123 1 1 26 TRP CA C -12.020 0.131 3.225 1.00 . A A . 26 TRP CA 1 1 10 5124 1 1 26 TRP CB C -13.044 -0.889 2.700 1.00 . A A . 26 TRP CB 1 1 10 5125 1 1 26 TRP CD1 C -15.396 -0.468 3.524 1.00 . A A . 26 TRP CD1 1 1 10 5126 1 1 26 TRP CD2 C -14.966 0.606 1.615 1.00 . A A . 26 TRP CD2 1 1 10 5127 1 1 26 TRP CE2 C -16.290 0.969 2.004 1.00 . A A . 26 TRP CE2 1 1 10 5128 1 1 26 TRP CE3 C -14.447 1.241 0.465 1.00 . A A . 26 TRP CE3 1 1 10 5129 1 1 26 TRP CG C -14.443 -0.369 2.571 1.00 . A A . 26 TRP CG 1 1 10 5130 1 1 26 TRP CH2 C -16.519 2.487 0.129 1.00 . A A . 26 TRP CH2 1 1 10 5131 1 1 26 TRP CZ2 C -17.060 1.888 1.277 1.00 . A A . 26 TRP CZ2 1 1 10 5132 1 1 26 TRP CZ3 C -15.213 2.159 -0.274 1.00 . A A . 26 TRP CZ3 1 1 10 5133 1 1 26 TRP H H -13.509 1.320 4.169 1.00 . A A . 26 TRP H 1 1 10 5134 1 1 26 TRP HA H -11.181 -0.446 3.613 1.00 . A A . 26 TRP HA 1 1 10 5135 1 1 26 TRP HB2 H -12.726 -1.277 1.731 1.00 . A A . 26 TRP HB2 1 1 10 5136 1 1 26 TRP HB3 H -13.054 -1.741 3.380 1.00 . A A . 26 TRP HB3 1 1 10 5137 1 1 26 TRP HD1 H -15.289 -1.009 4.457 1.00 . A A . 26 TRP HD1 1 1 10 5138 1 1 26 TRP HE1 H -17.328 0.315 3.755 1.00 . A A . 26 TRP HE1 1 1 10 5139 1 1 26 TRP HE3 H -13.439 1.028 0.151 1.00 . A A . 26 TRP HE3 1 1 10 5140 1 1 26 TRP HH2 H -17.105 3.199 -0.436 1.00 . A A . 26 TRP HH2 1 1 10 5141 1 1 26 TRP HZ2 H -18.055 2.140 1.602 1.00 . A A . 26 TRP HZ2 1 1 10 5142 1 1 26 TRP HZ3 H -14.785 2.614 -1.153 1.00 . A A . 26 TRP HZ3 1 1 10 5143 1 1 26 TRP N N -12.589 0.917 4.323 1.00 . A A . 26 TRP N 1 1 10 5144 1 1 26 TRP NE1 N -16.512 0.248 3.155 1.00 . A A . 26 TRP NE1 1 1 10 5145 1 1 26 TRP O O -11.789 2.182 1.974 1.00 . A A . 26 TRP O 1 1 10 5146 1 1 27 CYS C C -10.738 -0.292 -1.085 1.00 . A A . 27 CYS C 1 1 10 5147 1 1 27 CYS CA C -10.352 0.861 -0.137 1.00 . A A . 27 CYS CA 1 1 10 5148 1 1 27 CYS CB C -8.870 1.280 -0.130 1.00 . A A . 27 CYS CB 1 1 10 5149 1 1 27 CYS H H -10.526 -0.603 1.354 1.00 . A A . 27 CYS H 1 1 10 5150 1 1 27 CYS HA H -10.954 1.733 -0.390 1.00 . A A . 27 CYS HA 1 1 10 5151 1 1 27 CYS HB2 H -8.788 2.222 0.409 1.00 . A A . 27 CYS HB2 1 1 10 5152 1 1 27 CYS HB3 H -8.324 0.542 0.456 1.00 . A A . 27 CYS HB3 1 1 10 5153 1 1 27 CYS N N -10.700 0.380 1.203 1.00 . A A . 27 CYS N 1 1 10 5154 1 1 27 CYS O O -10.539 -1.456 -0.715 1.00 . A A . 27 CYS O 1 1 10 5155 1 1 27 CYS SG S -7.964 1.457 -1.696 1.00 . A A . 27 CYS SG 1 1 10 5156 1 1 28 LYS C C -12.397 -0.936 -4.344 1.00 . A A . 28 LYS C 1 1 10 5157 1 1 28 LYS CA C -12.327 -1.058 -2.815 1.00 . A A . 28 LYS CA 1 1 10 5158 1 1 28 LYS CB C -13.696 -1.146 -2.103 1.00 . A A . 28 LYS CB 1 1 10 5159 1 1 28 LYS CD C -13.844 -3.405 -0.998 1.00 . A A . 28 LYS CD 1 1 10 5160 1 1 28 LYS CE C -14.461 -4.801 -1.066 1.00 . A A . 28 LYS CE 1 1 10 5161 1 1 28 LYS CG C -14.314 -2.550 -2.184 1.00 . A A . 28 LYS CG 1 1 10 5162 1 1 28 LYS H H -11.649 0.957 -2.392 1.00 . A A . 28 LYS H 1 1 10 5163 1 1 28 LYS HA H -11.825 -2.015 -2.661 1.00 . A A . 28 LYS HA 1 1 10 5164 1 1 28 LYS HB2 H -13.572 -0.898 -1.049 1.00 . A A . 28 LYS HB2 1 1 10 5165 1 1 28 LYS HB3 H -14.390 -0.411 -2.509 1.00 . A A . 28 LYS HB3 1 1 10 5166 1 1 28 LYS HD2 H -12.757 -3.485 -1.003 1.00 . A A . 28 LYS HD2 1 1 10 5167 1 1 28 LYS HD3 H -14.148 -2.920 -0.071 1.00 . A A . 28 LYS HD3 1 1 10 5168 1 1 28 LYS HE2 H -15.540 -4.711 -1.218 1.00 . A A . 28 LYS HE2 1 1 10 5169 1 1 28 LYS HE3 H -14.037 -5.319 -1.931 1.00 . A A . 28 LYS HE3 1 1 10 5170 1 1 28 LYS HG2 H -15.399 -2.465 -2.141 1.00 . A A . 28 LYS HG2 1 1 10 5171 1 1 28 LYS HG3 H -14.047 -3.029 -3.127 1.00 . A A . 28 LYS HG3 1 1 10 5172 1 1 28 LYS HZ1 H -14.681 -5.176 0.959 1.00 . A A . 28 LYS HZ1 1 1 10 5173 1 1 28 LYS HZ2 H -13.196 -5.568 0.377 1.00 . A A . 28 LYS HZ2 1 1 10 5174 1 1 28 LYS HZ3 H -14.456 -6.548 0.030 1.00 . A A . 28 LYS HZ3 1 1 10 5175 1 1 28 LYS N N -11.496 -0.017 -2.160 1.00 . A A . 28 LYS N 1 1 10 5176 1 1 28 LYS NZ N -14.191 -5.580 0.163 1.00 . A A . 28 LYS NZ 1 1 10 5177 1 1 28 LYS O O -11.477 -1.398 -5.005 1.00 . A A . 28 LYS O 1 1 10 5178 1 1 29 LYS C C -14.929 0.842 -6.479 1.00 . A A . 29 LYS C 1 1 10 5179 1 1 29 LYS CA C -13.608 0.093 -6.304 1.00 . A A . 29 LYS CA 1 1 10 5180 1 1 29 LYS CB C -13.534 -1.069 -7.326 1.00 . A A . 29 LYS CB 1 1 10 5181 1 1 29 LYS CD C -12.225 -1.947 -9.359 1.00 . A A . 29 LYS CD 1 1 10 5182 1 1 29 LYS CE C -13.188 -1.620 -10.501 1.00 . A A . 29 LYS CE 1 1 10 5183 1 1 29 LYS CG C -12.292 -0.931 -8.217 1.00 . A A . 29 LYS CG 1 1 10 5184 1 1 29 LYS H H -14.247 -0.166 -4.290 1.00 . A A . 29 LYS H 1 1 10 5185 1 1 29 LYS HA H -12.795 0.792 -6.498 1.00 . A A . 29 LYS HA 1 1 10 5186 1 1 29 LYS HB2 H -13.497 -2.032 -6.812 1.00 . A A . 29 LYS HB2 1 1 10 5187 1 1 29 LYS HB3 H -14.419 -1.063 -7.962 1.00 . A A . 29 LYS HB3 1 1 10 5188 1 1 29 LYS HD2 H -11.212 -1.927 -9.758 1.00 . A A . 29 LYS HD2 1 1 10 5189 1 1 29 LYS HD3 H -12.421 -2.949 -8.975 1.00 . A A . 29 LYS HD3 1 1 10 5190 1 1 29 LYS HE2 H -14.219 -1.741 -10.157 1.00 . A A . 29 LYS HE2 1 1 10 5191 1 1 29 LYS HE3 H -13.038 -0.579 -10.807 1.00 . A A . 29 LYS HE3 1 1 10 5192 1 1 29 LYS HG2 H -12.260 0.073 -8.642 1.00 . A A . 29 LYS HG2 1 1 10 5193 1 1 29 LYS HG3 H -11.406 -1.072 -7.601 1.00 . A A . 29 LYS HG3 1 1 10 5194 1 1 29 LYS HZ1 H -13.044 -3.486 -11.379 1.00 . A A . 29 LYS HZ1 1 1 10 5195 1 1 29 LYS HZ2 H -11.968 -2.396 -11.980 1.00 . A A . 29 LYS HZ2 1 1 10 5196 1 1 29 LYS HZ3 H -13.539 -2.339 -12.433 1.00 . A A . 29 LYS HZ3 1 1 10 5197 1 1 29 LYS N N -13.480 -0.385 -4.910 1.00 . A A . 29 LYS N 1 1 10 5198 1 1 29 LYS NZ N -12.922 -2.515 -11.644 1.00 . A A . 29 LYS NZ 1 1 10 5199 1 1 29 LYS O O -15.939 0.437 -5.903 1.00 . A A . 29 LYS O 1 1 10 5200 1 1 30 LYS C C -16.000 3.350 -9.051 1.00 . A A . 30 LYS C 1 1 10 5201 1 1 30 LYS CA C -16.179 2.614 -7.713 1.00 . A A . 30 LYS CA 1 1 10 5202 1 1 30 LYS CB C -16.598 3.555 -6.561 1.00 . A A . 30 LYS CB 1 1 10 5203 1 1 30 LYS CD C -18.881 2.501 -6.074 1.00 . A A . 30 LYS CD 1 1 10 5204 1 1 30 LYS CE C -20.002 2.730 -5.052 1.00 . A A . 30 LYS CE 1 1 10 5205 1 1 30 LYS CG C -18.113 3.784 -6.454 1.00 . A A . 30 LYS CG 1 1 10 5206 1 1 30 LYS H H -14.084 2.129 -7.772 1.00 . A A . 30 LYS H 1 1 10 5207 1 1 30 LYS HA H -16.969 1.881 -7.881 1.00 . A A . 30 LYS HA 1 1 10 5208 1 1 30 LYS HB2 H -16.261 3.148 -5.606 1.00 . A A . 30 LYS HB2 1 1 10 5209 1 1 30 LYS HB3 H -16.107 4.519 -6.691 1.00 . A A . 30 LYS HB3 1 1 10 5210 1 1 30 LYS HD2 H -19.315 2.073 -6.980 1.00 . A A . 30 LYS HD2 1 1 10 5211 1 1 30 LYS HD3 H -18.196 1.761 -5.660 1.00 . A A . 30 LYS HD3 1 1 10 5212 1 1 30 LYS HE2 H -20.694 3.480 -5.438 1.00 . A A . 30 LYS HE2 1 1 10 5213 1 1 30 LYS HE3 H -20.555 1.793 -4.935 1.00 . A A . 30 LYS HE3 1 1 10 5214 1 1 30 LYS HG2 H -18.277 4.551 -5.697 1.00 . A A . 30 LYS HG2 1 1 10 5215 1 1 30 LYS HG3 H -18.496 4.169 -7.399 1.00 . A A . 30 LYS HG3 1 1 10 5216 1 1 30 LYS HZ1 H -19.141 4.115 -3.751 1.00 . A A . 30 LYS HZ1 1 1 10 5217 1 1 30 LYS HZ2 H -18.738 2.532 -3.416 1.00 . A A . 30 LYS HZ2 1 1 10 5218 1 1 30 LYS HZ3 H -20.214 3.136 -3.030 1.00 . A A . 30 LYS HZ3 1 1 10 5219 1 1 30 LYS N N -14.955 1.875 -7.328 1.00 . A A . 30 LYS N 1 1 10 5220 1 1 30 LYS NZ N -19.477 3.154 -3.732 1.00 . A A . 30 LYS NZ 1 1 10 5221 1 1 30 LYS O O -16.331 4.530 -9.183 1.00 . A A . 30 LYS O 1 1 10 5222 1 1 31 LEU C C -14.851 2.066 -12.316 1.00 . A A . 31 LEU C 1 1 10 5223 1 1 31 LEU CA C -14.920 3.216 -11.294 1.00 . A A . 31 LEU CA 1 1 10 5224 1 1 31 LEU CB C -13.586 3.961 -11.074 1.00 . A A . 31 LEU CB 1 1 10 5225 1 1 31 LEU CD1 C -12.490 6.104 -11.807 1.00 . A A . 31 LEU CD1 1 1 10 5226 1 1 31 LEU CD2 C -12.043 4.049 -13.094 1.00 . A A . 31 LEU CD2 1 1 10 5227 1 1 31 LEU CG C -13.105 4.787 -12.281 1.00 . A A . 31 LEU CG 1 1 10 5228 1 1 31 LEU H H -15.162 1.705 -9.838 1.00 . A A . 31 LEU H 1 1 10 5229 1 1 31 LEU HA H -15.666 3.931 -11.648 1.00 . A A . 31 LEU HA 1 1 10 5230 1 1 31 LEU HB2 H -13.728 4.643 -10.235 1.00 . A A . 31 LEU HB2 1 1 10 5231 1 1 31 LEU HB3 H -12.812 3.253 -10.779 1.00 . A A . 31 LEU HB3 1 1 10 5232 1 1 31 LEU HD11 H -13.250 6.701 -11.304 1.00 . A A . 31 LEU HD11 1 1 10 5233 1 1 31 LEU HD12 H -12.124 6.667 -12.664 1.00 . A A . 31 LEU HD12 1 1 10 5234 1 1 31 LEU HD13 H -11.670 5.910 -11.117 1.00 . A A . 31 LEU HD13 1 1 10 5235 1 1 31 LEU HD21 H -11.829 4.608 -14.004 1.00 . A A . 31 LEU HD21 1 1 10 5236 1 1 31 LEU HD22 H -12.391 3.057 -13.368 1.00 . A A . 31 LEU HD22 1 1 10 5237 1 1 31 LEU HD23 H -11.129 3.942 -12.510 1.00 . A A . 31 LEU HD23 1 1 10 5238 1 1 31 LEU HG H -13.955 5.021 -12.917 1.00 . A A . 31 LEU HG 1 1 10 5239 1 1 31 LEU N N -15.346 2.686 -9.997 1.00 . A A . 31 LEU N 1 1 10 5240 1 1 31 LEU O O -14.774 0.901 -11.919 1.00 . A A . 31 LEU O 1 1 10 5241 1 1 32 LEU C C -13.669 1.437 -15.418 1.00 . A A . 32 LEU C 1 1 10 5242 1 1 32 LEU CA C -14.972 1.302 -14.642 1.00 . A A . 32 LEU CA 1 1 10 5243 1 1 32 LEU CB C -16.149 1.542 -15.618 1.00 . A A . 32 LEU CB 1 1 10 5244 1 1 32 LEU CD1 C -18.127 2.237 -14.108 1.00 . A A . 32 LEU CD1 1 1 10 5245 1 1 32 LEU CD2 C -18.495 0.791 -16.083 1.00 . A A . 32 LEU CD2 1 1 10 5246 1 1 32 LEU CG C -17.496 1.134 -14.969 1.00 . A A . 32 LEU CG 1 1 10 5247 1 1 32 LEU H H -15.043 3.316 -13.922 1.00 . A A . 32 LEU H 1 1 10 5248 1 1 32 LEU HA H -15.026 0.303 -14.226 1.00 . A A . 32 LEU HA 1 1 10 5249 1 1 32 LEU HB2 H -16.184 2.576 -15.961 1.00 . A A . 32 LEU HB2 1 1 10 5250 1 1 32 LEU HB3 H -15.977 0.904 -16.486 1.00 . A A . 32 LEU HB3 1 1 10 5251 1 1 32 LEU HD11 H -18.190 3.165 -14.679 1.00 . A A . 32 LEU HD11 1 1 10 5252 1 1 32 LEU HD12 H -17.537 2.398 -13.208 1.00 . A A . 32 LEU HD12 1 1 10 5253 1 1 32 LEU HD13 H -19.129 1.937 -13.799 1.00 . A A . 32 LEU HD13 1 1 10 5254 1 1 32 LEU HD21 H -19.446 0.478 -15.650 1.00 . A A . 32 LEU HD21 1 1 10 5255 1 1 32 LEU HD22 H -18.112 -0.027 -16.694 1.00 . A A . 32 LEU HD22 1 1 10 5256 1 1 32 LEU HD23 H -18.662 1.662 -16.719 1.00 . A A . 32 LEU HD23 1 1 10 5257 1 1 32 LEU HG H -17.356 0.245 -14.351 1.00 . A A . 32 LEU HG 1 1 10 5258 1 1 32 LEU N N -14.982 2.350 -13.610 1.00 . A A . 32 LEU N 1 1 10 5259 1 1 32 LEU O O -12.782 0.624 -15.316 1.00 . A A . 32 LEU O 1 1 10 5260 1 1 32 LEU OXT O -13.532 2.298 -16.020 1.00 . A A . 32 LEU OXT 1 1 11 5261 1 1 1 GLY C C 3.073 -6.468 -4.453 1.00 . A A . 1 GLY C 1 1 11 5262 1 1 1 GLY CA C 4.227 -6.612 -5.428 1.00 . A A . 1 GLY CA 1 1 11 5263 1 1 1 GLY H1 H 5.987 -7.657 -5.488 1.00 . A A . 1 GLY H1 1 1 11 5264 1 1 1 GLY H2 H 5.292 -7.623 -4.004 1.00 . A A . 1 GLY H2 1 1 11 5265 1 1 1 GLY H3 H 4.659 -8.604 -5.151 1.00 . A A . 1 GLY H3 1 1 11 5266 1 1 1 GLY HA2 H 4.794 -5.683 -5.459 1.00 . A A . 1 GLY HA2 1 1 11 5267 1 1 1 GLY HA3 H 3.828 -6.818 -6.422 1.00 . A A . 1 GLY HA3 1 1 11 5268 1 1 1 GLY N N 5.105 -7.708 -4.996 1.00 . A A . 1 GLY N 1 1 11 5269 1 1 1 GLY O O 2.141 -7.269 -4.528 1.00 . A A . 1 GLY O 1 1 11 5270 1 1 2 PRO C C 0.836 -4.733 -2.826 1.00 . A A . 2 PRO C 1 1 11 5271 1 1 2 PRO CA C 2.179 -5.363 -2.419 1.00 . A A . 2 PRO CA 1 1 11 5272 1 1 2 PRO CB C 2.924 -4.523 -1.372 1.00 . A A . 2 PRO CB 1 1 11 5273 1 1 2 PRO CD C 4.206 -4.528 -3.373 1.00 . A A . 2 PRO CD 1 1 11 5274 1 1 2 PRO CG C 3.794 -3.606 -2.226 1.00 . A A . 2 PRO CG 1 1 11 5275 1 1 2 PRO HA H 1.974 -6.347 -1.995 1.00 . A A . 2 PRO HA 1 1 11 5276 1 1 2 PRO HB2 H 2.256 -3.955 -0.725 1.00 . A A . 2 PRO HB2 1 1 11 5277 1 1 2 PRO HB3 H 3.564 -5.174 -0.772 1.00 . A A . 2 PRO HB3 1 1 11 5278 1 1 2 PRO HD2 H 4.365 -3.948 -4.284 1.00 . A A . 2 PRO HD2 1 1 11 5279 1 1 2 PRO HD3 H 5.114 -5.062 -3.098 1.00 . A A . 2 PRO HD3 1 1 11 5280 1 1 2 PRO HG2 H 3.197 -2.778 -2.612 1.00 . A A . 2 PRO HG2 1 1 11 5281 1 1 2 PRO HG3 H 4.657 -3.237 -1.672 1.00 . A A . 2 PRO HG3 1 1 11 5282 1 1 2 PRO N N 3.126 -5.493 -3.527 1.00 . A A . 2 PRO N 1 1 11 5283 1 1 2 PRO O O 0.637 -4.273 -3.955 1.00 . A A . 2 PRO O 1 1 11 5284 1 1 3 TYR C C -1.969 -3.218 -0.954 1.00 . A A . 3 TYR C 1 1 11 5285 1 1 3 TYR CA C -1.445 -4.157 -2.044 1.00 . A A . 3 TYR CA 1 1 11 5286 1 1 3 TYR CB C -2.445 -5.244 -2.492 1.00 . A A . 3 TYR CB 1 1 11 5287 1 1 3 TYR CD1 C -2.234 -7.759 -2.785 1.00 . A A . 3 TYR CD1 1 1 11 5288 1 1 3 TYR CD2 C -2.060 -6.844 -0.535 1.00 . A A . 3 TYR CD2 1 1 11 5289 1 1 3 TYR CE1 C -2.040 -9.060 -2.277 1.00 . A A . 3 TYR CE1 1 1 11 5290 1 1 3 TYR CE2 C -1.850 -8.142 -0.026 1.00 . A A . 3 TYR CE2 1 1 11 5291 1 1 3 TYR CG C -2.242 -6.644 -1.920 1.00 . A A . 3 TYR CG 1 1 11 5292 1 1 3 TYR CZ C -1.837 -9.256 -0.894 1.00 . A A . 3 TYR CZ 1 1 11 5293 1 1 3 TYR H H 0.134 -5.070 -0.966 1.00 . A A . 3 TYR H 1 1 11 5294 1 1 3 TYR HA H -1.384 -3.495 -2.906 1.00 . A A . 3 TYR HA 1 1 11 5295 1 1 3 TYR HB2 H -3.456 -4.916 -2.251 1.00 . A A . 3 TYR HB2 1 1 11 5296 1 1 3 TYR HB3 H -2.385 -5.312 -3.578 1.00 . A A . 3 TYR HB3 1 1 11 5297 1 1 3 TYR HD1 H -2.377 -7.625 -3.848 1.00 . A A . 3 TYR HD1 1 1 11 5298 1 1 3 TYR HD2 H -2.068 -6.002 0.142 1.00 . A A . 3 TYR HD2 1 1 11 5299 1 1 3 TYR HE1 H -2.039 -9.908 -2.947 1.00 . A A . 3 TYR HE1 1 1 11 5300 1 1 3 TYR HE2 H -1.701 -8.292 1.033 1.00 . A A . 3 TYR HE2 1 1 11 5301 1 1 3 TYR HH H -1.732 -11.198 -1.076 1.00 . A A . 3 TYR HH 1 1 11 5302 1 1 3 TYR N N -0.092 -4.684 -1.871 1.00 . A A . 3 TYR N 1 1 11 5303 1 1 3 TYR O O -1.652 -3.400 0.225 1.00 . A A . 3 TYR O 1 1 11 5304 1 1 3 TYR OH O -1.607 -10.504 -0.399 1.00 . A A . 3 TYR OH 1 1 11 5305 1 1 4 CYS C C -5.095 -1.751 -0.481 1.00 . A A . 4 CYS C 1 1 11 5306 1 1 4 CYS CA C -3.593 -1.435 -0.416 1.00 . A A . 4 CYS CA 1 1 11 5307 1 1 4 CYS CB C -3.300 0.057 -0.620 1.00 . A A . 4 CYS CB 1 1 11 5308 1 1 4 CYS H H -2.914 -2.098 -2.337 1.00 . A A . 4 CYS H 1 1 11 5309 1 1 4 CYS HA H -3.281 -1.669 0.599 1.00 . A A . 4 CYS HA 1 1 11 5310 1 1 4 CYS HB2 H -3.921 0.413 -1.440 1.00 . A A . 4 CYS HB2 1 1 11 5311 1 1 4 CYS HB3 H -3.608 0.585 0.279 1.00 . A A . 4 CYS HB3 1 1 11 5312 1 1 4 CYS N N -2.832 -2.274 -1.343 1.00 . A A . 4 CYS N 1 1 11 5313 1 1 4 CYS O O -5.649 -2.305 0.467 1.00 . A A . 4 CYS O 1 1 11 5314 1 1 4 CYS SG S -1.606 0.588 -0.966 1.00 . A A . 4 CYS SG 1 1 11 5315 1 1 5 GLN C C -7.524 -3.252 -1.563 1.00 . A A . 5 GLN C 1 1 11 5316 1 1 5 GLN CA C -7.205 -1.758 -1.758 1.00 . A A . 5 GLN CA 1 1 11 5317 1 1 5 GLN CB C -7.722 -1.160 -3.090 1.00 . A A . 5 GLN CB 1 1 11 5318 1 1 5 GLN CD C -7.379 -3.077 -4.835 1.00 . A A . 5 GLN CD 1 1 11 5319 1 1 5 GLN CG C -8.346 -2.136 -4.106 1.00 . A A . 5 GLN CG 1 1 11 5320 1 1 5 GLN H H -5.269 -1.067 -2.392 1.00 . A A . 5 GLN H 1 1 11 5321 1 1 5 GLN HA H -7.723 -1.234 -0.953 1.00 . A A . 5 GLN HA 1 1 11 5322 1 1 5 GLN HB2 H -8.498 -0.440 -2.835 1.00 . A A . 5 GLN HB2 1 1 11 5323 1 1 5 GLN HB3 H -6.945 -0.577 -3.581 1.00 . A A . 5 GLN HB3 1 1 11 5324 1 1 5 GLN HE21 H -5.681 -2.017 -4.438 1.00 . A A . 5 GLN HE21 1 1 11 5325 1 1 5 GLN HE22 H -5.495 -3.503 -5.350 1.00 . A A . 5 GLN HE22 1 1 11 5326 1 1 5 GLN HG2 H -9.113 -2.731 -3.610 1.00 . A A . 5 GLN HG2 1 1 11 5327 1 1 5 GLN HG3 H -8.855 -1.547 -4.862 1.00 . A A . 5 GLN HG3 1 1 11 5328 1 1 5 GLN N N -5.765 -1.487 -1.611 1.00 . A A . 5 GLN N 1 1 11 5329 1 1 5 GLN NE2 N -6.082 -2.877 -4.798 1.00 . A A . 5 GLN NE2 1 1 11 5330 1 1 5 GLN O O -8.458 -3.605 -0.843 1.00 . A A . 5 GLN O 1 1 11 5331 1 1 5 GLN OE1 O -7.808 -4.006 -5.504 1.00 . A A . 5 GLN OE1 1 1 11 5332 1 1 6 LYS C C -6.574 -6.140 -0.532 1.00 . A A . 6 LYS C 1 1 11 5333 1 1 6 LYS CA C -6.802 -5.601 -1.948 1.00 . A A . 6 LYS CA 1 1 11 5334 1 1 6 LYS CB C -5.938 -6.311 -3.011 1.00 . A A . 6 LYS CB 1 1 11 5335 1 1 6 LYS CD C -6.174 -7.644 -5.190 1.00 . A A . 6 LYS CD 1 1 11 5336 1 1 6 LYS CE C -7.084 -8.629 -5.938 1.00 . A A . 6 LYS CE 1 1 11 5337 1 1 6 LYS CG C -6.859 -7.131 -3.919 1.00 . A A . 6 LYS CG 1 1 11 5338 1 1 6 LYS H H -5.948 -3.793 -2.705 1.00 . A A . 6 LYS H 1 1 11 5339 1 1 6 LYS HA H -7.848 -5.839 -2.142 1.00 . A A . 6 LYS HA 1 1 11 5340 1 1 6 LYS HB2 H -5.404 -5.580 -3.622 1.00 . A A . 6 LYS HB2 1 1 11 5341 1 1 6 LYS HB3 H -5.209 -6.972 -2.540 1.00 . A A . 6 LYS HB3 1 1 11 5342 1 1 6 LYS HD2 H -5.928 -6.802 -5.837 1.00 . A A . 6 LYS HD2 1 1 11 5343 1 1 6 LYS HD3 H -5.248 -8.155 -4.927 1.00 . A A . 6 LYS HD3 1 1 11 5344 1 1 6 LYS HE2 H -6.604 -8.905 -6.881 1.00 . A A . 6 LYS HE2 1 1 11 5345 1 1 6 LYS HE3 H -7.175 -9.533 -5.333 1.00 . A A . 6 LYS HE3 1 1 11 5346 1 1 6 LYS HG2 H -7.256 -7.972 -3.350 1.00 . A A . 6 LYS HG2 1 1 11 5347 1 1 6 LYS HG3 H -7.691 -6.498 -4.222 1.00 . A A . 6 LYS HG3 1 1 11 5348 1 1 6 LYS HZ1 H -9.031 -8.776 -6.629 1.00 . A A . 6 LYS HZ1 1 1 11 5349 1 1 6 LYS HZ2 H -8.362 -7.286 -6.854 1.00 . A A . 6 LYS HZ2 1 1 11 5350 1 1 6 LYS HZ3 H -8.887 -7.772 -5.348 1.00 . A A . 6 LYS HZ3 1 1 11 5351 1 1 6 LYS N N -6.665 -4.142 -2.080 1.00 . A A . 6 LYS N 1 1 11 5352 1 1 6 LYS NZ N -8.434 -8.071 -6.207 1.00 . A A . 6 LYS NZ 1 1 11 5353 1 1 6 LYS O O -6.889 -7.300 -0.281 1.00 . A A . 6 LYS O 1 1 11 5354 1 1 7 TRP C C -6.951 -4.595 2.691 1.00 . A A . 7 TRP C 1 1 11 5355 1 1 7 TRP CA C -6.145 -5.594 1.845 1.00 . A A . 7 TRP CA 1 1 11 5356 1 1 7 TRP CB C -4.668 -5.713 2.257 1.00 . A A . 7 TRP CB 1 1 11 5357 1 1 7 TRP CD1 C -4.369 -6.576 4.643 1.00 . A A . 7 TRP CD1 1 1 11 5358 1 1 7 TRP CD2 C -4.612 -8.194 3.117 1.00 . A A . 7 TRP CD2 1 1 11 5359 1 1 7 TRP CE2 C -4.556 -8.834 4.387 1.00 . A A . 7 TRP CE2 1 1 11 5360 1 1 7 TRP CE3 C -4.837 -9.013 1.991 1.00 . A A . 7 TRP CE3 1 1 11 5361 1 1 7 TRP CG C -4.447 -6.759 3.304 1.00 . A A . 7 TRP CG 1 1 11 5362 1 1 7 TRP CH2 C -4.900 -11.014 3.385 1.00 . A A . 7 TRP CH2 1 1 11 5363 1 1 7 TRP CZ2 C -4.685 -10.224 4.526 1.00 . A A . 7 TRP CZ2 1 1 11 5364 1 1 7 TRP CZ3 C -4.994 -10.403 2.123 1.00 . A A . 7 TRP CZ3 1 1 11 5365 1 1 7 TRP H H -6.023 -4.318 0.147 1.00 . A A . 7 TRP H 1 1 11 5366 1 1 7 TRP HA H -6.614 -6.566 2.008 1.00 . A A . 7 TRP HA 1 1 11 5367 1 1 7 TRP HB2 H -4.077 -6.007 1.391 1.00 . A A . 7 TRP HB2 1 1 11 5368 1 1 7 TRP HB3 H -4.294 -4.745 2.597 1.00 . A A . 7 TRP HB3 1 1 11 5369 1 1 7 TRP HD1 H -4.347 -5.610 5.135 1.00 . A A . 7 TRP HD1 1 1 11 5370 1 1 7 TRP HE1 H -4.375 -7.923 6.292 1.00 . A A . 7 TRP HE1 1 1 11 5371 1 1 7 TRP HE3 H -4.893 -8.560 1.010 1.00 . A A . 7 TRP HE3 1 1 11 5372 1 1 7 TRP HH2 H -4.988 -12.089 3.472 1.00 . A A . 7 TRP HH2 1 1 11 5373 1 1 7 TRP HZ2 H -4.601 -10.677 5.499 1.00 . A A . 7 TRP HZ2 1 1 11 5374 1 1 7 TRP HZ3 H -5.168 -11.004 1.241 1.00 . A A . 7 TRP HZ3 1 1 11 5375 1 1 7 TRP N N -6.222 -5.271 0.419 1.00 . A A . 7 TRP N 1 1 11 5376 1 1 7 TRP NE1 N -4.364 -7.804 5.280 1.00 . A A . 7 TRP NE1 1 1 11 5377 1 1 7 TRP O O -6.731 -4.495 3.894 1.00 . A A . 7 TRP O 1 1 11 5378 1 1 8 MET C C -8.115 -1.956 3.700 1.00 . A A . 8 MET C 1 1 11 5379 1 1 8 MET CA C -8.829 -2.948 2.762 1.00 . A A . 8 MET CA 1 1 11 5380 1 1 8 MET CB C -9.982 -3.742 3.404 1.00 . A A . 8 MET CB 1 1 11 5381 1 1 8 MET CE C -11.879 -6.452 3.722 1.00 . A A . 8 MET CE 1 1 11 5382 1 1 8 MET CG C -10.934 -4.267 2.318 1.00 . A A . 8 MET CG 1 1 11 5383 1 1 8 MET H H -8.033 -4.001 1.088 1.00 . A A . 8 MET H 1 1 11 5384 1 1 8 MET HA H -9.274 -2.325 1.985 1.00 . A A . 8 MET HA 1 1 11 5385 1 1 8 MET HB2 H -9.584 -4.569 3.992 1.00 . A A . 8 MET HB2 1 1 11 5386 1 1 8 MET HB3 H -10.549 -3.098 4.073 1.00 . A A . 8 MET HB3 1 1 11 5387 1 1 8 MET HE1 H -12.693 -6.962 4.234 1.00 . A A . 8 MET HE1 1 1 11 5388 1 1 8 MET HE2 H -11.456 -7.114 2.967 1.00 . A A . 8 MET HE2 1 1 11 5389 1 1 8 MET HE3 H -11.112 -6.204 4.455 1.00 . A A . 8 MET HE3 1 1 11 5390 1 1 8 MET HG2 H -11.179 -3.444 1.645 1.00 . A A . 8 MET HG2 1 1 11 5391 1 1 8 MET HG3 H -10.425 -5.035 1.734 1.00 . A A . 8 MET HG3 1 1 11 5392 1 1 8 MET N N -7.901 -3.866 2.084 1.00 . A A . 8 MET N 1 1 11 5393 1 1 8 MET O O -8.280 -1.978 4.922 1.00 . A A . 8 MET O 1 1 11 5394 1 1 8 MET SD S -12.499 -4.941 2.934 1.00 . A A . 8 MET SD 1 1 11 5395 1 1 9 GLN C C -6.698 0.865 4.669 1.00 . A A . 9 GLN C 1 1 11 5396 1 1 9 GLN CA C -6.245 -0.231 3.669 1.00 . A A . 9 GLN CA 1 1 11 5397 1 1 9 GLN CB C -5.384 0.360 2.523 1.00 . A A . 9 GLN CB 1 1 11 5398 1 1 9 GLN CD C -7.247 2.000 1.825 1.00 . A A . 9 GLN CD 1 1 11 5399 1 1 9 GLN CG C -6.157 1.042 1.372 1.00 . A A . 9 GLN CG 1 1 11 5400 1 1 9 GLN H H -7.175 -1.276 2.090 1.00 . A A . 9 GLN H 1 1 11 5401 1 1 9 GLN HA H -5.576 -0.863 4.253 1.00 . A A . 9 GLN HA 1 1 11 5402 1 1 9 GLN HB2 H -4.656 1.066 2.923 1.00 . A A . 9 GLN HB2 1 1 11 5403 1 1 9 GLN HB3 H -4.796 -0.452 2.100 1.00 . A A . 9 GLN HB3 1 1 11 5404 1 1 9 GLN HE21 H -6.031 3.632 1.843 1.00 . A A . 9 GLN HE21 1 1 11 5405 1 1 9 GLN HE22 H -7.694 3.861 2.358 1.00 . A A . 9 GLN HE22 1 1 11 5406 1 1 9 GLN HG2 H -5.458 1.593 0.746 1.00 . A A . 9 GLN HG2 1 1 11 5407 1 1 9 GLN HG3 H -6.629 0.280 0.755 1.00 . A A . 9 GLN HG3 1 1 11 5408 1 1 9 GLN N N -7.251 -1.140 3.089 1.00 . A A . 9 GLN N 1 1 11 5409 1 1 9 GLN NE2 N -6.958 3.262 2.027 1.00 . A A . 9 GLN NE2 1 1 11 5410 1 1 9 GLN O O -6.049 1.906 4.733 1.00 . A A . 9 GLN O 1 1 11 5411 1 1 9 GLN OE1 O -8.334 1.571 2.169 1.00 . A A . 9 GLN OE1 1 1 11 5412 1 1 10 THR C C -8.041 2.945 6.401 1.00 . A A . 10 THR C 1 1 11 5413 1 1 10 THR CA C -7.936 1.449 6.741 1.00 . A A . 10 THR CA 1 1 11 5414 1 1 10 THR CB C -6.872 1.143 7.819 1.00 . A A . 10 THR CB 1 1 11 5415 1 1 10 THR CG2 C -7.255 1.662 9.200 1.00 . A A . 10 THR CG2 1 1 11 5416 1 1 10 THR H H -8.174 -0.253 5.461 1.00 . A A . 10 THR H 1 1 11 5417 1 1 10 THR HA H -8.897 1.154 7.157 1.00 . A A . 10 THR HA 1 1 11 5418 1 1 10 THR HB H -5.914 1.574 7.524 1.00 . A A . 10 THR HB 1 1 11 5419 1 1 10 THR HG1 H -5.983 -0.393 8.592 1.00 . A A . 10 THR HG1 1 1 11 5420 1 1 10 THR HG21 H -8.208 1.232 9.508 1.00 . A A . 10 THR HG21 1 1 11 5421 1 1 10 THR HG22 H -7.345 2.749 9.184 1.00 . A A . 10 THR HG22 1 1 11 5422 1 1 10 THR HG23 H -6.489 1.393 9.926 1.00 . A A . 10 THR HG23 1 1 11 5423 1 1 10 THR N N -7.689 0.631 5.534 1.00 . A A . 10 THR N 1 1 11 5424 1 1 10 THR O O -7.170 3.737 6.762 1.00 . A A . 10 THR O 1 1 11 5425 1 1 10 THR OG1 O -6.710 -0.258 7.970 1.00 . A A . 10 THR OG1 1 1 11 5426 1 1 11 CYS C C -9.529 5.765 5.723 1.00 . A A . 11 CYS C 1 1 11 5427 1 1 11 CYS CA C -9.105 4.573 4.844 1.00 . A A . 11 CYS CA 1 1 11 5428 1 1 11 CYS CB C -9.923 4.432 3.549 1.00 . A A . 11 CYS CB 1 1 11 5429 1 1 11 CYS H H -9.710 2.580 5.351 1.00 . A A . 11 CYS H 1 1 11 5430 1 1 11 CYS HA H -8.083 4.798 4.533 1.00 . A A . 11 CYS HA 1 1 11 5431 1 1 11 CYS HB2 H -9.800 3.422 3.162 1.00 . A A . 11 CYS HB2 1 1 11 5432 1 1 11 CYS HB3 H -10.983 4.593 3.750 1.00 . A A . 11 CYS HB3 1 1 11 5433 1 1 11 CYS N N -9.026 3.296 5.564 1.00 . A A . 11 CYS N 1 1 11 5434 1 1 11 CYS O O -10.482 6.487 5.436 1.00 . A A . 11 CYS O 1 1 11 5435 1 1 11 CYS SG S -9.356 5.579 2.261 1.00 . A A . 11 CYS SG 1 1 11 5436 1 1 12 ASP C C -8.009 8.368 6.699 1.00 . A A . 12 ASP C 1 1 11 5437 1 1 12 ASP CA C -8.696 7.256 7.505 1.00 . A A . 12 ASP CA 1 1 11 5438 1 1 12 ASP CB C -8.009 7.018 8.851 1.00 . A A . 12 ASP CB 1 1 11 5439 1 1 12 ASP CG C -8.892 6.251 9.834 1.00 . A A . 12 ASP CG 1 1 11 5440 1 1 12 ASP H H -8.031 5.324 6.966 1.00 . A A . 12 ASP H 1 1 11 5441 1 1 12 ASP HA H -9.711 7.605 7.696 1.00 . A A . 12 ASP HA 1 1 11 5442 1 1 12 ASP HB2 H -7.066 6.491 8.694 1.00 . A A . 12 ASP HB2 1 1 11 5443 1 1 12 ASP HB3 H -7.790 7.988 9.288 1.00 . A A . 12 ASP HB3 1 1 11 5444 1 1 12 ASP N N -8.782 5.985 6.799 1.00 . A A . 12 ASP N 1 1 11 5445 1 1 12 ASP O O -7.264 8.073 5.760 1.00 . A A . 12 ASP O 1 1 11 5446 1 1 12 ASP OD1 O -10.105 6.563 9.922 1.00 . A A . 12 ASP OD1 1 1 11 5447 1 1 12 ASP OD2 O -8.373 5.386 10.573 1.00 . A A . 12 ASP OD2 1 1 11 5448 1 1 13 SER C C -6.265 10.819 5.955 1.00 . A A . 13 SER C 1 1 11 5449 1 1 13 SER CA C -7.779 10.787 6.229 1.00 . A A . 13 SER CA 1 1 11 5450 1 1 13 SER CB C -8.231 12.103 6.868 1.00 . A A . 13 SER CB 1 1 11 5451 1 1 13 SER H H -8.822 9.819 7.852 1.00 . A A . 13 SER H 1 1 11 5452 1 1 13 SER HA H -8.270 10.718 5.259 1.00 . A A . 13 SER HA 1 1 11 5453 1 1 13 SER HB2 H -9.309 12.078 7.008 1.00 . A A . 13 SER HB2 1 1 11 5454 1 1 13 SER HB3 H -7.757 12.215 7.838 1.00 . A A . 13 SER HB3 1 1 11 5455 1 1 13 SER HG H -8.469 13.967 6.366 1.00 . A A . 13 SER HG 1 1 11 5456 1 1 13 SER N N -8.231 9.641 7.047 1.00 . A A . 13 SER N 1 1 11 5457 1 1 13 SER O O -5.856 11.168 4.849 1.00 . A A . 13 SER O 1 1 11 5458 1 1 13 SER OG O -7.893 13.227 6.077 1.00 . A A . 13 SER OG 1 1 11 5459 1 1 14 GLU C C -3.477 9.193 5.740 1.00 . A A . 14 GLU C 1 1 11 5460 1 1 14 GLU CA C -3.956 10.331 6.671 1.00 . A A . 14 GLU CA 1 1 11 5461 1 1 14 GLU CB C -3.203 10.288 8.016 1.00 . A A . 14 GLU CB 1 1 11 5462 1 1 14 GLU CD C -2.509 8.967 10.084 1.00 . A A . 14 GLU CD 1 1 11 5463 1 1 14 GLU CG C -3.457 9.035 8.875 1.00 . A A . 14 GLU CG 1 1 11 5464 1 1 14 GLU H H -5.783 10.176 7.812 1.00 . A A . 14 GLU H 1 1 11 5465 1 1 14 GLU HA H -3.659 11.257 6.179 1.00 . A A . 14 GLU HA 1 1 11 5466 1 1 14 GLU HB2 H -2.137 10.358 7.796 1.00 . A A . 14 GLU HB2 1 1 11 5467 1 1 14 GLU HB3 H -3.474 11.170 8.598 1.00 . A A . 14 GLU HB3 1 1 11 5468 1 1 14 GLU HG2 H -4.496 9.033 9.203 1.00 . A A . 14 GLU HG2 1 1 11 5469 1 1 14 GLU HG3 H -3.297 8.144 8.265 1.00 . A A . 14 GLU HG3 1 1 11 5470 1 1 14 GLU N N -5.412 10.391 6.892 1.00 . A A . 14 GLU N 1 1 11 5471 1 1 14 GLU O O -2.324 9.224 5.299 1.00 . A A . 14 GLU O 1 1 11 5472 1 1 14 GLU OE1 O -1.275 9.107 9.892 1.00 . A A . 14 GLU OE1 1 1 11 5473 1 1 14 GLU OE2 O -2.968 8.771 11.235 1.00 . A A . 14 GLU OE2 1 1 11 5474 1 1 15 ARG C C -4.088 7.105 3.213 1.00 . A A . 15 ARG C 1 1 11 5475 1 1 15 ARG CA C -3.893 6.952 4.729 1.00 . A A . 15 ARG CA 1 1 11 5476 1 1 15 ARG CB C -4.648 5.721 5.294 1.00 . A A . 15 ARG CB 1 1 11 5477 1 1 15 ARG CD C -3.266 3.786 4.469 1.00 . A A . 15 ARG CD 1 1 11 5478 1 1 15 ARG CG C -3.721 4.563 5.725 1.00 . A A . 15 ARG CG 1 1 11 5479 1 1 15 ARG CZ C -2.452 1.644 5.472 1.00 . A A . 15 ARG CZ 1 1 11 5480 1 1 15 ARG H H -5.267 8.235 5.774 1.00 . A A . 15 ARG H 1 1 11 5481 1 1 15 ARG HA H -2.827 6.808 4.909 1.00 . A A . 15 ARG HA 1 1 11 5482 1 1 15 ARG HB2 H -5.203 6.024 6.184 1.00 . A A . 15 ARG HB2 1 1 11 5483 1 1 15 ARG HB3 H -5.387 5.359 4.576 1.00 . A A . 15 ARG HB3 1 1 11 5484 1 1 15 ARG HD2 H -4.111 3.278 4.026 1.00 . A A . 15 ARG HD2 1 1 11 5485 1 1 15 ARG HD3 H -2.800 4.467 3.775 1.00 . A A . 15 ARG HD3 1 1 11 5486 1 1 15 ARG HE H -1.265 3.068 4.732 1.00 . A A . 15 ARG HE 1 1 11 5487 1 1 15 ARG HG2 H -2.866 4.956 6.274 1.00 . A A . 15 ARG HG2 1 1 11 5488 1 1 15 ARG HG3 H -4.274 3.895 6.384 1.00 . A A . 15 ARG HG3 1 1 11 5489 1 1 15 ARG HH11 H -4.449 1.735 5.513 1.00 . A A . 15 ARG HH11 1 1 11 5490 1 1 15 ARG HH12 H -3.700 0.312 6.249 1.00 . A A . 15 ARG HH12 1 1 11 5491 1 1 15 ARG HH21 H -0.514 1.160 5.672 1.00 . A A . 15 ARG HH21 1 1 11 5492 1 1 15 ARG HH22 H -1.673 -0.012 6.269 1.00 . A A . 15 ARG HH22 1 1 11 5493 1 1 15 ARG N N -4.302 8.170 5.459 1.00 . A A . 15 ARG N 1 1 11 5494 1 1 15 ARG NE N -2.239 2.818 4.897 1.00 . A A . 15 ARG NE 1 1 11 5495 1 1 15 ARG NH1 N -3.631 1.195 5.779 1.00 . A A . 15 ARG NH1 1 1 11 5496 1 1 15 ARG NH2 N -1.473 0.848 5.777 1.00 . A A . 15 ARG NH2 1 1 11 5497 1 1 15 ARG O O -5.161 7.496 2.751 1.00 . A A . 15 ARG O 1 1 11 5498 1 1 16 LYS C C -4.370 5.585 0.557 1.00 . A A . 16 LYS C 1 1 11 5499 1 1 16 LYS CA C -3.186 6.472 0.969 1.00 . A A . 16 LYS CA 1 1 11 5500 1 1 16 LYS CB C -1.888 5.829 0.442 1.00 . A A . 16 LYS CB 1 1 11 5501 1 1 16 LYS CD C -0.646 7.873 -0.488 1.00 . A A . 16 LYS CD 1 1 11 5502 1 1 16 LYS CE C 0.774 8.332 -0.846 1.00 . A A . 16 LYS CE 1 1 11 5503 1 1 16 LYS CG C -0.624 6.700 0.508 1.00 . A A . 16 LYS CG 1 1 11 5504 1 1 16 LYS H H -2.258 6.342 2.898 1.00 . A A . 16 LYS H 1 1 11 5505 1 1 16 LYS HA H -3.326 7.450 0.503 1.00 . A A . 16 LYS HA 1 1 11 5506 1 1 16 LYS HB2 H -1.701 4.915 1.010 1.00 . A A . 16 LYS HB2 1 1 11 5507 1 1 16 LYS HB3 H -2.035 5.532 -0.598 1.00 . A A . 16 LYS HB3 1 1 11 5508 1 1 16 LYS HD2 H -1.129 7.552 -1.413 1.00 . A A . 16 LYS HD2 1 1 11 5509 1 1 16 LYS HD3 H -1.219 8.705 -0.073 1.00 . A A . 16 LYS HD3 1 1 11 5510 1 1 16 LYS HE2 H 1.336 7.472 -1.224 1.00 . A A . 16 LYS HE2 1 1 11 5511 1 1 16 LYS HE3 H 0.713 9.072 -1.649 1.00 . A A . 16 LYS HE3 1 1 11 5512 1 1 16 LYS HG2 H -0.480 7.076 1.521 1.00 . A A . 16 LYS HG2 1 1 11 5513 1 1 16 LYS HG3 H 0.220 6.055 0.264 1.00 . A A . 16 LYS HG3 1 1 11 5514 1 1 16 LYS HZ1 H 1.064 9.788 0.620 1.00 . A A . 16 LYS HZ1 1 1 11 5515 1 1 16 LYS HZ2 H 2.446 9.173 0.041 1.00 . A A . 16 LYS HZ2 1 1 11 5516 1 1 16 LYS HZ3 H 1.550 8.303 1.104 1.00 . A A . 16 LYS HZ3 1 1 11 5517 1 1 16 LYS N N -3.099 6.649 2.434 1.00 . A A . 16 LYS N 1 1 11 5518 1 1 16 LYS NZ N 1.494 8.922 0.304 1.00 . A A . 16 LYS NZ 1 1 11 5519 1 1 16 LYS O O -4.624 4.565 1.198 1.00 . A A . 16 LYS O 1 1 11 5520 1 1 17 CYS C C -5.493 4.508 -2.617 1.00 . A A . 17 CYS C 1 1 11 5521 1 1 17 CYS CA C -5.980 4.998 -1.246 1.00 . A A . 17 CYS CA 1 1 11 5522 1 1 17 CYS CB C -7.293 5.790 -1.311 1.00 . A A . 17 CYS CB 1 1 11 5523 1 1 17 CYS H H -4.626 6.647 -1.135 1.00 . A A . 17 CYS H 1 1 11 5524 1 1 17 CYS HA H -6.168 4.117 -0.633 1.00 . A A . 17 CYS HA 1 1 11 5525 1 1 17 CYS HB2 H -7.565 6.115 -0.306 1.00 . A A . 17 CYS HB2 1 1 11 5526 1 1 17 CYS HB3 H -7.123 6.687 -1.909 1.00 . A A . 17 CYS HB3 1 1 11 5527 1 1 17 CYS N N -4.938 5.826 -0.624 1.00 . A A . 17 CYS N 1 1 11 5528 1 1 17 CYS O O -5.846 5.068 -3.653 1.00 . A A . 17 CYS O 1 1 11 5529 1 1 17 CYS SG S -8.716 4.914 -2.031 1.00 . A A . 17 CYS SG 1 1 11 5530 1 1 18 CYS C C -4.492 2.471 -4.988 1.00 . A A . 18 CYS C 1 1 11 5531 1 1 18 CYS CA C -3.770 3.092 -3.759 1.00 . A A . 18 CYS CA 1 1 11 5532 1 1 18 CYS CB C -2.628 2.190 -3.259 1.00 . A A . 18 CYS CB 1 1 11 5533 1 1 18 CYS H H -4.377 3.093 -1.729 1.00 . A A . 18 CYS H 1 1 11 5534 1 1 18 CYS HA H -3.300 4.007 -4.120 1.00 . A A . 18 CYS HA 1 1 11 5535 1 1 18 CYS HB2 H -2.986 1.167 -3.268 1.00 . A A . 18 CYS HB2 1 1 11 5536 1 1 18 CYS HB3 H -1.813 2.233 -3.978 1.00 . A A . 18 CYS HB3 1 1 11 5537 1 1 18 CYS N N -4.628 3.484 -2.624 1.00 . A A . 18 CYS N 1 1 11 5538 1 1 18 CYS O O -3.929 1.637 -5.701 1.00 . A A . 18 CYS O 1 1 11 5539 1 1 18 CYS SG S -1.944 2.494 -1.608 1.00 . A A . 18 CYS SG 1 1 11 5540 1 1 19 GLU C C -7.223 3.944 -6.946 1.00 . A A . 19 GLU C 1 1 11 5541 1 1 19 GLU CA C -6.463 2.675 -6.502 1.00 . A A . 19 GLU CA 1 1 11 5542 1 1 19 GLU CB C -7.439 1.479 -6.454 1.00 . A A . 19 GLU CB 1 1 11 5543 1 1 19 GLU CD C -6.475 -0.232 -8.108 1.00 . A A . 19 GLU CD 1 1 11 5544 1 1 19 GLU CG C -6.856 0.075 -6.657 1.00 . A A . 19 GLU CG 1 1 11 5545 1 1 19 GLU H H -6.151 3.484 -4.567 1.00 . A A . 19 GLU H 1 1 11 5546 1 1 19 GLU HA H -5.731 2.497 -7.288 1.00 . A A . 19 GLU HA 1 1 11 5547 1 1 19 GLU HB2 H -7.965 1.502 -5.498 1.00 . A A . 19 GLU HB2 1 1 11 5548 1 1 19 GLU HB3 H -8.185 1.602 -7.235 1.00 . A A . 19 GLU HB3 1 1 11 5549 1 1 19 GLU HG2 H -5.992 -0.063 -6.010 1.00 . A A . 19 GLU HG2 1 1 11 5550 1 1 19 GLU HG3 H -7.618 -0.640 -6.361 1.00 . A A . 19 GLU HG3 1 1 11 5551 1 1 19 GLU N N -5.754 2.830 -5.225 1.00 . A A . 19 GLU N 1 1 11 5552 1 1 19 GLU O O -7.665 3.986 -8.092 1.00 . A A . 19 GLU O 1 1 11 5553 1 1 19 GLU OE1 O -5.856 0.633 -8.765 1.00 . A A . 19 GLU OE1 1 1 11 5554 1 1 19 GLU OE2 O -6.740 -1.367 -8.574 1.00 . A A . 19 GLU OE2 1 1 11 5555 1 1 20 GLY C C -9.694 5.899 -6.562 1.00 . A A . 20 GLY C 1 1 11 5556 1 1 20 GLY CA C -8.192 6.167 -6.398 1.00 . A A . 20 GLY CA 1 1 11 5557 1 1 20 GLY H H -6.948 4.938 -5.187 1.00 . A A . 20 GLY H 1 1 11 5558 1 1 20 GLY HA2 H -8.067 6.890 -5.592 1.00 . A A . 20 GLY HA2 1 1 11 5559 1 1 20 GLY HA3 H -7.816 6.615 -7.316 1.00 . A A . 20 GLY HA3 1 1 11 5560 1 1 20 GLY N N -7.410 4.960 -6.088 1.00 . A A . 20 GLY N 1 1 11 5561 1 1 20 GLY O O -10.244 6.077 -7.650 1.00 . A A . 20 GLY O 1 1 11 5562 1 1 21 MET C C -12.583 5.291 -4.444 1.00 . A A . 21 MET C 1 1 11 5563 1 1 21 MET CA C -11.664 4.744 -5.557 1.00 . A A . 21 MET CA 1 1 11 5564 1 1 21 MET CB C -11.483 3.211 -5.478 1.00 . A A . 21 MET CB 1 1 11 5565 1 1 21 MET CE C -10.184 2.218 -9.367 1.00 . A A . 21 MET CE 1 1 11 5566 1 1 21 MET CG C -10.677 2.651 -6.655 1.00 . A A . 21 MET CG 1 1 11 5567 1 1 21 MET H H -9.831 5.329 -4.634 1.00 . A A . 21 MET H 1 1 11 5568 1 1 21 MET HA H -12.147 4.977 -6.505 1.00 . A A . 21 MET HA 1 1 11 5569 1 1 21 MET HB2 H -10.967 2.962 -4.549 1.00 . A A . 21 MET HB2 1 1 11 5570 1 1 21 MET HB3 H -12.452 2.712 -5.475 1.00 . A A . 21 MET HB3 1 1 11 5571 1 1 21 MET HE1 H -9.479 3.043 -9.449 1.00 . A A . 21 MET HE1 1 1 11 5572 1 1 21 MET HE2 H -9.670 1.332 -8.994 1.00 . A A . 21 MET HE2 1 1 11 5573 1 1 21 MET HE3 H -10.586 2.006 -10.359 1.00 . A A . 21 MET HE3 1 1 11 5574 1 1 21 MET HG2 H -9.750 3.205 -6.750 1.00 . A A . 21 MET HG2 1 1 11 5575 1 1 21 MET HG3 H -10.417 1.618 -6.437 1.00 . A A . 21 MET HG3 1 1 11 5576 1 1 21 MET N N -10.328 5.364 -5.513 1.00 . A A . 21 MET N 1 1 11 5577 1 1 21 MET O O -12.317 6.353 -3.880 1.00 . A A . 21 MET O 1 1 11 5578 1 1 21 MET SD S -11.534 2.686 -8.246 1.00 . A A . 21 MET SD 1 1 11 5579 1 1 22 VAL C C -13.299 4.669 -1.653 1.00 . A A . 22 VAL C 1 1 11 5580 1 1 22 VAL CA C -14.324 4.673 -2.795 1.00 . A A . 22 VAL CA 1 1 11 5581 1 1 22 VAL CB C -15.338 3.522 -2.570 1.00 . A A . 22 VAL CB 1 1 11 5582 1 1 22 VAL CG1 C -16.238 3.764 -1.350 1.00 . A A . 22 VAL CG1 1 1 11 5583 1 1 22 VAL CG2 C -16.243 3.257 -3.780 1.00 . A A . 22 VAL CG2 1 1 11 5584 1 1 22 VAL H H -13.864 3.749 -4.657 1.00 . A A . 22 VAL H 1 1 11 5585 1 1 22 VAL HA H -14.866 5.619 -2.778 1.00 . A A . 22 VAL HA 1 1 11 5586 1 1 22 VAL HB H -14.777 2.603 -2.392 1.00 . A A . 22 VAL HB 1 1 11 5587 1 1 22 VAL HG11 H -15.644 3.801 -0.437 1.00 . A A . 22 VAL HG11 1 1 11 5588 1 1 22 VAL HG12 H -16.792 4.693 -1.471 1.00 . A A . 22 VAL HG12 1 1 11 5589 1 1 22 VAL HG13 H -16.951 2.945 -1.245 1.00 . A A . 22 VAL HG13 1 1 11 5590 1 1 22 VAL HG21 H -16.940 2.450 -3.552 1.00 . A A . 22 VAL HG21 1 1 11 5591 1 1 22 VAL HG22 H -16.811 4.155 -4.016 1.00 . A A . 22 VAL HG22 1 1 11 5592 1 1 22 VAL HG23 H -15.653 2.959 -4.644 1.00 . A A . 22 VAL HG23 1 1 11 5593 1 1 22 VAL N N -13.652 4.560 -4.102 1.00 . A A . 22 VAL N 1 1 11 5594 1 1 22 VAL O O -12.372 3.868 -1.706 1.00 . A A . 22 VAL O 1 1 11 5595 1 1 23 CYS C C -13.682 5.657 1.816 1.00 . A A . 23 CYS C 1 1 11 5596 1 1 23 CYS CA C -12.726 5.507 0.623 1.00 . A A . 23 CYS CA 1 1 11 5597 1 1 23 CYS CB C -11.698 6.644 0.540 1.00 . A A . 23 CYS CB 1 1 11 5598 1 1 23 CYS H H -14.276 6.132 -0.675 1.00 . A A . 23 CYS H 1 1 11 5599 1 1 23 CYS HA H -12.172 4.576 0.736 1.00 . A A . 23 CYS HA 1 1 11 5600 1 1 23 CYS HB2 H -10.983 6.420 -0.252 1.00 . A A . 23 CYS HB2 1 1 11 5601 1 1 23 CYS HB3 H -12.229 7.554 0.259 1.00 . A A . 23 CYS HB3 1 1 11 5602 1 1 23 CYS N N -13.518 5.473 -0.610 1.00 . A A . 23 CYS N 1 1 11 5603 1 1 23 CYS O O -14.105 6.767 2.139 1.00 . A A . 23 CYS O 1 1 11 5604 1 1 23 CYS SG S -10.779 7.021 2.065 1.00 . A A . 23 CYS SG 1 1 11 5605 1 1 24 ARG C C -14.680 3.232 4.378 1.00 . A A . 24 ARG C 1 1 11 5606 1 1 24 ARG CA C -15.049 4.445 3.531 1.00 . A A . 24 ARG CA 1 1 11 5607 1 1 24 ARG CB C -16.534 4.394 3.102 1.00 . A A . 24 ARG CB 1 1 11 5608 1 1 24 ARG CD C -17.150 6.157 1.415 1.00 . A A . 24 ARG CD 1 1 11 5609 1 1 24 ARG CG C -17.171 5.782 2.909 1.00 . A A . 24 ARG CG 1 1 11 5610 1 1 24 ARG CZ C -17.302 8.412 0.381 1.00 . A A . 24 ARG CZ 1 1 11 5611 1 1 24 ARG H H -13.785 3.651 1.993 1.00 . A A . 24 ARG H 1 1 11 5612 1 1 24 ARG HA H -14.900 5.326 4.159 1.00 . A A . 24 ARG HA 1 1 11 5613 1 1 24 ARG HB2 H -16.661 3.769 2.216 1.00 . A A . 24 ARG HB2 1 1 11 5614 1 1 24 ARG HB3 H -17.092 3.919 3.908 1.00 . A A . 24 ARG HB3 1 1 11 5615 1 1 24 ARG HD2 H -16.193 5.942 0.981 1.00 . A A . 24 ARG HD2 1 1 11 5616 1 1 24 ARG HD3 H -17.931 5.634 0.892 1.00 . A A . 24 ARG HD3 1 1 11 5617 1 1 24 ARG HE H -17.545 8.058 2.300 1.00 . A A . 24 ARG HE 1 1 11 5618 1 1 24 ARG HG2 H -18.208 5.756 3.244 1.00 . A A . 24 ARG HG2 1 1 11 5619 1 1 24 ARG HG3 H -16.634 6.519 3.510 1.00 . A A . 24 ARG HG3 1 1 11 5620 1 1 24 ARG HH11 H -17.292 7.051 -1.070 1.00 . A A . 24 ARG HH11 1 1 11 5621 1 1 24 ARG HH12 H -17.250 8.698 -1.577 1.00 . A A . 24 ARG HH12 1 1 11 5622 1 1 24 ARG HH21 H -17.561 9.976 1.562 1.00 . A A . 24 ARG HH21 1 1 11 5623 1 1 24 ARG HH22 H -17.394 10.371 -0.145 1.00 . A A . 24 ARG HH22 1 1 11 5624 1 1 24 ARG N N -14.143 4.528 2.369 1.00 . A A . 24 ARG N 1 1 11 5625 1 1 24 ARG NE N -17.390 7.597 1.410 1.00 . A A . 24 ARG NE 1 1 11 5626 1 1 24 ARG NH1 N -17.131 8.017 -0.847 1.00 . A A . 24 ARG NH1 1 1 11 5627 1 1 24 ARG NH2 N -17.397 9.686 0.602 1.00 . A A . 24 ARG NH2 1 1 11 5628 1 1 24 ARG O O -14.899 2.110 3.939 1.00 . A A . 24 ARG O 1 1 11 5629 1 1 25 LEU C C -12.032 1.751 5.398 1.00 . A A . 25 LEU C 1 1 11 5630 1 1 25 LEU CA C -13.094 2.508 6.227 1.00 . A A . 25 LEU CA 1 1 11 5631 1 1 25 LEU CB C -13.980 1.538 7.039 1.00 . A A . 25 LEU CB 1 1 11 5632 1 1 25 LEU CD1 C -15.690 1.335 8.877 1.00 . A A . 25 LEU CD1 1 1 11 5633 1 1 25 LEU CD2 C -13.437 2.178 9.435 1.00 . A A . 25 LEU CD2 1 1 11 5634 1 1 25 LEU CG C -14.514 2.151 8.346 1.00 . A A . 25 LEU CG 1 1 11 5635 1 1 25 LEU H H -13.895 4.429 5.774 1.00 . A A . 25 LEU H 1 1 11 5636 1 1 25 LEU HA H -12.513 3.099 6.936 1.00 . A A . 25 LEU HA 1 1 11 5637 1 1 25 LEU HB2 H -14.818 1.215 6.419 1.00 . A A . 25 LEU HB2 1 1 11 5638 1 1 25 LEU HB3 H -13.405 0.646 7.290 1.00 . A A . 25 LEU HB3 1 1 11 5639 1 1 25 LEU HD11 H -16.515 1.391 8.168 1.00 . A A . 25 LEU HD11 1 1 11 5640 1 1 25 LEU HD12 H -16.029 1.749 9.826 1.00 . A A . 25 LEU HD12 1 1 11 5641 1 1 25 LEU HD13 H -15.398 0.295 9.017 1.00 . A A . 25 LEU HD13 1 1 11 5642 1 1 25 LEU HD21 H -13.854 2.594 10.351 1.00 . A A . 25 LEU HD21 1 1 11 5643 1 1 25 LEU HD22 H -12.603 2.807 9.126 1.00 . A A . 25 LEU HD22 1 1 11 5644 1 1 25 LEU HD23 H -13.076 1.170 9.636 1.00 . A A . 25 LEU HD23 1 1 11 5645 1 1 25 LEU HG H -14.861 3.166 8.158 1.00 . A A . 25 LEU HG 1 1 11 5646 1 1 25 LEU N N -13.936 3.464 5.468 1.00 . A A . 25 LEU N 1 1 11 5647 1 1 25 LEU O O -11.034 1.293 5.949 1.00 . A A . 25 LEU O 1 1 11 5648 1 1 26 TRP C C -11.510 1.528 1.695 1.00 . A A . 26 TRP C 1 1 11 5649 1 1 26 TRP CA C -11.345 0.964 3.118 1.00 . A A . 26 TRP CA 1 1 11 5650 1 1 26 TRP CB C -11.641 -0.548 3.162 1.00 . A A . 26 TRP CB 1 1 11 5651 1 1 26 TRP CD1 C -13.501 -1.336 4.695 1.00 . A A . 26 TRP CD1 1 1 11 5652 1 1 26 TRP CD2 C -14.265 -0.758 2.670 1.00 . A A . 26 TRP CD2 1 1 11 5653 1 1 26 TRP CE2 C -15.400 -1.105 3.461 1.00 . A A . 26 TRP CE2 1 1 11 5654 1 1 26 TRP CE3 C -14.529 -0.262 1.373 1.00 . A A . 26 TRP CE3 1 1 11 5655 1 1 26 TRP CG C -13.055 -0.965 3.471 1.00 . A A . 26 TRP CG 1 1 11 5656 1 1 26 TRP CH2 C -16.940 -0.507 1.687 1.00 . A A . 26 TRP CH2 1 1 11 5657 1 1 26 TRP CZ2 C -16.716 -1.004 2.981 1.00 . A A . 26 TRP CZ2 1 1 11 5658 1 1 26 TRP CZ3 C -15.846 -0.126 0.892 1.00 . A A . 26 TRP CZ3 1 1 11 5659 1 1 26 TRP H H -13.091 1.945 3.722 1.00 . A A . 26 TRP H 1 1 11 5660 1 1 26 TRP HA H -10.306 1.107 3.406 1.00 . A A . 26 TRP HA 1 1 11 5661 1 1 26 TRP HB2 H -11.332 -1.024 2.232 1.00 . A A . 26 TRP HB2 1 1 11 5662 1 1 26 TRP HB3 H -11.002 -0.950 3.948 1.00 . A A . 26 TRP HB3 1 1 11 5663 1 1 26 TRP HD1 H -12.870 -1.450 5.569 1.00 . A A . 26 TRP HD1 1 1 11 5664 1 1 26 TRP HE1 H -15.436 -1.598 5.514 1.00 . A A . 26 TRP HE1 1 1 11 5665 1 1 26 TRP HE3 H -13.706 0.072 0.763 1.00 . A A . 26 TRP HE3 1 1 11 5666 1 1 26 TRP HH2 H -17.951 -0.380 1.319 1.00 . A A . 26 TRP HH2 1 1 11 5667 1 1 26 TRP HZ2 H -17.550 -1.250 3.623 1.00 . A A . 26 TRP HZ2 1 1 11 5668 1 1 26 TRP HZ3 H -16.020 0.299 -0.087 1.00 . A A . 26 TRP HZ3 1 1 11 5669 1 1 26 TRP N N -12.189 1.660 4.082 1.00 . A A . 26 TRP N 1 1 11 5670 1 1 26 TRP NE1 N -14.874 -1.473 4.677 1.00 . A A . 26 TRP NE1 1 1 11 5671 1 1 26 TRP O O -12.449 2.282 1.430 1.00 . A A . 26 TRP O 1 1 11 5672 1 1 27 CYS C C -10.988 -0.040 -1.419 1.00 . A A . 27 CYS C 1 1 11 5673 1 1 27 CYS CA C -10.780 1.279 -0.671 1.00 . A A . 27 CYS CA 1 1 11 5674 1 1 27 CYS CB C -9.580 2.076 -1.209 1.00 . A A . 27 CYS CB 1 1 11 5675 1 1 27 CYS H H -9.875 0.536 1.093 1.00 . A A . 27 CYS H 1 1 11 5676 1 1 27 CYS HA H -11.674 1.868 -0.844 1.00 . A A . 27 CYS HA 1 1 11 5677 1 1 27 CYS HB2 H -8.660 1.527 -1.013 1.00 . A A . 27 CYS HB2 1 1 11 5678 1 1 27 CYS HB3 H -9.699 2.175 -2.288 1.00 . A A . 27 CYS HB3 1 1 11 5679 1 1 27 CYS N N -10.673 1.060 0.766 1.00 . A A . 27 CYS N 1 1 11 5680 1 1 27 CYS O O -10.381 -1.057 -1.082 1.00 . A A . 27 CYS O 1 1 11 5681 1 1 27 CYS SG S -9.430 3.743 -0.524 1.00 . A A . 27 CYS SG 1 1 11 5682 1 1 28 LYS C C -12.160 -0.782 -4.762 1.00 . A A . 28 LYS C 1 1 11 5683 1 1 28 LYS CA C -12.252 -1.149 -3.276 1.00 . A A . 28 LYS CA 1 1 11 5684 1 1 28 LYS CB C -13.593 -1.741 -2.795 1.00 . A A . 28 LYS CB 1 1 11 5685 1 1 28 LYS CD C -14.786 -2.922 -0.888 1.00 . A A . 28 LYS CD 1 1 11 5686 1 1 28 LYS CE C -14.597 -3.573 0.485 1.00 . A A . 28 LYS CE 1 1 11 5687 1 1 28 LYS CG C -13.446 -2.415 -1.418 1.00 . A A . 28 LYS CG 1 1 11 5688 1 1 28 LYS H H -12.291 0.888 -2.618 1.00 . A A . 28 LYS H 1 1 11 5689 1 1 28 LYS HA H -11.505 -1.934 -3.149 1.00 . A A . 28 LYS HA 1 1 11 5690 1 1 28 LYS HB2 H -14.344 -0.953 -2.743 1.00 . A A . 28 LYS HB2 1 1 11 5691 1 1 28 LYS HB3 H -13.941 -2.487 -3.507 1.00 . A A . 28 LYS HB3 1 1 11 5692 1 1 28 LYS HD2 H -15.472 -2.080 -0.817 1.00 . A A . 28 LYS HD2 1 1 11 5693 1 1 28 LYS HD3 H -15.222 -3.648 -1.571 1.00 . A A . 28 LYS HD3 1 1 11 5694 1 1 28 LYS HE2 H -14.282 -4.612 0.348 1.00 . A A . 28 LYS HE2 1 1 11 5695 1 1 28 LYS HE3 H -13.811 -3.046 1.034 1.00 . A A . 28 LYS HE3 1 1 11 5696 1 1 28 LYS HG2 H -12.746 -3.248 -1.485 1.00 . A A . 28 LYS HG2 1 1 11 5697 1 1 28 LYS HG3 H -13.053 -1.699 -0.699 1.00 . A A . 28 LYS HG3 1 1 11 5698 1 1 28 LYS HZ1 H -16.641 -3.806 0.675 1.00 . A A . 28 LYS HZ1 1 1 11 5699 1 1 28 LYS HZ2 H -16.061 -2.550 1.520 1.00 . A A . 28 LYS HZ2 1 1 11 5700 1 1 28 LYS HZ3 H -15.856 -4.072 2.093 1.00 . A A . 28 LYS HZ3 1 1 11 5701 1 1 28 LYS N N -11.858 -0.005 -2.434 1.00 . A A . 28 LYS N 1 1 11 5702 1 1 28 LYS NZ N -15.856 -3.505 1.250 1.00 . A A . 28 LYS NZ 1 1 11 5703 1 1 28 LYS O O -11.073 -0.410 -5.194 1.00 . A A . 28 LYS O 1 1 11 5704 1 1 29 LYS C C -14.613 0.417 -7.293 1.00 . A A . 29 LYS C 1 1 11 5705 1 1 29 LYS CA C -13.277 -0.239 -6.909 1.00 . A A . 29 LYS CA 1 1 11 5706 1 1 29 LYS CB C -12.862 -1.358 -7.895 1.00 . A A . 29 LYS CB 1 1 11 5707 1 1 29 LYS CD C -11.121 -1.933 -9.724 1.00 . A A . 29 LYS CD 1 1 11 5708 1 1 29 LYS CE C -11.912 -1.986 -11.033 1.00 . A A . 29 LYS CE 1 1 11 5709 1 1 29 LYS CG C -11.675 -0.887 -8.749 1.00 . A A . 29 LYS CG 1 1 11 5710 1 1 29 LYS H H -14.135 -1.086 -5.128 1.00 . A A . 29 LYS H 1 1 11 5711 1 1 29 LYS HA H -12.524 0.544 -6.951 1.00 . A A . 29 LYS HA 1 1 11 5712 1 1 29 LYS HB2 H -12.555 -2.250 -7.345 1.00 . A A . 29 LYS HB2 1 1 11 5713 1 1 29 LYS HB3 H -13.701 -1.638 -8.532 1.00 . A A . 29 LYS HB3 1 1 11 5714 1 1 29 LYS HD2 H -10.091 -1.659 -9.953 1.00 . A A . 29 LYS HD2 1 1 11 5715 1 1 29 LYS HD3 H -11.115 -2.914 -9.251 1.00 . A A . 29 LYS HD3 1 1 11 5716 1 1 29 LYS HE2 H -12.882 -2.457 -10.858 1.00 . A A . 29 LYS HE2 1 1 11 5717 1 1 29 LYS HE3 H -12.083 -0.960 -11.373 1.00 . A A . 29 LYS HE3 1 1 11 5718 1 1 29 LYS HG2 H -11.967 -0.002 -9.313 1.00 . A A . 29 LYS HG2 1 1 11 5719 1 1 29 LYS HG3 H -10.865 -0.610 -8.073 1.00 . A A . 29 LYS HG3 1 1 11 5720 1 1 29 LYS HZ1 H -11.067 -3.709 -11.902 1.00 . A A . 29 LYS HZ1 1 1 11 5721 1 1 29 LYS HZ2 H -10.238 -2.307 -12.184 1.00 . A A . 29 LYS HZ2 1 1 11 5722 1 1 29 LYS HZ3 H -11.612 -2.593 -12.988 1.00 . A A . 29 LYS HZ3 1 1 11 5723 1 1 29 LYS N N -13.265 -0.759 -5.525 1.00 . A A . 29 LYS N 1 1 11 5724 1 1 29 LYS NZ N -11.164 -2.712 -12.082 1.00 . A A . 29 LYS NZ 1 1 11 5725 1 1 29 LYS O O -15.670 -0.117 -6.958 1.00 . A A . 29 LYS O 1 1 11 5726 1 1 30 LYS C C -15.320 3.227 -9.791 1.00 . A A . 30 LYS C 1 1 11 5727 1 1 30 LYS CA C -15.689 2.277 -8.618 1.00 . A A . 30 LYS CA 1 1 11 5728 1 1 30 LYS CB C -16.566 2.958 -7.538 1.00 . A A . 30 LYS CB 1 1 11 5729 1 1 30 LYS CD C -19.167 3.077 -7.347 1.00 . A A . 30 LYS CD 1 1 11 5730 1 1 30 LYS CE C -19.261 3.577 -5.911 1.00 . A A . 30 LYS CE 1 1 11 5731 1 1 30 LYS CG C -17.897 3.535 -8.073 1.00 . A A . 30 LYS CG 1 1 11 5732 1 1 30 LYS H H -13.618 1.919 -8.161 1.00 . A A . 30 LYS H 1 1 11 5733 1 1 30 LYS HA H -16.305 1.507 -9.079 1.00 . A A . 30 LYS HA 1 1 11 5734 1 1 30 LYS HB2 H -16.797 2.227 -6.763 1.00 . A A . 30 LYS HB2 1 1 11 5735 1 1 30 LYS HB3 H -15.995 3.761 -7.072 1.00 . A A . 30 LYS HB3 1 1 11 5736 1 1 30 LYS HD2 H -20.029 3.447 -7.907 1.00 . A A . 30 LYS HD2 1 1 11 5737 1 1 30 LYS HD3 H -19.201 1.988 -7.347 1.00 . A A . 30 LYS HD3 1 1 11 5738 1 1 30 LYS HE2 H -18.455 3.129 -5.325 1.00 . A A . 30 LYS HE2 1 1 11 5739 1 1 30 LYS HE3 H -19.131 4.662 -5.893 1.00 . A A . 30 LYS HE3 1 1 11 5740 1 1 30 LYS HG2 H -17.835 4.620 -8.068 1.00 . A A . 30 LYS HG2 1 1 11 5741 1 1 30 LYS HG3 H -18.049 3.233 -9.102 1.00 . A A . 30 LYS HG3 1 1 11 5742 1 1 30 LYS HZ1 H -20.785 2.237 -5.385 1.00 . A A . 30 LYS HZ1 1 1 11 5743 1 1 30 LYS HZ2 H -21.340 3.723 -5.750 1.00 . A A . 30 LYS HZ2 1 1 11 5744 1 1 30 LYS HZ3 H -20.572 3.514 -4.334 1.00 . A A . 30 LYS HZ3 1 1 11 5745 1 1 30 LYS N N -14.547 1.569 -7.984 1.00 . A A . 30 LYS N 1 1 11 5746 1 1 30 LYS NZ N -20.569 3.227 -5.311 1.00 . A A . 30 LYS NZ 1 1 11 5747 1 1 30 LYS O O -16.207 3.670 -10.521 1.00 . A A . 30 LYS O 1 1 11 5748 1 1 31 LEU C C -13.487 2.710 -12.329 1.00 . A A . 31 LEU C 1 1 11 5749 1 1 31 LEU CA C -13.587 3.931 -11.398 1.00 . A A . 31 LEU CA 1 1 11 5750 1 1 31 LEU CB C -12.281 4.734 -11.236 1.00 . A A . 31 LEU CB 1 1 11 5751 1 1 31 LEU CD1 C -12.392 5.911 -13.501 1.00 . A A . 31 LEU CD1 1 1 11 5752 1 1 31 LEU CD2 C -10.309 5.944 -12.163 1.00 . A A . 31 LEU CD2 1 1 11 5753 1 1 31 LEU CG C -11.533 5.105 -12.530 1.00 . A A . 31 LEU CG 1 1 11 5754 1 1 31 LEU H H -13.320 3.153 -9.449 1.00 . A A . 31 LEU H 1 1 11 5755 1 1 31 LEU HA H -14.329 4.608 -11.823 1.00 . A A . 31 LEU HA 1 1 11 5756 1 1 31 LEU HB2 H -12.513 5.648 -10.691 1.00 . A A . 31 LEU HB2 1 1 11 5757 1 1 31 LEU HB3 H -11.589 4.160 -10.629 1.00 . A A . 31 LEU HB3 1 1 11 5758 1 1 31 LEU HD11 H -12.796 6.796 -13.012 1.00 . A A . 31 LEU HD11 1 1 11 5759 1 1 31 LEU HD12 H -13.206 5.293 -13.870 1.00 . A A . 31 LEU HD12 1 1 11 5760 1 1 31 LEU HD13 H -11.791 6.219 -14.357 1.00 . A A . 31 LEU HD13 1 1 11 5761 1 1 31 LEU HD21 H -9.763 6.206 -13.069 1.00 . A A . 31 LEU HD21 1 1 11 5762 1 1 31 LEU HD22 H -9.648 5.368 -11.514 1.00 . A A . 31 LEU HD22 1 1 11 5763 1 1 31 LEU HD23 H -10.611 6.857 -11.651 1.00 . A A . 31 LEU HD23 1 1 11 5764 1 1 31 LEU HG H -11.191 4.200 -13.032 1.00 . A A . 31 LEU HG 1 1 11 5765 1 1 31 LEU N N -14.038 3.471 -10.076 1.00 . A A . 31 LEU N 1 1 11 5766 1 1 31 LEU O O -12.504 1.973 -12.301 1.00 . A A . 31 LEU O 1 1 11 5767 1 1 32 LEU C C -16.165 1.338 -14.577 1.00 . A A . 32 LEU C 1 1 11 5768 1 1 32 LEU CA C -14.801 1.229 -13.892 1.00 . A A . 32 LEU CA 1 1 11 5769 1 1 32 LEU CB C -14.721 -0.065 -13.031 1.00 . A A . 32 LEU CB 1 1 11 5770 1 1 32 LEU CD1 C -17.004 -0.994 -12.384 1.00 . A A . 32 LEU CD1 1 1 11 5771 1 1 32 LEU CD2 C -15.226 -0.752 -10.672 1.00 . A A . 32 LEU CD2 1 1 11 5772 1 1 32 LEU CG C -15.815 -0.129 -11.939 1.00 . A A . 32 LEU CG 1 1 11 5773 1 1 32 LEU H H -15.303 3.131 -13.073 1.00 . A A . 32 LEU H 1 1 11 5774 1 1 32 LEU HA H -14.056 1.170 -14.666 1.00 . A A . 32 LEU HA 1 1 11 5775 1 1 32 LEU HB2 H -14.788 -0.939 -13.674 1.00 . A A . 32 LEU HB2 1 1 11 5776 1 1 32 LEU HB3 H -13.734 -0.111 -12.578 1.00 . A A . 32 LEU HB3 1 1 11 5777 1 1 32 LEU HD11 H -17.764 -1.023 -11.606 1.00 . A A . 32 LEU HD11 1 1 11 5778 1 1 32 LEU HD12 H -16.681 -2.014 -12.593 1.00 . A A . 32 LEU HD12 1 1 11 5779 1 1 32 LEU HD13 H -17.466 -0.583 -13.278 1.00 . A A . 32 LEU HD13 1 1 11 5780 1 1 32 LEU HD21 H -15.974 -0.754 -9.880 1.00 . A A . 32 LEU HD21 1 1 11 5781 1 1 32 LEU HD22 H -14.369 -0.167 -10.343 1.00 . A A . 32 LEU HD22 1 1 11 5782 1 1 32 LEU HD23 H -14.921 -1.780 -10.869 1.00 . A A . 32 LEU HD23 1 1 11 5783 1 1 32 LEU HG H -16.169 0.870 -11.685 1.00 . A A . 32 LEU HG 1 1 11 5784 1 1 32 LEU N N -14.574 2.427 -13.044 1.00 . A A . 32 LEU N 1 1 11 5785 1 1 32 LEU O O -17.080 1.966 -14.087 1.00 . A A . 32 LEU O 1 1 11 5786 1 1 32 LEU OXT O -16.307 0.830 -15.497 1.00 . A A . 32 LEU OXT 1 1 12 5787 1 1 1 GLY C C 2.242 -1.152 -2.642 1.00 . A A . 1 GLY C 1 1 12 5788 1 1 1 GLY CA C 2.791 -0.027 -1.783 1.00 . A A . 1 GLY CA 1 1 12 5789 1 1 1 GLY H1 H 3.825 1.723 -2.042 1.00 . A A . 1 GLY H1 1 1 12 5790 1 1 1 GLY H2 H 4.177 0.581 -3.168 1.00 . A A . 1 GLY H2 1 1 12 5791 1 1 1 GLY H3 H 2.759 1.411 -3.255 1.00 . A A . 1 GLY H3 1 1 12 5792 1 1 1 GLY HA2 H 3.514 -0.415 -1.070 1.00 . A A . 1 GLY HA2 1 1 12 5793 1 1 1 GLY HA3 H 1.965 0.423 -1.234 1.00 . A A . 1 GLY HA3 1 1 12 5794 1 1 1 GLY N N 3.431 0.995 -2.624 1.00 . A A . 1 GLY N 1 1 12 5795 1 1 1 GLY O O 1.366 -0.881 -3.456 1.00 . A A . 1 GLY O 1 1 12 5796 1 1 2 PRO C C 0.884 -4.036 -3.037 1.00 . A A . 2 PRO C 1 1 12 5797 1 1 2 PRO CA C 2.318 -3.551 -3.308 1.00 . A A . 2 PRO CA 1 1 12 5798 1 1 2 PRO CB C 3.317 -4.654 -2.945 1.00 . A A . 2 PRO CB 1 1 12 5799 1 1 2 PRO CD C 3.755 -2.788 -1.536 1.00 . A A . 2 PRO CD 1 1 12 5800 1 1 2 PRO CG C 3.726 -4.307 -1.515 1.00 . A A . 2 PRO CG 1 1 12 5801 1 1 2 PRO HA H 2.409 -3.314 -4.369 1.00 . A A . 2 PRO HA 1 1 12 5802 1 1 2 PRO HB2 H 2.877 -5.650 -3.010 1.00 . A A . 2 PRO HB2 1 1 12 5803 1 1 2 PRO HB3 H 4.190 -4.586 -3.590 1.00 . A A . 2 PRO HB3 1 1 12 5804 1 1 2 PRO HD2 H 3.548 -2.403 -0.537 1.00 . A A . 2 PRO HD2 1 1 12 5805 1 1 2 PRO HD3 H 4.729 -2.446 -1.886 1.00 . A A . 2 PRO HD3 1 1 12 5806 1 1 2 PRO HG2 H 2.958 -4.627 -0.820 1.00 . A A . 2 PRO HG2 1 1 12 5807 1 1 2 PRO HG3 H 4.691 -4.729 -1.245 1.00 . A A . 2 PRO HG3 1 1 12 5808 1 1 2 PRO N N 2.730 -2.397 -2.492 1.00 . A A . 2 PRO N 1 1 12 5809 1 1 2 PRO O O 0.258 -4.652 -3.902 1.00 . A A . 2 PRO O 1 1 12 5810 1 1 3 TYR C C -1.724 -3.109 -0.596 1.00 . A A . 3 TYR C 1 1 12 5811 1 1 3 TYR CA C -0.965 -4.171 -1.383 1.00 . A A . 3 TYR CA 1 1 12 5812 1 1 3 TYR CB C -0.926 -5.525 -0.655 1.00 . A A . 3 TYR CB 1 1 12 5813 1 1 3 TYR CD1 C 1.322 -6.487 0.017 1.00 . A A . 3 TYR CD1 1 1 12 5814 1 1 3 TYR CD2 C 0.208 -4.957 1.549 1.00 . A A . 3 TYR CD2 1 1 12 5815 1 1 3 TYR CE1 C 2.415 -6.567 0.899 1.00 . A A . 3 TYR CE1 1 1 12 5816 1 1 3 TYR CE2 C 1.320 -5.002 2.411 1.00 . A A . 3 TYR CE2 1 1 12 5817 1 1 3 TYR CG C 0.224 -5.663 0.328 1.00 . A A . 3 TYR CG 1 1 12 5818 1 1 3 TYR CZ C 2.439 -5.789 2.075 1.00 . A A . 3 TYR CZ 1 1 12 5819 1 1 3 TYR H H 0.931 -3.252 -1.184 1.00 . A A . 3 TYR H 1 1 12 5820 1 1 3 TYR HA H -1.567 -4.343 -2.275 1.00 . A A . 3 TYR HA 1 1 12 5821 1 1 3 TYR HB2 H -1.869 -5.693 -0.133 1.00 . A A . 3 TYR HB2 1 1 12 5822 1 1 3 TYR HB3 H -0.832 -6.306 -1.410 1.00 . A A . 3 TYR HB3 1 1 12 5823 1 1 3 TYR HD1 H 1.338 -7.047 -0.911 1.00 . A A . 3 TYR HD1 1 1 12 5824 1 1 3 TYR HD2 H -0.646 -4.349 1.819 1.00 . A A . 3 TYR HD2 1 1 12 5825 1 1 3 TYR HE1 H 3.260 -7.188 0.651 1.00 . A A . 3 TYR HE1 1 1 12 5826 1 1 3 TYR HE2 H 1.322 -4.423 3.324 1.00 . A A . 3 TYR HE2 1 1 12 5827 1 1 3 TYR HH H 3.618 -4.967 3.382 1.00 . A A . 3 TYR HH 1 1 12 5828 1 1 3 TYR N N 0.354 -3.750 -1.847 1.00 . A A . 3 TYR N 1 1 12 5829 1 1 3 TYR O O -1.129 -2.424 0.237 1.00 . A A . 3 TYR O 1 1 12 5830 1 1 3 TYR OH O 3.535 -5.804 2.881 1.00 . A A . 3 TYR OH 1 1 12 5831 1 1 4 CYS C C -5.372 -2.380 -0.200 1.00 . A A . 4 CYS C 1 1 12 5832 1 1 4 CYS CA C -3.869 -2.083 -0.057 1.00 . A A . 4 CYS CA 1 1 12 5833 1 1 4 CYS CB C -3.514 -0.612 -0.361 1.00 . A A . 4 CYS CB 1 1 12 5834 1 1 4 CYS H H -3.447 -3.554 -1.557 1.00 . A A . 4 CYS H 1 1 12 5835 1 1 4 CYS HA H -3.620 -2.271 0.986 1.00 . A A . 4 CYS HA 1 1 12 5836 1 1 4 CYS HB2 H -4.386 0.011 -0.184 1.00 . A A . 4 CYS HB2 1 1 12 5837 1 1 4 CYS HB3 H -2.772 -0.319 0.385 1.00 . A A . 4 CYS HB3 1 1 12 5838 1 1 4 CYS N N -3.026 -2.970 -0.853 1.00 . A A . 4 CYS N 1 1 12 5839 1 1 4 CYS O O -6.026 -2.782 0.762 1.00 . A A . 4 CYS O 1 1 12 5840 1 1 4 CYS SG S -2.788 -0.162 -1.973 1.00 . A A . 4 CYS SG 1 1 12 5841 1 1 5 GLN C C -7.729 -3.970 -1.509 1.00 . A A . 5 GLN C 1 1 12 5842 1 1 5 GLN CA C -7.332 -2.505 -1.718 1.00 . A A . 5 GLN CA 1 1 12 5843 1 1 5 GLN CB C -7.582 -2.025 -3.160 1.00 . A A . 5 GLN CB 1 1 12 5844 1 1 5 GLN CD C -8.761 -3.869 -4.536 1.00 . A A . 5 GLN CD 1 1 12 5845 1 1 5 GLN CG C -8.880 -2.526 -3.811 1.00 . A A . 5 GLN CG 1 1 12 5846 1 1 5 GLN H H -5.337 -1.898 -2.155 1.00 . A A . 5 GLN H 1 1 12 5847 1 1 5 GLN HA H -7.953 -1.916 -1.043 1.00 . A A . 5 GLN HA 1 1 12 5848 1 1 5 GLN HB2 H -7.622 -0.937 -3.138 1.00 . A A . 5 GLN HB2 1 1 12 5849 1 1 5 GLN HB3 H -6.740 -2.303 -3.796 1.00 . A A . 5 GLN HB3 1 1 12 5850 1 1 5 GLN HE21 H -7.517 -3.159 -5.959 1.00 . A A . 5 GLN HE21 1 1 12 5851 1 1 5 GLN HE22 H -7.816 -4.901 -5.959 1.00 . A A . 5 GLN HE22 1 1 12 5852 1 1 5 GLN HG2 H -9.657 -2.603 -3.055 1.00 . A A . 5 GLN HG2 1 1 12 5853 1 1 5 GLN HG3 H -9.183 -1.773 -4.529 1.00 . A A . 5 GLN HG3 1 1 12 5854 1 1 5 GLN N N -5.920 -2.251 -1.409 1.00 . A A . 5 GLN N 1 1 12 5855 1 1 5 GLN NE2 N -7.883 -4.004 -5.504 1.00 . A A . 5 GLN NE2 1 1 12 5856 1 1 5 GLN O O -8.694 -4.279 -0.806 1.00 . A A . 5 GLN O 1 1 12 5857 1 1 5 GLN OE1 O -9.305 -4.871 -4.092 1.00 . A A . 5 GLN OE1 1 1 12 5858 1 1 6 LYS C C -7.056 -6.969 -0.674 1.00 . A A . 6 LYS C 1 1 12 5859 1 1 6 LYS CA C -7.102 -6.324 -2.068 1.00 . A A . 6 LYS CA 1 1 12 5860 1 1 6 LYS CB C -6.047 -6.920 -3.024 1.00 . A A . 6 LYS CB 1 1 12 5861 1 1 6 LYS CD C -5.605 -8.390 -5.021 1.00 . A A . 6 LYS CD 1 1 12 5862 1 1 6 LYS CE C -6.125 -9.436 -6.012 1.00 . A A . 6 LYS CE 1 1 12 5863 1 1 6 LYS CG C -6.621 -8.019 -3.927 1.00 . A A . 6 LYS CG 1 1 12 5864 1 1 6 LYS H H -6.154 -4.506 -2.623 1.00 . A A . 6 LYS H 1 1 12 5865 1 1 6 LYS HA H -8.100 -6.511 -2.470 1.00 . A A . 6 LYS HA 1 1 12 5866 1 1 6 LYS HB2 H -5.671 -6.132 -3.681 1.00 . A A . 6 LYS HB2 1 1 12 5867 1 1 6 LYS HB3 H -5.198 -7.307 -2.457 1.00 . A A . 6 LYS HB3 1 1 12 5868 1 1 6 LYS HD2 H -5.326 -7.494 -5.578 1.00 . A A . 6 LYS HD2 1 1 12 5869 1 1 6 LYS HD3 H -4.705 -8.787 -4.547 1.00 . A A . 6 LYS HD3 1 1 12 5870 1 1 6 LYS HE2 H -5.331 -9.638 -6.738 1.00 . A A . 6 LYS HE2 1 1 12 5871 1 1 6 LYS HE3 H -6.324 -10.368 -5.475 1.00 . A A . 6 LYS HE3 1 1 12 5872 1 1 6 LYS HG2 H -6.874 -8.897 -3.335 1.00 . A A . 6 LYS HG2 1 1 12 5873 1 1 6 LYS HG3 H -7.530 -7.644 -4.393 1.00 . A A . 6 LYS HG3 1 1 12 5874 1 1 6 LYS HZ1 H -7.222 -8.088 -7.162 1.00 . A A . 6 LYS HZ1 1 1 12 5875 1 1 6 LYS HZ2 H -8.134 -8.921 -6.081 1.00 . A A . 6 LYS HZ2 1 1 12 5876 1 1 6 LYS HZ3 H -7.617 -9.679 -7.425 1.00 . A A . 6 LYS HZ3 1 1 12 5877 1 1 6 LYS N N -6.896 -4.870 -2.043 1.00 . A A . 6 LYS N 1 1 12 5878 1 1 6 LYS NZ N -7.349 -8.996 -6.722 1.00 . A A . 6 LYS NZ 1 1 12 5879 1 1 6 LYS O O -7.415 -8.137 -0.523 1.00 . A A . 6 LYS O 1 1 12 5880 1 1 7 TRP C C -6.706 -5.465 2.669 1.00 . A A . 7 TRP C 1 1 12 5881 1 1 7 TRP CA C -6.416 -6.659 1.724 1.00 . A A . 7 TRP CA 1 1 12 5882 1 1 7 TRP CB C -4.966 -7.180 1.830 1.00 . A A . 7 TRP CB 1 1 12 5883 1 1 7 TRP CD1 C -4.257 -9.552 2.337 1.00 . A A . 7 TRP CD1 1 1 12 5884 1 1 7 TRP CD2 C -4.975 -8.522 4.195 1.00 . A A . 7 TRP CD2 1 1 12 5885 1 1 7 TRP CE2 C -4.543 -9.830 4.576 1.00 . A A . 7 TRP CE2 1 1 12 5886 1 1 7 TRP CE3 C -5.569 -7.752 5.224 1.00 . A A . 7 TRP CE3 1 1 12 5887 1 1 7 TRP CG C -4.707 -8.345 2.756 1.00 . A A . 7 TRP CG 1 1 12 5888 1 1 7 TRP CH2 C -5.232 -9.516 6.873 1.00 . A A . 7 TRP CH2 1 1 12 5889 1 1 7 TRP CZ2 C -4.645 -10.320 5.886 1.00 . A A . 7 TRP CZ2 1 1 12 5890 1 1 7 TRP CZ3 C -5.702 -8.239 6.537 1.00 . A A . 7 TRP CZ3 1 1 12 5891 1 1 7 TRP H H -6.445 -5.246 0.142 1.00 . A A . 7 TRP H 1 1 12 5892 1 1 7 TRP HA H -7.105 -7.471 1.971 1.00 . A A . 7 TRP HA 1 1 12 5893 1 1 7 TRP HB2 H -4.664 -7.513 0.835 1.00 . A A . 7 TRP HB2 1 1 12 5894 1 1 7 TRP HB3 H -4.281 -6.365 2.050 1.00 . A A . 7 TRP HB3 1 1 12 5895 1 1 7 TRP HD1 H -3.998 -9.796 1.312 1.00 . A A . 7 TRP HD1 1 1 12 5896 1 1 7 TRP HE1 H -3.786 -11.371 3.327 1.00 . A A . 7 TRP HE1 1 1 12 5897 1 1 7 TRP HE3 H -5.961 -6.776 5.012 1.00 . A A . 7 TRP HE3 1 1 12 5898 1 1 7 TRP HH2 H -5.356 -9.890 7.878 1.00 . A A . 7 TRP HH2 1 1 12 5899 1 1 7 TRP HZ2 H -4.315 -11.324 6.115 1.00 . A A . 7 TRP HZ2 1 1 12 5900 1 1 7 TRP HZ3 H -6.190 -7.630 7.289 1.00 . A A . 7 TRP HZ3 1 1 12 5901 1 1 7 TRP N N -6.646 -6.212 0.347 1.00 . A A . 7 TRP N 1 1 12 5902 1 1 7 TRP NE1 N -4.118 -10.407 3.408 1.00 . A A . 7 TRP NE1 1 1 12 5903 1 1 7 TRP O O -5.852 -5.052 3.451 1.00 . A A . 7 TRP O 1 1 12 5904 1 1 8 MET C C -7.681 -3.045 4.373 1.00 . A A . 8 MET C 1 1 12 5905 1 1 8 MET CA C -8.566 -3.996 3.532 1.00 . A A . 8 MET CA 1 1 12 5906 1 1 8 MET CB C -9.481 -4.865 4.418 1.00 . A A . 8 MET CB 1 1 12 5907 1 1 8 MET CE C -13.052 -6.785 3.409 1.00 . A A . 8 MET CE 1 1 12 5908 1 1 8 MET CG C -10.622 -5.503 3.623 1.00 . A A . 8 MET CG 1 1 12 5909 1 1 8 MET H H -8.456 -5.161 1.758 1.00 . A A . 8 MET H 1 1 12 5910 1 1 8 MET HA H -9.221 -3.331 2.971 1.00 . A A . 8 MET HA 1 1 12 5911 1 1 8 MET HB2 H -8.896 -5.643 4.912 1.00 . A A . 8 MET HB2 1 1 12 5912 1 1 8 MET HB3 H -9.937 -4.238 5.186 1.00 . A A . 8 MET HB3 1 1 12 5913 1 1 8 MET HE1 H -13.783 -7.459 3.854 1.00 . A A . 8 MET HE1 1 1 12 5914 1 1 8 MET HE2 H -13.560 -5.913 2.998 1.00 . A A . 8 MET HE2 1 1 12 5915 1 1 8 MET HE3 H -12.522 -7.311 2.617 1.00 . A A . 8 MET HE3 1 1 12 5916 1 1 8 MET HG2 H -11.106 -4.738 3.018 1.00 . A A . 8 MET HG2 1 1 12 5917 1 1 8 MET HG3 H -10.216 -6.260 2.953 1.00 . A A . 8 MET HG3 1 1 12 5918 1 1 8 MET N N -7.887 -4.845 2.528 1.00 . A A . 8 MET N 1 1 12 5919 1 1 8 MET O O -7.784 -3.011 5.598 1.00 . A A . 8 MET O 1 1 12 5920 1 1 8 MET SD S -11.876 -6.266 4.679 1.00 . A A . 8 MET SD 1 1 12 5921 1 1 9 GLN C C -6.205 -0.373 5.450 1.00 . A A . 9 GLN C 1 1 12 5922 1 1 9 GLN CA C -5.788 -1.419 4.381 1.00 . A A . 9 GLN CA 1 1 12 5923 1 1 9 GLN CB C -5.003 -0.706 3.268 1.00 . A A . 9 GLN CB 1 1 12 5924 1 1 9 GLN CD C -5.195 1.527 1.976 1.00 . A A . 9 GLN CD 1 1 12 5925 1 1 9 GLN CG C -5.875 0.225 2.396 1.00 . A A . 9 GLN CG 1 1 12 5926 1 1 9 GLN H H -6.727 -2.404 2.738 1.00 . A A . 9 GLN H 1 1 12 5927 1 1 9 GLN HA H -5.099 -2.101 4.883 1.00 . A A . 9 GLN HA 1 1 12 5928 1 1 9 GLN HB2 H -4.196 -0.143 3.727 1.00 . A A . 9 GLN HB2 1 1 12 5929 1 1 9 GLN HB3 H -4.537 -1.457 2.642 1.00 . A A . 9 GLN HB3 1 1 12 5930 1 1 9 GLN HE21 H -6.848 2.611 2.212 1.00 . A A . 9 GLN HE21 1 1 12 5931 1 1 9 GLN HE22 H -5.481 3.437 1.497 1.00 . A A . 9 GLN HE22 1 1 12 5932 1 1 9 GLN HG2 H -6.186 -0.301 1.497 1.00 . A A . 9 GLN HG2 1 1 12 5933 1 1 9 GLN HG3 H -6.791 0.471 2.926 1.00 . A A . 9 GLN HG3 1 1 12 5934 1 1 9 GLN N N -6.831 -2.240 3.733 1.00 . A A . 9 GLN N 1 1 12 5935 1 1 9 GLN NE2 N -5.955 2.572 1.746 1.00 . A A . 9 GLN NE2 1 1 12 5936 1 1 9 GLN O O -5.325 0.276 6.008 1.00 . A A . 9 GLN O 1 1 12 5937 1 1 9 GLN OE1 O -3.992 1.616 1.768 1.00 . A A . 9 GLN OE1 1 1 12 5938 1 1 10 THR C C -7.900 2.308 5.366 1.00 . A A . 10 THR C 1 1 12 5939 1 1 10 THR CA C -8.053 1.089 6.297 1.00 . A A . 10 THR CA 1 1 12 5940 1 1 10 THR CB C -7.584 1.313 7.746 1.00 . A A . 10 THR CB 1 1 12 5941 1 1 10 THR CG2 C -8.301 2.478 8.419 1.00 . A A . 10 THR CG2 1 1 12 5942 1 1 10 THR H H -8.165 -0.809 5.321 1.00 . A A . 10 THR H 1 1 12 5943 1 1 10 THR HA H -9.119 0.938 6.400 1.00 . A A . 10 THR HA 1 1 12 5944 1 1 10 THR HB H -6.511 1.492 7.785 1.00 . A A . 10 THR HB 1 1 12 5945 1 1 10 THR HG1 H -7.123 -0.418 8.501 1.00 . A A . 10 THR HG1 1 1 12 5946 1 1 10 THR HG21 H -9.380 2.372 8.321 1.00 . A A . 10 THR HG21 1 1 12 5947 1 1 10 THR HG22 H -7.985 3.418 7.973 1.00 . A A . 10 THR HG22 1 1 12 5948 1 1 10 THR HG23 H -8.039 2.509 9.477 1.00 . A A . 10 THR HG23 1 1 12 5949 1 1 10 THR N N -7.503 -0.156 5.710 1.00 . A A . 10 THR N 1 1 12 5950 1 1 10 THR O O -7.026 2.342 4.501 1.00 . A A . 10 THR O 1 1 12 5951 1 1 10 THR OG1 O -7.909 0.164 8.509 1.00 . A A . 10 THR OG1 1 1 12 5952 1 1 11 CYS C C -9.704 5.538 5.039 1.00 . A A . 11 CYS C 1 1 12 5953 1 1 11 CYS CA C -8.879 4.385 4.455 1.00 . A A . 11 CYS CA 1 1 12 5954 1 1 11 CYS CB C -9.421 3.932 3.094 1.00 . A A . 11 CYS CB 1 1 12 5955 1 1 11 CYS H H -9.586 3.201 6.076 1.00 . A A . 11 CYS H 1 1 12 5956 1 1 11 CYS HA H -7.858 4.737 4.317 1.00 . A A . 11 CYS HA 1 1 12 5957 1 1 11 CYS HB2 H -9.214 2.870 2.991 1.00 . A A . 11 CYS HB2 1 1 12 5958 1 1 11 CYS HB3 H -10.502 4.065 3.068 1.00 . A A . 11 CYS HB3 1 1 12 5959 1 1 11 CYS N N -8.858 3.241 5.375 1.00 . A A . 11 CYS N 1 1 12 5960 1 1 11 CYS O O -10.826 5.318 5.487 1.00 . A A . 11 CYS O 1 1 12 5961 1 1 11 CYS SG S -8.659 4.743 1.666 1.00 . A A . 11 CYS SG 1 1 12 5962 1 1 12 ASP C C -9.175 9.161 5.079 1.00 . A A . 12 ASP C 1 1 12 5963 1 1 12 ASP CA C -9.556 7.889 5.866 1.00 . A A . 12 ASP CA 1 1 12 5964 1 1 12 ASP CB C -8.788 7.884 7.199 1.00 . A A . 12 ASP CB 1 1 12 5965 1 1 12 ASP CG C -8.732 6.520 7.899 1.00 . A A . 12 ASP CG 1 1 12 5966 1 1 12 ASP H H -8.286 6.884 4.517 1.00 . A A . 12 ASP H 1 1 12 5967 1 1 12 ASP HA H -10.627 7.848 6.056 1.00 . A A . 12 ASP HA 1 1 12 5968 1 1 12 ASP HB2 H -7.764 8.214 7.013 1.00 . A A . 12 ASP HB2 1 1 12 5969 1 1 12 ASP HB3 H -9.246 8.615 7.865 1.00 . A A . 12 ASP HB3 1 1 12 5970 1 1 12 ASP N N -9.122 6.736 5.069 1.00 . A A . 12 ASP N 1 1 12 5971 1 1 12 ASP O O -8.286 9.100 4.228 1.00 . A A . 12 ASP O 1 1 12 5972 1 1 12 ASP OD1 O -7.614 5.960 7.995 1.00 . A A . 12 ASP OD1 1 1 12 5973 1 1 12 ASP OD2 O -9.773 6.072 8.440 1.00 . A A . 12 ASP OD2 1 1 12 5974 1 1 13 SER C C -7.886 11.925 4.665 1.00 . A A . 13 SER C 1 1 12 5975 1 1 13 SER CA C -9.393 11.621 4.755 1.00 . A A . 13 SER CA 1 1 12 5976 1 1 13 SER CB C -10.130 12.763 5.464 1.00 . A A . 13 SER CB 1 1 12 5977 1 1 13 SER H H -10.432 10.351 6.146 1.00 . A A . 13 SER H 1 1 12 5978 1 1 13 SER HA H -9.778 11.578 3.738 1.00 . A A . 13 SER HA 1 1 12 5979 1 1 13 SER HB2 H -11.199 12.577 5.390 1.00 . A A . 13 SER HB2 1 1 12 5980 1 1 13 SER HB3 H -9.856 12.775 6.518 1.00 . A A . 13 SER HB3 1 1 12 5981 1 1 13 SER HG H -10.673 14.534 4.923 1.00 . A A . 13 SER HG 1 1 12 5982 1 1 13 SER N N -9.712 10.340 5.428 1.00 . A A . 13 SER N 1 1 12 5983 1 1 13 SER O O -7.392 12.327 3.611 1.00 . A A . 13 SER O 1 1 12 5984 1 1 13 SER OG O -9.843 14.030 4.902 1.00 . A A . 13 SER OG 1 1 12 5985 1 1 14 GLU C C -4.904 10.756 4.790 1.00 . A A . 14 GLU C 1 1 12 5986 1 1 14 GLU CA C -5.656 11.684 5.764 1.00 . A A . 14 GLU CA 1 1 12 5987 1 1 14 GLU CB C -5.249 11.374 7.219 1.00 . A A . 14 GLU CB 1 1 12 5988 1 1 14 GLU CD C -3.399 10.890 8.929 1.00 . A A . 14 GLU CD 1 1 12 5989 1 1 14 GLU CG C -3.747 11.147 7.461 1.00 . A A . 14 GLU CG 1 1 12 5990 1 1 14 GLU H H -7.597 11.235 6.528 1.00 . A A . 14 GLU H 1 1 12 5991 1 1 14 GLU HA H -5.347 12.700 5.526 1.00 . A A . 14 GLU HA 1 1 12 5992 1 1 14 GLU HB2 H -5.580 12.200 7.845 1.00 . A A . 14 GLU HB2 1 1 12 5993 1 1 14 GLU HB3 H -5.777 10.477 7.545 1.00 . A A . 14 GLU HB3 1 1 12 5994 1 1 14 GLU HG2 H -3.406 10.287 6.887 1.00 . A A . 14 GLU HG2 1 1 12 5995 1 1 14 GLU HG3 H -3.201 12.024 7.115 1.00 . A A . 14 GLU HG3 1 1 12 5996 1 1 14 GLU N N -7.125 11.593 5.711 1.00 . A A . 14 GLU N 1 1 12 5997 1 1 14 GLU O O -3.768 11.052 4.401 1.00 . A A . 14 GLU O 1 1 12 5998 1 1 14 GLU OE1 O -4.294 10.849 9.805 1.00 . A A . 14 GLU OE1 1 1 12 5999 1 1 14 GLU OE2 O -2.193 10.753 9.238 1.00 . A A . 14 GLU OE2 1 1 12 6000 1 1 15 ARG C C -4.862 7.888 2.791 1.00 . A A . 15 ARG C 1 1 12 6001 1 1 15 ARG CA C -4.670 8.364 4.229 1.00 . A A . 15 ARG CA 1 1 12 6002 1 1 15 ARG CB C -4.985 7.299 5.293 1.00 . A A . 15 ARG CB 1 1 12 6003 1 1 15 ARG CD C -5.072 4.934 4.509 1.00 . A A . 15 ARG CD 1 1 12 6004 1 1 15 ARG CG C -4.162 6.010 5.124 1.00 . A A . 15 ARG CG 1 1 12 6005 1 1 15 ARG CZ C -3.687 2.925 4.939 1.00 . A A . 15 ARG CZ 1 1 12 6006 1 1 15 ARG H H -6.444 9.446 4.720 1.00 . A A . 15 ARG H 1 1 12 6007 1 1 15 ARG HA H -3.612 8.611 4.331 1.00 . A A . 15 ARG HA 1 1 12 6008 1 1 15 ARG HB2 H -4.745 7.725 6.268 1.00 . A A . 15 ARG HB2 1 1 12 6009 1 1 15 ARG HB3 H -6.054 7.076 5.293 1.00 . A A . 15 ARG HB3 1 1 12 6010 1 1 15 ARG HD2 H -5.787 4.604 5.252 1.00 . A A . 15 ARG HD2 1 1 12 6011 1 1 15 ARG HD3 H -5.548 5.327 3.620 1.00 . A A . 15 ARG HD3 1 1 12 6012 1 1 15 ARG HE H -3.962 3.730 3.143 1.00 . A A . 15 ARG HE 1 1 12 6013 1 1 15 ARG HG2 H -3.306 6.180 4.482 1.00 . A A . 15 ARG HG2 1 1 12 6014 1 1 15 ARG HG3 H -3.791 5.683 6.092 1.00 . A A . 15 ARG HG3 1 1 12 6015 1 1 15 ARG HH11 H -4.450 3.658 6.656 1.00 . A A . 15 ARG HH11 1 1 12 6016 1 1 15 ARG HH12 H -3.599 2.146 6.784 1.00 . A A . 15 ARG HH12 1 1 12 6017 1 1 15 ARG HH21 H -2.971 1.794 3.455 1.00 . A A . 15 ARG HH21 1 1 12 6018 1 1 15 ARG HH22 H -2.546 1.310 5.105 1.00 . A A . 15 ARG HH22 1 1 12 6019 1 1 15 ARG N N -5.452 9.565 4.537 1.00 . A A . 15 ARG N 1 1 12 6020 1 1 15 ARG NE N -4.189 3.831 4.119 1.00 . A A . 15 ARG NE 1 1 12 6021 1 1 15 ARG NH1 N -3.875 2.942 6.226 1.00 . A A . 15 ARG NH1 1 1 12 6022 1 1 15 ARG NH2 N -2.955 1.972 4.448 1.00 . A A . 15 ARG NH2 1 1 12 6023 1 1 15 ARG O O -5.989 7.790 2.308 1.00 . A A . 15 ARG O 1 1 12 6024 1 1 16 LYS C C -4.736 6.096 0.356 1.00 . A A . 16 LYS C 1 1 12 6025 1 1 16 LYS CA C -3.675 7.132 0.737 1.00 . A A . 16 LYS CA 1 1 12 6026 1 1 16 LYS CB C -2.240 6.693 0.370 1.00 . A A . 16 LYS CB 1 1 12 6027 1 1 16 LYS CD C -0.288 5.107 0.808 1.00 . A A . 16 LYS CD 1 1 12 6028 1 1 16 LYS CE C 0.078 3.688 1.267 1.00 . A A . 16 LYS CE 1 1 12 6029 1 1 16 LYS CG C -1.799 5.334 0.953 1.00 . A A . 16 LYS CG 1 1 12 6030 1 1 16 LYS H H -2.885 7.515 2.688 1.00 . A A . 16 LYS H 1 1 12 6031 1 1 16 LYS HA H -3.888 8.042 0.173 1.00 . A A . 16 LYS HA 1 1 12 6032 1 1 16 LYS HB2 H -2.158 6.645 -0.716 1.00 . A A . 16 LYS HB2 1 1 12 6033 1 1 16 LYS HB3 H -1.551 7.467 0.715 1.00 . A A . 16 LYS HB3 1 1 12 6034 1 1 16 LYS HD2 H 0.005 5.239 -0.235 1.00 . A A . 16 LYS HD2 1 1 12 6035 1 1 16 LYS HD3 H 0.237 5.840 1.422 1.00 . A A . 16 LYS HD3 1 1 12 6036 1 1 16 LYS HE2 H -0.301 3.540 2.282 1.00 . A A . 16 LYS HE2 1 1 12 6037 1 1 16 LYS HE3 H -0.417 2.965 0.612 1.00 . A A . 16 LYS HE3 1 1 12 6038 1 1 16 LYS HG2 H -2.063 5.279 2.008 1.00 . A A . 16 LYS HG2 1 1 12 6039 1 1 16 LYS HG3 H -2.322 4.535 0.428 1.00 . A A . 16 LYS HG3 1 1 12 6040 1 1 16 LYS HZ1 H 2.010 4.058 1.932 1.00 . A A . 16 LYS HZ1 1 1 12 6041 1 1 16 LYS HZ2 H 1.958 3.653 0.342 1.00 . A A . 16 LYS HZ2 1 1 12 6042 1 1 16 LYS HZ3 H 1.781 2.494 1.459 1.00 . A A . 16 LYS HZ3 1 1 12 6043 1 1 16 LYS N N -3.752 7.486 2.159 1.00 . A A . 16 LYS N 1 1 12 6044 1 1 16 LYS NZ N 1.542 3.462 1.251 1.00 . A A . 16 LYS NZ 1 1 12 6045 1 1 16 LYS O O -4.811 5.010 0.937 1.00 . A A . 16 LYS O 1 1 12 6046 1 1 17 CYS C C -5.644 4.711 -2.421 1.00 . A A . 17 CYS C 1 1 12 6047 1 1 17 CYS CA C -6.411 5.443 -1.316 1.00 . A A . 17 CYS CA 1 1 12 6048 1 1 17 CYS CB C -7.657 6.162 -1.846 1.00 . A A . 17 CYS CB 1 1 12 6049 1 1 17 CYS H H -5.389 7.303 -1.118 1.00 . A A . 17 CYS H 1 1 12 6050 1 1 17 CYS HA H -6.740 4.726 -0.566 1.00 . A A . 17 CYS HA 1 1 12 6051 1 1 17 CYS HB2 H -7.942 6.933 -1.126 1.00 . A A . 17 CYS HB2 1 1 12 6052 1 1 17 CYS HB3 H -7.399 6.677 -2.771 1.00 . A A . 17 CYS HB3 1 1 12 6053 1 1 17 CYS N N -5.504 6.396 -0.689 1.00 . A A . 17 CYS N 1 1 12 6054 1 1 17 CYS O O -5.215 5.335 -3.392 1.00 . A A . 17 CYS O 1 1 12 6055 1 1 17 CYS SG S -9.146 5.154 -2.138 1.00 . A A . 17 CYS SG 1 1 12 6056 1 1 18 CYS C C -4.981 2.727 -4.664 1.00 . A A . 18 CYS C 1 1 12 6057 1 1 18 CYS CA C -4.807 2.458 -3.157 1.00 . A A . 18 CYS CA 1 1 12 6058 1 1 18 CYS CB C -5.362 1.062 -2.846 1.00 . A A . 18 CYS CB 1 1 12 6059 1 1 18 CYS H H -5.855 3.010 -1.402 1.00 . A A . 18 CYS H 1 1 12 6060 1 1 18 CYS HA H -3.742 2.485 -2.926 1.00 . A A . 18 CYS HA 1 1 12 6061 1 1 18 CYS HB2 H -5.541 0.980 -1.775 1.00 . A A . 18 CYS HB2 1 1 12 6062 1 1 18 CYS HB3 H -6.322 0.944 -3.351 1.00 . A A . 18 CYS HB3 1 1 12 6063 1 1 18 CYS N N -5.504 3.393 -2.264 1.00 . A A . 18 CYS N 1 1 12 6064 1 1 18 CYS O O -4.012 2.670 -5.414 1.00 . A A . 18 CYS O 1 1 12 6065 1 1 18 CYS SG S -4.297 -0.317 -3.320 1.00 . A A . 18 CYS SG 1 1 12 6066 1 1 19 GLU C C -7.341 4.599 -6.680 1.00 . A A . 19 GLU C 1 1 12 6067 1 1 19 GLU CA C -6.579 3.265 -6.503 1.00 . A A . 19 GLU CA 1 1 12 6068 1 1 19 GLU CB C -7.382 2.061 -7.044 1.00 . A A . 19 GLU CB 1 1 12 6069 1 1 19 GLU CD C -7.642 -0.465 -7.345 1.00 . A A . 19 GLU CD 1 1 12 6070 1 1 19 GLU CG C -6.728 0.678 -6.870 1.00 . A A . 19 GLU CG 1 1 12 6071 1 1 19 GLU H H -6.950 3.041 -4.421 1.00 . A A . 19 GLU H 1 1 12 6072 1 1 19 GLU HA H -5.675 3.355 -7.106 1.00 . A A . 19 GLU HA 1 1 12 6073 1 1 19 GLU HB2 H -8.343 2.038 -6.532 1.00 . A A . 19 GLU HB2 1 1 12 6074 1 1 19 GLU HB3 H -7.553 2.221 -8.109 1.00 . A A . 19 GLU HB3 1 1 12 6075 1 1 19 GLU HG2 H -5.793 0.654 -7.430 1.00 . A A . 19 GLU HG2 1 1 12 6076 1 1 19 GLU HG3 H -6.493 0.517 -5.817 1.00 . A A . 19 GLU HG3 1 1 12 6077 1 1 19 GLU N N -6.206 3.037 -5.099 1.00 . A A . 19 GLU N 1 1 12 6078 1 1 19 GLU O O -8.139 4.746 -7.602 1.00 . A A . 19 GLU O 1 1 12 6079 1 1 19 GLU OE1 O -8.558 -0.248 -8.170 1.00 . A A . 19 GLU OE1 1 1 12 6080 1 1 19 GLU OE2 O -7.503 -1.603 -6.838 1.00 . A A . 19 GLU OE2 1 1 12 6081 1 1 20 GLY C C -9.353 6.938 -5.667 1.00 . A A . 20 GLY C 1 1 12 6082 1 1 20 GLY CA C -7.821 6.883 -5.820 1.00 . A A . 20 GLY CA 1 1 12 6083 1 1 20 GLY H H -6.476 5.404 -5.043 1.00 . A A . 20 GLY H 1 1 12 6084 1 1 20 GLY HA2 H -7.400 7.499 -5.028 1.00 . A A . 20 GLY HA2 1 1 12 6085 1 1 20 GLY HA3 H -7.566 7.335 -6.779 1.00 . A A . 20 GLY HA3 1 1 12 6086 1 1 20 GLY N N -7.188 5.553 -5.750 1.00 . A A . 20 GLY N 1 1 12 6087 1 1 20 GLY O O -9.960 7.969 -5.966 1.00 . A A . 20 GLY O 1 1 12 6088 1 1 21 MET C C -12.079 6.302 -3.910 1.00 . A A . 21 MET C 1 1 12 6089 1 1 21 MET CA C -11.414 5.598 -5.117 1.00 . A A . 21 MET CA 1 1 12 6090 1 1 21 MET CB C -11.643 4.075 -5.017 1.00 . A A . 21 MET CB 1 1 12 6091 1 1 21 MET CE C -10.515 2.380 -8.646 1.00 . A A . 21 MET CE 1 1 12 6092 1 1 21 MET CG C -10.968 3.269 -6.128 1.00 . A A . 21 MET CG 1 1 12 6093 1 1 21 MET H H -9.361 5.071 -4.984 1.00 . A A . 21 MET H 1 1 12 6094 1 1 21 MET HA H -11.885 5.956 -6.029 1.00 . A A . 21 MET HA 1 1 12 6095 1 1 21 MET HB2 H -11.256 3.726 -4.060 1.00 . A A . 21 MET HB2 1 1 12 6096 1 1 21 MET HB3 H -12.710 3.853 -5.047 1.00 . A A . 21 MET HB3 1 1 12 6097 1 1 21 MET HE1 H -10.298 1.470 -8.087 1.00 . A A . 21 MET HE1 1 1 12 6098 1 1 21 MET HE2 H -10.884 2.107 -9.629 1.00 . A A . 21 MET HE2 1 1 12 6099 1 1 21 MET HE3 H -9.601 2.959 -8.759 1.00 . A A . 21 MET HE3 1 1 12 6100 1 1 21 MET HG2 H -9.928 3.567 -6.221 1.00 . A A . 21 MET HG2 1 1 12 6101 1 1 21 MET HG3 H -10.966 2.228 -5.824 1.00 . A A . 21 MET HG3 1 1 12 6102 1 1 21 MET N N -9.965 5.838 -5.224 1.00 . A A . 21 MET N 1 1 12 6103 1 1 21 MET O O -11.445 7.061 -3.176 1.00 . A A . 21 MET O 1 1 12 6104 1 1 21 MET SD S -11.749 3.357 -7.755 1.00 . A A . 21 MET SD 1 1 12 6105 1 1 22 VAL C C -13.022 5.435 -1.249 1.00 . A A . 22 VAL C 1 1 12 6106 1 1 22 VAL CA C -13.963 6.069 -2.287 1.00 . A A . 22 VAL CA 1 1 12 6107 1 1 22 VAL CB C -15.326 5.340 -2.287 1.00 . A A . 22 VAL CB 1 1 12 6108 1 1 22 VAL CG1 C -15.872 5.000 -0.891 1.00 . A A . 22 VAL CG1 1 1 12 6109 1 1 22 VAL CG2 C -16.373 6.208 -2.996 1.00 . A A . 22 VAL CG2 1 1 12 6110 1 1 22 VAL H H -13.831 5.405 -4.312 1.00 . A A . 22 VAL H 1 1 12 6111 1 1 22 VAL HA H -14.116 7.118 -2.036 1.00 . A A . 22 VAL HA 1 1 12 6112 1 1 22 VAL HB H -15.225 4.404 -2.838 1.00 . A A . 22 VAL HB 1 1 12 6113 1 1 22 VAL HG11 H -15.908 5.896 -0.274 1.00 . A A . 22 VAL HG11 1 1 12 6114 1 1 22 VAL HG12 H -16.874 4.581 -0.983 1.00 . A A . 22 VAL HG12 1 1 12 6115 1 1 22 VAL HG13 H -15.240 4.252 -0.408 1.00 . A A . 22 VAL HG13 1 1 12 6116 1 1 22 VAL HG21 H -16.567 7.113 -2.420 1.00 . A A . 22 VAL HG21 1 1 12 6117 1 1 22 VAL HG22 H -16.014 6.492 -3.985 1.00 . A A . 22 VAL HG22 1 1 12 6118 1 1 22 VAL HG23 H -17.303 5.649 -3.111 1.00 . A A . 22 VAL HG23 1 1 12 6119 1 1 22 VAL N N -13.341 5.953 -3.624 1.00 . A A . 22 VAL N 1 1 12 6120 1 1 22 VAL O O -12.499 4.340 -1.466 1.00 . A A . 22 VAL O 1 1 12 6121 1 1 23 CYS C C -12.474 5.945 2.322 1.00 . A A . 23 CYS C 1 1 12 6122 1 1 23 CYS CA C -11.854 5.841 0.917 1.00 . A A . 23 CYS CA 1 1 12 6123 1 1 23 CYS CB C -10.695 6.821 0.690 1.00 . A A . 23 CYS CB 1 1 12 6124 1 1 23 CYS H H -13.336 7.005 -0.031 1.00 . A A . 23 CYS H 1 1 12 6125 1 1 23 CYS HA H -11.473 4.828 0.789 1.00 . A A . 23 CYS HA 1 1 12 6126 1 1 23 CYS HB2 H -10.358 6.725 -0.338 1.00 . A A . 23 CYS HB2 1 1 12 6127 1 1 23 CYS HB3 H -11.078 7.833 0.798 1.00 . A A . 23 CYS HB3 1 1 12 6128 1 1 23 CYS N N -12.864 6.113 -0.108 1.00 . A A . 23 CYS N 1 1 12 6129 1 1 23 CYS O O -12.388 6.983 2.981 1.00 . A A . 23 CYS O 1 1 12 6130 1 1 23 CYS SG S -9.249 6.682 1.774 1.00 . A A . 23 CYS SG 1 1 12 6131 1 1 24 ARG C C -13.949 3.279 4.430 1.00 . A A . 24 ARG C 1 1 12 6132 1 1 24 ARG CA C -13.920 4.750 4.007 1.00 . A A . 24 ARG CA 1 1 12 6133 1 1 24 ARG CB C -15.361 5.310 3.915 1.00 . A A . 24 ARG CB 1 1 12 6134 1 1 24 ARG CD C -15.488 7.520 2.661 1.00 . A A . 24 ARG CD 1 1 12 6135 1 1 24 ARG CG C -15.465 6.842 4.043 1.00 . A A . 24 ARG CG 1 1 12 6136 1 1 24 ARG CZ C -17.255 8.023 1.029 1.00 . A A . 24 ARG CZ 1 1 12 6137 1 1 24 ARG H H -13.245 4.102 2.085 1.00 . A A . 24 ARG H 1 1 12 6138 1 1 24 ARG HA H -13.377 5.299 4.781 1.00 . A A . 24 ARG HA 1 1 12 6139 1 1 24 ARG HB2 H -15.840 4.966 2.998 1.00 . A A . 24 ARG HB2 1 1 12 6140 1 1 24 ARG HB3 H -15.927 4.893 4.751 1.00 . A A . 24 ARG HB3 1 1 12 6141 1 1 24 ARG HD2 H -15.212 8.553 2.793 1.00 . A A . 24 ARG HD2 1 1 12 6142 1 1 24 ARG HD3 H -14.812 7.035 1.983 1.00 . A A . 24 ARG HD3 1 1 12 6143 1 1 24 ARG HE H -17.587 7.053 2.735 1.00 . A A . 24 ARG HE 1 1 12 6144 1 1 24 ARG HG2 H -16.355 7.112 4.610 1.00 . A A . 24 ARG HG2 1 1 12 6145 1 1 24 ARG HG3 H -14.603 7.206 4.583 1.00 . A A . 24 ARG HG3 1 1 12 6146 1 1 24 ARG HH11 H -15.447 8.719 0.492 1.00 . A A . 24 ARG HH11 1 1 12 6147 1 1 24 ARG HH12 H -16.782 9.144 -0.569 1.00 . A A . 24 ARG HH12 1 1 12 6148 1 1 24 ARG HH21 H -19.190 7.536 1.301 1.00 . A A . 24 ARG HH21 1 1 12 6149 1 1 24 ARG HH22 H -18.846 8.456 -0.137 1.00 . A A . 24 ARG HH22 1 1 12 6150 1 1 24 ARG N N -13.207 4.894 2.719 1.00 . A A . 24 ARG N 1 1 12 6151 1 1 24 ARG NE N -16.860 7.450 2.150 1.00 . A A . 24 ARG NE 1 1 12 6152 1 1 24 ARG NH1 N -16.424 8.637 0.232 1.00 . A A . 24 ARG NH1 1 1 12 6153 1 1 24 ARG NH2 N -18.508 7.970 0.685 1.00 . A A . 24 ARG NH2 1 1 12 6154 1 1 24 ARG O O -14.532 2.468 3.709 1.00 . A A . 24 ARG O 1 1 12 6155 1 1 25 LEU C C -11.878 0.859 4.941 1.00 . A A . 25 LEU C 1 1 12 6156 1 1 25 LEU CA C -12.836 1.565 5.923 1.00 . A A . 25 LEU CA 1 1 12 6157 1 1 25 LEU CB C -14.038 0.657 6.249 1.00 . A A . 25 LEU CB 1 1 12 6158 1 1 25 LEU CD1 C -16.167 0.158 7.427 1.00 . A A . 25 LEU CD1 1 1 12 6159 1 1 25 LEU CD2 C -14.476 1.497 8.623 1.00 . A A . 25 LEU CD2 1 1 12 6160 1 1 25 LEU CG C -15.073 1.210 7.244 1.00 . A A . 25 LEU CG 1 1 12 6161 1 1 25 LEU H H -12.827 3.686 6.046 1.00 . A A . 25 LEU H 1 1 12 6162 1 1 25 LEU HA H -12.267 1.675 6.847 1.00 . A A . 25 LEU HA 1 1 12 6163 1 1 25 LEU HB2 H -14.554 0.423 5.317 1.00 . A A . 25 LEU HB2 1 1 12 6164 1 1 25 LEU HB3 H -13.648 -0.283 6.642 1.00 . A A . 25 LEU HB3 1 1 12 6165 1 1 25 LEU HD11 H -15.722 -0.759 7.813 1.00 . A A . 25 LEU HD11 1 1 12 6166 1 1 25 LEU HD12 H -16.656 -0.031 6.471 1.00 . A A . 25 LEU HD12 1 1 12 6167 1 1 25 LEU HD13 H -16.907 0.517 8.139 1.00 . A A . 25 LEU HD13 1 1 12 6168 1 1 25 LEU HD21 H -13.719 2.275 8.549 1.00 . A A . 25 LEU HD21 1 1 12 6169 1 1 25 LEU HD22 H -14.020 0.596 9.031 1.00 . A A . 25 LEU HD22 1 1 12 6170 1 1 25 LEU HD23 H -15.257 1.845 9.300 1.00 . A A . 25 LEU HD23 1 1 12 6171 1 1 25 LEU HG H -15.521 2.119 6.844 1.00 . A A . 25 LEU HG 1 1 12 6172 1 1 25 LEU N N -13.256 2.929 5.521 1.00 . A A . 25 LEU N 1 1 12 6173 1 1 25 LEU O O -10.979 0.132 5.359 1.00 . A A . 25 LEU O 1 1 12 6174 1 1 26 TRP C C -11.071 1.604 1.413 1.00 . A A . 26 TRP C 1 1 12 6175 1 1 26 TRP CA C -11.072 0.646 2.608 1.00 . A A . 26 TRP CA 1 1 12 6176 1 1 26 TRP CB C -11.407 -0.794 2.147 1.00 . A A . 26 TRP CB 1 1 12 6177 1 1 26 TRP CD1 C -12.634 -2.336 3.765 1.00 . A A . 26 TRP CD1 1 1 12 6178 1 1 26 TRP CD2 C -14.022 -1.092 2.531 1.00 . A A . 26 TRP CD2 1 1 12 6179 1 1 26 TRP CE2 C -14.828 -1.822 3.456 1.00 . A A . 26 TRP CE2 1 1 12 6180 1 1 26 TRP CE3 C -14.684 -0.176 1.687 1.00 . A A . 26 TRP CE3 1 1 12 6181 1 1 26 TRP CG C -12.622 -1.461 2.731 1.00 . A A . 26 TRP CG 1 1 12 6182 1 1 26 TRP CH2 C -16.842 -0.709 2.709 1.00 . A A . 26 TRP CH2 1 1 12 6183 1 1 26 TRP CZ2 C -16.217 -1.652 3.542 1.00 . A A . 26 TRP CZ2 1 1 12 6184 1 1 26 TRP CZ3 C -16.075 0.011 1.774 1.00 . A A . 26 TRP CZ3 1 1 12 6185 1 1 26 TRP H H -12.809 1.637 3.336 1.00 . A A . 26 TRP H 1 1 12 6186 1 1 26 TRP HA H -10.065 0.640 3.028 1.00 . A A . 26 TRP HA 1 1 12 6187 1 1 26 TRP HB2 H -11.526 -0.800 1.064 1.00 . A A . 26 TRP HB2 1 1 12 6188 1 1 26 TRP HB3 H -10.538 -1.418 2.359 1.00 . A A . 26 TRP HB3 1 1 12 6189 1 1 26 TRP HD1 H -11.753 -2.731 4.258 1.00 . A A . 26 TRP HD1 1 1 12 6190 1 1 26 TRP HE1 H -14.175 -3.297 4.856 1.00 . A A . 26 TRP HE1 1 1 12 6191 1 1 26 TRP HE3 H -14.103 0.427 1.002 1.00 . A A . 26 TRP HE3 1 1 12 6192 1 1 26 TRP HH2 H -17.908 -0.534 2.790 1.00 . A A . 26 TRP HH2 1 1 12 6193 1 1 26 TRP HZ2 H -16.792 -2.215 4.262 1.00 . A A . 26 TRP HZ2 1 1 12 6194 1 1 26 TRP HZ3 H -16.549 0.748 1.140 1.00 . A A . 26 TRP HZ3 1 1 12 6195 1 1 26 TRP N N -11.991 1.121 3.641 1.00 . A A . 26 TRP N 1 1 12 6196 1 1 26 TRP NE1 N -13.935 -2.632 4.118 1.00 . A A . 26 TRP NE1 1 1 12 6197 1 1 26 TRP O O -12.044 2.316 1.165 1.00 . A A . 26 TRP O 1 1 12 6198 1 1 27 CYS C C -10.449 0.657 -1.563 1.00 . A A . 27 CYS C 1 1 12 6199 1 1 27 CYS CA C -10.029 1.907 -0.785 1.00 . A A . 27 CYS CA 1 1 12 6200 1 1 27 CYS CB C -8.631 2.365 -1.218 1.00 . A A . 27 CYS CB 1 1 12 6201 1 1 27 CYS H H -9.278 0.880 0.889 1.00 . A A . 27 CYS H 1 1 12 6202 1 1 27 CYS HA H -10.743 2.714 -0.947 1.00 . A A . 27 CYS HA 1 1 12 6203 1 1 27 CYS HB2 H -8.208 2.997 -0.441 1.00 . A A . 27 CYS HB2 1 1 12 6204 1 1 27 CYS HB3 H -7.993 1.488 -1.326 1.00 . A A . 27 CYS HB3 1 1 12 6205 1 1 27 CYS N N -9.998 1.532 0.625 1.00 . A A . 27 CYS N 1 1 12 6206 1 1 27 CYS O O -9.800 -0.374 -1.382 1.00 . A A . 27 CYS O 1 1 12 6207 1 1 27 CYS SG S -8.617 3.296 -2.769 1.00 . A A . 27 CYS SG 1 1 12 6208 1 1 28 LYS C C -12.094 -0.288 -4.573 1.00 . A A . 28 LYS C 1 1 12 6209 1 1 28 LYS CA C -12.055 -0.490 -3.053 1.00 . A A . 28 LYS CA 1 1 12 6210 1 1 28 LYS CB C -13.330 -0.998 -2.335 1.00 . A A . 28 LYS CB 1 1 12 6211 1 1 28 LYS CD C -12.296 -2.886 -0.961 1.00 . A A . 28 LYS CD 1 1 12 6212 1 1 28 LYS CE C -12.046 -4.389 -0.825 1.00 . A A . 28 LYS CE 1 1 12 6213 1 1 28 LYS CG C -13.278 -2.519 -2.093 1.00 . A A . 28 LYS CG 1 1 12 6214 1 1 28 LYS H H -12.024 1.579 -2.428 1.00 . A A . 28 LYS H 1 1 12 6215 1 1 28 LYS HA H -11.313 -1.276 -2.961 1.00 . A A . 28 LYS HA 1 1 12 6216 1 1 28 LYS HB2 H -13.427 -0.511 -1.363 1.00 . A A . 28 LYS HB2 1 1 12 6217 1 1 28 LYS HB3 H -14.226 -0.740 -2.896 1.00 . A A . 28 LYS HB3 1 1 12 6218 1 1 28 LYS HD2 H -11.330 -2.418 -1.136 1.00 . A A . 28 LYS HD2 1 1 12 6219 1 1 28 LYS HD3 H -12.690 -2.506 -0.019 1.00 . A A . 28 LYS HD3 1 1 12 6220 1 1 28 LYS HE2 H -11.655 -4.775 -1.769 1.00 . A A . 28 LYS HE2 1 1 12 6221 1 1 28 LYS HE3 H -11.274 -4.542 -0.066 1.00 . A A . 28 LYS HE3 1 1 12 6222 1 1 28 LYS HG2 H -14.276 -2.863 -1.821 1.00 . A A . 28 LYS HG2 1 1 12 6223 1 1 28 LYS HG3 H -12.983 -3.021 -3.015 1.00 . A A . 28 LYS HG3 1 1 12 6224 1 1 28 LYS HZ1 H -13.738 -4.689 0.359 1.00 . A A . 28 LYS HZ1 1 1 12 6225 1 1 28 LYS HZ2 H -13.110 -6.094 -0.242 1.00 . A A . 28 LYS HZ2 1 1 12 6226 1 1 28 LYS HZ3 H -13.977 -5.107 -1.182 1.00 . A A . 28 LYS HZ3 1 1 12 6227 1 1 28 LYS N N -11.524 0.702 -2.359 1.00 . A A . 28 LYS N 1 1 12 6228 1 1 28 LYS NZ N -13.278 -5.111 -0.443 1.00 . A A . 28 LYS NZ 1 1 12 6229 1 1 28 LYS O O -11.036 -0.032 -5.144 1.00 . A A . 28 LYS O 1 1 12 6230 1 1 29 LYS C C -14.735 0.868 -6.815 1.00 . A A . 29 LYS C 1 1 12 6231 1 1 29 LYS CA C -13.418 0.118 -6.625 1.00 . A A . 29 LYS CA 1 1 12 6232 1 1 29 LYS CB C -13.294 -1.050 -7.618 1.00 . A A . 29 LYS CB 1 1 12 6233 1 1 29 LYS CD C -12.648 -1.648 -10.026 1.00 . A A . 29 LYS CD 1 1 12 6234 1 1 29 LYS CE C -11.366 -2.452 -9.761 1.00 . A A . 29 LYS CE 1 1 12 6235 1 1 29 LYS CG C -12.915 -0.527 -9.014 1.00 . A A . 29 LYS CG 1 1 12 6236 1 1 29 LYS H H -14.063 -0.721 -4.759 1.00 . A A . 29 LYS H 1 1 12 6237 1 1 29 LYS HA H -12.605 0.812 -6.837 1.00 . A A . 29 LYS HA 1 1 12 6238 1 1 29 LYS HB2 H -12.526 -1.735 -7.274 1.00 . A A . 29 LYS HB2 1 1 12 6239 1 1 29 LYS HB3 H -14.234 -1.602 -7.669 1.00 . A A . 29 LYS HB3 1 1 12 6240 1 1 29 LYS HD2 H -13.492 -2.337 -10.020 1.00 . A A . 29 LYS HD2 1 1 12 6241 1 1 29 LYS HD3 H -12.585 -1.210 -11.024 1.00 . A A . 29 LYS HD3 1 1 12 6242 1 1 29 LYS HE2 H -11.417 -2.913 -8.772 1.00 . A A . 29 LYS HE2 1 1 12 6243 1 1 29 LYS HE3 H -11.324 -3.253 -10.504 1.00 . A A . 29 LYS HE3 1 1 12 6244 1 1 29 LYS HG2 H -13.722 0.100 -9.391 1.00 . A A . 29 LYS HG2 1 1 12 6245 1 1 29 LYS HG3 H -12.024 0.092 -8.938 1.00 . A A . 29 LYS HG3 1 1 12 6246 1 1 29 LYS HZ1 H -10.239 -0.905 -10.585 1.00 . A A . 29 LYS HZ1 1 1 12 6247 1 1 29 LYS HZ2 H -9.340 -2.210 -10.131 1.00 . A A . 29 LYS HZ2 1 1 12 6248 1 1 29 LYS HZ3 H -9.868 -1.161 -9.013 1.00 . A A . 29 LYS HZ3 1 1 12 6249 1 1 29 LYS N N -13.252 -0.344 -5.238 1.00 . A A . 29 LYS N 1 1 12 6250 1 1 29 LYS NZ N -10.136 -1.631 -9.882 1.00 . A A . 29 LYS NZ 1 1 12 6251 1 1 29 LYS O O -15.810 0.358 -6.501 1.00 . A A . 29 LYS O 1 1 12 6252 1 1 30 LYS C C -15.689 3.150 -9.377 1.00 . A A . 30 LYS C 1 1 12 6253 1 1 30 LYS CA C -15.745 2.916 -7.861 1.00 . A A . 30 LYS CA 1 1 12 6254 1 1 30 LYS CB C -15.725 4.248 -7.081 1.00 . A A . 30 LYS CB 1 1 12 6255 1 1 30 LYS CD C -18.102 5.063 -7.656 1.00 . A A . 30 LYS CD 1 1 12 6256 1 1 30 LYS CE C -19.463 5.499 -7.101 1.00 . A A . 30 LYS CE 1 1 12 6257 1 1 30 LYS CG C -17.101 4.690 -6.554 1.00 . A A . 30 LYS CG 1 1 12 6258 1 1 30 LYS H H -13.693 2.398 -7.555 1.00 . A A . 30 LYS H 1 1 12 6259 1 1 30 LYS HA H -16.691 2.408 -7.665 1.00 . A A . 30 LYS HA 1 1 12 6260 1 1 30 LYS HB2 H -15.069 4.155 -6.213 1.00 . A A . 30 LYS HB2 1 1 12 6261 1 1 30 LYS HB3 H -15.316 5.034 -7.716 1.00 . A A . 30 LYS HB3 1 1 12 6262 1 1 30 LYS HD2 H -17.686 5.882 -8.244 1.00 . A A . 30 LYS HD2 1 1 12 6263 1 1 30 LYS HD3 H -18.264 4.218 -8.320 1.00 . A A . 30 LYS HD3 1 1 12 6264 1 1 30 LYS HE2 H -19.325 6.312 -6.388 1.00 . A A . 30 LYS HE2 1 1 12 6265 1 1 30 LYS HE3 H -20.056 5.885 -7.935 1.00 . A A . 30 LYS HE3 1 1 12 6266 1 1 30 LYS HG2 H -17.510 3.891 -5.937 1.00 . A A . 30 LYS HG2 1 1 12 6267 1 1 30 LYS HG3 H -16.958 5.565 -5.921 1.00 . A A . 30 LYS HG3 1 1 12 6268 1 1 30 LYS HZ1 H -20.151 3.546 -7.028 1.00 . A A . 30 LYS HZ1 1 1 12 6269 1 1 30 LYS HZ2 H -21.176 4.616 -6.336 1.00 . A A . 30 LYS HZ2 1 1 12 6270 1 1 30 LYS HZ3 H -19.814 4.161 -5.537 1.00 . A A . 30 LYS HZ3 1 1 12 6271 1 1 30 LYS N N -14.633 2.063 -7.402 1.00 . A A . 30 LYS N 1 1 12 6272 1 1 30 LYS NZ N -20.193 4.384 -6.456 1.00 . A A . 30 LYS NZ 1 1 12 6273 1 1 30 LYS O O -16.740 3.221 -10.008 1.00 . A A . 30 LYS O 1 1 12 6274 1 1 31 LEU C C -14.623 1.929 -12.176 1.00 . A A . 31 LEU C 1 1 12 6275 1 1 31 LEU CA C -14.247 3.240 -11.436 1.00 . A A . 31 LEU CA 1 1 12 6276 1 1 31 LEU CB C -12.776 3.678 -11.663 1.00 . A A . 31 LEU CB 1 1 12 6277 1 1 31 LEU CD1 C -12.895 5.929 -12.810 1.00 . A A . 31 LEU CD1 1 1 12 6278 1 1 31 LEU CD2 C -13.051 5.890 -10.335 1.00 . A A . 31 LEU CD2 1 1 12 6279 1 1 31 LEU CG C -12.452 5.184 -11.553 1.00 . A A . 31 LEU CG 1 1 12 6280 1 1 31 LEU H H -13.677 3.108 -9.398 1.00 . A A . 31 LEU H 1 1 12 6281 1 1 31 LEU HA H -14.897 4.013 -11.850 1.00 . A A . 31 LEU HA 1 1 12 6282 1 1 31 LEU HB2 H -12.143 3.138 -10.966 1.00 . A A . 31 LEU HB2 1 1 12 6283 1 1 31 LEU HB3 H -12.455 3.371 -12.658 1.00 . A A . 31 LEU HB3 1 1 12 6284 1 1 31 LEU HD11 H -12.401 5.503 -13.682 1.00 . A A . 31 LEU HD11 1 1 12 6285 1 1 31 LEU HD12 H -12.613 6.980 -12.737 1.00 . A A . 31 LEU HD12 1 1 12 6286 1 1 31 LEU HD13 H -13.974 5.858 -12.933 1.00 . A A . 31 LEU HD13 1 1 12 6287 1 1 31 LEU HD21 H -12.711 5.407 -9.424 1.00 . A A . 31 LEU HD21 1 1 12 6288 1 1 31 LEU HD22 H -14.140 5.888 -10.385 1.00 . A A . 31 LEU HD22 1 1 12 6289 1 1 31 LEU HD23 H -12.708 6.924 -10.324 1.00 . A A . 31 LEU HD23 1 1 12 6290 1 1 31 LEU HG H -11.368 5.279 -11.487 1.00 . A A . 31 LEU HG 1 1 12 6291 1 1 31 LEU N N -14.495 3.144 -9.983 1.00 . A A . 31 LEU N 1 1 12 6292 1 1 31 LEU O O -13.883 1.410 -13.005 1.00 . A A . 31 LEU O 1 1 12 6293 1 1 32 LEU C C -17.300 0.805 -13.677 1.00 . A A . 32 LEU C 1 1 12 6294 1 1 32 LEU CA C -16.411 0.244 -12.562 1.00 . A A . 32 LEU CA 1 1 12 6295 1 1 32 LEU CB C -17.338 -0.443 -11.528 1.00 . A A . 32 LEU CB 1 1 12 6296 1 1 32 LEU CD1 C -17.255 -1.535 -9.264 1.00 . A A . 32 LEU CD1 1 1 12 6297 1 1 32 LEU CD2 C -16.196 -2.689 -11.210 1.00 . A A . 32 LEU CD2 1 1 12 6298 1 1 32 LEU CG C -16.496 -1.320 -10.578 1.00 . A A . 32 LEU CG 1 1 12 6299 1 1 32 LEU H H -16.359 1.877 -11.200 1.00 . A A . 32 LEU H 1 1 12 6300 1 1 32 LEU HA H -15.686 -0.445 -12.973 1.00 . A A . 32 LEU HA 1 1 12 6301 1 1 32 LEU HB2 H -17.880 0.318 -10.964 1.00 . A A . 32 LEU HB2 1 1 12 6302 1 1 32 LEU HB3 H -18.067 -1.071 -12.039 1.00 . A A . 32 LEU HB3 1 1 12 6303 1 1 32 LEU HD11 H -17.437 -0.577 -8.776 1.00 . A A . 32 LEU HD11 1 1 12 6304 1 1 32 LEU HD12 H -16.663 -2.156 -8.590 1.00 . A A . 32 LEU HD12 1 1 12 6305 1 1 32 LEU HD13 H -18.211 -2.023 -9.457 1.00 . A A . 32 LEU HD13 1 1 12 6306 1 1 32 LEU HD21 H -15.603 -2.572 -12.118 1.00 . A A . 32 LEU HD21 1 1 12 6307 1 1 32 LEU HD22 H -17.125 -3.204 -11.459 1.00 . A A . 32 LEU HD22 1 1 12 6308 1 1 32 LEU HD23 H -15.636 -3.310 -10.511 1.00 . A A . 32 LEU HD23 1 1 12 6309 1 1 32 LEU HG H -15.557 -0.821 -10.343 1.00 . A A . 32 LEU HG 1 1 12 6310 1 1 32 LEU N N -15.781 1.366 -11.852 1.00 . A A . 32 LEU N 1 1 12 6311 1 1 32 LEU O O -18.093 1.705 -13.485 1.00 . A A . 32 LEU O 1 1 12 6312 1 1 32 LEU OXT O -17.244 0.351 -14.634 1.00 . A A . 32 LEU OXT 1 1 13 6313 1 1 1 GLY C C 2.547 -2.348 -0.526 1.00 . A A . 1 GLY C 1 1 13 6314 1 1 1 GLY CA C 3.412 -2.114 0.700 1.00 . A A . 1 GLY CA 1 1 13 6315 1 1 1 GLY H1 H 1.998 -0.953 1.642 1.00 . A A . 1 GLY H1 1 1 13 6316 1 1 1 GLY H2 H 1.998 -2.519 2.120 1.00 . A A . 1 GLY H2 1 1 13 6317 1 1 1 GLY H3 H 3.193 -1.511 2.646 1.00 . A A . 1 GLY H3 1 1 13 6318 1 1 1 GLY HA2 H 4.104 -1.304 0.482 1.00 . A A . 1 GLY HA2 1 1 13 6319 1 1 1 GLY HA3 H 3.981 -3.012 0.936 1.00 . A A . 1 GLY HA3 1 1 13 6320 1 1 1 GLY N N 2.593 -1.742 1.864 1.00 . A A . 1 GLY N 1 1 13 6321 1 1 1 GLY O O 1.679 -1.522 -0.793 1.00 . A A . 1 GLY O 1 1 13 6322 1 1 2 PRO C C 0.614 -4.058 -2.535 1.00 . A A . 2 PRO C 1 1 13 6323 1 1 2 PRO CA C 2.104 -3.666 -2.587 1.00 . A A . 2 PRO CA 1 1 13 6324 1 1 2 PRO CB C 2.958 -4.740 -3.270 1.00 . A A . 2 PRO CB 1 1 13 6325 1 1 2 PRO CD C 3.716 -4.496 -1.023 1.00 . A A . 2 PRO CD 1 1 13 6326 1 1 2 PRO CG C 3.474 -5.560 -2.091 1.00 . A A . 2 PRO CG 1 1 13 6327 1 1 2 PRO HA H 2.170 -2.748 -3.174 1.00 . A A . 2 PRO HA 1 1 13 6328 1 1 2 PRO HB2 H 2.389 -5.352 -3.970 1.00 . A A . 2 PRO HB2 1 1 13 6329 1 1 2 PRO HB3 H 3.798 -4.267 -3.781 1.00 . A A . 2 PRO HB3 1 1 13 6330 1 1 2 PRO HD2 H 3.593 -4.925 -0.027 1.00 . A A . 2 PRO HD2 1 1 13 6331 1 1 2 PRO HD3 H 4.719 -4.087 -1.142 1.00 . A A . 2 PRO HD3 1 1 13 6332 1 1 2 PRO HG2 H 2.702 -6.250 -1.757 1.00 . A A . 2 PRO HG2 1 1 13 6333 1 1 2 PRO HG3 H 4.382 -6.103 -2.342 1.00 . A A . 2 PRO HG3 1 1 13 6334 1 1 2 PRO N N 2.741 -3.446 -1.281 1.00 . A A . 2 PRO N 1 1 13 6335 1 1 2 PRO O O 0.017 -4.288 -3.589 1.00 . A A . 2 PRO O 1 1 13 6336 1 1 3 TYR C C -2.184 -3.390 -0.282 1.00 . A A . 3 TYR C 1 1 13 6337 1 1 3 TYR CA C -1.421 -4.398 -1.143 1.00 . A A . 3 TYR CA 1 1 13 6338 1 1 3 TYR CB C -1.642 -5.851 -0.699 1.00 . A A . 3 TYR CB 1 1 13 6339 1 1 3 TYR CD1 C 0.483 -6.835 0.317 1.00 . A A . 3 TYR CD1 1 1 13 6340 1 1 3 TYR CD2 C -1.314 -6.116 1.787 1.00 . A A . 3 TYR CD2 1 1 13 6341 1 1 3 TYR CE1 C 1.257 -7.211 1.436 1.00 . A A . 3 TYR CE1 1 1 13 6342 1 1 3 TYR CE2 C -0.556 -6.504 2.904 1.00 . A A . 3 TYR CE2 1 1 13 6343 1 1 3 TYR CG C -0.802 -6.284 0.490 1.00 . A A . 3 TYR CG 1 1 13 6344 1 1 3 TYR CZ C 0.730 -7.050 2.736 1.00 . A A . 3 TYR CZ 1 1 13 6345 1 1 3 TYR H H 0.543 -3.871 -0.529 1.00 . A A . 3 TYR H 1 1 13 6346 1 1 3 TYR HA H -1.899 -4.319 -2.114 1.00 . A A . 3 TYR HA 1 1 13 6347 1 1 3 TYR HB2 H -2.699 -6.006 -0.481 1.00 . A A . 3 TYR HB2 1 1 13 6348 1 1 3 TYR HB3 H -1.390 -6.498 -1.534 1.00 . A A . 3 TYR HB3 1 1 13 6349 1 1 3 TYR HD1 H 0.872 -6.972 -0.680 1.00 . A A . 3 TYR HD1 1 1 13 6350 1 1 3 TYR HD2 H -2.291 -5.683 1.932 1.00 . A A . 3 TYR HD2 1 1 13 6351 1 1 3 TYR HE1 H 2.244 -7.629 1.302 1.00 . A A . 3 TYR HE1 1 1 13 6352 1 1 3 TYR HE2 H -0.961 -6.399 3.897 1.00 . A A . 3 TYR HE2 1 1 13 6353 1 1 3 TYR HH H 2.219 -7.927 3.653 1.00 . A A . 3 TYR HH 1 1 13 6354 1 1 3 TYR N N -0.004 -4.093 -1.349 1.00 . A A . 3 TYR N 1 1 13 6355 1 1 3 TYR O O -1.726 -3.043 0.813 1.00 . A A . 3 TYR O 1 1 13 6356 1 1 3 TYR OH O 1.454 -7.358 3.842 1.00 . A A . 3 TYR OH 1 1 13 6357 1 1 4 CYS C C -5.632 -1.922 -0.413 1.00 . A A . 4 CYS C 1 1 13 6358 1 1 4 CYS CA C -4.122 -1.888 -0.086 1.00 . A A . 4 CYS CA 1 1 13 6359 1 1 4 CYS CB C -3.488 -0.501 -0.328 1.00 . A A . 4 CYS CB 1 1 13 6360 1 1 4 CYS H H -3.633 -3.216 -1.688 1.00 . A A . 4 CYS H 1 1 13 6361 1 1 4 CYS HA H -4.055 -2.091 0.982 1.00 . A A . 4 CYS HA 1 1 13 6362 1 1 4 CYS HB2 H -4.281 0.238 -0.371 1.00 . A A . 4 CYS HB2 1 1 13 6363 1 1 4 CYS HB3 H -2.898 -0.258 0.554 1.00 . A A . 4 CYS HB3 1 1 13 6364 1 1 4 CYS N N -3.337 -2.917 -0.764 1.00 . A A . 4 CYS N 1 1 13 6365 1 1 4 CYS O O -6.445 -2.143 0.489 1.00 . A A . 4 CYS O 1 1 13 6366 1 1 4 CYS SG S -2.387 -0.223 -1.753 1.00 . A A . 4 CYS SG 1 1 13 6367 1 1 5 GLN C C -7.855 -3.446 -1.906 1.00 . A A . 5 GLN C 1 1 13 6368 1 1 5 GLN CA C -7.429 -1.989 -2.117 1.00 . A A . 5 GLN CA 1 1 13 6369 1 1 5 GLN CB C -7.591 -1.537 -3.588 1.00 . A A . 5 GLN CB 1 1 13 6370 1 1 5 GLN CD C -9.120 -3.207 -4.862 1.00 . A A . 5 GLN CD 1 1 13 6371 1 1 5 GLN CG C -8.963 -1.818 -4.243 1.00 . A A . 5 GLN CG 1 1 13 6372 1 1 5 GLN H H -5.320 -1.679 -2.396 1.00 . A A . 5 GLN H 1 1 13 6373 1 1 5 GLN HA H -8.076 -1.372 -1.495 1.00 . A A . 5 GLN HA 1 1 13 6374 1 1 5 GLN HB2 H -7.442 -0.457 -3.607 1.00 . A A . 5 GLN HB2 1 1 13 6375 1 1 5 GLN HB3 H -6.807 -1.986 -4.199 1.00 . A A . 5 GLN HB3 1 1 13 6376 1 1 5 GLN HE21 H -7.900 -2.751 -6.418 1.00 . A A . 5 GLN HE21 1 1 13 6377 1 1 5 GLN HE22 H -8.410 -4.440 -6.265 1.00 . A A . 5 GLN HE22 1 1 13 6378 1 1 5 GLN HG2 H -9.755 -1.676 -3.516 1.00 . A A . 5 GLN HG2 1 1 13 6379 1 1 5 GLN HG3 H -9.116 -1.088 -5.038 1.00 . A A . 5 GLN HG3 1 1 13 6380 1 1 5 GLN N N -6.030 -1.798 -1.685 1.00 . A A . 5 GLN N 1 1 13 6381 1 1 5 GLN NE2 N -8.397 -3.500 -5.918 1.00 . A A . 5 GLN NE2 1 1 13 6382 1 1 5 GLN O O -8.873 -3.734 -1.273 1.00 . A A . 5 GLN O 1 1 13 6383 1 1 5 GLN OE1 O -9.714 -4.107 -4.279 1.00 . A A . 5 GLN OE1 1 1 13 6384 1 1 6 LYS C C -6.962 -6.401 -0.813 1.00 . A A . 6 LYS C 1 1 13 6385 1 1 6 LYS CA C -7.091 -5.818 -2.235 1.00 . A A . 6 LYS CA 1 1 13 6386 1 1 6 LYS CB C -6.034 -6.350 -3.224 1.00 . A A . 6 LYS CB 1 1 13 6387 1 1 6 LYS CD C -5.556 -7.903 -5.127 1.00 . A A . 6 LYS CD 1 1 13 6388 1 1 6 LYS CE C -5.815 -9.253 -5.797 1.00 . A A . 6 LYS CE 1 1 13 6389 1 1 6 LYS CG C -6.273 -7.762 -3.772 1.00 . A A . 6 LYS CG 1 1 13 6390 1 1 6 LYS H H -6.119 -4.010 -2.749 1.00 . A A . 6 LYS H 1 1 13 6391 1 1 6 LYS HA H -8.082 -6.092 -2.601 1.00 . A A . 6 LYS HA 1 1 13 6392 1 1 6 LYS HB2 H -6.025 -5.675 -4.082 1.00 . A A . 6 LYS HB2 1 1 13 6393 1 1 6 LYS HB3 H -5.046 -6.310 -2.762 1.00 . A A . 6 LYS HB3 1 1 13 6394 1 1 6 LYS HD2 H -5.928 -7.131 -5.803 1.00 . A A . 6 LYS HD2 1 1 13 6395 1 1 6 LYS HD3 H -4.483 -7.749 -4.999 1.00 . A A . 6 LYS HD3 1 1 13 6396 1 1 6 LYS HE2 H -6.873 -9.505 -5.689 1.00 . A A . 6 LYS HE2 1 1 13 6397 1 1 6 LYS HE3 H -5.595 -9.160 -6.864 1.00 . A A . 6 LYS HE3 1 1 13 6398 1 1 6 LYS HG2 H -5.897 -8.491 -3.061 1.00 . A A . 6 LYS HG2 1 1 13 6399 1 1 6 LYS HG3 H -7.339 -7.928 -3.913 1.00 . A A . 6 LYS HG3 1 1 13 6400 1 1 6 LYS HZ1 H -3.994 -10.161 -5.372 1.00 . A A . 6 LYS HZ1 1 1 13 6401 1 1 6 LYS HZ2 H -5.214 -11.210 -5.681 1.00 . A A . 6 LYS HZ2 1 1 13 6402 1 1 6 LYS HZ3 H -5.190 -10.469 -4.240 1.00 . A A . 6 LYS HZ3 1 1 13 6403 1 1 6 LYS N N -6.962 -4.359 -2.296 1.00 . A A . 6 LYS N 1 1 13 6404 1 1 6 LYS NZ N -4.981 -10.331 -5.228 1.00 . A A . 6 LYS NZ 1 1 13 6405 1 1 6 LYS O O -6.951 -7.616 -0.652 1.00 . A A . 6 LYS O 1 1 13 6406 1 1 7 TRP C C -7.085 -4.939 2.652 1.00 . A A . 7 TRP C 1 1 13 6407 1 1 7 TRP CA C -6.560 -5.955 1.607 1.00 . A A . 7 TRP CA 1 1 13 6408 1 1 7 TRP CB C -5.046 -6.192 1.725 1.00 . A A . 7 TRP CB 1 1 13 6409 1 1 7 TRP CD1 C -4.056 -6.777 4.005 1.00 . A A . 7 TRP CD1 1 1 13 6410 1 1 7 TRP CD2 C -4.842 -8.558 2.902 1.00 . A A . 7 TRP CD2 1 1 13 6411 1 1 7 TRP CE2 C -4.260 -9.042 4.109 1.00 . A A . 7 TRP CE2 1 1 13 6412 1 1 7 TRP CE3 C -5.497 -9.502 2.081 1.00 . A A . 7 TRP CE3 1 1 13 6413 1 1 7 TRP CG C -4.603 -7.120 2.815 1.00 . A A . 7 TRP CG 1 1 13 6414 1 1 7 TRP CH2 C -4.839 -11.322 3.569 1.00 . A A . 7 TRP CH2 1 1 13 6415 1 1 7 TRP CZ2 C -4.243 -10.402 4.442 1.00 . A A . 7 TRP CZ2 1 1 13 6416 1 1 7 TRP CZ3 C -5.487 -10.874 2.406 1.00 . A A . 7 TRP CZ3 1 1 13 6417 1 1 7 TRP H H -6.838 -4.561 0.003 1.00 . A A . 7 TRP H 1 1 13 6418 1 1 7 TRP HA H -7.072 -6.899 1.799 1.00 . A A . 7 TRP HA 1 1 13 6419 1 1 7 TRP HB2 H -4.682 -6.632 0.796 1.00 . A A . 7 TRP HB2 1 1 13 6420 1 1 7 TRP HB3 H -4.552 -5.225 1.836 1.00 . A A . 7 TRP HB3 1 1 13 6421 1 1 7 TRP HD1 H -3.827 -5.762 4.309 1.00 . A A . 7 TRP HD1 1 1 13 6422 1 1 7 TRP HE1 H -3.332 -7.918 5.655 1.00 . A A . 7 TRP HE1 1 1 13 6423 1 1 7 TRP HE3 H -5.996 -9.152 1.185 1.00 . A A . 7 TRP HE3 1 1 13 6424 1 1 7 TRP HH2 H -4.800 -12.376 3.795 1.00 . A A . 7 TRP HH2 1 1 13 6425 1 1 7 TRP HZ2 H -3.752 -10.736 5.346 1.00 . A A . 7 TRP HZ2 1 1 13 6426 1 1 7 TRP HZ3 H -5.980 -11.597 1.765 1.00 . A A . 7 TRP HZ3 1 1 13 6427 1 1 7 TRP N N -6.834 -5.546 0.216 1.00 . A A . 7 TRP N 1 1 13 6428 1 1 7 TRP NE1 N -3.779 -7.916 4.735 1.00 . A A . 7 TRP NE1 1 1 13 6429 1 1 7 TRP O O -6.587 -4.874 3.772 1.00 . A A . 7 TRP O 1 1 13 6430 1 1 8 MET C C -7.894 -2.292 4.041 1.00 . A A . 8 MET C 1 1 13 6431 1 1 8 MET CA C -8.812 -3.223 3.219 1.00 . A A . 8 MET CA 1 1 13 6432 1 1 8 MET CB C -9.783 -4.007 4.126 1.00 . A A . 8 MET CB 1 1 13 6433 1 1 8 MET CE C -12.574 -4.990 5.667 1.00 . A A . 8 MET CE 1 1 13 6434 1 1 8 MET CG C -10.928 -4.689 3.369 1.00 . A A . 8 MET CG 1 1 13 6435 1 1 8 MET H H -8.450 -4.223 1.360 1.00 . A A . 8 MET H 1 1 13 6436 1 1 8 MET HA H -9.408 -2.568 2.591 1.00 . A A . 8 MET HA 1 1 13 6437 1 1 8 MET HB2 H -9.221 -4.764 4.677 1.00 . A A . 8 MET HB2 1 1 13 6438 1 1 8 MET HB3 H -10.224 -3.322 4.851 1.00 . A A . 8 MET HB3 1 1 13 6439 1 1 8 MET HE1 H -13.023 -5.675 6.387 1.00 . A A . 8 MET HE1 1 1 13 6440 1 1 8 MET HE2 H -11.830 -4.380 6.180 1.00 . A A . 8 MET HE2 1 1 13 6441 1 1 8 MET HE3 H -13.359 -4.357 5.256 1.00 . A A . 8 MET HE3 1 1 13 6442 1 1 8 MET HG2 H -11.640 -3.938 3.031 1.00 . A A . 8 MET HG2 1 1 13 6443 1 1 8 MET HG3 H -10.522 -5.187 2.489 1.00 . A A . 8 MET HG3 1 1 13 6444 1 1 8 MET N N -8.101 -4.136 2.302 1.00 . A A . 8 MET N 1 1 13 6445 1 1 8 MET O O -7.784 -2.412 5.258 1.00 . A A . 8 MET O 1 1 13 6446 1 1 8 MET SD S -11.801 -5.948 4.337 1.00 . A A . 8 MET SD 1 1 13 6447 1 1 9 GLN C C -6.527 0.567 4.999 1.00 . A A . 9 GLN C 1 1 13 6448 1 1 9 GLN CA C -6.157 -0.483 3.913 1.00 . A A . 9 GLN CA 1 1 13 6449 1 1 9 GLN CB C -5.466 0.196 2.721 1.00 . A A . 9 GLN CB 1 1 13 6450 1 1 9 GLN CD C -5.683 1.986 0.906 1.00 . A A . 9 GLN CD 1 1 13 6451 1 1 9 GLN CG C -6.415 1.105 1.906 1.00 . A A . 9 GLN CG 1 1 13 6452 1 1 9 GLN H H -7.262 -1.422 2.362 1.00 . A A . 9 GLN H 1 1 13 6453 1 1 9 GLN HA H -5.415 -1.131 4.379 1.00 . A A . 9 GLN HA 1 1 13 6454 1 1 9 GLN HB2 H -4.613 0.763 3.093 1.00 . A A . 9 GLN HB2 1 1 13 6455 1 1 9 GLN HB3 H -5.066 -0.570 2.071 1.00 . A A . 9 GLN HB3 1 1 13 6456 1 1 9 GLN HE21 H -4.250 2.477 2.226 1.00 . A A . 9 GLN HE21 1 1 13 6457 1 1 9 GLN HE22 H -4.118 3.232 0.648 1.00 . A A . 9 GLN HE22 1 1 13 6458 1 1 9 GLN HG2 H -7.139 0.492 1.369 1.00 . A A . 9 GLN HG2 1 1 13 6459 1 1 9 GLN HG3 H -6.962 1.765 2.577 1.00 . A A . 9 GLN HG3 1 1 13 6460 1 1 9 GLN N N -7.212 -1.362 3.371 1.00 . A A . 9 GLN N 1 1 13 6461 1 1 9 GLN NE2 N -4.591 2.603 1.290 1.00 . A A . 9 GLN NE2 1 1 13 6462 1 1 9 GLN O O -5.964 1.662 4.976 1.00 . A A . 9 GLN O 1 1 13 6463 1 1 9 GLN OE1 O -6.046 2.069 -0.257 1.00 . A A . 9 GLN OE1 1 1 13 6464 1 1 10 THR C C -8.045 2.679 6.531 1.00 . A A . 10 THR C 1 1 13 6465 1 1 10 THR CA C -7.882 1.226 7.002 1.00 . A A . 10 THR CA 1 1 13 6466 1 1 10 THR CB C -6.933 1.146 8.211 1.00 . A A . 10 THR CB 1 1 13 6467 1 1 10 THR CG2 C -7.612 1.705 9.452 1.00 . A A . 10 THR CG2 1 1 13 6468 1 1 10 THR H H -7.875 -0.620 5.913 1.00 . A A . 10 THR H 1 1 13 6469 1 1 10 THR HA H -8.863 0.900 7.346 1.00 . A A . 10 THR HA 1 1 13 6470 1 1 10 THR HB H -6.008 1.688 8.010 1.00 . A A . 10 THR HB 1 1 13 6471 1 1 10 THR HG1 H -6.009 -0.106 9.323 1.00 . A A . 10 THR HG1 1 1 13 6472 1 1 10 THR HG21 H -7.731 2.782 9.356 1.00 . A A . 10 THR HG21 1 1 13 6473 1 1 10 THR HG22 H -7.018 1.502 10.338 1.00 . A A . 10 THR HG22 1 1 13 6474 1 1 10 THR HG23 H -8.592 1.245 9.571 1.00 . A A . 10 THR HG23 1 1 13 6475 1 1 10 THR N N -7.478 0.313 5.904 1.00 . A A . 10 THR N 1 1 13 6476 1 1 10 THR O O -7.238 3.552 6.872 1.00 . A A . 10 THR O 1 1 13 6477 1 1 10 THR OG1 O -6.599 -0.178 8.549 1.00 . A A . 10 THR OG1 1 1 13 6478 1 1 11 CYS C C -9.587 5.271 5.431 1.00 . A A . 11 CYS C 1 1 13 6479 1 1 11 CYS CA C -8.948 4.076 4.709 1.00 . A A . 11 CYS CA 1 1 13 6480 1 1 11 CYS CB C -9.564 3.742 3.345 1.00 . A A . 11 CYS CB 1 1 13 6481 1 1 11 CYS H H -9.541 2.107 5.324 1.00 . A A . 11 CYS H 1 1 13 6482 1 1 11 CYS HA H -7.910 4.346 4.515 1.00 . A A . 11 CYS HA 1 1 13 6483 1 1 11 CYS HB2 H -9.343 2.700 3.132 1.00 . A A . 11 CYS HB2 1 1 13 6484 1 1 11 CYS HB3 H -10.648 3.867 3.379 1.00 . A A . 11 CYS HB3 1 1 13 6485 1 1 11 CYS N N -8.925 2.879 5.548 1.00 . A A . 11 CYS N 1 1 13 6486 1 1 11 CYS O O -10.778 5.547 5.294 1.00 . A A . 11 CYS O 1 1 13 6487 1 1 11 CYS SG S -8.872 4.703 1.975 1.00 . A A . 11 CYS SG 1 1 13 6488 1 1 12 ASP C C -8.987 8.386 6.038 1.00 . A A . 12 ASP C 1 1 13 6489 1 1 12 ASP CA C -9.085 7.163 6.970 1.00 . A A . 12 ASP CA 1 1 13 6490 1 1 12 ASP CB C -8.181 7.278 8.214 1.00 . A A . 12 ASP CB 1 1 13 6491 1 1 12 ASP CG C -8.539 6.247 9.293 1.00 . A A . 12 ASP CG 1 1 13 6492 1 1 12 ASP H H -7.879 5.498 6.441 1.00 . A A . 12 ASP H 1 1 13 6493 1 1 12 ASP HA H -10.121 7.133 7.312 1.00 . A A . 12 ASP HA 1 1 13 6494 1 1 12 ASP HB2 H -7.137 7.158 7.916 1.00 . A A . 12 ASP HB2 1 1 13 6495 1 1 12 ASP HB3 H -8.291 8.273 8.648 1.00 . A A . 12 ASP HB3 1 1 13 6496 1 1 12 ASP N N -8.797 5.894 6.302 1.00 . A A . 12 ASP N 1 1 13 6497 1 1 12 ASP O O -8.415 8.289 4.953 1.00 . A A . 12 ASP O 1 1 13 6498 1 1 12 ASP OD1 O -9.748 6.034 9.547 1.00 . A A . 12 ASP OD1 1 1 13 6499 1 1 12 ASP OD2 O -7.624 5.614 9.867 1.00 . A A . 12 ASP OD2 1 1 13 6500 1 1 13 SER C C -8.239 11.157 4.922 1.00 . A A . 13 SER C 1 1 13 6501 1 1 13 SER CA C -9.537 10.793 5.668 1.00 . A A . 13 SER CA 1 1 13 6502 1 1 13 SER CB C -9.996 11.941 6.582 1.00 . A A . 13 SER CB 1 1 13 6503 1 1 13 SER H H -9.957 9.556 7.367 1.00 . A A . 13 SER H 1 1 13 6504 1 1 13 SER HA H -10.302 10.663 4.904 1.00 . A A . 13 SER HA 1 1 13 6505 1 1 13 SER HB2 H -11.079 11.892 6.672 1.00 . A A . 13 SER HB2 1 1 13 6506 1 1 13 SER HB3 H -9.565 11.794 7.570 1.00 . A A . 13 SER HB3 1 1 13 6507 1 1 13 SER HG H -8.965 13.586 6.758 1.00 . A A . 13 SER HG 1 1 13 6508 1 1 13 SER N N -9.488 9.550 6.470 1.00 . A A . 13 SER N 1 1 13 6509 1 1 13 SER O O -8.290 11.579 3.764 1.00 . A A . 13 SER O 1 1 13 6510 1 1 13 SER OG O -9.639 13.237 6.128 1.00 . A A . 13 SER OG 1 1 13 6511 1 1 14 GLU C C -4.978 10.120 4.461 1.00 . A A . 14 GLU C 1 1 13 6512 1 1 14 GLU CA C -5.756 11.328 5.018 1.00 . A A . 14 GLU CA 1 1 13 6513 1 1 14 GLU CB C -4.933 12.061 6.096 1.00 . A A . 14 GLU CB 1 1 13 6514 1 1 14 GLU CD C -6.759 13.010 7.656 1.00 . A A . 14 GLU CD 1 1 13 6515 1 1 14 GLU CG C -5.628 13.312 6.661 1.00 . A A . 14 GLU CG 1 1 13 6516 1 1 14 GLU H H -7.120 10.716 6.538 1.00 . A A . 14 GLU H 1 1 13 6517 1 1 14 GLU HA H -5.889 12.016 4.182 1.00 . A A . 14 GLU HA 1 1 13 6518 1 1 14 GLU HB2 H -4.680 11.373 6.904 1.00 . A A . 14 GLU HB2 1 1 13 6519 1 1 14 GLU HB3 H -4.000 12.384 5.637 1.00 . A A . 14 GLU HB3 1 1 13 6520 1 1 14 GLU HG2 H -4.876 13.910 7.175 1.00 . A A . 14 GLU HG2 1 1 13 6521 1 1 14 GLU HG3 H -6.011 13.910 5.831 1.00 . A A . 14 GLU HG3 1 1 13 6522 1 1 14 GLU N N -7.079 10.976 5.558 1.00 . A A . 14 GLU N 1 1 13 6523 1 1 14 GLU O O -3.766 10.199 4.238 1.00 . A A . 14 GLU O 1 1 13 6524 1 1 14 GLU OE1 O -6.805 11.910 8.253 1.00 . A A . 14 GLU OE1 1 1 13 6525 1 1 14 GLU OE2 O -7.657 13.871 7.818 1.00 . A A . 14 GLU OE2 1 1 13 6526 1 1 15 ARG C C -4.665 7.568 2.524 1.00 . A A . 15 ARG C 1 1 13 6527 1 1 15 ARG CA C -4.910 7.700 4.028 1.00 . A A . 15 ARG CA 1 1 13 6528 1 1 15 ARG CB C -5.673 6.513 4.645 1.00 . A A . 15 ARG CB 1 1 13 6529 1 1 15 ARG CD C -4.472 4.476 3.783 1.00 . A A . 15 ARG CD 1 1 13 6530 1 1 15 ARG CG C -4.718 5.369 5.016 1.00 . A A . 15 ARG CG 1 1 13 6531 1 1 15 ARG CZ C -2.684 3.142 4.869 1.00 . A A . 15 ARG CZ 1 1 13 6532 1 1 15 ARG H H -6.623 8.917 4.497 1.00 . A A . 15 ARG H 1 1 13 6533 1 1 15 ARG HA H -3.944 7.758 4.522 1.00 . A A . 15 ARG HA 1 1 13 6534 1 1 15 ARG HB2 H -6.128 6.850 5.578 1.00 . A A . 15 ARG HB2 1 1 13 6535 1 1 15 ARG HB3 H -6.473 6.174 3.985 1.00 . A A . 15 ARG HB3 1 1 13 6536 1 1 15 ARG HD2 H -5.195 3.673 3.790 1.00 . A A . 15 ARG HD2 1 1 13 6537 1 1 15 ARG HD3 H -4.534 5.049 2.870 1.00 . A A . 15 ARG HD3 1 1 13 6538 1 1 15 ARG HE H -2.369 4.402 3.375 1.00 . A A . 15 ARG HE 1 1 13 6539 1 1 15 ARG HG2 H -3.786 5.787 5.397 1.00 . A A . 15 ARG HG2 1 1 13 6540 1 1 15 ARG HG3 H -5.167 4.767 5.804 1.00 . A A . 15 ARG HG3 1 1 13 6541 1 1 15 ARG HH11 H -4.484 2.536 5.532 1.00 . A A . 15 ARG HH11 1 1 13 6542 1 1 15 ARG HH12 H -3.073 1.967 6.420 1.00 . A A . 15 ARG HH12 1 1 13 6543 1 1 15 ARG HH21 H -0.697 3.251 4.440 1.00 . A A . 15 ARG HH21 1 1 13 6544 1 1 15 ARG HH22 H -1.155 2.293 5.820 1.00 . A A . 15 ARG HH22 1 1 13 6545 1 1 15 ARG N N -5.617 8.949 4.333 1.00 . A A . 15 ARG N 1 1 13 6546 1 1 15 ARG NE N -3.097 3.954 3.908 1.00 . A A . 15 ARG NE 1 1 13 6547 1 1 15 ARG NH1 N -3.482 2.529 5.684 1.00 . A A . 15 ARG NH1 1 1 13 6548 1 1 15 ARG NH2 N -1.425 2.907 5.058 1.00 . A A . 15 ARG NH2 1 1 13 6549 1 1 15 ARG O O -5.618 7.557 1.747 1.00 . A A . 15 ARG O 1 1 13 6550 1 1 16 LYS C C -3.694 5.987 0.021 1.00 . A A . 16 LYS C 1 1 13 6551 1 1 16 LYS CA C -3.001 7.175 0.697 1.00 . A A . 16 LYS CA 1 1 13 6552 1 1 16 LYS CB C -1.468 7.120 0.543 1.00 . A A . 16 LYS CB 1 1 13 6553 1 1 16 LYS CD C 0.630 5.697 0.845 1.00 . A A . 16 LYS CD 1 1 13 6554 1 1 16 LYS CE C 0.436 4.676 -0.287 1.00 . A A . 16 LYS CE 1 1 13 6555 1 1 16 LYS CG C -0.714 6.125 1.453 1.00 . A A . 16 LYS CG 1 1 13 6556 1 1 16 LYS H H -2.676 7.465 2.803 1.00 . A A . 16 LYS H 1 1 13 6557 1 1 16 LYS HA H -3.317 8.058 0.144 1.00 . A A . 16 LYS HA 1 1 13 6558 1 1 16 LYS HB2 H -1.255 6.894 -0.503 1.00 . A A . 16 LYS HB2 1 1 13 6559 1 1 16 LYS HB3 H -1.070 8.118 0.731 1.00 . A A . 16 LYS HB3 1 1 13 6560 1 1 16 LYS HD2 H 1.148 6.579 0.466 1.00 . A A . 16 LYS HD2 1 1 13 6561 1 1 16 LYS HD3 H 1.244 5.244 1.626 1.00 . A A . 16 LYS HD3 1 1 13 6562 1 1 16 LYS HE2 H 0.066 3.742 0.146 1.00 . A A . 16 LYS HE2 1 1 13 6563 1 1 16 LYS HE3 H -0.321 5.047 -0.982 1.00 . A A . 16 LYS HE3 1 1 13 6564 1 1 16 LYS HG2 H -0.526 6.606 2.412 1.00 . A A . 16 LYS HG2 1 1 13 6565 1 1 16 LYS HG3 H -1.311 5.235 1.644 1.00 . A A . 16 LYS HG3 1 1 13 6566 1 1 16 LYS HZ1 H 2.463 4.174 -0.400 1.00 . A A . 16 LYS HZ1 1 1 13 6567 1 1 16 LYS HZ2 H 2.022 5.274 -1.485 1.00 . A A . 16 LYS HZ2 1 1 13 6568 1 1 16 LYS HZ3 H 1.578 3.734 -1.757 1.00 . A A . 16 LYS HZ3 1 1 13 6569 1 1 16 LYS N N -3.406 7.362 2.107 1.00 . A A . 16 LYS N 1 1 13 6570 1 1 16 LYS NZ N 1.698 4.428 -1.022 1.00 . A A . 16 LYS NZ 1 1 13 6571 1 1 16 LYS O O -3.295 4.835 0.202 1.00 . A A . 16 LYS O 1 1 13 6572 1 1 17 CYS C C -4.664 4.526 -2.527 1.00 . A A . 17 CYS C 1 1 13 6573 1 1 17 CYS CA C -5.506 5.228 -1.445 1.00 . A A . 17 CYS CA 1 1 13 6574 1 1 17 CYS CB C -6.792 5.820 -2.028 1.00 . A A . 17 CYS CB 1 1 13 6575 1 1 17 CYS H H -5.055 7.224 -0.802 1.00 . A A . 17 CYS H 1 1 13 6576 1 1 17 CYS HA H -5.804 4.485 -0.706 1.00 . A A . 17 CYS HA 1 1 13 6577 1 1 17 CYS HB2 H -7.413 6.207 -1.217 1.00 . A A . 17 CYS HB2 1 1 13 6578 1 1 17 CYS HB3 H -6.525 6.656 -2.678 1.00 . A A . 17 CYS HB3 1 1 13 6579 1 1 17 CYS N N -4.743 6.263 -0.752 1.00 . A A . 17 CYS N 1 1 13 6580 1 1 17 CYS O O -3.936 5.176 -3.279 1.00 . A A . 17 CYS O 1 1 13 6581 1 1 17 CYS SG S -7.761 4.634 -3.005 1.00 . A A . 17 CYS SG 1 1 13 6582 1 1 18 CYS C C -4.324 2.600 -5.046 1.00 . A A . 18 CYS C 1 1 13 6583 1 1 18 CYS CA C -4.142 2.293 -3.547 1.00 . A A . 18 CYS CA 1 1 13 6584 1 1 18 CYS CB C -4.712 0.895 -3.269 1.00 . A A . 18 CYS CB 1 1 13 6585 1 1 18 CYS H H -5.439 2.774 -1.939 1.00 . A A . 18 CYS H 1 1 13 6586 1 1 18 CYS HA H -3.076 2.310 -3.313 1.00 . A A . 18 CYS HA 1 1 13 6587 1 1 18 CYS HB2 H -5.132 0.867 -2.266 1.00 . A A . 18 CYS HB2 1 1 13 6588 1 1 18 CYS HB3 H -5.537 0.713 -3.955 1.00 . A A . 18 CYS HB3 1 1 13 6589 1 1 18 CYS N N -4.846 3.207 -2.639 1.00 . A A . 18 CYS N 1 1 13 6590 1 1 18 CYS O O -3.480 2.249 -5.869 1.00 . A A . 18 CYS O 1 1 13 6591 1 1 18 CYS SG S -3.556 -0.485 -3.394 1.00 . A A . 18 CYS SG 1 1 13 6592 1 1 19 GLU C C -6.508 4.742 -7.102 1.00 . A A . 19 GLU C 1 1 13 6593 1 1 19 GLU CA C -5.924 3.350 -6.799 1.00 . A A . 19 GLU CA 1 1 13 6594 1 1 19 GLU CB C -7.003 2.291 -7.099 1.00 . A A . 19 GLU CB 1 1 13 6595 1 1 19 GLU CD C -7.644 -0.173 -7.395 1.00 . A A . 19 GLU CD 1 1 13 6596 1 1 19 GLU CG C -6.528 0.830 -7.057 1.00 . A A . 19 GLU CG 1 1 13 6597 1 1 19 GLU H H -6.124 3.390 -4.673 1.00 . A A . 19 GLU H 1 1 13 6598 1 1 19 GLU HA H -5.092 3.200 -7.489 1.00 . A A . 19 GLU HA 1 1 13 6599 1 1 19 GLU HB2 H -7.800 2.408 -6.366 1.00 . A A . 19 GLU HB2 1 1 13 6600 1 1 19 GLU HB3 H -7.410 2.489 -8.092 1.00 . A A . 19 GLU HB3 1 1 13 6601 1 1 19 GLU HG2 H -5.708 0.709 -7.766 1.00 . A A . 19 GLU HG2 1 1 13 6602 1 1 19 GLU HG3 H -6.149 0.601 -6.062 1.00 . A A . 19 GLU HG3 1 1 13 6603 1 1 19 GLU N N -5.468 3.189 -5.409 1.00 . A A . 19 GLU N 1 1 13 6604 1 1 19 GLU O O -6.537 5.148 -8.263 1.00 . A A . 19 GLU O 1 1 13 6605 1 1 19 GLU OE1 O -7.374 -1.396 -7.436 1.00 . A A . 19 GLU OE1 1 1 13 6606 1 1 19 GLU OE2 O -8.794 0.217 -7.679 1.00 . A A . 19 GLU OE2 1 1 13 6607 1 1 20 GLY C C -9.340 6.183 -6.405 1.00 . A A . 20 GLY C 1 1 13 6608 1 1 20 GLY CA C -7.881 6.625 -6.264 1.00 . A A . 20 GLY CA 1 1 13 6609 1 1 20 GLY H H -6.832 5.141 -5.156 1.00 . A A . 20 GLY H 1 1 13 6610 1 1 20 GLY HA2 H -7.792 7.287 -5.402 1.00 . A A . 20 GLY HA2 1 1 13 6611 1 1 20 GLY HA3 H -7.599 7.181 -7.158 1.00 . A A . 20 GLY HA3 1 1 13 6612 1 1 20 GLY N N -6.990 5.473 -6.092 1.00 . A A . 20 GLY N 1 1 13 6613 1 1 20 GLY O O -9.881 6.157 -7.509 1.00 . A A . 20 GLY O 1 1 13 6614 1 1 21 MET C C -12.013 5.622 -3.934 1.00 . A A . 21 MET C 1 1 13 6615 1 1 21 MET CA C -11.275 5.143 -5.198 1.00 . A A . 21 MET CA 1 1 13 6616 1 1 21 MET CB C -11.151 3.607 -5.190 1.00 . A A . 21 MET CB 1 1 13 6617 1 1 21 MET CE C -10.328 2.988 -9.156 1.00 . A A . 21 MET CE 1 1 13 6618 1 1 21 MET CG C -10.565 2.993 -6.460 1.00 . A A . 21 MET CG 1 1 13 6619 1 1 21 MET H H -9.456 5.880 -4.417 1.00 . A A . 21 MET H 1 1 13 6620 1 1 21 MET HA H -11.874 5.436 -6.059 1.00 . A A . 21 MET HA 1 1 13 6621 1 1 21 MET HB2 H -10.534 3.300 -4.347 1.00 . A A . 21 MET HB2 1 1 13 6622 1 1 21 MET HB3 H -12.138 3.186 -5.053 1.00 . A A . 21 MET HB3 1 1 13 6623 1 1 21 MET HE1 H -9.652 3.827 -8.997 1.00 . A A . 21 MET HE1 1 1 13 6624 1 1 21 MET HE2 H -9.769 2.058 -9.063 1.00 . A A . 21 MET HE2 1 1 13 6625 1 1 21 MET HE3 H -10.747 3.057 -10.156 1.00 . A A . 21 MET HE3 1 1 13 6626 1 1 21 MET HG2 H -9.642 3.515 -6.701 1.00 . A A . 21 MET HG2 1 1 13 6627 1 1 21 MET HG3 H -10.312 1.951 -6.258 1.00 . A A . 21 MET HG3 1 1 13 6628 1 1 21 MET N N -9.944 5.759 -5.292 1.00 . A A . 21 MET N 1 1 13 6629 1 1 21 MET O O -11.457 6.385 -3.139 1.00 . A A . 21 MET O 1 1 13 6630 1 1 21 MET SD S -11.645 3.026 -7.912 1.00 . A A . 21 MET SD 1 1 13 6631 1 1 22 VAL C C -13.333 4.919 -1.288 1.00 . A A . 22 VAL C 1 1 13 6632 1 1 22 VAL CA C -14.055 5.470 -2.524 1.00 . A A . 22 VAL CA 1 1 13 6633 1 1 22 VAL CB C -15.458 4.840 -2.660 1.00 . A A . 22 VAL CB 1 1 13 6634 1 1 22 VAL CG1 C -16.275 4.938 -1.367 1.00 . A A . 22 VAL CG1 1 1 13 6635 1 1 22 VAL CG2 C -16.253 5.546 -3.765 1.00 . A A . 22 VAL CG2 1 1 13 6636 1 1 22 VAL H H -13.659 4.554 -4.418 1.00 . A A . 22 VAL H 1 1 13 6637 1 1 22 VAL HA H -14.164 6.549 -2.420 1.00 . A A . 22 VAL HA 1 1 13 6638 1 1 22 VAL HB H -15.357 3.786 -2.923 1.00 . A A . 22 VAL HB 1 1 13 6639 1 1 22 VAL HG11 H -16.329 5.978 -1.051 1.00 . A A . 22 VAL HG11 1 1 13 6640 1 1 22 VAL HG12 H -17.285 4.562 -1.540 1.00 . A A . 22 VAL HG12 1 1 13 6641 1 1 22 VAL HG13 H -15.825 4.330 -0.582 1.00 . A A . 22 VAL HG13 1 1 13 6642 1 1 22 VAL HG21 H -16.399 6.596 -3.511 1.00 . A A . 22 VAL HG21 1 1 13 6643 1 1 22 VAL HG22 H -15.722 5.485 -4.714 1.00 . A A . 22 VAL HG22 1 1 13 6644 1 1 22 VAL HG23 H -17.227 5.068 -3.879 1.00 . A A . 22 VAL HG23 1 1 13 6645 1 1 22 VAL N N -13.256 5.175 -3.729 1.00 . A A . 22 VAL N 1 1 13 6646 1 1 22 VAL O O -13.050 3.725 -1.242 1.00 . A A . 22 VAL O 1 1 13 6647 1 1 23 CYS C C -12.968 5.710 2.193 1.00 . A A . 23 CYS C 1 1 13 6648 1 1 23 CYS CA C -12.207 5.544 0.862 1.00 . A A . 23 CYS CA 1 1 13 6649 1 1 23 CYS CB C -11.017 6.508 0.731 1.00 . A A . 23 CYS CB 1 1 13 6650 1 1 23 CYS H H -13.382 6.734 -0.432 1.00 . A A . 23 CYS H 1 1 13 6651 1 1 23 CYS HA H -11.807 4.535 0.817 1.00 . A A . 23 CYS HA 1 1 13 6652 1 1 23 CYS HB2 H -10.500 6.297 -0.205 1.00 . A A . 23 CYS HB2 1 1 13 6653 1 1 23 CYS HB3 H -11.411 7.523 0.659 1.00 . A A . 23 CYS HB3 1 1 13 6654 1 1 23 CYS N N -13.088 5.780 -0.291 1.00 . A A . 23 CYS N 1 1 13 6655 1 1 23 CYS O O -13.174 6.839 2.646 1.00 . A A . 23 CYS O 1 1 13 6656 1 1 23 CYS SG S -9.784 6.516 2.066 1.00 . A A . 23 CYS SG 1 1 13 6657 1 1 24 ARG C C -14.087 3.118 4.610 1.00 . A A . 24 ARG C 1 1 13 6658 1 1 24 ARG CA C -14.266 4.512 4.002 1.00 . A A . 24 ARG CA 1 1 13 6659 1 1 24 ARG CB C -15.780 4.761 3.804 1.00 . A A . 24 ARG CB 1 1 13 6660 1 1 24 ARG CD C -16.264 6.223 1.850 1.00 . A A . 24 ARG CD 1 1 13 6661 1 1 24 ARG CG C -16.205 6.181 3.388 1.00 . A A . 24 ARG CG 1 1 13 6662 1 1 24 ARG CZ C -17.888 7.785 0.841 1.00 . A A . 24 ARG CZ 1 1 13 6663 1 1 24 ARG H H -13.316 3.728 2.248 1.00 . A A . 24 ARG H 1 1 13 6664 1 1 24 ARG HA H -13.884 5.248 4.715 1.00 . A A . 24 ARG HA 1 1 13 6665 1 1 24 ARG HB2 H -16.185 4.030 3.101 1.00 . A A . 24 ARG HB2 1 1 13 6666 1 1 24 ARG HB3 H -16.262 4.562 4.763 1.00 . A A . 24 ARG HB3 1 1 13 6667 1 1 24 ARG HD2 H -15.289 6.096 1.420 1.00 . A A . 24 ARG HD2 1 1 13 6668 1 1 24 ARG HD3 H -16.927 5.444 1.513 1.00 . A A . 24 ARG HD3 1 1 13 6669 1 1 24 ARG HE H -16.237 8.364 1.802 1.00 . A A . 24 ARG HE 1 1 13 6670 1 1 24 ARG HG2 H -17.205 6.372 3.780 1.00 . A A . 24 ARG HG2 1 1 13 6671 1 1 24 ARG HG3 H -15.518 6.926 3.791 1.00 . A A . 24 ARG HG3 1 1 13 6672 1 1 24 ARG HH11 H -18.380 5.863 0.488 1.00 . A A . 24 ARG HH11 1 1 13 6673 1 1 24 ARG HH12 H -19.462 7.050 -0.177 1.00 . A A . 24 ARG HH12 1 1 13 6674 1 1 24 ARG HH21 H -17.802 9.751 1.131 1.00 . A A . 24 ARG HH21 1 1 13 6675 1 1 24 ARG HH22 H -19.260 9.171 0.368 1.00 . A A . 24 ARG HH22 1 1 13 6676 1 1 24 ARG N N -13.504 4.603 2.734 1.00 . A A . 24 ARG N 1 1 13 6677 1 1 24 ARG NE N -16.764 7.556 1.496 1.00 . A A . 24 ARG NE 1 1 13 6678 1 1 24 ARG NH1 N -18.614 6.837 0.333 1.00 . A A . 24 ARG NH1 1 1 13 6679 1 1 24 ARG NH2 N -18.315 8.997 0.685 1.00 . A A . 24 ARG NH2 1 1 13 6680 1 1 24 ARG O O -14.576 2.150 4.035 1.00 . A A . 24 ARG O 1 1 13 6681 1 1 25 LEU C C -11.717 1.060 5.249 1.00 . A A . 25 LEU C 1 1 13 6682 1 1 25 LEU CA C -12.673 1.765 6.233 1.00 . A A . 25 LEU CA 1 1 13 6683 1 1 25 LEU CB C -13.706 0.765 6.796 1.00 . A A . 25 LEU CB 1 1 13 6684 1 1 25 LEU CD1 C -15.558 2.181 7.864 1.00 . A A . 25 LEU CD1 1 1 13 6685 1 1 25 LEU CD2 C -15.003 -0.043 8.778 1.00 . A A . 25 LEU CD2 1 1 13 6686 1 1 25 LEU CG C -14.412 1.194 8.097 1.00 . A A . 25 LEU CG 1 1 13 6687 1 1 25 LEU H H -13.042 3.859 6.145 1.00 . A A . 25 LEU H 1 1 13 6688 1 1 25 LEU HA H -12.045 2.073 7.071 1.00 . A A . 25 LEU HA 1 1 13 6689 1 1 25 LEU HB2 H -14.449 0.516 6.038 1.00 . A A . 25 LEU HB2 1 1 13 6690 1 1 25 LEU HB3 H -13.158 -0.153 7.015 1.00 . A A . 25 LEU HB3 1 1 13 6691 1 1 25 LEU HD11 H -16.057 2.384 8.812 1.00 . A A . 25 LEU HD11 1 1 13 6692 1 1 25 LEU HD12 H -16.266 1.767 7.147 1.00 . A A . 25 LEU HD12 1 1 13 6693 1 1 25 LEU HD13 H -15.169 3.125 7.489 1.00 . A A . 25 LEU HD13 1 1 13 6694 1 1 25 LEU HD21 H -15.738 -0.520 8.130 1.00 . A A . 25 LEU HD21 1 1 13 6695 1 1 25 LEU HD22 H -15.477 0.247 9.715 1.00 . A A . 25 LEU HD22 1 1 13 6696 1 1 25 LEU HD23 H -14.209 -0.754 9.010 1.00 . A A . 25 LEU HD23 1 1 13 6697 1 1 25 LEU HG H -13.685 1.644 8.772 1.00 . A A . 25 LEU HG 1 1 13 6698 1 1 25 LEU N N -13.311 2.992 5.692 1.00 . A A . 25 LEU N 1 1 13 6699 1 1 25 LEU O O -10.655 0.576 5.631 1.00 . A A . 25 LEU O 1 1 13 6700 1 1 26 TRP C C -11.264 1.470 1.646 1.00 . A A . 26 TRP C 1 1 13 6701 1 1 26 TRP CA C -11.241 0.541 2.859 1.00 . A A . 26 TRP CA 1 1 13 6702 1 1 26 TRP CB C -11.753 -0.873 2.546 1.00 . A A . 26 TRP CB 1 1 13 6703 1 1 26 TRP CD1 C -13.631 -1.803 3.960 1.00 . A A . 26 TRP CD1 1 1 13 6704 1 1 26 TRP CD2 C -14.425 -0.643 2.219 1.00 . A A . 26 TRP CD2 1 1 13 6705 1 1 26 TRP CE2 C -15.552 -1.121 2.957 1.00 . A A . 26 TRP CE2 1 1 13 6706 1 1 26 TRP CE3 C -14.708 0.223 1.137 1.00 . A A . 26 TRP CE3 1 1 13 6707 1 1 26 TRP CG C -13.203 -1.175 2.840 1.00 . A A . 26 TRP CG 1 1 13 6708 1 1 26 TRP CH2 C -17.117 0.024 1.504 1.00 . A A . 26 TRP CH2 1 1 13 6709 1 1 26 TRP CZ2 C -16.875 -0.818 2.602 1.00 . A A . 26 TRP CZ2 1 1 13 6710 1 1 26 TRP CZ3 C -16.032 0.554 0.783 1.00 . A A . 26 TRP CZ3 1 1 13 6711 1 1 26 TRP H H -12.930 1.453 3.716 1.00 . A A . 26 TRP H 1 1 13 6712 1 1 26 TRP HA H -10.199 0.456 3.165 1.00 . A A . 26 TRP HA 1 1 13 6713 1 1 26 TRP HB2 H -11.520 -1.136 1.517 1.00 . A A . 26 TRP HB2 1 1 13 6714 1 1 26 TRP HB3 H -11.170 -1.542 3.175 1.00 . A A . 26 TRP HB3 1 1 13 6715 1 1 26 TRP HD1 H -12.982 -2.215 4.723 1.00 . A A . 26 TRP HD1 1 1 13 6716 1 1 26 TRP HE1 H -15.533 -2.292 4.748 1.00 . A A . 26 TRP HE1 1 1 13 6717 1 1 26 TRP HE3 H -13.892 0.668 0.590 1.00 . A A . 26 TRP HE3 1 1 13 6718 1 1 26 TRP HH2 H -18.132 0.294 1.240 1.00 . A A . 26 TRP HH2 1 1 13 6719 1 1 26 TRP HZ2 H -17.696 -1.196 3.194 1.00 . A A . 26 TRP HZ2 1 1 13 6720 1 1 26 TRP HZ3 H -16.211 1.251 -0.026 1.00 . A A . 26 TRP HZ3 1 1 13 6721 1 1 26 TRP N N -12.007 1.105 3.958 1.00 . A A . 26 TRP N 1 1 13 6722 1 1 26 TRP NE1 N -15.008 -1.850 3.990 1.00 . A A . 26 TRP NE1 1 1 13 6723 1 1 26 TRP O O -12.172 2.290 1.535 1.00 . A A . 26 TRP O 1 1 13 6724 1 1 27 CYS C C -10.834 0.940 -1.580 1.00 . A A . 27 CYS C 1 1 13 6725 1 1 27 CYS CA C -10.379 1.997 -0.572 1.00 . A A . 27 CYS CA 1 1 13 6726 1 1 27 CYS CB C -9.073 2.694 -0.976 1.00 . A A . 27 CYS CB 1 1 13 6727 1 1 27 CYS H H -9.588 0.641 0.853 1.00 . A A . 27 CYS H 1 1 13 6728 1 1 27 CYS HA H -11.129 2.774 -0.519 1.00 . A A . 27 CYS HA 1 1 13 6729 1 1 27 CYS HB2 H -8.497 2.954 -0.091 1.00 . A A . 27 CYS HB2 1 1 13 6730 1 1 27 CYS HB3 H -8.472 2.018 -1.585 1.00 . A A . 27 CYS HB3 1 1 13 6731 1 1 27 CYS N N -10.286 1.358 0.741 1.00 . A A . 27 CYS N 1 1 13 6732 1 1 27 CYS O O -10.154 -0.081 -1.683 1.00 . A A . 27 CYS O 1 1 13 6733 1 1 27 CYS SG S -9.413 4.212 -1.902 1.00 . A A . 27 CYS SG 1 1 13 6734 1 1 28 LYS C C -13.156 0.385 -4.395 1.00 . A A . 28 LYS C 1 1 13 6735 1 1 28 LYS CA C -12.629 0.015 -3.007 1.00 . A A . 28 LYS CA 1 1 13 6736 1 1 28 LYS CB C -13.700 -0.718 -2.187 1.00 . A A . 28 LYS CB 1 1 13 6737 1 1 28 LYS CD C -12.313 -2.837 -1.632 1.00 . A A . 28 LYS CD 1 1 13 6738 1 1 28 LYS CE C -12.131 -3.908 -0.549 1.00 . A A . 28 LYS CE 1 1 13 6739 1 1 28 LYS CG C -13.158 -1.667 -1.101 1.00 . A A . 28 LYS CG 1 1 13 6740 1 1 28 LYS H H -12.526 1.957 -2.059 1.00 . A A . 28 LYS H 1 1 13 6741 1 1 28 LYS HA H -11.848 -0.713 -3.215 1.00 . A A . 28 LYS HA 1 1 13 6742 1 1 28 LYS HB2 H -14.355 0.022 -1.728 1.00 . A A . 28 LYS HB2 1 1 13 6743 1 1 28 LYS HB3 H -14.311 -1.308 -2.869 1.00 . A A . 28 LYS HB3 1 1 13 6744 1 1 28 LYS HD2 H -12.807 -3.283 -2.494 1.00 . A A . 28 LYS HD2 1 1 13 6745 1 1 28 LYS HD3 H -11.335 -2.475 -1.943 1.00 . A A . 28 LYS HD3 1 1 13 6746 1 1 28 LYS HE2 H -11.624 -3.465 0.311 1.00 . A A . 28 LYS HE2 1 1 13 6747 1 1 28 LYS HE3 H -13.117 -4.260 -0.231 1.00 . A A . 28 LYS HE3 1 1 13 6748 1 1 28 LYS HG2 H -12.560 -1.091 -0.400 1.00 . A A . 28 LYS HG2 1 1 13 6749 1 1 28 LYS HG3 H -14.012 -2.077 -0.562 1.00 . A A . 28 LYS HG3 1 1 13 6750 1 1 28 LYS HZ1 H -11.810 -5.491 -1.854 1.00 . A A . 28 LYS HZ1 1 1 13 6751 1 1 28 LYS HZ2 H -11.241 -5.795 -0.372 1.00 . A A . 28 LYS HZ2 1 1 13 6752 1 1 28 LYS HZ3 H -10.423 -4.760 -1.372 1.00 . A A . 28 LYS HZ3 1 1 13 6753 1 1 28 LYS N N -11.999 1.101 -2.227 1.00 . A A . 28 LYS N 1 1 13 6754 1 1 28 LYS NZ N -11.346 -5.053 -1.063 1.00 . A A . 28 LYS NZ 1 1 13 6755 1 1 28 LYS O O -13.712 1.450 -4.645 1.00 . A A . 28 LYS O 1 1 13 6756 1 1 29 LYS C C -14.372 -0.404 -7.353 1.00 . A A . 29 LYS C 1 1 13 6757 1 1 29 LYS CA C -12.955 -0.459 -6.763 1.00 . A A . 29 LYS CA 1 1 13 6758 1 1 29 LYS CB C -12.112 -1.644 -7.270 1.00 . A A . 29 LYS CB 1 1 13 6759 1 1 29 LYS CD C -10.824 -2.808 -9.066 1.00 . A A . 29 LYS CD 1 1 13 6760 1 1 29 LYS CE C -9.820 -2.589 -10.200 1.00 . A A . 29 LYS CE 1 1 13 6761 1 1 29 LYS CG C -11.693 -1.574 -8.743 1.00 . A A . 29 LYS CG 1 1 13 6762 1 1 29 LYS H H -12.574 -1.434 -4.936 1.00 . A A . 29 LYS H 1 1 13 6763 1 1 29 LYS HA H -12.441 0.461 -7.045 1.00 . A A . 29 LYS HA 1 1 13 6764 1 1 29 LYS HB2 H -11.194 -1.674 -6.679 1.00 . A A . 29 LYS HB2 1 1 13 6765 1 1 29 LYS HB3 H -12.652 -2.575 -7.095 1.00 . A A . 29 LYS HB3 1 1 13 6766 1 1 29 LYS HD2 H -10.253 -3.101 -8.184 1.00 . A A . 29 LYS HD2 1 1 13 6767 1 1 29 LYS HD3 H -11.481 -3.639 -9.326 1.00 . A A . 29 LYS HD3 1 1 13 6768 1 1 29 LYS HE2 H -9.291 -3.529 -10.379 1.00 . A A . 29 LYS HE2 1 1 13 6769 1 1 29 LYS HE3 H -10.357 -2.321 -11.115 1.00 . A A . 29 LYS HE3 1 1 13 6770 1 1 29 LYS HG2 H -12.566 -1.557 -9.394 1.00 . A A . 29 LYS HG2 1 1 13 6771 1 1 29 LYS HG3 H -11.133 -0.653 -8.895 1.00 . A A . 29 LYS HG3 1 1 13 6772 1 1 29 LYS HZ1 H -8.085 -1.482 -10.527 1.00 . A A . 29 LYS HZ1 1 1 13 6773 1 1 29 LYS HZ2 H -8.456 -1.614 -8.916 1.00 . A A . 29 LYS HZ2 1 1 13 6774 1 1 29 LYS HZ3 H -9.292 -0.613 -9.880 1.00 . A A . 29 LYS HZ3 1 1 13 6775 1 1 29 LYS N N -12.947 -0.572 -5.301 1.00 . A A . 29 LYS N 1 1 13 6776 1 1 29 LYS NZ N -8.846 -1.529 -9.858 1.00 . A A . 29 LYS NZ 1 1 13 6777 1 1 29 LYS O O -14.897 -1.411 -7.839 1.00 . A A . 29 LYS O 1 1 13 6778 1 1 30 LYS C C -16.190 1.567 -9.400 1.00 . A A . 30 LYS C 1 1 13 6779 1 1 30 LYS CA C -16.299 1.044 -7.959 1.00 . A A . 30 LYS CA 1 1 13 6780 1 1 30 LYS CB C -17.159 1.992 -7.104 1.00 . A A . 30 LYS CB 1 1 13 6781 1 1 30 LYS CD C -17.841 4.460 -7.065 1.00 . A A . 30 LYS CD 1 1 13 6782 1 1 30 LYS CE C -18.296 4.910 -8.464 1.00 . A A . 30 LYS CE 1 1 13 6783 1 1 30 LYS CG C -16.680 3.453 -7.077 1.00 . A A . 30 LYS CG 1 1 13 6784 1 1 30 LYS H H -14.573 1.506 -6.741 1.00 . A A . 30 LYS H 1 1 13 6785 1 1 30 LYS HA H -16.850 0.103 -8.028 1.00 . A A . 30 LYS HA 1 1 13 6786 1 1 30 LYS HB2 H -18.181 1.944 -7.482 1.00 . A A . 30 LYS HB2 1 1 13 6787 1 1 30 LYS HB3 H -17.183 1.632 -6.077 1.00 . A A . 30 LYS HB3 1 1 13 6788 1 1 30 LYS HD2 H -18.685 4.063 -6.499 1.00 . A A . 30 LYS HD2 1 1 13 6789 1 1 30 LYS HD3 H -17.494 5.354 -6.546 1.00 . A A . 30 LYS HD3 1 1 13 6790 1 1 30 LYS HE2 H -18.973 5.757 -8.337 1.00 . A A . 30 LYS HE2 1 1 13 6791 1 1 30 LYS HE3 H -17.425 5.274 -9.010 1.00 . A A . 30 LYS HE3 1 1 13 6792 1 1 30 LYS HG2 H -16.081 3.588 -6.176 1.00 . A A . 30 LYS HG2 1 1 13 6793 1 1 30 LYS HG3 H -16.040 3.675 -7.929 1.00 . A A . 30 LYS HG3 1 1 13 6794 1 1 30 LYS HZ1 H -19.809 3.506 -8.787 1.00 . A A . 30 LYS HZ1 1 1 13 6795 1 1 30 LYS HZ2 H -18.379 3.093 -9.495 1.00 . A A . 30 LYS HZ2 1 1 13 6796 1 1 30 LYS HZ3 H -19.306 4.245 -10.160 1.00 . A A . 30 LYS HZ3 1 1 13 6797 1 1 30 LYS N N -15.003 0.775 -7.300 1.00 . A A . 30 LYS N 1 1 13 6798 1 1 30 LYS NZ N -18.989 3.871 -9.266 1.00 . A A . 30 LYS NZ 1 1 13 6799 1 1 30 LYS O O -17.226 1.830 -10.005 1.00 . A A . 30 LYS O 1 1 13 6800 1 1 31 LEU C C -14.846 1.329 -12.322 1.00 . A A . 31 LEU C 1 1 13 6801 1 1 31 LEU CA C -14.777 2.415 -11.240 1.00 . A A . 31 LEU CA 1 1 13 6802 1 1 31 LEU CB C -13.444 3.181 -11.258 1.00 . A A . 31 LEU CB 1 1 13 6803 1 1 31 LEU CD1 C -12.428 5.237 -12.307 1.00 . A A . 31 LEU CD1 1 1 13 6804 1 1 31 LEU CD2 C -12.302 3.112 -13.544 1.00 . A A . 31 LEU CD2 1 1 13 6805 1 1 31 LEU CG C -13.169 3.928 -12.581 1.00 . A A . 31 LEU CG 1 1 13 6806 1 1 31 LEU H H -14.175 1.678 -9.331 1.00 . A A . 31 LEU H 1 1 13 6807 1 1 31 LEU HA H -15.572 3.136 -11.440 1.00 . A A . 31 LEU HA 1 1 13 6808 1 1 31 LEU HB2 H -13.476 3.904 -10.442 1.00 . A A . 31 LEU HB2 1 1 13 6809 1 1 31 LEU HB3 H -12.632 2.483 -11.057 1.00 . A A . 31 LEU HB3 1 1 13 6810 1 1 31 LEU HD11 H -11.457 5.035 -11.856 1.00 . A A . 31 LEU HD11 1 1 13 6811 1 1 31 LEU HD12 H -13.026 5.870 -11.653 1.00 . A A . 31 LEU HD12 1 1 13 6812 1 1 31 LEU HD13 H -12.279 5.766 -13.248 1.00 . A A . 31 LEU HD13 1 1 13 6813 1 1 31 LEU HD21 H -12.117 3.689 -14.450 1.00 . A A . 31 LEU HD21 1 1 13 6814 1 1 31 LEU HD22 H -12.813 2.197 -13.835 1.00 . A A . 31 LEU HD22 1 1 13 6815 1 1 31 LEU HD23 H -11.349 2.864 -13.079 1.00 . A A . 31 LEU HD23 1 1 13 6816 1 1 31 LEU HG H -14.113 4.177 -13.064 1.00 . A A . 31 LEU HG 1 1 13 6817 1 1 31 LEU N N -14.985 1.852 -9.901 1.00 . A A . 31 LEU N 1 1 13 6818 1 1 31 LEU O O -14.076 0.367 -12.289 1.00 . A A . 31 LEU O 1 1 13 6819 1 1 32 LEU C C -16.567 1.231 -15.615 1.00 . A A . 32 LEU C 1 1 13 6820 1 1 32 LEU CA C -15.889 0.557 -14.418 1.00 . A A . 32 LEU CA 1 1 13 6821 1 1 32 LEU CB C -16.706 -0.679 -13.931 1.00 . A A . 32 LEU CB 1 1 13 6822 1 1 32 LEU CD1 C -18.895 -1.805 -13.475 1.00 . A A . 32 LEU CD1 1 1 13 6823 1 1 32 LEU CD2 C -18.621 0.494 -12.626 1.00 . A A . 32 LEU CD2 1 1 13 6824 1 1 32 LEU CG C -18.233 -0.451 -13.771 1.00 . A A . 32 LEU CG 1 1 13 6825 1 1 32 LEU H H -16.304 2.333 -13.305 1.00 . A A . 32 LEU H 1 1 13 6826 1 1 32 LEU HA H -14.916 0.211 -14.737 1.00 . A A . 32 LEU HA 1 1 13 6827 1 1 32 LEU HB2 H -16.557 -1.462 -14.674 1.00 . A A . 32 LEU HB2 1 1 13 6828 1 1 32 LEU HB3 H -16.289 -1.043 -12.991 1.00 . A A . 32 LEU HB3 1 1 13 6829 1 1 32 LEU HD11 H -18.512 -2.220 -12.542 1.00 . A A . 32 LEU HD11 1 1 13 6830 1 1 32 LEU HD12 H -18.699 -2.507 -14.284 1.00 . A A . 32 LEU HD12 1 1 13 6831 1 1 32 LEU HD13 H -19.975 -1.681 -13.388 1.00 . A A . 32 LEU HD13 1 1 13 6832 1 1 32 LEU HD21 H -18.253 1.500 -12.810 1.00 . A A . 32 LEU HD21 1 1 13 6833 1 1 32 LEU HD22 H -18.215 0.124 -11.684 1.00 . A A . 32 LEU HD22 1 1 13 6834 1 1 32 LEU HD23 H -19.706 0.554 -12.544 1.00 . A A . 32 LEU HD23 1 1 13 6835 1 1 32 LEU HG H -18.663 -0.079 -14.702 1.00 . A A . 32 LEU HG 1 1 13 6836 1 1 32 LEU N N -15.716 1.509 -13.309 1.00 . A A . 32 LEU N 1 1 13 6837 1 1 32 LEU O O -17.454 2.044 -15.495 1.00 . A A . 32 LEU O 1 1 13 6838 1 1 32 LEU OXT O -16.260 0.935 -16.585 1.00 . A A . 32 LEU OXT 1 1 14 6839 1 1 1 GLY C C 1.412 -4.850 1.225 1.00 . A A . 1 GLY C 1 1 14 6840 1 1 1 GLY CA C 1.960 -5.852 2.230 1.00 . A A . 1 GLY CA 1 1 14 6841 1 1 1 GLY H1 H 2.726 -4.379 3.430 1.00 . A A . 1 GLY H1 1 1 14 6842 1 1 1 GLY H2 H 1.271 -4.954 3.939 1.00 . A A . 1 GLY H2 1 1 14 6843 1 1 1 GLY H3 H 2.647 -5.847 4.163 1.00 . A A . 1 GLY H3 1 1 14 6844 1 1 1 GLY HA2 H 2.917 -6.224 1.868 1.00 . A A . 1 GLY HA2 1 1 14 6845 1 1 1 GLY HA3 H 1.264 -6.682 2.330 1.00 . A A . 1 GLY HA3 1 1 14 6846 1 1 1 GLY N N 2.164 -5.214 3.539 1.00 . A A . 1 GLY N 1 1 14 6847 1 1 1 GLY O O 0.681 -3.941 1.622 1.00 . A A . 1 GLY O 1 1 14 6848 1 1 2 PRO C C 0.037 -3.888 -1.554 1.00 . A A . 2 PRO C 1 1 14 6849 1 1 2 PRO CA C 1.495 -3.935 -1.070 1.00 . A A . 2 PRO CA 1 1 14 6850 1 1 2 PRO CB C 2.451 -4.260 -2.221 1.00 . A A . 2 PRO CB 1 1 14 6851 1 1 2 PRO CD C 2.586 -6.029 -0.631 1.00 . A A . 2 PRO CD 1 1 14 6852 1 1 2 PRO CG C 2.621 -5.774 -2.134 1.00 . A A . 2 PRO CG 1 1 14 6853 1 1 2 PRO HA H 1.750 -2.954 -0.668 1.00 . A A . 2 PRO HA 1 1 14 6854 1 1 2 PRO HB2 H 2.046 -3.965 -3.188 1.00 . A A . 2 PRO HB2 1 1 14 6855 1 1 2 PRO HB3 H 3.413 -3.774 -2.047 1.00 . A A . 2 PRO HB3 1 1 14 6856 1 1 2 PRO HD2 H 2.169 -7.015 -0.421 1.00 . A A . 2 PRO HD2 1 1 14 6857 1 1 2 PRO HD3 H 3.599 -5.956 -0.238 1.00 . A A . 2 PRO HD3 1 1 14 6858 1 1 2 PRO HG2 H 1.774 -6.269 -2.610 1.00 . A A . 2 PRO HG2 1 1 14 6859 1 1 2 PRO HG3 H 3.562 -6.101 -2.576 1.00 . A A . 2 PRO HG3 1 1 14 6860 1 1 2 PRO N N 1.764 -4.967 -0.067 1.00 . A A . 2 PRO N 1 1 14 6861 1 1 2 PRO O O -0.411 -2.847 -2.028 1.00 . A A . 2 PRO O 1 1 14 6862 1 1 3 TYR C C -3.258 -4.406 -1.328 1.00 . A A . 3 TYR C 1 1 14 6863 1 1 3 TYR CA C -2.070 -5.143 -1.982 1.00 . A A . 3 TYR CA 1 1 14 6864 1 1 3 TYR CB C -2.306 -6.608 -2.378 1.00 . A A . 3 TYR CB 1 1 14 6865 1 1 3 TYR CD1 C -0.482 -7.895 -3.581 1.00 . A A . 3 TYR CD1 1 1 14 6866 1 1 3 TYR CD2 C -2.227 -6.805 -4.893 1.00 . A A . 3 TYR CD2 1 1 14 6867 1 1 3 TYR CE1 C 0.054 -8.450 -4.760 1.00 . A A . 3 TYR CE1 1 1 14 6868 1 1 3 TYR CE2 C -1.691 -7.361 -6.069 1.00 . A A . 3 TYR CE2 1 1 14 6869 1 1 3 TYR CG C -1.628 -7.078 -3.648 1.00 . A A . 3 TYR CG 1 1 14 6870 1 1 3 TYR CZ C -0.554 -8.190 -6.006 1.00 . A A . 3 TYR CZ 1 1 14 6871 1 1 3 TYR H H -0.369 -5.737 -0.850 1.00 . A A . 3 TYR H 1 1 14 6872 1 1 3 TYR HA H -2.010 -4.636 -2.945 1.00 . A A . 3 TYR HA 1 1 14 6873 1 1 3 TYR HB2 H -1.991 -7.246 -1.555 1.00 . A A . 3 TYR HB2 1 1 14 6874 1 1 3 TYR HB3 H -3.369 -6.773 -2.527 1.00 . A A . 3 TYR HB3 1 1 14 6875 1 1 3 TYR HD1 H -0.045 -8.143 -2.622 1.00 . A A . 3 TYR HD1 1 1 14 6876 1 1 3 TYR HD2 H -3.121 -6.197 -4.946 1.00 . A A . 3 TYR HD2 1 1 14 6877 1 1 3 TYR HE1 H 0.908 -9.107 -4.711 1.00 . A A . 3 TYR HE1 1 1 14 6878 1 1 3 TYR HE2 H -2.158 -7.182 -7.027 1.00 . A A . 3 TYR HE2 1 1 14 6879 1 1 3 TYR HH H 0.628 -9.408 -6.961 1.00 . A A . 3 TYR HH 1 1 14 6880 1 1 3 TYR N N -0.737 -4.963 -1.392 1.00 . A A . 3 TYR N 1 1 14 6881 1 1 3 TYR O O -4.297 -4.999 -1.040 1.00 . A A . 3 TYR O 1 1 14 6882 1 1 3 TYR OH O -0.076 -8.756 -7.140 1.00 . A A . 3 TYR OH 1 1 14 6883 1 1 4 CYS C C -5.452 -2.443 -0.351 1.00 . A A . 4 CYS C 1 1 14 6884 1 1 4 CYS CA C -3.926 -2.232 -0.227 1.00 . A A . 4 CYS CA 1 1 14 6885 1 1 4 CYS CB C -3.534 -0.771 -0.548 1.00 . A A . 4 CYS CB 1 1 14 6886 1 1 4 CYS H H -2.174 -2.732 -1.302 1.00 . A A . 4 CYS H 1 1 14 6887 1 1 4 CYS HA H -3.679 -2.413 0.820 1.00 . A A . 4 CYS HA 1 1 14 6888 1 1 4 CYS HB2 H -4.377 -0.115 -0.334 1.00 . A A . 4 CYS HB2 1 1 14 6889 1 1 4 CYS HB3 H -2.750 -0.496 0.159 1.00 . A A . 4 CYS HB3 1 1 14 6890 1 1 4 CYS N N -3.074 -3.117 -1.033 1.00 . A A . 4 CYS N 1 1 14 6891 1 1 4 CYS O O -6.160 -2.562 0.653 1.00 . A A . 4 CYS O 1 1 14 6892 1 1 4 CYS SG S -2.882 -0.343 -2.201 1.00 . A A . 4 CYS SG 1 1 14 6893 1 1 5 GLN C C -7.937 -4.087 -1.473 1.00 . A A . 5 GLN C 1 1 14 6894 1 1 5 GLN CA C -7.398 -2.694 -1.870 1.00 . A A . 5 GLN CA 1 1 14 6895 1 1 5 GLN CB C -7.581 -2.336 -3.357 1.00 . A A . 5 GLN CB 1 1 14 6896 1 1 5 GLN CD C -8.882 -3.951 -4.828 1.00 . A A . 5 GLN CD 1 1 14 6897 1 1 5 GLN CG C -8.937 -2.686 -3.986 1.00 . A A . 5 GLN CG 1 1 14 6898 1 1 5 GLN H H -5.339 -2.393 -2.354 1.00 . A A . 5 GLN H 1 1 14 6899 1 1 5 GLN HA H -7.962 -1.967 -1.285 1.00 . A A . 5 GLN HA 1 1 14 6900 1 1 5 GLN HB2 H -7.447 -1.258 -3.448 1.00 . A A . 5 GLN HB2 1 1 14 6901 1 1 5 GLN HB3 H -6.784 -2.803 -3.939 1.00 . A A . 5 GLN HB3 1 1 14 6902 1 1 5 GLN HE21 H -7.756 -3.058 -6.276 1.00 . A A . 5 GLN HE21 1 1 14 6903 1 1 5 GLN HE22 H -8.103 -4.762 -6.501 1.00 . A A . 5 GLN HE22 1 1 14 6904 1 1 5 GLN HG2 H -9.701 -2.788 -3.216 1.00 . A A . 5 GLN HG2 1 1 14 6905 1 1 5 GLN HG3 H -9.230 -1.870 -4.646 1.00 . A A . 5 GLN HG3 1 1 14 6906 1 1 5 GLN N N -5.971 -2.520 -1.576 1.00 . A A . 5 GLN N 1 1 14 6907 1 1 5 GLN NE2 N -8.145 -3.929 -5.918 1.00 . A A . 5 GLN NE2 1 1 14 6908 1 1 5 GLN O O -9.010 -4.190 -0.868 1.00 . A A . 5 GLN O 1 1 14 6909 1 1 5 GLN OE1 O -9.297 -5.017 -4.389 1.00 . A A . 5 GLN OE1 1 1 14 6910 1 1 6 LYS C C -7.228 -6.768 0.229 1.00 . A A . 6 LYS C 1 1 14 6911 1 1 6 LYS CA C -7.407 -6.529 -1.273 1.00 . A A . 6 LYS CA 1 1 14 6912 1 1 6 LYS CB C -6.524 -7.493 -2.083 1.00 . A A . 6 LYS CB 1 1 14 6913 1 1 6 LYS CD C -6.026 -8.356 -4.415 1.00 . A A . 6 LYS CD 1 1 14 6914 1 1 6 LYS CE C -6.617 -9.276 -5.489 1.00 . A A . 6 LYS CE 1 1 14 6915 1 1 6 LYS CG C -7.102 -7.792 -3.473 1.00 . A A . 6 LYS CG 1 1 14 6916 1 1 6 LYS H H -6.237 -4.952 -2.119 1.00 . A A . 6 LYS H 1 1 14 6917 1 1 6 LYS HA H -8.445 -6.765 -1.490 1.00 . A A . 6 LYS HA 1 1 14 6918 1 1 6 LYS HB2 H -5.531 -7.063 -2.184 1.00 . A A . 6 LYS HB2 1 1 14 6919 1 1 6 LYS HB3 H -6.428 -8.442 -1.549 1.00 . A A . 6 LYS HB3 1 1 14 6920 1 1 6 LYS HD2 H -5.520 -7.522 -4.904 1.00 . A A . 6 LYS HD2 1 1 14 6921 1 1 6 LYS HD3 H -5.275 -8.905 -3.847 1.00 . A A . 6 LYS HD3 1 1 14 6922 1 1 6 LYS HE2 H -7.478 -8.782 -5.950 1.00 . A A . 6 LYS HE2 1 1 14 6923 1 1 6 LYS HE3 H -5.864 -9.436 -6.263 1.00 . A A . 6 LYS HE3 1 1 14 6924 1 1 6 LYS HG2 H -7.922 -8.501 -3.357 1.00 . A A . 6 LYS HG2 1 1 14 6925 1 1 6 LYS HG3 H -7.499 -6.881 -3.919 1.00 . A A . 6 LYS HG3 1 1 14 6926 1 1 6 LYS HZ1 H -7.634 -10.491 -4.134 1.00 . A A . 6 LYS HZ1 1 1 14 6927 1 1 6 LYS HZ2 H -6.211 -11.114 -4.599 1.00 . A A . 6 LYS HZ2 1 1 14 6928 1 1 6 LYS HZ3 H -7.497 -11.152 -5.633 1.00 . A A . 6 LYS HZ3 1 1 14 6929 1 1 6 LYS N N -7.138 -5.140 -1.697 1.00 . A A . 6 LYS N 1 1 14 6930 1 1 6 LYS NZ N -7.019 -10.589 -4.930 1.00 . A A . 6 LYS NZ 1 1 14 6931 1 1 6 LYS O O -8.040 -7.465 0.834 1.00 . A A . 6 LYS O 1 1 14 6932 1 1 7 TRP C C -6.698 -5.282 3.206 1.00 . A A . 7 TRP C 1 1 14 6933 1 1 7 TRP CA C -5.894 -6.186 2.268 1.00 . A A . 7 TRP CA 1 1 14 6934 1 1 7 TRP CB C -4.377 -6.003 2.449 1.00 . A A . 7 TRP CB 1 1 14 6935 1 1 7 TRP CD1 C -3.405 -7.886 3.808 1.00 . A A . 7 TRP CD1 1 1 14 6936 1 1 7 TRP CD2 C -3.413 -8.336 1.624 1.00 . A A . 7 TRP CD2 1 1 14 6937 1 1 7 TRP CE2 C -2.910 -9.498 2.280 1.00 . A A . 7 TRP CE2 1 1 14 6938 1 1 7 TRP CE3 C -3.604 -8.415 0.231 1.00 . A A . 7 TRP CE3 1 1 14 6939 1 1 7 TRP CG C -3.650 -7.296 2.618 1.00 . A A . 7 TRP CG 1 1 14 6940 1 1 7 TRP CH2 C -2.755 -10.705 0.190 1.00 . A A . 7 TRP CH2 1 1 14 6941 1 1 7 TRP CZ2 C -2.581 -10.670 1.584 1.00 . A A . 7 TRP CZ2 1 1 14 6942 1 1 7 TRP CZ3 C -3.270 -9.581 -0.479 1.00 . A A . 7 TRP CZ3 1 1 14 6943 1 1 7 TRP H H -5.620 -5.573 0.237 1.00 . A A . 7 TRP H 1 1 14 6944 1 1 7 TRP HA H -6.131 -7.196 2.608 1.00 . A A . 7 TRP HA 1 1 14 6945 1 1 7 TRP HB2 H -3.957 -5.467 1.597 1.00 . A A . 7 TRP HB2 1 1 14 6946 1 1 7 TRP HB3 H -4.182 -5.383 3.326 1.00 . A A . 7 TRP HB3 1 1 14 6947 1 1 7 TRP HD1 H -3.623 -7.440 4.773 1.00 . A A . 7 TRP HD1 1 1 14 6948 1 1 7 TRP HE1 H -2.762 -9.814 4.380 1.00 . A A . 7 TRP HE1 1 1 14 6949 1 1 7 TRP HE3 H -4.017 -7.566 -0.289 1.00 . A A . 7 TRP HE3 1 1 14 6950 1 1 7 TRP HH2 H -2.523 -11.604 -0.365 1.00 . A A . 7 TRP HH2 1 1 14 6951 1 1 7 TRP HZ2 H -2.237 -11.545 2.116 1.00 . A A . 7 TRP HZ2 1 1 14 6952 1 1 7 TRP HZ3 H -3.428 -9.624 -1.547 1.00 . A A . 7 TRP HZ3 1 1 14 6953 1 1 7 TRP N N -6.237 -6.110 0.835 1.00 . A A . 7 TRP N 1 1 14 6954 1 1 7 TRP NE1 N -2.910 -9.159 3.613 1.00 . A A . 7 TRP NE1 1 1 14 6955 1 1 7 TRP O O -6.535 -5.367 4.425 1.00 . A A . 7 TRP O 1 1 14 6956 1 1 8 MET C C -7.523 -2.435 4.108 1.00 . A A . 8 MET C 1 1 14 6957 1 1 8 MET CA C -8.391 -3.458 3.356 1.00 . A A . 8 MET CA 1 1 14 6958 1 1 8 MET CB C -9.439 -4.148 4.254 1.00 . A A . 8 MET CB 1 1 14 6959 1 1 8 MET CE C -9.640 -7.499 4.456 1.00 . A A . 8 MET CE 1 1 14 6960 1 1 8 MET CG C -10.421 -5.040 3.482 1.00 . A A . 8 MET CG 1 1 14 6961 1 1 8 MET H H -7.595 -4.432 1.634 1.00 . A A . 8 MET H 1 1 14 6962 1 1 8 MET HA H -8.940 -2.898 2.601 1.00 . A A . 8 MET HA 1 1 14 6963 1 1 8 MET HB2 H -8.924 -4.749 5.001 1.00 . A A . 8 MET HB2 1 1 14 6964 1 1 8 MET HB3 H -10.010 -3.391 4.791 1.00 . A A . 8 MET HB3 1 1 14 6965 1 1 8 MET HE1 H -9.300 -7.656 3.433 1.00 . A A . 8 MET HE1 1 1 14 6966 1 1 8 MET HE2 H -8.836 -7.052 5.042 1.00 . A A . 8 MET HE2 1 1 14 6967 1 1 8 MET HE3 H -9.903 -8.461 4.890 1.00 . A A . 8 MET HE3 1 1 14 6968 1 1 8 MET HG2 H -11.248 -4.425 3.127 1.00 . A A . 8 MET HG2 1 1 14 6969 1 1 8 MET HG3 H -9.930 -5.470 2.609 1.00 . A A . 8 MET HG3 1 1 14 6970 1 1 8 MET N N -7.574 -4.444 2.642 1.00 . A A . 8 MET N 1 1 14 6971 1 1 8 MET O O -7.496 -2.405 5.334 1.00 . A A . 8 MET O 1 1 14 6972 1 1 8 MET SD S -11.094 -6.411 4.458 1.00 . A A . 8 MET SD 1 1 14 6973 1 1 9 GLN C C -6.442 0.622 4.699 1.00 . A A . 9 GLN C 1 1 14 6974 1 1 9 GLN CA C -5.908 -0.504 3.771 1.00 . A A . 9 GLN CA 1 1 14 6975 1 1 9 GLN CB C -5.313 0.103 2.490 1.00 . A A . 9 GLN CB 1 1 14 6976 1 1 9 GLN CD C -6.010 2.125 1.081 1.00 . A A . 9 GLN CD 1 1 14 6977 1 1 9 GLN CG C -6.400 0.752 1.600 1.00 . A A . 9 GLN CG 1 1 14 6978 1 1 9 GLN H H -6.843 -1.773 2.358 1.00 . A A . 9 GLN H 1 1 14 6979 1 1 9 GLN HA H -5.097 -0.986 4.318 1.00 . A A . 9 GLN HA 1 1 14 6980 1 1 9 GLN HB2 H -4.544 0.829 2.757 1.00 . A A . 9 GLN HB2 1 1 14 6981 1 1 9 GLN HB3 H -4.809 -0.682 1.935 1.00 . A A . 9 GLN HB3 1 1 14 6982 1 1 9 GLN HE21 H -5.874 2.870 2.949 1.00 . A A . 9 GLN HE21 1 1 14 6983 1 1 9 GLN HE22 H -5.432 3.969 1.626 1.00 . A A . 9 GLN HE22 1 1 14 6984 1 1 9 GLN HG2 H -6.615 0.100 0.754 1.00 . A A . 9 GLN HG2 1 1 14 6985 1 1 9 GLN HG3 H -7.328 0.877 2.159 1.00 . A A . 9 GLN HG3 1 1 14 6986 1 1 9 GLN N N -6.846 -1.567 3.351 1.00 . A A . 9 GLN N 1 1 14 6987 1 1 9 GLN NE2 N -5.766 3.067 1.963 1.00 . A A . 9 GLN NE2 1 1 14 6988 1 1 9 GLN O O -5.986 1.767 4.607 1.00 . A A . 9 GLN O 1 1 14 6989 1 1 9 GLN OE1 O -5.774 2.300 -0.104 1.00 . A A . 9 GLN OE1 1 1 14 6990 1 1 10 THR C C -8.116 2.633 6.307 1.00 . A A . 10 THR C 1 1 14 6991 1 1 10 THR CA C -7.912 1.164 6.668 1.00 . A A . 10 THR CA 1 1 14 6992 1 1 10 THR CB C -7.042 0.977 7.916 1.00 . A A . 10 THR CB 1 1 14 6993 1 1 10 THR CG2 C -7.777 1.444 9.168 1.00 . A A . 10 THR CG2 1 1 14 6994 1 1 10 THR H H -7.693 -0.642 5.589 1.00 . A A . 10 THR H 1 1 14 6995 1 1 10 THR HA H -8.893 0.785 6.938 1.00 . A A . 10 THR HA 1 1 14 6996 1 1 10 THR HB H -6.092 1.502 7.811 1.00 . A A . 10 THR HB 1 1 14 6997 1 1 10 THR HG1 H -6.102 -0.443 8.785 1.00 . A A . 10 THR HG1 1 1 14 6998 1 1 10 THR HG21 H -7.681 2.524 9.278 1.00 . A A . 10 THR HG21 1 1 14 6999 1 1 10 THR HG22 H -7.371 0.960 10.053 1.00 . A A . 10 THR HG22 1 1 14 7000 1 1 10 THR HG23 H -8.831 1.189 9.094 1.00 . A A . 10 THR HG23 1 1 14 7001 1 1 10 THR N N -7.432 0.334 5.544 1.00 . A A . 10 THR N 1 1 14 7002 1 1 10 THR O O -7.448 3.515 6.846 1.00 . A A . 10 THR O 1 1 14 7003 1 1 10 THR OG1 O -6.785 -0.398 8.092 1.00 . A A . 10 THR OG1 1 1 14 7004 1 1 11 CYS C C -10.038 5.080 5.492 1.00 . A A . 11 CYS C 1 1 14 7005 1 1 11 CYS CA C -9.110 4.173 4.666 1.00 . A A . 11 CYS CA 1 1 14 7006 1 1 11 CYS CB C -9.495 4.008 3.195 1.00 . A A . 11 CYS CB 1 1 14 7007 1 1 11 CYS H H -9.506 2.092 4.962 1.00 . A A . 11 CYS H 1 1 14 7008 1 1 11 CYS HA H -8.128 4.647 4.676 1.00 . A A . 11 CYS HA 1 1 14 7009 1 1 11 CYS HB2 H -9.310 2.978 2.900 1.00 . A A . 11 CYS HB2 1 1 14 7010 1 1 11 CYS HB3 H -10.556 4.212 3.058 1.00 . A A . 11 CYS HB3 1 1 14 7011 1 1 11 CYS N N -8.941 2.863 5.285 1.00 . A A . 11 CYS N 1 1 14 7012 1 1 11 CYS O O -10.890 4.600 6.244 1.00 . A A . 11 CYS O 1 1 14 7013 1 1 11 CYS SG S -8.508 5.034 2.083 1.00 . A A . 11 CYS SG 1 1 14 7014 1 1 12 ASP C C -9.566 8.660 6.311 1.00 . A A . 12 ASP C 1 1 14 7015 1 1 12 ASP CA C -9.796 7.192 6.730 1.00 . A A . 12 ASP CA 1 1 14 7016 1 1 12 ASP CB C -8.634 6.719 7.624 1.00 . A A . 12 ASP CB 1 1 14 7017 1 1 12 ASP CG C -8.714 7.132 9.084 1.00 . A A . 12 ASP CG 1 1 14 7018 1 1 12 ASP H H -9.149 6.750 4.769 1.00 . A A . 12 ASP H 1 1 14 7019 1 1 12 ASP HA H -10.759 7.073 7.231 1.00 . A A . 12 ASP HA 1 1 14 7020 1 1 12 ASP HB2 H -8.607 5.632 7.631 1.00 . A A . 12 ASP HB2 1 1 14 7021 1 1 12 ASP HB3 H -7.691 7.077 7.205 1.00 . A A . 12 ASP HB3 1 1 14 7022 1 1 12 ASP N N -9.711 6.367 5.520 1.00 . A A . 12 ASP N 1 1 14 7023 1 1 12 ASP O O -9.308 8.946 5.140 1.00 . A A . 12 ASP O 1 1 14 7024 1 1 12 ASP OD1 O -7.732 6.834 9.797 1.00 . A A . 12 ASP OD1 1 1 14 7025 1 1 12 ASP OD2 O -9.705 7.776 9.499 1.00 . A A . 12 ASP OD2 1 1 14 7026 1 1 13 SER C C -7.873 11.238 6.382 1.00 . A A . 13 SER C 1 1 14 7027 1 1 13 SER CA C -9.279 11.026 6.954 1.00 . A A . 13 SER CA 1 1 14 7028 1 1 13 SER CB C -9.455 11.871 8.213 1.00 . A A . 13 SER CB 1 1 14 7029 1 1 13 SER H H -9.792 9.334 8.201 1.00 . A A . 13 SER H 1 1 14 7030 1 1 13 SER HA H -9.981 11.397 6.211 1.00 . A A . 13 SER HA 1 1 14 7031 1 1 13 SER HB2 H -10.497 11.843 8.528 1.00 . A A . 13 SER HB2 1 1 14 7032 1 1 13 SER HB3 H -8.845 11.429 8.990 1.00 . A A . 13 SER HB3 1 1 14 7033 1 1 13 SER HG H -9.838 13.770 7.924 1.00 . A A . 13 SER HG 1 1 14 7034 1 1 13 SER N N -9.588 9.613 7.247 1.00 . A A . 13 SER N 1 1 14 7035 1 1 13 SER O O -7.712 11.918 5.369 1.00 . A A . 13 SER O 1 1 14 7036 1 1 13 SER OG O -9.038 13.212 8.016 1.00 . A A . 13 SER OG 1 1 14 7037 1 1 14 GLU C C -4.806 9.962 5.694 1.00 . A A . 14 GLU C 1 1 14 7038 1 1 14 GLU CA C -5.434 10.964 6.687 1.00 . A A . 14 GLU CA 1 1 14 7039 1 1 14 GLU CB C -4.661 11.086 8.010 1.00 . A A . 14 GLU CB 1 1 14 7040 1 1 14 GLU CD C -2.855 12.461 9.215 1.00 . A A . 14 GLU CD 1 1 14 7041 1 1 14 GLU CG C -3.348 11.874 7.888 1.00 . A A . 14 GLU CG 1 1 14 7042 1 1 14 GLU H H -7.019 10.148 7.866 1.00 . A A . 14 GLU H 1 1 14 7043 1 1 14 GLU HA H -5.394 11.938 6.200 1.00 . A A . 14 GLU HA 1 1 14 7044 1 1 14 GLU HB2 H -5.313 11.603 8.711 1.00 . A A . 14 GLU HB2 1 1 14 7045 1 1 14 GLU HB3 H -4.456 10.096 8.413 1.00 . A A . 14 GLU HB3 1 1 14 7046 1 1 14 GLU HG2 H -2.572 11.230 7.477 1.00 . A A . 14 GLU HG2 1 1 14 7047 1 1 14 GLU HG3 H -3.498 12.703 7.194 1.00 . A A . 14 GLU HG3 1 1 14 7048 1 1 14 GLU N N -6.841 10.669 7.011 1.00 . A A . 14 GLU N 1 1 14 7049 1 1 14 GLU O O -3.583 9.841 5.606 1.00 . A A . 14 GLU O 1 1 14 7050 1 1 14 GLU OE1 O -3.590 12.477 10.234 1.00 . A A . 14 GLU OE1 1 1 14 7051 1 1 14 GLU OE2 O -1.707 12.960 9.234 1.00 . A A . 14 GLU OE2 1 1 14 7052 1 1 15 ARG C C -5.016 8.323 2.676 1.00 . A A . 15 ARG C 1 1 14 7053 1 1 15 ARG CA C -5.154 8.036 4.171 1.00 . A A . 15 ARG CA 1 1 14 7054 1 1 15 ARG CB C -6.012 6.792 4.457 1.00 . A A . 15 ARG CB 1 1 14 7055 1 1 15 ARG CD C -4.377 5.031 5.095 1.00 . A A . 15 ARG CD 1 1 14 7056 1 1 15 ARG CG C -5.429 6.016 5.650 1.00 . A A . 15 ARG CG 1 1 14 7057 1 1 15 ARG CZ C -3.215 3.489 6.677 1.00 . A A . 15 ARG CZ 1 1 14 7058 1 1 15 ARG H H -6.622 9.340 5.041 1.00 . A A . 15 ARG H 1 1 14 7059 1 1 15 ARG HA H -4.145 7.794 4.500 1.00 . A A . 15 ARG HA 1 1 14 7060 1 1 15 ARG HB2 H -7.032 7.102 4.684 1.00 . A A . 15 ARG HB2 1 1 14 7061 1 1 15 ARG HB3 H -6.053 6.144 3.579 1.00 . A A . 15 ARG HB3 1 1 14 7062 1 1 15 ARG HD2 H -4.889 4.158 4.715 1.00 . A A . 15 ARG HD2 1 1 14 7063 1 1 15 ARG HD3 H -3.786 5.520 4.331 1.00 . A A . 15 ARG HD3 1 1 14 7064 1 1 15 ARG HE H -2.951 5.445 6.633 1.00 . A A . 15 ARG HE 1 1 14 7065 1 1 15 ARG HG2 H -4.994 6.709 6.374 1.00 . A A . 15 ARG HG2 1 1 14 7066 1 1 15 ARG HG3 H -6.220 5.461 6.137 1.00 . A A . 15 ARG HG3 1 1 14 7067 1 1 15 ARG HH11 H -4.653 2.463 5.710 1.00 . A A . 15 ARG HH11 1 1 14 7068 1 1 15 ARG HH12 H -3.533 1.503 6.664 1.00 . A A . 15 ARG HH12 1 1 14 7069 1 1 15 ARG HH21 H -1.697 4.183 7.787 1.00 . A A . 15 ARG HH21 1 1 14 7070 1 1 15 ARG HH22 H -2.035 2.472 7.946 1.00 . A A . 15 ARG HH22 1 1 14 7071 1 1 15 ARG N N -5.623 9.169 4.985 1.00 . A A . 15 ARG N 1 1 14 7072 1 1 15 ARG NE N -3.486 4.698 6.214 1.00 . A A . 15 ARG NE 1 1 14 7073 1 1 15 ARG NH1 N -3.848 2.403 6.321 1.00 . A A . 15 ARG NH1 1 1 14 7074 1 1 15 ARG NH2 N -2.251 3.371 7.539 1.00 . A A . 15 ARG NH2 1 1 14 7075 1 1 15 ARG O O -5.982 8.645 1.990 1.00 . A A . 15 ARG O 1 1 14 7076 1 1 16 LYS C C -4.415 6.456 0.337 1.00 . A A . 16 LYS C 1 1 14 7077 1 1 16 LYS CA C -3.593 7.690 0.742 1.00 . A A . 16 LYS CA 1 1 14 7078 1 1 16 LYS CB C -2.083 7.517 0.484 1.00 . A A . 16 LYS CB 1 1 14 7079 1 1 16 LYS CD C 0.067 6.211 0.971 1.00 . A A . 16 LYS CD 1 1 14 7080 1 1 16 LYS CE C 0.894 6.482 2.236 1.00 . A A . 16 LYS CE 1 1 14 7081 1 1 16 LYS CG C -1.457 6.295 1.185 1.00 . A A . 16 LYS CG 1 1 14 7082 1 1 16 LYS H H -3.072 7.849 2.815 1.00 . A A . 16 LYS H 1 1 14 7083 1 1 16 LYS HA H -3.953 8.528 0.144 1.00 . A A . 16 LYS HA 1 1 14 7084 1 1 16 LYS HB2 H -1.922 7.420 -0.591 1.00 . A A . 16 LYS HB2 1 1 14 7085 1 1 16 LYS HB3 H -1.569 8.422 0.812 1.00 . A A . 16 LYS HB3 1 1 14 7086 1 1 16 LYS HD2 H 0.307 5.200 0.634 1.00 . A A . 16 LYS HD2 1 1 14 7087 1 1 16 LYS HD3 H 0.381 6.896 0.180 1.00 . A A . 16 LYS HD3 1 1 14 7088 1 1 16 LYS HE2 H 0.630 5.747 3.002 1.00 . A A . 16 LYS HE2 1 1 14 7089 1 1 16 LYS HE3 H 1.950 6.335 1.988 1.00 . A A . 16 LYS HE3 1 1 14 7090 1 1 16 LYS HG2 H -1.678 6.318 2.253 1.00 . A A . 16 LYS HG2 1 1 14 7091 1 1 16 LYS HG3 H -1.907 5.392 0.772 1.00 . A A . 16 LYS HG3 1 1 14 7092 1 1 16 LYS HZ1 H 1.368 8.038 3.519 1.00 . A A . 16 LYS HZ1 1 1 14 7093 1 1 16 LYS HZ2 H -0.220 8.008 3.146 1.00 . A A . 16 LYS HZ2 1 1 14 7094 1 1 16 LYS HZ3 H 0.892 8.561 2.059 1.00 . A A . 16 LYS HZ3 1 1 14 7095 1 1 16 LYS N N -3.825 8.010 2.157 1.00 . A A . 16 LYS N 1 1 14 7096 1 1 16 LYS NZ N 0.710 7.852 2.768 1.00 . A A . 16 LYS NZ 1 1 14 7097 1 1 16 LYS O O -4.742 5.619 1.181 1.00 . A A . 16 LYS O 1 1 14 7098 1 1 17 CYS C C -5.151 4.601 -2.722 1.00 . A A . 17 CYS C 1 1 14 7099 1 1 17 CYS CA C -5.672 5.362 -1.487 1.00 . A A . 17 CYS CA 1 1 14 7100 1 1 17 CYS CB C -6.976 6.112 -1.769 1.00 . A A . 17 CYS CB 1 1 14 7101 1 1 17 CYS H H -4.350 7.025 -1.593 1.00 . A A . 17 CYS H 1 1 14 7102 1 1 17 CYS HA H -5.898 4.627 -0.718 1.00 . A A . 17 CYS HA 1 1 14 7103 1 1 17 CYS HB2 H -7.357 6.535 -0.837 1.00 . A A . 17 CYS HB2 1 1 14 7104 1 1 17 CYS HB3 H -6.743 6.943 -2.435 1.00 . A A . 17 CYS HB3 1 1 14 7105 1 1 17 CYS N N -4.697 6.318 -0.957 1.00 . A A . 17 CYS N 1 1 14 7106 1 1 17 CYS O O -4.558 5.184 -3.629 1.00 . A A . 17 CYS O 1 1 14 7107 1 1 17 CYS SG S -8.296 5.154 -2.552 1.00 . A A . 17 CYS SG 1 1 14 7108 1 1 18 CYS C C -4.988 2.575 -5.162 1.00 . A A . 18 CYS C 1 1 14 7109 1 1 18 CYS CA C -4.809 2.304 -3.650 1.00 . A A . 18 CYS CA 1 1 14 7110 1 1 18 CYS CB C -5.422 0.945 -3.268 1.00 . A A . 18 CYS CB 1 1 14 7111 1 1 18 CYS H H -5.842 2.920 -1.910 1.00 . A A . 18 CYS H 1 1 14 7112 1 1 18 CYS HA H -3.738 2.275 -3.446 1.00 . A A . 18 CYS HA 1 1 14 7113 1 1 18 CYS HB2 H -5.663 0.950 -2.206 1.00 . A A . 18 CYS HB2 1 1 14 7114 1 1 18 CYS HB3 H -6.362 0.827 -3.809 1.00 . A A . 18 CYS HB3 1 1 14 7115 1 1 18 CYS N N -5.413 3.293 -2.751 1.00 . A A . 18 CYS N 1 1 14 7116 1 1 18 CYS O O -4.094 2.272 -5.951 1.00 . A A . 18 CYS O 1 1 14 7117 1 1 18 CYS SG S -4.403 -0.526 -3.548 1.00 . A A . 18 CYS SG 1 1 14 7118 1 1 19 GLU C C -7.376 4.593 -7.247 1.00 . A A . 19 GLU C 1 1 14 7119 1 1 19 GLU CA C -6.491 3.338 -7.006 1.00 . A A . 19 GLU CA 1 1 14 7120 1 1 19 GLU CB C -7.166 2.100 -7.629 1.00 . A A . 19 GLU CB 1 1 14 7121 1 1 19 GLU CD C -7.449 -0.391 -8.042 1.00 . A A . 19 GLU CD 1 1 14 7122 1 1 19 GLU CG C -6.583 0.697 -7.375 1.00 . A A . 19 GLU CG 1 1 14 7123 1 1 19 GLU H H -6.832 3.339 -4.886 1.00 . A A . 19 GLU H 1 1 14 7124 1 1 19 GLU HA H -5.569 3.506 -7.556 1.00 . A A . 19 GLU HA 1 1 14 7125 1 1 19 GLU HB2 H -8.198 2.085 -7.298 1.00 . A A . 19 GLU HB2 1 1 14 7126 1 1 19 GLU HB3 H -7.182 2.266 -8.705 1.00 . A A . 19 GLU HB3 1 1 14 7127 1 1 19 GLU HG2 H -5.569 0.651 -7.774 1.00 . A A . 19 GLU HG2 1 1 14 7128 1 1 19 GLU HG3 H -6.530 0.504 -6.303 1.00 . A A . 19 GLU HG3 1 1 14 7129 1 1 19 GLU N N -6.138 3.121 -5.586 1.00 . A A . 19 GLU N 1 1 14 7130 1 1 19 GLU O O -8.225 4.620 -8.148 1.00 . A A . 19 GLU O 1 1 14 7131 1 1 19 GLU OE1 O -7.368 -1.577 -7.638 1.00 . A A . 19 GLU OE1 1 1 14 7132 1 1 19 GLU OE2 O -8.229 -0.078 -8.978 1.00 . A A . 19 GLU OE2 1 1 14 7133 1 1 20 GLY C C -9.538 6.818 -6.270 1.00 . A A . 20 GLY C 1 1 14 7134 1 1 20 GLY CA C -8.017 6.882 -6.515 1.00 . A A . 20 GLY CA 1 1 14 7135 1 1 20 GLY H H -6.558 5.561 -5.671 1.00 . A A . 20 GLY H 1 1 14 7136 1 1 20 GLY HA2 H -7.600 7.596 -5.805 1.00 . A A . 20 GLY HA2 1 1 14 7137 1 1 20 GLY HA3 H -7.857 7.280 -7.517 1.00 . A A . 20 GLY HA3 1 1 14 7138 1 1 20 GLY N N -7.274 5.613 -6.384 1.00 . A A . 20 GLY N 1 1 14 7139 1 1 20 GLY O O -10.245 7.793 -6.538 1.00 . A A . 20 GLY O 1 1 14 7140 1 1 21 MET C C -11.853 6.158 -4.120 1.00 . A A . 21 MET C 1 1 14 7141 1 1 21 MET CA C -11.455 5.453 -5.437 1.00 . A A . 21 MET CA 1 1 14 7142 1 1 21 MET CB C -11.692 3.933 -5.361 1.00 . A A . 21 MET CB 1 1 14 7143 1 1 21 MET CE C -9.451 1.041 -5.254 1.00 . A A . 21 MET CE 1 1 14 7144 1 1 21 MET CG C -10.856 3.265 -4.264 1.00 . A A . 21 MET CG 1 1 14 7145 1 1 21 MET H H -9.403 4.931 -5.613 1.00 . A A . 21 MET H 1 1 14 7146 1 1 21 MET HA H -12.092 5.852 -6.226 1.00 . A A . 21 MET HA 1 1 14 7147 1 1 21 MET HB2 H -12.748 3.753 -5.157 1.00 . A A . 21 MET HB2 1 1 14 7148 1 1 21 MET HB3 H -11.459 3.472 -6.321 1.00 . A A . 21 MET HB3 1 1 14 7149 1 1 21 MET HE1 H -10.019 1.021 -6.183 1.00 . A A . 21 MET HE1 1 1 14 7150 1 1 21 MET HE2 H -8.494 0.552 -5.408 1.00 . A A . 21 MET HE2 1 1 14 7151 1 1 21 MET HE3 H -9.976 0.502 -4.476 1.00 . A A . 21 MET HE3 1 1 14 7152 1 1 21 MET HG2 H -10.785 3.940 -3.414 1.00 . A A . 21 MET HG2 1 1 14 7153 1 1 21 MET HG3 H -11.384 2.394 -3.907 1.00 . A A . 21 MET HG3 1 1 14 7154 1 1 21 MET N N -10.051 5.681 -5.799 1.00 . A A . 21 MET N 1 1 14 7155 1 1 21 MET O O -11.045 6.846 -3.492 1.00 . A A . 21 MET O 1 1 14 7156 1 1 21 MET SD S -9.184 2.752 -4.741 1.00 . A A . 21 MET SD 1 1 14 7157 1 1 22 VAL C C -12.891 5.675 -1.242 1.00 . A A . 22 VAL C 1 1 14 7158 1 1 22 VAL CA C -13.615 6.413 -2.380 1.00 . A A . 22 VAL CA 1 1 14 7159 1 1 22 VAL CB C -15.144 6.207 -2.305 1.00 . A A . 22 VAL CB 1 1 14 7160 1 1 22 VAL CG1 C -15.733 6.601 -0.946 1.00 . A A . 22 VAL CG1 1 1 14 7161 1 1 22 VAL CG2 C -15.863 7.034 -3.382 1.00 . A A . 22 VAL CG2 1 1 14 7162 1 1 22 VAL H H -13.715 5.392 -4.248 1.00 . A A . 22 VAL H 1 1 14 7163 1 1 22 VAL HA H -13.411 7.479 -2.271 1.00 . A A . 22 VAL HA 1 1 14 7164 1 1 22 VAL HB H -15.367 5.153 -2.479 1.00 . A A . 22 VAL HB 1 1 14 7165 1 1 22 VAL HG11 H -15.460 7.627 -0.696 1.00 . A A . 22 VAL HG11 1 1 14 7166 1 1 22 VAL HG12 H -16.820 6.518 -0.976 1.00 . A A . 22 VAL HG12 1 1 14 7167 1 1 22 VAL HG13 H -15.373 5.920 -0.175 1.00 . A A . 22 VAL HG13 1 1 14 7168 1 1 22 VAL HG21 H -15.542 6.734 -4.379 1.00 . A A . 22 VAL HG21 1 1 14 7169 1 1 22 VAL HG22 H -16.940 6.877 -3.313 1.00 . A A . 22 VAL HG22 1 1 14 7170 1 1 22 VAL HG23 H -15.651 8.094 -3.243 1.00 . A A . 22 VAL HG23 1 1 14 7171 1 1 22 VAL N N -13.106 5.971 -3.691 1.00 . A A . 22 VAL N 1 1 14 7172 1 1 22 VAL O O -12.620 4.478 -1.347 1.00 . A A . 22 VAL O 1 1 14 7173 1 1 23 CYS C C -12.475 6.009 2.286 1.00 . A A . 23 CYS C 1 1 14 7174 1 1 23 CYS CA C -11.724 6.016 0.946 1.00 . A A . 23 CYS CA 1 1 14 7175 1 1 23 CYS CB C -10.532 6.993 0.912 1.00 . A A . 23 CYS CB 1 1 14 7176 1 1 23 CYS H H -12.943 7.358 -0.136 1.00 . A A . 23 CYS H 1 1 14 7177 1 1 23 CYS HA H -11.346 5.008 0.777 1.00 . A A . 23 CYS HA 1 1 14 7178 1 1 23 CYS HB2 H -10.016 6.878 -0.041 1.00 . A A . 23 CYS HB2 1 1 14 7179 1 1 23 CYS HB3 H -10.928 8.007 0.941 1.00 . A A . 23 CYS HB3 1 1 14 7180 1 1 23 CYS N N -12.625 6.392 -0.144 1.00 . A A . 23 CYS N 1 1 14 7181 1 1 23 CYS O O -12.458 6.986 3.035 1.00 . A A . 23 CYS O 1 1 14 7182 1 1 23 CYS SG S -9.301 6.890 2.242 1.00 . A A . 23 CYS SG 1 1 14 7183 1 1 24 ARG C C -13.914 3.297 4.293 1.00 . A A . 24 ARG C 1 1 14 7184 1 1 24 ARG CA C -14.019 4.735 3.792 1.00 . A A . 24 ARG CA 1 1 14 7185 1 1 24 ARG CB C -15.499 5.108 3.563 1.00 . A A . 24 ARG CB 1 1 14 7186 1 1 24 ARG CD C -15.668 7.356 2.448 1.00 . A A . 24 ARG CD 1 1 14 7187 1 1 24 ARG CG C -15.840 6.590 3.775 1.00 . A A . 24 ARG CG 1 1 14 7188 1 1 24 ARG CZ C -15.130 9.575 3.439 1.00 . A A . 24 ARG CZ 1 1 14 7189 1 1 24 ARG H H -13.176 4.159 1.900 1.00 . A A . 24 ARG H 1 1 14 7190 1 1 24 ARG HA H -13.626 5.373 4.588 1.00 . A A . 24 ARG HA 1 1 14 7191 1 1 24 ARG HB2 H -15.821 4.777 2.576 1.00 . A A . 24 ARG HB2 1 1 14 7192 1 1 24 ARG HB3 H -16.093 4.559 4.296 1.00 . A A . 24 ARG HB3 1 1 14 7193 1 1 24 ARG HD2 H -14.683 7.241 2.038 1.00 . A A . 24 ARG HD2 1 1 14 7194 1 1 24 ARG HD3 H -16.409 7.006 1.748 1.00 . A A . 24 ARG HD3 1 1 14 7195 1 1 24 ARG HE H -16.788 9.162 2.403 1.00 . A A . 24 ARG HE 1 1 14 7196 1 1 24 ARG HG2 H -16.880 6.667 4.091 1.00 . A A . 24 ARG HG2 1 1 14 7197 1 1 24 ARG HG3 H -15.210 7.002 4.559 1.00 . A A . 24 ARG HG3 1 1 14 7198 1 1 24 ARG HH11 H -13.572 8.309 3.557 1.00 . A A . 24 ARG HH11 1 1 14 7199 1 1 24 ARG HH12 H -13.327 9.821 4.345 1.00 . A A . 24 ARG HH12 1 1 14 7200 1 1 24 ARG HH21 H -16.385 11.115 3.291 1.00 . A A . 24 ARG HH21 1 1 14 7201 1 1 24 ARG HH22 H -14.956 11.417 4.248 1.00 . A A . 24 ARG HH22 1 1 14 7202 1 1 24 ARG N N -13.215 4.927 2.566 1.00 . A A . 24 ARG N 1 1 14 7203 1 1 24 ARG NE N -15.921 8.770 2.746 1.00 . A A . 24 ARG NE 1 1 14 7204 1 1 24 ARG NH1 N -13.955 9.202 3.855 1.00 . A A . 24 ARG NH1 1 1 14 7205 1 1 24 ARG NH2 N -15.535 10.778 3.734 1.00 . A A . 24 ARG NH2 1 1 14 7206 1 1 24 ARG O O -14.419 2.384 3.641 1.00 . A A . 24 ARG O 1 1 14 7207 1 1 25 LEU C C -11.757 1.048 5.098 1.00 . A A . 25 LEU C 1 1 14 7208 1 1 25 LEU CA C -12.738 1.832 5.996 1.00 . A A . 25 LEU CA 1 1 14 7209 1 1 25 LEU CB C -13.920 0.970 6.494 1.00 . A A . 25 LEU CB 1 1 14 7210 1 1 25 LEU CD1 C -15.751 2.637 7.257 1.00 . A A . 25 LEU CD1 1 1 14 7211 1 1 25 LEU CD2 C -15.508 0.455 8.367 1.00 . A A . 25 LEU CD2 1 1 14 7212 1 1 25 LEU CG C -14.729 1.570 7.667 1.00 . A A . 25 LEU CG 1 1 14 7213 1 1 25 LEU H H -12.847 3.939 5.859 1.00 . A A . 25 LEU H 1 1 14 7214 1 1 25 LEU HA H -12.154 2.096 6.875 1.00 . A A . 25 LEU HA 1 1 14 7215 1 1 25 LEU HB2 H -14.590 0.731 5.667 1.00 . A A . 25 LEU HB2 1 1 14 7216 1 1 25 LEU HB3 H -13.490 0.027 6.836 1.00 . A A . 25 LEU HB3 1 1 14 7217 1 1 25 LEU HD11 H -15.238 3.523 6.890 1.00 . A A . 25 LEU HD11 1 1 14 7218 1 1 25 LEU HD12 H -16.324 2.953 8.128 1.00 . A A . 25 LEU HD12 1 1 14 7219 1 1 25 LEU HD13 H -16.411 2.253 6.477 1.00 . A A . 25 LEU HD13 1 1 14 7220 1 1 25 LEU HD21 H -14.814 -0.311 8.717 1.00 . A A . 25 LEU HD21 1 1 14 7221 1 1 25 LEU HD22 H -16.220 0.004 7.676 1.00 . A A . 25 LEU HD22 1 1 14 7222 1 1 25 LEU HD23 H -16.028 0.852 9.238 1.00 . A A . 25 LEU HD23 1 1 14 7223 1 1 25 LEU HG H -14.045 2.004 8.394 1.00 . A A . 25 LEU HG 1 1 14 7224 1 1 25 LEU N N -13.207 3.104 5.411 1.00 . A A . 25 LEU N 1 1 14 7225 1 1 25 LEU O O -10.769 0.485 5.566 1.00 . A A . 25 LEU O 1 1 14 7226 1 1 26 TRP C C -11.127 1.498 1.467 1.00 . A A . 26 TRP C 1 1 14 7227 1 1 26 TRP CA C -11.029 0.641 2.741 1.00 . A A . 26 TRP CA 1 1 14 7228 1 1 26 TRP CB C -11.300 -0.856 2.486 1.00 . A A . 26 TRP CB 1 1 14 7229 1 1 26 TRP CD1 C -12.932 -2.178 3.906 1.00 . A A . 26 TRP CD1 1 1 14 7230 1 1 26 TRP CD2 C -13.976 -0.986 2.325 1.00 . A A . 26 TRP CD2 1 1 14 7231 1 1 26 TRP CE2 C -14.984 -1.689 3.052 1.00 . A A . 26 TRP CE2 1 1 14 7232 1 1 26 TRP CE3 C -14.428 -0.048 1.371 1.00 . A A . 26 TRP CE3 1 1 14 7233 1 1 26 TRP CG C -12.661 -1.388 2.841 1.00 . A A . 26 TRP CG 1 1 14 7234 1 1 26 TRP CH2 C -16.766 -0.584 1.859 1.00 . A A . 26 TRP CH2 1 1 14 7235 1 1 26 TRP CZ2 C -16.355 -1.522 2.816 1.00 . A A . 26 TRP CZ2 1 1 14 7236 1 1 26 TRP CZ3 C -15.803 0.163 1.159 1.00 . A A . 26 TRP CZ3 1 1 14 7237 1 1 26 TRP H H -12.783 1.555 3.461 1.00 . A A . 26 TRP H 1 1 14 7238 1 1 26 TRP HA H -10.000 0.728 3.089 1.00 . A A . 26 TRP HA 1 1 14 7239 1 1 26 TRP HB2 H -11.082 -1.117 1.454 1.00 . A A . 26 TRP HB2 1 1 14 7240 1 1 26 TRP HB3 H -10.575 -1.401 3.092 1.00 . A A . 26 TRP HB3 1 1 14 7241 1 1 26 TRP HD1 H -12.202 -2.578 4.600 1.00 . A A . 26 TRP HD1 1 1 14 7242 1 1 26 TRP HE1 H -14.704 -2.976 4.721 1.00 . A A . 26 TRP HE1 1 1 14 7243 1 1 26 TRP HE3 H -13.715 0.566 0.844 1.00 . A A . 26 TRP HE3 1 1 14 7244 1 1 26 TRP HH2 H -17.821 -0.400 1.700 1.00 . A A . 26 TRP HH2 1 1 14 7245 1 1 26 TRP HZ2 H -17.080 -2.068 3.403 1.00 . A A . 26 TRP HZ2 1 1 14 7246 1 1 26 TRP HZ3 H -16.125 0.937 0.475 1.00 . A A . 26 TRP HZ3 1 1 14 7247 1 1 26 TRP N N -11.914 1.141 3.784 1.00 . A A . 26 TRP N 1 1 14 7248 1 1 26 TRP NE1 N -14.284 -2.424 3.974 1.00 . A A . 26 TRP NE1 1 1 14 7249 1 1 26 TRP O O -11.884 2.465 1.415 1.00 . A A . 26 TRP O 1 1 14 7250 1 1 27 CYS C C -10.653 0.509 -1.876 1.00 . A A . 27 CYS C 1 1 14 7251 1 1 27 CYS CA C -10.426 1.676 -0.906 1.00 . A A . 27 CYS CA 1 1 14 7252 1 1 27 CYS CB C -9.139 2.477 -1.194 1.00 . A A . 27 CYS CB 1 1 14 7253 1 1 27 CYS H H -9.771 0.317 0.564 1.00 . A A . 27 CYS H 1 1 14 7254 1 1 27 CYS HA H -11.277 2.354 -0.995 1.00 . A A . 27 CYS HA 1 1 14 7255 1 1 27 CYS HB2 H -8.338 2.157 -0.530 1.00 . A A . 27 CYS HB2 1 1 14 7256 1 1 27 CYS HB3 H -8.811 2.259 -2.205 1.00 . A A . 27 CYS HB3 1 1 14 7257 1 1 27 CYS N N -10.364 1.122 0.442 1.00 . A A . 27 CYS N 1 1 14 7258 1 1 27 CYS O O -9.756 -0.313 -2.050 1.00 . A A . 27 CYS O 1 1 14 7259 1 1 27 CYS SG S -9.350 4.269 -1.046 1.00 . A A . 27 CYS SG 1 1 14 7260 1 1 28 LYS C C -12.611 0.084 -4.790 1.00 . A A . 28 LYS C 1 1 14 7261 1 1 28 LYS CA C -12.227 -0.613 -3.479 1.00 . A A . 28 LYS CA 1 1 14 7262 1 1 28 LYS CB C -13.359 -1.535 -2.989 1.00 . A A . 28 LYS CB 1 1 14 7263 1 1 28 LYS CD C -12.272 -2.384 -0.791 1.00 . A A . 28 LYS CD 1 1 14 7264 1 1 28 LYS CE C -12.392 -3.511 0.244 1.00 . A A . 28 LYS CE 1 1 14 7265 1 1 28 LYS CG C -12.912 -2.739 -2.141 1.00 . A A . 28 LYS CG 1 1 14 7266 1 1 28 LYS H H -12.549 1.099 -2.246 1.00 . A A . 28 LYS H 1 1 14 7267 1 1 28 LYS HA H -11.366 -1.239 -3.701 1.00 . A A . 28 LYS HA 1 1 14 7268 1 1 28 LYS HB2 H -14.092 -0.947 -2.435 1.00 . A A . 28 LYS HB2 1 1 14 7269 1 1 28 LYS HB3 H -13.873 -1.943 -3.861 1.00 . A A . 28 LYS HB3 1 1 14 7270 1 1 28 LYS HD2 H -11.221 -2.146 -0.942 1.00 . A A . 28 LYS HD2 1 1 14 7271 1 1 28 LYS HD3 H -12.771 -1.505 -0.388 1.00 . A A . 28 LYS HD3 1 1 14 7272 1 1 28 LYS HE2 H -11.929 -3.185 1.178 1.00 . A A . 28 LYS HE2 1 1 14 7273 1 1 28 LYS HE3 H -13.453 -3.687 0.451 1.00 . A A . 28 LYS HE3 1 1 14 7274 1 1 28 LYS HG2 H -13.799 -3.334 -1.945 1.00 . A A . 28 LYS HG2 1 1 14 7275 1 1 28 LYS HG3 H -12.220 -3.354 -2.719 1.00 . A A . 28 LYS HG3 1 1 14 7276 1 1 28 LYS HZ1 H -12.278 -5.170 -0.982 1.00 . A A . 28 LYS HZ1 1 1 14 7277 1 1 28 LYS HZ2 H -11.788 -5.486 0.511 1.00 . A A . 28 LYS HZ2 1 1 14 7278 1 1 28 LYS HZ3 H -10.793 -4.642 -0.514 1.00 . A A . 28 LYS HZ3 1 1 14 7279 1 1 28 LYS N N -11.862 0.380 -2.444 1.00 . A A . 28 LYS N 1 1 14 7280 1 1 28 LYS NZ N -11.756 -4.767 -0.211 1.00 . A A . 28 LYS NZ 1 1 14 7281 1 1 28 LYS O O -13.224 1.147 -4.751 1.00 . A A . 28 LYS O 1 1 14 7282 1 1 29 LYS C C -14.023 0.282 -7.428 1.00 . A A . 29 LYS C 1 1 14 7283 1 1 29 LYS CA C -12.506 0.117 -7.274 1.00 . A A . 29 LYS CA 1 1 14 7284 1 1 29 LYS CB C -11.866 -0.742 -8.389 1.00 . A A . 29 LYS CB 1 1 14 7285 1 1 29 LYS CD C -11.880 -1.330 -10.916 1.00 . A A . 29 LYS CD 1 1 14 7286 1 1 29 LYS CE C -10.517 -1.183 -11.613 1.00 . A A . 29 LYS CE 1 1 14 7287 1 1 29 LYS CG C -12.199 -0.289 -9.824 1.00 . A A . 29 LYS CG 1 1 14 7288 1 1 29 LYS H H -11.838 -1.407 -5.917 1.00 . A A . 29 LYS H 1 1 14 7289 1 1 29 LYS HA H -12.062 1.112 -7.314 1.00 . A A . 29 LYS HA 1 1 14 7290 1 1 29 LYS HB2 H -10.784 -0.732 -8.261 1.00 . A A . 29 LYS HB2 1 1 14 7291 1 1 29 LYS HB3 H -12.214 -1.766 -8.275 1.00 . A A . 29 LYS HB3 1 1 14 7292 1 1 29 LYS HD2 H -11.997 -2.344 -10.527 1.00 . A A . 29 LYS HD2 1 1 14 7293 1 1 29 LYS HD3 H -12.634 -1.209 -11.696 1.00 . A A . 29 LYS HD3 1 1 14 7294 1 1 29 LYS HE2 H -10.585 -1.704 -12.572 1.00 . A A . 29 LYS HE2 1 1 14 7295 1 1 29 LYS HE3 H -10.328 -0.127 -11.820 1.00 . A A . 29 LYS HE3 1 1 14 7296 1 1 29 LYS HG2 H -13.270 -0.094 -9.887 1.00 . A A . 29 LYS HG2 1 1 14 7297 1 1 29 LYS HG3 H -11.681 0.643 -10.042 1.00 . A A . 29 LYS HG3 1 1 14 7298 1 1 29 LYS HZ1 H -9.624 -2.691 -10.508 1.00 . A A . 29 LYS HZ1 1 1 14 7299 1 1 29 LYS HZ2 H -9.124 -1.186 -10.051 1.00 . A A . 29 LYS HZ2 1 1 14 7300 1 1 29 LYS HZ3 H -8.572 -1.882 -11.448 1.00 . A A . 29 LYS HZ3 1 1 14 7301 1 1 29 LYS N N -12.230 -0.477 -5.948 1.00 . A A . 29 LYS N 1 1 14 7302 1 1 29 LYS NZ N -9.387 -1.759 -10.853 1.00 . A A . 29 LYS NZ 1 1 14 7303 1 1 29 LYS O O -14.754 -0.710 -7.367 1.00 . A A . 29 LYS O 1 1 14 7304 1 1 30 LYS C C -16.139 3.152 -8.293 1.00 . A A . 30 LYS C 1 1 14 7305 1 1 30 LYS CA C -15.915 1.890 -7.456 1.00 . A A . 30 LYS CA 1 1 14 7306 1 1 30 LYS CB C -16.345 2.013 -5.976 1.00 . A A . 30 LYS CB 1 1 14 7307 1 1 30 LYS CD C -18.653 3.116 -6.251 1.00 . A A . 30 LYS CD 1 1 14 7308 1 1 30 LYS CE C -20.144 2.978 -5.941 1.00 . A A . 30 LYS CE 1 1 14 7309 1 1 30 LYS CG C -17.863 1.905 -5.746 1.00 . A A . 30 LYS CG 1 1 14 7310 1 1 30 LYS H H -13.817 2.277 -7.615 1.00 . A A . 30 LYS H 1 1 14 7311 1 1 30 LYS HA H -16.487 1.080 -7.901 1.00 . A A . 30 LYS HA 1 1 14 7312 1 1 30 LYS HB2 H -15.891 1.193 -5.418 1.00 . A A . 30 LYS HB2 1 1 14 7313 1 1 30 LYS HB3 H -15.967 2.944 -5.549 1.00 . A A . 30 LYS HB3 1 1 14 7314 1 1 30 LYS HD2 H -18.262 4.019 -5.778 1.00 . A A . 30 LYS HD2 1 1 14 7315 1 1 30 LYS HD3 H -18.549 3.200 -7.331 1.00 . A A . 30 LYS HD3 1 1 14 7316 1 1 30 LYS HE2 H -20.556 2.163 -6.543 1.00 . A A . 30 LYS HE2 1 1 14 7317 1 1 30 LYS HE3 H -20.281 2.740 -4.883 1.00 . A A . 30 LYS HE3 1 1 14 7318 1 1 30 LYS HG2 H -18.235 1.002 -6.231 1.00 . A A . 30 LYS HG2 1 1 14 7319 1 1 30 LYS HG3 H -18.036 1.807 -4.673 1.00 . A A . 30 LYS HG3 1 1 14 7320 1 1 30 LYS HZ1 H -20.588 4.549 -7.202 1.00 . A A . 30 LYS HZ1 1 1 14 7321 1 1 30 LYS HZ2 H -20.558 4.978 -5.623 1.00 . A A . 30 LYS HZ2 1 1 14 7322 1 1 30 LYS HZ3 H -21.849 4.153 -6.214 1.00 . A A . 30 LYS HZ3 1 1 14 7323 1 1 30 LYS N N -14.495 1.527 -7.522 1.00 . A A . 30 LYS N 1 1 14 7324 1 1 30 LYS NZ N -20.839 4.239 -6.264 1.00 . A A . 30 LYS NZ 1 1 14 7325 1 1 30 LYS O O -15.833 4.264 -7.860 1.00 . A A . 30 LYS O 1 1 14 7326 1 1 31 LEU C C -17.489 3.368 -11.751 1.00 . A A . 31 LEU C 1 1 14 7327 1 1 31 LEU CA C -16.555 3.892 -10.651 1.00 . A A . 31 LEU CA 1 1 14 7328 1 1 31 LEU CB C -15.092 4.057 -11.130 1.00 . A A . 31 LEU CB 1 1 14 7329 1 1 31 LEU CD1 C -13.707 5.533 -12.641 1.00 . A A . 31 LEU CD1 1 1 14 7330 1 1 31 LEU CD2 C -14.614 3.411 -13.551 1.00 . A A . 31 LEU CD2 1 1 14 7331 1 1 31 LEU CG C -14.883 4.559 -12.575 1.00 . A A . 31 LEU CG 1 1 14 7332 1 1 31 LEU H H -16.919 2.013 -9.736 1.00 . A A . 31 LEU H 1 1 14 7333 1 1 31 LEU HA H -16.933 4.859 -10.315 1.00 . A A . 31 LEU HA 1 1 14 7334 1 1 31 LEU HB2 H -14.618 4.755 -10.441 1.00 . A A . 31 LEU HB2 1 1 14 7335 1 1 31 LEU HB3 H -14.570 3.105 -11.025 1.00 . A A . 31 LEU HB3 1 1 14 7336 1 1 31 LEU HD11 H -12.808 5.080 -12.232 1.00 . A A . 31 LEU HD11 1 1 14 7337 1 1 31 LEU HD12 H -13.947 6.431 -12.075 1.00 . A A . 31 LEU HD12 1 1 14 7338 1 1 31 LEU HD13 H -13.522 5.820 -13.676 1.00 . A A . 31 LEU HD13 1 1 14 7339 1 1 31 LEU HD21 H -13.724 2.868 -13.246 1.00 . A A . 31 LEU HD21 1 1 14 7340 1 1 31 LEU HD22 H -14.464 3.807 -14.554 1.00 . A A . 31 LEU HD22 1 1 14 7341 1 1 31 LEU HD23 H -15.461 2.727 -13.573 1.00 . A A . 31 LEU HD23 1 1 14 7342 1 1 31 LEU HG H -15.763 5.092 -12.914 1.00 . A A . 31 LEU HG 1 1 14 7343 1 1 31 LEU N N -16.561 2.942 -9.535 1.00 . A A . 31 LEU N 1 1 14 7344 1 1 31 LEU O O -17.517 2.167 -12.013 1.00 . A A . 31 LEU O 1 1 14 7345 1 1 32 LEU C C -18.588 4.169 -14.850 1.00 . A A . 32 LEU C 1 1 14 7346 1 1 32 LEU CA C -19.161 3.836 -13.478 1.00 . A A . 32 LEU CA 1 1 14 7347 1 1 32 LEU CB C -20.516 4.543 -13.226 1.00 . A A . 32 LEU CB 1 1 14 7348 1 1 32 LEU CD1 C -20.951 6.471 -14.857 1.00 . A A . 32 LEU CD1 1 1 14 7349 1 1 32 LEU CD2 C -21.366 6.769 -12.433 1.00 . A A . 32 LEU CD2 1 1 14 7350 1 1 32 LEU CG C -20.459 6.074 -13.456 1.00 . A A . 32 LEU CG 1 1 14 7351 1 1 32 LEU H H -18.095 5.240 -12.228 1.00 . A A . 32 LEU H 1 1 14 7352 1 1 32 LEU HA H -19.336 2.769 -13.434 1.00 . A A . 32 LEU HA 1 1 14 7353 1 1 32 LEU HB2 H -21.277 4.100 -13.871 1.00 . A A . 32 LEU HB2 1 1 14 7354 1 1 32 LEU HB3 H -20.801 4.327 -12.195 1.00 . A A . 32 LEU HB3 1 1 14 7355 1 1 32 LEU HD11 H -20.331 6.025 -15.633 1.00 . A A . 32 LEU HD11 1 1 14 7356 1 1 32 LEU HD12 H -20.904 7.556 -14.968 1.00 . A A . 32 LEU HD12 1 1 14 7357 1 1 32 LEU HD13 H -21.983 6.150 -15.000 1.00 . A A . 32 LEU HD13 1 1 14 7358 1 1 32 LEU HD21 H -21.037 6.520 -11.424 1.00 . A A . 32 LEU HD21 1 1 14 7359 1 1 32 LEU HD22 H -22.400 6.443 -12.556 1.00 . A A . 32 LEU HD22 1 1 14 7360 1 1 32 LEU HD23 H -21.312 7.851 -12.557 1.00 . A A . 32 LEU HD23 1 1 14 7361 1 1 32 LEU HG H -19.448 6.454 -13.312 1.00 . A A . 32 LEU HG 1 1 14 7362 1 1 32 LEU N N -18.218 4.253 -12.427 1.00 . A A . 32 LEU N 1 1 14 7363 1 1 32 LEU O O -18.595 3.362 -15.751 1.00 . A A . 32 LEU O 1 1 14 7364 1 1 32 LEU OXT O -18.174 5.134 -15.007 1.00 . A A . 32 LEU OXT 1 1 15 7365 1 1 1 GLY C C 2.569 -7.733 -0.991 1.00 . A A . 1 GLY C 1 1 15 7366 1 1 1 GLY CA C 3.428 -7.733 -2.235 1.00 . A A . 1 GLY CA 1 1 15 7367 1 1 1 GLY H1 H 3.096 -5.768 -2.760 1.00 . A A . 1 GLY H1 1 1 15 7368 1 1 1 GLY H2 H 3.387 -6.764 -4.042 1.00 . A A . 1 GLY H2 1 1 15 7369 1 1 1 GLY H3 H 1.925 -6.796 -3.274 1.00 . A A . 1 GLY H3 1 1 15 7370 1 1 1 GLY HA2 H 3.341 -8.708 -2.713 1.00 . A A . 1 GLY HA2 1 1 15 7371 1 1 1 GLY HA3 H 4.467 -7.542 -1.978 1.00 . A A . 1 GLY HA3 1 1 15 7372 1 1 1 GLY N N 2.923 -6.690 -3.147 1.00 . A A . 1 GLY N 1 1 15 7373 1 1 1 GLY O O 1.529 -8.391 -1.010 1.00 . A A . 1 GLY O 1 1 15 7374 1 1 2 PRO C C 0.851 -5.408 -0.367 1.00 . A A . 2 PRO C 1 1 15 7375 1 1 2 PRO CA C 1.746 -6.132 0.658 1.00 . A A . 2 PRO CA 1 1 15 7376 1 1 2 PRO CB C 2.436 -5.142 1.604 1.00 . A A . 2 PRO CB 1 1 15 7377 1 1 2 PRO CD C 4.092 -6.125 0.196 1.00 . A A . 2 PRO CD 1 1 15 7378 1 1 2 PRO CG C 3.715 -4.793 0.846 1.00 . A A . 2 PRO CG 1 1 15 7379 1 1 2 PRO HA H 1.140 -6.835 1.228 1.00 . A A . 2 PRO HA 1 1 15 7380 1 1 2 PRO HB2 H 1.828 -4.258 1.803 1.00 . A A . 2 PRO HB2 1 1 15 7381 1 1 2 PRO HB3 H 2.698 -5.642 2.537 1.00 . A A . 2 PRO HB3 1 1 15 7382 1 1 2 PRO HD2 H 4.646 -5.941 -0.723 1.00 . A A . 2 PRO HD2 1 1 15 7383 1 1 2 PRO HD3 H 4.705 -6.707 0.885 1.00 . A A . 2 PRO HD3 1 1 15 7384 1 1 2 PRO HG2 H 3.495 -4.054 0.076 1.00 . A A . 2 PRO HG2 1 1 15 7385 1 1 2 PRO HG3 H 4.497 -4.432 1.514 1.00 . A A . 2 PRO HG3 1 1 15 7386 1 1 2 PRO N N 2.834 -6.829 -0.030 1.00 . A A . 2 PRO N 1 1 15 7387 1 1 2 PRO O O 1.272 -5.159 -1.499 1.00 . A A . 2 PRO O 1 1 15 7388 1 1 3 TYR C C -2.232 -3.379 -0.086 1.00 . A A . 3 TYR C 1 1 15 7389 1 1 3 TYR CA C -1.365 -4.395 -0.839 1.00 . A A . 3 TYR CA 1 1 15 7390 1 1 3 TYR CB C -2.197 -5.418 -1.641 1.00 . A A . 3 TYR CB 1 1 15 7391 1 1 3 TYR CD1 C -1.058 -7.495 -2.535 1.00 . A A . 3 TYR CD1 1 1 15 7392 1 1 3 TYR CD2 C -1.172 -5.519 -3.960 1.00 . A A . 3 TYR CD2 1 1 15 7393 1 1 3 TYR CE1 C -0.408 -8.200 -3.564 1.00 . A A . 3 TYR CE1 1 1 15 7394 1 1 3 TYR CE2 C -0.534 -6.228 -4.995 1.00 . A A . 3 TYR CE2 1 1 15 7395 1 1 3 TYR CG C -1.450 -6.156 -2.734 1.00 . A A . 3 TYR CG 1 1 15 7396 1 1 3 TYR CZ C -0.167 -7.576 -4.804 1.00 . A A . 3 TYR CZ 1 1 15 7397 1 1 3 TYR H H -0.641 -5.219 0.984 1.00 . A A . 3 TYR H 1 1 15 7398 1 1 3 TYR HA H -0.816 -3.803 -1.573 1.00 . A A . 3 TYR HA 1 1 15 7399 1 1 3 TYR HB2 H -2.652 -6.132 -0.958 1.00 . A A . 3 TYR HB2 1 1 15 7400 1 1 3 TYR HB3 H -3.021 -4.902 -2.134 1.00 . A A . 3 TYR HB3 1 1 15 7401 1 1 3 TYR HD1 H -1.255 -7.987 -1.592 1.00 . A A . 3 TYR HD1 1 1 15 7402 1 1 3 TYR HD2 H -1.452 -4.486 -4.116 1.00 . A A . 3 TYR HD2 1 1 15 7403 1 1 3 TYR HE1 H -0.116 -9.229 -3.418 1.00 . A A . 3 TYR HE1 1 1 15 7404 1 1 3 TYR HE2 H -0.332 -5.743 -5.938 1.00 . A A . 3 TYR HE2 1 1 15 7405 1 1 3 TYR HH H 0.144 -7.933 -6.678 1.00 . A A . 3 TYR HH 1 1 15 7406 1 1 3 TYR N N -0.378 -5.066 0.019 1.00 . A A . 3 TYR N 1 1 15 7407 1 1 3 TYR O O -2.097 -3.252 1.131 1.00 . A A . 3 TYR O 1 1 15 7408 1 1 3 TYR OH O 0.429 -8.272 -5.806 1.00 . A A . 3 TYR OH 1 1 15 7409 1 1 4 CYS C C -5.580 -2.006 -0.573 1.00 . A A . 4 CYS C 1 1 15 7410 1 1 4 CYS CA C -4.118 -1.808 -0.129 1.00 . A A . 4 CYS CA 1 1 15 7411 1 1 4 CYS CB C -3.620 -0.351 -0.170 1.00 . A A . 4 CYS CB 1 1 15 7412 1 1 4 CYS H H -3.179 -2.798 -1.778 1.00 . A A . 4 CYS H 1 1 15 7413 1 1 4 CYS HA H -4.136 -2.078 0.927 1.00 . A A . 4 CYS HA 1 1 15 7414 1 1 4 CYS HB2 H -4.480 0.313 -0.146 1.00 . A A . 4 CYS HB2 1 1 15 7415 1 1 4 CYS HB3 H -3.085 -0.176 0.761 1.00 . A A . 4 CYS HB3 1 1 15 7416 1 1 4 CYS N N -3.163 -2.710 -0.774 1.00 . A A . 4 CYS N 1 1 15 7417 1 1 4 CYS O O -6.396 -2.483 0.214 1.00 . A A . 4 CYS O 1 1 15 7418 1 1 4 CYS SG S -2.510 0.203 -1.504 1.00 . A A . 4 CYS SG 1 1 15 7419 1 1 5 GLN C C -7.878 -3.264 -2.244 1.00 . A A . 5 GLN C 1 1 15 7420 1 1 5 GLN CA C -7.307 -1.838 -2.339 1.00 . A A . 5 GLN CA 1 1 15 7421 1 1 5 GLN CB C -7.354 -1.228 -3.753 1.00 . A A . 5 GLN CB 1 1 15 7422 1 1 5 GLN CD C -7.943 -3.038 -5.482 1.00 . A A . 5 GLN CD 1 1 15 7423 1 1 5 GLN CG C -8.392 -1.780 -4.740 1.00 . A A . 5 GLN CG 1 1 15 7424 1 1 5 GLN H H -5.221 -1.352 -2.454 1.00 . A A . 5 GLN H 1 1 15 7425 1 1 5 GLN HA H -7.953 -1.229 -1.704 1.00 . A A . 5 GLN HA 1 1 15 7426 1 1 5 GLN HB2 H -7.571 -0.168 -3.623 1.00 . A A . 5 GLN HB2 1 1 15 7427 1 1 5 GLN HB3 H -6.370 -1.306 -4.217 1.00 . A A . 5 GLN HB3 1 1 15 7428 1 1 5 GLN HE21 H -6.239 -2.203 -6.281 1.00 . A A . 5 GLN HE21 1 1 15 7429 1 1 5 GLN HE22 H -6.551 -3.910 -6.587 1.00 . A A . 5 GLN HE22 1 1 15 7430 1 1 5 GLN HG2 H -9.319 -1.982 -4.206 1.00 . A A . 5 GLN HG2 1 1 15 7431 1 1 5 GLN HG3 H -8.605 -1.020 -5.489 1.00 . A A . 5 GLN HG3 1 1 15 7432 1 1 5 GLN N N -5.926 -1.726 -1.833 1.00 . A A . 5 GLN N 1 1 15 7433 1 1 5 GLN NE2 N -6.805 -3.048 -6.142 1.00 . A A . 5 GLN NE2 1 1 15 7434 1 1 5 GLN O O -9.048 -3.448 -1.907 1.00 . A A . 5 GLN O 1 1 15 7435 1 1 5 GLN OE1 O -8.533 -4.096 -5.327 1.00 . A A . 5 GLN OE1 1 1 15 7436 1 1 6 LYS C C -7.601 -6.067 -0.743 1.00 . A A . 6 LYS C 1 1 15 7437 1 1 6 LYS CA C -7.388 -5.680 -2.220 1.00 . A A . 6 LYS CA 1 1 15 7438 1 1 6 LYS CB C -6.337 -6.553 -2.937 1.00 . A A . 6 LYS CB 1 1 15 7439 1 1 6 LYS CD C -5.826 -8.895 -3.829 1.00 . A A . 6 LYS CD 1 1 15 7440 1 1 6 LYS CE C -6.066 -10.374 -3.514 1.00 . A A . 6 LYS CE 1 1 15 7441 1 1 6 LYS CG C -6.613 -8.059 -2.811 1.00 . A A . 6 LYS CG 1 1 15 7442 1 1 6 LYS H H -6.092 -4.060 -2.739 1.00 . A A . 6 LYS H 1 1 15 7443 1 1 6 LYS HA H -8.345 -5.853 -2.719 1.00 . A A . 6 LYS HA 1 1 15 7444 1 1 6 LYS HB2 H -6.341 -6.284 -3.996 1.00 . A A . 6 LYS HB2 1 1 15 7445 1 1 6 LYS HB3 H -5.345 -6.343 -2.533 1.00 . A A . 6 LYS HB3 1 1 15 7446 1 1 6 LYS HD2 H -6.170 -8.663 -4.835 1.00 . A A . 6 LYS HD2 1 1 15 7447 1 1 6 LYS HD3 H -4.763 -8.668 -3.764 1.00 . A A . 6 LYS HD3 1 1 15 7448 1 1 6 LYS HE2 H -5.608 -10.607 -2.547 1.00 . A A . 6 LYS HE2 1 1 15 7449 1 1 6 LYS HE3 H -7.142 -10.542 -3.418 1.00 . A A . 6 LYS HE3 1 1 15 7450 1 1 6 LYS HG2 H -6.352 -8.384 -1.804 1.00 . A A . 6 LYS HG2 1 1 15 7451 1 1 6 LYS HG3 H -7.676 -8.243 -2.967 1.00 . A A . 6 LYS HG3 1 1 15 7452 1 1 6 LYS HZ1 H -5.537 -12.229 -4.186 1.00 . A A . 6 LYS HZ1 1 1 15 7453 1 1 6 LYS HZ2 H -4.572 -11.067 -4.809 1.00 . A A . 6 LYS HZ2 1 1 15 7454 1 1 6 LYS HZ3 H -6.120 -11.282 -5.385 1.00 . A A . 6 LYS HZ3 1 1 15 7455 1 1 6 LYS N N -7.022 -4.276 -2.415 1.00 . A A . 6 LYS N 1 1 15 7456 1 1 6 LYS NZ N -5.533 -11.280 -4.554 1.00 . A A . 6 LYS NZ 1 1 15 7457 1 1 6 LYS O O -8.286 -7.055 -0.496 1.00 . A A . 6 LYS O 1 1 15 7458 1 1 7 TRP C C -6.896 -4.822 2.682 1.00 . A A . 7 TRP C 1 1 15 7459 1 1 7 TRP CA C -6.706 -5.865 1.548 1.00 . A A . 7 TRP CA 1 1 15 7460 1 1 7 TRP CB C -5.253 -6.404 1.424 1.00 . A A . 7 TRP CB 1 1 15 7461 1 1 7 TRP CD1 C -5.632 -8.395 3.000 1.00 . A A . 7 TRP CD1 1 1 15 7462 1 1 7 TRP CD2 C -3.576 -8.362 2.107 1.00 . A A . 7 TRP CD2 1 1 15 7463 1 1 7 TRP CE2 C -3.662 -9.540 2.906 1.00 . A A . 7 TRP CE2 1 1 15 7464 1 1 7 TRP CE3 C -2.343 -8.137 1.451 1.00 . A A . 7 TRP CE3 1 1 15 7465 1 1 7 TRP CG C -4.858 -7.651 2.173 1.00 . A A . 7 TRP CG 1 1 15 7466 1 1 7 TRP CH2 C -1.398 -10.206 2.347 1.00 . A A . 7 TRP CH2 1 1 15 7467 1 1 7 TRP CZ2 C -2.596 -10.443 3.044 1.00 . A A . 7 TRP CZ2 1 1 15 7468 1 1 7 TRP CZ3 C -1.274 -9.050 1.556 1.00 . A A . 7 TRP CZ3 1 1 15 7469 1 1 7 TRP H H -6.687 -4.409 -0.010 1.00 . A A . 7 TRP H 1 1 15 7470 1 1 7 TRP HA H -7.376 -6.697 1.763 1.00 . A A . 7 TRP HA 1 1 15 7471 1 1 7 TRP HB2 H -5.065 -6.647 0.377 1.00 . A A . 7 TRP HB2 1 1 15 7472 1 1 7 TRP HB3 H -4.543 -5.612 1.668 1.00 . A A . 7 TRP HB3 1 1 15 7473 1 1 7 TRP HD1 H -6.660 -8.180 3.268 1.00 . A A . 7 TRP HD1 1 1 15 7474 1 1 7 TRP HE1 H -5.299 -10.167 4.109 1.00 . A A . 7 TRP HE1 1 1 15 7475 1 1 7 TRP HE3 H -2.226 -7.242 0.863 1.00 . A A . 7 TRP HE3 1 1 15 7476 1 1 7 TRP HH2 H -0.565 -10.895 2.431 1.00 . A A . 7 TRP HH2 1 1 15 7477 1 1 7 TRP HZ2 H -2.708 -11.314 3.676 1.00 . A A . 7 TRP HZ2 1 1 15 7478 1 1 7 TRP HZ3 H -0.344 -8.861 1.033 1.00 . A A . 7 TRP HZ3 1 1 15 7479 1 1 7 TRP N N -7.066 -5.315 0.230 1.00 . A A . 7 TRP N 1 1 15 7480 1 1 7 TRP NE1 N -4.927 -9.496 3.440 1.00 . A A . 7 TRP NE1 1 1 15 7481 1 1 7 TRP O O -5.951 -4.437 3.368 1.00 . A A . 7 TRP O 1 1 15 7482 1 1 8 MET C C -7.820 -2.435 4.618 1.00 . A A . 8 MET C 1 1 15 7483 1 1 8 MET CA C -8.601 -3.688 4.143 1.00 . A A . 8 MET CA 1 1 15 7484 1 1 8 MET CB C -8.875 -4.715 5.261 1.00 . A A . 8 MET CB 1 1 15 7485 1 1 8 MET CE C -12.347 -6.972 5.480 1.00 . A A . 8 MET CE 1 1 15 7486 1 1 8 MET CG C -10.024 -5.648 4.861 1.00 . A A . 8 MET CG 1 1 15 7487 1 1 8 MET H H -8.867 -4.719 2.289 1.00 . A A . 8 MET H 1 1 15 7488 1 1 8 MET HA H -9.581 -3.293 3.897 1.00 . A A . 8 MET HA 1 1 15 7489 1 1 8 MET HB2 H -7.977 -5.294 5.478 1.00 . A A . 8 MET HB2 1 1 15 7490 1 1 8 MET HB3 H -9.181 -4.190 6.167 1.00 . A A . 8 MET HB3 1 1 15 7491 1 1 8 MET HE1 H -12.922 -6.049 5.411 1.00 . A A . 8 MET HE1 1 1 15 7492 1 1 8 MET HE2 H -12.220 -7.385 4.480 1.00 . A A . 8 MET HE2 1 1 15 7493 1 1 8 MET HE3 H -12.885 -7.689 6.100 1.00 . A A . 8 MET HE3 1 1 15 7494 1 1 8 MET HG2 H -10.829 -5.039 4.449 1.00 . A A . 8 MET HG2 1 1 15 7495 1 1 8 MET HG3 H -9.683 -6.327 4.080 1.00 . A A . 8 MET HG3 1 1 15 7496 1 1 8 MET N N -8.138 -4.370 2.910 1.00 . A A . 8 MET N 1 1 15 7497 1 1 8 MET O O -7.702 -2.180 5.815 1.00 . A A . 8 MET O 1 1 15 7498 1 1 8 MET SD S -10.725 -6.628 6.211 1.00 . A A . 8 MET SD 1 1 15 7499 1 1 9 GLN C C -6.766 0.739 4.721 1.00 . A A . 9 GLN C 1 1 15 7500 1 1 9 GLN CA C -6.358 -0.515 3.900 1.00 . A A . 9 GLN CA 1 1 15 7501 1 1 9 GLN CB C -5.858 -0.068 2.522 1.00 . A A . 9 GLN CB 1 1 15 7502 1 1 9 GLN CD C -6.529 1.962 1.121 1.00 . A A . 9 GLN CD 1 1 15 7503 1 1 9 GLN CG C -6.958 0.619 1.687 1.00 . A A . 9 GLN CG 1 1 15 7504 1 1 9 GLN H H -7.424 -1.938 2.732 1.00 . A A . 9 GLN H 1 1 15 7505 1 1 9 GLN HA H -5.508 -0.949 4.429 1.00 . A A . 9 GLN HA 1 1 15 7506 1 1 9 GLN HB2 H -4.995 0.589 2.639 1.00 . A A . 9 GLN HB2 1 1 15 7507 1 1 9 GLN HB3 H -5.510 -0.949 2.005 1.00 . A A . 9 GLN HB3 1 1 15 7508 1 1 9 GLN HE21 H -6.308 2.765 2.961 1.00 . A A . 9 GLN HE21 1 1 15 7509 1 1 9 GLN HE22 H -5.897 3.817 1.612 1.00 . A A . 9 GLN HE22 1 1 15 7510 1 1 9 GLN HG2 H -7.252 -0.034 0.866 1.00 . A A . 9 GLN HG2 1 1 15 7511 1 1 9 GLN HG3 H -7.841 0.797 2.296 1.00 . A A . 9 GLN HG3 1 1 15 7512 1 1 9 GLN N N -7.328 -1.614 3.685 1.00 . A A . 9 GLN N 1 1 15 7513 1 1 9 GLN NE2 N -6.248 2.930 1.965 1.00 . A A . 9 GLN NE2 1 1 15 7514 1 1 9 GLN O O -6.105 1.772 4.583 1.00 . A A . 9 GLN O 1 1 15 7515 1 1 9 GLN OE1 O -6.219 2.068 -0.055 1.00 . A A . 9 GLN OE1 1 1 15 7516 1 1 10 THR C C -7.937 3.166 6.150 1.00 . A A . 10 THR C 1 1 15 7517 1 1 10 THR CA C -8.057 1.702 6.609 1.00 . A A . 10 THR CA 1 1 15 7518 1 1 10 THR CB C -7.127 1.365 7.790 1.00 . A A . 10 THR CB 1 1 15 7519 1 1 10 THR CG2 C -7.526 2.025 9.098 1.00 . A A . 10 THR CG2 1 1 15 7520 1 1 10 THR H H -8.302 -0.178 5.634 1.00 . A A . 10 THR H 1 1 15 7521 1 1 10 THR HA H -9.077 1.585 6.971 1.00 . A A . 10 THR HA 1 1 15 7522 1 1 10 THR HB H -6.102 1.632 7.535 1.00 . A A . 10 THR HB 1 1 15 7523 1 1 10 THR HG1 H -6.365 -0.289 8.459 1.00 . A A . 10 THR HG1 1 1 15 7524 1 1 10 THR HG21 H -8.389 1.523 9.523 1.00 . A A . 10 THR HG21 1 1 15 7525 1 1 10 THR HG22 H -7.789 3.065 8.932 1.00 . A A . 10 THR HG22 1 1 15 7526 1 1 10 THR HG23 H -6.698 1.977 9.805 1.00 . A A . 10 THR HG23 1 1 15 7527 1 1 10 THR N N -7.830 0.712 5.527 1.00 . A A . 10 THR N 1 1 15 7528 1 1 10 THR O O -7.013 3.886 6.542 1.00 . A A . 10 THR O 1 1 15 7529 1 1 10 THR OG1 O -7.203 -0.021 8.040 1.00 . A A . 10 THR OG1 1 1 15 7530 1 1 11 CYS C C -9.205 6.051 5.217 1.00 . A A . 11 CYS C 1 1 15 7531 1 1 11 CYS CA C -8.639 4.831 4.463 1.00 . A A . 11 CYS CA 1 1 15 7532 1 1 11 CYS CB C -9.184 4.655 3.041 1.00 . A A . 11 CYS CB 1 1 15 7533 1 1 11 CYS H H -9.552 2.968 4.948 1.00 . A A . 11 CYS H 1 1 15 7534 1 1 11 CYS HA H -7.571 5.018 4.353 1.00 . A A . 11 CYS HA 1 1 15 7535 1 1 11 CYS HB2 H -8.881 3.677 2.669 1.00 . A A . 11 CYS HB2 1 1 15 7536 1 1 11 CYS HB3 H -10.273 4.692 3.052 1.00 . A A . 11 CYS HB3 1 1 15 7537 1 1 11 CYS N N -8.789 3.575 5.204 1.00 . A A . 11 CYS N 1 1 15 7538 1 1 11 CYS O O -10.187 6.665 4.803 1.00 . A A . 11 CYS O 1 1 15 7539 1 1 11 CYS SG S -8.543 5.887 1.879 1.00 . A A . 11 CYS SG 1 1 15 7540 1 1 12 ASP C C -8.440 8.854 6.323 1.00 . A A . 12 ASP C 1 1 15 7541 1 1 12 ASP CA C -8.895 7.604 7.095 1.00 . A A . 12 ASP CA 1 1 15 7542 1 1 12 ASP CB C -8.265 7.544 8.487 1.00 . A A . 12 ASP CB 1 1 15 7543 1 1 12 ASP CG C -8.979 6.555 9.406 1.00 . A A . 12 ASP CG 1 1 15 7544 1 1 12 ASP H H -7.876 5.772 6.704 1.00 . A A . 12 ASP H 1 1 15 7545 1 1 12 ASP HA H -9.973 7.701 7.229 1.00 . A A . 12 ASP HA 1 1 15 7546 1 1 12 ASP HB2 H -7.206 7.291 8.400 1.00 . A A . 12 ASP HB2 1 1 15 7547 1 1 12 ASP HB3 H -8.343 8.534 8.935 1.00 . A A . 12 ASP HB3 1 1 15 7548 1 1 12 ASP N N -8.640 6.350 6.384 1.00 . A A . 12 ASP N 1 1 15 7549 1 1 12 ASP O O -7.636 8.748 5.396 1.00 . A A . 12 ASP O 1 1 15 7550 1 1 12 ASP OD1 O -10.100 6.886 9.862 1.00 . A A . 12 ASP OD1 1 1 15 7551 1 1 12 ASP OD2 O -8.417 5.467 9.676 1.00 . A A . 12 ASP OD2 1 1 15 7552 1 1 13 SER C C -7.001 11.589 5.852 1.00 . A A . 13 SER C 1 1 15 7553 1 1 13 SER CA C -8.495 11.327 6.081 1.00 . A A . 13 SER CA 1 1 15 7554 1 1 13 SER CB C -9.093 12.520 6.835 1.00 . A A . 13 SER CB 1 1 15 7555 1 1 13 SER H H -9.464 10.094 7.549 1.00 . A A . 13 SER H 1 1 15 7556 1 1 13 SER HA H -8.947 11.313 5.089 1.00 . A A . 13 SER HA 1 1 15 7557 1 1 13 SER HB2 H -8.539 13.429 6.596 1.00 . A A . 13 SER HB2 1 1 15 7558 1 1 13 SER HB3 H -10.119 12.659 6.497 1.00 . A A . 13 SER HB3 1 1 15 7559 1 1 13 SER HG H -8.165 12.369 8.581 1.00 . A A . 13 SER HG 1 1 15 7560 1 1 13 SER N N -8.849 10.054 6.745 1.00 . A A . 13 SER N 1 1 15 7561 1 1 13 SER O O -6.652 12.317 4.923 1.00 . A A . 13 SER O 1 1 15 7562 1 1 13 SER OG O -9.092 12.317 8.242 1.00 . A A . 13 SER OG 1 1 15 7563 1 1 14 GLU C C -3.971 9.950 5.797 1.00 . A A . 14 GLU C 1 1 15 7564 1 1 14 GLU CA C -4.653 11.134 6.518 1.00 . A A . 14 GLU CA 1 1 15 7565 1 1 14 GLU CB C -4.001 11.427 7.879 1.00 . A A . 14 GLU CB 1 1 15 7566 1 1 14 GLU CD C -4.056 10.793 10.320 1.00 . A A . 14 GLU CD 1 1 15 7567 1 1 14 GLU CG C -4.141 10.277 8.883 1.00 . A A . 14 GLU CG 1 1 15 7568 1 1 14 GLU H H -6.473 10.469 7.440 1.00 . A A . 14 GLU H 1 1 15 7569 1 1 14 GLU HA H -4.462 12.006 5.895 1.00 . A A . 14 GLU HA 1 1 15 7570 1 1 14 GLU HB2 H -2.943 11.647 7.740 1.00 . A A . 14 GLU HB2 1 1 15 7571 1 1 14 GLU HB3 H -4.464 12.326 8.287 1.00 . A A . 14 GLU HB3 1 1 15 7572 1 1 14 GLU HG2 H -5.101 9.776 8.745 1.00 . A A . 14 GLU HG2 1 1 15 7573 1 1 14 GLU HG3 H -3.355 9.542 8.700 1.00 . A A . 14 GLU HG3 1 1 15 7574 1 1 14 GLU N N -6.113 11.012 6.667 1.00 . A A . 14 GLU N 1 1 15 7575 1 1 14 GLU O O -2.736 9.935 5.679 1.00 . A A . 14 GLU O 1 1 15 7576 1 1 14 GLU OE1 O -5.112 10.854 10.988 1.00 . A A . 14 GLU OE1 1 1 15 7577 1 1 14 GLU OE2 O -2.937 11.096 10.800 1.00 . A A . 14 GLU OE2 1 1 15 7578 1 1 15 ARG C C -4.338 8.083 3.014 1.00 . A A . 15 ARG C 1 1 15 7579 1 1 15 ARG CA C -4.213 7.820 4.520 1.00 . A A . 15 ARG CA 1 1 15 7580 1 1 15 ARG CB C -4.929 6.518 4.945 1.00 . A A . 15 ARG CB 1 1 15 7581 1 1 15 ARG CD C -3.310 4.652 4.428 1.00 . A A . 15 ARG CD 1 1 15 7582 1 1 15 ARG CG C -3.966 5.483 5.563 1.00 . A A . 15 ARG CG 1 1 15 7583 1 1 15 ARG CZ C -2.572 2.784 5.890 1.00 . A A . 15 ARG CZ 1 1 15 7584 1 1 15 ARG H H -5.740 9.054 5.377 1.00 . A A . 15 ARG H 1 1 15 7585 1 1 15 ARG HA H -3.154 7.701 4.734 1.00 . A A . 15 ARG HA 1 1 15 7586 1 1 15 ARG HB2 H -5.682 6.753 5.700 1.00 . A A . 15 ARG HB2 1 1 15 7587 1 1 15 ARG HB3 H -5.460 6.077 4.100 1.00 . A A . 15 ARG HB3 1 1 15 7588 1 1 15 ARG HD2 H -4.067 4.053 3.935 1.00 . A A . 15 ARG HD2 1 1 15 7589 1 1 15 ARG HD3 H -2.802 5.314 3.742 1.00 . A A . 15 ARG HD3 1 1 15 7590 1 1 15 ARG HE H -1.319 4.021 4.955 1.00 . A A . 15 ARG HE 1 1 15 7591 1 1 15 ARG HG2 H -3.211 5.985 6.170 1.00 . A A . 15 ARG HG2 1 1 15 7592 1 1 15 ARG HG3 H -4.543 4.827 6.212 1.00 . A A . 15 ARG HG3 1 1 15 7593 1 1 15 ARG HH11 H -4.545 2.589 5.480 1.00 . A A . 15 ARG HH11 1 1 15 7594 1 1 15 ARG HH12 H -3.906 1.683 6.845 1.00 . A A . 15 ARG HH12 1 1 15 7595 1 1 15 ARG HH21 H -0.680 2.493 6.578 1.00 . A A . 15 ARG HH21 1 1 15 7596 1 1 15 ARG HH22 H -1.968 1.581 7.342 1.00 . A A . 15 ARG HH22 1 1 15 7597 1 1 15 ARG N N -4.726 8.958 5.307 1.00 . A A . 15 ARG N 1 1 15 7598 1 1 15 ARG NE N -2.298 3.778 5.058 1.00 . A A . 15 ARG NE 1 1 15 7599 1 1 15 ARG NH1 N -3.765 2.298 6.054 1.00 . A A . 15 ARG NH1 1 1 15 7600 1 1 15 ARG NH2 N -1.659 2.235 6.634 1.00 . A A . 15 ARG NH2 1 1 15 7601 1 1 15 ARG O O -5.203 8.831 2.558 1.00 . A A . 15 ARG O 1 1 15 7602 1 1 16 LYS C C -4.913 6.329 0.524 1.00 . A A . 16 LYS C 1 1 15 7603 1 1 16 LYS CA C -3.703 7.230 0.777 1.00 . A A . 16 LYS CA 1 1 15 7604 1 1 16 LYS CB C -2.472 6.606 0.092 1.00 . A A . 16 LYS CB 1 1 15 7605 1 1 16 LYS CD C -0.104 6.966 -0.677 1.00 . A A . 16 LYS CD 1 1 15 7606 1 1 16 LYS CE C 1.313 7.378 -0.273 1.00 . A A . 16 LYS CE 1 1 15 7607 1 1 16 LYS CG C -1.141 7.295 0.407 1.00 . A A . 16 LYS CG 1 1 15 7608 1 1 16 LYS H H -2.747 6.899 2.662 1.00 . A A . 16 LYS H 1 1 15 7609 1 1 16 LYS HA H -3.901 8.197 0.318 1.00 . A A . 16 LYS HA 1 1 15 7610 1 1 16 LYS HB2 H -2.391 5.555 0.377 1.00 . A A . 16 LYS HB2 1 1 15 7611 1 1 16 LYS HB3 H -2.636 6.642 -0.986 1.00 . A A . 16 LYS HB3 1 1 15 7612 1 1 16 LYS HD2 H -0.117 5.895 -0.891 1.00 . A A . 16 LYS HD2 1 1 15 7613 1 1 16 LYS HD3 H -0.373 7.499 -1.592 1.00 . A A . 16 LYS HD3 1 1 15 7614 1 1 16 LYS HE2 H 1.958 7.306 -1.153 1.00 . A A . 16 LYS HE2 1 1 15 7615 1 1 16 LYS HE3 H 1.309 8.425 0.045 1.00 . A A . 16 LYS HE3 1 1 15 7616 1 1 16 LYS HG2 H -1.280 8.373 0.450 1.00 . A A . 16 LYS HG2 1 1 15 7617 1 1 16 LYS HG3 H -0.798 6.950 1.379 1.00 . A A . 16 LYS HG3 1 1 15 7618 1 1 16 LYS HZ1 H 2.843 6.673 0.943 1.00 . A A . 16 LYS HZ1 1 1 15 7619 1 1 16 LYS HZ2 H 1.763 5.532 0.549 1.00 . A A . 16 LYS HZ2 1 1 15 7620 1 1 16 LYS HZ3 H 1.372 6.658 1.688 1.00 . A A . 16 LYS HZ3 1 1 15 7621 1 1 16 LYS N N -3.492 7.414 2.223 1.00 . A A . 16 LYS N 1 1 15 7622 1 1 16 LYS NZ N 1.850 6.513 0.802 1.00 . A A . 16 LYS NZ 1 1 15 7623 1 1 16 LYS O O -5.259 5.497 1.362 1.00 . A A . 16 LYS O 1 1 15 7624 1 1 17 CYS C C -5.601 4.655 -2.487 1.00 . A A . 17 CYS C 1 1 15 7625 1 1 17 CYS CA C -6.273 5.326 -1.283 1.00 . A A . 17 CYS CA 1 1 15 7626 1 1 17 CYS CB C -7.599 5.991 -1.651 1.00 . A A . 17 CYS CB 1 1 15 7627 1 1 17 CYS H H -4.992 7.021 -1.355 1.00 . A A . 17 CYS H 1 1 15 7628 1 1 17 CYS HA H -6.478 4.564 -0.533 1.00 . A A . 17 CYS HA 1 1 15 7629 1 1 17 CYS HB2 H -7.990 6.507 -0.775 1.00 . A A . 17 CYS HB2 1 1 15 7630 1 1 17 CYS HB3 H -7.419 6.744 -2.419 1.00 . A A . 17 CYS HB3 1 1 15 7631 1 1 17 CYS N N -5.377 6.332 -0.720 1.00 . A A . 17 CYS N 1 1 15 7632 1 1 17 CYS O O -5.236 5.343 -3.438 1.00 . A A . 17 CYS O 1 1 15 7633 1 1 17 CYS SG S -8.863 4.844 -2.244 1.00 . A A . 17 CYS SG 1 1 15 7634 1 1 18 CYS C C -4.696 2.887 -4.842 1.00 . A A . 18 CYS C 1 1 15 7635 1 1 18 CYS CA C -4.555 2.560 -3.342 1.00 . A A . 18 CYS CA 1 1 15 7636 1 1 18 CYS CB C -4.883 1.079 -3.131 1.00 . A A . 18 CYS CB 1 1 15 7637 1 1 18 CYS H H -5.759 2.858 -1.615 1.00 . A A . 18 CYS H 1 1 15 7638 1 1 18 CYS HA H -3.523 2.741 -3.040 1.00 . A A . 18 CYS HA 1 1 15 7639 1 1 18 CYS HB2 H -5.343 0.951 -2.153 1.00 . A A . 18 CYS HB2 1 1 15 7640 1 1 18 CYS HB3 H -5.618 0.796 -3.879 1.00 . A A . 18 CYS HB3 1 1 15 7641 1 1 18 CYS N N -5.439 3.331 -2.455 1.00 . A A . 18 CYS N 1 1 15 7642 1 1 18 CYS O O -3.692 3.027 -5.537 1.00 . A A . 18 CYS O 1 1 15 7643 1 1 18 CYS SG S -3.519 -0.102 -3.241 1.00 . A A . 18 CYS SG 1 1 15 7644 1 1 19 GLU C C -7.089 4.677 -6.781 1.00 . A A . 19 GLU C 1 1 15 7645 1 1 19 GLU CA C -6.309 3.341 -6.702 1.00 . A A . 19 GLU CA 1 1 15 7646 1 1 19 GLU CB C -7.164 2.204 -7.306 1.00 . A A . 19 GLU CB 1 1 15 7647 1 1 19 GLU CD C -5.466 0.232 -7.214 1.00 . A A . 19 GLU CD 1 1 15 7648 1 1 19 GLU CG C -6.862 0.761 -6.878 1.00 . A A . 19 GLU CG 1 1 15 7649 1 1 19 GLU H H -6.692 2.882 -4.655 1.00 . A A . 19 GLU H 1 1 15 7650 1 1 19 GLU HA H -5.403 3.451 -7.303 1.00 . A A . 19 GLU HA 1 1 15 7651 1 1 19 GLU HB2 H -8.198 2.381 -7.011 1.00 . A A . 19 GLU HB2 1 1 15 7652 1 1 19 GLU HB3 H -7.111 2.269 -8.394 1.00 . A A . 19 GLU HB3 1 1 15 7653 1 1 19 GLU HG2 H -7.023 0.683 -5.803 1.00 . A A . 19 GLU HG2 1 1 15 7654 1 1 19 GLU HG3 H -7.596 0.113 -7.360 1.00 . A A . 19 GLU HG3 1 1 15 7655 1 1 19 GLU N N -5.941 3.018 -5.312 1.00 . A A . 19 GLU N 1 1 15 7656 1 1 19 GLU O O -7.745 4.970 -7.781 1.00 . A A . 19 GLU O 1 1 15 7657 1 1 19 GLU OE1 O -5.122 -0.851 -6.687 1.00 . A A . 19 GLU OE1 1 1 15 7658 1 1 19 GLU OE2 O -4.721 0.857 -8.004 1.00 . A A . 19 GLU OE2 1 1 15 7659 1 1 20 GLY C C -9.446 6.466 -5.221 1.00 . A A . 20 GLY C 1 1 15 7660 1 1 20 GLY CA C -7.945 6.639 -5.501 1.00 . A A . 20 GLY CA 1 1 15 7661 1 1 20 GLY H H -6.496 5.190 -4.934 1.00 . A A . 20 GLY H 1 1 15 7662 1 1 20 GLY HA2 H -7.523 7.203 -4.671 1.00 . A A . 20 GLY HA2 1 1 15 7663 1 1 20 GLY HA3 H -7.850 7.241 -6.405 1.00 . A A . 20 GLY HA3 1 1 15 7664 1 1 20 GLY N N -7.149 5.423 -5.673 1.00 . A A . 20 GLY N 1 1 15 7665 1 1 20 GLY O O -10.092 7.455 -4.884 1.00 . A A . 20 GLY O 1 1 15 7666 1 1 21 MET C C -12.024 4.249 -4.047 1.00 . A A . 21 MET C 1 1 15 7667 1 1 21 MET CA C -11.478 5.034 -5.262 1.00 . A A . 21 MET CA 1 1 15 7668 1 1 21 MET CB C -11.936 4.433 -6.599 1.00 . A A . 21 MET CB 1 1 15 7669 1 1 21 MET CE C -10.102 3.516 -9.310 1.00 . A A . 21 MET CE 1 1 15 7670 1 1 21 MET CG C -11.361 3.039 -6.880 1.00 . A A . 21 MET CG 1 1 15 7671 1 1 21 MET H H -9.427 4.481 -5.549 1.00 . A A . 21 MET H 1 1 15 7672 1 1 21 MET HA H -11.957 6.011 -5.219 1.00 . A A . 21 MET HA 1 1 15 7673 1 1 21 MET HB2 H -13.024 4.378 -6.618 1.00 . A A . 21 MET HB2 1 1 15 7674 1 1 21 MET HB3 H -11.626 5.113 -7.394 1.00 . A A . 21 MET HB3 1 1 15 7675 1 1 21 MET HE1 H -9.174 3.242 -8.821 1.00 . A A . 21 MET HE1 1 1 15 7676 1 1 21 MET HE2 H -9.987 3.305 -10.369 1.00 . A A . 21 MET HE2 1 1 15 7677 1 1 21 MET HE3 H -10.286 4.581 -9.173 1.00 . A A . 21 MET HE3 1 1 15 7678 1 1 21 MET HG2 H -10.315 3.006 -6.580 1.00 . A A . 21 MET HG2 1 1 15 7679 1 1 21 MET HG3 H -11.902 2.314 -6.271 1.00 . A A . 21 MET HG3 1 1 15 7680 1 1 21 MET N N -10.018 5.256 -5.299 1.00 . A A . 21 MET N 1 1 15 7681 1 1 21 MET O O -11.547 3.165 -3.695 1.00 . A A . 21 MET O 1 1 15 7682 1 1 21 MET SD S -11.458 2.535 -8.617 1.00 . A A . 21 MET SD 1 1 15 7683 1 1 22 VAL C C -13.216 4.135 -1.035 1.00 . A A . 22 VAL C 1 1 15 7684 1 1 22 VAL CA C -13.921 4.149 -2.399 1.00 . A A . 22 VAL CA 1 1 15 7685 1 1 22 VAL CB C -14.679 2.841 -2.743 1.00 . A A . 22 VAL CB 1 1 15 7686 1 1 22 VAL CG1 C -15.950 2.682 -1.895 1.00 . A A . 22 VAL CG1 1 1 15 7687 1 1 22 VAL CG2 C -15.104 2.744 -4.215 1.00 . A A . 22 VAL CG2 1 1 15 7688 1 1 22 VAL H H -13.470 5.632 -3.870 1.00 . A A . 22 VAL H 1 1 15 7689 1 1 22 VAL HA H -14.718 4.877 -2.247 1.00 . A A . 22 VAL HA 1 1 15 7690 1 1 22 VAL HB H -14.018 2.000 -2.543 1.00 . A A . 22 VAL HB 1 1 15 7691 1 1 22 VAL HG11 H -16.617 3.528 -2.061 1.00 . A A . 22 VAL HG11 1 1 15 7692 1 1 22 VAL HG12 H -16.466 1.759 -2.162 1.00 . A A . 22 VAL HG12 1 1 15 7693 1 1 22 VAL HG13 H -15.699 2.630 -0.837 1.00 . A A . 22 VAL HG13 1 1 15 7694 1 1 22 VAL HG21 H -15.698 3.617 -4.487 1.00 . A A . 22 VAL HG21 1 1 15 7695 1 1 22 VAL HG22 H -14.228 2.678 -4.857 1.00 . A A . 22 VAL HG22 1 1 15 7696 1 1 22 VAL HG23 H -15.709 1.851 -4.373 1.00 . A A . 22 VAL HG23 1 1 15 7697 1 1 22 VAL N N -13.154 4.738 -3.518 1.00 . A A . 22 VAL N 1 1 15 7698 1 1 22 VAL O O -13.297 3.164 -0.289 1.00 . A A . 22 VAL O 1 1 15 7699 1 1 23 CYS C C -12.820 5.550 1.770 1.00 . A A . 23 CYS C 1 1 15 7700 1 1 23 CYS CA C -11.850 5.482 0.568 1.00 . A A . 23 CYS CA 1 1 15 7701 1 1 23 CYS CB C -11.044 6.777 0.383 1.00 . A A . 23 CYS CB 1 1 15 7702 1 1 23 CYS H H -12.470 5.968 -1.405 1.00 . A A . 23 CYS H 1 1 15 7703 1 1 23 CYS HA H -11.155 4.669 0.758 1.00 . A A . 23 CYS HA 1 1 15 7704 1 1 23 CYS HB2 H -10.404 6.663 -0.492 1.00 . A A . 23 CYS HB2 1 1 15 7705 1 1 23 CYS HB3 H -11.742 7.588 0.172 1.00 . A A . 23 CYS HB3 1 1 15 7706 1 1 23 CYS N N -12.534 5.236 -0.708 1.00 . A A . 23 CYS N 1 1 15 7707 1 1 23 CYS O O -13.272 6.635 2.141 1.00 . A A . 23 CYS O 1 1 15 7708 1 1 23 CYS SG S -9.988 7.312 1.752 1.00 . A A . 23 CYS SG 1 1 15 7709 1 1 24 ARG C C -13.904 2.850 4.118 1.00 . A A . 24 ARG C 1 1 15 7710 1 1 24 ARG CA C -14.158 4.205 3.442 1.00 . A A . 24 ARG CA 1 1 15 7711 1 1 24 ARG CB C -15.644 4.254 3.024 1.00 . A A . 24 ARG CB 1 1 15 7712 1 1 24 ARG CD C -16.088 5.491 0.913 1.00 . A A . 24 ARG CD 1 1 15 7713 1 1 24 ARG CG C -16.224 5.553 2.449 1.00 . A A . 24 ARG CG 1 1 15 7714 1 1 24 ARG CZ C -16.356 7.889 0.343 1.00 . A A . 24 ARG CZ 1 1 15 7715 1 1 24 ARG H H -12.892 3.547 1.836 1.00 . A A . 24 ARG H 1 1 15 7716 1 1 24 ARG HA H -13.978 4.993 4.176 1.00 . A A . 24 ARG HA 1 1 15 7717 1 1 24 ARG HB2 H -15.855 3.434 2.335 1.00 . A A . 24 ARG HB2 1 1 15 7718 1 1 24 ARG HB3 H -16.210 4.061 3.931 1.00 . A A . 24 ARG HB3 1 1 15 7719 1 1 24 ARG HD2 H -15.060 5.520 0.607 1.00 . A A . 24 ARG HD2 1 1 15 7720 1 1 24 ARG HD3 H -16.564 4.595 0.549 1.00 . A A . 24 ARG HD3 1 1 15 7721 1 1 24 ARG HE H -17.783 6.511 0.150 1.00 . A A . 24 ARG HE 1 1 15 7722 1 1 24 ARG HG2 H -17.285 5.597 2.701 1.00 . A A . 24 ARG HG2 1 1 15 7723 1 1 24 ARG HG3 H -15.727 6.421 2.882 1.00 . A A . 24 ARG HG3 1 1 15 7724 1 1 24 ARG HH11 H -14.610 7.569 1.313 1.00 . A A . 24 ARG HH11 1 1 15 7725 1 1 24 ARG HH12 H -14.873 9.196 0.736 1.00 . A A . 24 ARG HH12 1 1 15 7726 1 1 24 ARG HH21 H -17.952 8.553 -0.676 1.00 . A A . 24 ARG HH21 1 1 15 7727 1 1 24 ARG HH22 H -16.869 9.788 -0.091 1.00 . A A . 24 ARG HH22 1 1 15 7728 1 1 24 ARG N N -13.247 4.388 2.289 1.00 . A A . 24 ARG N 1 1 15 7729 1 1 24 ARG NE N -16.806 6.648 0.383 1.00 . A A . 24 ARG NE 1 1 15 7730 1 1 24 ARG NH1 N -15.189 8.233 0.810 1.00 . A A . 24 ARG NH1 1 1 15 7731 1 1 24 ARG NH2 N -17.100 8.812 -0.192 1.00 . A A . 24 ARG NH2 1 1 15 7732 1 1 24 ARG O O -14.285 1.822 3.564 1.00 . A A . 24 ARG O 1 1 15 7733 1 1 25 LEU C C -11.652 0.803 5.235 1.00 . A A . 25 LEU C 1 1 15 7734 1 1 25 LEU CA C -12.684 1.657 6.002 1.00 . A A . 25 LEU CA 1 1 15 7735 1 1 25 LEU CB C -13.828 0.799 6.580 1.00 . A A . 25 LEU CB 1 1 15 7736 1 1 25 LEU CD1 C -15.954 0.592 7.886 1.00 . A A . 25 LEU CD1 1 1 15 7737 1 1 25 LEU CD2 C -14.297 2.307 8.582 1.00 . A A . 25 LEU CD2 1 1 15 7738 1 1 25 LEU CG C -14.895 1.572 7.381 1.00 . A A . 25 LEU CG 1 1 15 7739 1 1 25 LEU H H -12.941 3.733 5.625 1.00 . A A . 25 LEU H 1 1 15 7740 1 1 25 LEU HA H -12.134 2.060 6.853 1.00 . A A . 25 LEU HA 1 1 15 7741 1 1 25 LEU HB2 H -14.326 0.286 5.756 1.00 . A A . 25 LEU HB2 1 1 15 7742 1 1 25 LEU HB3 H -13.391 0.035 7.224 1.00 . A A . 25 LEU HB3 1 1 15 7743 1 1 25 LEU HD11 H -16.439 0.106 7.039 1.00 . A A . 25 LEU HD11 1 1 15 7744 1 1 25 LEU HD12 H -16.705 1.115 8.473 1.00 . A A . 25 LEU HD12 1 1 15 7745 1 1 25 LEU HD13 H -15.490 -0.164 8.518 1.00 . A A . 25 LEU HD13 1 1 15 7746 1 1 25 LEU HD21 H -15.093 2.760 9.173 1.00 . A A . 25 LEU HD21 1 1 15 7747 1 1 25 LEU HD22 H -13.632 3.103 8.246 1.00 . A A . 25 LEU HD22 1 1 15 7748 1 1 25 LEU HD23 H -13.742 1.609 9.208 1.00 . A A . 25 LEU HD23 1 1 15 7749 1 1 25 LEU HG H -15.388 2.298 6.737 1.00 . A A . 25 LEU HG 1 1 15 7750 1 1 25 LEU N N -13.218 2.825 5.264 1.00 . A A . 25 LEU N 1 1 15 7751 1 1 25 LEU O O -10.787 0.167 5.842 1.00 . A A . 25 LEU O 1 1 15 7752 1 1 26 TRP C C -10.659 1.233 1.714 1.00 . A A . 26 TRP C 1 1 15 7753 1 1 26 TRP CA C -10.739 0.294 2.940 1.00 . A A . 26 TRP CA 1 1 15 7754 1 1 26 TRP CB C -11.214 -1.137 2.566 1.00 . A A . 26 TRP CB 1 1 15 7755 1 1 26 TRP CD1 C -12.471 -2.333 4.443 1.00 . A A . 26 TRP CD1 1 1 15 7756 1 1 26 TRP CD2 C -13.824 -1.441 2.898 1.00 . A A . 26 TRP CD2 1 1 15 7757 1 1 26 TRP CE2 C -14.662 -2.022 3.895 1.00 . A A . 26 TRP CE2 1 1 15 7758 1 1 26 TRP CE3 C -14.466 -0.774 1.832 1.00 . A A . 26 TRP CE3 1 1 15 7759 1 1 26 TRP CG C -12.429 -1.702 3.245 1.00 . A A . 26 TRP CG 1 1 15 7760 1 1 26 TRP CH2 C -16.669 -1.295 2.755 1.00 . A A . 26 TRP CH2 1 1 15 7761 1 1 26 TRP CZ2 C -16.062 -1.967 3.829 1.00 . A A . 26 TRP CZ2 1 1 15 7762 1 1 26 TRP CZ3 C -15.870 -0.698 1.763 1.00 . A A . 26 TRP CZ3 1 1 15 7763 1 1 26 TRP H H -12.448 1.377 3.511 1.00 . A A . 26 TRP H 1 1 15 7764 1 1 26 TRP HA H -9.749 0.227 3.387 1.00 . A A . 26 TRP HA 1 1 15 7765 1 1 26 TRP HB2 H -11.453 -1.183 1.505 1.00 . A A . 26 TRP HB2 1 1 15 7766 1 1 26 TRP HB3 H -10.377 -1.814 2.700 1.00 . A A . 26 TRP HB3 1 1 15 7767 1 1 26 TRP HD1 H -11.611 -2.583 5.053 1.00 . A A . 26 TRP HD1 1 1 15 7768 1 1 26 TRP HE1 H -14.057 -3.071 5.639 1.00 . A A . 26 TRP HE1 1 1 15 7769 1 1 26 TRP HE3 H -13.867 -0.275 1.083 1.00 . A A . 26 TRP HE3 1 1 15 7770 1 1 26 TRP HH2 H -17.747 -1.207 2.707 1.00 . A A . 26 TRP HH2 1 1 15 7771 1 1 26 TRP HZ2 H -16.663 -2.408 4.611 1.00 . A A . 26 TRP HZ2 1 1 15 7772 1 1 26 TRP HZ3 H -16.338 -0.145 0.960 1.00 . A A . 26 TRP HZ3 1 1 15 7773 1 1 26 TRP N N -11.654 0.891 3.909 1.00 . A A . 26 TRP N 1 1 15 7774 1 1 26 TRP NE1 N -13.783 -2.572 4.796 1.00 . A A . 26 TRP NE1 1 1 15 7775 1 1 26 TRP O O -11.117 2.372 1.775 1.00 . A A . 26 TRP O 1 1 15 7776 1 1 27 CYS C C -10.988 -0.005 -1.575 1.00 . A A . 27 CYS C 1 1 15 7777 1 1 27 CYS CA C -10.479 1.186 -0.756 1.00 . A A . 27 CYS CA 1 1 15 7778 1 1 27 CYS CB C -9.319 1.947 -1.403 1.00 . A A . 27 CYS CB 1 1 15 7779 1 1 27 CYS H H -9.804 -0.225 0.640 1.00 . A A . 27 CYS H 1 1 15 7780 1 1 27 CYS HA H -11.312 1.882 -0.691 1.00 . A A . 27 CYS HA 1 1 15 7781 1 1 27 CYS HB2 H -8.390 1.387 -1.300 1.00 . A A . 27 CYS HB2 1 1 15 7782 1 1 27 CYS HB3 H -9.534 2.076 -2.464 1.00 . A A . 27 CYS HB3 1 1 15 7783 1 1 27 CYS N N -10.138 0.726 0.594 1.00 . A A . 27 CYS N 1 1 15 7784 1 1 27 CYS O O -10.829 -1.154 -1.144 1.00 . A A . 27 CYS O 1 1 15 7785 1 1 27 CYS SG S -9.136 3.587 -0.676 1.00 . A A . 27 CYS SG 1 1 15 7786 1 1 28 LYS C C -12.412 -0.731 -4.876 1.00 . A A . 28 LYS C 1 1 15 7787 1 1 28 LYS CA C -12.493 -0.805 -3.349 1.00 . A A . 28 LYS CA 1 1 15 7788 1 1 28 LYS CB C -13.912 -0.851 -2.732 1.00 . A A . 28 LYS CB 1 1 15 7789 1 1 28 LYS CD C -14.068 -3.202 -1.704 1.00 . A A . 28 LYS CD 1 1 15 7790 1 1 28 LYS CE C -12.821 -3.980 -2.148 1.00 . A A . 28 LYS CE 1 1 15 7791 1 1 28 LYS CG C -14.595 -2.228 -2.774 1.00 . A A . 28 LYS CG 1 1 15 7792 1 1 28 LYS H H -11.782 1.209 -2.992 1.00 . A A . 28 LYS H 1 1 15 7793 1 1 28 LYS HA H -12.006 -1.750 -3.129 1.00 . A A . 28 LYS HA 1 1 15 7794 1 1 28 LYS HB2 H -13.865 -0.536 -1.688 1.00 . A A . 28 LYS HB2 1 1 15 7795 1 1 28 LYS HB3 H -14.558 -0.132 -3.233 1.00 . A A . 28 LYS HB3 1 1 15 7796 1 1 28 LYS HD2 H -13.878 -2.662 -0.774 1.00 . A A . 28 LYS HD2 1 1 15 7797 1 1 28 LYS HD3 H -14.851 -3.930 -1.495 1.00 . A A . 28 LYS HD3 1 1 15 7798 1 1 28 LYS HE2 H -13.098 -5.031 -2.264 1.00 . A A . 28 LYS HE2 1 1 15 7799 1 1 28 LYS HE3 H -12.496 -3.628 -3.129 1.00 . A A . 28 LYS HE3 1 1 15 7800 1 1 28 LYS HG2 H -15.656 -2.068 -2.575 1.00 . A A . 28 LYS HG2 1 1 15 7801 1 1 28 LYS HG3 H -14.507 -2.669 -3.768 1.00 . A A . 28 LYS HG3 1 1 15 7802 1 1 28 LYS HZ1 H -11.958 -4.328 -0.302 1.00 . A A . 28 LYS HZ1 1 1 15 7803 1 1 28 LYS HZ2 H -11.449 -2.903 -1.007 1.00 . A A . 28 LYS HZ2 1 1 15 7804 1 1 28 LYS HZ3 H -10.869 -4.311 -1.536 1.00 . A A . 28 LYS HZ3 1 1 15 7805 1 1 28 LYS N N -11.700 0.244 -2.682 1.00 . A A . 28 LYS N 1 1 15 7806 1 1 28 LYS NZ N -11.709 -3.871 -1.176 1.00 . A A . 28 LYS NZ 1 1 15 7807 1 1 28 LYS O O -11.384 -1.116 -5.428 1.00 . A A . 28 LYS O 1 1 15 7808 1 1 29 LYS C C -14.688 0.716 -7.416 1.00 . A A . 29 LYS C 1 1 15 7809 1 1 29 LYS CA C -13.507 -0.171 -7.030 1.00 . A A . 29 LYS CA 1 1 15 7810 1 1 29 LYS CB C -13.601 -1.552 -7.712 1.00 . A A . 29 LYS CB 1 1 15 7811 1 1 29 LYS CD C -12.668 -3.043 -9.510 1.00 . A A . 29 LYS CD 1 1 15 7812 1 1 29 LYS CE C -11.546 -3.220 -10.535 1.00 . A A . 29 LYS CE 1 1 15 7813 1 1 29 LYS CG C -12.618 -1.646 -8.886 1.00 . A A . 29 LYS CG 1 1 15 7814 1 1 29 LYS H H -14.322 -0.097 -5.064 1.00 . A A . 29 LYS H 1 1 15 7815 1 1 29 LYS HA H -12.582 0.317 -7.337 1.00 . A A . 29 LYS HA 1 1 15 7816 1 1 29 LYS HB2 H -13.351 -2.339 -6.999 1.00 . A A . 29 LYS HB2 1 1 15 7817 1 1 29 LYS HB3 H -14.617 -1.737 -8.062 1.00 . A A . 29 LYS HB3 1 1 15 7818 1 1 29 LYS HD2 H -12.556 -3.795 -8.729 1.00 . A A . 29 LYS HD2 1 1 15 7819 1 1 29 LYS HD3 H -13.636 -3.186 -9.988 1.00 . A A . 29 LYS HD3 1 1 15 7820 1 1 29 LYS HE2 H -11.615 -2.428 -11.286 1.00 . A A . 29 LYS HE2 1 1 15 7821 1 1 29 LYS HE3 H -10.578 -3.120 -10.036 1.00 . A A . 29 LYS HE3 1 1 15 7822 1 1 29 LYS HG2 H -12.863 -0.897 -9.639 1.00 . A A . 29 LYS HG2 1 1 15 7823 1 1 29 LYS HG3 H -11.609 -1.451 -8.524 1.00 . A A . 29 LYS HG3 1 1 15 7824 1 1 29 LYS HZ1 H -12.530 -4.611 -11.696 1.00 . A A . 29 LYS HZ1 1 1 15 7825 1 1 29 LYS HZ2 H -11.599 -5.311 -10.525 1.00 . A A . 29 LYS HZ2 1 1 15 7826 1 1 29 LYS HZ3 H -10.898 -4.695 -11.856 1.00 . A A . 29 LYS HZ3 1 1 15 7827 1 1 29 LYS N N -13.480 -0.333 -5.570 1.00 . A A . 29 LYS N 1 1 15 7828 1 1 29 LYS NZ N -11.653 -4.542 -11.188 1.00 . A A . 29 LYS NZ 1 1 15 7829 1 1 29 LYS O O -15.765 0.581 -6.836 1.00 . A A . 29 LYS O 1 1 15 7830 1 1 30 LYS C C -15.260 3.097 -10.269 1.00 . A A . 30 LYS C 1 1 15 7831 1 1 30 LYS CA C -15.557 2.523 -8.883 1.00 . A A . 30 LYS CA 1 1 15 7832 1 1 30 LYS CB C -15.819 3.661 -7.872 1.00 . A A . 30 LYS CB 1 1 15 7833 1 1 30 LYS CD C -18.197 4.404 -8.619 1.00 . A A . 30 LYS CD 1 1 15 7834 1 1 30 LYS CE C -18.852 3.341 -9.514 1.00 . A A . 30 LYS CE 1 1 15 7835 1 1 30 LYS CG C -17.304 3.838 -7.500 1.00 . A A . 30 LYS CG 1 1 15 7836 1 1 30 LYS H H -13.587 1.641 -8.817 1.00 . A A . 30 LYS H 1 1 15 7837 1 1 30 LYS HA H -16.462 1.926 -8.987 1.00 . A A . 30 LYS HA 1 1 15 7838 1 1 30 LYS HB2 H -15.287 3.450 -6.945 1.00 . A A . 30 LYS HB2 1 1 15 7839 1 1 30 LYS HB3 H -15.425 4.605 -8.251 1.00 . A A . 30 LYS HB3 1 1 15 7840 1 1 30 LYS HD2 H -18.995 4.977 -8.145 1.00 . A A . 30 LYS HD2 1 1 15 7841 1 1 30 LYS HD3 H -17.612 5.092 -9.226 1.00 . A A . 30 LYS HD3 1 1 15 7842 1 1 30 LYS HE2 H -18.099 2.637 -9.873 1.00 . A A . 30 LYS HE2 1 1 15 7843 1 1 30 LYS HE3 H -19.577 2.783 -8.916 1.00 . A A . 30 LYS HE3 1 1 15 7844 1 1 30 LYS HG2 H -17.710 2.892 -7.142 1.00 . A A . 30 LYS HG2 1 1 15 7845 1 1 30 LYS HG3 H -17.339 4.542 -6.668 1.00 . A A . 30 LYS HG3 1 1 15 7846 1 1 30 LYS HZ1 H -20.074 3.283 -11.213 1.00 . A A . 30 LYS HZ1 1 1 15 7847 1 1 30 LYS HZ2 H -18.871 4.401 -11.311 1.00 . A A . 30 LYS HZ2 1 1 15 7848 1 1 30 LYS HZ3 H -20.169 4.695 -10.372 1.00 . A A . 30 LYS HZ3 1 1 15 7849 1 1 30 LYS N N -14.496 1.625 -8.376 1.00 . A A . 30 LYS N 1 1 15 7850 1 1 30 LYS NZ N -19.532 3.962 -10.677 1.00 . A A . 30 LYS NZ 1 1 15 7851 1 1 30 LYS O O -16.202 3.397 -10.998 1.00 . A A . 30 LYS O 1 1 15 7852 1 1 31 LEU C C -13.588 2.080 -12.775 1.00 . A A . 31 LEU C 1 1 15 7853 1 1 31 LEU CA C -13.606 3.437 -12.053 1.00 . A A . 31 LEU CA 1 1 15 7854 1 1 31 LEU CB C -12.275 4.198 -12.115 1.00 . A A . 31 LEU CB 1 1 15 7855 1 1 31 LEU CD1 C -11.299 6.181 -13.296 1.00 . A A . 31 LEU CD1 1 1 15 7856 1 1 31 LEU CD2 C -11.062 3.955 -14.337 1.00 . A A . 31 LEU CD2 1 1 15 7857 1 1 31 LEU CG C -11.980 4.830 -13.490 1.00 . A A . 31 LEU CG 1 1 15 7858 1 1 31 LEU H H -13.258 3.002 -10.010 1.00 . A A . 31 LEU H 1 1 15 7859 1 1 31 LEU HA H -14.363 4.061 -12.531 1.00 . A A . 31 LEU HA 1 1 15 7860 1 1 31 LEU HB2 H -12.313 4.990 -11.366 1.00 . A A . 31 LEU HB2 1 1 15 7861 1 1 31 LEU HB3 H -11.468 3.522 -11.847 1.00 . A A . 31 LEU HB3 1 1 15 7862 1 1 31 LEU HD11 H -10.356 6.059 -12.763 1.00 . A A . 31 LEU HD11 1 1 15 7863 1 1 31 LEU HD12 H -11.955 6.840 -12.731 1.00 . A A . 31 LEU HD12 1 1 15 7864 1 1 31 LEU HD13 H -11.111 6.637 -14.264 1.00 . A A . 31 LEU HD13 1 1 15 7865 1 1 31 LEU HD21 H -10.116 3.796 -13.821 1.00 . A A . 31 LEU HD21 1 1 15 7866 1 1 31 LEU HD22 H -10.868 4.437 -15.294 1.00 . A A . 31 LEU HD22 1 1 15 7867 1 1 31 LEU HD23 H -11.524 2.989 -14.519 1.00 . A A . 31 LEU HD23 1 1 15 7868 1 1 31 LEU HG H -12.914 4.995 -14.028 1.00 . A A . 31 LEU HG 1 1 15 7869 1 1 31 LEU N N -13.992 3.244 -10.655 1.00 . A A . 31 LEU N 1 1 15 7870 1 1 31 LEU O O -13.315 1.044 -12.173 1.00 . A A . 31 LEU O 1 1 15 7871 1 1 32 LEU C C -14.076 0.673 -16.078 1.00 . A A . 32 LEU C 1 1 15 7872 1 1 32 LEU CA C -14.579 0.868 -14.646 1.00 . A A . 32 LEU CA 1 1 15 7873 1 1 32 LEU CB C -16.132 0.999 -14.555 1.00 . A A . 32 LEU CB 1 1 15 7874 1 1 32 LEU CD1 C -16.513 3.231 -15.800 1.00 . A A . 32 LEU CD1 1 1 15 7875 1 1 32 LEU CD2 C -18.185 2.364 -14.181 1.00 . A A . 32 LEU CD2 1 1 15 7876 1 1 32 LEU CG C -16.691 2.447 -14.496 1.00 . A A . 32 LEU CG 1 1 15 7877 1 1 32 LEU H H -14.192 2.944 -14.484 1.00 . A A . 32 LEU H 1 1 15 7878 1 1 32 LEU HA H -14.292 -0.022 -14.104 1.00 . A A . 32 LEU HA 1 1 15 7879 1 1 32 LEU HB2 H -16.598 0.457 -15.378 1.00 . A A . 32 LEU HB2 1 1 15 7880 1 1 32 LEU HB3 H -16.422 0.495 -13.632 1.00 . A A . 32 LEU HB3 1 1 15 7881 1 1 32 LEU HD11 H -16.948 2.674 -16.629 1.00 . A A . 32 LEU HD11 1 1 15 7882 1 1 32 LEU HD12 H -15.458 3.402 -16.007 1.00 . A A . 32 LEU HD12 1 1 15 7883 1 1 32 LEU HD13 H -17.009 4.200 -15.730 1.00 . A A . 32 LEU HD13 1 1 15 7884 1 1 32 LEU HD21 H -18.335 1.853 -13.229 1.00 . A A . 32 LEU HD21 1 1 15 7885 1 1 32 LEU HD22 H -18.703 1.816 -14.965 1.00 . A A . 32 LEU HD22 1 1 15 7886 1 1 32 LEU HD23 H -18.605 3.368 -14.109 1.00 . A A . 32 LEU HD23 1 1 15 7887 1 1 32 LEU HG H -16.242 3.005 -13.675 1.00 . A A . 32 LEU HG 1 1 15 7888 1 1 32 LEU N N -13.970 2.064 -14.045 1.00 . A A . 32 LEU N 1 1 15 7889 1 1 32 LEU O O -14.623 1.125 -17.056 1.00 . A A . 32 LEU O 1 1 15 7890 1 1 32 LEU OXT O -13.161 0.147 -16.193 1.00 . A A . 32 LEU OXT 1 1 16 7891 1 1 1 GLY C C 1.266 -7.716 1.823 1.00 . A A . 1 GLY C 1 1 16 7892 1 1 1 GLY CA C 1.250 -9.222 1.998 1.00 . A A . 1 GLY CA 1 1 16 7893 1 1 1 GLY H1 H -0.116 -10.673 2.451 1.00 . A A . 1 GLY H1 1 1 16 7894 1 1 1 GLY H2 H -0.189 -9.352 3.438 1.00 . A A . 1 GLY H2 1 1 16 7895 1 1 1 GLY H3 H -0.786 -9.281 1.891 1.00 . A A . 1 GLY H3 1 1 16 7896 1 1 1 GLY HA2 H 2.023 -9.515 2.704 1.00 . A A . 1 GLY HA2 1 1 16 7897 1 1 1 GLY HA3 H 1.440 -9.700 1.040 1.00 . A A . 1 GLY HA3 1 1 16 7898 1 1 1 GLY N N -0.060 -9.663 2.483 1.00 . A A . 1 GLY N 1 1 16 7899 1 1 1 GLY O O 0.675 -7.009 2.643 1.00 . A A . 1 GLY O 1 1 16 7900 1 1 2 PRO C C 0.849 -5.043 -0.053 1.00 . A A . 2 PRO C 1 1 16 7901 1 1 2 PRO CA C 2.077 -5.793 0.475 1.00 . A A . 2 PRO CA 1 1 16 7902 1 1 2 PRO CB C 3.220 -5.754 -0.537 1.00 . A A . 2 PRO CB 1 1 16 7903 1 1 2 PRO CD C 2.466 -8.000 -0.338 1.00 . A A . 2 PRO CD 1 1 16 7904 1 1 2 PRO CG C 2.951 -6.998 -1.376 1.00 . A A . 2 PRO CG 1 1 16 7905 1 1 2 PRO HA H 2.388 -5.300 1.393 1.00 . A A . 2 PRO HA 1 1 16 7906 1 1 2 PRO HB2 H 3.222 -4.844 -1.138 1.00 . A A . 2 PRO HB2 1 1 16 7907 1 1 2 PRO HB3 H 4.167 -5.874 -0.016 1.00 . A A . 2 PRO HB3 1 1 16 7908 1 1 2 PRO HD2 H 1.751 -8.689 -0.783 1.00 . A A . 2 PRO HD2 1 1 16 7909 1 1 2 PRO HD3 H 3.313 -8.557 0.047 1.00 . A A . 2 PRO HD3 1 1 16 7910 1 1 2 PRO HG2 H 2.154 -6.793 -2.086 1.00 . A A . 2 PRO HG2 1 1 16 7911 1 1 2 PRO HG3 H 3.843 -7.350 -1.887 1.00 . A A . 2 PRO HG3 1 1 16 7912 1 1 2 PRO N N 1.863 -7.215 0.728 1.00 . A A . 2 PRO N 1 1 16 7913 1 1 2 PRO O O 0.893 -3.810 -0.111 1.00 . A A . 2 PRO O 1 1 16 7914 1 1 3 TYR C C -2.003 -3.976 0.131 1.00 . A A . 3 TYR C 1 1 16 7915 1 1 3 TYR CA C -1.507 -5.113 -0.769 1.00 . A A . 3 TYR CA 1 1 16 7916 1 1 3 TYR CB C -2.649 -6.121 -0.987 1.00 . A A . 3 TYR CB 1 1 16 7917 1 1 3 TYR CD1 C -2.351 -6.429 -3.531 1.00 . A A . 3 TYR CD1 1 1 16 7918 1 1 3 TYR CD2 C -3.519 -8.111 -2.220 1.00 . A A . 3 TYR CD2 1 1 16 7919 1 1 3 TYR CE1 C -2.624 -7.158 -4.707 1.00 . A A . 3 TYR CE1 1 1 16 7920 1 1 3 TYR CE2 C -3.812 -8.827 -3.391 1.00 . A A . 3 TYR CE2 1 1 16 7921 1 1 3 TYR CG C -2.784 -6.912 -2.278 1.00 . A A . 3 TYR CG 1 1 16 7922 1 1 3 TYR CZ C -3.362 -8.359 -4.641 1.00 . A A . 3 TYR CZ 1 1 16 7923 1 1 3 TYR H H -0.232 -6.747 -0.293 1.00 . A A . 3 TYR H 1 1 16 7924 1 1 3 TYR HA H -1.304 -4.652 -1.726 1.00 . A A . 3 TYR HA 1 1 16 7925 1 1 3 TYR HB2 H -2.600 -6.828 -0.161 1.00 . A A . 3 TYR HB2 1 1 16 7926 1 1 3 TYR HB3 H -3.593 -5.585 -0.888 1.00 . A A . 3 TYR HB3 1 1 16 7927 1 1 3 TYR HD1 H -1.822 -5.494 -3.609 1.00 . A A . 3 TYR HD1 1 1 16 7928 1 1 3 TYR HD2 H -3.902 -8.467 -1.272 1.00 . A A . 3 TYR HD2 1 1 16 7929 1 1 3 TYR HE1 H -2.292 -6.791 -5.667 1.00 . A A . 3 TYR HE1 1 1 16 7930 1 1 3 TYR HE2 H -4.407 -9.721 -3.326 1.00 . A A . 3 TYR HE2 1 1 16 7931 1 1 3 TYR HH H -4.148 -9.870 -5.573 1.00 . A A . 3 TYR HH 1 1 16 7932 1 1 3 TYR N N -0.245 -5.741 -0.387 1.00 . A A . 3 TYR N 1 1 16 7933 1 1 3 TYR O O -1.923 -4.076 1.357 1.00 . A A . 3 TYR O 1 1 16 7934 1 1 3 TYR OH O -3.653 -9.055 -5.773 1.00 . A A . 3 TYR OH 1 1 16 7935 1 1 4 CYS C C -4.851 -1.923 -0.056 1.00 . A A . 4 CYS C 1 1 16 7936 1 1 4 CYS CA C -3.349 -1.923 0.255 1.00 . A A . 4 CYS CA 1 1 16 7937 1 1 4 CYS CB C -2.616 -0.578 0.100 1.00 . A A . 4 CYS CB 1 1 16 7938 1 1 4 CYS H H -2.615 -2.937 -1.483 1.00 . A A . 4 CYS H 1 1 16 7939 1 1 4 CYS HA H -3.303 -2.148 1.322 1.00 . A A . 4 CYS HA 1 1 16 7940 1 1 4 CYS HB2 H -3.318 0.227 0.298 1.00 . A A . 4 CYS HB2 1 1 16 7941 1 1 4 CYS HB3 H -1.876 -0.543 0.901 1.00 . A A . 4 CYS HB3 1 1 16 7942 1 1 4 CYS N N -2.652 -2.980 -0.467 1.00 . A A . 4 CYS N 1 1 16 7943 1 1 4 CYS O O -5.661 -2.271 0.804 1.00 . A A . 4 CYS O 1 1 16 7944 1 1 4 CYS SG S -1.696 -0.173 -1.425 1.00 . A A . 4 CYS SG 1 1 16 7945 1 1 5 GLN C C -7.263 -3.090 -1.566 1.00 . A A . 5 GLN C 1 1 16 7946 1 1 5 GLN CA C -6.659 -1.682 -1.699 1.00 . A A . 5 GLN CA 1 1 16 7947 1 1 5 GLN CB C -6.795 -1.033 -3.086 1.00 . A A . 5 GLN CB 1 1 16 7948 1 1 5 GLN CD C -7.839 -2.707 -4.747 1.00 . A A . 5 GLN CD 1 1 16 7949 1 1 5 GLN CG C -8.024 -1.441 -3.911 1.00 . A A . 5 GLN CG 1 1 16 7950 1 1 5 GLN H H -4.542 -1.431 -1.992 1.00 . A A . 5 GLN H 1 1 16 7951 1 1 5 GLN HA H -7.224 -1.056 -1.005 1.00 . A A . 5 GLN HA 1 1 16 7952 1 1 5 GLN HB2 H -6.850 0.045 -2.928 1.00 . A A . 5 GLN HB2 1 1 16 7953 1 1 5 GLN HB3 H -5.894 -1.218 -3.666 1.00 . A A . 5 GLN HB3 1 1 16 7954 1 1 5 GLN HE21 H -6.112 -2.060 -5.593 1.00 . A A . 5 GLN HE21 1 1 16 7955 1 1 5 GLN HE22 H -6.655 -3.637 -6.088 1.00 . A A . 5 GLN HE22 1 1 16 7956 1 1 5 GLN HG2 H -8.876 -1.579 -3.255 1.00 . A A . 5 GLN HG2 1 1 16 7957 1 1 5 GLN HG3 H -8.261 -0.619 -4.579 1.00 . A A . 5 GLN HG3 1 1 16 7958 1 1 5 GLN N N -5.246 -1.654 -1.300 1.00 . A A . 5 GLN N 1 1 16 7959 1 1 5 GLN NE2 N -6.780 -2.821 -5.512 1.00 . A A . 5 GLN NE2 1 1 16 7960 1 1 5 GLN O O -8.200 -3.287 -0.791 1.00 . A A . 5 GLN O 1 1 16 7961 1 1 5 GLN OE1 O -8.555 -3.692 -4.599 1.00 . A A . 5 GLN OE1 1 1 16 7962 1 1 6 LYS C C -6.708 -6.225 -0.779 1.00 . A A . 6 LYS C 1 1 16 7963 1 1 6 LYS CA C -7.069 -5.511 -2.103 1.00 . A A . 6 LYS CA 1 1 16 7964 1 1 6 LYS CB C -6.634 -6.235 -3.396 1.00 . A A . 6 LYS CB 1 1 16 7965 1 1 6 LYS CD C -7.632 -7.955 -5.060 1.00 . A A . 6 LYS CD 1 1 16 7966 1 1 6 LYS CE C -9.032 -7.503 -5.509 1.00 . A A . 6 LYS CE 1 1 16 7967 1 1 6 LYS CG C -7.322 -7.599 -3.595 1.00 . A A . 6 LYS CG 1 1 16 7968 1 1 6 LYS H H -5.828 -3.897 -2.750 1.00 . A A . 6 LYS H 1 1 16 7969 1 1 6 LYS HA H -8.159 -5.491 -2.113 1.00 . A A . 6 LYS HA 1 1 16 7970 1 1 6 LYS HB2 H -6.876 -5.599 -4.245 1.00 . A A . 6 LYS HB2 1 1 16 7971 1 1 6 LYS HB3 H -5.552 -6.373 -3.396 1.00 . A A . 6 LYS HB3 1 1 16 7972 1 1 6 LYS HD2 H -6.859 -7.571 -5.729 1.00 . A A . 6 LYS HD2 1 1 16 7973 1 1 6 LYS HD3 H -7.613 -9.041 -5.134 1.00 . A A . 6 LYS HD3 1 1 16 7974 1 1 6 LYS HE2 H -9.362 -8.169 -6.312 1.00 . A A . 6 LYS HE2 1 1 16 7975 1 1 6 LYS HE3 H -9.732 -7.628 -4.679 1.00 . A A . 6 LYS HE3 1 1 16 7976 1 1 6 LYS HG2 H -6.667 -8.369 -3.187 1.00 . A A . 6 LYS HG2 1 1 16 7977 1 1 6 LYS HG3 H -8.255 -7.633 -3.030 1.00 . A A . 6 LYS HG3 1 1 16 7978 1 1 6 LYS HZ1 H -8.730 -5.428 -5.352 1.00 . A A . 6 LYS HZ1 1 1 16 7979 1 1 6 LYS HZ2 H -10.039 -5.855 -6.248 1.00 . A A . 6 LYS HZ2 1 1 16 7980 1 1 6 LYS HZ3 H -8.566 -6.053 -6.890 1.00 . A A . 6 LYS HZ3 1 1 16 7981 1 1 6 LYS N N -6.624 -4.107 -2.164 1.00 . A A . 6 LYS N 1 1 16 7982 1 1 6 LYS NZ N -9.083 -6.111 -6.014 1.00 . A A . 6 LYS NZ 1 1 16 7983 1 1 6 LYS O O -6.760 -7.447 -0.690 1.00 . A A . 6 LYS O 1 1 16 7984 1 1 7 TRP C C -6.882 -5.008 2.697 1.00 . A A . 7 TRP C 1 1 16 7985 1 1 7 TRP CA C -6.221 -5.940 1.655 1.00 . A A . 7 TRP CA 1 1 16 7986 1 1 7 TRP CB C -4.722 -6.215 1.851 1.00 . A A . 7 TRP CB 1 1 16 7987 1 1 7 TRP CD1 C -3.797 -6.249 4.222 1.00 . A A . 7 TRP CD1 1 1 16 7988 1 1 7 TRP CD2 C -4.487 -8.260 3.522 1.00 . A A . 7 TRP CD2 1 1 16 7989 1 1 7 TRP CE2 C -4.079 -8.412 4.881 1.00 . A A . 7 TRP CE2 1 1 16 7990 1 1 7 TRP CE3 C -4.991 -9.405 2.864 1.00 . A A . 7 TRP CE3 1 1 16 7991 1 1 7 TRP CG C -4.279 -6.872 3.123 1.00 . A A . 7 TRP CG 1 1 16 7992 1 1 7 TRP CH2 C -4.727 -10.744 4.889 1.00 . A A . 7 TRP CH2 1 1 16 7993 1 1 7 TRP CZ2 C -4.200 -9.630 5.564 1.00 . A A . 7 TRP CZ2 1 1 16 7994 1 1 7 TRP CZ3 C -5.102 -10.636 3.537 1.00 . A A . 7 TRP CZ3 1 1 16 7995 1 1 7 TRP H H -6.381 -4.461 0.129 1.00 . A A . 7 TRP H 1 1 16 7996 1 1 7 TRP HA H -6.732 -6.898 1.763 1.00 . A A . 7 TRP HA 1 1 16 7997 1 1 7 TRP HB2 H -4.415 -6.882 1.049 1.00 . A A . 7 TRP HB2 1 1 16 7998 1 1 7 TRP HB3 H -4.185 -5.274 1.735 1.00 . A A . 7 TRP HB3 1 1 16 7999 1 1 7 TRP HD1 H -3.597 -5.185 4.294 1.00 . A A . 7 TRP HD1 1 1 16 8000 1 1 7 TRP HE1 H -3.226 -6.905 6.140 1.00 . A A . 7 TRP HE1 1 1 16 8001 1 1 7 TRP HE3 H -5.301 -9.323 1.831 1.00 . A A . 7 TRP HE3 1 1 16 8002 1 1 7 TRP HH2 H -4.839 -11.688 5.407 1.00 . A A . 7 TRP HH2 1 1 16 8003 1 1 7 TRP HZ2 H -3.899 -9.710 6.598 1.00 . A A . 7 TRP HZ2 1 1 16 8004 1 1 7 TRP HZ3 H -5.500 -11.500 3.019 1.00 . A A . 7 TRP HZ3 1 1 16 8005 1 1 7 TRP N N -6.422 -5.458 0.278 1.00 . A A . 7 TRP N 1 1 16 8006 1 1 7 TRP NE1 N -3.618 -7.163 5.242 1.00 . A A . 7 TRP NE1 1 1 16 8007 1 1 7 TRP O O -6.633 -5.098 3.896 1.00 . A A . 7 TRP O 1 1 16 8008 1 1 8 MET C C -7.892 -2.352 4.040 1.00 . A A . 8 MET C 1 1 16 8009 1 1 8 MET CA C -8.652 -3.277 3.074 1.00 . A A . 8 MET CA 1 1 16 8010 1 1 8 MET CB C -9.781 -4.093 3.726 1.00 . A A . 8 MET CB 1 1 16 8011 1 1 8 MET CE C -11.595 -6.796 4.210 1.00 . A A . 8 MET CE 1 1 16 8012 1 1 8 MET CG C -10.711 -4.669 2.651 1.00 . A A . 8 MET CG 1 1 16 8013 1 1 8 MET H H -7.955 -4.106 1.246 1.00 . A A . 8 MET H 1 1 16 8014 1 1 8 MET HA H -9.134 -2.598 2.373 1.00 . A A . 8 MET HA 1 1 16 8015 1 1 8 MET HB2 H -9.363 -4.897 4.333 1.00 . A A . 8 MET HB2 1 1 16 8016 1 1 8 MET HB3 H -10.368 -3.441 4.374 1.00 . A A . 8 MET HB3 1 1 16 8017 1 1 8 MET HE1 H -10.929 -7.379 3.576 1.00 . A A . 8 MET HE1 1 1 16 8018 1 1 8 MET HE2 H -11.040 -6.442 5.078 1.00 . A A . 8 MET HE2 1 1 16 8019 1 1 8 MET HE3 H -12.418 -7.428 4.542 1.00 . A A . 8 MET HE3 1 1 16 8020 1 1 8 MET HG2 H -10.984 -3.868 1.964 1.00 . A A . 8 MET HG2 1 1 16 8021 1 1 8 MET HG3 H -10.176 -5.431 2.083 1.00 . A A . 8 MET HG3 1 1 16 8022 1 1 8 MET N N -7.795 -4.136 2.245 1.00 . A A . 8 MET N 1 1 16 8023 1 1 8 MET O O -8.067 -2.385 5.257 1.00 . A A . 8 MET O 1 1 16 8024 1 1 8 MET SD S -12.249 -5.389 3.271 1.00 . A A . 8 MET SD 1 1 16 8025 1 1 9 GLN C C -6.865 0.656 4.905 1.00 . A A . 9 GLN C 1 1 16 8026 1 1 9 GLN CA C -6.199 -0.455 4.048 1.00 . A A . 9 GLN CA 1 1 16 8027 1 1 9 GLN CB C -5.402 0.183 2.893 1.00 . A A . 9 GLN CB 1 1 16 8028 1 1 9 GLN CD C -5.706 1.720 0.827 1.00 . A A . 9 GLN CD 1 1 16 8029 1 1 9 GLN CG C -6.358 0.807 1.846 1.00 . A A . 9 GLN CG 1 1 16 8030 1 1 9 GLN H H -6.908 -1.658 2.466 1.00 . A A . 9 GLN H 1 1 16 8031 1 1 9 GLN HA H -5.490 -0.960 4.706 1.00 . A A . 9 GLN HA 1 1 16 8032 1 1 9 GLN HB2 H -4.729 0.935 3.303 1.00 . A A . 9 GLN HB2 1 1 16 8033 1 1 9 GLN HB3 H -4.774 -0.570 2.424 1.00 . A A . 9 GLN HB3 1 1 16 8034 1 1 9 GLN HE21 H -4.136 2.193 2.008 1.00 . A A . 9 GLN HE21 1 1 16 8035 1 1 9 GLN HE22 H -4.200 3.018 0.463 1.00 . A A . 9 GLN HE22 1 1 16 8036 1 1 9 GLN HG2 H -6.873 0.016 1.302 1.00 . A A . 9 GLN HG2 1 1 16 8037 1 1 9 GLN HG3 H -7.120 1.404 2.345 1.00 . A A . 9 GLN HG3 1 1 16 8038 1 1 9 GLN N N -7.060 -1.492 3.453 1.00 . A A . 9 GLN N 1 1 16 8039 1 1 9 GLN NE2 N -4.585 2.345 1.121 1.00 . A A . 9 GLN NE2 1 1 16 8040 1 1 9 GLN O O -6.515 1.829 4.750 1.00 . A A . 9 GLN O 1 1 16 8041 1 1 9 GLN OE1 O -6.281 1.964 -0.220 1.00 . A A . 9 GLN OE1 1 1 16 8042 1 1 10 THR C C -8.313 2.646 6.676 1.00 . A A . 10 THR C 1 1 16 8043 1 1 10 THR CA C -8.099 1.160 7.012 1.00 . A A . 10 THR CA 1 1 16 8044 1 1 10 THR CB C -7.015 0.976 8.088 1.00 . A A . 10 THR CB 1 1 16 8045 1 1 10 THR CG2 C -7.396 1.551 9.448 1.00 . A A . 10 THR CG2 1 1 16 8046 1 1 10 THR H H -8.029 -0.649 5.885 1.00 . A A . 10 THR H 1 1 16 8047 1 1 10 THR HA H -9.036 0.791 7.424 1.00 . A A . 10 THR HA 1 1 16 8048 1 1 10 THR HB H -6.096 1.449 7.745 1.00 . A A . 10 THR HB 1 1 16 8049 1 1 10 THR HG1 H -6.122 -0.449 9.025 1.00 . A A . 10 THR HG1 1 1 16 8050 1 1 10 THR HG21 H -7.911 0.803 10.044 1.00 . A A . 10 THR HG21 1 1 16 8051 1 1 10 THR HG22 H -8.034 2.428 9.348 1.00 . A A . 10 THR HG22 1 1 16 8052 1 1 10 THR HG23 H -6.485 1.859 9.953 1.00 . A A . 10 THR HG23 1 1 16 8053 1 1 10 THR N N -7.764 0.328 5.833 1.00 . A A . 10 THR N 1 1 16 8054 1 1 10 THR O O -7.521 3.498 7.084 1.00 . A A . 10 THR O 1 1 16 8055 1 1 10 THR OG1 O -6.764 -0.401 8.289 1.00 . A A . 10 THR OG1 1 1 16 8056 1 1 11 CYS C C -9.425 5.421 5.763 1.00 . A A . 11 CYS C 1 1 16 8057 1 1 11 CYS CA C -9.063 4.168 4.946 1.00 . A A . 11 CYS CA 1 1 16 8058 1 1 11 CYS CB C -9.792 4.075 3.604 1.00 . A A . 11 CYS CB 1 1 16 8059 1 1 11 CYS H H -9.786 2.182 5.384 1.00 . A A . 11 CYS H 1 1 16 8060 1 1 11 CYS HA H -8.004 4.255 4.696 1.00 . A A . 11 CYS HA 1 1 16 8061 1 1 11 CYS HB2 H -9.586 3.100 3.166 1.00 . A A . 11 CYS HB2 1 1 16 8062 1 1 11 CYS HB3 H -10.869 4.174 3.745 1.00 . A A . 11 CYS HB3 1 1 16 8063 1 1 11 CYS N N -9.190 2.930 5.711 1.00 . A A . 11 CYS N 1 1 16 8064 1 1 11 CYS O O -10.487 5.490 6.382 1.00 . A A . 11 CYS O 1 1 16 8065 1 1 11 CYS SG S -9.193 5.328 2.445 1.00 . A A . 11 CYS SG 1 1 16 8066 1 1 12 ASP C C -8.457 8.899 5.366 1.00 . A A . 12 ASP C 1 1 16 8067 1 1 12 ASP CA C -8.631 7.730 6.349 1.00 . A A . 12 ASP CA 1 1 16 8068 1 1 12 ASP CB C -7.580 7.808 7.477 1.00 . A A . 12 ASP CB 1 1 16 8069 1 1 12 ASP CG C -7.855 6.918 8.690 1.00 . A A . 12 ASP CG 1 1 16 8070 1 1 12 ASP H H -7.801 6.327 5.023 1.00 . A A . 12 ASP H 1 1 16 8071 1 1 12 ASP HA H -9.618 7.839 6.801 1.00 . A A . 12 ASP HA 1 1 16 8072 1 1 12 ASP HB2 H -6.595 7.572 7.075 1.00 . A A . 12 ASP HB2 1 1 16 8073 1 1 12 ASP HB3 H -7.543 8.836 7.838 1.00 . A A . 12 ASP HB3 1 1 16 8074 1 1 12 ASP N N -8.561 6.431 5.677 1.00 . A A . 12 ASP N 1 1 16 8075 1 1 12 ASP O O -7.852 8.732 4.310 1.00 . A A . 12 ASP O 1 1 16 8076 1 1 12 ASP OD1 O -9.037 6.730 9.034 1.00 . A A . 12 ASP OD1 1 1 16 8077 1 1 12 ASP OD2 O -6.874 6.518 9.367 1.00 . A A . 12 ASP OD2 1 1 16 8078 1 1 13 SER C C -7.173 11.651 4.634 1.00 . A A . 13 SER C 1 1 16 8079 1 1 13 SER CA C -8.653 11.341 4.953 1.00 . A A . 13 SER CA 1 1 16 8080 1 1 13 SER CB C -9.345 12.495 5.692 1.00 . A A . 13 SER CB 1 1 16 8081 1 1 13 SER H H -9.345 10.187 6.635 1.00 . A A . 13 SER H 1 1 16 8082 1 1 13 SER HA H -9.158 11.206 3.996 1.00 . A A . 13 SER HA 1 1 16 8083 1 1 13 SER HB2 H -10.412 12.282 5.745 1.00 . A A . 13 SER HB2 1 1 16 8084 1 1 13 SER HB3 H -8.960 12.548 6.710 1.00 . A A . 13 SER HB3 1 1 16 8085 1 1 13 SER HG H -9.368 13.663 4.121 1.00 . A A . 13 SER HG 1 1 16 8086 1 1 13 SER N N -8.848 10.116 5.752 1.00 . A A . 13 SER N 1 1 16 8087 1 1 13 SER O O -6.871 12.348 3.665 1.00 . A A . 13 SER O 1 1 16 8088 1 1 13 SER OG O -9.167 13.758 5.080 1.00 . A A . 13 SER OG 1 1 16 8089 1 1 14 GLU C C -4.184 9.975 4.393 1.00 . A A . 14 GLU C 1 1 16 8090 1 1 14 GLU CA C -4.777 11.165 5.172 1.00 . A A . 14 GLU CA 1 1 16 8091 1 1 14 GLU CB C -4.103 11.269 6.548 1.00 . A A . 14 GLU CB 1 1 16 8092 1 1 14 GLU CD C -3.607 10.229 8.780 1.00 . A A . 14 GLU CD 1 1 16 8093 1 1 14 GLU CG C -4.213 9.991 7.399 1.00 . A A . 14 GLU CG 1 1 16 8094 1 1 14 GLU H H -6.546 10.511 6.159 1.00 . A A . 14 GLU H 1 1 16 8095 1 1 14 GLU HA H -4.538 12.068 4.610 1.00 . A A . 14 GLU HA 1 1 16 8096 1 1 14 GLU HB2 H -3.048 11.496 6.408 1.00 . A A . 14 GLU HB2 1 1 16 8097 1 1 14 GLU HB3 H -4.554 12.103 7.086 1.00 . A A . 14 GLU HB3 1 1 16 8098 1 1 14 GLU HG2 H -5.261 9.717 7.512 1.00 . A A . 14 GLU HG2 1 1 16 8099 1 1 14 GLU HG3 H -3.699 9.166 6.904 1.00 . A A . 14 GLU HG3 1 1 16 8100 1 1 14 GLU N N -6.231 11.086 5.393 1.00 . A A . 14 GLU N 1 1 16 8101 1 1 14 GLU O O -2.985 9.957 4.106 1.00 . A A . 14 GLU O 1 1 16 8102 1 1 14 GLU OE1 O -2.563 9.620 9.106 1.00 . A A . 14 GLU OE1 1 1 16 8103 1 1 14 GLU OE2 O -4.132 11.106 9.507 1.00 . A A . 14 GLU OE2 1 1 16 8104 1 1 15 ARG C C -4.251 7.598 2.223 1.00 . A A . 15 ARG C 1 1 16 8105 1 1 15 ARG CA C -4.445 7.607 3.738 1.00 . A A . 15 ARG CA 1 1 16 8106 1 1 15 ARG CB C -5.401 6.504 4.237 1.00 . A A . 15 ARG CB 1 1 16 8107 1 1 15 ARG CD C -4.352 4.296 3.701 1.00 . A A . 15 ARG CD 1 1 16 8108 1 1 15 ARG CG C -4.671 5.292 4.834 1.00 . A A . 15 ARG CG 1 1 16 8109 1 1 15 ARG CZ C -3.073 2.755 5.190 1.00 . A A . 15 ARG CZ 1 1 16 8110 1 1 15 ARG H H -5.965 9.004 4.309 1.00 . A A . 15 ARG H 1 1 16 8111 1 1 15 ARG HA H -3.472 7.467 4.208 1.00 . A A . 15 ARG HA 1 1 16 8112 1 1 15 ARG HB2 H -5.987 6.918 5.052 1.00 . A A . 15 ARG HB2 1 1 16 8113 1 1 15 ARG HB3 H -6.102 6.203 3.456 1.00 . A A . 15 ARG HB3 1 1 16 8114 1 1 15 ARG HD2 H -5.201 3.640 3.560 1.00 . A A . 15 ARG HD2 1 1 16 8115 1 1 15 ARG HD3 H -4.098 4.832 2.797 1.00 . A A . 15 ARG HD3 1 1 16 8116 1 1 15 ARG HE H -2.262 3.799 3.739 1.00 . A A . 15 ARG HE 1 1 16 8117 1 1 15 ARG HG2 H -3.772 5.623 5.355 1.00 . A A . 15 ARG HG2 1 1 16 8118 1 1 15 ARG HG3 H -5.324 4.806 5.558 1.00 . A A . 15 ARG HG3 1 1 16 8119 1 1 15 ARG HH11 H -5.024 2.555 5.607 1.00 . A A . 15 ARG HH11 1 1 16 8120 1 1 15 ARG HH12 H -3.902 1.906 6.798 1.00 . A A . 15 ARG HH12 1 1 16 8121 1 1 15 ARG HH21 H -1.086 2.686 5.061 1.00 . A A . 15 ARG HH21 1 1 16 8122 1 1 15 ARG HH22 H -1.802 1.761 6.373 1.00 . A A . 15 ARG HH22 1 1 16 8123 1 1 15 ARG N N -4.962 8.912 4.167 1.00 . A A . 15 ARG N 1 1 16 8124 1 1 15 ARG NE N -3.167 3.535 4.125 1.00 . A A . 15 ARG NE 1 1 16 8125 1 1 15 ARG NH1 N -4.078 2.355 5.908 1.00 . A A . 15 ARG NH1 1 1 16 8126 1 1 15 ARG NH2 N -1.902 2.353 5.556 1.00 . A A . 15 ARG NH2 1 1 16 8127 1 1 15 ARG O O -5.181 7.906 1.482 1.00 . A A . 15 ARG O 1 1 16 8128 1 1 16 LYS C C -3.753 5.760 -0.230 1.00 . A A . 16 LYS C 1 1 16 8129 1 1 16 LYS CA C -2.834 6.862 0.321 1.00 . A A . 16 LYS CA 1 1 16 8130 1 1 16 LYS CB C -1.343 6.556 0.074 1.00 . A A . 16 LYS CB 1 1 16 8131 1 1 16 LYS CD C 1.033 7.460 0.001 1.00 . A A . 16 LYS CD 1 1 16 8132 1 1 16 LYS CE C 1.990 8.532 0.540 1.00 . A A . 16 LYS CE 1 1 16 8133 1 1 16 LYS CG C -0.429 7.756 0.375 1.00 . A A . 16 LYS CG 1 1 16 8134 1 1 16 LYS H H -2.341 6.979 2.414 1.00 . A A . 16 LYS H 1 1 16 8135 1 1 16 LYS HA H -3.073 7.773 -0.232 1.00 . A A . 16 LYS HA 1 1 16 8136 1 1 16 LYS HB2 H -1.038 5.703 0.681 1.00 . A A . 16 LYS HB2 1 1 16 8137 1 1 16 LYS HB3 H -1.214 6.279 -0.973 1.00 . A A . 16 LYS HB3 1 1 16 8138 1 1 16 LYS HD2 H 1.318 6.505 0.447 1.00 . A A . 16 LYS HD2 1 1 16 8139 1 1 16 LYS HD3 H 1.135 7.376 -1.083 1.00 . A A . 16 LYS HD3 1 1 16 8140 1 1 16 LYS HE2 H 1.743 8.714 1.588 1.00 . A A . 16 LYS HE2 1 1 16 8141 1 1 16 LYS HE3 H 3.011 8.145 0.501 1.00 . A A . 16 LYS HE3 1 1 16 8142 1 1 16 LYS HG2 H -0.778 8.626 -0.180 1.00 . A A . 16 LYS HG2 1 1 16 8143 1 1 16 LYS HG3 H -0.481 7.983 1.438 1.00 . A A . 16 LYS HG3 1 1 16 8144 1 1 16 LYS HZ1 H 2.455 9.724 -1.085 1.00 . A A . 16 LYS HZ1 1 1 16 8145 1 1 16 LYS HZ2 H 2.353 10.554 0.337 1.00 . A A . 16 LYS HZ2 1 1 16 8146 1 1 16 LYS HZ3 H 0.986 10.064 -0.472 1.00 . A A . 16 LYS HZ3 1 1 16 8147 1 1 16 LYS N N -3.092 7.123 1.750 1.00 . A A . 16 LYS N 1 1 16 8148 1 1 16 LYS NZ N 1.933 9.806 -0.214 1.00 . A A . 16 LYS NZ 1 1 16 8149 1 1 16 LYS O O -3.409 4.577 -0.240 1.00 . A A . 16 LYS O 1 1 16 8150 1 1 17 CYS C C -5.451 4.591 -2.476 1.00 . A A . 17 CYS C 1 1 16 8151 1 1 17 CYS CA C -5.973 5.231 -1.176 1.00 . A A . 17 CYS CA 1 1 16 8152 1 1 17 CYS CB C -7.276 6.008 -1.370 1.00 . A A . 17 CYS CB 1 1 16 8153 1 1 17 CYS H H -5.235 7.095 -0.436 1.00 . A A . 17 CYS H 1 1 16 8154 1 1 17 CYS HA H -6.163 4.446 -0.445 1.00 . A A . 17 CYS HA 1 1 16 8155 1 1 17 CYS HB2 H -7.603 6.402 -0.405 1.00 . A A . 17 CYS HB2 1 1 16 8156 1 1 17 CYS HB3 H -7.059 6.859 -2.011 1.00 . A A . 17 CYS HB3 1 1 16 8157 1 1 17 CYS N N -4.965 6.137 -0.631 1.00 . A A . 17 CYS N 1 1 16 8158 1 1 17 CYS O O -4.949 5.274 -3.374 1.00 . A A . 17 CYS O 1 1 16 8159 1 1 17 CYS SG S -8.664 5.126 -2.127 1.00 . A A . 17 CYS SG 1 1 16 8160 1 1 18 CYS C C -5.282 1.922 -4.678 1.00 . A A . 18 CYS C 1 1 16 8161 1 1 18 CYS CA C -4.641 2.430 -3.367 1.00 . A A . 18 CYS CA 1 1 16 8162 1 1 18 CYS CB C -4.087 1.386 -2.389 1.00 . A A . 18 CYS CB 1 1 16 8163 1 1 18 CYS H H -5.997 2.801 -1.786 1.00 . A A . 18 CYS H 1 1 16 8164 1 1 18 CYS HA H -3.787 3.032 -3.680 1.00 . A A . 18 CYS HA 1 1 16 8165 1 1 18 CYS HB2 H -3.528 1.933 -1.629 1.00 . A A . 18 CYS HB2 1 1 16 8166 1 1 18 CYS HB3 H -4.926 0.910 -1.892 1.00 . A A . 18 CYS HB3 1 1 16 8167 1 1 18 CYS N N -5.539 3.268 -2.564 1.00 . A A . 18 CYS N 1 1 16 8168 1 1 18 CYS O O -4.634 1.250 -5.478 1.00 . A A . 18 CYS O 1 1 16 8169 1 1 18 CYS SG S -3.023 0.051 -2.963 1.00 . A A . 18 CYS SG 1 1 16 8170 1 1 19 GLU C C -7.537 4.098 -6.488 1.00 . A A . 19 GLU C 1 1 16 8171 1 1 19 GLU CA C -7.028 2.648 -6.311 1.00 . A A . 19 GLU CA 1 1 16 8172 1 1 19 GLU CB C -8.079 1.602 -6.720 1.00 . A A . 19 GLU CB 1 1 16 8173 1 1 19 GLU CD C -8.365 -0.777 -7.605 1.00 . A A . 19 GLU CD 1 1 16 8174 1 1 19 GLU CG C -7.384 0.311 -7.172 1.00 . A A . 19 GLU CG 1 1 16 8175 1 1 19 GLU H H -7.018 2.770 -4.184 1.00 . A A . 19 GLU H 1 1 16 8176 1 1 19 GLU HA H -6.202 2.568 -7.019 1.00 . A A . 19 GLU HA 1 1 16 8177 1 1 19 GLU HB2 H -8.754 1.410 -5.885 1.00 . A A . 19 GLU HB2 1 1 16 8178 1 1 19 GLU HB3 H -8.663 1.982 -7.560 1.00 . A A . 19 GLU HB3 1 1 16 8179 1 1 19 GLU HG2 H -6.720 0.547 -8.000 1.00 . A A . 19 GLU HG2 1 1 16 8180 1 1 19 GLU HG3 H -6.774 -0.077 -6.356 1.00 . A A . 19 GLU HG3 1 1 16 8181 1 1 19 GLU N N -6.512 2.368 -4.955 1.00 . A A . 19 GLU N 1 1 16 8182 1 1 19 GLU O O -7.791 4.541 -7.611 1.00 . A A . 19 GLU O 1 1 16 8183 1 1 19 GLU OE1 O -9.292 -1.089 -6.826 1.00 . A A . 19 GLU OE1 1 1 16 8184 1 1 19 GLU OE2 O -8.154 -1.361 -8.697 1.00 . A A . 19 GLU OE2 1 1 16 8185 1 1 20 GLY C C -9.307 6.756 -5.365 1.00 . A A . 20 GLY C 1 1 16 8186 1 1 20 GLY CA C -7.835 6.330 -5.425 1.00 . A A . 20 GLY CA 1 1 16 8187 1 1 20 GLY H H -7.278 4.492 -4.527 1.00 . A A . 20 GLY H 1 1 16 8188 1 1 20 GLY HA2 H -7.336 6.776 -4.565 1.00 . A A . 20 GLY HA2 1 1 16 8189 1 1 20 GLY HA3 H -7.397 6.766 -6.323 1.00 . A A . 20 GLY HA3 1 1 16 8190 1 1 20 GLY N N -7.576 4.885 -5.403 1.00 . A A . 20 GLY N 1 1 16 8191 1 1 20 GLY O O -9.629 7.839 -5.852 1.00 . A A . 20 GLY O 1 1 16 8192 1 1 21 MET C C -12.373 5.565 -3.558 1.00 . A A . 21 MET C 1 1 16 8193 1 1 21 MET CA C -11.639 6.226 -4.736 1.00 . A A . 21 MET CA 1 1 16 8194 1 1 21 MET CB C -12.287 5.826 -6.066 1.00 . A A . 21 MET CB 1 1 16 8195 1 1 21 MET CE C -11.222 4.737 -9.080 1.00 . A A . 21 MET CE 1 1 16 8196 1 1 21 MET CG C -12.099 4.362 -6.468 1.00 . A A . 21 MET CG 1 1 16 8197 1 1 21 MET H H -9.892 5.063 -4.402 1.00 . A A . 21 MET H 1 1 16 8198 1 1 21 MET HA H -11.761 7.304 -4.622 1.00 . A A . 21 MET HA 1 1 16 8199 1 1 21 MET HB2 H -13.355 6.010 -5.999 1.00 . A A . 21 MET HB2 1 1 16 8200 1 1 21 MET HB3 H -11.879 6.465 -6.849 1.00 . A A . 21 MET HB3 1 1 16 8201 1 1 21 MET HE1 H -10.310 4.229 -8.768 1.00 . A A . 21 MET HE1 1 1 16 8202 1 1 21 MET HE2 H -11.371 4.581 -10.148 1.00 . A A . 21 MET HE2 1 1 16 8203 1 1 21 MET HE3 H -11.130 5.805 -8.886 1.00 . A A . 21 MET HE3 1 1 16 8204 1 1 21 MET HG2 H -11.054 4.069 -6.375 1.00 . A A . 21 MET HG2 1 1 16 8205 1 1 21 MET HG3 H -12.686 3.738 -5.795 1.00 . A A . 21 MET HG3 1 1 16 8206 1 1 21 MET N N -10.203 5.935 -4.804 1.00 . A A . 21 MET N 1 1 16 8207 1 1 21 MET O O -12.003 4.474 -3.125 1.00 . A A . 21 MET O 1 1 16 8208 1 1 21 MET SD S -12.630 4.050 -8.168 1.00 . A A . 21 MET SD 1 1 16 8209 1 1 22 VAL C C -13.860 5.213 -0.802 1.00 . A A . 22 VAL C 1 1 16 8210 1 1 22 VAL CA C -14.446 5.718 -2.126 1.00 . A A . 22 VAL CA 1 1 16 8211 1 1 22 VAL CB C -15.540 4.812 -2.739 1.00 . A A . 22 VAL CB 1 1 16 8212 1 1 22 VAL CG1 C -16.812 4.823 -1.877 1.00 . A A . 22 VAL CG1 1 1 16 8213 1 1 22 VAL CG2 C -15.940 5.261 -4.153 1.00 . A A . 22 VAL CG2 1 1 16 8214 1 1 22 VAL H H -13.661 7.108 -3.541 1.00 . A A . 22 VAL H 1 1 16 8215 1 1 22 VAL HA H -14.984 6.620 -1.835 1.00 . A A . 22 VAL HA 1 1 16 8216 1 1 22 VAL HB H -15.169 3.789 -2.810 1.00 . A A . 22 VAL HB 1 1 16 8217 1 1 22 VAL HG11 H -17.198 5.839 -1.784 1.00 . A A . 22 VAL HG11 1 1 16 8218 1 1 22 VAL HG12 H -17.578 4.200 -2.338 1.00 . A A . 22 VAL HG12 1 1 16 8219 1 1 22 VAL HG13 H -16.596 4.422 -0.887 1.00 . A A . 22 VAL HG13 1 1 16 8220 1 1 22 VAL HG21 H -16.812 4.702 -4.488 1.00 . A A . 22 VAL HG21 1 1 16 8221 1 1 22 VAL HG22 H -16.191 6.323 -4.152 1.00 . A A . 22 VAL HG22 1 1 16 8222 1 1 22 VAL HG23 H -15.124 5.076 -4.847 1.00 . A A . 22 VAL HG23 1 1 16 8223 1 1 22 VAL N N -13.460 6.212 -3.111 1.00 . A A . 22 VAL N 1 1 16 8224 1 1 22 VAL O O -14.050 4.070 -0.395 1.00 . A A . 22 VAL O 1 1 16 8225 1 1 23 CYS C C -13.418 5.703 2.318 1.00 . A A . 23 CYS C 1 1 16 8226 1 1 23 CYS CA C -12.442 5.842 1.133 1.00 . A A . 23 CYS CA 1 1 16 8227 1 1 23 CYS CB C -11.456 7.001 1.325 1.00 . A A . 23 CYS CB 1 1 16 8228 1 1 23 CYS H H -13.092 7.043 -0.502 1.00 . A A . 23 CYS H 1 1 16 8229 1 1 23 CYS HA H -11.875 4.917 1.034 1.00 . A A . 23 CYS HA 1 1 16 8230 1 1 23 CYS HB2 H -10.818 7.056 0.442 1.00 . A A . 23 CYS HB2 1 1 16 8231 1 1 23 CYS HB3 H -12.031 7.925 1.383 1.00 . A A . 23 CYS HB3 1 1 16 8232 1 1 23 CYS N N -13.149 6.108 -0.118 1.00 . A A . 23 CYS N 1 1 16 8233 1 1 23 CYS O O -13.821 6.713 2.903 1.00 . A A . 23 CYS O 1 1 16 8234 1 1 23 CYS SG S -10.377 6.945 2.777 1.00 . A A . 23 CYS SG 1 1 16 8235 1 1 24 ARG C C -14.345 2.805 4.403 1.00 . A A . 24 ARG C 1 1 16 8236 1 1 24 ARG CA C -14.725 4.155 3.800 1.00 . A A . 24 ARG CA 1 1 16 8237 1 1 24 ARG CB C -16.222 4.161 3.425 1.00 . A A . 24 ARG CB 1 1 16 8238 1 1 24 ARG CD C -16.830 5.989 1.835 1.00 . A A . 24 ARG CD 1 1 16 8239 1 1 24 ARG CG C -16.856 5.558 3.312 1.00 . A A . 24 ARG CG 1 1 16 8240 1 1 24 ARG CZ C -16.917 8.476 1.811 1.00 . A A . 24 ARG CZ 1 1 16 8241 1 1 24 ARG H H -13.538 3.709 2.056 1.00 . A A . 24 ARG H 1 1 16 8242 1 1 24 ARG HA H -14.583 4.900 4.581 1.00 . A A . 24 ARG HA 1 1 16 8243 1 1 24 ARG HB2 H -16.387 3.579 2.516 1.00 . A A . 24 ARG HB2 1 1 16 8244 1 1 24 ARG HB3 H -16.757 3.651 4.229 1.00 . A A . 24 ARG HB3 1 1 16 8245 1 1 24 ARG HD2 H -15.826 6.058 1.459 1.00 . A A . 24 ARG HD2 1 1 16 8246 1 1 24 ARG HD3 H -17.400 5.285 1.252 1.00 . A A . 24 ARG HD3 1 1 16 8247 1 1 24 ARG HE H -18.505 7.298 1.901 1.00 . A A . 24 ARG HE 1 1 16 8248 1 1 24 ARG HG2 H -17.896 5.498 3.640 1.00 . A A . 24 ARG HG2 1 1 16 8249 1 1 24 ARG HG3 H -16.329 6.274 3.945 1.00 . A A . 24 ARG HG3 1 1 16 8250 1 1 24 ARG HH11 H -15.035 7.880 2.186 1.00 . A A . 24 ARG HH11 1 1 16 8251 1 1 24 ARG HH12 H -15.248 9.597 1.992 1.00 . A A . 24 ARG HH12 1 1 16 8252 1 1 24 ARG HH21 H -18.666 9.441 1.551 1.00 . A A . 24 ARG HH21 1 1 16 8253 1 1 24 ARG HH22 H -17.264 10.451 1.615 1.00 . A A . 24 ARG HH22 1 1 16 8254 1 1 24 ARG N N -13.855 4.479 2.645 1.00 . A A . 24 ARG N 1 1 16 8255 1 1 24 ARG NE N -17.498 7.289 1.798 1.00 . A A . 24 ARG NE 1 1 16 8256 1 1 24 ARG NH1 N -15.633 8.660 1.941 1.00 . A A . 24 ARG NH1 1 1 16 8257 1 1 24 ARG NH2 N -17.669 9.528 1.707 1.00 . A A . 24 ARG NH2 1 1 16 8258 1 1 24 ARG O O -14.688 1.776 3.835 1.00 . A A . 24 ARG O 1 1 16 8259 1 1 25 LEU C C -11.809 0.992 5.144 1.00 . A A . 25 LEU C 1 1 16 8260 1 1 25 LEU CA C -12.850 1.651 6.078 1.00 . A A . 25 LEU CA 1 1 16 8261 1 1 25 LEU CB C -13.850 0.608 6.623 1.00 . A A . 25 LEU CB 1 1 16 8262 1 1 25 LEU CD1 C -16.020 0.098 7.777 1.00 . A A . 25 LEU CD1 1 1 16 8263 1 1 25 LEU CD2 C -14.380 1.497 8.946 1.00 . A A . 25 LEU CD2 1 1 16 8264 1 1 25 LEU CG C -14.939 1.152 7.569 1.00 . A A . 25 LEU CG 1 1 16 8265 1 1 25 LEU H H -13.371 3.717 5.894 1.00 . A A . 25 LEU H 1 1 16 8266 1 1 25 LEU HA H -12.283 2.028 6.930 1.00 . A A . 25 LEU HA 1 1 16 8267 1 1 25 LEU HB2 H -14.345 0.139 5.774 1.00 . A A . 25 LEU HB2 1 1 16 8268 1 1 25 LEU HB3 H -13.293 -0.174 7.141 1.00 . A A . 25 LEU HB3 1 1 16 8269 1 1 25 LEU HD11 H -16.460 -0.183 6.820 1.00 . A A . 25 LEU HD11 1 1 16 8270 1 1 25 LEU HD12 H -16.801 0.484 8.431 1.00 . A A . 25 LEU HD12 1 1 16 8271 1 1 25 LEU HD13 H -15.570 -0.778 8.239 1.00 . A A . 25 LEU HD13 1 1 16 8272 1 1 25 LEU HD21 H -13.611 2.262 8.857 1.00 . A A . 25 LEU HD21 1 1 16 8273 1 1 25 LEU HD22 H -13.952 0.611 9.408 1.00 . A A . 25 LEU HD22 1 1 16 8274 1 1 25 LEU HD23 H -15.189 1.865 9.575 1.00 . A A . 25 LEU HD23 1 1 16 8275 1 1 25 LEU HG H -15.415 2.033 7.138 1.00 . A A . 25 LEU HG 1 1 16 8276 1 1 25 LEU N N -13.562 2.808 5.487 1.00 . A A . 25 LEU N 1 1 16 8277 1 1 25 LEU O O -10.802 0.458 5.598 1.00 . A A . 25 LEU O 1 1 16 8278 1 1 26 TRP C C -11.269 1.470 1.488 1.00 . A A . 26 TRP C 1 1 16 8279 1 1 26 TRP CA C -11.117 0.622 2.765 1.00 . A A . 26 TRP CA 1 1 16 8280 1 1 26 TRP CB C -11.375 -0.888 2.563 1.00 . A A . 26 TRP CB 1 1 16 8281 1 1 26 TRP CD1 C -13.313 -1.878 3.871 1.00 . A A . 26 TRP CD1 1 1 16 8282 1 1 26 TRP CD2 C -13.924 -1.263 1.807 1.00 . A A . 26 TRP CD2 1 1 16 8283 1 1 26 TRP CE2 C -15.091 -1.773 2.456 1.00 . A A . 26 TRP CE2 1 1 16 8284 1 1 26 TRP CE3 C -14.097 -0.755 0.500 1.00 . A A . 26 TRP CE3 1 1 16 8285 1 1 26 TRP CG C -12.784 -1.401 2.717 1.00 . A A . 26 TRP CG 1 1 16 8286 1 1 26 TRP CH2 C -16.484 -1.287 0.535 1.00 . A A . 26 TRP CH2 1 1 16 8287 1 1 26 TRP CZ2 C -16.352 -1.793 1.840 1.00 . A A . 26 TRP CZ2 1 1 16 8288 1 1 26 TRP CZ3 C -15.357 -0.775 -0.132 1.00 . A A . 26 TRP CZ3 1 1 16 8289 1 1 26 TRP H H -12.875 1.473 3.528 1.00 . A A . 26 TRP H 1 1 16 8290 1 1 26 TRP HA H -10.079 0.733 3.079 1.00 . A A . 26 TRP HA 1 1 16 8291 1 1 26 TRP HB2 H -10.989 -1.222 1.601 1.00 . A A . 26 TRP HB2 1 1 16 8292 1 1 26 TRP HB3 H -10.779 -1.388 3.323 1.00 . A A . 26 TRP HB3 1 1 16 8293 1 1 26 TRP HD1 H -12.764 -2.008 4.796 1.00 . A A . 26 TRP HD1 1 1 16 8294 1 1 26 TRP HE1 H -15.248 -2.513 4.443 1.00 . A A . 26 TRP HE1 1 1 16 8295 1 1 26 TRP HE3 H -13.252 -0.322 -0.011 1.00 . A A . 26 TRP HE3 1 1 16 8296 1 1 26 TRP HH2 H -17.454 -1.272 0.054 1.00 . A A . 26 TRP HH2 1 1 16 8297 1 1 26 TRP HZ2 H -17.211 -2.167 2.378 1.00 . A A . 26 TRP HZ2 1 1 16 8298 1 1 26 TRP HZ3 H -15.466 -0.362 -1.126 1.00 . A A . 26 TRP HZ3 1 1 16 8299 1 1 26 TRP N N -11.979 1.113 3.832 1.00 . A A . 26 TRP N 1 1 16 8300 1 1 26 TRP NE1 N -14.653 -2.156 3.703 1.00 . A A . 26 TRP NE1 1 1 16 8301 1 1 26 TRP O O -11.935 2.502 1.509 1.00 . A A . 26 TRP O 1 1 16 8302 1 1 27 CYS C C -11.008 0.282 -1.901 1.00 . A A . 27 CYS C 1 1 16 8303 1 1 27 CYS CA C -10.866 1.505 -0.981 1.00 . A A . 27 CYS CA 1 1 16 8304 1 1 27 CYS CB C -9.689 2.378 -1.441 1.00 . A A . 27 CYS CB 1 1 16 8305 1 1 27 CYS H H -10.169 0.145 0.457 1.00 . A A . 27 CYS H 1 1 16 8306 1 1 27 CYS HA H -11.785 2.094 -1.037 1.00 . A A . 27 CYS HA 1 1 16 8307 1 1 27 CYS HB2 H -8.755 1.837 -1.290 1.00 . A A . 27 CYS HB2 1 1 16 8308 1 1 27 CYS HB3 H -9.816 2.545 -2.512 1.00 . A A . 27 CYS HB3 1 1 16 8309 1 1 27 CYS N N -10.661 1.023 0.388 1.00 . A A . 27 CYS N 1 1 16 8310 1 1 27 CYS O O -10.433 -0.760 -1.584 1.00 . A A . 27 CYS O 1 1 16 8311 1 1 27 CYS SG S -9.552 4.008 -0.677 1.00 . A A . 27 CYS SG 1 1 16 8312 1 1 28 LYS C C -12.261 -0.010 -5.434 1.00 . A A . 28 LYS C 1 1 16 8313 1 1 28 LYS CA C -11.965 -0.633 -4.058 1.00 . A A . 28 LYS CA 1 1 16 8314 1 1 28 LYS CB C -13.152 -1.535 -3.640 1.00 . A A . 28 LYS CB 1 1 16 8315 1 1 28 LYS CD C -11.713 -3.482 -2.762 1.00 . A A . 28 LYS CD 1 1 16 8316 1 1 28 LYS CE C -11.662 -4.619 -1.739 1.00 . A A . 28 LYS CE 1 1 16 8317 1 1 28 LYS CG C -12.903 -2.545 -2.506 1.00 . A A . 28 LYS CG 1 1 16 8318 1 1 28 LYS H H -12.121 1.320 -3.226 1.00 . A A . 28 LYS H 1 1 16 8319 1 1 28 LYS HA H -11.069 -1.238 -4.185 1.00 . A A . 28 LYS HA 1 1 16 8320 1 1 28 LYS HB2 H -13.994 -0.900 -3.358 1.00 . A A . 28 LYS HB2 1 1 16 8321 1 1 28 LYS HB3 H -13.476 -2.112 -4.505 1.00 . A A . 28 LYS HB3 1 1 16 8322 1 1 28 LYS HD2 H -11.773 -3.885 -3.771 1.00 . A A . 28 LYS HD2 1 1 16 8323 1 1 28 LYS HD3 H -10.784 -2.923 -2.687 1.00 . A A . 28 LYS HD3 1 1 16 8324 1 1 28 LYS HE2 H -10.637 -4.996 -1.696 1.00 . A A . 28 LYS HE2 1 1 16 8325 1 1 28 LYS HE3 H -11.918 -4.222 -0.752 1.00 . A A . 28 LYS HE3 1 1 16 8326 1 1 28 LYS HG2 H -12.740 -2.015 -1.571 1.00 . A A . 28 LYS HG2 1 1 16 8327 1 1 28 LYS HG3 H -13.808 -3.144 -2.393 1.00 . A A . 28 LYS HG3 1 1 16 8328 1 1 28 LYS HZ1 H -13.545 -5.428 -2.179 1.00 . A A . 28 LYS HZ1 1 1 16 8329 1 1 28 LYS HZ2 H -12.555 -6.470 -1.409 1.00 . A A . 28 LYS HZ2 1 1 16 8330 1 1 28 LYS HZ3 H -12.318 -6.117 -3.009 1.00 . A A . 28 LYS HZ3 1 1 16 8331 1 1 28 LYS N N -11.722 0.408 -3.030 1.00 . A A . 28 LYS N 1 1 16 8332 1 1 28 LYS NZ N -12.575 -5.727 -2.105 1.00 . A A . 28 LYS NZ 1 1 16 8333 1 1 28 LYS O O -12.527 1.189 -5.507 1.00 . A A . 28 LYS O 1 1 16 8334 1 1 29 LYS C C -14.250 0.110 -7.769 1.00 . A A . 29 LYS C 1 1 16 8335 1 1 29 LYS CA C -12.816 -0.399 -7.831 1.00 . A A . 29 LYS CA 1 1 16 8336 1 1 29 LYS CB C -12.750 -1.538 -8.859 1.00 . A A . 29 LYS CB 1 1 16 8337 1 1 29 LYS CD C -11.296 -2.780 -10.518 1.00 . A A . 29 LYS CD 1 1 16 8338 1 1 29 LYS CE C -9.857 -3.093 -10.938 1.00 . A A . 29 LYS CE 1 1 16 8339 1 1 29 LYS CG C -11.326 -1.820 -9.324 1.00 . A A . 29 LYS CG 1 1 16 8340 1 1 29 LYS H H -12.068 -1.787 -6.368 1.00 . A A . 29 LYS H 1 1 16 8341 1 1 29 LYS HA H -12.186 0.420 -8.182 1.00 . A A . 29 LYS HA 1 1 16 8342 1 1 29 LYS HB2 H -13.187 -2.437 -8.430 1.00 . A A . 29 LYS HB2 1 1 16 8343 1 1 29 LYS HB3 H -13.338 -1.249 -9.733 1.00 . A A . 29 LYS HB3 1 1 16 8344 1 1 29 LYS HD2 H -11.793 -3.712 -10.252 1.00 . A A . 29 LYS HD2 1 1 16 8345 1 1 29 LYS HD3 H -11.830 -2.333 -11.356 1.00 . A A . 29 LYS HD3 1 1 16 8346 1 1 29 LYS HE2 H -9.362 -3.643 -10.132 1.00 . A A . 29 LYS HE2 1 1 16 8347 1 1 29 LYS HE3 H -9.877 -3.725 -11.827 1.00 . A A . 29 LYS HE3 1 1 16 8348 1 1 29 LYS HG2 H -10.863 -0.873 -9.596 1.00 . A A . 29 LYS HG2 1 1 16 8349 1 1 29 LYS HG3 H -10.763 -2.266 -8.515 1.00 . A A . 29 LYS HG3 1 1 16 8350 1 1 29 LYS HZ1 H -9.662 -1.208 -11.784 1.00 . A A . 29 LYS HZ1 1 1 16 8351 1 1 29 LYS HZ2 H -8.239 -2.024 -11.701 1.00 . A A . 29 LYS HZ2 1 1 16 8352 1 1 29 LYS HZ3 H -8.880 -1.402 -10.323 1.00 . A A . 29 LYS HZ3 1 1 16 8353 1 1 29 LYS N N -12.335 -0.820 -6.501 1.00 . A A . 29 LYS N 1 1 16 8354 1 1 29 LYS NZ N -9.110 -1.849 -11.213 1.00 . A A . 29 LYS NZ 1 1 16 8355 1 1 29 LYS O O -15.168 -0.658 -7.469 1.00 . A A . 29 LYS O 1 1 16 8356 1 1 30 LYS C C -15.974 3.124 -9.111 1.00 . A A . 30 LYS C 1 1 16 8357 1 1 30 LYS CA C -15.739 2.083 -8.011 1.00 . A A . 30 LYS CA 1 1 16 8358 1 1 30 LYS CB C -15.862 2.663 -6.582 1.00 . A A . 30 LYS CB 1 1 16 8359 1 1 30 LYS CD C -18.356 2.432 -6.228 1.00 . A A . 30 LYS CD 1 1 16 8360 1 1 30 LYS CE C -19.516 1.606 -5.659 1.00 . A A . 30 LYS CE 1 1 16 8361 1 1 30 LYS CG C -16.966 1.961 -5.775 1.00 . A A . 30 LYS CG 1 1 16 8362 1 1 30 LYS H H -13.625 1.909 -8.372 1.00 . A A . 30 LYS H 1 1 16 8363 1 1 30 LYS HA H -16.532 1.351 -8.165 1.00 . A A . 30 LYS HA 1 1 16 8364 1 1 30 LYS HB2 H -14.919 2.540 -6.046 1.00 . A A . 30 LYS HB2 1 1 16 8365 1 1 30 LYS HB3 H -16.067 3.733 -6.623 1.00 . A A . 30 LYS HB3 1 1 16 8366 1 1 30 LYS HD2 H -18.478 3.469 -5.915 1.00 . A A . 30 LYS HD2 1 1 16 8367 1 1 30 LYS HD3 H -18.422 2.413 -7.315 1.00 . A A . 30 LYS HD3 1 1 16 8368 1 1 30 LYS HE2 H -19.461 1.600 -4.569 1.00 . A A . 30 LYS HE2 1 1 16 8369 1 1 30 LYS HE3 H -20.449 2.097 -5.949 1.00 . A A . 30 LYS HE3 1 1 16 8370 1 1 30 LYS HG2 H -16.869 0.881 -5.891 1.00 . A A . 30 LYS HG2 1 1 16 8371 1 1 30 LYS HG3 H -16.841 2.202 -4.720 1.00 . A A . 30 LYS HG3 1 1 16 8372 1 1 30 LYS HZ1 H -20.410 -0.243 -6.000 1.00 . A A . 30 LYS HZ1 1 1 16 8373 1 1 30 LYS HZ2 H -18.803 -0.356 -5.760 1.00 . A A . 30 LYS HZ2 1 1 16 8374 1 1 30 LYS HZ3 H -19.388 0.230 -7.187 1.00 . A A . 30 LYS HZ3 1 1 16 8375 1 1 30 LYS N N -14.452 1.375 -8.127 1.00 . A A . 30 LYS N 1 1 16 8376 1 1 30 LYS NZ N -19.522 0.224 -6.180 1.00 . A A . 30 LYS NZ 1 1 16 8377 1 1 30 LYS O O -16.931 3.898 -9.030 1.00 . A A . 30 LYS O 1 1 16 8378 1 1 31 LEU C C -15.962 3.074 -12.460 1.00 . A A . 31 LEU C 1 1 16 8379 1 1 31 LEU CA C -15.310 3.914 -11.356 1.00 . A A . 31 LEU CA 1 1 16 8380 1 1 31 LEU CB C -13.953 4.522 -11.737 1.00 . A A . 31 LEU CB 1 1 16 8381 1 1 31 LEU CD1 C -12.902 6.471 -12.883 1.00 . A A . 31 LEU CD1 1 1 16 8382 1 1 31 LEU CD2 C -13.698 4.616 -14.271 1.00 . A A . 31 LEU CD2 1 1 16 8383 1 1 31 LEU CG C -13.981 5.403 -12.994 1.00 . A A . 31 LEU CG 1 1 16 8384 1 1 31 LEU H H -14.366 2.464 -10.138 1.00 . A A . 31 LEU H 1 1 16 8385 1 1 31 LEU HA H -15.990 4.735 -11.140 1.00 . A A . 31 LEU HA 1 1 16 8386 1 1 31 LEU HB2 H -13.635 5.132 -10.891 1.00 . A A . 31 LEU HB2 1 1 16 8387 1 1 31 LEU HB3 H -13.215 3.731 -11.872 1.00 . A A . 31 LEU HB3 1 1 16 8388 1 1 31 LEU HD11 H -12.915 7.068 -13.791 1.00 . A A . 31 LEU HD11 1 1 16 8389 1 1 31 LEU HD12 H -11.923 6.004 -12.775 1.00 . A A . 31 LEU HD12 1 1 16 8390 1 1 31 LEU HD13 H -13.093 7.108 -12.020 1.00 . A A . 31 LEU HD13 1 1 16 8391 1 1 31 LEU HD21 H -14.451 3.853 -14.444 1.00 . A A . 31 LEU HD21 1 1 16 8392 1 1 31 LEU HD22 H -12.728 4.128 -14.188 1.00 . A A . 31 LEU HD22 1 1 16 8393 1 1 31 LEU HD23 H -13.696 5.289 -15.130 1.00 . A A . 31 LEU HD23 1 1 16 8394 1 1 31 LEU HG H -14.941 5.905 -13.085 1.00 . A A . 31 LEU HG 1 1 16 8395 1 1 31 LEU N N -15.129 3.129 -10.142 1.00 . A A . 31 LEU N 1 1 16 8396 1 1 31 LEU O O -15.611 1.913 -12.658 1.00 . A A . 31 LEU O 1 1 16 8397 1 1 32 LEU C C -17.222 3.581 -15.603 1.00 . A A . 32 LEU C 1 1 16 8398 1 1 32 LEU CA C -17.644 2.996 -14.254 1.00 . A A . 32 LEU CA 1 1 16 8399 1 1 32 LEU CB C -19.141 3.311 -13.992 1.00 . A A . 32 LEU CB 1 1 16 8400 1 1 32 LEU CD1 C -21.048 3.151 -12.381 1.00 . A A . 32 LEU CD1 1 1 16 8401 1 1 32 LEU CD2 C -19.607 1.138 -12.699 1.00 . A A . 32 LEU CD2 1 1 16 8402 1 1 32 LEU CG C -19.617 2.674 -12.663 1.00 . A A . 32 LEU CG 1 1 16 8403 1 1 32 LEU H H -17.117 4.646 -13.003 1.00 . A A . 32 LEU H 1 1 16 8404 1 1 32 LEU HA H -17.467 1.929 -14.269 1.00 . A A . 32 LEU HA 1 1 16 8405 1 1 32 LEU HB2 H -19.277 4.394 -13.945 1.00 . A A . 32 LEU HB2 1 1 16 8406 1 1 32 LEU HB3 H -19.739 2.927 -14.818 1.00 . A A . 32 LEU HB3 1 1 16 8407 1 1 32 LEU HD11 H -21.723 2.820 -13.172 1.00 . A A . 32 LEU HD11 1 1 16 8408 1 1 32 LEU HD12 H -21.074 4.241 -12.325 1.00 . A A . 32 LEU HD12 1 1 16 8409 1 1 32 LEU HD13 H -21.396 2.754 -11.427 1.00 . A A . 32 LEU HD13 1 1 16 8410 1 1 32 LEU HD21 H -20.161 0.774 -13.566 1.00 . A A . 32 LEU HD21 1 1 16 8411 1 1 32 LEU HD22 H -20.070 0.746 -11.794 1.00 . A A . 32 LEU HD22 1 1 16 8412 1 1 32 LEU HD23 H -18.583 0.765 -12.740 1.00 . A A . 32 LEU HD23 1 1 16 8413 1 1 32 LEU HG H -18.989 3.012 -11.835 1.00 . A A . 32 LEU HG 1 1 16 8414 1 1 32 LEU N N -16.883 3.676 -13.202 1.00 . A A . 32 LEU N 1 1 16 8415 1 1 32 LEU O O -17.646 4.632 -16.018 1.00 . A A . 32 LEU O 1 1 16 8416 1 1 32 LEU OXT O -16.465 3.072 -16.143 1.00 . A A . 32 LEU OXT 1 1 17 8417 1 1 1 GLY C C 1.298 -1.928 -2.187 1.00 . A A . 1 GLY C 1 1 17 8418 1 1 1 GLY CA C 1.986 -0.700 -1.637 1.00 . A A . 1 GLY CA 1 1 17 8419 1 1 1 GLY H1 H 1.860 0.237 -3.463 1.00 . A A . 1 GLY H1 1 1 17 8420 1 1 1 GLY H2 H 2.901 0.956 -2.403 1.00 . A A . 1 GLY H2 1 1 17 8421 1 1 1 GLY H3 H 3.331 -0.440 -3.159 1.00 . A A . 1 GLY H3 1 1 17 8422 1 1 1 GLY HA2 H 2.775 -0.980 -0.941 1.00 . A A . 1 GLY HA2 1 1 17 8423 1 1 1 GLY HA3 H 1.246 -0.091 -1.118 1.00 . A A . 1 GLY HA3 1 1 17 8424 1 1 1 GLY N N 2.558 0.070 -2.750 1.00 . A A . 1 GLY N 1 1 17 8425 1 1 1 GLY O O 0.247 -1.770 -2.798 1.00 . A A . 1 GLY O 1 1 17 8426 1 1 2 PRO C C 0.026 -4.852 -2.257 1.00 . A A . 2 PRO C 1 1 17 8427 1 1 2 PRO CA C 1.393 -4.337 -2.743 1.00 . A A . 2 PRO CA 1 1 17 8428 1 1 2 PRO CB C 2.494 -5.383 -2.541 1.00 . A A . 2 PRO CB 1 1 17 8429 1 1 2 PRO CD C 3.138 -3.406 -1.386 1.00 . A A . 2 PRO CD 1 1 17 8430 1 1 2 PRO CG C 3.215 -4.924 -1.276 1.00 . A A . 2 PRO CG 1 1 17 8431 1 1 2 PRO HA H 1.301 -4.132 -3.811 1.00 . A A . 2 PRO HA 1 1 17 8432 1 1 2 PRO HB2 H 2.089 -6.388 -2.425 1.00 . A A . 2 PRO HB2 1 1 17 8433 1 1 2 PRO HB3 H 3.186 -5.347 -3.384 1.00 . A A . 2 PRO HB3 1 1 17 8434 1 1 2 PRO HD2 H 3.175 -2.955 -0.394 1.00 . A A . 2 PRO HD2 1 1 17 8435 1 1 2 PRO HD3 H 3.961 -3.042 -2.002 1.00 . A A . 2 PRO HD3 1 1 17 8436 1 1 2 PRO HG2 H 2.667 -5.255 -0.394 1.00 . A A . 2 PRO HG2 1 1 17 8437 1 1 2 PRO HG3 H 4.245 -5.278 -1.241 1.00 . A A . 2 PRO HG3 1 1 17 8438 1 1 2 PRO N N 1.882 -3.132 -2.064 1.00 . A A . 2 PRO N 1 1 17 8439 1 1 2 PRO O O -0.588 -5.673 -2.936 1.00 . A A . 2 PRO O 1 1 17 8440 1 1 3 TYR C C -2.587 -3.646 0.117 1.00 . A A . 3 TYR C 1 1 17 8441 1 1 3 TYR CA C -1.802 -4.751 -0.593 1.00 . A A . 3 TYR CA 1 1 17 8442 1 1 3 TYR CB C -1.817 -6.116 0.108 1.00 . A A . 3 TYR CB 1 1 17 8443 1 1 3 TYR CD1 C 0.507 -7.055 0.414 1.00 . A A . 3 TYR CD1 1 1 17 8444 1 1 3 TYR CD2 C -0.578 -5.960 2.302 1.00 . A A . 3 TYR CD2 1 1 17 8445 1 1 3 TYR CE1 C 1.643 -7.301 1.204 1.00 . A A . 3 TYR CE1 1 1 17 8446 1 1 3 TYR CE2 C 0.556 -6.205 3.094 1.00 . A A . 3 TYR CE2 1 1 17 8447 1 1 3 TYR CG C -0.603 -6.388 0.964 1.00 . A A . 3 TYR CG 1 1 17 8448 1 1 3 TYR CZ C 1.666 -6.884 2.547 1.00 . A A . 3 TYR CZ 1 1 17 8449 1 1 3 TYR H H 0.106 -3.802 -0.533 1.00 . A A . 3 TYR H 1 1 17 8450 1 1 3 TYR HA H -2.412 -4.932 -1.480 1.00 . A A . 3 TYR HA 1 1 17 8451 1 1 3 TYR HB2 H -2.719 -6.219 0.710 1.00 . A A . 3 TYR HB2 1 1 17 8452 1 1 3 TYR HB3 H -1.860 -6.886 -0.659 1.00 . A A . 3 TYR HB3 1 1 17 8453 1 1 3 TYR HD1 H 0.489 -7.384 -0.618 1.00 . A A . 3 TYR HD1 1 1 17 8454 1 1 3 TYR HD2 H -1.433 -5.448 2.725 1.00 . A A . 3 TYR HD2 1 1 17 8455 1 1 3 TYR HE1 H 2.491 -7.824 0.791 1.00 . A A . 3 TYR HE1 1 1 17 8456 1 1 3 TYR HE2 H 0.572 -5.889 4.127 1.00 . A A . 3 TYR HE2 1 1 17 8457 1 1 3 TYR HH H 3.546 -7.236 2.812 1.00 . A A . 3 TYR HH 1 1 17 8458 1 1 3 TYR N N -0.481 -4.390 -1.113 1.00 . A A . 3 TYR N 1 1 17 8459 1 1 3 TYR O O -2.703 -3.618 1.343 1.00 . A A . 3 TYR O 1 1 17 8460 1 1 3 TYR OH O 2.717 -7.219 3.333 1.00 . A A . 3 TYR OH 1 1 17 8461 1 1 4 CYS C C -5.406 -1.633 -1.062 1.00 . A A . 4 CYS C 1 1 17 8462 1 1 4 CYS CA C -4.116 -1.737 -0.221 1.00 . A A . 4 CYS CA 1 1 17 8463 1 1 4 CYS CB C -3.374 -0.402 -0.039 1.00 . A A . 4 CYS CB 1 1 17 8464 1 1 4 CYS H H -2.888 -2.733 -1.652 1.00 . A A . 4 CYS H 1 1 17 8465 1 1 4 CYS HA H -4.465 -2.033 0.768 1.00 . A A . 4 CYS HA 1 1 17 8466 1 1 4 CYS HB2 H -4.108 0.365 0.210 1.00 . A A . 4 CYS HB2 1 1 17 8467 1 1 4 CYS HB3 H -2.718 -0.500 0.827 1.00 . A A . 4 CYS HB3 1 1 17 8468 1 1 4 CYS N N -3.175 -2.758 -0.686 1.00 . A A . 4 CYS N 1 1 17 8469 1 1 4 CYS O O -6.377 -1.039 -0.607 1.00 . A A . 4 CYS O 1 1 17 8470 1 1 4 CYS SG S -2.349 0.216 -1.414 1.00 . A A . 4 CYS SG 1 1 17 8471 1 1 5 GLN C C -7.398 -3.761 -2.614 1.00 . A A . 5 GLN C 1 1 17 8472 1 1 5 GLN CA C -6.733 -2.425 -2.989 1.00 . A A . 5 GLN CA 1 1 17 8473 1 1 5 GLN CB C -6.445 -2.350 -4.499 1.00 . A A . 5 GLN CB 1 1 17 8474 1 1 5 GLN CD C -7.683 -2.975 -6.653 1.00 . A A . 5 GLN CD 1 1 17 8475 1 1 5 GLN CG C -7.732 -2.205 -5.335 1.00 . A A . 5 GLN CG 1 1 17 8476 1 1 5 GLN H H -4.625 -2.622 -2.649 1.00 . A A . 5 GLN H 1 1 17 8477 1 1 5 GLN HA H -7.424 -1.618 -2.733 1.00 . A A . 5 GLN HA 1 1 17 8478 1 1 5 GLN HB2 H -5.799 -1.497 -4.709 1.00 . A A . 5 GLN HB2 1 1 17 8479 1 1 5 GLN HB3 H -5.911 -3.254 -4.797 1.00 . A A . 5 GLN HB3 1 1 17 8480 1 1 5 GLN HE21 H -5.979 -2.042 -7.302 1.00 . A A . 5 GLN HE21 1 1 17 8481 1 1 5 GLN HE22 H -6.603 -3.326 -8.307 1.00 . A A . 5 GLN HE22 1 1 17 8482 1 1 5 GLN HG2 H -8.586 -2.569 -4.766 1.00 . A A . 5 GLN HG2 1 1 17 8483 1 1 5 GLN HG3 H -7.911 -1.150 -5.539 1.00 . A A . 5 GLN HG3 1 1 17 8484 1 1 5 GLN N N -5.473 -2.256 -2.247 1.00 . A A . 5 GLN N 1 1 17 8485 1 1 5 GLN NE2 N -6.682 -2.759 -7.479 1.00 . A A . 5 GLN NE2 1 1 17 8486 1 1 5 GLN O O -8.592 -3.829 -2.329 1.00 . A A . 5 GLN O 1 1 17 8487 1 1 5 GLN OE1 O -8.448 -3.910 -6.875 1.00 . A A . 5 GLN OE1 1 1 17 8488 1 1 6 LYS C C -7.029 -6.537 -0.754 1.00 . A A . 6 LYS C 1 1 17 8489 1 1 6 LYS CA C -7.017 -6.210 -2.264 1.00 . A A . 6 LYS CA 1 1 17 8490 1 1 6 LYS CB C -6.107 -7.161 -3.068 1.00 . A A . 6 LYS CB 1 1 17 8491 1 1 6 LYS CD C -5.884 -9.630 -3.701 1.00 . A A . 6 LYS CD 1 1 17 8492 1 1 6 LYS CE C -5.821 -10.596 -2.510 1.00 . A A . 6 LYS CE 1 1 17 8493 1 1 6 LYS CG C -6.839 -8.452 -3.461 1.00 . A A . 6 LYS CG 1 1 17 8494 1 1 6 LYS H H -5.631 -4.693 -2.815 1.00 . A A . 6 LYS H 1 1 17 8495 1 1 6 LYS HA H -8.045 -6.330 -2.613 1.00 . A A . 6 LYS HA 1 1 17 8496 1 1 6 LYS HB2 H -5.778 -6.680 -3.992 1.00 . A A . 6 LYS HB2 1 1 17 8497 1 1 6 LYS HB3 H -5.216 -7.384 -2.479 1.00 . A A . 6 LYS HB3 1 1 17 8498 1 1 6 LYS HD2 H -6.249 -10.197 -4.557 1.00 . A A . 6 LYS HD2 1 1 17 8499 1 1 6 LYS HD3 H -4.888 -9.268 -3.957 1.00 . A A . 6 LYS HD3 1 1 17 8500 1 1 6 LYS HE2 H -6.815 -11.023 -2.367 1.00 . A A . 6 LYS HE2 1 1 17 8501 1 1 6 LYS HE3 H -5.150 -11.420 -2.767 1.00 . A A . 6 LYS HE3 1 1 17 8502 1 1 6 LYS HG2 H -7.558 -8.728 -2.692 1.00 . A A . 6 LYS HG2 1 1 17 8503 1 1 6 LYS HG3 H -7.397 -8.254 -4.378 1.00 . A A . 6 LYS HG3 1 1 17 8504 1 1 6 LYS HZ1 H -5.386 -10.667 -0.499 1.00 . A A . 6 LYS HZ1 1 1 17 8505 1 1 6 LYS HZ2 H -6.028 -9.233 -0.955 1.00 . A A . 6 LYS HZ2 1 1 17 8506 1 1 6 LYS HZ3 H -4.456 -9.568 -1.329 1.00 . A A . 6 LYS HZ3 1 1 17 8507 1 1 6 LYS N N -6.597 -4.832 -2.560 1.00 . A A . 6 LYS N 1 1 17 8508 1 1 6 LYS NZ N -5.386 -9.969 -1.240 1.00 . A A . 6 LYS NZ 1 1 17 8509 1 1 6 LYS O O -6.801 -7.691 -0.382 1.00 . A A . 6 LYS O 1 1 17 8510 1 1 7 TRP C C -7.668 -4.331 2.169 1.00 . A A . 7 TRP C 1 1 17 8511 1 1 7 TRP CA C -7.044 -5.601 1.560 1.00 . A A . 7 TRP CA 1 1 17 8512 1 1 7 TRP CB C -5.569 -5.727 1.984 1.00 . A A . 7 TRP CB 1 1 17 8513 1 1 7 TRP CD1 C -5.834 -7.673 3.594 1.00 . A A . 7 TRP CD1 1 1 17 8514 1 1 7 TRP CD2 C -4.297 -6.196 4.288 1.00 . A A . 7 TRP CD2 1 1 17 8515 1 1 7 TRP CE2 C -4.275 -7.287 5.208 1.00 . A A . 7 TRP CE2 1 1 17 8516 1 1 7 TRP CE3 C -3.383 -5.144 4.526 1.00 . A A . 7 TRP CE3 1 1 17 8517 1 1 7 TRP CG C -5.295 -6.478 3.254 1.00 . A A . 7 TRP CG 1 1 17 8518 1 1 7 TRP CH2 C -2.437 -6.314 6.453 1.00 . A A . 7 TRP CH2 1 1 17 8519 1 1 7 TRP CZ2 C -3.369 -7.352 6.276 1.00 . A A . 7 TRP CZ2 1 1 17 8520 1 1 7 TRP CZ3 C -2.460 -5.205 5.589 1.00 . A A . 7 TRP CZ3 1 1 17 8521 1 1 7 TRP H H -7.335 -4.601 -0.287 1.00 . A A . 7 TRP H 1 1 17 8522 1 1 7 TRP HA H -7.605 -6.473 1.891 1.00 . A A . 7 TRP HA 1 1 17 8523 1 1 7 TRP HB2 H -5.022 -6.255 1.202 1.00 . A A . 7 TRP HB2 1 1 17 8524 1 1 7 TRP HB3 H -5.131 -4.731 2.056 1.00 . A A . 7 TRP HB3 1 1 17 8525 1 1 7 TRP HD1 H -6.571 -8.216 3.014 1.00 . A A . 7 TRP HD1 1 1 17 8526 1 1 7 TRP HE1 H -5.552 -9.008 5.209 1.00 . A A . 7 TRP HE1 1 1 17 8527 1 1 7 TRP HE3 H -3.387 -4.293 3.862 1.00 . A A . 7 TRP HE3 1 1 17 8528 1 1 7 TRP HH2 H -1.712 -6.357 7.256 1.00 . A A . 7 TRP HH2 1 1 17 8529 1 1 7 TRP HZ2 H -3.390 -8.199 6.945 1.00 . A A . 7 TRP HZ2 1 1 17 8530 1 1 7 TRP HZ3 H -1.753 -4.399 5.740 1.00 . A A . 7 TRP HZ3 1 1 17 8531 1 1 7 TRP N N -7.117 -5.510 0.097 1.00 . A A . 7 TRP N 1 1 17 8532 1 1 7 TRP NE1 N -5.273 -8.128 4.768 1.00 . A A . 7 TRP NE1 1 1 17 8533 1 1 7 TRP O O -7.722 -3.285 1.515 1.00 . A A . 7 TRP O 1 1 17 8534 1 1 8 MET C C -7.930 -2.197 4.640 1.00 . A A . 8 MET C 1 1 17 8535 1 1 8 MET CA C -8.856 -3.276 4.068 1.00 . A A . 8 MET CA 1 1 17 8536 1 1 8 MET CB C -9.876 -3.794 5.092 1.00 . A A . 8 MET CB 1 1 17 8537 1 1 8 MET CE C -12.566 -6.848 4.527 1.00 . A A . 8 MET CE 1 1 17 8538 1 1 8 MET CG C -10.775 -4.840 4.435 1.00 . A A . 8 MET CG 1 1 17 8539 1 1 8 MET H H -8.035 -5.256 3.929 1.00 . A A . 8 MET H 1 1 17 8540 1 1 8 MET HA H -9.437 -2.790 3.286 1.00 . A A . 8 MET HA 1 1 17 8541 1 1 8 MET HB2 H -9.370 -4.235 5.949 1.00 . A A . 8 MET HB2 1 1 17 8542 1 1 8 MET HB3 H -10.489 -2.958 5.433 1.00 . A A . 8 MET HB3 1 1 17 8543 1 1 8 MET HE1 H -12.677 -6.731 3.448 1.00 . A A . 8 MET HE1 1 1 17 8544 1 1 8 MET HE2 H -11.700 -7.479 4.728 1.00 . A A . 8 MET HE2 1 1 17 8545 1 1 8 MET HE3 H -13.455 -7.325 4.935 1.00 . A A . 8 MET HE3 1 1 17 8546 1 1 8 MET HG2 H -11.030 -4.519 3.425 1.00 . A A . 8 MET HG2 1 1 17 8547 1 1 8 MET HG3 H -10.197 -5.761 4.359 1.00 . A A . 8 MET HG3 1 1 17 8548 1 1 8 MET N N -8.113 -4.381 3.431 1.00 . A A . 8 MET N 1 1 17 8549 1 1 8 MET O O -7.663 -2.134 5.841 1.00 . A A . 8 MET O 1 1 17 8550 1 1 8 MET SD S -12.313 -5.224 5.292 1.00 . A A . 8 MET SD 1 1 17 8551 1 1 9 GLN C C -6.589 0.812 4.874 1.00 . A A . 9 GLN C 1 1 17 8552 1 1 9 GLN CA C -6.349 -0.375 3.910 1.00 . A A . 9 GLN CA 1 1 17 8553 1 1 9 GLN CB C -6.032 0.154 2.507 1.00 . A A . 9 GLN CB 1 1 17 8554 1 1 9 GLN CD C -6.755 2.302 1.355 1.00 . A A . 9 GLN CD 1 1 17 8555 1 1 9 GLN CG C -7.206 0.966 1.916 1.00 . A A . 9 GLN CG 1 1 17 8556 1 1 9 GLN H H -7.649 -1.594 2.775 1.00 . A A . 9 GLN H 1 1 17 8557 1 1 9 GLN HA H -5.472 -0.905 4.277 1.00 . A A . 9 GLN HA 1 1 17 8558 1 1 9 GLN HB2 H -5.124 0.758 2.547 1.00 . A A . 9 GLN HB2 1 1 17 8559 1 1 9 GLN HB3 H -5.824 -0.692 1.859 1.00 . A A . 9 GLN HB3 1 1 17 8560 1 1 9 GLN HE21 H -6.165 2.974 3.167 1.00 . A A . 9 GLN HE21 1 1 17 8561 1 1 9 GLN HE22 H -5.852 4.034 1.776 1.00 . A A . 9 GLN HE22 1 1 17 8562 1 1 9 GLN HG2 H -7.683 0.389 1.125 1.00 . A A . 9 GLN HG2 1 1 17 8563 1 1 9 GLN HG3 H -7.967 1.169 2.669 1.00 . A A . 9 GLN HG3 1 1 17 8564 1 1 9 GLN N N -7.423 -1.362 3.737 1.00 . A A . 9 GLN N 1 1 17 8565 1 1 9 GLN NE2 N -6.252 3.192 2.180 1.00 . A A . 9 GLN NE2 1 1 17 8566 1 1 9 GLN O O -5.870 1.804 4.779 1.00 . A A . 9 GLN O 1 1 17 8567 1 1 9 GLN OE1 O -6.633 2.462 0.153 1.00 . A A . 9 GLN OE1 1 1 17 8568 1 1 10 THR C C -7.929 3.261 6.203 1.00 . A A . 10 THR C 1 1 17 8569 1 1 10 THR CA C -7.986 1.810 6.709 1.00 . A A . 10 THR CA 1 1 17 8570 1 1 10 THR CB C -7.145 1.641 7.985 1.00 . A A . 10 THR CB 1 1 17 8571 1 1 10 THR CG2 C -7.869 2.277 9.166 1.00 . A A . 10 THR CG2 1 1 17 8572 1 1 10 THR H H -8.191 -0.055 5.712 1.00 . A A . 10 THR H 1 1 17 8573 1 1 10 THR HA H -9.018 1.613 6.997 1.00 . A A . 10 THR HA 1 1 17 8574 1 1 10 THR HB H -6.167 2.102 7.862 1.00 . A A . 10 THR HB 1 1 17 8575 1 1 10 THR HG1 H -6.087 0.013 7.938 1.00 . A A . 10 THR HG1 1 1 17 8576 1 1 10 THR HG21 H -8.821 1.775 9.338 1.00 . A A . 10 THR HG21 1 1 17 8577 1 1 10 THR HG22 H -8.054 3.332 8.971 1.00 . A A . 10 THR HG22 1 1 17 8578 1 1 10 THR HG23 H -7.244 2.189 10.050 1.00 . A A . 10 THR HG23 1 1 17 8579 1 1 10 THR N N -7.639 0.795 5.695 1.00 . A A . 10 THR N 1 1 17 8580 1 1 10 THR O O -6.917 3.954 6.336 1.00 . A A . 10 THR O 1 1 17 8581 1 1 10 THR OG1 O -6.954 0.279 8.306 1.00 . A A . 10 THR OG1 1 1 17 8582 1 1 11 CYS C C -9.203 6.267 5.904 1.00 . A A . 11 CYS C 1 1 17 8583 1 1 11 CYS CA C -9.169 5.044 4.959 1.00 . A A . 11 CYS CA 1 1 17 8584 1 1 11 CYS CB C -10.399 4.994 4.053 1.00 . A A . 11 CYS CB 1 1 17 8585 1 1 11 CYS H H -9.824 3.115 5.563 1.00 . A A . 11 CYS H 1 1 17 8586 1 1 11 CYS HA H -8.295 5.181 4.320 1.00 . A A . 11 CYS HA 1 1 17 8587 1 1 11 CYS HB2 H -11.276 4.823 4.673 1.00 . A A . 11 CYS HB2 1 1 17 8588 1 1 11 CYS HB3 H -10.529 5.966 3.572 1.00 . A A . 11 CYS HB3 1 1 17 8589 1 1 11 CYS N N -9.035 3.737 5.626 1.00 . A A . 11 CYS N 1 1 17 8590 1 1 11 CYS O O -10.045 7.155 5.764 1.00 . A A . 11 CYS O 1 1 17 8591 1 1 11 CYS SG S -10.311 3.732 2.764 1.00 . A A . 11 CYS SG 1 1 17 8592 1 1 12 ASP C C -7.706 8.753 6.999 1.00 . A A . 12 ASP C 1 1 17 8593 1 1 12 ASP CA C -8.055 7.456 7.737 1.00 . A A . 12 ASP CA 1 1 17 8594 1 1 12 ASP CB C -7.006 7.092 8.799 1.00 . A A . 12 ASP CB 1 1 17 8595 1 1 12 ASP CG C -7.540 6.094 9.827 1.00 . A A . 12 ASP CG 1 1 17 8596 1 1 12 ASP H H -7.617 5.552 6.901 1.00 . A A . 12 ASP H 1 1 17 8597 1 1 12 ASP HA H -8.994 7.657 8.250 1.00 . A A . 12 ASP HA 1 1 17 8598 1 1 12 ASP HB2 H -6.113 6.693 8.313 1.00 . A A . 12 ASP HB2 1 1 17 8599 1 1 12 ASP HB3 H -6.730 8.000 9.331 1.00 . A A . 12 ASP HB3 1 1 17 8600 1 1 12 ASP N N -8.285 6.313 6.865 1.00 . A A . 12 ASP N 1 1 17 8601 1 1 12 ASP O O -6.993 8.723 5.998 1.00 . A A . 12 ASP O 1 1 17 8602 1 1 12 ASP OD1 O -6.783 5.210 10.281 1.00 . A A . 12 ASP OD1 1 1 17 8603 1 1 12 ASP OD2 O -8.733 6.203 10.190 1.00 . A A . 12 ASP OD2 1 1 17 8604 1 1 13 SER C C -6.544 11.661 6.587 1.00 . A A . 13 SER C 1 1 17 8605 1 1 13 SER CA C -7.996 11.210 6.855 1.00 . A A . 13 SER CA 1 1 17 8606 1 1 13 SER CB C -8.730 12.277 7.672 1.00 . A A . 13 SER CB 1 1 17 8607 1 1 13 SER H H -8.768 9.842 8.321 1.00 . A A . 13 SER H 1 1 17 8608 1 1 13 SER HA H -8.488 11.139 5.884 1.00 . A A . 13 SER HA 1 1 17 8609 1 1 13 SER HB2 H -9.750 11.946 7.864 1.00 . A A . 13 SER HB2 1 1 17 8610 1 1 13 SER HB3 H -8.228 12.410 8.630 1.00 . A A . 13 SER HB3 1 1 17 8611 1 1 13 SER HG H -7.948 13.614 6.478 1.00 . A A . 13 SER HG 1 1 17 8612 1 1 13 SER N N -8.142 9.902 7.525 1.00 . A A . 13 SER N 1 1 17 8613 1 1 13 SER O O -6.331 12.660 5.903 1.00 . A A . 13 SER O 1 1 17 8614 1 1 13 SER OG O -8.774 13.514 6.983 1.00 . A A . 13 SER OG 1 1 17 8615 1 1 14 GLU C C -3.559 10.249 5.693 1.00 . A A . 14 GLU C 1 1 17 8616 1 1 14 GLU CA C -4.107 11.167 6.801 1.00 . A A . 14 GLU CA 1 1 17 8617 1 1 14 GLU CB C -3.300 10.949 8.084 1.00 . A A . 14 GLU CB 1 1 17 8618 1 1 14 GLU CD C -2.932 11.696 10.484 1.00 . A A . 14 GLU CD 1 1 17 8619 1 1 14 GLU CG C -3.482 12.075 9.106 1.00 . A A . 14 GLU CG 1 1 17 8620 1 1 14 GLU H H -5.776 10.161 7.672 1.00 . A A . 14 GLU H 1 1 17 8621 1 1 14 GLU HA H -3.943 12.190 6.463 1.00 . A A . 14 GLU HA 1 1 17 8622 1 1 14 GLU HB2 H -3.624 10.000 8.504 1.00 . A A . 14 GLU HB2 1 1 17 8623 1 1 14 GLU HB3 H -2.236 10.873 7.865 1.00 . A A . 14 GLU HB3 1 1 17 8624 1 1 14 GLU HG2 H -2.981 12.972 8.739 1.00 . A A . 14 GLU HG2 1 1 17 8625 1 1 14 GLU HG3 H -4.543 12.303 9.208 1.00 . A A . 14 GLU HG3 1 1 17 8626 1 1 14 GLU N N -5.534 10.962 7.107 1.00 . A A . 14 GLU N 1 1 17 8627 1 1 14 GLU O O -2.348 10.242 5.452 1.00 . A A . 14 GLU O 1 1 17 8628 1 1 14 GLU OE1 O -2.628 10.502 10.724 1.00 . A A . 14 GLU OE1 1 1 17 8629 1 1 14 GLU OE2 O -2.845 12.596 11.352 1.00 . A A . 14 GLU OE2 1 1 17 8630 1 1 15 ARG C C -4.440 8.541 2.744 1.00 . A A . 15 ARG C 1 1 17 8631 1 1 15 ARG CA C -3.978 8.323 4.183 1.00 . A A . 15 ARG CA 1 1 17 8632 1 1 15 ARG CB C -4.483 6.959 4.694 1.00 . A A . 15 ARG CB 1 1 17 8633 1 1 15 ARG CD C -4.107 4.525 4.277 1.00 . A A . 15 ARG CD 1 1 17 8634 1 1 15 ARG CG C -3.405 5.873 4.515 1.00 . A A . 15 ARG CG 1 1 17 8635 1 1 15 ARG CZ C -3.203 3.071 6.048 1.00 . A A . 15 ARG CZ 1 1 17 8636 1 1 15 ARG H H -5.384 9.428 5.350 1.00 . A A . 15 ARG H 1 1 17 8637 1 1 15 ARG HA H -2.888 8.309 4.174 1.00 . A A . 15 ARG HA 1 1 17 8638 1 1 15 ARG HB2 H -4.726 7.017 5.757 1.00 . A A . 15 ARG HB2 1 1 17 8639 1 1 15 ARG HB3 H -5.398 6.693 4.160 1.00 . A A . 15 ARG HB3 1 1 17 8640 1 1 15 ARG HD2 H -5.051 4.495 4.802 1.00 . A A . 15 ARG HD2 1 1 17 8641 1 1 15 ARG HD3 H -4.224 4.390 3.212 1.00 . A A . 15 ARG HD3 1 1 17 8642 1 1 15 ARG HE H -2.476 3.104 4.207 1.00 . A A . 15 ARG HE 1 1 17 8643 1 1 15 ARG HG2 H -2.774 6.075 3.654 1.00 . A A . 15 ARG HG2 1 1 17 8644 1 1 15 ARG HG3 H -2.781 5.856 5.407 1.00 . A A . 15 ARG HG3 1 1 17 8645 1 1 15 ARG HH11 H -4.930 3.906 6.608 1.00 . A A . 15 ARG HH11 1 1 17 8646 1 1 15 ARG HH12 H -3.972 3.281 7.918 1.00 . A A . 15 ARG HH12 1 1 17 8647 1 1 15 ARG HH21 H -1.629 1.910 5.721 1.00 . A A . 15 ARG HH21 1 1 17 8648 1 1 15 ARG HH22 H -2.353 1.821 7.339 1.00 . A A . 15 ARG HH22 1 1 17 8649 1 1 15 ARG N N -4.401 9.398 5.089 1.00 . A A . 15 ARG N 1 1 17 8650 1 1 15 ARG NE N -3.203 3.491 4.796 1.00 . A A . 15 ARG NE 1 1 17 8651 1 1 15 ARG NH1 N -4.080 3.464 6.928 1.00 . A A . 15 ARG NH1 1 1 17 8652 1 1 15 ARG NH2 N -2.293 2.228 6.419 1.00 . A A . 15 ARG NH2 1 1 17 8653 1 1 15 ARG O O -5.521 9.059 2.463 1.00 . A A . 15 ARG O 1 1 17 8654 1 1 16 LYS C C -5.090 6.589 0.334 1.00 . A A . 16 LYS C 1 1 17 8655 1 1 16 LYS CA C -4.029 7.693 0.437 1.00 . A A . 16 LYS CA 1 1 17 8656 1 1 16 LYS CB C -2.756 7.295 -0.324 1.00 . A A . 16 LYS CB 1 1 17 8657 1 1 16 LYS CD C -0.378 8.022 -0.867 1.00 . A A . 16 LYS CD 1 1 17 8658 1 1 16 LYS CE C 0.268 8.986 -1.862 1.00 . A A . 16 LYS CE 1 1 17 8659 1 1 16 LYS CG C -1.795 8.484 -0.491 1.00 . A A . 16 LYS CG 1 1 17 8660 1 1 16 LYS H H -2.774 7.611 2.156 1.00 . A A . 16 LYS H 1 1 17 8661 1 1 16 LYS HA H -4.443 8.594 -0.014 1.00 . A A . 16 LYS HA 1 1 17 8662 1 1 16 LYS HB2 H -2.257 6.489 0.216 1.00 . A A . 16 LYS HB2 1 1 17 8663 1 1 16 LYS HB3 H -3.018 6.916 -1.311 1.00 . A A . 16 LYS HB3 1 1 17 8664 1 1 16 LYS HD2 H 0.229 7.975 0.038 1.00 . A A . 16 LYS HD2 1 1 17 8665 1 1 16 LYS HD3 H -0.401 7.022 -1.304 1.00 . A A . 16 LYS HD3 1 1 17 8666 1 1 16 LYS HE2 H 0.130 10.007 -1.502 1.00 . A A . 16 LYS HE2 1 1 17 8667 1 1 16 LYS HE3 H 1.340 8.775 -1.922 1.00 . A A . 16 LYS HE3 1 1 17 8668 1 1 16 LYS HG2 H -2.205 9.148 -1.253 1.00 . A A . 16 LYS HG2 1 1 17 8669 1 1 16 LYS HG3 H -1.725 9.058 0.432 1.00 . A A . 16 LYS HG3 1 1 17 8670 1 1 16 LYS HZ1 H -0.238 7.873 -3.515 1.00 . A A . 16 LYS HZ1 1 1 17 8671 1 1 16 LYS HZ2 H 0.067 9.428 -3.906 1.00 . A A . 16 LYS HZ2 1 1 17 8672 1 1 16 LYS HZ3 H -1.346 9.008 -3.189 1.00 . A A . 16 LYS HZ3 1 1 17 8673 1 1 16 LYS N N -3.657 7.974 1.829 1.00 . A A . 16 LYS N 1 1 17 8674 1 1 16 LYS NZ N -0.342 8.832 -3.196 1.00 . A A . 16 LYS NZ 1 1 17 8675 1 1 16 LYS O O -5.007 5.594 1.057 1.00 . A A . 16 LYS O 1 1 17 8676 1 1 17 CYS C C -5.565 4.801 -2.207 1.00 . A A . 17 CYS C 1 1 17 8677 1 1 17 CYS CA C -6.563 5.462 -1.249 1.00 . A A . 17 CYS CA 1 1 17 8678 1 1 17 CYS CB C -7.854 5.781 -2.002 1.00 . A A . 17 CYS CB 1 1 17 8679 1 1 17 CYS H H -6.011 7.527 -1.195 1.00 . A A . 17 CYS H 1 1 17 8680 1 1 17 CYS HA H -6.811 4.766 -0.451 1.00 . A A . 17 CYS HA 1 1 17 8681 1 1 17 CYS HB2 H -8.629 6.072 -1.295 1.00 . A A . 17 CYS HB2 1 1 17 8682 1 1 17 CYS HB3 H -7.671 6.625 -2.667 1.00 . A A . 17 CYS HB3 1 1 17 8683 1 1 17 CYS N N -5.961 6.666 -0.672 1.00 . A A . 17 CYS N 1 1 17 8684 1 1 17 CYS O O -5.013 5.483 -3.073 1.00 . A A . 17 CYS O 1 1 17 8685 1 1 17 CYS SG S -8.426 4.384 -3.015 1.00 . A A . 17 CYS SG 1 1 17 8686 1 1 18 CYS C C -4.548 2.971 -4.467 1.00 . A A . 18 CYS C 1 1 17 8687 1 1 18 CYS CA C -4.530 2.668 -2.960 1.00 . A A . 18 CYS CA 1 1 17 8688 1 1 18 CYS CB C -4.869 1.198 -2.729 1.00 . A A . 18 CYS CB 1 1 17 8689 1 1 18 CYS H H -5.950 2.997 -1.415 1.00 . A A . 18 CYS H 1 1 17 8690 1 1 18 CYS HA H -3.520 2.852 -2.589 1.00 . A A . 18 CYS HA 1 1 17 8691 1 1 18 CYS HB2 H -5.159 1.063 -1.687 1.00 . A A . 18 CYS HB2 1 1 17 8692 1 1 18 CYS HB3 H -5.727 0.923 -3.342 1.00 . A A . 18 CYS HB3 1 1 17 8693 1 1 18 CYS N N -5.455 3.473 -2.165 1.00 . A A . 18 CYS N 1 1 17 8694 1 1 18 CYS O O -3.488 3.218 -5.034 1.00 . A A . 18 CYS O 1 1 17 8695 1 1 18 CYS SG S -3.506 0.064 -3.083 1.00 . A A . 18 CYS SG 1 1 17 8696 1 1 19 GLU C C -6.689 4.681 -6.820 1.00 . A A . 19 GLU C 1 1 17 8697 1 1 19 GLU CA C -5.886 3.386 -6.537 1.00 . A A . 19 GLU CA 1 1 17 8698 1 1 19 GLU CB C -6.555 2.195 -7.257 1.00 . A A . 19 GLU CB 1 1 17 8699 1 1 19 GLU CD C -4.757 0.329 -7.521 1.00 . A A . 19 GLU CD 1 1 17 8700 1 1 19 GLU CG C -6.098 0.769 -6.927 1.00 . A A . 19 GLU CG 1 1 17 8701 1 1 19 GLU H H -6.558 2.928 -4.550 1.00 . A A . 19 GLU H 1 1 17 8702 1 1 19 GLU HA H -4.906 3.524 -6.995 1.00 . A A . 19 GLU HA 1 1 17 8703 1 1 19 GLU HB2 H -7.608 2.225 -7.003 1.00 . A A . 19 GLU HB2 1 1 17 8704 1 1 19 GLU HB3 H -6.479 2.341 -8.336 1.00 . A A . 19 GLU HB3 1 1 17 8705 1 1 19 GLU HG2 H -6.081 0.628 -5.845 1.00 . A A . 19 GLU HG2 1 1 17 8706 1 1 19 GLU HG3 H -6.867 0.100 -7.318 1.00 . A A . 19 GLU HG3 1 1 17 8707 1 1 19 GLU N N -5.725 3.108 -5.091 1.00 . A A . 19 GLU N 1 1 17 8708 1 1 19 GLU O O -7.171 4.886 -7.932 1.00 . A A . 19 GLU O 1 1 17 8709 1 1 19 GLU OE1 O -3.905 1.168 -7.909 1.00 . A A . 19 GLU OE1 1 1 17 8710 1 1 19 GLU OE2 O -4.550 -0.908 -7.570 1.00 . A A . 19 GLU OE2 1 1 17 8711 1 1 20 GLY C C -9.311 6.447 -6.094 1.00 . A A . 20 GLY C 1 1 17 8712 1 1 20 GLY CA C -7.800 6.723 -5.960 1.00 . A A . 20 GLY CA 1 1 17 8713 1 1 20 GLY H H -6.498 5.366 -4.923 1.00 . A A . 20 GLY H 1 1 17 8714 1 1 20 GLY HA2 H -7.660 7.351 -5.082 1.00 . A A . 20 GLY HA2 1 1 17 8715 1 1 20 GLY HA3 H -7.482 7.290 -6.835 1.00 . A A . 20 GLY HA3 1 1 17 8716 1 1 20 GLY N N -6.942 5.530 -5.817 1.00 . A A . 20 GLY N 1 1 17 8717 1 1 20 GLY O O -10.071 7.342 -6.470 1.00 . A A . 20 GLY O 1 1 17 8718 1 1 21 MET C C -11.841 5.503 -4.443 1.00 . A A . 21 MET C 1 1 17 8719 1 1 21 MET CA C -11.163 4.817 -5.653 1.00 . A A . 21 MET CA 1 1 17 8720 1 1 21 MET CB C -11.256 3.279 -5.519 1.00 . A A . 21 MET CB 1 1 17 8721 1 1 21 MET CE C -9.784 2.274 -9.254 1.00 . A A . 21 MET CE 1 1 17 8722 1 1 21 MET CG C -10.484 2.503 -6.588 1.00 . A A . 21 MET CG 1 1 17 8723 1 1 21 MET H H -9.059 4.572 -5.459 1.00 . A A . 21 MET H 1 1 17 8724 1 1 21 MET HA H -11.694 5.109 -6.559 1.00 . A A . 21 MET HA 1 1 17 8725 1 1 21 MET HB2 H -10.855 2.979 -4.558 1.00 . A A . 21 MET HB2 1 1 17 8726 1 1 21 MET HB3 H -12.301 2.970 -5.549 1.00 . A A . 21 MET HB3 1 1 17 8727 1 1 21 MET HE1 H -9.275 1.344 -8.999 1.00 . A A . 21 MET HE1 1 1 17 8728 1 1 21 MET HE2 H -10.079 2.251 -10.303 1.00 . A A . 21 MET HE2 1 1 17 8729 1 1 21 MET HE3 H -9.104 3.113 -9.099 1.00 . A A . 21 MET HE3 1 1 17 8730 1 1 21 MET HG2 H -9.497 2.940 -6.685 1.00 . A A . 21 MET HG2 1 1 17 8731 1 1 21 MET HG3 H -10.356 1.473 -6.253 1.00 . A A . 21 MET HG3 1 1 17 8732 1 1 21 MET N N -9.754 5.226 -5.780 1.00 . A A . 21 MET N 1 1 17 8733 1 1 21 MET O O -11.202 6.232 -3.681 1.00 . A A . 21 MET O 1 1 17 8734 1 1 21 MET SD S -11.258 2.479 -8.217 1.00 . A A . 21 MET SD 1 1 17 8735 1 1 22 VAL C C -13.363 4.874 -1.795 1.00 . A A . 22 VAL C 1 1 17 8736 1 1 22 VAL CA C -13.877 5.650 -3.017 1.00 . A A . 22 VAL CA 1 1 17 8737 1 1 22 VAL CB C -15.387 5.418 -3.220 1.00 . A A . 22 VAL CB 1 1 17 8738 1 1 22 VAL CG1 C -16.203 5.716 -1.961 1.00 . A A . 22 VAL CG1 1 1 17 8739 1 1 22 VAL CG2 C -15.933 6.305 -4.347 1.00 . A A . 22 VAL CG2 1 1 17 8740 1 1 22 VAL H H -13.619 4.678 -4.903 1.00 . A A . 22 VAL H 1 1 17 8741 1 1 22 VAL HA H -13.719 6.713 -2.841 1.00 . A A . 22 VAL HA 1 1 17 8742 1 1 22 VAL HB H -15.554 4.375 -3.495 1.00 . A A . 22 VAL HB 1 1 17 8743 1 1 22 VAL HG11 H -17.264 5.599 -2.183 1.00 . A A . 22 VAL HG11 1 1 17 8744 1 1 22 VAL HG12 H -15.949 5.016 -1.165 1.00 . A A . 22 VAL HG12 1 1 17 8745 1 1 22 VAL HG13 H -16.017 6.737 -1.626 1.00 . A A . 22 VAL HG13 1 1 17 8746 1 1 22 VAL HG21 H -15.428 6.093 -5.288 1.00 . A A . 22 VAL HG21 1 1 17 8747 1 1 22 VAL HG22 H -17.001 6.136 -4.481 1.00 . A A . 22 VAL HG22 1 1 17 8748 1 1 22 VAL HG23 H -15.778 7.354 -4.096 1.00 . A A . 22 VAL HG23 1 1 17 8749 1 1 22 VAL N N -13.134 5.245 -4.229 1.00 . A A . 22 VAL N 1 1 17 8750 1 1 22 VAL O O -13.286 3.647 -1.849 1.00 . A A . 22 VAL O 1 1 17 8751 1 1 23 CYS C C -13.062 5.257 1.795 1.00 . A A . 23 CYS C 1 1 17 8752 1 1 23 CYS CA C -12.325 5.042 0.458 1.00 . A A . 23 CYS CA 1 1 17 8753 1 1 23 CYS CB C -10.935 5.709 0.473 1.00 . A A . 23 CYS CB 1 1 17 8754 1 1 23 CYS H H -13.219 6.573 -0.709 1.00 . A A . 23 CYS H 1 1 17 8755 1 1 23 CYS HA H -12.173 3.972 0.314 1.00 . A A . 23 CYS HA 1 1 17 8756 1 1 23 CYS HB2 H -10.659 5.950 -0.553 1.00 . A A . 23 CYS HB2 1 1 17 8757 1 1 23 CYS HB3 H -11.011 6.661 1.000 1.00 . A A . 23 CYS HB3 1 1 17 8758 1 1 23 CYS N N -13.077 5.574 -0.687 1.00 . A A . 23 CYS N 1 1 17 8759 1 1 23 CYS O O -13.143 6.386 2.281 1.00 . A A . 23 CYS O 1 1 17 8760 1 1 23 CYS SG S -9.550 4.770 1.192 1.00 . A A . 23 CYS SG 1 1 17 8761 1 1 24 ARG C C -13.776 2.787 4.463 1.00 . A A . 24 ARG C 1 1 17 8762 1 1 24 ARG CA C -14.057 4.142 3.812 1.00 . A A . 24 ARG CA 1 1 17 8763 1 1 24 ARG CB C -15.571 4.397 3.848 1.00 . A A . 24 ARG CB 1 1 17 8764 1 1 24 ARG CD C -16.414 6.209 2.276 1.00 . A A . 24 ARG CD 1 1 17 8765 1 1 24 ARG CG C -16.042 5.862 3.731 1.00 . A A . 24 ARG CG 1 1 17 8766 1 1 24 ARG CZ C -18.342 5.561 0.875 1.00 . A A . 24 ARG CZ 1 1 17 8767 1 1 24 ARG H H -13.407 3.276 1.957 1.00 . A A . 24 ARG H 1 1 17 8768 1 1 24 ARG HA H -13.572 4.914 4.411 1.00 . A A . 24 ARG HA 1 1 17 8769 1 1 24 ARG HB2 H -16.059 3.742 3.127 1.00 . A A . 24 ARG HB2 1 1 17 8770 1 1 24 ARG HB3 H -15.907 4.070 4.827 1.00 . A A . 24 ARG HB3 1 1 17 8771 1 1 24 ARG HD2 H -16.715 7.242 2.249 1.00 . A A . 24 ARG HD2 1 1 17 8772 1 1 24 ARG HD3 H -15.580 6.042 1.621 1.00 . A A . 24 ARG HD3 1 1 17 8773 1 1 24 ARG HE H -17.610 4.432 2.323 1.00 . A A . 24 ARG HE 1 1 17 8774 1 1 24 ARG HG2 H -16.924 6.006 4.358 1.00 . A A . 24 ARG HG2 1 1 17 8775 1 1 24 ARG HG3 H -15.260 6.530 4.088 1.00 . A A . 24 ARG HG3 1 1 17 8776 1 1 24 ARG HH11 H -17.683 7.398 0.355 1.00 . A A . 24 ARG HH11 1 1 17 8777 1 1 24 ARG HH12 H -18.989 6.709 -0.602 1.00 . A A . 24 ARG HH12 1 1 17 8778 1 1 24 ARG HH21 H -19.129 3.725 0.919 1.00 . A A . 24 ARG HH21 1 1 17 8779 1 1 24 ARG HH22 H -19.709 4.818 -0.354 1.00 . A A . 24 ARG HH22 1 1 17 8780 1 1 24 ARG N N -13.532 4.171 2.428 1.00 . A A . 24 ARG N 1 1 17 8781 1 1 24 ARG NE N -17.536 5.341 1.893 1.00 . A A . 24 ARG NE 1 1 17 8782 1 1 24 ARG NH1 N -18.360 6.660 0.186 1.00 . A A . 24 ARG NH1 1 1 17 8783 1 1 24 ARG NH2 N -19.164 4.639 0.484 1.00 . A A . 24 ARG NH2 1 1 17 8784 1 1 24 ARG O O -14.352 1.793 4.035 1.00 . A A . 24 ARG O 1 1 17 8785 1 1 25 LEU C C -11.453 0.612 4.906 1.00 . A A . 25 LEU C 1 1 17 8786 1 1 25 LEU CA C -12.173 1.510 5.948 1.00 . A A . 25 LEU CA 1 1 17 8787 1 1 25 LEU CB C -13.163 0.700 6.816 1.00 . A A . 25 LEU CB 1 1 17 8788 1 1 25 LEU CD1 C -14.887 0.620 8.656 1.00 . A A . 25 LEU CD1 1 1 17 8789 1 1 25 LEU CD2 C -12.863 2.005 8.991 1.00 . A A . 25 LEU CD2 1 1 17 8790 1 1 25 LEU CG C -13.854 1.492 7.945 1.00 . A A . 25 LEU CG 1 1 17 8791 1 1 25 LEU H H -12.518 3.615 5.773 1.00 . A A . 25 LEU H 1 1 17 8792 1 1 25 LEU HA H -11.384 1.849 6.618 1.00 . A A . 25 LEU HA 1 1 17 8793 1 1 25 LEU HB2 H -13.937 0.290 6.167 1.00 . A A . 25 LEU HB2 1 1 17 8794 1 1 25 LEU HB3 H -12.629 -0.142 7.259 1.00 . A A . 25 LEU HB3 1 1 17 8795 1 1 25 LEU HD11 H -15.616 0.253 7.934 1.00 . A A . 25 LEU HD11 1 1 17 8796 1 1 25 LEU HD12 H -15.409 1.210 9.409 1.00 . A A . 25 LEU HD12 1 1 17 8797 1 1 25 LEU HD13 H -14.395 -0.221 9.137 1.00 . A A . 25 LEU HD13 1 1 17 8798 1 1 25 LEU HD21 H -13.404 2.511 9.791 1.00 . A A . 25 LEU HD21 1 1 17 8799 1 1 25 LEU HD22 H -12.179 2.723 8.541 1.00 . A A . 25 LEU HD22 1 1 17 8800 1 1 25 LEU HD23 H -12.294 1.176 9.413 1.00 . A A . 25 LEU HD23 1 1 17 8801 1 1 25 LEU HG H -14.385 2.337 7.517 1.00 . A A . 25 LEU HG 1 1 17 8802 1 1 25 LEU N N -12.826 2.728 5.405 1.00 . A A . 25 LEU N 1 1 17 8803 1 1 25 LEU O O -10.442 -0.012 5.220 1.00 . A A . 25 LEU O 1 1 17 8804 1 1 26 TRP C C -11.537 0.734 1.204 1.00 . A A . 26 TRP C 1 1 17 8805 1 1 26 TRP CA C -11.362 -0.088 2.490 1.00 . A A . 26 TRP CA 1 1 17 8806 1 1 26 TRP CB C -12.035 -1.472 2.394 1.00 . A A . 26 TRP CB 1 1 17 8807 1 1 26 TRP CD1 C -13.941 -1.805 4.033 1.00 . A A . 26 TRP CD1 1 1 17 8808 1 1 26 TRP CD2 C -14.667 -1.091 2.037 1.00 . A A . 26 TRP CD2 1 1 17 8809 1 1 26 TRP CE2 C -15.810 -1.185 2.886 1.00 . A A . 26 TRP CE2 1 1 17 8810 1 1 26 TRP CE3 C -14.897 -0.641 0.718 1.00 . A A . 26 TRP CE3 1 1 17 8811 1 1 26 TRP CG C -13.489 -1.543 2.782 1.00 . A A . 26 TRP CG 1 1 17 8812 1 1 26 TRP CH2 C -17.307 -0.514 1.106 1.00 . A A . 26 TRP CH2 1 1 17 8813 1 1 26 TRP CZ2 C -17.109 -0.904 2.440 1.00 . A A . 26 TRP CZ2 1 1 17 8814 1 1 26 TRP CZ3 C -16.198 -0.363 0.253 1.00 . A A . 26 TRP CZ3 1 1 17 8815 1 1 26 TRP H H -12.765 1.102 3.485 1.00 . A A . 26 TRP H 1 1 17 8816 1 1 26 TRP HA H -10.292 -0.243 2.623 1.00 . A A . 26 TRP HA 1 1 17 8817 1 1 26 TRP HB2 H -11.920 -1.868 1.385 1.00 . A A . 26 TRP HB2 1 1 17 8818 1 1 26 TRP HB3 H -11.495 -2.144 3.058 1.00 . A A . 26 TRP HB3 1 1 17 8819 1 1 26 TRP HD1 H -13.312 -2.083 4.871 1.00 . A A . 26 TRP HD1 1 1 17 8820 1 1 26 TRP HE1 H -15.856 -1.731 4.944 1.00 . A A . 26 TRP HE1 1 1 17 8821 1 1 26 TRP HE3 H -14.053 -0.519 0.061 1.00 . A A . 26 TRP HE3 1 1 17 8822 1 1 26 TRP HH2 H -18.307 -0.327 0.738 1.00 . A A . 26 TRP HH2 1 1 17 8823 1 1 26 TRP HZ2 H -17.945 -1.018 3.115 1.00 . A A . 26 TRP HZ2 1 1 17 8824 1 1 26 TRP HZ3 H -16.350 -0.041 -0.768 1.00 . A A . 26 TRP HZ3 1 1 17 8825 1 1 26 TRP N N -11.877 0.640 3.646 1.00 . A A . 26 TRP N 1 1 17 8826 1 1 26 TRP NE1 N -15.305 -1.613 4.093 1.00 . A A . 26 TRP NE1 1 1 17 8827 1 1 26 TRP O O -12.398 1.614 1.154 1.00 . A A . 26 TRP O 1 1 17 8828 1 1 27 CYS C C -10.975 0.235 -2.319 1.00 . A A . 27 CYS C 1 1 17 8829 1 1 27 CYS CA C -10.788 1.173 -1.112 1.00 . A A . 27 CYS CA 1 1 17 8830 1 1 27 CYS CB C -9.588 2.127 -1.213 1.00 . A A . 27 CYS CB 1 1 17 8831 1 1 27 CYS H H -10.088 -0.318 0.242 1.00 . A A . 27 CYS H 1 1 17 8832 1 1 27 CYS HA H -11.675 1.807 -1.104 1.00 . A A . 27 CYS HA 1 1 17 8833 1 1 27 CYS HB2 H -9.256 2.409 -0.216 1.00 . A A . 27 CYS HB2 1 1 17 8834 1 1 27 CYS HB3 H -8.758 1.636 -1.723 1.00 . A A . 27 CYS HB3 1 1 17 8835 1 1 27 CYS N N -10.762 0.430 0.156 1.00 . A A . 27 CYS N 1 1 17 8836 1 1 27 CYS O O -10.072 0.037 -3.131 1.00 . A A . 27 CYS O 1 1 17 8837 1 1 27 CYS SG S -10.064 3.631 -2.096 1.00 . A A . 27 CYS SG 1 1 17 8838 1 1 28 LYS C C -12.283 -1.371 -4.671 1.00 . A A . 28 LYS C 1 1 17 8839 1 1 28 LYS CA C -12.499 -1.597 -3.165 1.00 . A A . 28 LYS CA 1 1 17 8840 1 1 28 LYS CB C -13.938 -2.040 -2.806 1.00 . A A . 28 LYS CB 1 1 17 8841 1 1 28 LYS CD C -15.901 -3.548 -3.384 1.00 . A A . 28 LYS CD 1 1 17 8842 1 1 28 LYS CE C -16.385 -4.968 -3.730 1.00 . A A . 28 LYS CE 1 1 17 8843 1 1 28 LYS CG C -14.372 -3.373 -3.441 1.00 . A A . 28 LYS CG 1 1 17 8844 1 1 28 LYS H H -12.808 -0.147 -1.631 1.00 . A A . 28 LYS H 1 1 17 8845 1 1 28 LYS HA H -11.820 -2.405 -2.887 1.00 . A A . 28 LYS HA 1 1 17 8846 1 1 28 LYS HB2 H -14.012 -2.152 -1.723 1.00 . A A . 28 LYS HB2 1 1 17 8847 1 1 28 LYS HB3 H -14.637 -1.255 -3.100 1.00 . A A . 28 LYS HB3 1 1 17 8848 1 1 28 LYS HD2 H -16.260 -3.289 -2.387 1.00 . A A . 28 LYS HD2 1 1 17 8849 1 1 28 LYS HD3 H -16.353 -2.852 -4.092 1.00 . A A . 28 LYS HD3 1 1 17 8850 1 1 28 LYS HE2 H -17.473 -4.944 -3.836 1.00 . A A . 28 LYS HE2 1 1 17 8851 1 1 28 LYS HE3 H -15.964 -5.276 -4.693 1.00 . A A . 28 LYS HE3 1 1 17 8852 1 1 28 LYS HG2 H -14.053 -3.429 -4.481 1.00 . A A . 28 LYS HG2 1 1 17 8853 1 1 28 LYS HG3 H -13.887 -4.170 -2.886 1.00 . A A . 28 LYS HG3 1 1 17 8854 1 1 28 LYS HZ1 H -16.322 -5.629 -1.762 1.00 . A A . 28 LYS HZ1 1 1 17 8855 1 1 28 LYS HZ2 H -15.023 -6.124 -2.685 1.00 . A A . 28 LYS HZ2 1 1 17 8856 1 1 28 LYS HZ3 H -16.484 -6.848 -2.837 1.00 . A A . 28 LYS HZ3 1 1 17 8857 1 1 28 LYS N N -12.148 -0.420 -2.345 1.00 . A A . 28 LYS N 1 1 17 8858 1 1 28 LYS NZ N -16.022 -5.951 -2.682 1.00 . A A . 28 LYS NZ 1 1 17 8859 1 1 28 LYS O O -11.288 -1.839 -5.220 1.00 . A A . 28 LYS O 1 1 17 8860 1 1 29 LYS C C -14.537 0.544 -6.967 1.00 . A A . 29 LYS C 1 1 17 8861 1 1 29 LYS CA C -13.217 -0.184 -6.702 1.00 . A A . 29 LYS CA 1 1 17 8862 1 1 29 LYS CB C -12.987 -1.294 -7.751 1.00 . A A . 29 LYS CB 1 1 17 8863 1 1 29 LYS CD C -11.085 -2.587 -8.868 1.00 . A A . 29 LYS CD 1 1 17 8864 1 1 29 LYS CE C -11.991 -3.172 -9.955 1.00 . A A . 29 LYS CE 1 1 17 8865 1 1 29 LYS CG C -11.568 -1.224 -8.355 1.00 . A A . 29 LYS CG 1 1 17 8866 1 1 29 LYS H H -14.083 -0.523 -4.797 1.00 . A A . 29 LYS H 1 1 17 8867 1 1 29 LYS HA H -12.411 0.541 -6.762 1.00 . A A . 29 LYS HA 1 1 17 8868 1 1 29 LYS HB2 H -13.150 -2.271 -7.289 1.00 . A A . 29 LYS HB2 1 1 17 8869 1 1 29 LYS HB3 H -13.709 -1.196 -8.565 1.00 . A A . 29 LYS HB3 1 1 17 8870 1 1 29 LYS HD2 H -10.063 -2.500 -9.242 1.00 . A A . 29 LYS HD2 1 1 17 8871 1 1 29 LYS HD3 H -11.072 -3.277 -8.024 1.00 . A A . 29 LYS HD3 1 1 17 8872 1 1 29 LYS HE2 H -11.840 -4.255 -9.991 1.00 . A A . 29 LYS HE2 1 1 17 8873 1 1 29 LYS HE3 H -13.037 -3.001 -9.686 1.00 . A A . 29 LYS HE3 1 1 17 8874 1 1 29 LYS HG2 H -11.558 -0.497 -9.166 1.00 . A A . 29 LYS HG2 1 1 17 8875 1 1 29 LYS HG3 H -10.858 -0.890 -7.598 1.00 . A A . 29 LYS HG3 1 1 17 8876 1 1 29 LYS HZ1 H -10.863 -3.020 -11.684 1.00 . A A . 29 LYS HZ1 1 1 17 8877 1 1 29 LYS HZ2 H -11.630 -1.599 -11.301 1.00 . A A . 29 LYS HZ2 1 1 17 8878 1 1 29 LYS HZ3 H -12.496 -2.854 -11.909 1.00 . A A . 29 LYS HZ3 1 1 17 8879 1 1 29 LYS N N -13.251 -0.728 -5.332 1.00 . A A . 29 LYS N 1 1 17 8880 1 1 29 LYS NZ N -11.718 -2.614 -11.300 1.00 . A A . 29 LYS NZ 1 1 17 8881 1 1 29 LYS O O -15.583 0.032 -6.571 1.00 . A A . 29 LYS O 1 1 17 8882 1 1 30 LYS C C -15.385 3.724 -8.829 1.00 . A A . 30 LYS C 1 1 17 8883 1 1 30 LYS CA C -15.681 2.583 -7.837 1.00 . A A . 30 LYS CA 1 1 17 8884 1 1 30 LYS CB C -16.310 3.084 -6.507 1.00 . A A . 30 LYS CB 1 1 17 8885 1 1 30 LYS CD C -18.613 3.621 -5.452 1.00 . A A . 30 LYS CD 1 1 17 8886 1 1 30 LYS CE C -19.066 2.188 -5.138 1.00 . A A . 30 LYS CE 1 1 17 8887 1 1 30 LYS CG C -17.693 3.751 -6.676 1.00 . A A . 30 LYS CG 1 1 17 8888 1 1 30 LYS H H -13.579 2.095 -7.827 1.00 . A A . 30 LYS H 1 1 17 8889 1 1 30 LYS HA H -16.415 1.943 -8.330 1.00 . A A . 30 LYS HA 1 1 17 8890 1 1 30 LYS HB2 H -16.424 2.240 -5.830 1.00 . A A . 30 LYS HB2 1 1 17 8891 1 1 30 LYS HB3 H -15.630 3.787 -6.026 1.00 . A A . 30 LYS HB3 1 1 17 8892 1 1 30 LYS HD2 H -18.102 4.023 -4.576 1.00 . A A . 30 LYS HD2 1 1 17 8893 1 1 30 LYS HD3 H -19.499 4.235 -5.623 1.00 . A A . 30 LYS HD3 1 1 17 8894 1 1 30 LYS HE2 H -18.197 1.587 -4.859 1.00 . A A . 30 LYS HE2 1 1 17 8895 1 1 30 LYS HE3 H -19.741 2.233 -4.278 1.00 . A A . 30 LYS HE3 1 1 17 8896 1 1 30 LYS HG2 H -17.551 4.815 -6.864 1.00 . A A . 30 LYS HG2 1 1 17 8897 1 1 30 LYS HG3 H -18.200 3.329 -7.543 1.00 . A A . 30 LYS HG3 1 1 17 8898 1 1 30 LYS HZ1 H -20.492 2.155 -6.661 1.00 . A A . 30 LYS HZ1 1 1 17 8899 1 1 30 LYS HZ2 H -20.206 0.679 -6.017 1.00 . A A . 30 LYS HZ2 1 1 17 8900 1 1 30 LYS HZ3 H -19.139 1.339 -7.058 1.00 . A A . 30 LYS HZ3 1 1 17 8901 1 1 30 LYS N N -14.489 1.751 -7.548 1.00 . A A . 30 LYS N 1 1 17 8902 1 1 30 LYS NZ N -19.764 1.554 -6.281 1.00 . A A . 30 LYS NZ 1 1 17 8903 1 1 30 LYS O O -15.782 4.865 -8.592 1.00 . A A . 30 LYS O 1 1 17 8904 1 1 31 LEU C C -13.944 4.244 -12.184 1.00 . A A . 31 LEU C 1 1 17 8905 1 1 31 LEU CA C -14.006 4.575 -10.689 1.00 . A A . 31 LEU CA 1 1 17 8906 1 1 31 LEU CB C -12.628 4.929 -10.108 1.00 . A A . 31 LEU CB 1 1 17 8907 1 1 31 LEU CD1 C -12.769 7.437 -10.536 1.00 . A A . 31 LEU CD1 1 1 17 8908 1 1 31 LEU CD2 C -10.651 6.402 -9.851 1.00 . A A . 31 LEU CD2 1 1 17 8909 1 1 31 LEU CG C -11.921 6.173 -10.665 1.00 . A A . 31 LEU CG 1 1 17 8910 1 1 31 LEU H H -14.313 2.547 -10.092 1.00 . A A . 31 LEU H 1 1 17 8911 1 1 31 LEU HA H -14.644 5.454 -10.599 1.00 . A A . 31 LEU HA 1 1 17 8912 1 1 31 LEU HB2 H -12.731 5.054 -9.029 1.00 . A A . 31 LEU HB2 1 1 17 8913 1 1 31 LEU HB3 H -11.972 4.082 -10.299 1.00 . A A . 31 LEU HB3 1 1 17 8914 1 1 31 LEU HD11 H -13.590 7.432 -11.248 1.00 . A A . 31 LEU HD11 1 1 17 8915 1 1 31 LEU HD12 H -12.139 8.299 -10.732 1.00 . A A . 31 LEU HD12 1 1 17 8916 1 1 31 LEU HD13 H -13.159 7.526 -9.526 1.00 . A A . 31 LEU HD13 1 1 17 8917 1 1 31 LEU HD21 H -10.073 7.204 -10.308 1.00 . A A . 31 LEU HD21 1 1 17 8918 1 1 31 LEU HD22 H -10.051 5.492 -9.838 1.00 . A A . 31 LEU HD22 1 1 17 8919 1 1 31 LEU HD23 H -10.904 6.677 -8.830 1.00 . A A . 31 LEU HD23 1 1 17 8920 1 1 31 LEU HG H -11.652 6.016 -11.709 1.00 . A A . 31 LEU HG 1 1 17 8921 1 1 31 LEU N N -14.579 3.494 -9.870 1.00 . A A . 31 LEU N 1 1 17 8922 1 1 31 LEU O O -13.791 3.090 -12.578 1.00 . A A . 31 LEU O 1 1 17 8923 1 1 32 LEU C C -13.228 6.323 -15.043 1.00 . A A . 32 LEU C 1 1 17 8924 1 1 32 LEU CA C -14.064 5.181 -14.465 1.00 . A A . 32 LEU CA 1 1 17 8925 1 1 32 LEU CB C -15.538 5.238 -14.955 1.00 . A A . 32 LEU CB 1 1 17 8926 1 1 32 LEU CD1 C -17.458 6.801 -15.375 1.00 . A A . 32 LEU CD1 1 1 17 8927 1 1 32 LEU CD2 C -17.154 5.963 -13.076 1.00 . A A . 32 LEU CD2 1 1 17 8928 1 1 32 LEU CG C -16.399 6.381 -14.346 1.00 . A A . 32 LEU CG 1 1 17 8929 1 1 32 LEU H H -14.172 6.199 -12.622 1.00 . A A . 32 LEU H 1 1 17 8930 1 1 32 LEU HA H -13.631 4.248 -14.796 1.00 . A A . 32 LEU HA 1 1 17 8931 1 1 32 LEU HB2 H -15.507 5.334 -16.041 1.00 . A A . 32 LEU HB2 1 1 17 8932 1 1 32 LEU HB3 H -16.006 4.282 -14.725 1.00 . A A . 32 LEU HB3 1 1 17 8933 1 1 32 LEU HD11 H -16.971 7.210 -16.260 1.00 . A A . 32 LEU HD11 1 1 17 8934 1 1 32 LEU HD12 H -18.106 7.572 -14.956 1.00 . A A . 32 LEU HD12 1 1 17 8935 1 1 32 LEU HD13 H -18.065 5.943 -15.665 1.00 . A A . 32 LEU HD13 1 1 17 8936 1 1 32 LEU HD21 H -17.808 5.119 -13.291 1.00 . A A . 32 LEU HD21 1 1 17 8937 1 1 32 LEU HD22 H -17.753 6.800 -12.716 1.00 . A A . 32 LEU HD22 1 1 17 8938 1 1 32 LEU HD23 H -16.468 5.678 -12.283 1.00 . A A . 32 LEU HD23 1 1 17 8939 1 1 32 LEU HG H -15.796 7.256 -14.112 1.00 . A A . 32 LEU HG 1 1 17 8940 1 1 32 LEU N N -14.034 5.280 -13.009 1.00 . A A . 32 LEU N 1 1 17 8941 1 1 32 LEU O O -13.549 7.488 -14.956 1.00 . A A . 32 LEU O 1 1 17 8942 1 1 32 LEU OXT O -12.288 6.064 -15.460 1.00 . A A . 32 LEU OXT 1 1 18 8943 1 1 1 GLY C C 2.382 -5.681 -4.559 1.00 . A A . 1 GLY C 1 1 18 8944 1 1 1 GLY CA C 2.744 -5.777 -6.028 1.00 . A A . 1 GLY CA 1 1 18 8945 1 1 1 GLY H1 H 3.605 -7.079 -7.347 1.00 . A A . 1 GLY H1 1 1 18 8946 1 1 1 GLY H2 H 4.197 -7.210 -5.810 1.00 . A A . 1 GLY H2 1 1 18 8947 1 1 1 GLY H3 H 2.722 -7.831 -6.168 1.00 . A A . 1 GLY H3 1 1 18 8948 1 1 1 GLY HA2 H 3.452 -4.988 -6.275 1.00 . A A . 1 GLY HA2 1 1 18 8949 1 1 1 GLY HA3 H 1.842 -5.639 -6.623 1.00 . A A . 1 GLY HA3 1 1 18 8950 1 1 1 GLY N N 3.360 -7.070 -6.366 1.00 . A A . 1 GLY N 1 1 18 8951 1 1 1 GLY O O 1.881 -6.662 -4.001 1.00 . A A . 1 GLY O 1 1 18 8952 1 1 2 PRO C C 0.518 -4.268 -2.553 1.00 . A A . 2 PRO C 1 1 18 8953 1 1 2 PRO CA C 2.057 -4.244 -2.579 1.00 . A A . 2 PRO CA 1 1 18 8954 1 1 2 PRO CB C 2.628 -2.871 -2.201 1.00 . A A . 2 PRO CB 1 1 18 8955 1 1 2 PRO CD C 3.152 -3.303 -4.494 1.00 . A A . 2 PRO CD 1 1 18 8956 1 1 2 PRO CG C 2.766 -2.166 -3.551 1.00 . A A . 2 PRO CG 1 1 18 8957 1 1 2 PRO HA H 2.433 -4.992 -1.880 1.00 . A A . 2 PRO HA 1 1 18 8958 1 1 2 PRO HB2 H 1.979 -2.319 -1.520 1.00 . A A . 2 PRO HB2 1 1 18 8959 1 1 2 PRO HB3 H 3.616 -3.001 -1.757 1.00 . A A . 2 PRO HB3 1 1 18 8960 1 1 2 PRO HD2 H 2.768 -3.097 -5.494 1.00 . A A . 2 PRO HD2 1 1 18 8961 1 1 2 PRO HD3 H 4.238 -3.405 -4.520 1.00 . A A . 2 PRO HD3 1 1 18 8962 1 1 2 PRO HG2 H 1.803 -1.748 -3.850 1.00 . A A . 2 PRO HG2 1 1 18 8963 1 1 2 PRO HG3 H 3.533 -1.392 -3.530 1.00 . A A . 2 PRO HG3 1 1 18 8964 1 1 2 PRO N N 2.567 -4.510 -3.924 1.00 . A A . 2 PRO N 1 1 18 8965 1 1 2 PRO O O -0.140 -4.192 -3.596 1.00 . A A . 2 PRO O 1 1 18 8966 1 1 3 TYR C C -2.206 -3.370 -0.350 1.00 . A A . 3 TYR C 1 1 18 8967 1 1 3 TYR CA C -1.506 -4.480 -1.139 1.00 . A A . 3 TYR CA 1 1 18 8968 1 1 3 TYR CB C -1.918 -5.909 -0.746 1.00 . A A . 3 TYR CB 1 1 18 8969 1 1 3 TYR CD1 C -0.822 -6.120 1.541 1.00 . A A . 3 TYR CD1 1 1 18 8970 1 1 3 TYR CD2 C -0.322 -7.795 -0.158 1.00 . A A . 3 TYR CD2 1 1 18 8971 1 1 3 TYR CE1 C 0.024 -6.787 2.449 1.00 . A A . 3 TYR CE1 1 1 18 8972 1 1 3 TYR CE2 C 0.513 -8.471 0.753 1.00 . A A . 3 TYR CE2 1 1 18 8973 1 1 3 TYR CG C -0.996 -6.620 0.234 1.00 . A A . 3 TYR CG 1 1 18 8974 1 1 3 TYR CZ C 0.692 -7.968 2.057 1.00 . A A . 3 TYR CZ 1 1 18 8975 1 1 3 TYR H H 0.529 -4.404 -0.536 1.00 . A A . 3 TYR H 1 1 18 8976 1 1 3 TYR HA H -1.953 -4.375 -2.127 1.00 . A A . 3 TYR HA 1 1 18 8977 1 1 3 TYR HB2 H -2.924 -5.894 -0.332 1.00 . A A . 3 TYR HB2 1 1 18 8978 1 1 3 TYR HB3 H -1.969 -6.503 -1.658 1.00 . A A . 3 TYR HB3 1 1 18 8979 1 1 3 TYR HD1 H -1.331 -5.219 1.855 1.00 . A A . 3 TYR HD1 1 1 18 8980 1 1 3 TYR HD2 H -0.447 -8.183 -1.160 1.00 . A A . 3 TYR HD2 1 1 18 8981 1 1 3 TYR HE1 H 0.158 -6.405 3.451 1.00 . A A . 3 TYR HE1 1 1 18 8982 1 1 3 TYR HE2 H 1.034 -9.372 0.461 1.00 . A A . 3 TYR HE2 1 1 18 8983 1 1 3 TYR HH H 1.565 -8.166 3.790 1.00 . A A . 3 TYR HH 1 1 18 8984 1 1 3 TYR N N -0.063 -4.344 -1.352 1.00 . A A . 3 TYR N 1 1 18 8985 1 1 3 TYR O O -1.754 -2.989 0.728 1.00 . A A . 3 TYR O 1 1 18 8986 1 1 3 TYR OH O 1.450 -8.654 2.950 1.00 . A A . 3 TYR OH 1 1 18 8987 1 1 4 CYS C C -5.669 -2.009 -0.658 1.00 . A A . 4 CYS C 1 1 18 8988 1 1 4 CYS CA C -4.223 -1.981 -0.128 1.00 . A A . 4 CYS CA 1 1 18 8989 1 1 4 CYS CB C -3.648 -0.549 -0.046 1.00 . A A . 4 CYS CB 1 1 18 8990 1 1 4 CYS H H -3.599 -3.160 -1.796 1.00 . A A . 4 CYS H 1 1 18 8991 1 1 4 CYS HA H -4.278 -2.364 0.893 1.00 . A A . 4 CYS HA 1 1 18 8992 1 1 4 CYS HB2 H -4.474 0.156 0.008 1.00 . A A . 4 CYS HB2 1 1 18 8993 1 1 4 CYS HB3 H -3.125 -0.475 0.909 1.00 . A A . 4 CYS HB3 1 1 18 8994 1 1 4 CYS N N -3.327 -2.866 -0.872 1.00 . A A . 4 CYS N 1 1 18 8995 1 1 4 CYS O O -6.586 -2.371 0.076 1.00 . A A . 4 CYS O 1 1 18 8996 1 1 4 CYS SG S -2.477 0.062 -1.302 1.00 . A A . 4 CYS SG 1 1 18 8997 1 1 5 GLN C C -8.029 -2.974 -2.406 1.00 . A A . 5 GLN C 1 1 18 8998 1 1 5 GLN CA C -7.241 -1.655 -2.524 1.00 . A A . 5 GLN CA 1 1 18 8999 1 1 5 GLN CB C -7.142 -1.058 -3.946 1.00 . A A . 5 GLN CB 1 1 18 9000 1 1 5 GLN CD C -7.303 -3.008 -5.596 1.00 . A A . 5 GLN CD 1 1 18 9001 1 1 5 GLN CG C -7.939 -1.721 -5.079 1.00 . A A . 5 GLN CG 1 1 18 9002 1 1 5 GLN H H -5.111 -1.440 -2.517 1.00 . A A . 5 GLN H 1 1 18 9003 1 1 5 GLN HA H -7.798 -0.936 -1.923 1.00 . A A . 5 GLN HA 1 1 18 9004 1 1 5 GLN HB2 H -7.479 -0.023 -3.881 1.00 . A A . 5 GLN HB2 1 1 18 9005 1 1 5 GLN HB3 H -6.099 -1.018 -4.251 1.00 . A A . 5 GLN HB3 1 1 18 9006 1 1 5 GLN HE21 H -5.457 -2.192 -5.889 1.00 . A A . 5 GLN HE21 1 1 18 9007 1 1 5 GLN HE22 H -5.639 -3.905 -6.248 1.00 . A A . 5 GLN HE22 1 1 18 9008 1 1 5 GLN HG2 H -8.964 -1.908 -4.758 1.00 . A A . 5 GLN HG2 1 1 18 9009 1 1 5 GLN HG3 H -7.973 -1.024 -5.915 1.00 . A A . 5 GLN HG3 1 1 18 9010 1 1 5 GLN N N -5.889 -1.743 -1.947 1.00 . A A . 5 GLN N 1 1 18 9011 1 1 5 GLN NE2 N -6.019 -3.053 -5.868 1.00 . A A . 5 GLN NE2 1 1 18 9012 1 1 5 GLN O O -9.186 -2.964 -1.991 1.00 . A A . 5 GLN O 1 1 18 9013 1 1 5 GLN OE1 O -7.966 -4.021 -5.765 1.00 . A A . 5 GLN OE1 1 1 18 9014 1 1 6 LYS C C -7.993 -5.854 -0.890 1.00 . A A . 6 LYS C 1 1 18 9015 1 1 6 LYS CA C -7.898 -5.464 -2.375 1.00 . A A . 6 LYS CA 1 1 18 9016 1 1 6 LYS CB C -7.020 -6.456 -3.160 1.00 . A A . 6 LYS CB 1 1 18 9017 1 1 6 LYS CD C -6.776 -8.824 -4.022 1.00 . A A . 6 LYS CD 1 1 18 9018 1 1 6 LYS CE C -7.591 -10.051 -4.429 1.00 . A A . 6 LYS CE 1 1 18 9019 1 1 6 LYS CG C -7.730 -7.791 -3.414 1.00 . A A . 6 LYS CG 1 1 18 9020 1 1 6 LYS H H -6.415 -4.037 -2.964 1.00 . A A . 6 LYS H 1 1 18 9021 1 1 6 LYS HA H -8.913 -5.498 -2.768 1.00 . A A . 6 LYS HA 1 1 18 9022 1 1 6 LYS HB2 H -6.764 -6.027 -4.131 1.00 . A A . 6 LYS HB2 1 1 18 9023 1 1 6 LYS HB3 H -6.094 -6.631 -2.607 1.00 . A A . 6 LYS HB3 1 1 18 9024 1 1 6 LYS HD2 H -6.268 -8.414 -4.893 1.00 . A A . 6 LYS HD2 1 1 18 9025 1 1 6 LYS HD3 H -6.027 -9.093 -3.279 1.00 . A A . 6 LYS HD3 1 1 18 9026 1 1 6 LYS HE2 H -8.361 -10.226 -3.672 1.00 . A A . 6 LYS HE2 1 1 18 9027 1 1 6 LYS HE3 H -8.098 -9.851 -5.377 1.00 . A A . 6 LYS HE3 1 1 18 9028 1 1 6 LYS HG2 H -8.121 -8.196 -2.482 1.00 . A A . 6 LYS HG2 1 1 18 9029 1 1 6 LYS HG3 H -8.566 -7.622 -4.092 1.00 . A A . 6 LYS HG3 1 1 18 9030 1 1 6 LYS HZ1 H -6.338 -11.502 -3.640 1.00 . A A . 6 LYS HZ1 1 1 18 9031 1 1 6 LYS HZ2 H -5.991 -11.176 -5.201 1.00 . A A . 6 LYS HZ2 1 1 18 9032 1 1 6 LYS HZ3 H -7.329 -12.046 -4.841 1.00 . A A . 6 LYS HZ3 1 1 18 9033 1 1 6 LYS N N -7.352 -4.114 -2.599 1.00 . A A . 6 LYS N 1 1 18 9034 1 1 6 LYS NZ N -6.753 -11.263 -4.537 1.00 . A A . 6 LYS NZ 1 1 18 9035 1 1 6 LYS O O -8.795 -6.704 -0.508 1.00 . A A . 6 LYS O 1 1 18 9036 1 1 7 TRP C C -7.147 -4.489 2.341 1.00 . A A . 7 TRP C 1 1 18 9037 1 1 7 TRP CA C -6.873 -5.609 1.329 1.00 . A A . 7 TRP CA 1 1 18 9038 1 1 7 TRP CB C -5.437 -6.179 1.336 1.00 . A A . 7 TRP CB 1 1 18 9039 1 1 7 TRP CD1 C -4.086 -5.797 3.463 1.00 . A A . 7 TRP CD1 1 1 18 9040 1 1 7 TRP CD2 C -5.165 -7.754 3.481 1.00 . A A . 7 TRP CD2 1 1 18 9041 1 1 7 TRP CE2 C -4.523 -7.618 4.751 1.00 . A A . 7 TRP CE2 1 1 18 9042 1 1 7 TRP CE3 C -5.922 -8.926 3.271 1.00 . A A . 7 TRP CE3 1 1 18 9043 1 1 7 TRP CG C -4.843 -6.585 2.662 1.00 . A A . 7 TRP CG 1 1 18 9044 1 1 7 TRP CH2 C -5.400 -9.736 5.516 1.00 . A A . 7 TRP CH2 1 1 18 9045 1 1 7 TRP CZ2 C -4.630 -8.587 5.758 1.00 . A A . 7 TRP CZ2 1 1 18 9046 1 1 7 TRP CZ3 C -6.040 -9.901 4.279 1.00 . A A . 7 TRP CZ3 1 1 18 9047 1 1 7 TRP H H -6.782 -4.347 -0.367 1.00 . A A . 7 TRP H 1 1 18 9048 1 1 7 TRP HA H -7.527 -6.433 1.620 1.00 . A A . 7 TRP HA 1 1 18 9049 1 1 7 TRP HB2 H -5.408 -7.048 0.678 1.00 . A A . 7 TRP HB2 1 1 18 9050 1 1 7 TRP HB3 H -4.785 -5.422 0.899 1.00 . A A . 7 TRP HB3 1 1 18 9051 1 1 7 TRP HD1 H -3.780 -4.788 3.210 1.00 . A A . 7 TRP HD1 1 1 18 9052 1 1 7 TRP HE1 H -3.466 -5.919 5.477 1.00 . A A . 7 TRP HE1 1 1 18 9053 1 1 7 TRP HE3 H -6.409 -9.077 2.318 1.00 . A A . 7 TRP HE3 1 1 18 9054 1 1 7 TRP HH2 H -5.505 -10.499 6.276 1.00 . A A . 7 TRP HH2 1 1 18 9055 1 1 7 TRP HZ2 H -4.129 -8.454 6.705 1.00 . A A . 7 TRP HZ2 1 1 18 9056 1 1 7 TRP HZ3 H -6.626 -10.790 4.107 1.00 . A A . 7 TRP HZ3 1 1 18 9057 1 1 7 TRP N N -7.220 -5.191 -0.031 1.00 . A A . 7 TRP N 1 1 18 9058 1 1 7 TRP NE1 N -3.880 -6.403 4.684 1.00 . A A . 7 TRP NE1 1 1 18 9059 1 1 7 TRP O O -6.232 -3.880 2.883 1.00 . A A . 7 TRP O 1 1 18 9060 1 1 8 MET C C -8.162 -2.499 4.477 1.00 . A A . 8 MET C 1 1 18 9061 1 1 8 MET CA C -8.969 -3.644 3.815 1.00 . A A . 8 MET CA 1 1 18 9062 1 1 8 MET CB C -9.230 -4.827 4.762 1.00 . A A . 8 MET CB 1 1 18 9063 1 1 8 MET CE C -11.958 -7.959 4.370 1.00 . A A . 8 MET CE 1 1 18 9064 1 1 8 MET CG C -10.264 -5.801 4.186 1.00 . A A . 8 MET CG 1 1 18 9065 1 1 8 MET H H -9.095 -4.618 1.930 1.00 . A A . 8 MET H 1 1 18 9066 1 1 8 MET HA H -9.941 -3.216 3.590 1.00 . A A . 8 MET HA 1 1 18 9067 1 1 8 MET HB2 H -8.296 -5.358 4.952 1.00 . A A . 8 MET HB2 1 1 18 9068 1 1 8 MET HB3 H -9.621 -4.453 5.706 1.00 . A A . 8 MET HB3 1 1 18 9069 1 1 8 MET HE1 H -12.798 -7.283 4.517 1.00 . A A . 8 MET HE1 1 1 18 9070 1 1 8 MET HE2 H -11.769 -8.071 3.302 1.00 . A A . 8 MET HE2 1 1 18 9071 1 1 8 MET HE3 H -12.203 -8.929 4.802 1.00 . A A . 8 MET HE3 1 1 18 9072 1 1 8 MET HG2 H -11.219 -5.283 4.103 1.00 . A A . 8 MET HG2 1 1 18 9073 1 1 8 MET HG3 H -9.963 -6.118 3.188 1.00 . A A . 8 MET HG3 1 1 18 9074 1 1 8 MET N N -8.431 -4.170 2.544 1.00 . A A . 8 MET N 1 1 18 9075 1 1 8 MET O O -7.916 -2.508 5.682 1.00 . A A . 8 MET O 1 1 18 9076 1 1 8 MET SD S -10.487 -7.289 5.183 1.00 . A A . 8 MET SD 1 1 18 9077 1 1 9 GLN C C -6.585 0.428 4.904 1.00 . A A . 9 GLN C 1 1 18 9078 1 1 9 GLN CA C -6.466 -0.759 3.931 1.00 . A A . 9 GLN CA 1 1 18 9079 1 1 9 GLN CB C -5.911 -0.276 2.585 1.00 . A A . 9 GLN CB 1 1 18 9080 1 1 9 GLN CD C -6.188 1.912 1.266 1.00 . A A . 9 GLN CD 1 1 18 9081 1 1 9 GLN CG C -6.875 0.681 1.846 1.00 . A A . 9 GLN CG 1 1 18 9082 1 1 9 GLN H H -7.854 -1.728 2.682 1.00 . A A . 9 GLN H 1 1 18 9083 1 1 9 GLN HA H -5.723 -1.430 4.368 1.00 . A A . 9 GLN HA 1 1 18 9084 1 1 9 GLN HB2 H -4.940 0.194 2.743 1.00 . A A . 9 GLN HB2 1 1 18 9085 1 1 9 GLN HB3 H -5.728 -1.149 1.978 1.00 . A A . 9 GLN HB3 1 1 18 9086 1 1 9 GLN HE21 H -5.432 2.470 3.063 1.00 . A A . 9 GLN HE21 1 1 18 9087 1 1 9 GLN HE22 H -5.014 3.484 1.668 1.00 . A A . 9 GLN HE22 1 1 18 9088 1 1 9 GLN HG2 H -7.371 0.137 1.042 1.00 . A A . 9 GLN HG2 1 1 18 9089 1 1 9 GLN HG3 H -7.646 1.039 2.526 1.00 . A A . 9 GLN HG3 1 1 18 9090 1 1 9 GLN N N -7.668 -1.564 3.660 1.00 . A A . 9 GLN N 1 1 18 9091 1 1 9 GLN NE2 N -5.495 2.683 2.072 1.00 . A A . 9 GLN NE2 1 1 18 9092 1 1 9 GLN O O -5.812 1.377 4.767 1.00 . A A . 9 GLN O 1 1 18 9093 1 1 9 GLN OE1 O -6.149 2.094 0.057 1.00 . A A . 9 GLN OE1 1 1 18 9094 1 1 10 THR C C -7.786 2.951 6.067 1.00 . A A . 10 THR C 1 1 18 9095 1 1 10 THR CA C -7.739 1.578 6.756 1.00 . A A . 10 THR CA 1 1 18 9096 1 1 10 THR CB C -6.664 1.535 7.861 1.00 . A A . 10 THR CB 1 1 18 9097 1 1 10 THR CG2 C -7.080 2.318 9.105 1.00 . A A . 10 THR CG2 1 1 18 9098 1 1 10 THR H H -8.181 -0.344 5.888 1.00 . A A . 10 THR H 1 1 18 9099 1 1 10 THR HA H -8.707 1.452 7.232 1.00 . A A . 10 THR HA 1 1 18 9100 1 1 10 THR HB H -5.733 1.947 7.472 1.00 . A A . 10 THR HB 1 1 18 9101 1 1 10 THR HG1 H -7.300 -0.217 8.342 1.00 . A A . 10 THR HG1 1 1 18 9102 1 1 10 THR HG21 H -7.569 3.253 8.837 1.00 . A A . 10 THR HG21 1 1 18 9103 1 1 10 THR HG22 H -6.180 2.564 9.659 1.00 . A A . 10 THR HG22 1 1 18 9104 1 1 10 THR HG23 H -7.751 1.731 9.731 1.00 . A A . 10 THR HG23 1 1 18 9105 1 1 10 THR N N -7.571 0.462 5.803 1.00 . A A . 10 THR N 1 1 18 9106 1 1 10 THR O O -7.073 3.879 6.440 1.00 . A A . 10 THR O 1 1 18 9107 1 1 10 THR OG1 O -6.418 0.205 8.287 1.00 . A A . 10 THR OG1 1 1 18 9108 1 1 11 CYS C C -9.455 5.330 5.065 1.00 . A A . 11 CYS C 1 1 18 9109 1 1 11 CYS CA C -8.646 4.319 4.235 1.00 . A A . 11 CYS CA 1 1 18 9110 1 1 11 CYS CB C -9.216 4.065 2.840 1.00 . A A . 11 CYS CB 1 1 18 9111 1 1 11 CYS H H -9.123 2.279 4.709 1.00 . A A . 11 CYS H 1 1 18 9112 1 1 11 CYS HA H -7.636 4.714 4.107 1.00 . A A . 11 CYS HA 1 1 18 9113 1 1 11 CYS HB2 H -8.895 3.081 2.505 1.00 . A A . 11 CYS HB2 1 1 18 9114 1 1 11 CYS HB3 H -10.304 4.082 2.885 1.00 . A A . 11 CYS HB3 1 1 18 9115 1 1 11 CYS N N -8.544 3.059 4.972 1.00 . A A . 11 CYS N 1 1 18 9116 1 1 11 CYS O O -10.562 5.027 5.504 1.00 . A A . 11 CYS O 1 1 18 9117 1 1 11 CYS SG S -8.639 5.249 1.606 1.00 . A A . 11 CYS SG 1 1 18 9118 1 1 12 ASP C C -8.619 8.684 6.328 1.00 . A A . 12 ASP C 1 1 18 9119 1 1 12 ASP CA C -9.152 7.260 6.592 1.00 . A A . 12 ASP CA 1 1 18 9120 1 1 12 ASP CB C -8.412 6.582 7.766 1.00 . A A . 12 ASP CB 1 1 18 9121 1 1 12 ASP CG C -8.808 7.041 9.169 1.00 . A A . 12 ASP CG 1 1 18 9122 1 1 12 ASP H H -7.999 6.718 4.905 1.00 . A A . 12 ASP H 1 1 18 9123 1 1 12 ASP HA H -10.226 7.288 6.780 1.00 . A A . 12 ASP HA 1 1 18 9124 1 1 12 ASP HB2 H -8.623 5.513 7.732 1.00 . A A . 12 ASP HB2 1 1 18 9125 1 1 12 ASP HB3 H -7.336 6.716 7.638 1.00 . A A . 12 ASP HB3 1 1 18 9126 1 1 12 ASP N N -8.848 6.464 5.394 1.00 . A A . 12 ASP N 1 1 18 9127 1 1 12 ASP O O -7.835 8.879 5.403 1.00 . A A . 12 ASP O 1 1 18 9128 1 1 12 ASP OD1 O -9.623 7.979 9.326 1.00 . A A . 12 ASP OD1 1 1 18 9129 1 1 12 ASP OD2 O -8.291 6.450 10.146 1.00 . A A . 12 ASP OD2 1 1 18 9130 1 1 13 SER C C -7.632 11.583 6.098 1.00 . A A . 13 SER C 1 1 18 9131 1 1 13 SER CA C -8.871 11.123 6.888 1.00 . A A . 13 SER CA 1 1 18 9132 1 1 13 SER CB C -8.942 11.851 8.234 1.00 . A A . 13 SER CB 1 1 18 9133 1 1 13 SER H H -9.575 9.390 7.937 1.00 . A A . 13 SER H 1 1 18 9134 1 1 13 SER HA H -9.735 11.437 6.305 1.00 . A A . 13 SER HA 1 1 18 9135 1 1 13 SER HB2 H -9.931 11.696 8.658 1.00 . A A . 13 SER HB2 1 1 18 9136 1 1 13 SER HB3 H -8.205 11.426 8.916 1.00 . A A . 13 SER HB3 1 1 18 9137 1 1 13 SER HG H -7.812 13.426 8.482 1.00 . A A . 13 SER HG 1 1 18 9138 1 1 13 SER N N -9.004 9.671 7.144 1.00 . A A . 13 SER N 1 1 18 9139 1 1 13 SER O O -7.763 12.248 5.071 1.00 . A A . 13 SER O 1 1 18 9140 1 1 13 SER OG O -8.701 13.237 8.112 1.00 . A A . 13 SER OG 1 1 18 9141 1 1 14 GLU C C -4.609 10.453 4.957 1.00 . A A . 14 GLU C 1 1 18 9142 1 1 14 GLU CA C -5.160 11.541 5.900 1.00 . A A . 14 GLU CA 1 1 18 9143 1 1 14 GLU CB C -4.182 11.812 7.049 1.00 . A A . 14 GLU CB 1 1 18 9144 1 1 14 GLU CD C -1.954 12.631 7.787 1.00 . A A . 14 GLU CD 1 1 18 9145 1 1 14 GLU CG C -2.728 12.020 6.630 1.00 . A A . 14 GLU CG 1 1 18 9146 1 1 14 GLU H H -6.404 10.652 7.388 1.00 . A A . 14 GLU H 1 1 18 9147 1 1 14 GLU HA H -5.266 12.455 5.312 1.00 . A A . 14 GLU HA 1 1 18 9148 1 1 14 GLU HB2 H -4.524 12.698 7.581 1.00 . A A . 14 GLU HB2 1 1 18 9149 1 1 14 GLU HB3 H -4.214 10.974 7.744 1.00 . A A . 14 GLU HB3 1 1 18 9150 1 1 14 GLU HG2 H -2.281 11.064 6.361 1.00 . A A . 14 GLU HG2 1 1 18 9151 1 1 14 GLU HG3 H -2.678 12.675 5.761 1.00 . A A . 14 GLU HG3 1 1 18 9152 1 1 14 GLU N N -6.435 11.203 6.546 1.00 . A A . 14 GLU N 1 1 18 9153 1 1 14 GLU O O -3.732 10.724 4.132 1.00 . A A . 14 GLU O 1 1 18 9154 1 1 14 GLU OE1 O -1.642 13.843 7.718 1.00 . A A . 14 GLU OE1 1 1 18 9155 1 1 14 GLU OE2 O -1.655 11.904 8.766 1.00 . A A . 14 GLU OE2 1 1 18 9156 1 1 15 ARG C C -4.638 7.644 3.260 1.00 . A A . 15 ARG C 1 1 18 9157 1 1 15 ARG CA C -4.266 8.023 4.692 1.00 . A A . 15 ARG CA 1 1 18 9158 1 1 15 ARG CB C -4.430 6.871 5.695 1.00 . A A . 15 ARG CB 1 1 18 9159 1 1 15 ARG CD C -4.185 4.642 4.580 1.00 . A A . 15 ARG CD 1 1 18 9160 1 1 15 ARG CG C -3.452 5.719 5.406 1.00 . A A . 15 ARG CG 1 1 18 9161 1 1 15 ARG CZ C -2.774 2.704 5.155 1.00 . A A . 15 ARG CZ 1 1 18 9162 1 1 15 ARG H H -5.892 9.054 5.645 1.00 . A A . 15 ARG H 1 1 18 9163 1 1 15 ARG HA H -3.209 8.296 4.691 1.00 . A A . 15 ARG HA 1 1 18 9164 1 1 15 ARG HB2 H -4.199 7.256 6.690 1.00 . A A . 15 ARG HB2 1 1 18 9165 1 1 15 ARG HB3 H -5.463 6.516 5.708 1.00 . A A . 15 ARG HB3 1 1 18 9166 1 1 15 ARG HD2 H -4.988 4.220 5.168 1.00 . A A . 15 ARG HD2 1 1 18 9167 1 1 15 ARG HD3 H -4.537 5.058 3.647 1.00 . A A . 15 ARG HD3 1 1 18 9168 1 1 15 ARG HE H -2.664 3.648 3.416 1.00 . A A . 15 ARG HE 1 1 18 9169 1 1 15 ARG HG2 H -2.572 6.084 4.874 1.00 . A A . 15 ARG HG2 1 1 18 9170 1 1 15 ARG HG3 H -3.124 5.297 6.355 1.00 . A A . 15 ARG HG3 1 1 18 9171 1 1 15 ARG HH11 H -3.860 3.278 6.766 1.00 . A A . 15 ARG HH11 1 1 18 9172 1 1 15 ARG HH12 H -2.786 1.910 6.961 1.00 . A A . 15 ARG HH12 1 1 18 9173 1 1 15 ARG HH21 H -1.312 2.006 3.982 1.00 . A A . 15 ARG HH21 1 1 18 9174 1 1 15 ARG HH22 H -1.481 1.271 5.575 1.00 . A A . 15 ARG HH22 1 1 18 9175 1 1 15 ARG N N -5.012 9.195 5.158 1.00 . A A . 15 ARG N 1 1 18 9176 1 1 15 ARG NE N -3.183 3.615 4.290 1.00 . A A . 15 ARG NE 1 1 18 9177 1 1 15 ARG NH1 N -3.237 2.586 6.364 1.00 . A A . 15 ARG NH1 1 1 18 9178 1 1 15 ARG NH2 N -1.831 1.870 4.839 1.00 . A A . 15 ARG NH2 1 1 18 9179 1 1 15 ARG O O -5.794 7.355 2.955 1.00 . A A . 15 ARG O 1 1 18 9180 1 1 16 LYS C C -4.598 6.209 0.534 1.00 . A A . 16 LYS C 1 1 18 9181 1 1 16 LYS CA C -3.713 7.393 0.946 1.00 . A A . 16 LYS CA 1 1 18 9182 1 1 16 LYS CB C -2.274 7.248 0.404 1.00 . A A . 16 LYS CB 1 1 18 9183 1 1 16 LYS CD C -2.594 8.473 -1.790 1.00 . A A . 16 LYS CD 1 1 18 9184 1 1 16 LYS CE C -2.206 8.540 -3.267 1.00 . A A . 16 LYS CE 1 1 18 9185 1 1 16 LYS CG C -2.120 7.176 -1.120 1.00 . A A . 16 LYS CG 1 1 18 9186 1 1 16 LYS H H -2.704 7.811 2.766 1.00 . A A . 16 LYS H 1 1 18 9187 1 1 16 LYS HA H -4.155 8.302 0.538 1.00 . A A . 16 LYS HA 1 1 18 9188 1 1 16 LYS HB2 H -1.685 8.100 0.737 1.00 . A A . 16 LYS HB2 1 1 18 9189 1 1 16 LYS HB3 H -1.827 6.350 0.834 1.00 . A A . 16 LYS HB3 1 1 18 9190 1 1 16 LYS HD2 H -3.676 8.562 -1.699 1.00 . A A . 16 LYS HD2 1 1 18 9191 1 1 16 LYS HD3 H -2.131 9.323 -1.286 1.00 . A A . 16 LYS HD3 1 1 18 9192 1 1 16 LYS HE2 H -2.436 9.541 -3.641 1.00 . A A . 16 LYS HE2 1 1 18 9193 1 1 16 LYS HE3 H -1.128 8.386 -3.361 1.00 . A A . 16 LYS HE3 1 1 18 9194 1 1 16 LYS HG2 H -1.062 7.032 -1.346 1.00 . A A . 16 LYS HG2 1 1 18 9195 1 1 16 LYS HG3 H -2.665 6.319 -1.507 1.00 . A A . 16 LYS HG3 1 1 18 9196 1 1 16 LYS HZ1 H -2.693 6.591 -3.810 1.00 . A A . 16 LYS HZ1 1 1 18 9197 1 1 16 LYS HZ2 H -2.699 7.633 -5.056 1.00 . A A . 16 LYS HZ2 1 1 18 9198 1 1 16 LYS HZ3 H -3.943 7.664 -3.999 1.00 . A A . 16 LYS HZ3 1 1 18 9199 1 1 16 LYS N N -3.618 7.573 2.400 1.00 . A A . 16 LYS N 1 1 18 9200 1 1 16 LYS NZ N -2.937 7.542 -4.072 1.00 . A A . 16 LYS NZ 1 1 18 9201 1 1 16 LYS O O -4.346 5.071 0.934 1.00 . A A . 16 LYS O 1 1 18 9202 1 1 17 CYS C C -5.225 4.778 -2.169 1.00 . A A . 17 CYS C 1 1 18 9203 1 1 17 CYS CA C -6.186 5.377 -1.133 1.00 . A A . 17 CYS CA 1 1 18 9204 1 1 17 CYS CB C -7.451 5.886 -1.826 1.00 . A A . 17 CYS CB 1 1 18 9205 1 1 17 CYS H H -5.698 7.403 -0.667 1.00 . A A . 17 CYS H 1 1 18 9206 1 1 17 CYS HA H -6.481 4.594 -0.433 1.00 . A A . 17 CYS HA 1 1 18 9207 1 1 17 CYS HB2 H -8.152 6.272 -1.085 1.00 . A A . 17 CYS HB2 1 1 18 9208 1 1 17 CYS HB3 H -7.175 6.708 -2.488 1.00 . A A . 17 CYS HB3 1 1 18 9209 1 1 17 CYS N N -5.527 6.450 -0.392 1.00 . A A . 17 CYS N 1 1 18 9210 1 1 17 CYS O O -4.586 5.508 -2.928 1.00 . A A . 17 CYS O 1 1 18 9211 1 1 17 CYS SG S -8.277 4.619 -2.828 1.00 . A A . 17 CYS SG 1 1 18 9212 1 1 18 CYS C C -4.213 3.097 -4.551 1.00 . A A . 18 CYS C 1 1 18 9213 1 1 18 CYS CA C -4.285 2.664 -3.073 1.00 . A A . 18 CYS CA 1 1 18 9214 1 1 18 CYS CB C -4.725 1.202 -2.970 1.00 . A A . 18 CYS CB 1 1 18 9215 1 1 18 CYS H H -5.748 2.944 -1.562 1.00 . A A . 18 CYS H 1 1 18 9216 1 1 18 CYS HA H -3.289 2.762 -2.638 1.00 . A A . 18 CYS HA 1 1 18 9217 1 1 18 CYS HB2 H -5.232 1.045 -2.019 1.00 . A A . 18 CYS HB2 1 1 18 9218 1 1 18 CYS HB3 H -5.452 1.021 -3.757 1.00 . A A . 18 CYS HB3 1 1 18 9219 1 1 18 CYS N N -5.214 3.450 -2.263 1.00 . A A . 18 CYS N 1 1 18 9220 1 1 18 CYS O O -3.110 3.306 -5.054 1.00 . A A . 18 CYS O 1 1 18 9221 1 1 18 CYS SG S -3.431 -0.055 -3.093 1.00 . A A . 18 CYS SG 1 1 18 9222 1 1 19 GLU C C -6.417 4.784 -6.982 1.00 . A A . 19 GLU C 1 1 18 9223 1 1 19 GLU CA C -5.436 3.625 -6.659 1.00 . A A . 19 GLU CA 1 1 18 9224 1 1 19 GLU CB C -5.745 2.398 -7.563 1.00 . A A . 19 GLU CB 1 1 18 9225 1 1 19 GLU CD C -4.421 0.253 -6.841 1.00 . A A . 19 GLU CD 1 1 18 9226 1 1 19 GLU CG C -5.764 0.975 -6.963 1.00 . A A . 19 GLU CG 1 1 18 9227 1 1 19 GLU H H -6.224 3.056 -4.749 1.00 . A A . 19 GLU H 1 1 18 9228 1 1 19 GLU HA H -4.453 3.989 -6.966 1.00 . A A . 19 GLU HA 1 1 18 9229 1 1 19 GLU HB2 H -6.741 2.549 -7.978 1.00 . A A . 19 GLU HB2 1 1 18 9230 1 1 19 GLU HB3 H -5.074 2.420 -8.421 1.00 . A A . 19 GLU HB3 1 1 18 9231 1 1 19 GLU HG2 H -6.262 0.981 -5.994 1.00 . A A . 19 GLU HG2 1 1 18 9232 1 1 19 GLU HG3 H -6.373 0.358 -7.624 1.00 . A A . 19 GLU HG3 1 1 18 9233 1 1 19 GLU N N -5.361 3.274 -5.225 1.00 . A A . 19 GLU N 1 1 18 9234 1 1 19 GLU O O -6.502 5.182 -8.148 1.00 . A A . 19 GLU O 1 1 18 9235 1 1 19 GLU OE1 O -3.388 0.703 -7.395 1.00 . A A . 19 GLU OE1 1 1 18 9236 1 1 19 GLU OE2 O -4.408 -0.824 -6.208 1.00 . A A . 19 GLU OE2 1 1 18 9237 1 1 20 GLY C C -9.517 6.333 -5.838 1.00 . A A . 20 GLY C 1 1 18 9238 1 1 20 GLY CA C -8.014 6.537 -6.134 1.00 . A A . 20 GLY CA 1 1 18 9239 1 1 20 GLY H H -6.976 5.010 -5.059 1.00 . A A . 20 GLY H 1 1 18 9240 1 1 20 GLY HA2 H -7.655 7.307 -5.456 1.00 . A A . 20 GLY HA2 1 1 18 9241 1 1 20 GLY HA3 H -7.939 6.935 -7.146 1.00 . A A . 20 GLY HA3 1 1 18 9242 1 1 20 GLY N N -7.130 5.354 -5.995 1.00 . A A . 20 GLY N 1 1 18 9243 1 1 20 GLY O O -10.271 7.306 -5.766 1.00 . A A . 20 GLY O 1 1 18 9244 1 1 21 MET C C -11.923 4.971 -4.041 1.00 . A A . 21 MET C 1 1 18 9245 1 1 21 MET CA C -11.347 4.662 -5.447 1.00 . A A . 21 MET CA 1 1 18 9246 1 1 21 MET CB C -11.469 3.184 -5.856 1.00 . A A . 21 MET CB 1 1 18 9247 1 1 21 MET CE C -9.308 1.148 -7.354 1.00 . A A . 21 MET CE 1 1 18 9248 1 1 21 MET CG C -10.498 2.244 -5.127 1.00 . A A . 21 MET CG 1 1 18 9249 1 1 21 MET H H -9.267 4.344 -5.738 1.00 . A A . 21 MET H 1 1 18 9250 1 1 21 MET HA H -11.967 5.222 -6.145 1.00 . A A . 21 MET HA 1 1 18 9251 1 1 21 MET HB2 H -12.491 2.842 -5.702 1.00 . A A . 21 MET HB2 1 1 18 9252 1 1 21 MET HB3 H -11.283 3.120 -6.925 1.00 . A A . 21 MET HB3 1 1 18 9253 1 1 21 MET HE1 H -8.425 0.934 -7.949 1.00 . A A . 21 MET HE1 1 1 18 9254 1 1 21 MET HE2 H -9.772 0.208 -7.058 1.00 . A A . 21 MET HE2 1 1 18 9255 1 1 21 MET HE3 H -10.001 1.716 -7.972 1.00 . A A . 21 MET HE3 1 1 18 9256 1 1 21 MET HG2 H -10.400 2.558 -4.090 1.00 . A A . 21 MET HG2 1 1 18 9257 1 1 21 MET HG3 H -10.918 1.243 -5.127 1.00 . A A . 21 MET HG3 1 1 18 9258 1 1 21 MET N N -9.952 5.082 -5.661 1.00 . A A . 21 MET N 1 1 18 9259 1 1 21 MET O O -11.452 5.875 -3.351 1.00 . A A . 21 MET O 1 1 18 9260 1 1 21 MET SD S -8.857 2.100 -5.873 1.00 . A A . 21 MET SD 1 1 18 9261 1 1 22 VAL C C -13.323 4.478 -1.172 1.00 . A A . 22 VAL C 1 1 18 9262 1 1 22 VAL CA C -13.927 4.737 -2.559 1.00 . A A . 22 VAL CA 1 1 18 9263 1 1 22 VAL CB C -15.309 4.070 -2.717 1.00 . A A . 22 VAL CB 1 1 18 9264 1 1 22 VAL CG1 C -16.298 4.563 -1.655 1.00 . A A . 22 VAL CG1 1 1 18 9265 1 1 22 VAL CG2 C -15.904 4.367 -4.101 1.00 . A A . 22 VAL CG2 1 1 18 9266 1 1 22 VAL H H -13.353 3.558 -4.233 1.00 . A A . 22 VAL H 1 1 18 9267 1 1 22 VAL HA H -14.091 5.811 -2.647 1.00 . A A . 22 VAL HA 1 1 18 9268 1 1 22 VAL HB H -15.202 2.989 -2.618 1.00 . A A . 22 VAL HB 1 1 18 9269 1 1 22 VAL HG11 H -17.279 4.120 -1.825 1.00 . A A . 22 VAL HG11 1 1 18 9270 1 1 22 VAL HG12 H -15.955 4.259 -0.669 1.00 . A A . 22 VAL HG12 1 1 18 9271 1 1 22 VAL HG13 H -16.389 5.650 -1.697 1.00 . A A . 22 VAL HG13 1 1 18 9272 1 1 22 VAL HG21 H -15.277 3.961 -4.894 1.00 . A A . 22 VAL HG21 1 1 18 9273 1 1 22 VAL HG22 H -16.884 3.903 -4.186 1.00 . A A . 22 VAL HG22 1 1 18 9274 1 1 22 VAL HG23 H -16.004 5.444 -4.241 1.00 . A A . 22 VAL HG23 1 1 18 9275 1 1 22 VAL N N -13.038 4.331 -3.665 1.00 . A A . 22 VAL N 1 1 18 9276 1 1 22 VAL O O -13.281 3.342 -0.704 1.00 . A A . 22 VAL O 1 1 18 9277 1 1 23 CYS C C -12.928 5.639 1.985 1.00 . A A . 23 CYS C 1 1 18 9278 1 1 23 CYS CA C -12.078 5.543 0.706 1.00 . A A . 23 CYS CA 1 1 18 9279 1 1 23 CYS CB C -11.081 6.704 0.571 1.00 . A A . 23 CYS CB 1 1 18 9280 1 1 23 CYS H H -13.013 6.454 -0.959 1.00 . A A . 23 CYS H 1 1 18 9281 1 1 23 CYS HA H -11.505 4.618 0.734 1.00 . A A . 23 CYS HA 1 1 18 9282 1 1 23 CYS HB2 H -10.557 6.600 -0.379 1.00 . A A . 23 CYS HB2 1 1 18 9283 1 1 23 CYS HB3 H -11.645 7.637 0.534 1.00 . A A . 23 CYS HB3 1 1 18 9284 1 1 23 CYS N N -12.909 5.555 -0.499 1.00 . A A . 23 CYS N 1 1 18 9285 1 1 23 CYS O O -13.299 6.741 2.399 1.00 . A A . 23 CYS O 1 1 18 9286 1 1 23 CYS SG S -9.830 6.872 1.871 1.00 . A A . 23 CYS SG 1 1 18 9287 1 1 24 ARG C C -13.813 3.205 4.657 1.00 . A A . 24 ARG C 1 1 18 9288 1 1 24 ARG CA C -14.176 4.403 3.769 1.00 . A A . 24 ARG CA 1 1 18 9289 1 1 24 ARG CB C -15.684 4.387 3.416 1.00 . A A . 24 ARG CB 1 1 18 9290 1 1 24 ARG CD C -16.323 5.991 1.588 1.00 . A A . 24 ARG CD 1 1 18 9291 1 1 24 ARG CG C -16.320 5.755 3.111 1.00 . A A . 24 ARG CG 1 1 18 9292 1 1 24 ARG CZ C -16.518 8.475 1.564 1.00 . A A . 24 ARG CZ 1 1 18 9293 1 1 24 ARG H H -13.031 3.632 2.102 1.00 . A A . 24 ARG H 1 1 18 9294 1 1 24 ARG HA H -13.992 5.282 4.389 1.00 . A A . 24 ARG HA 1 1 18 9295 1 1 24 ARG HB2 H -15.876 3.680 2.608 1.00 . A A . 24 ARG HB2 1 1 18 9296 1 1 24 ARG HB3 H -16.217 4.014 4.293 1.00 . A A . 24 ARG HB3 1 1 18 9297 1 1 24 ARG HD2 H -15.329 6.028 1.186 1.00 . A A . 24 ARG HD2 1 1 18 9298 1 1 24 ARG HD3 H -16.889 5.202 1.123 1.00 . A A . 24 ARG HD3 1 1 18 9299 1 1 24 ARG HE H -17.978 7.215 1.044 1.00 . A A . 24 ARG HE 1 1 18 9300 1 1 24 ARG HG2 H -17.355 5.740 3.455 1.00 . A A . 24 ARG HG2 1 1 18 9301 1 1 24 ARG HG3 H -15.782 6.543 3.637 1.00 . A A . 24 ARG HG3 1 1 18 9302 1 1 24 ARG HH11 H -14.671 7.929 2.175 1.00 . A A . 24 ARG HH11 1 1 18 9303 1 1 24 ARG HH12 H -15.041 9.637 2.272 1.00 . A A . 24 ARG HH12 1 1 18 9304 1 1 24 ARG HH21 H -18.218 9.365 1.021 1.00 . A A . 24 ARG HH21 1 1 18 9305 1 1 24 ARG HH22 H -16.909 10.461 1.399 1.00 . A A . 24 ARG HH22 1 1 18 9306 1 1 24 ARG N N -13.331 4.493 2.554 1.00 . A A . 24 ARG N 1 1 18 9307 1 1 24 ARG NE N -17.016 7.265 1.354 1.00 . A A . 24 ARG NE 1 1 18 9308 1 1 24 ARG NH1 N -15.315 8.697 2.012 1.00 . A A . 24 ARG NH1 1 1 18 9309 1 1 24 ARG NH2 N -17.263 9.514 1.329 1.00 . A A . 24 ARG NH2 1 1 18 9310 1 1 24 ARG O O -14.461 2.168 4.584 1.00 . A A . 24 ARG O 1 1 18 9311 1 1 25 LEU C C -11.373 1.155 5.314 1.00 . A A . 25 LEU C 1 1 18 9312 1 1 25 LEU CA C -12.089 2.207 6.197 1.00 . A A . 25 LEU CA 1 1 18 9313 1 1 25 LEU CB C -13.064 1.590 7.231 1.00 . A A . 25 LEU CB 1 1 18 9314 1 1 25 LEU CD1 C -14.718 1.858 9.110 1.00 . A A . 25 LEU CD1 1 1 18 9315 1 1 25 LEU CD2 C -12.972 3.582 8.853 1.00 . A A . 25 LEU CD2 1 1 18 9316 1 1 25 LEU CG C -13.861 2.602 8.086 1.00 . A A . 25 LEU CG 1 1 18 9317 1 1 25 LEU H H -12.255 4.200 5.454 1.00 . A A . 25 LEU H 1 1 18 9318 1 1 25 LEU HA H -11.286 2.671 6.770 1.00 . A A . 25 LEU HA 1 1 18 9319 1 1 25 LEU HB2 H -13.780 0.960 6.704 1.00 . A A . 25 LEU HB2 1 1 18 9320 1 1 25 LEU HB3 H -12.506 0.927 7.888 1.00 . A A . 25 LEU HB3 1 1 18 9321 1 1 25 LEU HD11 H -15.272 2.571 9.719 1.00 . A A . 25 LEU HD11 1 1 18 9322 1 1 25 LEU HD12 H -14.096 1.248 9.755 1.00 . A A . 25 LEU HD12 1 1 18 9323 1 1 25 LEU HD13 H -15.425 1.212 8.593 1.00 . A A . 25 LEU HD13 1 1 18 9324 1 1 25 LEU HD21 H -13.595 4.306 9.372 1.00 . A A . 25 LEU HD21 1 1 18 9325 1 1 25 LEU HD22 H -12.326 4.130 8.169 1.00 . A A . 25 LEU HD22 1 1 18 9326 1 1 25 LEU HD23 H -12.372 3.048 9.583 1.00 . A A . 25 LEU HD23 1 1 18 9327 1 1 25 LEU HG H -14.524 3.179 7.442 1.00 . A A . 25 LEU HG 1 1 18 9328 1 1 25 LEU N N -12.739 3.306 5.445 1.00 . A A . 25 LEU N 1 1 18 9329 1 1 25 LEU O O -10.567 0.359 5.791 1.00 . A A . 25 LEU O 1 1 18 9330 1 1 26 TRP C C -10.955 1.232 1.600 1.00 . A A . 26 TRP C 1 1 18 9331 1 1 26 TRP CA C -10.957 0.448 2.924 1.00 . A A . 26 TRP CA 1 1 18 9332 1 1 26 TRP CB C -11.717 -0.881 2.797 1.00 . A A . 26 TRP CB 1 1 18 9333 1 1 26 TRP CD1 C -13.739 -1.366 4.242 1.00 . A A . 26 TRP CD1 1 1 18 9334 1 1 26 TRP CD2 C -14.280 -0.143 2.443 1.00 . A A . 26 TRP CD2 1 1 18 9335 1 1 26 TRP CE2 C -15.485 -0.356 3.182 1.00 . A A . 26 TRP CE2 1 1 18 9336 1 1 26 TRP CE3 C -14.379 0.694 1.308 1.00 . A A . 26 TRP CE3 1 1 18 9337 1 1 26 TRP CG C -13.190 -0.865 3.111 1.00 . A A . 26 TRP CG 1 1 18 9338 1 1 26 TRP CH2 C -16.772 1.032 1.671 1.00 . A A . 26 TRP CH2 1 1 18 9339 1 1 26 TRP CZ2 C -16.716 0.201 2.803 1.00 . A A . 26 TRP CZ2 1 1 18 9340 1 1 26 TRP CZ3 C -15.602 1.280 0.932 1.00 . A A . 26 TRP CZ3 1 1 18 9341 1 1 26 TRP H H -12.244 1.915 3.697 1.00 . A A . 26 TRP H 1 1 18 9342 1 1 26 TRP HA H -9.919 0.225 3.173 1.00 . A A . 26 TRP HA 1 1 18 9343 1 1 26 TRP HB2 H -11.561 -1.315 1.812 1.00 . A A . 26 TRP HB2 1 1 18 9344 1 1 26 TRP HB3 H -11.254 -1.561 3.509 1.00 . A A . 26 TRP HB3 1 1 18 9345 1 1 26 TRP HD1 H -13.194 -1.889 5.022 1.00 . A A . 26 TRP HD1 1 1 18 9346 1 1 26 TRP HE1 H -15.695 -1.414 5.027 1.00 . A A . 26 TRP HE1 1 1 18 9347 1 1 26 TRP HE3 H -13.500 0.922 0.729 1.00 . A A . 26 TRP HE3 1 1 18 9348 1 1 26 TRP HH2 H -17.704 1.493 1.377 1.00 . A A . 26 TRP HH2 1 1 18 9349 1 1 26 TRP HZ2 H -17.599 0.023 3.398 1.00 . A A . 26 TRP HZ2 1 1 18 9350 1 1 26 TRP HZ3 H -15.634 1.933 0.069 1.00 . A A . 26 TRP HZ3 1 1 18 9351 1 1 26 TRP N N -11.547 1.251 3.998 1.00 . A A . 26 TRP N 1 1 18 9352 1 1 26 TRP NE1 N -15.096 -1.131 4.251 1.00 . A A . 26 TRP NE1 1 1 18 9353 1 1 26 TRP O O -11.478 2.343 1.581 1.00 . A A . 26 TRP O 1 1 18 9354 1 1 27 CYS C C -10.777 0.378 -1.989 1.00 . A A . 27 CYS C 1 1 18 9355 1 1 27 CYS CA C -10.477 1.345 -0.821 1.00 . A A . 27 CYS CA 1 1 18 9356 1 1 27 CYS CB C -9.253 2.261 -1.027 1.00 . A A . 27 CYS CB 1 1 18 9357 1 1 27 CYS H H -10.016 -0.237 0.543 1.00 . A A . 27 CYS H 1 1 18 9358 1 1 27 CYS HA H -11.338 2.007 -0.801 1.00 . A A . 27 CYS HA 1 1 18 9359 1 1 27 CYS HB2 H -8.747 2.428 -0.077 1.00 . A A . 27 CYS HB2 1 1 18 9360 1 1 27 CYS HB3 H -8.546 1.801 -1.717 1.00 . A A . 27 CYS HB3 1 1 18 9361 1 1 27 CYS N N -10.424 0.684 0.495 1.00 . A A . 27 CYS N 1 1 18 9362 1 1 27 CYS O O -9.913 0.064 -2.804 1.00 . A A . 27 CYS O 1 1 18 9363 1 1 27 CYS SG S -9.768 3.876 -1.660 1.00 . A A . 27 CYS SG 1 1 18 9364 1 1 28 LYS C C -12.737 -0.484 -4.411 1.00 . A A . 28 LYS C 1 1 18 9365 1 1 28 LYS CA C -12.520 -1.103 -3.024 1.00 . A A . 28 LYS CA 1 1 18 9366 1 1 28 LYS CB C -13.858 -1.695 -2.557 1.00 . A A . 28 LYS CB 1 1 18 9367 1 1 28 LYS CD C -13.197 -2.487 -0.184 1.00 . A A . 28 LYS CD 1 1 18 9368 1 1 28 LYS CE C -13.902 -3.210 0.972 1.00 . A A . 28 LYS CE 1 1 18 9369 1 1 28 LYS CG C -13.786 -2.852 -1.552 1.00 . A A . 28 LYS CG 1 1 18 9370 1 1 28 LYS H H -12.685 0.239 -1.374 1.00 . A A . 28 LYS H 1 1 18 9371 1 1 28 LYS HA H -11.789 -1.907 -3.135 1.00 . A A . 28 LYS HA 1 1 18 9372 1 1 28 LYS HB2 H -14.480 -0.895 -2.153 1.00 . A A . 28 LYS HB2 1 1 18 9373 1 1 28 LYS HB3 H -14.381 -2.083 -3.428 1.00 . A A . 28 LYS HB3 1 1 18 9374 1 1 28 LYS HD2 H -12.129 -2.712 -0.179 1.00 . A A . 28 LYS HD2 1 1 18 9375 1 1 28 LYS HD3 H -13.323 -1.421 -0.018 1.00 . A A . 28 LYS HD3 1 1 18 9376 1 1 28 LYS HE2 H -13.447 -2.903 1.914 1.00 . A A . 28 LYS HE2 1 1 18 9377 1 1 28 LYS HE3 H -14.952 -2.901 0.994 1.00 . A A . 28 LYS HE3 1 1 18 9378 1 1 28 LYS HG2 H -14.807 -3.193 -1.407 1.00 . A A . 28 LYS HG2 1 1 18 9379 1 1 28 LYS HG3 H -13.218 -3.675 -1.984 1.00 . A A . 28 LYS HG3 1 1 18 9380 1 1 28 LYS HZ1 H -14.365 -5.013 0.067 1.00 . A A . 28 LYS HZ1 1 1 18 9381 1 1 28 LYS HZ2 H -14.260 -5.108 1.685 1.00 . A A . 28 LYS HZ2 1 1 18 9382 1 1 28 LYS HZ3 H -12.878 -5.016 0.770 1.00 . A A . 28 LYS HZ3 1 1 18 9383 1 1 28 LYS N N -12.014 -0.137 -2.027 1.00 . A A . 28 LYS N 1 1 18 9384 1 1 28 LYS NZ N -13.833 -4.679 0.865 1.00 . A A . 28 LYS NZ 1 1 18 9385 1 1 28 LYS O O -13.210 0.649 -4.512 1.00 . A A . 28 LYS O 1 1 18 9386 1 1 29 LYS C C -14.203 -0.638 -7.177 1.00 . A A . 29 LYS C 1 1 18 9387 1 1 29 LYS CA C -12.705 -0.798 -6.878 1.00 . A A . 29 LYS CA 1 1 18 9388 1 1 29 LYS CB C -12.033 -1.766 -7.865 1.00 . A A . 29 LYS CB 1 1 18 9389 1 1 29 LYS CD C -11.533 -2.241 -10.307 1.00 . A A . 29 LYS CD 1 1 18 9390 1 1 29 LYS CE C -10.931 -1.694 -11.609 1.00 . A A . 29 LYS CE 1 1 18 9391 1 1 29 LYS CG C -11.844 -1.156 -9.264 1.00 . A A . 29 LYS CG 1 1 18 9392 1 1 29 LYS H H -12.186 -2.197 -5.330 1.00 . A A . 29 LYS H 1 1 18 9393 1 1 29 LYS HA H -12.234 0.180 -6.992 1.00 . A A . 29 LYS HA 1 1 18 9394 1 1 29 LYS HB2 H -11.053 -2.044 -7.478 1.00 . A A . 29 LYS HB2 1 1 18 9395 1 1 29 LYS HB3 H -12.643 -2.665 -7.950 1.00 . A A . 29 LYS HB3 1 1 18 9396 1 1 29 LYS HD2 H -10.824 -2.955 -9.891 1.00 . A A . 29 LYS HD2 1 1 18 9397 1 1 29 LYS HD3 H -12.454 -2.781 -10.529 1.00 . A A . 29 LYS HD3 1 1 18 9398 1 1 29 LYS HE2 H -9.944 -1.272 -11.397 1.00 . A A . 29 LYS HE2 1 1 18 9399 1 1 29 LYS HE3 H -10.804 -2.531 -12.302 1.00 . A A . 29 LYS HE3 1 1 18 9400 1 1 29 LYS HG2 H -12.750 -0.635 -9.569 1.00 . A A . 29 LYS HG2 1 1 18 9401 1 1 29 LYS HG3 H -11.028 -0.435 -9.227 1.00 . A A . 29 LYS HG3 1 1 18 9402 1 1 29 LYS HZ1 H -11.784 0.201 -11.709 1.00 . A A . 29 LYS HZ1 1 1 18 9403 1 1 29 LYS HZ2 H -12.759 -0.973 -12.302 1.00 . A A . 29 LYS HZ2 1 1 18 9404 1 1 29 LYS HZ3 H -11.480 -0.438 -13.177 1.00 . A A . 29 LYS HZ3 1 1 18 9405 1 1 29 LYS N N -12.491 -1.248 -5.487 1.00 . A A . 29 LYS N 1 1 18 9406 1 1 29 LYS NZ N -11.790 -0.666 -12.237 1.00 . A A . 29 LYS NZ 1 1 18 9407 1 1 29 LYS O O -14.980 -1.597 -7.084 1.00 . A A . 29 LYS O 1 1 18 9408 1 1 30 LYS C C -16.093 2.251 -8.592 1.00 . A A . 30 LYS C 1 1 18 9409 1 1 30 LYS CA C -16.013 0.977 -7.736 1.00 . A A . 30 LYS CA 1 1 18 9410 1 1 30 LYS CB C -16.677 1.114 -6.351 1.00 . A A . 30 LYS CB 1 1 18 9411 1 1 30 LYS CD C -18.842 1.272 -5.066 1.00 . A A . 30 LYS CD 1 1 18 9412 1 1 30 LYS CE C -20.349 1.547 -5.098 1.00 . A A . 30 LYS CE 1 1 18 9413 1 1 30 LYS CG C -18.193 1.302 -6.457 1.00 . A A . 30 LYS CG 1 1 18 9414 1 1 30 LYS H H -13.890 1.284 -7.666 1.00 . A A . 30 LYS H 1 1 18 9415 1 1 30 LYS HA H -16.527 0.184 -8.282 1.00 . A A . 30 LYS HA 1 1 18 9416 1 1 30 LYS HB2 H -16.489 0.210 -5.771 1.00 . A A . 30 LYS HB2 1 1 18 9417 1 1 30 LYS HB3 H -16.238 1.951 -5.810 1.00 . A A . 30 LYS HB3 1 1 18 9418 1 1 30 LYS HD2 H -18.683 0.287 -4.624 1.00 . A A . 30 LYS HD2 1 1 18 9419 1 1 30 LYS HD3 H -18.361 2.015 -4.430 1.00 . A A . 30 LYS HD3 1 1 18 9420 1 1 30 LYS HE2 H -20.836 0.777 -5.703 1.00 . A A . 30 LYS HE2 1 1 18 9421 1 1 30 LYS HE3 H -20.737 1.484 -4.078 1.00 . A A . 30 LYS HE3 1 1 18 9422 1 1 30 LYS HG2 H -18.403 2.249 -6.951 1.00 . A A . 30 LYS HG2 1 1 18 9423 1 1 30 LYS HG3 H -18.610 0.497 -7.059 1.00 . A A . 30 LYS HG3 1 1 18 9424 1 1 30 LYS HZ1 H -20.435 2.876 -6.656 1.00 . A A . 30 LYS HZ1 1 1 18 9425 1 1 30 LYS HZ2 H -20.109 3.608 -5.190 1.00 . A A . 30 LYS HZ2 1 1 18 9426 1 1 30 LYS HZ3 H -21.624 3.126 -5.570 1.00 . A A . 30 LYS HZ3 1 1 18 9427 1 1 30 LYS N N -14.611 0.581 -7.533 1.00 . A A . 30 LYS N 1 1 18 9428 1 1 30 LYS NZ N -20.641 2.882 -5.665 1.00 . A A . 30 LYS NZ 1 1 18 9429 1 1 30 LYS O O -16.168 3.366 -8.076 1.00 . A A . 30 LYS O 1 1 18 9430 1 1 31 LEU C C -16.486 2.440 -12.254 1.00 . A A . 31 LEU C 1 1 18 9431 1 1 31 LEU CA C -16.000 3.095 -10.954 1.00 . A A . 31 LEU CA 1 1 18 9432 1 1 31 LEU CB C -14.586 3.707 -11.065 1.00 . A A . 31 LEU CB 1 1 18 9433 1 1 31 LEU CD1 C -13.164 5.646 -11.752 1.00 . A A . 31 LEU CD1 1 1 18 9434 1 1 31 LEU CD2 C -13.949 4.136 -13.515 1.00 . A A . 31 LEU CD2 1 1 18 9435 1 1 31 LEU CG C -14.338 4.757 -12.169 1.00 . A A . 31 LEU CG 1 1 18 9436 1 1 31 LEU H H -15.873 1.117 -10.237 1.00 . A A . 31 LEU H 1 1 18 9437 1 1 31 LEU HA H -16.706 3.882 -10.681 1.00 . A A . 31 LEU HA 1 1 18 9438 1 1 31 LEU HB2 H -14.374 4.175 -10.103 1.00 . A A . 31 LEU HB2 1 1 18 9439 1 1 31 LEU HB3 H -13.869 2.898 -11.202 1.00 . A A . 31 LEU HB3 1 1 18 9440 1 1 31 LEU HD11 H -12.962 6.371 -12.537 1.00 . A A . 31 LEU HD11 1 1 18 9441 1 1 31 LEU HD12 H -12.272 5.042 -11.584 1.00 . A A . 31 LEU HD12 1 1 18 9442 1 1 31 LEU HD13 H -13.415 6.188 -10.841 1.00 . A A . 31 LEU HD13 1 1 18 9443 1 1 31 LEU HD21 H -14.761 3.542 -13.923 1.00 . A A . 31 LEU HD21 1 1 18 9444 1 1 31 LEU HD22 H -13.068 3.506 -13.402 1.00 . A A . 31 LEU HD22 1 1 18 9445 1 1 31 LEU HD23 H -13.726 4.926 -14.234 1.00 . A A . 31 LEU HD23 1 1 18 9446 1 1 31 LEU HG H -15.221 5.382 -12.292 1.00 . A A . 31 LEU HG 1 1 18 9447 1 1 31 LEU N N -15.979 2.065 -9.906 1.00 . A A . 31 LEU N 1 1 18 9448 1 1 31 LEU O O -16.189 1.269 -12.493 1.00 . A A . 31 LEU O 1 1 18 9449 1 1 32 LEU C C -17.923 3.528 -15.427 1.00 . A A . 32 LEU C 1 1 18 9450 1 1 32 LEU CA C -17.868 2.538 -14.272 1.00 . A A . 32 LEU CA 1 1 18 9451 1 1 32 LEU CB C -19.300 2.046 -13.941 1.00 . A A . 32 LEU CB 1 1 18 9452 1 1 32 LEU CD1 C -21.576 3.147 -14.026 1.00 . A A . 32 LEU CD1 1 1 18 9453 1 1 32 LEU CD2 C -20.392 2.968 -11.843 1.00 . A A . 32 LEU CD2 1 1 18 9454 1 1 32 LEU CG C -20.197 3.168 -13.354 1.00 . A A . 32 LEU CG 1 1 18 9455 1 1 32 LEU H H -17.514 4.097 -12.801 1.00 . A A . 32 LEU H 1 1 18 9456 1 1 32 LEU HA H -17.286 1.689 -14.609 1.00 . A A . 32 LEU HA 1 1 18 9457 1 1 32 LEU HB2 H -19.735 1.655 -14.863 1.00 . A A . 32 LEU HB2 1 1 18 9458 1 1 32 LEU HB3 H -19.231 1.211 -13.241 1.00 . A A . 32 LEU HB3 1 1 18 9459 1 1 32 LEU HD11 H -22.054 2.179 -13.873 1.00 . A A . 32 LEU HD11 1 1 18 9460 1 1 32 LEU HD12 H -21.471 3.329 -15.097 1.00 . A A . 32 LEU HD12 1 1 18 9461 1 1 32 LEU HD13 H -22.208 3.929 -13.603 1.00 . A A . 32 LEU HD13 1 1 18 9462 1 1 32 LEU HD21 H -20.867 2.006 -11.645 1.00 . A A . 32 LEU HD21 1 1 18 9463 1 1 32 LEU HD22 H -21.024 3.761 -11.445 1.00 . A A . 32 LEU HD22 1 1 18 9464 1 1 32 LEU HD23 H -19.431 3.001 -11.331 1.00 . A A . 32 LEU HD23 1 1 18 9465 1 1 32 LEU HG H -19.760 4.154 -13.522 1.00 . A A . 32 LEU HG 1 1 18 9466 1 1 32 LEU N N -17.269 3.144 -13.065 1.00 . A A . 32 LEU N 1 1 18 9467 1 1 32 LEU O O -17.716 3.164 -16.557 1.00 . A A . 32 LEU O 1 1 18 9468 1 1 32 LEU OXT O -18.173 4.540 -15.230 1.00 . A A . 32 LEU OXT 1 1 19 9469 1 1 1 GLY C C 1.879 -3.336 -4.051 1.00 . A A . 1 GLY C 1 1 19 9470 1 1 1 GLY CA C 3.031 -3.931 -4.844 1.00 . A A . 1 GLY CA 1 1 19 9471 1 1 1 GLY H1 H 3.870 -4.987 -3.298 1.00 . A A . 1 GLY H1 1 1 19 9472 1 1 1 GLY H2 H 4.916 -4.669 -4.516 1.00 . A A . 1 GLY H2 1 1 19 9473 1 1 1 GLY H3 H 4.490 -3.474 -3.455 1.00 . A A . 1 GLY H3 1 1 19 9474 1 1 1 GLY HA2 H 3.363 -3.199 -5.578 1.00 . A A . 1 GLY HA2 1 1 19 9475 1 1 1 GLY HA3 H 2.682 -4.823 -5.364 1.00 . A A . 1 GLY HA3 1 1 19 9476 1 1 1 GLY N N 4.159 -4.283 -3.965 1.00 . A A . 1 GLY N 1 1 19 9477 1 1 1 GLY O O 1.921 -3.376 -2.822 1.00 . A A . 1 GLY O 1 1 19 9478 1 1 2 PRO C C -1.276 -2.938 -3.446 1.00 . A A . 2 PRO C 1 1 19 9479 1 1 2 PRO CA C -0.224 -2.007 -4.076 1.00 . A A . 2 PRO CA 1 1 19 9480 1 1 2 PRO CB C -0.781 -1.105 -5.183 1.00 . A A . 2 PRO CB 1 1 19 9481 1 1 2 PRO CD C 0.752 -2.659 -6.164 1.00 . A A . 2 PRO CD 1 1 19 9482 1 1 2 PRO CG C -0.572 -1.946 -6.436 1.00 . A A . 2 PRO CG 1 1 19 9483 1 1 2 PRO HA H 0.177 -1.370 -3.285 1.00 . A A . 2 PRO HA 1 1 19 9484 1 1 2 PRO HB2 H -1.829 -0.843 -5.040 1.00 . A A . 2 PRO HB2 1 1 19 9485 1 1 2 PRO HB3 H -0.179 -0.199 -5.256 1.00 . A A . 2 PRO HB3 1 1 19 9486 1 1 2 PRO HD2 H 0.750 -3.646 -6.630 1.00 . A A . 2 PRO HD2 1 1 19 9487 1 1 2 PRO HD3 H 1.574 -2.059 -6.558 1.00 . A A . 2 PRO HD3 1 1 19 9488 1 1 2 PRO HG2 H -1.376 -2.676 -6.537 1.00 . A A . 2 PRO HG2 1 1 19 9489 1 1 2 PRO HG3 H -0.508 -1.315 -7.317 1.00 . A A . 2 PRO HG3 1 1 19 9490 1 1 2 PRO N N 0.865 -2.753 -4.715 1.00 . A A . 2 PRO N 1 1 19 9491 1 1 2 PRO O O -2.387 -3.108 -3.952 1.00 . A A . 2 PRO O 1 1 19 9492 1 1 3 TYR C C -2.706 -3.834 -0.528 1.00 . A A . 3 TYR C 1 1 19 9493 1 1 3 TYR CA C -1.800 -4.482 -1.582 1.00 . A A . 3 TYR CA 1 1 19 9494 1 1 3 TYR CB C -1.003 -5.715 -1.133 1.00 . A A . 3 TYR CB 1 1 19 9495 1 1 3 TYR CD1 C 0.918 -6.532 -2.555 1.00 . A A . 3 TYR CD1 1 1 19 9496 1 1 3 TYR CD2 C -1.349 -7.143 -3.212 1.00 . A A . 3 TYR CD2 1 1 19 9497 1 1 3 TYR CE1 C 1.419 -7.148 -3.714 1.00 . A A . 3 TYR CE1 1 1 19 9498 1 1 3 TYR CE2 C -0.849 -7.753 -4.380 1.00 . A A . 3 TYR CE2 1 1 19 9499 1 1 3 TYR CG C -0.468 -6.514 -2.308 1.00 . A A . 3 TYR CG 1 1 19 9500 1 1 3 TYR CZ C 0.539 -7.746 -4.636 1.00 . A A . 3 TYR CZ 1 1 19 9501 1 1 3 TYR H H 0.006 -3.403 -1.967 1.00 . A A . 3 TYR H 1 1 19 9502 1 1 3 TYR HA H -2.510 -4.874 -2.311 1.00 . A A . 3 TYR HA 1 1 19 9503 1 1 3 TYR HB2 H -0.183 -5.399 -0.487 1.00 . A A . 3 TYR HB2 1 1 19 9504 1 1 3 TYR HB3 H -1.658 -6.366 -0.553 1.00 . A A . 3 TYR HB3 1 1 19 9505 1 1 3 TYR HD1 H 1.601 -6.049 -1.868 1.00 . A A . 3 TYR HD1 1 1 19 9506 1 1 3 TYR HD2 H -2.414 -7.129 -3.029 1.00 . A A . 3 TYR HD2 1 1 19 9507 1 1 3 TYR HE1 H 2.477 -7.158 -3.918 1.00 . A A . 3 TYR HE1 1 1 19 9508 1 1 3 TYR HE2 H -1.524 -8.210 -5.089 1.00 . A A . 3 TYR HE2 1 1 19 9509 1 1 3 TYR HH H 0.354 -8.467 -6.431 1.00 . A A . 3 TYR HH 1 1 19 9510 1 1 3 TYR N N -0.942 -3.534 -2.300 1.00 . A A . 3 TYR N 1 1 19 9511 1 1 3 TYR O O -2.521 -4.020 0.680 1.00 . A A . 3 TYR O 1 1 19 9512 1 1 3 TYR OH O 1.049 -8.302 -5.764 1.00 . A A . 3 TYR OH 1 1 19 9513 1 1 4 CYS C C -5.763 -1.730 -0.470 1.00 . A A . 4 CYS C 1 1 19 9514 1 1 4 CYS CA C -4.275 -1.977 -0.137 1.00 . A A . 4 CYS CA 1 1 19 9515 1 1 4 CYS CB C -3.420 -0.695 -0.098 1.00 . A A . 4 CYS CB 1 1 19 9516 1 1 4 CYS H H -3.628 -2.813 -1.993 1.00 . A A . 4 CYS H 1 1 19 9517 1 1 4 CYS HA H -4.292 -2.362 0.883 1.00 . A A . 4 CYS HA 1 1 19 9518 1 1 4 CYS HB2 H -4.047 0.134 0.221 1.00 . A A . 4 CYS HB2 1 1 19 9519 1 1 4 CYS HB3 H -2.670 -0.838 0.678 1.00 . A A . 4 CYS HB3 1 1 19 9520 1 1 4 CYS N N -3.603 -2.959 -0.990 1.00 . A A . 4 CYS N 1 1 19 9521 1 1 4 CYS O O -6.550 -1.517 0.451 1.00 . A A . 4 CYS O 1 1 19 9522 1 1 4 CYS SG S -2.502 -0.166 -1.579 1.00 . A A . 4 CYS SG 1 1 19 9523 1 1 5 GLN C C -8.117 -3.419 -2.053 1.00 . A A . 5 GLN C 1 1 19 9524 1 1 5 GLN CA C -7.619 -1.969 -2.095 1.00 . A A . 5 GLN CA 1 1 19 9525 1 1 5 GLN CB C -7.814 -1.261 -3.448 1.00 . A A . 5 GLN CB 1 1 19 9526 1 1 5 GLN CD C -9.399 -2.834 -4.795 1.00 . A A . 5 GLN CD 1 1 19 9527 1 1 5 GLN CG C -9.142 -1.451 -4.199 1.00 . A A . 5 GLN CG 1 1 19 9528 1 1 5 GLN H H -5.523 -2.083 -2.456 1.00 . A A . 5 GLN H 1 1 19 9529 1 1 5 GLN HA H -8.198 -1.419 -1.356 1.00 . A A . 5 GLN HA 1 1 19 9530 1 1 5 GLN HB2 H -7.704 -0.193 -3.269 1.00 . A A . 5 GLN HB2 1 1 19 9531 1 1 5 GLN HB3 H -7.009 -1.558 -4.100 1.00 . A A . 5 GLN HB3 1 1 19 9532 1 1 5 GLN HE21 H -7.557 -2.965 -5.667 1.00 . A A . 5 GLN HE21 1 1 19 9533 1 1 5 GLN HE22 H -8.644 -4.352 -5.833 1.00 . A A . 5 GLN HE22 1 1 19 9534 1 1 5 GLN HG2 H -9.955 -1.200 -3.535 1.00 . A A . 5 GLN HG2 1 1 19 9535 1 1 5 GLN HG3 H -9.157 -0.739 -5.025 1.00 . A A . 5 GLN HG3 1 1 19 9536 1 1 5 GLN N N -6.199 -1.897 -1.721 1.00 . A A . 5 GLN N 1 1 19 9537 1 1 5 GLN NE2 N -8.451 -3.431 -5.483 1.00 . A A . 5 GLN NE2 1 1 19 9538 1 1 5 GLN O O -9.068 -3.728 -1.339 1.00 . A A . 5 GLN O 1 1 19 9539 1 1 5 GLN OE1 O -10.504 -3.358 -4.719 1.00 . A A . 5 GLN OE1 1 1 19 9540 1 1 6 LYS C C -7.456 -6.303 -1.040 1.00 . A A . 6 LYS C 1 1 19 9541 1 1 6 LYS CA C -7.604 -5.803 -2.490 1.00 . A A . 6 LYS CA 1 1 19 9542 1 1 6 LYS CB C -6.674 -6.587 -3.436 1.00 . A A . 6 LYS CB 1 1 19 9543 1 1 6 LYS CD C -6.499 -9.059 -4.188 1.00 . A A . 6 LYS CD 1 1 19 9544 1 1 6 LYS CE C -5.274 -8.863 -5.086 1.00 . A A . 6 LYS CE 1 1 19 9545 1 1 6 LYS CG C -7.394 -7.837 -3.966 1.00 . A A . 6 LYS CG 1 1 19 9546 1 1 6 LYS H H -6.551 -4.051 -3.181 1.00 . A A . 6 LYS H 1 1 19 9547 1 1 6 LYS HA H -8.643 -5.973 -2.782 1.00 . A A . 6 LYS HA 1 1 19 9548 1 1 6 LYS HB2 H -6.392 -5.971 -4.293 1.00 . A A . 6 LYS HB2 1 1 19 9549 1 1 6 LYS HB3 H -5.765 -6.865 -2.901 1.00 . A A . 6 LYS HB3 1 1 19 9550 1 1 6 LYS HD2 H -6.163 -9.414 -3.213 1.00 . A A . 6 LYS HD2 1 1 19 9551 1 1 6 LYS HD3 H -7.125 -9.832 -4.634 1.00 . A A . 6 LYS HD3 1 1 19 9552 1 1 6 LYS HE2 H -5.596 -8.428 -6.037 1.00 . A A . 6 LYS HE2 1 1 19 9553 1 1 6 LYS HE3 H -4.575 -8.174 -4.607 1.00 . A A . 6 LYS HE3 1 1 19 9554 1 1 6 LYS HG2 H -8.162 -8.146 -3.257 1.00 . A A . 6 LYS HG2 1 1 19 9555 1 1 6 LYS HG3 H -7.902 -7.579 -4.895 1.00 . A A . 6 LYS HG3 1 1 19 9556 1 1 6 LYS HZ1 H -5.245 -10.771 -5.875 1.00 . A A . 6 LYS HZ1 1 1 19 9557 1 1 6 LYS HZ2 H -4.405 -10.673 -4.471 1.00 . A A . 6 LYS HZ2 1 1 19 9558 1 1 6 LYS HZ3 H -3.756 -10.099 -5.853 1.00 . A A . 6 LYS HZ3 1 1 19 9559 1 1 6 LYS N N -7.345 -4.357 -2.621 1.00 . A A . 6 LYS N 1 1 19 9560 1 1 6 LYS NZ N -4.625 -10.174 -5.331 1.00 . A A . 6 LYS NZ 1 1 19 9561 1 1 6 LYS O O -7.899 -7.405 -0.713 1.00 . A A . 6 LYS O 1 1 19 9562 1 1 7 TRP C C -6.844 -4.633 2.212 1.00 . A A . 7 TRP C 1 1 19 9563 1 1 7 TRP CA C -6.483 -5.750 1.212 1.00 . A A . 7 TRP CA 1 1 19 9564 1 1 7 TRP CB C -5.020 -6.226 1.240 1.00 . A A . 7 TRP CB 1 1 19 9565 1 1 7 TRP CD1 C -4.856 -8.512 0.137 1.00 . A A . 7 TRP CD1 1 1 19 9566 1 1 7 TRP CD2 C -4.845 -8.607 2.378 1.00 . A A . 7 TRP CD2 1 1 19 9567 1 1 7 TRP CE2 C -4.681 -9.941 1.909 1.00 . A A . 7 TRP CE2 1 1 19 9568 1 1 7 TRP CE3 C -4.920 -8.422 3.777 1.00 . A A . 7 TRP CE3 1 1 19 9569 1 1 7 TRP CG C -4.840 -7.709 1.226 1.00 . A A . 7 TRP CG 1 1 19 9570 1 1 7 TRP CH2 C -4.526 -10.800 4.169 1.00 . A A . 7 TRP CH2 1 1 19 9571 1 1 7 TRP CZ2 C -4.506 -11.025 2.782 1.00 . A A . 7 TRP CZ2 1 1 19 9572 1 1 7 TRP CZ3 C -4.762 -9.506 4.663 1.00 . A A . 7 TRP CZ3 1 1 19 9573 1 1 7 TRP H H -6.591 -4.585 -0.553 1.00 . A A . 7 TRP H 1 1 19 9574 1 1 7 TRP HA H -7.080 -6.597 1.555 1.00 . A A . 7 TRP HA 1 1 19 9575 1 1 7 TRP HB2 H -4.480 -5.798 0.397 1.00 . A A . 7 TRP HB2 1 1 19 9576 1 1 7 TRP HB3 H -4.521 -5.870 2.139 1.00 . A A . 7 TRP HB3 1 1 19 9577 1 1 7 TRP HD1 H -4.922 -8.174 -0.889 1.00 . A A . 7 TRP HD1 1 1 19 9578 1 1 7 TRP HE1 H -4.643 -10.613 -0.105 1.00 . A A . 7 TRP HE1 1 1 19 9579 1 1 7 TRP HE3 H -5.076 -7.430 4.172 1.00 . A A . 7 TRP HE3 1 1 19 9580 1 1 7 TRP HH2 H -4.383 -11.622 4.859 1.00 . A A . 7 TRP HH2 1 1 19 9581 1 1 7 TRP HZ2 H -4.336 -12.017 2.390 1.00 . A A . 7 TRP HZ2 1 1 19 9582 1 1 7 TRP HZ3 H -4.795 -9.340 5.733 1.00 . A A . 7 TRP HZ3 1 1 19 9583 1 1 7 TRP N N -6.870 -5.474 -0.174 1.00 . A A . 7 TRP N 1 1 19 9584 1 1 7 TRP NE1 N -4.742 -9.828 0.537 1.00 . A A . 7 TRP NE1 1 1 19 9585 1 1 7 TRP O O -6.132 -4.407 3.189 1.00 . A A . 7 TRP O 1 1 19 9586 1 1 8 MET C C -7.889 -2.240 3.907 1.00 . A A . 8 MET C 1 1 19 9587 1 1 8 MET CA C -8.704 -3.125 2.932 1.00 . A A . 8 MET CA 1 1 19 9588 1 1 8 MET CB C -9.738 -4.030 3.628 1.00 . A A . 8 MET CB 1 1 19 9589 1 1 8 MET CE C -11.518 -6.815 4.028 1.00 . A A . 8 MET CE 1 1 19 9590 1 1 8 MET CG C -10.796 -4.521 2.628 1.00 . A A . 8 MET CG 1 1 19 9591 1 1 8 MET H H -8.409 -4.099 1.071 1.00 . A A . 8 MET H 1 1 19 9592 1 1 8 MET HA H -9.264 -2.414 2.332 1.00 . A A . 8 MET HA 1 1 19 9593 1 1 8 MET HB2 H -9.235 -4.884 4.081 1.00 . A A . 8 MET HB2 1 1 19 9594 1 1 8 MET HB3 H -10.245 -3.468 4.413 1.00 . A A . 8 MET HB3 1 1 19 9595 1 1 8 MET HE1 H -10.993 -7.348 3.237 1.00 . A A . 8 MET HE1 1 1 19 9596 1 1 8 MET HE2 H -10.812 -6.565 4.818 1.00 . A A . 8 MET HE2 1 1 19 9597 1 1 8 MET HE3 H -12.301 -7.455 4.433 1.00 . A A . 8 MET HE3 1 1 19 9598 1 1 8 MET HG2 H -11.143 -3.666 2.048 1.00 . A A . 8 MET HG2 1 1 19 9599 1 1 8 MET HG3 H -10.335 -5.227 1.937 1.00 . A A . 8 MET HG3 1 1 19 9600 1 1 8 MET N N -7.940 -3.913 1.949 1.00 . A A . 8 MET N 1 1 19 9601 1 1 8 MET O O -7.937 -2.385 5.129 1.00 . A A . 8 MET O 1 1 19 9602 1 1 8 MET SD S -12.259 -5.302 3.358 1.00 . A A . 8 MET SD 1 1 19 9603 1 1 9 GLN C C -6.588 0.618 5.053 1.00 . A A . 9 GLN C 1 1 19 9604 1 1 9 GLN CA C -6.143 -0.417 3.985 1.00 . A A . 9 GLN CA 1 1 19 9605 1 1 9 GLN CB C -5.405 0.318 2.859 1.00 . A A . 9 GLN CB 1 1 19 9606 1 1 9 GLN CD C -5.688 2.206 1.132 1.00 . A A . 9 GLN CD 1 1 19 9607 1 1 9 GLN CG C -6.362 1.277 2.116 1.00 . A A . 9 GLN CG 1 1 19 9608 1 1 9 GLN H H -7.132 -1.289 2.328 1.00 . A A . 9 GLN H 1 1 19 9609 1 1 9 GLN HA H -5.425 -1.073 4.480 1.00 . A A . 9 GLN HA 1 1 19 9610 1 1 9 GLN HB2 H -4.562 0.866 3.281 1.00 . A A . 9 GLN HB2 1 1 19 9611 1 1 9 GLN HB3 H -4.997 -0.413 2.168 1.00 . A A . 9 GLN HB3 1 1 19 9612 1 1 9 GLN HE21 H -3.967 2.357 2.185 1.00 . A A . 9 GLN HE21 1 1 19 9613 1 1 9 GLN HE22 H -4.210 3.503 0.873 1.00 . A A . 9 GLN HE22 1 1 19 9614 1 1 9 GLN HG2 H -7.121 0.709 1.581 1.00 . A A . 9 GLN HG2 1 1 19 9615 1 1 9 GLN HG3 H -6.875 1.920 2.829 1.00 . A A . 9 GLN HG3 1 1 19 9616 1 1 9 GLN N N -7.153 -1.282 3.343 1.00 . A A . 9 GLN N 1 1 19 9617 1 1 9 GLN NE2 N -4.479 2.660 1.376 1.00 . A A . 9 GLN NE2 1 1 19 9618 1 1 9 GLN O O -5.905 1.631 5.212 1.00 . A A . 9 GLN O 1 1 19 9619 1 1 9 GLN OE1 O -6.302 2.605 0.160 1.00 . A A . 9 GLN OE1 1 1 19 9620 1 1 10 THR C C -8.121 2.817 6.565 1.00 . A A . 10 THR C 1 1 19 9621 1 1 10 THR CA C -8.033 1.321 6.927 1.00 . A A . 10 THR CA 1 1 19 9622 1 1 10 THR CB C -7.056 1.028 8.084 1.00 . A A . 10 THR CB 1 1 19 9623 1 1 10 THR CG2 C -7.549 1.546 9.424 1.00 . A A . 10 THR CG2 1 1 19 9624 1 1 10 THR H H -8.211 -0.421 5.668 1.00 . A A . 10 THR H 1 1 19 9625 1 1 10 THR HA H -9.021 1.052 7.293 1.00 . A A . 10 THR HA 1 1 19 9626 1 1 10 THR HB H -6.083 1.469 7.866 1.00 . A A . 10 THR HB 1 1 19 9627 1 1 10 THR HG1 H -7.775 -0.770 8.119 1.00 . A A . 10 THR HG1 1 1 19 9628 1 1 10 THR HG21 H -8.451 1.008 9.694 1.00 . A A . 10 THR HG21 1 1 19 9629 1 1 10 THR HG22 H -7.767 2.611 9.374 1.00 . A A . 10 THR HG22 1 1 19 9630 1 1 10 THR HG23 H -6.793 1.385 10.189 1.00 . A A . 10 THR HG23 1 1 19 9631 1 1 10 THR N N -7.702 0.449 5.770 1.00 . A A . 10 THR N 1 1 19 9632 1 1 10 THR O O -7.350 3.643 7.058 1.00 . A A . 10 THR O 1 1 19 9633 1 1 10 THR OG1 O -6.897 -0.371 8.250 1.00 . A A . 10 THR OG1 1 1 19 9634 1 1 11 CYS C C -9.574 5.602 5.544 1.00 . A A . 11 CYS C 1 1 19 9635 1 1 11 CYS CA C -8.865 4.420 4.845 1.00 . A A . 11 CYS CA 1 1 19 9636 1 1 11 CYS CB C -9.280 4.186 3.387 1.00 . A A . 11 CYS CB 1 1 19 9637 1 1 11 CYS H H -9.573 2.438 5.220 1.00 . A A . 11 CYS H 1 1 19 9638 1 1 11 CYS HA H -7.809 4.677 4.809 1.00 . A A . 11 CYS HA 1 1 19 9639 1 1 11 CYS HB2 H -9.031 3.159 3.130 1.00 . A A . 11 CYS HB2 1 1 19 9640 1 1 11 CYS HB3 H -10.358 4.311 3.286 1.00 . A A . 11 CYS HB3 1 1 19 9641 1 1 11 CYS N N -8.960 3.152 5.579 1.00 . A A . 11 CYS N 1 1 19 9642 1 1 11 CYS O O -10.705 5.961 5.217 1.00 . A A . 11 CYS O 1 1 19 9643 1 1 11 CYS SG S -8.437 5.221 2.162 1.00 . A A . 11 CYS SG 1 1 19 9644 1 1 12 ASP C C -8.968 8.741 6.283 1.00 . A A . 12 ASP C 1 1 19 9645 1 1 12 ASP CA C -9.213 7.483 7.163 1.00 . A A . 12 ASP CA 1 1 19 9646 1 1 12 ASP CB C -8.474 7.556 8.516 1.00 . A A . 12 ASP CB 1 1 19 9647 1 1 12 ASP CG C -9.072 6.646 9.599 1.00 . A A . 12 ASP CG 1 1 19 9648 1 1 12 ASP H H -8.011 5.768 6.780 1.00 . A A . 12 ASP H 1 1 19 9649 1 1 12 ASP HA H -10.283 7.487 7.382 1.00 . A A . 12 ASP HA 1 1 19 9650 1 1 12 ASP HB2 H -7.421 7.316 8.362 1.00 . A A . 12 ASP HB2 1 1 19 9651 1 1 12 ASP HB3 H -8.525 8.577 8.890 1.00 . A A . 12 ASP HB3 1 1 19 9652 1 1 12 ASP N N -8.892 6.194 6.528 1.00 . A A . 12 ASP N 1 1 19 9653 1 1 12 ASP O O -8.456 8.637 5.167 1.00 . A A . 12 ASP O 1 1 19 9654 1 1 12 ASP OD1 O -8.347 5.798 10.167 1.00 . A A . 12 ASP OD1 1 1 19 9655 1 1 12 ASP OD2 O -10.284 6.769 9.890 1.00 . A A . 12 ASP OD2 1 1 19 9656 1 1 13 SER C C -7.455 11.377 5.736 1.00 . A A . 13 SER C 1 1 19 9657 1 1 13 SER CA C -8.939 11.235 6.116 1.00 . A A . 13 SER CA 1 1 19 9658 1 1 13 SER CB C -9.352 12.399 7.026 1.00 . A A . 13 SER CB 1 1 19 9659 1 1 13 SER H H -9.679 9.991 7.708 1.00 . A A . 13 SER H 1 1 19 9660 1 1 13 SER HA H -9.525 11.310 5.202 1.00 . A A . 13 SER HA 1 1 19 9661 1 1 13 SER HB2 H -10.419 12.345 7.207 1.00 . A A . 13 SER HB2 1 1 19 9662 1 1 13 SER HB3 H -8.838 12.303 7.980 1.00 . A A . 13 SER HB3 1 1 19 9663 1 1 13 SER HG H -9.490 14.325 7.085 1.00 . A A . 13 SER HG 1 1 19 9664 1 1 13 SER N N -9.254 9.951 6.791 1.00 . A A . 13 SER N 1 1 19 9665 1 1 13 SER O O -7.123 11.767 4.614 1.00 . A A . 13 SER O 1 1 19 9666 1 1 13 SER OG O -9.062 13.673 6.487 1.00 . A A . 13 SER OG 1 1 19 9667 1 1 14 GLU C C -4.621 9.944 5.386 1.00 . A A . 14 GLU C 1 1 19 9668 1 1 14 GLU CA C -5.097 10.976 6.426 1.00 . A A . 14 GLU CA 1 1 19 9669 1 1 14 GLU CB C -4.425 10.744 7.795 1.00 . A A . 14 GLU CB 1 1 19 9670 1 1 14 GLU CD C -2.291 10.255 9.147 1.00 . A A . 14 GLU CD 1 1 19 9671 1 1 14 GLU CG C -2.928 10.391 7.757 1.00 . A A . 14 GLU CG 1 1 19 9672 1 1 14 GLU H H -6.894 10.695 7.545 1.00 . A A . 14 GLU H 1 1 19 9673 1 1 14 GLU HA H -4.784 11.956 6.063 1.00 . A A . 14 GLU HA 1 1 19 9674 1 1 14 GLU HB2 H -4.565 11.641 8.393 1.00 . A A . 14 GLU HB2 1 1 19 9675 1 1 14 GLU HB3 H -4.939 9.925 8.294 1.00 . A A . 14 GLU HB3 1 1 19 9676 1 1 14 GLU HG2 H -2.794 9.447 7.229 1.00 . A A . 14 GLU HG2 1 1 19 9677 1 1 14 GLU HG3 H -2.397 11.166 7.203 1.00 . A A . 14 GLU HG3 1 1 19 9678 1 1 14 GLU N N -6.554 10.983 6.640 1.00 . A A . 14 GLU N 1 1 19 9679 1 1 14 GLU O O -3.564 10.123 4.777 1.00 . A A . 14 GLU O 1 1 19 9680 1 1 14 GLU OE1 O -1.325 9.464 9.274 1.00 . A A . 14 GLU OE1 1 1 19 9681 1 1 14 GLU OE2 O -2.694 10.964 10.103 1.00 . A A . 14 GLU OE2 1 1 19 9682 1 1 15 ARG C C -4.897 7.883 2.953 1.00 . A A . 15 ARG C 1 1 19 9683 1 1 15 ARG CA C -4.817 7.671 4.469 1.00 . A A . 15 ARG CA 1 1 19 9684 1 1 15 ARG CB C -5.532 6.390 4.953 1.00 . A A . 15 ARG CB 1 1 19 9685 1 1 15 ARG CD C -4.178 4.432 4.167 1.00 . A A . 15 ARG CD 1 1 19 9686 1 1 15 ARG CG C -4.549 5.289 5.398 1.00 . A A . 15 ARG CG 1 1 19 9687 1 1 15 ARG CZ C -2.584 2.926 5.404 1.00 . A A . 15 ARG CZ 1 1 19 9688 1 1 15 ARG H H -6.273 8.779 5.594 1.00 . A A . 15 ARG H 1 1 19 9689 1 1 15 ARG HA H -3.760 7.596 4.728 1.00 . A A . 15 ARG HA 1 1 19 9690 1 1 15 ARG HB2 H -6.143 6.635 5.824 1.00 . A A . 15 ARG HB2 1 1 19 9691 1 1 15 ARG HB3 H -6.205 6.019 4.180 1.00 . A A . 15 ARG HB3 1 1 19 9692 1 1 15 ARG HD2 H -4.951 3.692 4.005 1.00 . A A . 15 ARG HD2 1 1 19 9693 1 1 15 ARG HD3 H -4.050 5.077 3.309 1.00 . A A . 15 ARG HD3 1 1 19 9694 1 1 15 ARG HE H -2.091 4.024 3.844 1.00 . A A . 15 ARG HE 1 1 19 9695 1 1 15 ARG HG2 H -3.667 5.737 5.857 1.00 . A A . 15 ARG HG2 1 1 19 9696 1 1 15 ARG HG3 H -5.032 4.655 6.140 1.00 . A A . 15 ARG HG3 1 1 19 9697 1 1 15 ARG HH11 H -4.437 2.473 6.023 1.00 . A A . 15 ARG HH11 1 1 19 9698 1 1 15 ARG HH12 H -3.102 1.794 6.949 1.00 . A A . 15 ARG HH12 1 1 19 9699 1 1 15 ARG HH21 H -0.652 2.872 4.905 1.00 . A A . 15 ARG HH21 1 1 19 9700 1 1 15 ARG HH22 H -1.118 1.934 6.325 1.00 . A A . 15 ARG HH22 1 1 19 9701 1 1 15 ARG N N -5.344 8.834 5.193 1.00 . A A . 15 ARG N 1 1 19 9702 1 1 15 ARG NE N -2.882 3.780 4.436 1.00 . A A . 15 ARG NE 1 1 19 9703 1 1 15 ARG NH1 N -3.446 2.405 6.222 1.00 . A A . 15 ARG NH1 1 1 19 9704 1 1 15 ARG NH2 N -1.352 2.554 5.563 1.00 . A A . 15 ARG NH2 1 1 19 9705 1 1 15 ARG O O -5.968 8.132 2.396 1.00 . A A . 15 ARG O 1 1 19 9706 1 1 16 LYS C C -4.583 6.474 0.290 1.00 . A A . 16 LYS C 1 1 19 9707 1 1 16 LYS CA C -3.742 7.652 0.784 1.00 . A A . 16 LYS CA 1 1 19 9708 1 1 16 LYS CB C -2.308 7.495 0.251 1.00 . A A . 16 LYS CB 1 1 19 9709 1 1 16 LYS CD C -1.742 10.004 0.269 1.00 . A A . 16 LYS CD 1 1 19 9710 1 1 16 LYS CE C -0.512 10.860 -0.052 1.00 . A A . 16 LYS CE 1 1 19 9711 1 1 16 LYS CG C -1.301 8.580 0.648 1.00 . A A . 16 LYS CG 1 1 19 9712 1 1 16 LYS H H -2.913 7.533 2.757 1.00 . A A . 16 LYS H 1 1 19 9713 1 1 16 LYS HA H -4.167 8.569 0.382 1.00 . A A . 16 LYS HA 1 1 19 9714 1 1 16 LYS HB2 H -1.906 6.534 0.577 1.00 . A A . 16 LYS HB2 1 1 19 9715 1 1 16 LYS HB3 H -2.363 7.475 -0.836 1.00 . A A . 16 LYS HB3 1 1 19 9716 1 1 16 LYS HD2 H -2.407 9.986 -0.597 1.00 . A A . 16 LYS HD2 1 1 19 9717 1 1 16 LYS HD3 H -2.284 10.442 1.108 1.00 . A A . 16 LYS HD3 1 1 19 9718 1 1 16 LYS HE2 H -0.749 11.914 0.126 1.00 . A A . 16 LYS HE2 1 1 19 9719 1 1 16 LYS HE3 H 0.302 10.588 0.625 1.00 . A A . 16 LYS HE3 1 1 19 9720 1 1 16 LYS HG2 H -1.119 8.537 1.722 1.00 . A A . 16 LYS HG2 1 1 19 9721 1 1 16 LYS HG3 H -0.362 8.342 0.145 1.00 . A A . 16 LYS HG3 1 1 19 9722 1 1 16 LYS HZ1 H 0.825 11.048 -1.655 1.00 . A A . 16 LYS HZ1 1 1 19 9723 1 1 16 LYS HZ2 H -0.752 11.202 -2.058 1.00 . A A . 16 LYS HZ2 1 1 19 9724 1 1 16 LYS HZ3 H -0.153 9.715 -1.773 1.00 . A A . 16 LYS HZ3 1 1 19 9725 1 1 16 LYS N N -3.770 7.703 2.254 1.00 . A A . 16 LYS N 1 1 19 9726 1 1 16 LYS NZ N -0.106 10.684 -1.466 1.00 . A A . 16 LYS NZ 1 1 19 9727 1 1 16 LYS O O -4.276 5.334 0.641 1.00 . A A . 16 LYS O 1 1 19 9728 1 1 17 CYS C C -5.228 4.836 -2.169 1.00 . A A . 17 CYS C 1 1 19 9729 1 1 17 CYS CA C -6.222 5.601 -1.276 1.00 . A A . 17 CYS CA 1 1 19 9730 1 1 17 CYS CB C -7.420 6.094 -2.086 1.00 . A A . 17 CYS CB 1 1 19 9731 1 1 17 CYS H H -5.814 7.660 -0.807 1.00 . A A . 17 CYS H 1 1 19 9732 1 1 17 CYS HA H -6.604 4.921 -0.515 1.00 . A A . 17 CYS HA 1 1 19 9733 1 1 17 CYS HB2 H -8.073 6.678 -1.436 1.00 . A A . 17 CYS HB2 1 1 19 9734 1 1 17 CYS HB3 H -7.063 6.753 -2.880 1.00 . A A . 17 CYS HB3 1 1 19 9735 1 1 17 CYS N N -5.558 6.705 -0.588 1.00 . A A . 17 CYS N 1 1 19 9736 1 1 17 CYS O O -4.330 5.423 -2.774 1.00 . A A . 17 CYS O 1 1 19 9737 1 1 17 CYS SG S -8.401 4.756 -2.829 1.00 . A A . 17 CYS SG 1 1 19 9738 1 1 18 CYS C C -4.567 2.770 -4.524 1.00 . A A . 18 CYS C 1 1 19 9739 1 1 18 CYS CA C -4.515 2.617 -2.990 1.00 . A A . 18 CYS CA 1 1 19 9740 1 1 18 CYS CB C -4.956 1.213 -2.581 1.00 . A A . 18 CYS CB 1 1 19 9741 1 1 18 CYS H H -6.077 3.114 -1.631 1.00 . A A . 18 CYS H 1 1 19 9742 1 1 18 CYS HA H -3.489 2.779 -2.656 1.00 . A A . 18 CYS HA 1 1 19 9743 1 1 18 CYS HB2 H -5.055 1.178 -1.498 1.00 . A A . 18 CYS HB2 1 1 19 9744 1 1 18 CYS HB3 H -5.941 1.032 -3.003 1.00 . A A . 18 CYS HB3 1 1 19 9745 1 1 18 CYS N N -5.407 3.525 -2.276 1.00 . A A . 18 CYS N 1 1 19 9746 1 1 18 CYS O O -3.547 2.616 -5.200 1.00 . A A . 18 CYS O 1 1 19 9747 1 1 18 CYS SG S -3.876 -0.144 -3.068 1.00 . A A . 18 CYS SG 1 1 19 9748 1 1 19 GLU C C -6.936 3.976 -7.121 1.00 . A A . 19 GLU C 1 1 19 9749 1 1 19 GLU CA C -6.045 2.870 -6.517 1.00 . A A . 19 GLU CA 1 1 19 9750 1 1 19 GLU CB C -6.621 1.461 -6.806 1.00 . A A . 19 GLU CB 1 1 19 9751 1 1 19 GLU CD C -6.024 -1.058 -6.894 1.00 . A A . 19 GLU CD 1 1 19 9752 1 1 19 GLU CG C -5.809 0.296 -6.201 1.00 . A A . 19 GLU CG 1 1 19 9753 1 1 19 GLU H H -6.543 3.158 -4.453 1.00 . A A . 19 GLU H 1 1 19 9754 1 1 19 GLU HA H -5.111 2.951 -7.064 1.00 . A A . 19 GLU HA 1 1 19 9755 1 1 19 GLU HB2 H -7.639 1.400 -6.419 1.00 . A A . 19 GLU HB2 1 1 19 9756 1 1 19 GLU HB3 H -6.664 1.341 -7.888 1.00 . A A . 19 GLU HB3 1 1 19 9757 1 1 19 GLU HG2 H -4.748 0.532 -6.282 1.00 . A A . 19 GLU HG2 1 1 19 9758 1 1 19 GLU HG3 H -6.053 0.219 -5.143 1.00 . A A . 19 GLU HG3 1 1 19 9759 1 1 19 GLU N N -5.762 3.031 -5.077 1.00 . A A . 19 GLU N 1 1 19 9760 1 1 19 GLU O O -7.459 3.810 -8.220 1.00 . A A . 19 GLU O 1 1 19 9761 1 1 19 GLU OE1 O -6.050 -2.109 -6.204 1.00 . A A . 19 GLU OE1 1 1 19 9762 1 1 19 GLU OE2 O -6.065 -1.093 -8.144 1.00 . A A . 19 GLU OE2 1 1 19 9763 1 1 20 GLY C C -9.551 5.737 -6.800 1.00 . A A . 20 GLY C 1 1 19 9764 1 1 20 GLY CA C -8.075 6.150 -6.893 1.00 . A A . 20 GLY CA 1 1 19 9765 1 1 20 GLY H H -6.655 5.239 -5.560 1.00 . A A . 20 GLY H 1 1 19 9766 1 1 20 GLY HA2 H -7.925 7.045 -6.296 1.00 . A A . 20 GLY HA2 1 1 19 9767 1 1 20 GLY HA3 H -7.846 6.398 -7.929 1.00 . A A . 20 GLY HA3 1 1 19 9768 1 1 20 GLY N N -7.162 5.095 -6.422 1.00 . A A . 20 GLY N 1 1 19 9769 1 1 20 GLY O O -10.250 5.652 -7.809 1.00 . A A . 20 GLY O 1 1 19 9770 1 1 21 MET C C -11.925 5.199 -4.055 1.00 . A A . 21 MET C 1 1 19 9771 1 1 21 MET CA C -11.244 4.646 -5.319 1.00 . A A . 21 MET CA 1 1 19 9772 1 1 21 MET CB C -10.959 3.139 -5.205 1.00 . A A . 21 MET CB 1 1 19 9773 1 1 21 MET CE C -10.173 1.996 -9.180 1.00 . A A . 21 MET CE 1 1 19 9774 1 1 21 MET CG C -10.335 2.512 -6.457 1.00 . A A . 21 MET CG 1 1 19 9775 1 1 21 MET H H -9.395 5.555 -4.806 1.00 . A A . 21 MET H 1 1 19 9776 1 1 21 MET HA H -11.941 4.791 -6.140 1.00 . A A . 21 MET HA 1 1 19 9777 1 1 21 MET HB2 H -10.295 2.963 -4.359 1.00 . A A . 21 MET HB2 1 1 19 9778 1 1 21 MET HB3 H -11.895 2.632 -5.012 1.00 . A A . 21 MET HB3 1 1 19 9779 1 1 21 MET HE1 H -10.684 1.751 -10.112 1.00 . A A . 21 MET HE1 1 1 19 9780 1 1 21 MET HE2 H -9.463 2.797 -9.371 1.00 . A A . 21 MET HE2 1 1 19 9781 1 1 21 MET HE3 H -9.633 1.120 -8.822 1.00 . A A . 21 MET HE3 1 1 19 9782 1 1 21 MET HG2 H -9.400 3.019 -6.680 1.00 . A A . 21 MET HG2 1 1 19 9783 1 1 21 MET HG3 H -10.098 1.471 -6.236 1.00 . A A . 21 MET HG3 1 1 19 9784 1 1 21 MET N N -9.987 5.356 -5.599 1.00 . A A . 21 MET N 1 1 19 9785 1 1 21 MET O O -11.462 6.197 -3.503 1.00 . A A . 21 MET O 1 1 19 9786 1 1 21 MET SD S -11.378 2.543 -7.938 1.00 . A A . 21 MET SD 1 1 19 9787 1 1 22 VAL C C -12.932 4.780 -1.134 1.00 . A A . 22 VAL C 1 1 19 9788 1 1 22 VAL CA C -13.758 5.048 -2.394 1.00 . A A . 22 VAL CA 1 1 19 9789 1 1 22 VAL CB C -15.144 4.379 -2.254 1.00 . A A . 22 VAL CB 1 1 19 9790 1 1 22 VAL CG1 C -15.904 4.904 -1.026 1.00 . A A . 22 VAL CG1 1 1 19 9791 1 1 22 VAL CG2 C -16.031 4.609 -3.476 1.00 . A A . 22 VAL CG2 1 1 19 9792 1 1 22 VAL H H -13.413 3.816 -4.117 1.00 . A A . 22 VAL H 1 1 19 9793 1 1 22 VAL HA H -13.921 6.124 -2.467 1.00 . A A . 22 VAL HA 1 1 19 9794 1 1 22 VAL HB H -15.013 3.302 -2.149 1.00 . A A . 22 VAL HB 1 1 19 9795 1 1 22 VAL HG11 H -15.370 4.644 -0.112 1.00 . A A . 22 VAL HG11 1 1 19 9796 1 1 22 VAL HG12 H -16.013 5.986 -1.089 1.00 . A A . 22 VAL HG12 1 1 19 9797 1 1 22 VAL HG13 H -16.890 4.442 -0.977 1.00 . A A . 22 VAL HG13 1 1 19 9798 1 1 22 VAL HG21 H -16.168 5.678 -3.647 1.00 . A A . 22 VAL HG21 1 1 19 9799 1 1 22 VAL HG22 H -15.579 4.155 -4.355 1.00 . A A . 22 VAL HG22 1 1 19 9800 1 1 22 VAL HG23 H -17.002 4.143 -3.313 1.00 . A A . 22 VAL HG23 1 1 19 9801 1 1 22 VAL N N -13.041 4.606 -3.608 1.00 . A A . 22 VAL N 1 1 19 9802 1 1 22 VAL O O -12.854 3.638 -0.690 1.00 . A A . 22 VAL O 1 1 19 9803 1 1 23 CYS C C -12.653 5.895 1.915 1.00 . A A . 23 CYS C 1 1 19 9804 1 1 23 CYS CA C -11.667 5.784 0.742 1.00 . A A . 23 CYS CA 1 1 19 9805 1 1 23 CYS CB C -10.598 6.886 0.733 1.00 . A A . 23 CYS CB 1 1 19 9806 1 1 23 CYS H H -12.449 6.739 -0.991 1.00 . A A . 23 CYS H 1 1 19 9807 1 1 23 CYS HA H -11.150 4.829 0.819 1.00 . A A . 23 CYS HA 1 1 19 9808 1 1 23 CYS HB2 H -9.989 6.762 -0.161 1.00 . A A . 23 CYS HB2 1 1 19 9809 1 1 23 CYS HB3 H -11.101 7.851 0.651 1.00 . A A . 23 CYS HB3 1 1 19 9810 1 1 23 CYS N N -12.389 5.836 -0.527 1.00 . A A . 23 CYS N 1 1 19 9811 1 1 23 CYS O O -13.057 7.000 2.290 1.00 . A A . 23 CYS O 1 1 19 9812 1 1 23 CYS SG S -9.476 6.967 2.160 1.00 . A A . 23 CYS SG 1 1 19 9813 1 1 24 ARG C C -13.693 3.241 4.303 1.00 . A A . 24 ARG C 1 1 19 9814 1 1 24 ARG CA C -13.932 4.594 3.642 1.00 . A A . 24 ARG CA 1 1 19 9815 1 1 24 ARG CB C -15.435 4.737 3.311 1.00 . A A . 24 ARG CB 1 1 19 9816 1 1 24 ARG CD C -16.299 6.711 2.022 1.00 . A A . 24 ARG CD 1 1 19 9817 1 1 24 ARG CG C -15.974 6.171 3.426 1.00 . A A . 24 ARG CG 1 1 19 9818 1 1 24 ARG CZ C -17.344 8.885 1.402 1.00 . A A . 24 ARG CZ 1 1 19 9819 1 1 24 ARG H H -12.767 3.889 1.985 1.00 . A A . 24 ARG H 1 1 19 9820 1 1 24 ARG HA H -13.646 5.358 4.363 1.00 . A A . 24 ARG HA 1 1 19 9821 1 1 24 ARG HB2 H -15.653 4.302 2.333 1.00 . A A . 24 ARG HB2 1 1 19 9822 1 1 24 ARG HB3 H -15.996 4.151 4.042 1.00 . A A . 24 ARG HB3 1 1 19 9823 1 1 24 ARG HD2 H -15.418 6.725 1.409 1.00 . A A . 24 ARG HD2 1 1 19 9824 1 1 24 ARG HD3 H -17.067 6.111 1.571 1.00 . A A . 24 ARG HD3 1 1 19 9825 1 1 24 ARG HE H -16.833 8.370 3.236 1.00 . A A . 24 ARG HE 1 1 19 9826 1 1 24 ARG HG2 H -16.893 6.143 4.012 1.00 . A A . 24 ARG HG2 1 1 19 9827 1 1 24 ARG HG3 H -15.257 6.819 3.932 1.00 . A A . 24 ARG HG3 1 1 19 9828 1 1 24 ARG HH11 H -17.690 7.549 -0.047 1.00 . A A . 24 ARG HH11 1 1 19 9829 1 1 24 ARG HH12 H -18.089 9.219 -0.411 1.00 . A A . 24 ARG HH12 1 1 19 9830 1 1 24 ARG HH21 H -17.276 10.468 2.632 1.00 . A A . 24 ARG HH21 1 1 19 9831 1 1 24 ARG HH22 H -18.059 10.723 1.089 1.00 . A A . 24 ARG HH22 1 1 19 9832 1 1 24 ARG N N -13.096 4.742 2.434 1.00 . A A . 24 ARG N 1 1 19 9833 1 1 24 ARG NE N -16.775 8.073 2.267 1.00 . A A . 24 ARG NE 1 1 19 9834 1 1 24 ARG NH1 N -17.667 8.528 0.193 1.00 . A A . 24 ARG NH1 1 1 19 9835 1 1 24 ARG NH2 N -17.629 10.102 1.752 1.00 . A A . 24 ARG NH2 1 1 19 9836 1 1 24 ARG O O -14.098 2.233 3.743 1.00 . A A . 24 ARG O 1 1 19 9837 1 1 25 LEU C C -11.537 1.068 5.315 1.00 . A A . 25 LEU C 1 1 19 9838 1 1 25 LEU CA C -12.516 1.955 6.118 1.00 . A A . 25 LEU CA 1 1 19 9839 1 1 25 LEU CB C -13.699 1.094 6.599 1.00 . A A . 25 LEU CB 1 1 19 9840 1 1 25 LEU CD1 C -15.967 0.780 7.536 1.00 . A A . 25 LEU CD1 1 1 19 9841 1 1 25 LEU CD2 C -14.538 2.552 8.501 1.00 . A A . 25 LEU CD2 1 1 19 9842 1 1 25 LEU CG C -14.905 1.821 7.213 1.00 . A A . 25 LEU CG 1 1 19 9843 1 1 25 LEU H H -12.785 4.076 5.880 1.00 . A A . 25 LEU H 1 1 19 9844 1 1 25 LEU HA H -11.973 2.280 7.004 1.00 . A A . 25 LEU HA 1 1 19 9845 1 1 25 LEU HB2 H -14.064 0.521 5.745 1.00 . A A . 25 LEU HB2 1 1 19 9846 1 1 25 LEU HB3 H -13.314 0.379 7.323 1.00 . A A . 25 LEU HB3 1 1 19 9847 1 1 25 LEU HD11 H -16.843 1.271 7.945 1.00 . A A . 25 LEU HD11 1 1 19 9848 1 1 25 LEU HD12 H -15.568 0.079 8.267 1.00 . A A . 25 LEU HD12 1 1 19 9849 1 1 25 LEU HD13 H -16.252 0.246 6.629 1.00 . A A . 25 LEU HD13 1 1 19 9850 1 1 25 LEU HD21 H -15.422 3.045 8.906 1.00 . A A . 25 LEU HD21 1 1 19 9851 1 1 25 LEU HD22 H -13.786 3.306 8.280 1.00 . A A . 25 LEU HD22 1 1 19 9852 1 1 25 LEU HD23 H -14.141 1.852 9.235 1.00 . A A . 25 LEU HD23 1 1 19 9853 1 1 25 LEU HG H -15.329 2.529 6.502 1.00 . A A . 25 LEU HG 1 1 19 9854 1 1 25 LEU N N -12.993 3.187 5.441 1.00 . A A . 25 LEU N 1 1 19 9855 1 1 25 LEU O O -10.779 0.276 5.874 1.00 . A A . 25 LEU O 1 1 19 9856 1 1 26 TRP C C -10.598 1.467 1.745 1.00 . A A . 26 TRP C 1 1 19 9857 1 1 26 TRP CA C -10.704 0.571 2.987 1.00 . A A . 26 TRP CA 1 1 19 9858 1 1 26 TRP CB C -11.349 -0.793 2.656 1.00 . A A . 26 TRP CB 1 1 19 9859 1 1 26 TRP CD1 C -13.485 -1.623 3.742 1.00 . A A . 26 TRP CD1 1 1 19 9860 1 1 26 TRP CD2 C -13.899 -0.221 2.041 1.00 . A A . 26 TRP CD2 1 1 19 9861 1 1 26 TRP CE2 C -15.159 -0.583 2.606 1.00 . A A . 26 TRP CE2 1 1 19 9862 1 1 26 TRP CE3 C -13.928 0.740 1.004 1.00 . A A . 26 TRP CE3 1 1 19 9863 1 1 26 TRP CG C -12.843 -0.935 2.767 1.00 . A A . 26 TRP CG 1 1 19 9864 1 1 26 TRP CH2 C -16.352 0.966 1.182 1.00 . A A . 26 TRP CH2 1 1 19 9865 1 1 26 TRP CZ2 C -16.370 -0.028 2.173 1.00 . A A . 26 TRP CZ2 1 1 19 9866 1 1 26 TRP CZ3 C -15.133 1.337 0.589 1.00 . A A . 26 TRP CZ3 1 1 19 9867 1 1 26 TRP H H -12.232 1.834 3.626 1.00 . A A . 26 TRP H 1 1 19 9868 1 1 26 TRP HA H -9.694 0.403 3.358 1.00 . A A . 26 TRP HA 1 1 19 9869 1 1 26 TRP HB2 H -11.043 -1.140 1.670 1.00 . A A . 26 TRP HB2 1 1 19 9870 1 1 26 TRP HB3 H -10.929 -1.486 3.380 1.00 . A A . 26 TRP HB3 1 1 19 9871 1 1 26 TRP HD1 H -13.003 -2.212 4.513 1.00 . A A . 26 TRP HD1 1 1 19 9872 1 1 26 TRP HE1 H -15.525 -1.881 4.250 1.00 . A A . 26 TRP HE1 1 1 19 9873 1 1 26 TRP HE3 H -13.008 1.076 0.563 1.00 . A A . 26 TRP HE3 1 1 19 9874 1 1 26 TRP HH2 H -17.265 1.465 0.895 1.00 . A A . 26 TRP HH2 1 1 19 9875 1 1 26 TRP HZ2 H -17.296 -0.335 2.633 1.00 . A A . 26 TRP HZ2 1 1 19 9876 1 1 26 TRP HZ3 H -15.108 2.119 -0.155 1.00 . A A . 26 TRP HZ3 1 1 19 9877 1 1 26 TRP N N -11.495 1.249 4.004 1.00 . A A . 26 TRP N 1 1 19 9878 1 1 26 TRP NE1 N -14.848 -1.474 3.606 1.00 . A A . 26 TRP NE1 1 1 19 9879 1 1 26 TRP O O -11.207 2.535 1.721 1.00 . A A . 26 TRP O 1 1 19 9880 1 1 27 CYS C C -10.928 0.102 -1.351 1.00 . A A . 27 CYS C 1 1 19 9881 1 1 27 CYS CA C -10.359 1.352 -0.673 1.00 . A A . 27 CYS CA 1 1 19 9882 1 1 27 CYS CB C -9.254 2.090 -1.450 1.00 . A A . 27 CYS CB 1 1 19 9883 1 1 27 CYS H H -9.483 0.104 0.767 1.00 . A A . 27 CYS H 1 1 19 9884 1 1 27 CYS HA H -11.191 2.043 -0.614 1.00 . A A . 27 CYS HA 1 1 19 9885 1 1 27 CYS HB2 H -8.273 1.741 -1.129 1.00 . A A . 27 CYS HB2 1 1 19 9886 1 1 27 CYS HB3 H -9.369 1.865 -2.509 1.00 . A A . 27 CYS HB3 1 1 19 9887 1 1 27 CYS N N -9.948 0.995 0.682 1.00 . A A . 27 CYS N 1 1 19 9888 1 1 27 CYS O O -10.488 -1.009 -1.066 1.00 . A A . 27 CYS O 1 1 19 9889 1 1 27 CYS SG S -9.372 3.894 -1.255 1.00 . A A . 27 CYS SG 1 1 19 9890 1 1 28 LYS C C -12.884 -0.319 -4.374 1.00 . A A . 28 LYS C 1 1 19 9891 1 1 28 LYS CA C -12.618 -0.800 -2.953 1.00 . A A . 28 LYS CA 1 1 19 9892 1 1 28 LYS CB C -13.933 -1.184 -2.256 1.00 . A A . 28 LYS CB 1 1 19 9893 1 1 28 LYS CD C -13.329 -3.452 -1.192 1.00 . A A . 28 LYS CD 1 1 19 9894 1 1 28 LYS CE C -13.557 -4.251 0.095 1.00 . A A . 28 LYS CE 1 1 19 9895 1 1 28 LYS CG C -13.780 -2.003 -0.963 1.00 . A A . 28 LYS CG 1 1 19 9896 1 1 28 LYS H H -12.296 1.212 -2.330 1.00 . A A . 28 LYS H 1 1 19 9897 1 1 28 LYS HA H -11.990 -1.689 -3.005 1.00 . A A . 28 LYS HA 1 1 19 9898 1 1 28 LYS HB2 H -14.462 -0.262 -2.016 1.00 . A A . 28 LYS HB2 1 1 19 9899 1 1 28 LYS HB3 H -14.558 -1.750 -2.948 1.00 . A A . 28 LYS HB3 1 1 19 9900 1 1 28 LYS HD2 H -13.913 -3.893 -1.996 1.00 . A A . 28 LYS HD2 1 1 19 9901 1 1 28 LYS HD3 H -12.277 -3.478 -1.472 1.00 . A A . 28 LYS HD3 1 1 19 9902 1 1 28 LYS HE2 H -12.981 -3.804 0.910 1.00 . A A . 28 LYS HE2 1 1 19 9903 1 1 28 LYS HE3 H -14.616 -4.178 0.363 1.00 . A A . 28 LYS HE3 1 1 19 9904 1 1 28 LYS HG2 H -13.071 -1.517 -0.296 1.00 . A A . 28 LYS HG2 1 1 19 9905 1 1 28 LYS HG3 H -14.752 -2.018 -0.469 1.00 . A A . 28 LYS HG3 1 1 19 9906 1 1 28 LYS HZ1 H -12.200 -5.824 -0.167 1.00 . A A . 28 LYS HZ1 1 1 19 9907 1 1 28 LYS HZ2 H -13.659 -6.090 -0.869 1.00 . A A . 28 LYS HZ2 1 1 19 9908 1 1 28 LYS HZ3 H -13.537 -6.208 0.741 1.00 . A A . 28 LYS HZ3 1 1 19 9909 1 1 28 LYS N N -11.937 0.273 -2.207 1.00 . A A . 28 LYS N 1 1 19 9910 1 1 28 LYS NZ N -13.199 -5.678 -0.062 1.00 . A A . 28 LYS NZ 1 1 19 9911 1 1 28 LYS O O -13.347 0.809 -4.542 1.00 . A A . 28 LYS O 1 1 19 9912 1 1 29 LYS C C -14.093 -0.190 -7.128 1.00 . A A . 29 LYS C 1 1 19 9913 1 1 29 LYS CA C -12.686 -0.722 -6.808 1.00 . A A . 29 LYS CA 1 1 19 9914 1 1 29 LYS CB C -12.279 -1.855 -7.773 1.00 . A A . 29 LYS CB 1 1 19 9915 1 1 29 LYS CD C -10.420 -3.155 -8.909 1.00 . A A . 29 LYS CD 1 1 19 9916 1 1 29 LYS CE C -8.917 -3.272 -9.214 1.00 . A A . 29 LYS CE 1 1 19 9917 1 1 29 LYS CG C -10.771 -1.904 -8.086 1.00 . A A . 29 LYS CG 1 1 19 9918 1 1 29 LYS H H -12.166 -2.036 -5.176 1.00 . A A . 29 LYS H 1 1 19 9919 1 1 29 LYS HA H -11.998 0.103 -6.975 1.00 . A A . 29 LYS HA 1 1 19 9920 1 1 29 LYS HB2 H -12.610 -2.812 -7.367 1.00 . A A . 29 LYS HB2 1 1 19 9921 1 1 29 LYS HB3 H -12.793 -1.697 -8.722 1.00 . A A . 29 LYS HB3 1 1 19 9922 1 1 29 LYS HD2 H -10.731 -4.032 -8.346 1.00 . A A . 29 LYS HD2 1 1 19 9923 1 1 29 LYS HD3 H -10.977 -3.136 -9.848 1.00 . A A . 29 LYS HD3 1 1 19 9924 1 1 29 LYS HE2 H -8.612 -2.445 -9.864 1.00 . A A . 29 LYS HE2 1 1 19 9925 1 1 29 LYS HE3 H -8.357 -3.181 -8.279 1.00 . A A . 29 LYS HE3 1 1 19 9926 1 1 29 LYS HG2 H -10.494 -1.015 -8.650 1.00 . A A . 29 LYS HG2 1 1 19 9927 1 1 29 LYS HG3 H -10.207 -1.913 -7.157 1.00 . A A . 29 LYS HG3 1 1 19 9928 1 1 29 LYS HZ1 H -8.903 -5.347 -9.270 1.00 . A A . 29 LYS HZ1 1 1 19 9929 1 1 29 LYS HZ2 H -7.609 -4.693 -10.029 1.00 . A A . 29 LYS HZ2 1 1 19 9930 1 1 29 LYS HZ3 H -9.097 -4.679 -10.748 1.00 . A A . 29 LYS HZ3 1 1 19 9931 1 1 29 LYS N N -12.552 -1.125 -5.393 1.00 . A A . 29 LYS N 1 1 19 9932 1 1 29 LYS NZ N -8.607 -4.574 -9.861 1.00 . A A . 29 LYS NZ 1 1 19 9933 1 1 29 LYS O O -15.090 -0.871 -6.884 1.00 . A A . 29 LYS O 1 1 19 9934 1 1 30 LYS C C -14.965 2.711 -9.258 1.00 . A A . 30 LYS C 1 1 19 9935 1 1 30 LYS CA C -15.353 1.728 -8.147 1.00 . A A . 30 LYS CA 1 1 19 9936 1 1 30 LYS CB C -16.043 2.407 -6.945 1.00 . A A . 30 LYS CB 1 1 19 9937 1 1 30 LYS CD C -18.048 3.786 -6.223 1.00 . A A . 30 LYS CD 1 1 19 9938 1 1 30 LYS CE C -19.512 4.140 -6.506 1.00 . A A . 30 LYS CE 1 1 19 9939 1 1 30 LYS CG C -17.481 2.837 -7.286 1.00 . A A . 30 LYS CG 1 1 19 9940 1 1 30 LYS H H -13.268 1.495 -7.813 1.00 . A A . 30 LYS H 1 1 19 9941 1 1 30 LYS HA H -16.048 1.006 -8.576 1.00 . A A . 30 LYS HA 1 1 19 9942 1 1 30 LYS HB2 H -16.082 1.711 -6.107 1.00 . A A . 30 LYS HB2 1 1 19 9943 1 1 30 LYS HB3 H -15.455 3.270 -6.629 1.00 . A A . 30 LYS HB3 1 1 19 9944 1 1 30 LYS HD2 H -17.984 3.307 -5.246 1.00 . A A . 30 LYS HD2 1 1 19 9945 1 1 30 LYS HD3 H -17.448 4.696 -6.208 1.00 . A A . 30 LYS HD3 1 1 19 9946 1 1 30 LYS HE2 H -19.636 4.337 -7.576 1.00 . A A . 30 LYS HE2 1 1 19 9947 1 1 30 LYS HE3 H -20.134 3.282 -6.239 1.00 . A A . 30 LYS HE3 1 1 19 9948 1 1 30 LYS HG2 H -17.498 3.344 -8.249 1.00 . A A . 30 LYS HG2 1 1 19 9949 1 1 30 LYS HG3 H -18.110 1.949 -7.356 1.00 . A A . 30 LYS HG3 1 1 19 9950 1 1 30 LYS HZ1 H -19.565 5.332 -4.786 1.00 . A A . 30 LYS HZ1 1 1 19 9951 1 1 30 LYS HZ2 H -20.938 5.438 -5.686 1.00 . A A . 30 LYS HZ2 1 1 19 9952 1 1 30 LYS HZ3 H -19.594 6.179 -6.198 1.00 . A A . 30 LYS HZ3 1 1 19 9953 1 1 30 LYS N N -14.149 1.015 -7.699 1.00 . A A . 30 LYS N 1 1 19 9954 1 1 30 LYS NZ N -19.929 5.335 -5.735 1.00 . A A . 30 LYS NZ 1 1 19 9955 1 1 30 LYS O O -14.915 3.924 -9.055 1.00 . A A . 30 LYS O 1 1 19 9956 1 1 31 LEU C C -14.176 1.934 -12.790 1.00 . A A . 31 LEU C 1 1 19 9957 1 1 31 LEU CA C -14.169 2.902 -11.603 1.00 . A A . 31 LEU CA 1 1 19 9958 1 1 31 LEU CB C -12.811 3.632 -11.481 1.00 . A A . 31 LEU CB 1 1 19 9959 1 1 31 LEU CD1 C -11.613 5.836 -11.241 1.00 . A A . 31 LEU CD1 1 1 19 9960 1 1 31 LEU CD2 C -13.400 5.631 -12.929 1.00 . A A . 31 LEU CD2 1 1 19 9961 1 1 31 LEU CG C -12.949 5.164 -11.545 1.00 . A A . 31 LEU CG 1 1 19 9962 1 1 31 LEU H H -14.544 1.164 -10.450 1.00 . A A . 31 LEU H 1 1 19 9963 1 1 31 LEU HA H -14.961 3.632 -11.775 1.00 . A A . 31 LEU HA 1 1 19 9964 1 1 31 LEU HB2 H -12.345 3.371 -10.534 1.00 . A A . 31 LEU HB2 1 1 19 9965 1 1 31 LEU HB3 H -12.134 3.304 -12.273 1.00 . A A . 31 LEU HB3 1 1 19 9966 1 1 31 LEU HD11 H -11.758 6.915 -11.201 1.00 . A A . 31 LEU HD11 1 1 19 9967 1 1 31 LEU HD12 H -10.885 5.592 -12.014 1.00 . A A . 31 LEU HD12 1 1 19 9968 1 1 31 LEU HD13 H -11.234 5.491 -10.280 1.00 . A A . 31 LEU HD13 1 1 19 9969 1 1 31 LEU HD21 H -13.417 6.719 -12.956 1.00 . A A . 31 LEU HD21 1 1 19 9970 1 1 31 LEU HD22 H -14.408 5.284 -13.144 1.00 . A A . 31 LEU HD22 1 1 19 9971 1 1 31 LEU HD23 H -12.709 5.264 -13.687 1.00 . A A . 31 LEU HD23 1 1 19 9972 1 1 31 LEU HG H -13.678 5.496 -10.807 1.00 . A A . 31 LEU HG 1 1 19 9973 1 1 31 LEU N N -14.499 2.172 -10.376 1.00 . A A . 31 LEU N 1 1 19 9974 1 1 31 LEU O O -14.103 0.718 -12.613 1.00 . A A . 31 LEU O 1 1 19 9975 1 1 32 LEU C C -13.623 2.303 -16.256 1.00 . A A . 32 LEU C 1 1 19 9976 1 1 32 LEU CA C -14.520 1.674 -15.199 1.00 . A A . 32 LEU CA 1 1 19 9977 1 1 32 LEU CB C -15.985 1.802 -15.686 1.00 . A A . 32 LEU CB 1 1 19 9978 1 1 32 LEU CD1 C -17.510 1.929 -13.589 1.00 . A A . 32 LEU CD1 1 1 19 9979 1 1 32 LEU CD2 C -18.218 0.675 -15.576 1.00 . A A . 32 LEU CD2 1 1 19 9980 1 1 32 LEU CG C -16.982 1.070 -14.752 1.00 . A A . 32 LEU CG 1 1 19 9981 1 1 32 LEU H H -14.485 3.475 -14.040 1.00 . A A . 32 LEU H 1 1 19 9982 1 1 32 LEU HA H -14.241 0.636 -15.059 1.00 . A A . 32 LEU HA 1 1 19 9983 1 1 32 LEU HB2 H -16.271 2.846 -15.805 1.00 . A A . 32 LEU HB2 1 1 19 9984 1 1 32 LEU HB3 H -16.025 1.326 -16.663 1.00 . A A . 32 LEU HB3 1 1 19 9985 1 1 32 LEU HD11 H -18.344 1.428 -13.097 1.00 . A A . 32 LEU HD11 1 1 19 9986 1 1 32 LEU HD12 H -17.851 2.895 -13.960 1.00 . A A . 32 LEU HD12 1 1 19 9987 1 1 32 LEU HD13 H -16.747 2.093 -12.836 1.00 . A A . 32 LEU HD13 1 1 19 9988 1 1 32 LEU HD21 H -18.910 0.095 -14.964 1.00 . A A . 32 LEU HD21 1 1 19 9989 1 1 32 LEU HD22 H -17.936 0.075 -16.441 1.00 . A A . 32 LEU HD22 1 1 19 9990 1 1 32 LEU HD23 H -18.734 1.570 -15.928 1.00 . A A . 32 LEU HD23 1 1 19 9991 1 1 32 LEU HG H -16.520 0.164 -14.354 1.00 . A A . 32 LEU HG 1 1 19 9992 1 1 32 LEU N N -14.380 2.476 -13.982 1.00 . A A . 32 LEU N 1 1 19 9993 1 1 32 LEU O O -12.665 1.737 -16.715 1.00 . A A . 32 LEU O 1 1 19 9994 1 1 32 LEU OXT O -13.833 3.300 -16.549 1.00 . A A . 32 LEU OXT 1 1 20 9995 1 1 1 GLY C C 2.503 -3.611 -1.892 1.00 . A A . 1 GLY C 1 1 20 9996 1 1 1 GLY CA C 3.313 -4.616 -2.683 1.00 . A A . 1 GLY CA 1 1 20 9997 1 1 1 GLY H1 H 5.082 -3.594 -2.707 1.00 . A A . 1 GLY H1 1 1 20 9998 1 1 1 GLY H2 H 4.907 -4.568 -1.383 1.00 . A A . 1 GLY H2 1 1 20 9999 1 1 1 GLY H3 H 5.260 -5.217 -2.861 1.00 . A A . 1 GLY H3 1 1 20 10000 1 1 1 GLY HA2 H 3.167 -4.462 -3.751 1.00 . A A . 1 GLY HA2 1 1 20 10001 1 1 1 GLY HA3 H 2.974 -5.616 -2.422 1.00 . A A . 1 GLY HA3 1 1 20 10002 1 1 1 GLY N N 4.746 -4.490 -2.378 1.00 . A A . 1 GLY N 1 1 20 10003 1 1 1 GLY O O 2.668 -3.553 -0.677 1.00 . A A . 1 GLY O 1 1 20 10004 1 1 2 PRO C C -0.277 -2.212 -0.940 1.00 . A A . 2 PRO C 1 1 20 10005 1 1 2 PRO CA C 0.881 -1.753 -1.847 1.00 . A A . 2 PRO CA 1 1 20 10006 1 1 2 PRO CB C 0.411 -0.853 -2.990 1.00 . A A . 2 PRO CB 1 1 20 10007 1 1 2 PRO CD C 1.348 -2.820 -3.957 1.00 . A A . 2 PRO CD 1 1 20 10008 1 1 2 PRO CG C 0.222 -1.810 -4.167 1.00 . A A . 2 PRO CG 1 1 20 10009 1 1 2 PRO HA H 1.583 -1.191 -1.229 1.00 . A A . 2 PRO HA 1 1 20 10010 1 1 2 PRO HB2 H -0.508 -0.320 -2.755 1.00 . A A . 2 PRO HB2 1 1 20 10011 1 1 2 PRO HB3 H 1.209 -0.148 -3.222 1.00 . A A . 2 PRO HB3 1 1 20 10012 1 1 2 PRO HD2 H 1.053 -3.802 -4.331 1.00 . A A . 2 PRO HD2 1 1 20 10013 1 1 2 PRO HD3 H 2.247 -2.476 -4.474 1.00 . A A . 2 PRO HD3 1 1 20 10014 1 1 2 PRO HG2 H -0.744 -2.310 -4.085 1.00 . A A . 2 PRO HG2 1 1 20 10015 1 1 2 PRO HG3 H 0.310 -1.299 -5.125 1.00 . A A . 2 PRO HG3 1 1 20 10016 1 1 2 PRO N N 1.594 -2.844 -2.521 1.00 . A A . 2 PRO N 1 1 20 10017 1 1 2 PRO O O -0.619 -1.520 0.024 1.00 . A A . 2 PRO O 1 1 20 10018 1 1 3 TYR C C -2.966 -3.343 0.310 1.00 . A A . 3 TYR C 1 1 20 10019 1 1 3 TYR CA C -1.788 -4.097 -0.333 1.00 . A A . 3 TYR CA 1 1 20 10020 1 1 3 TYR CB C -1.022 -5.062 0.585 1.00 . A A . 3 TYR CB 1 1 20 10021 1 1 3 TYR CD1 C 0.816 -6.500 -0.420 1.00 . A A . 3 TYR CD1 1 1 20 10022 1 1 3 TYR CD2 C -1.487 -7.298 -0.491 1.00 . A A . 3 TYR CD2 1 1 20 10023 1 1 3 TYR CE1 C 1.246 -7.696 -1.027 1.00 . A A . 3 TYR CE1 1 1 20 10024 1 1 3 TYR CE2 C -1.063 -8.486 -1.114 1.00 . A A . 3 TYR CE2 1 1 20 10025 1 1 3 TYR CG C -0.550 -6.311 -0.133 1.00 . A A . 3 TYR CG 1 1 20 10026 1 1 3 TYR CZ C 0.307 -8.699 -1.365 1.00 . A A . 3 TYR CZ 1 1 20 10027 1 1 3 TYR H H -0.543 -3.872 -2.043 1.00 . A A . 3 TYR H 1 1 20 10028 1 1 3 TYR HA H -2.323 -4.766 -1.006 1.00 . A A . 3 TYR HA 1 1 20 10029 1 1 3 TYR HB2 H -0.179 -4.542 1.043 1.00 . A A . 3 TYR HB2 1 1 20 10030 1 1 3 TYR HB3 H -1.674 -5.395 1.394 1.00 . A A . 3 TYR HB3 1 1 20 10031 1 1 3 TYR HD1 H 1.538 -5.748 -0.131 1.00 . A A . 3 TYR HD1 1 1 20 10032 1 1 3 TYR HD2 H -2.535 -7.171 -0.252 1.00 . A A . 3 TYR HD2 1 1 20 10033 1 1 3 TYR HE1 H 2.296 -7.864 -1.219 1.00 . A A . 3 TYR HE1 1 1 20 10034 1 1 3 TYR HE2 H -1.776 -9.261 -1.355 1.00 . A A . 3 TYR HE2 1 1 20 10035 1 1 3 TYR HH H 1.649 -10.048 -1.604 1.00 . A A . 3 TYR HH 1 1 20 10036 1 1 3 TYR N N -0.881 -3.372 -1.234 1.00 . A A . 3 TYR N 1 1 20 10037 1 1 3 TYR O O -3.168 -3.398 1.523 1.00 . A A . 3 TYR O 1 1 20 10038 1 1 3 TYR OH O 0.720 -9.903 -1.842 1.00 . A A . 3 TYR OH 1 1 20 10039 1 1 4 CYS C C -6.015 -1.520 -0.721 1.00 . A A . 4 CYS C 1 1 20 10040 1 1 4 CYS CA C -4.655 -1.571 0.006 1.00 . A A . 4 CYS CA 1 1 20 10041 1 1 4 CYS CB C -3.948 -0.210 0.032 1.00 . A A . 4 CYS CB 1 1 20 10042 1 1 4 CYS H H -3.363 -2.446 -1.438 1.00 . A A . 4 CYS H 1 1 20 10043 1 1 4 CYS HA H -4.913 -1.831 1.032 1.00 . A A . 4 CYS HA 1 1 20 10044 1 1 4 CYS HB2 H -4.702 0.551 0.193 1.00 . A A . 4 CYS HB2 1 1 20 10045 1 1 4 CYS HB3 H -3.283 -0.187 0.889 1.00 . A A . 4 CYS HB3 1 1 20 10046 1 1 4 CYS N N -3.690 -2.559 -0.492 1.00 . A A . 4 CYS N 1 1 20 10047 1 1 4 CYS O O -6.943 -0.856 -0.262 1.00 . A A . 4 CYS O 1 1 20 10048 1 1 4 CYS SG S -2.971 0.288 -1.415 1.00 . A A . 4 CYS SG 1 1 20 10049 1 1 5 GLN C C -7.971 -3.732 -2.532 1.00 . A A . 5 GLN C 1 1 20 10050 1 1 5 GLN CA C -7.352 -2.336 -2.664 1.00 . A A . 5 GLN CA 1 1 20 10051 1 1 5 GLN CB C -6.959 -1.994 -4.113 1.00 . A A . 5 GLN CB 1 1 20 10052 1 1 5 GLN CD C -7.579 -3.369 -6.174 1.00 . A A . 5 GLN CD 1 1 20 10053 1 1 5 GLN CG C -8.025 -2.305 -5.176 1.00 . A A . 5 GLN CG 1 1 20 10054 1 1 5 GLN H H -5.295 -2.648 -2.202 1.00 . A A . 5 GLN H 1 1 20 10055 1 1 5 GLN HA H -8.099 -1.613 -2.330 1.00 . A A . 5 GLN HA 1 1 20 10056 1 1 5 GLN HB2 H -6.743 -0.931 -4.156 1.00 . A A . 5 GLN HB2 1 1 20 10057 1 1 5 GLN HB3 H -6.037 -2.522 -4.364 1.00 . A A . 5 GLN HB3 1 1 20 10058 1 1 5 GLN HE21 H -6.110 -2.188 -6.994 1.00 . A A . 5 GLN HE21 1 1 20 10059 1 1 5 GLN HE22 H -6.208 -3.857 -7.548 1.00 . A A . 5 GLN HE22 1 1 20 10060 1 1 5 GLN HG2 H -8.935 -2.637 -4.691 1.00 . A A . 5 GLN HG2 1 1 20 10061 1 1 5 GLN HG3 H -8.268 -1.395 -5.720 1.00 . A A . 5 GLN HG3 1 1 20 10062 1 1 5 GLN N N -6.136 -2.228 -1.847 1.00 . A A . 5 GLN N 1 1 20 10063 1 1 5 GLN NE2 N -6.560 -3.109 -6.960 1.00 . A A . 5 GLN NE2 1 1 20 10064 1 1 5 GLN O O -9.163 -3.895 -2.266 1.00 . A A . 5 GLN O 1 1 20 10065 1 1 5 GLN OE1 O -7.959 -4.535 -6.068 1.00 . A A . 5 GLN OE1 1 1 20 10066 1 1 6 LYS C C -7.353 -6.579 -0.950 1.00 . A A . 6 LYS C 1 1 20 10067 1 1 6 LYS CA C -7.455 -6.163 -2.425 1.00 . A A . 6 LYS CA 1 1 20 10068 1 1 6 LYS CB C -6.591 -7.041 -3.349 1.00 . A A . 6 LYS CB 1 1 20 10069 1 1 6 LYS CD C -6.678 -8.986 -5.030 1.00 . A A . 6 LYS CD 1 1 20 10070 1 1 6 LYS CE C -6.046 -8.153 -6.156 1.00 . A A . 6 LYS CE 1 1 20 10071 1 1 6 LYS CG C -7.437 -8.164 -3.976 1.00 . A A . 6 LYS CG 1 1 20 10072 1 1 6 LYS H H -6.168 -4.538 -2.912 1.00 . A A . 6 LYS H 1 1 20 10073 1 1 6 LYS HA H -8.496 -6.302 -2.704 1.00 . A A . 6 LYS HA 1 1 20 10074 1 1 6 LYS HB2 H -6.186 -6.421 -4.149 1.00 . A A . 6 LYS HB2 1 1 20 10075 1 1 6 LYS HB3 H -5.754 -7.471 -2.794 1.00 . A A . 6 LYS HB3 1 1 20 10076 1 1 6 LYS HD2 H -5.890 -9.552 -4.532 1.00 . A A . 6 LYS HD2 1 1 20 10077 1 1 6 LYS HD3 H -7.368 -9.706 -5.473 1.00 . A A . 6 LYS HD3 1 1 20 10078 1 1 6 LYS HE2 H -5.243 -7.542 -5.739 1.00 . A A . 6 LYS HE2 1 1 20 10079 1 1 6 LYS HE3 H -5.591 -8.842 -6.874 1.00 . A A . 6 LYS HE3 1 1 20 10080 1 1 6 LYS HG2 H -7.778 -8.839 -3.190 1.00 . A A . 6 LYS HG2 1 1 20 10081 1 1 6 LYS HG3 H -8.319 -7.728 -4.448 1.00 . A A . 6 LYS HG3 1 1 20 10082 1 1 6 LYS HZ1 H -6.582 -6.756 -7.589 1.00 . A A . 6 LYS HZ1 1 1 20 10083 1 1 6 LYS HZ2 H -7.479 -6.614 -6.255 1.00 . A A . 6 LYS HZ2 1 1 20 10084 1 1 6 LYS HZ3 H -7.736 -7.860 -7.329 1.00 . A A . 6 LYS HZ3 1 1 20 10085 1 1 6 LYS N N -7.116 -4.754 -2.648 1.00 . A A . 6 LYS N 1 1 20 10086 1 1 6 LYS NZ N -7.031 -7.294 -6.854 1.00 . A A . 6 LYS NZ 1 1 20 10087 1 1 6 LYS O O -7.656 -7.723 -0.642 1.00 . A A . 6 LYS O 1 1 20 10088 1 1 7 TRP C C -7.065 -4.605 2.149 1.00 . A A . 7 TRP C 1 1 20 10089 1 1 7 TRP CA C -6.767 -5.901 1.378 1.00 . A A . 7 TRP CA 1 1 20 10090 1 1 7 TRP CB C -5.313 -6.356 1.550 1.00 . A A . 7 TRP CB 1 1 20 10091 1 1 7 TRP CD1 C -4.424 -6.058 3.910 1.00 . A A . 7 TRP CD1 1 1 20 10092 1 1 7 TRP CD2 C -5.141 -8.144 3.509 1.00 . A A . 7 TRP CD2 1 1 20 10093 1 1 7 TRP CE2 C -4.635 -8.133 4.842 1.00 . A A . 7 TRP CE2 1 1 20 10094 1 1 7 TRP CE3 C -5.670 -9.364 3.032 1.00 . A A . 7 TRP CE3 1 1 20 10095 1 1 7 TRP CG C -4.912 -6.830 2.912 1.00 . A A . 7 TRP CG 1 1 20 10096 1 1 7 TRP CH2 C -5.127 -10.487 5.135 1.00 . A A . 7 TRP CH2 1 1 20 10097 1 1 7 TRP CZ2 C -4.632 -9.278 5.652 1.00 . A A . 7 TRP CZ2 1 1 20 10098 1 1 7 TRP CZ3 C -5.641 -10.527 3.826 1.00 . A A . 7 TRP CZ3 1 1 20 10099 1 1 7 TRP H H -6.896 -4.709 -0.357 1.00 . A A . 7 TRP H 1 1 20 10100 1 1 7 TRP HA H -7.434 -6.689 1.735 1.00 . A A . 7 TRP HA 1 1 20 10101 1 1 7 TRP HB2 H -5.129 -7.182 0.862 1.00 . A A . 7 TRP HB2 1 1 20 10102 1 1 7 TRP HB3 H -4.652 -5.544 1.250 1.00 . A A . 7 TRP HB3 1 1 20 10103 1 1 7 TRP HD1 H -4.185 -5.003 3.818 1.00 . A A . 7 TRP HD1 1 1 20 10104 1 1 7 TRP HE1 H -3.842 -6.465 5.908 1.00 . A A . 7 TRP HE1 1 1 20 10105 1 1 7 TRP HE3 H -6.076 -9.410 2.030 1.00 . A A . 7 TRP HE3 1 1 20 10106 1 1 7 TRP HH2 H -5.117 -11.384 5.742 1.00 . A A . 7 TRP HH2 1 1 20 10107 1 1 7 TRP HZ2 H -4.248 -9.232 6.660 1.00 . A A . 7 TRP HZ2 1 1 20 10108 1 1 7 TRP HZ3 H -6.009 -11.465 3.428 1.00 . A A . 7 TRP HZ3 1 1 20 10109 1 1 7 TRP N N -6.998 -5.662 -0.049 1.00 . A A . 7 TRP N 1 1 20 10110 1 1 7 TRP NE1 N -4.226 -6.832 5.038 1.00 . A A . 7 TRP NE1 1 1 20 10111 1 1 7 TRP O O -6.900 -3.511 1.605 1.00 . A A . 7 TRP O 1 1 20 10112 1 1 8 MET C C -7.367 -2.610 4.740 1.00 . A A . 8 MET C 1 1 20 10113 1 1 8 MET CA C -8.308 -3.595 4.022 1.00 . A A . 8 MET CA 1 1 20 10114 1 1 8 MET CB C -9.406 -4.142 4.947 1.00 . A A . 8 MET CB 1 1 20 10115 1 1 8 MET CE C -11.914 -7.238 4.232 1.00 . A A . 8 MET CE 1 1 20 10116 1 1 8 MET CG C -10.451 -4.940 4.159 1.00 . A A . 8 MET CG 1 1 20 10117 1 1 8 MET H H -7.658 -5.623 3.794 1.00 . A A . 8 MET H 1 1 20 10118 1 1 8 MET HA H -8.818 -3.028 3.243 1.00 . A A . 8 MET HA 1 1 20 10119 1 1 8 MET HB2 H -8.960 -4.793 5.697 1.00 . A A . 8 MET HB2 1 1 20 10120 1 1 8 MET HB3 H -9.905 -3.313 5.450 1.00 . A A . 8 MET HB3 1 1 20 10121 1 1 8 MET HE1 H -12.642 -7.897 4.694 1.00 . A A . 8 MET HE1 1 1 20 10122 1 1 8 MET HE2 H -12.254 -6.995 3.230 1.00 . A A . 8 MET HE2 1 1 20 10123 1 1 8 MET HE3 H -10.957 -7.758 4.177 1.00 . A A . 8 MET HE3 1 1 20 10124 1 1 8 MET HG2 H -10.927 -4.295 3.422 1.00 . A A . 8 MET HG2 1 1 20 10125 1 1 8 MET HG3 H -9.939 -5.737 3.618 1.00 . A A . 8 MET HG3 1 1 20 10126 1 1 8 MET N N -7.603 -4.708 3.367 1.00 . A A . 8 MET N 1 1 20 10127 1 1 8 MET O O -7.022 -2.788 5.911 1.00 . A A . 8 MET O 1 1 20 10128 1 1 8 MET SD S -11.731 -5.706 5.182 1.00 . A A . 8 MET SD 1 1 20 10129 1 1 9 GLN C C -6.372 0.385 5.674 1.00 . A A . 9 GLN C 1 1 20 10130 1 1 9 GLN CA C -5.982 -0.556 4.513 1.00 . A A . 9 GLN CA 1 1 20 10131 1 1 9 GLN CB C -5.476 0.280 3.320 1.00 . A A . 9 GLN CB 1 1 20 10132 1 1 9 GLN CD C -6.000 2.168 1.619 1.00 . A A . 9 GLN CD 1 1 20 10133 1 1 9 GLN CG C -6.544 1.173 2.651 1.00 . A A . 9 GLN CG 1 1 20 10134 1 1 9 GLN H H -7.260 -1.496 3.077 1.00 . A A . 9 GLN H 1 1 20 10135 1 1 9 GLN HA H -5.130 -1.130 4.879 1.00 . A A . 9 GLN HA 1 1 20 10136 1 1 9 GLN HB2 H -4.659 0.904 3.680 1.00 . A A . 9 GLN HB2 1 1 20 10137 1 1 9 GLN HB3 H -5.061 -0.394 2.579 1.00 . A A . 9 GLN HB3 1 1 20 10138 1 1 9 GLN HE21 H -4.094 2.243 2.357 1.00 . A A . 9 GLN HE21 1 1 20 10139 1 1 9 GLN HE22 H -4.513 3.384 1.084 1.00 . A A . 9 GLN HE22 1 1 20 10140 1 1 9 GLN HG2 H -7.281 0.539 2.161 1.00 . A A . 9 GLN HG2 1 1 20 10141 1 1 9 GLN HG3 H -7.052 1.755 3.418 1.00 . A A . 9 GLN HG3 1 1 20 10142 1 1 9 GLN N N -6.989 -1.528 4.051 1.00 . A A . 9 GLN N 1 1 20 10143 1 1 9 GLN NE2 N -4.779 2.646 1.733 1.00 . A A . 9 GLN NE2 1 1 20 10144 1 1 9 GLN O O -5.526 1.166 6.092 1.00 . A A . 9 GLN O 1 1 20 10145 1 1 9 GLN OE1 O -6.701 2.594 0.713 1.00 . A A . 9 GLN OE1 1 1 20 10146 1 1 10 THR C C -7.943 2.866 6.512 1.00 . A A . 10 THR C 1 1 20 10147 1 1 10 THR CA C -8.105 1.449 7.098 1.00 . A A . 10 THR CA 1 1 20 10148 1 1 10 THR CB C -7.479 1.346 8.499 1.00 . A A . 10 THR CB 1 1 20 10149 1 1 10 THR CG2 C -8.275 2.170 9.505 1.00 . A A . 10 THR CG2 1 1 20 10150 1 1 10 THR H H -8.290 -0.254 5.810 1.00 . A A . 10 THR H 1 1 20 10151 1 1 10 THR HA H -9.174 1.285 7.233 1.00 . A A . 10 THR HA 1 1 20 10152 1 1 10 THR HB H -6.449 1.702 8.476 1.00 . A A . 10 THR HB 1 1 20 10153 1 1 10 THR HG1 H -7.973 -0.552 8.362 1.00 . A A . 10 THR HG1 1 1 20 10154 1 1 10 THR HG21 H -8.355 3.199 9.169 1.00 . A A . 10 THR HG21 1 1 20 10155 1 1 10 THR HG22 H -7.751 2.166 10.459 1.00 . A A . 10 THR HG22 1 1 20 10156 1 1 10 THR HG23 H -9.280 1.766 9.625 1.00 . A A . 10 THR HG23 1 1 20 10157 1 1 10 THR N N -7.610 0.398 6.178 1.00 . A A . 10 THR N 1 1 20 10158 1 1 10 THR O O -7.000 3.599 6.822 1.00 . A A . 10 THR O 1 1 20 10159 1 1 10 THR OG1 O -7.484 0.020 8.988 1.00 . A A . 10 THR OG1 1 1 20 10160 1 1 11 CYS C C -9.294 5.727 5.645 1.00 . A A . 11 CYS C 1 1 20 10161 1 1 11 CYS CA C -8.789 4.497 4.855 1.00 . A A . 11 CYS CA 1 1 20 10162 1 1 11 CYS CB C -9.437 4.293 3.475 1.00 . A A . 11 CYS CB 1 1 20 10163 1 1 11 CYS H H -9.585 2.585 5.391 1.00 . A A . 11 CYS H 1 1 20 10164 1 1 11 CYS HA H -7.732 4.690 4.659 1.00 . A A . 11 CYS HA 1 1 20 10165 1 1 11 CYS HB2 H -9.212 3.284 3.133 1.00 . A A . 11 CYS HB2 1 1 20 10166 1 1 11 CYS HB3 H -10.521 4.397 3.546 1.00 . A A . 11 CYS HB3 1 1 20 10167 1 1 11 CYS N N -8.857 3.246 5.617 1.00 . A A . 11 CYS N 1 1 20 10168 1 1 11 CYS O O -10.316 6.332 5.312 1.00 . A A . 11 CYS O 1 1 20 10169 1 1 11 CYS SG S -8.796 5.422 2.210 1.00 . A A . 11 CYS SG 1 1 20 10170 1 1 12 ASP C C -8.360 8.558 6.217 1.00 . A A . 12 ASP C 1 1 20 10171 1 1 12 ASP CA C -8.617 7.464 7.268 1.00 . A A . 12 ASP CA 1 1 20 10172 1 1 12 ASP CB C -7.597 7.632 8.412 1.00 . A A . 12 ASP CB 1 1 20 10173 1 1 12 ASP CG C -7.863 6.816 9.680 1.00 . A A . 12 ASP CG 1 1 20 10174 1 1 12 ASP H H -7.786 5.523 6.965 1.00 . A A . 12 ASP H 1 1 20 10175 1 1 12 ASP HA H -9.618 7.619 7.675 1.00 . A A . 12 ASP HA 1 1 20 10176 1 1 12 ASP HB2 H -6.603 7.380 8.038 1.00 . A A . 12 ASP HB2 1 1 20 10177 1 1 12 ASP HB3 H -7.581 8.687 8.694 1.00 . A A . 12 ASP HB3 1 1 20 10178 1 1 12 ASP N N -8.556 6.117 6.688 1.00 . A A . 12 ASP N 1 1 20 10179 1 1 12 ASP O O -7.549 8.346 5.318 1.00 . A A . 12 ASP O 1 1 20 10180 1 1 12 ASP OD1 O -7.715 7.386 10.784 1.00 . A A . 12 ASP OD1 1 1 20 10181 1 1 12 ASP OD2 O -8.250 5.632 9.623 1.00 . A A . 12 ASP OD2 1 1 20 10182 1 1 13 SER C C -7.262 11.406 5.297 1.00 . A A . 13 SER C 1 1 20 10183 1 1 13 SER CA C -8.707 10.878 5.416 1.00 . A A . 13 SER CA 1 1 20 10184 1 1 13 SER CB C -9.636 12.047 5.741 1.00 . A A . 13 SER CB 1 1 20 10185 1 1 13 SER H H -9.597 9.896 7.112 1.00 . A A . 13 SER H 1 1 20 10186 1 1 13 SER HA H -8.981 10.510 4.427 1.00 . A A . 13 SER HA 1 1 20 10187 1 1 13 SER HB2 H -9.612 12.755 4.912 1.00 . A A . 13 SER HB2 1 1 20 10188 1 1 13 SER HB3 H -10.653 11.678 5.841 1.00 . A A . 13 SER HB3 1 1 20 10189 1 1 13 SER HG H -9.391 12.153 7.705 1.00 . A A . 13 SER HG 1 1 20 10190 1 1 13 SER N N -8.919 9.766 6.373 1.00 . A A . 13 SER N 1 1 20 10191 1 1 13 SER O O -6.991 12.274 4.466 1.00 . A A . 13 SER O 1 1 20 10192 1 1 13 SER OG O -9.235 12.720 6.923 1.00 . A A . 13 SER OG 1 1 20 10193 1 1 14 GLU C C -4.152 10.070 5.138 1.00 . A A . 14 GLU C 1 1 20 10194 1 1 14 GLU CA C -4.891 11.128 5.986 1.00 . A A . 14 GLU CA 1 1 20 10195 1 1 14 GLU CB C -4.270 11.242 7.390 1.00 . A A . 14 GLU CB 1 1 20 10196 1 1 14 GLU CD C -3.616 10.085 9.582 1.00 . A A . 14 GLU CD 1 1 20 10197 1 1 14 GLU CG C -4.481 10.023 8.311 1.00 . A A . 14 GLU CG 1 1 20 10198 1 1 14 GLU H H -6.636 10.212 6.781 1.00 . A A . 14 GLU H 1 1 20 10199 1 1 14 GLU HA H -4.731 12.084 5.485 1.00 . A A . 14 GLU HA 1 1 20 10200 1 1 14 GLU HB2 H -3.203 11.408 7.259 1.00 . A A . 14 GLU HB2 1 1 20 10201 1 1 14 GLU HB3 H -4.680 12.124 7.883 1.00 . A A . 14 GLU HB3 1 1 20 10202 1 1 14 GLU HG2 H -5.534 9.960 8.586 1.00 . A A . 14 GLU HG2 1 1 20 10203 1 1 14 GLU HG3 H -4.224 9.115 7.763 1.00 . A A . 14 GLU HG3 1 1 20 10204 1 1 14 GLU N N -6.333 10.898 6.110 1.00 . A A . 14 GLU N 1 1 20 10205 1 1 14 GLU O O -2.960 10.242 4.872 1.00 . A A . 14 GLU O 1 1 20 10206 1 1 14 GLU OE1 O -2.583 10.796 9.596 1.00 . A A . 14 GLU OE1 1 1 20 10207 1 1 14 GLU OE2 O -3.937 9.399 10.584 1.00 . A A . 14 GLU OE2 1 1 20 10208 1 1 15 ARG C C -4.276 7.894 2.553 1.00 . A A . 15 ARG C 1 1 20 10209 1 1 15 ARG CA C -4.148 7.823 4.080 1.00 . A A . 15 ARG CA 1 1 20 10210 1 1 15 ARG CB C -4.672 6.488 4.655 1.00 . A A . 15 ARG CB 1 1 20 10211 1 1 15 ARG CD C -4.204 4.040 4.982 1.00 . A A . 15 ARG CD 1 1 20 10212 1 1 15 ARG CG C -3.780 5.310 4.218 1.00 . A A . 15 ARG CG 1 1 20 10213 1 1 15 ARG CZ C -2.510 2.463 5.862 1.00 . A A . 15 ARG CZ 1 1 20 10214 1 1 15 ARG H H -5.792 8.880 4.963 1.00 . A A . 15 ARG H 1 1 20 10215 1 1 15 ARG HA H -3.083 7.879 4.311 1.00 . A A . 15 ARG HA 1 1 20 10216 1 1 15 ARG HB2 H -4.662 6.554 5.745 1.00 . A A . 15 ARG HB2 1 1 20 10217 1 1 15 ARG HB3 H -5.700 6.320 4.326 1.00 . A A . 15 ARG HB3 1 1 20 10218 1 1 15 ARG HD2 H -4.359 4.292 6.024 1.00 . A A . 15 ARG HD2 1 1 20 10219 1 1 15 ARG HD3 H -5.084 3.613 4.518 1.00 . A A . 15 ARG HD3 1 1 20 10220 1 1 15 ARG HE H -2.589 3.028 3.957 1.00 . A A . 15 ARG HE 1 1 20 10221 1 1 15 ARG HG2 H -3.869 5.136 3.149 1.00 . A A . 15 ARG HG2 1 1 20 10222 1 1 15 ARG HG3 H -2.743 5.552 4.446 1.00 . A A . 15 ARG HG3 1 1 20 10223 1 1 15 ARG HH11 H -4.159 2.293 6.943 1.00 . A A . 15 ARG HH11 1 1 20 10224 1 1 15 ARG HH12 H -2.671 1.839 7.760 1.00 . A A . 15 ARG HH12 1 1 20 10225 1 1 15 ARG HH21 H -0.727 2.120 4.967 1.00 . A A . 15 ARG HH21 1 1 20 10226 1 1 15 ARG HH22 H -0.969 1.427 6.564 1.00 . A A . 15 ARG HH22 1 1 20 10227 1 1 15 ARG N N -4.798 8.955 4.761 1.00 . A A . 15 ARG N 1 1 20 10228 1 1 15 ARG NE N -3.054 3.119 4.850 1.00 . A A . 15 ARG NE 1 1 20 10229 1 1 15 ARG NH1 N -3.150 2.229 6.963 1.00 . A A . 15 ARG NH1 1 1 20 10230 1 1 15 ARG NH2 N -1.297 2.005 5.795 1.00 . A A . 15 ARG NH2 1 1 20 10231 1 1 15 ARG O O -5.355 8.145 2.012 1.00 . A A . 15 ARG O 1 1 20 10232 1 1 16 LYS C C -4.270 6.135 0.029 1.00 . A A . 16 LYS C 1 1 20 10233 1 1 16 LYS CA C -3.155 7.120 0.439 1.00 . A A . 16 LYS CA 1 1 20 10234 1 1 16 LYS CB C -1.754 6.548 0.121 1.00 . A A . 16 LYS CB 1 1 20 10235 1 1 16 LYS CD C -0.448 4.345 0.392 1.00 . A A . 16 LYS CD 1 1 20 10236 1 1 16 LYS CE C 0.981 4.803 0.089 1.00 . A A . 16 LYS CE 1 1 20 10237 1 1 16 LYS CG C -1.278 5.431 1.083 1.00 . A A . 16 LYS CG 1 1 20 10238 1 1 16 LYS H H -2.336 7.419 2.392 1.00 . A A . 16 LYS H 1 1 20 10239 1 1 16 LYS HA H -3.281 8.020 -0.164 1.00 . A A . 16 LYS HA 1 1 20 10240 1 1 16 LYS HB2 H -1.772 6.171 -0.903 1.00 . A A . 16 LYS HB2 1 1 20 10241 1 1 16 LYS HB3 H -1.025 7.360 0.153 1.00 . A A . 16 LYS HB3 1 1 20 10242 1 1 16 LYS HD2 H -0.400 3.484 1.059 1.00 . A A . 16 LYS HD2 1 1 20 10243 1 1 16 LYS HD3 H -0.949 4.033 -0.526 1.00 . A A . 16 LYS HD3 1 1 20 10244 1 1 16 LYS HE2 H 0.961 5.706 -0.528 1.00 . A A . 16 LYS HE2 1 1 20 10245 1 1 16 LYS HE3 H 1.471 5.055 1.033 1.00 . A A . 16 LYS HE3 1 1 20 10246 1 1 16 LYS HG2 H -0.707 5.866 1.902 1.00 . A A . 16 LYS HG2 1 1 20 10247 1 1 16 LYS HG3 H -2.129 4.932 1.539 1.00 . A A . 16 LYS HG3 1 1 20 10248 1 1 16 LYS HZ1 H 2.733 3.786 -0.432 1.00 . A A . 16 LYS HZ1 1 1 20 10249 1 1 16 LYS HZ2 H 1.636 3.815 -1.615 1.00 . A A . 16 LYS HZ2 1 1 20 10250 1 1 16 LYS HZ3 H 1.381 2.812 -0.348 1.00 . A A . 16 LYS HZ3 1 1 20 10251 1 1 16 LYS N N -3.201 7.489 1.866 1.00 . A A . 16 LYS N 1 1 20 10252 1 1 16 LYS NZ N 1.729 3.730 -0.601 1.00 . A A . 16 LYS NZ 1 1 20 10253 1 1 16 LYS O O -4.133 4.925 0.205 1.00 . A A . 16 LYS O 1 1 20 10254 1 1 17 CYS C C -5.909 4.920 -2.222 1.00 . A A . 17 CYS C 1 1 20 10255 1 1 17 CYS CA C -6.432 5.742 -1.037 1.00 . A A . 17 CYS CA 1 1 20 10256 1 1 17 CYS CB C -7.670 6.556 -1.407 1.00 . A A . 17 CYS CB 1 1 20 10257 1 1 17 CYS H H -5.462 7.625 -0.648 1.00 . A A . 17 CYS H 1 1 20 10258 1 1 17 CYS HA H -6.712 5.055 -0.236 1.00 . A A . 17 CYS HA 1 1 20 10259 1 1 17 CYS HB2 H -8.052 7.024 -0.498 1.00 . A A . 17 CYS HB2 1 1 20 10260 1 1 17 CYS HB3 H -7.375 7.349 -2.095 1.00 . A A . 17 CYS HB3 1 1 20 10261 1 1 17 CYS N N -5.370 6.624 -0.545 1.00 . A A . 17 CYS N 1 1 20 10262 1 1 17 CYS O O -5.463 5.486 -3.222 1.00 . A A . 17 CYS O 1 1 20 10263 1 1 17 CYS SG S -9.020 5.615 -2.178 1.00 . A A . 17 CYS SG 1 1 20 10264 1 1 18 CYS C C -5.049 2.921 -4.387 1.00 . A A . 18 CYS C 1 1 20 10265 1 1 18 CYS CA C -5.072 2.689 -2.867 1.00 . A A . 18 CYS CA 1 1 20 10266 1 1 18 CYS CB C -5.517 1.257 -2.599 1.00 . A A . 18 CYS CB 1 1 20 10267 1 1 18 CYS H H -6.305 3.233 -1.217 1.00 . A A . 18 CYS H 1 1 20 10268 1 1 18 CYS HA H -4.052 2.814 -2.498 1.00 . A A . 18 CYS HA 1 1 20 10269 1 1 18 CYS HB2 H -5.792 1.161 -1.550 1.00 . A A . 18 CYS HB2 1 1 20 10270 1 1 18 CYS HB3 H -6.407 1.037 -3.187 1.00 . A A . 18 CYS HB3 1 1 20 10271 1 1 18 CYS N N -5.937 3.591 -2.096 1.00 . A A . 18 CYS N 1 1 20 10272 1 1 18 CYS O O -3.978 3.102 -4.965 1.00 . A A . 18 CYS O 1 1 20 10273 1 1 18 CYS SG S -4.233 0.041 -2.980 1.00 . A A . 18 CYS SG 1 1 20 10274 1 1 19 GLU C C -7.201 4.686 -6.587 1.00 . A A . 19 GLU C 1 1 20 10275 1 1 19 GLU CA C -6.448 3.346 -6.418 1.00 . A A . 19 GLU CA 1 1 20 10276 1 1 19 GLU CB C -7.210 2.199 -7.113 1.00 . A A . 19 GLU CB 1 1 20 10277 1 1 19 GLU CD C -5.378 0.393 -7.456 1.00 . A A . 19 GLU CD 1 1 20 10278 1 1 19 GLU CG C -6.733 0.765 -6.847 1.00 . A A . 19 GLU CG 1 1 20 10279 1 1 19 GLU H H -7.052 2.891 -4.426 1.00 . A A . 19 GLU H 1 1 20 10280 1 1 19 GLU HA H -5.483 3.463 -6.912 1.00 . A A . 19 GLU HA 1 1 20 10281 1 1 19 GLU HB2 H -8.246 2.243 -6.779 1.00 . A A . 19 GLU HB2 1 1 20 10282 1 1 19 GLU HB3 H -7.196 2.370 -8.189 1.00 . A A . 19 GLU HB3 1 1 20 10283 1 1 19 GLU HG2 H -6.712 0.585 -5.774 1.00 . A A . 19 GLU HG2 1 1 20 10284 1 1 19 GLU HG3 H -7.482 0.095 -7.275 1.00 . A A . 19 GLU HG3 1 1 20 10285 1 1 19 GLU N N -6.234 3.029 -4.996 1.00 . A A . 19 GLU N 1 1 20 10286 1 1 19 GLU O O -7.835 4.933 -7.614 1.00 . A A . 19 GLU O 1 1 20 10287 1 1 19 GLU OE1 O -4.975 -0.779 -7.272 1.00 . A A . 19 GLU OE1 1 1 20 10288 1 1 19 GLU OE2 O -4.752 1.234 -8.147 1.00 . A A . 19 GLU OE2 1 1 20 10289 1 1 20 GLY C C -9.449 6.788 -5.489 1.00 . A A . 20 GLY C 1 1 20 10290 1 1 20 GLY CA C -7.916 6.816 -5.532 1.00 . A A . 20 GLY CA 1 1 20 10291 1 1 20 GLY H H -6.642 5.306 -4.751 1.00 . A A . 20 GLY H 1 1 20 10292 1 1 20 GLY HA2 H -7.570 7.372 -4.661 1.00 . A A . 20 GLY HA2 1 1 20 10293 1 1 20 GLY HA3 H -7.616 7.361 -6.427 1.00 . A A . 20 GLY HA3 1 1 20 10294 1 1 20 GLY N N -7.244 5.516 -5.539 1.00 . A A . 20 GLY N 1 1 20 10295 1 1 20 GLY O O -10.069 7.819 -5.752 1.00 . A A . 20 GLY O 1 1 20 10296 1 1 21 MET C C -12.210 4.939 -4.039 1.00 . A A . 21 MET C 1 1 20 10297 1 1 21 MET CA C -11.524 5.439 -5.322 1.00 . A A . 21 MET CA 1 1 20 10298 1 1 21 MET CB C -11.846 4.565 -6.550 1.00 . A A . 21 MET CB 1 1 20 10299 1 1 21 MET CE C -10.168 3.183 -9.206 1.00 . A A . 21 MET CE 1 1 20 10300 1 1 21 MET CG C -11.158 3.195 -6.575 1.00 . A A . 21 MET CG 1 1 20 10301 1 1 21 MET H H -9.504 4.839 -4.971 1.00 . A A . 21 MET H 1 1 20 10302 1 1 21 MET HA H -11.963 6.411 -5.523 1.00 . A A . 21 MET HA 1 1 20 10303 1 1 21 MET HB2 H -12.924 4.416 -6.614 1.00 . A A . 21 MET HB2 1 1 20 10304 1 1 21 MET HB3 H -11.532 5.111 -7.437 1.00 . A A . 21 MET HB3 1 1 20 10305 1 1 21 MET HE1 H -9.162 3.076 -8.812 1.00 . A A . 21 MET HE1 1 1 20 10306 1 1 21 MET HE2 H -10.198 2.754 -10.207 1.00 . A A . 21 MET HE2 1 1 20 10307 1 1 21 MET HE3 H -10.421 4.241 -9.257 1.00 . A A . 21 MET HE3 1 1 20 10308 1 1 21 MET HG2 H -10.096 3.322 -6.378 1.00 . A A . 21 MET HG2 1 1 20 10309 1 1 21 MET HG3 H -11.578 2.579 -5.780 1.00 . A A . 21 MET HG3 1 1 20 10310 1 1 21 MET N N -10.073 5.636 -5.208 1.00 . A A . 21 MET N 1 1 20 10311 1 1 21 MET O O -11.955 3.827 -3.583 1.00 . A A . 21 MET O 1 1 20 10312 1 1 21 MET SD S -11.342 2.306 -8.146 1.00 . A A . 21 MET SD 1 1 20 10313 1 1 22 VAL C C -13.481 4.916 -1.166 1.00 . A A . 22 VAL C 1 1 20 10314 1 1 22 VAL CA C -14.119 5.436 -2.457 1.00 . A A . 22 VAL CA 1 1 20 10315 1 1 22 VAL CB C -15.337 4.645 -2.976 1.00 . A A . 22 VAL CB 1 1 20 10316 1 1 22 VAL CG1 C -16.492 4.589 -1.966 1.00 . A A . 22 VAL CG1 1 1 20 10317 1 1 22 VAL CG2 C -15.902 5.360 -4.216 1.00 . A A . 22 VAL CG2 1 1 20 10318 1 1 22 VAL H H -13.277 6.638 -3.996 1.00 . A A . 22 VAL H 1 1 20 10319 1 1 22 VAL HA H -14.539 6.398 -2.167 1.00 . A A . 22 VAL HA 1 1 20 10320 1 1 22 VAL HB H -15.038 3.633 -3.249 1.00 . A A . 22 VAL HB 1 1 20 10321 1 1 22 VAL HG11 H -16.183 4.059 -1.067 1.00 . A A . 22 VAL HG11 1 1 20 10322 1 1 22 VAL HG12 H -16.817 5.595 -1.700 1.00 . A A . 22 VAL HG12 1 1 20 10323 1 1 22 VAL HG13 H -17.325 4.029 -2.389 1.00 . A A . 22 VAL HG13 1 1 20 10324 1 1 22 VAL HG21 H -16.163 6.391 -3.975 1.00 . A A . 22 VAL HG21 1 1 20 10325 1 1 22 VAL HG22 H -15.171 5.368 -5.021 1.00 . A A . 22 VAL HG22 1 1 20 10326 1 1 22 VAL HG23 H -16.787 4.846 -4.569 1.00 . A A . 22 VAL HG23 1 1 20 10327 1 1 22 VAL N N -13.150 5.749 -3.530 1.00 . A A . 22 VAL N 1 1 20 10328 1 1 22 VAL O O -13.740 3.814 -0.694 1.00 . A A . 22 VAL O 1 1 20 10329 1 1 23 CYS C C -13.056 5.594 1.886 1.00 . A A . 23 CYS C 1 1 20 10330 1 1 23 CYS CA C -12.041 5.691 0.735 1.00 . A A . 23 CYS CA 1 1 20 10331 1 1 23 CYS CB C -11.106 6.906 0.845 1.00 . A A . 23 CYS CB 1 1 20 10332 1 1 23 CYS H H -12.625 6.710 -1.030 1.00 . A A . 23 CYS H 1 1 20 10333 1 1 23 CYS HA H -11.440 4.785 0.742 1.00 . A A . 23 CYS HA 1 1 20 10334 1 1 23 CYS HB2 H -10.472 6.926 -0.041 1.00 . A A . 23 CYS HB2 1 1 20 10335 1 1 23 CYS HB3 H -11.721 7.805 0.822 1.00 . A A . 23 CYS HB3 1 1 20 10336 1 1 23 CYS N N -12.713 5.819 -0.556 1.00 . A A . 23 CYS N 1 1 20 10337 1 1 23 CYS O O -13.451 6.613 2.464 1.00 . A A . 23 CYS O 1 1 20 10338 1 1 23 CYS SG S -10.014 7.050 2.282 1.00 . A A . 23 CYS SG 1 1 20 10339 1 1 24 ARG C C -13.995 2.740 3.941 1.00 . A A . 24 ARG C 1 1 20 10340 1 1 24 ARG CA C -14.459 4.025 3.261 1.00 . A A . 24 ARG CA 1 1 20 10341 1 1 24 ARG CB C -15.929 3.941 2.801 1.00 . A A . 24 ARG CB 1 1 20 10342 1 1 24 ARG CD C -16.504 5.927 1.390 1.00 . A A . 24 ARG CD 1 1 20 10343 1 1 24 ARG CG C -16.646 5.302 2.787 1.00 . A A . 24 ARG CG 1 1 20 10344 1 1 24 ARG CZ C -16.474 8.413 1.247 1.00 . A A . 24 ARG CZ 1 1 20 10345 1 1 24 ARG H H -13.236 3.627 1.536 1.00 . A A . 24 ARG H 1 1 20 10346 1 1 24 ARG HA H -14.404 4.800 4.024 1.00 . A A . 24 ARG HA 1 1 20 10347 1 1 24 ARG HB2 H -16.002 3.444 1.831 1.00 . A A . 24 ARG HB2 1 1 20 10348 1 1 24 ARG HB3 H -16.466 3.324 3.522 1.00 . A A . 24 ARG HB3 1 1 20 10349 1 1 24 ARG HD2 H -15.477 5.967 1.081 1.00 . A A . 24 ARG HD2 1 1 20 10350 1 1 24 ARG HD3 H -17.083 5.341 0.696 1.00 . A A . 24 ARG HD3 1 1 20 10351 1 1 24 ARG HE H -18.043 7.342 1.827 1.00 . A A . 24 ARG HE 1 1 20 10352 1 1 24 ARG HG2 H -17.706 5.139 2.983 1.00 . A A . 24 ARG HG2 1 1 20 10353 1 1 24 ARG HG3 H -16.239 5.960 3.557 1.00 . A A . 24 ARG HG3 1 1 20 10354 1 1 24 ARG HH11 H -14.600 7.776 1.479 1.00 . A A . 24 ARG HH11 1 1 20 10355 1 1 24 ARG HH12 H -14.793 9.447 0.978 1.00 . A A . 24 ARG HH12 1 1 20 10356 1 1 24 ARG HH21 H -18.185 9.427 1.129 1.00 . A A . 24 ARG HH21 1 1 20 10357 1 1 24 ARG HH22 H -16.725 10.387 0.920 1.00 . A A . 24 ARG HH22 1 1 20 10358 1 1 24 ARG N N -13.544 4.377 2.157 1.00 . A A . 24 ARG N 1 1 20 10359 1 1 24 ARG NE N -17.088 7.269 1.490 1.00 . A A . 24 ARG NE 1 1 20 10360 1 1 24 ARG NH1 N -15.182 8.542 1.167 1.00 . A A . 24 ARG NH1 1 1 20 10361 1 1 24 ARG NH2 N -17.172 9.492 1.079 1.00 . A A . 24 ARG NH2 1 1 20 10362 1 1 24 ARG O O -14.337 1.638 3.512 1.00 . A A . 24 ARG O 1 1 20 10363 1 1 25 LEU C C -11.288 1.134 4.621 1.00 . A A . 25 LEU C 1 1 20 10364 1 1 25 LEU CA C -12.270 1.867 5.564 1.00 . A A . 25 LEU CA 1 1 20 10365 1 1 25 LEU CB C -13.129 0.904 6.412 1.00 . A A . 25 LEU CB 1 1 20 10366 1 1 25 LEU CD1 C -14.909 0.523 8.143 1.00 . A A . 25 LEU CD1 1 1 20 10367 1 1 25 LEU CD2 C -13.522 2.540 8.349 1.00 . A A . 25 LEU CD2 1 1 20 10368 1 1 25 LEU CG C -14.160 1.582 7.341 1.00 . A A . 25 LEU CG 1 1 20 10369 1 1 25 LEU H H -12.948 3.857 5.227 1.00 . A A . 25 LEU H 1 1 20 10370 1 1 25 LEU HA H -11.631 2.399 6.269 1.00 . A A . 25 LEU HA 1 1 20 10371 1 1 25 LEU HB2 H -13.666 0.234 5.738 1.00 . A A . 25 LEU HB2 1 1 20 10372 1 1 25 LEU HB3 H -12.459 0.292 7.017 1.00 . A A . 25 LEU HB3 1 1 20 10373 1 1 25 LEU HD11 H -15.623 1.000 8.812 1.00 . A A . 25 LEU HD11 1 1 20 10374 1 1 25 LEU HD12 H -14.208 -0.067 8.734 1.00 . A A . 25 LEU HD12 1 1 20 10375 1 1 25 LEU HD13 H -15.448 -0.134 7.460 1.00 . A A . 25 LEU HD13 1 1 20 10376 1 1 25 LEU HD21 H -12.798 2.011 8.970 1.00 . A A . 25 LEU HD21 1 1 20 10377 1 1 25 LEU HD22 H -14.293 2.977 8.981 1.00 . A A . 25 LEU HD22 1 1 20 10378 1 1 25 LEU HD23 H -13.022 3.356 7.828 1.00 . A A . 25 LEU HD23 1 1 20 10379 1 1 25 LEU HG H -14.889 2.132 6.746 1.00 . A A . 25 LEU HG 1 1 20 10380 1 1 25 LEU N N -13.105 2.898 4.922 1.00 . A A . 25 LEU N 1 1 20 10381 1 1 25 LEU O O -10.255 0.655 5.076 1.00 . A A . 25 LEU O 1 1 20 10382 1 1 26 TRP C C -10.897 1.422 0.918 1.00 . A A . 26 TRP C 1 1 20 10383 1 1 26 TRP CA C -10.627 0.686 2.244 1.00 . A A . 26 TRP CA 1 1 20 10384 1 1 26 TRP CB C -10.799 -0.841 2.134 1.00 . A A . 26 TRP CB 1 1 20 10385 1 1 26 TRP CD1 C -12.586 -1.956 3.561 1.00 . A A . 26 TRP CD1 1 1 20 10386 1 1 26 TRP CD2 C -13.395 -1.222 1.608 1.00 . A A . 26 TRP CD2 1 1 20 10387 1 1 26 TRP CE2 C -14.460 -1.902 2.268 1.00 . A A . 26 TRP CE2 1 1 20 10388 1 1 26 TRP CE3 C -13.722 -0.553 0.409 1.00 . A A . 26 TRP CE3 1 1 20 10389 1 1 26 TRP CG C -12.175 -1.392 2.399 1.00 . A A . 26 TRP CG 1 1 20 10390 1 1 26 TRP CH2 C -15.995 -1.434 0.460 1.00 . A A . 26 TRP CH2 1 1 20 10391 1 1 26 TRP CZ2 C -15.733 -2.042 1.700 1.00 . A A . 26 TRP CZ2 1 1 20 10392 1 1 26 TRP CZ3 C -15.004 -0.656 -0.161 1.00 . A A . 26 TRP CZ3 1 1 20 10393 1 1 26 TRP H H -12.401 1.529 3.005 1.00 . A A . 26 TRP H 1 1 20 10394 1 1 26 TRP HA H -9.590 0.891 2.503 1.00 . A A . 26 TRP HA 1 1 20 10395 1 1 26 TRP HB2 H -10.459 -1.200 1.163 1.00 . A A . 26 TRP HB2 1 1 20 10396 1 1 26 TRP HB3 H -10.125 -1.280 2.869 1.00 . A A . 26 TRP HB3 1 1 20 10397 1 1 26 TRP HD1 H -11.953 -2.143 4.421 1.00 . A A . 26 TRP HD1 1 1 20 10398 1 1 26 TRP HE1 H -14.447 -2.714 4.238 1.00 . A A . 26 TRP HE1 1 1 20 10399 1 1 26 TRP HE3 H -12.980 0.063 -0.064 1.00 . A A . 26 TRP HE3 1 1 20 10400 1 1 26 TRP HH2 H -16.973 -1.521 0.007 1.00 . A A . 26 TRP HH2 1 1 20 10401 1 1 26 TRP HZ2 H -16.503 -2.590 2.221 1.00 . A A . 26 TRP HZ2 1 1 20 10402 1 1 26 TRP HZ3 H -15.233 -0.133 -1.082 1.00 . A A . 26 TRP HZ3 1 1 20 10403 1 1 26 TRP N N -11.497 1.188 3.310 1.00 . A A . 26 TRP N 1 1 20 10404 1 1 26 TRP NE1 N -13.920 -2.291 3.473 1.00 . A A . 26 TRP NE1 1 1 20 10405 1 1 26 TRP O O -11.741 2.315 0.897 1.00 . A A . 26 TRP O 1 1 20 10406 1 1 27 CYS C C -10.641 0.369 -2.560 1.00 . A A . 27 CYS C 1 1 20 10407 1 1 27 CYS CA C -10.504 1.527 -1.545 1.00 . A A . 27 CYS CA 1 1 20 10408 1 1 27 CYS CB C -9.414 2.551 -1.918 1.00 . A A . 27 CYS CB 1 1 20 10409 1 1 27 CYS H H -9.552 0.294 -0.091 1.00 . A A . 27 CYS H 1 1 20 10410 1 1 27 CYS HA H -11.456 2.062 -1.556 1.00 . A A . 27 CYS HA 1 1 20 10411 1 1 27 CYS HB2 H -8.433 2.085 -1.828 1.00 . A A . 27 CYS HB2 1 1 20 10412 1 1 27 CYS HB3 H -9.568 2.833 -2.959 1.00 . A A . 27 CYS HB3 1 1 20 10413 1 1 27 CYS N N -10.261 1.008 -0.187 1.00 . A A . 27 CYS N 1 1 20 10414 1 1 27 CYS O O -9.734 0.112 -3.351 1.00 . A A . 27 CYS O 1 1 20 10415 1 1 27 CYS SG S -9.450 4.067 -0.922 1.00 . A A . 27 CYS SG 1 1 20 10416 1 1 28 LYS C C -11.962 -1.684 -4.635 1.00 . A A . 28 LYS C 1 1 20 10417 1 1 28 LYS CA C -11.938 -1.726 -3.104 1.00 . A A . 28 LYS CA 1 1 20 10418 1 1 28 LYS CB C -13.211 -2.374 -2.514 1.00 . A A . 28 LYS CB 1 1 20 10419 1 1 28 LYS CD C -14.953 -3.462 -4.072 1.00 . A A . 28 LYS CD 1 1 20 10420 1 1 28 LYS CE C -15.430 -4.794 -4.663 1.00 . A A . 28 LYS CE 1 1 20 10421 1 1 28 LYS CG C -13.709 -3.670 -3.188 1.00 . A A . 28 LYS CG 1 1 20 10422 1 1 28 LYS H H -12.424 -0.123 -1.774 1.00 . A A . 28 LYS H 1 1 20 10423 1 1 28 LYS HA H -11.092 -2.364 -2.846 1.00 . A A . 28 LYS HA 1 1 20 10424 1 1 28 LYS HB2 H -13.007 -2.602 -1.467 1.00 . A A . 28 LYS HB2 1 1 20 10425 1 1 28 LYS HB3 H -14.020 -1.643 -2.536 1.00 . A A . 28 LYS HB3 1 1 20 10426 1 1 28 LYS HD2 H -15.754 -3.030 -3.470 1.00 . A A . 28 LYS HD2 1 1 20 10427 1 1 28 LYS HD3 H -14.726 -2.774 -4.885 1.00 . A A . 28 LYS HD3 1 1 20 10428 1 1 28 LYS HE2 H -14.626 -5.218 -5.271 1.00 . A A . 28 LYS HE2 1 1 20 10429 1 1 28 LYS HE3 H -15.631 -5.495 -3.847 1.00 . A A . 28 LYS HE3 1 1 20 10430 1 1 28 LYS HG2 H -12.910 -4.119 -3.776 1.00 . A A . 28 LYS HG2 1 1 20 10431 1 1 28 LYS HG3 H -13.977 -4.375 -2.399 1.00 . A A . 28 LYS HG3 1 1 20 10432 1 1 28 LYS HZ1 H -17.446 -4.299 -4.950 1.00 . A A . 28 LYS HZ1 1 1 20 10433 1 1 28 LYS HZ2 H -16.919 -5.500 -5.927 1.00 . A A . 28 LYS HZ2 1 1 20 10434 1 1 28 LYS HZ3 H -16.497 -3.961 -6.253 1.00 . A A . 28 LYS HZ3 1 1 20 10435 1 1 28 LYS N N -11.734 -0.410 -2.453 1.00 . A A . 28 LYS N 1 1 20 10436 1 1 28 LYS NZ N -16.648 -4.622 -5.491 1.00 . A A . 28 LYS NZ 1 1 20 10437 1 1 28 LYS O O -11.281 -2.486 -5.272 1.00 . A A . 28 LYS O 1 1 20 10438 1 1 29 LYS C C -14.317 0.300 -6.753 1.00 . A A . 29 LYS C 1 1 20 10439 1 1 29 LYS CA C -13.010 -0.484 -6.611 1.00 . A A . 29 LYS CA 1 1 20 10440 1 1 29 LYS CB C -13.059 -1.687 -7.584 1.00 . A A . 29 LYS CB 1 1 20 10441 1 1 29 LYS CD C -11.860 -2.938 -9.452 1.00 . A A . 29 LYS CD 1 1 20 10442 1 1 29 LYS CE C -12.617 -2.461 -10.697 1.00 . A A . 29 LYS CE 1 1 20 10443 1 1 29 LYS CG C -11.755 -1.833 -8.392 1.00 . A A . 29 LYS CG 1 1 20 10444 1 1 29 LYS H H -13.465 -0.393 -4.541 1.00 . A A . 29 LYS H 1 1 20 10445 1 1 29 LYS HA H -12.180 0.162 -6.878 1.00 . A A . 29 LYS HA 1 1 20 10446 1 1 29 LYS HB2 H -13.272 -2.611 -7.044 1.00 . A A . 29 LYS HB2 1 1 20 10447 1 1 29 LYS HB3 H -13.872 -1.536 -8.293 1.00 . A A . 29 LYS HB3 1 1 20 10448 1 1 29 LYS HD2 H -10.855 -3.239 -9.751 1.00 . A A . 29 LYS HD2 1 1 20 10449 1 1 29 LYS HD3 H -12.358 -3.804 -9.016 1.00 . A A . 29 LYS HD3 1 1 20 10450 1 1 29 LYS HE2 H -13.538 -1.960 -10.393 1.00 . A A . 29 LYS HE2 1 1 20 10451 1 1 29 LYS HE3 H -11.991 -1.737 -11.225 1.00 . A A . 29 LYS HE3 1 1 20 10452 1 1 29 LYS HG2 H -11.517 -0.888 -8.884 1.00 . A A . 29 LYS HG2 1 1 20 10453 1 1 29 LYS HG3 H -10.935 -2.076 -7.719 1.00 . A A . 29 LYS HG3 1 1 20 10454 1 1 29 LYS HZ1 H -13.256 -3.279 -12.502 1.00 . A A . 29 LYS HZ1 1 1 20 10455 1 1 29 LYS HZ2 H -13.650 -4.190 -11.173 1.00 . A A . 29 LYS HZ2 1 1 20 10456 1 1 29 LYS HZ3 H -12.098 -4.148 -11.764 1.00 . A A . 29 LYS HZ3 1 1 20 10457 1 1 29 LYS N N -12.862 -0.873 -5.195 1.00 . A A . 29 LYS N 1 1 20 10458 1 1 29 LYS NZ N -12.938 -3.595 -11.590 1.00 . A A . 29 LYS NZ 1 1 20 10459 1 1 29 LYS O O -15.322 -0.128 -6.192 1.00 . A A . 29 LYS O 1 1 20 10460 1 1 30 LYS C C -15.285 3.127 -9.059 1.00 . A A . 30 LYS C 1 1 20 10461 1 1 30 LYS CA C -15.526 2.185 -7.858 1.00 . A A . 30 LYS CA 1 1 20 10462 1 1 30 LYS CB C -16.079 2.912 -6.609 1.00 . A A . 30 LYS CB 1 1 20 10463 1 1 30 LYS CD C -18.323 3.850 -7.478 1.00 . A A . 30 LYS CD 1 1 20 10464 1 1 30 LYS CE C -19.719 4.315 -7.050 1.00 . A A . 30 LYS CE 1 1 20 10465 1 1 30 LYS CG C -17.620 2.904 -6.492 1.00 . A A . 30 LYS CG 1 1 20 10466 1 1 30 LYS H H -13.424 1.719 -7.860 1.00 . A A . 30 LYS H 1 1 20 10467 1 1 30 LYS HA H -16.276 1.465 -8.178 1.00 . A A . 30 LYS HA 1 1 20 10468 1 1 30 LYS HB2 H -15.700 2.430 -5.707 1.00 . A A . 30 LYS HB2 1 1 20 10469 1 1 30 LYS HB3 H -15.707 3.934 -6.594 1.00 . A A . 30 LYS HB3 1 1 20 10470 1 1 30 LYS HD2 H -17.727 4.758 -7.575 1.00 . A A . 30 LYS HD2 1 1 20 10471 1 1 30 LYS HD3 H -18.383 3.368 -8.455 1.00 . A A . 30 LYS HD3 1 1 20 10472 1 1 30 LYS HE2 H -19.620 4.976 -6.184 1.00 . A A . 30 LYS HE2 1 1 20 10473 1 1 30 LYS HE3 H -20.139 4.906 -7.867 1.00 . A A . 30 LYS HE3 1 1 20 10474 1 1 30 LYS HG2 H -17.992 1.888 -6.635 1.00 . A A . 30 LYS HG2 1 1 20 10475 1 1 30 LYS HG3 H -17.885 3.200 -5.479 1.00 . A A . 30 LYS HG3 1 1 20 10476 1 1 30 LYS HZ1 H -21.576 3.587 -6.563 1.00 . A A . 30 LYS HZ1 1 1 20 10477 1 1 30 LYS HZ2 H -20.381 2.762 -5.842 1.00 . A A . 30 LYS HZ2 1 1 20 10478 1 1 30 LYS HZ3 H -20.714 2.512 -7.453 1.00 . A A . 30 LYS HZ3 1 1 20 10479 1 1 30 LYS N N -14.316 1.411 -7.498 1.00 . A A . 30 LYS N 1 1 20 10480 1 1 30 LYS NZ N -20.644 3.209 -6.716 1.00 . A A . 30 LYS NZ 1 1 20 10481 1 1 30 LYS O O -15.801 4.247 -9.101 1.00 . A A . 30 LYS O 1 1 20 10482 1 1 31 LEU C C -13.985 2.558 -12.448 1.00 . A A . 31 LEU C 1 1 20 10483 1 1 31 LEU CA C -14.211 3.483 -11.247 1.00 . A A . 31 LEU CA 1 1 20 10484 1 1 31 LEU CB C -13.075 4.498 -11.041 1.00 . A A . 31 LEU CB 1 1 20 10485 1 1 31 LEU CD1 C -13.940 6.131 -12.821 1.00 . A A . 31 LEU CD1 1 1 20 10486 1 1 31 LEU CD2 C -11.689 6.394 -11.902 1.00 . A A . 31 LEU CD2 1 1 20 10487 1 1 31 LEU CG C -12.740 5.354 -12.277 1.00 . A A . 31 LEU CG 1 1 20 10488 1 1 31 LEU H H -14.068 1.791 -9.972 1.00 . A A . 31 LEU H 1 1 20 10489 1 1 31 LEU HA H -15.111 4.059 -11.456 1.00 . A A . 31 LEU HA 1 1 20 10490 1 1 31 LEU HB2 H -13.337 5.158 -10.213 1.00 . A A . 31 LEU HB2 1 1 20 10491 1 1 31 LEU HB3 H -12.179 3.946 -10.771 1.00 . A A . 31 LEU HB3 1 1 20 10492 1 1 31 LEU HD11 H -14.674 5.456 -13.251 1.00 . A A . 31 LEU HD11 1 1 20 10493 1 1 31 LEU HD12 H -13.608 6.803 -13.610 1.00 . A A . 31 LEU HD12 1 1 20 10494 1 1 31 LEU HD13 H -14.402 6.716 -12.025 1.00 . A A . 31 LEU HD13 1 1 20 10495 1 1 31 LEU HD21 H -11.358 6.913 -12.800 1.00 . A A . 31 LEU HD21 1 1 20 10496 1 1 31 LEU HD22 H -10.832 5.908 -11.442 1.00 . A A . 31 LEU HD22 1 1 20 10497 1 1 31 LEU HD23 H -12.117 7.124 -11.218 1.00 . A A . 31 LEU HD23 1 1 20 10498 1 1 31 LEU HG H -12.335 4.714 -13.059 1.00 . A A . 31 LEU HG 1 1 20 10499 1 1 31 LEU N N -14.450 2.721 -10.018 1.00 . A A . 31 LEU N 1 1 20 10500 1 1 31 LEU O O -13.147 1.657 -12.419 1.00 . A A . 31 LEU O 1 1 20 10501 1 1 32 LEU C C -14.701 2.716 -15.911 1.00 . A A . 32 LEU C 1 1 20 10502 1 1 32 LEU CA C -14.909 1.899 -14.641 1.00 . A A . 32 LEU CA 1 1 20 10503 1 1 32 LEU CB C -16.367 1.376 -14.643 1.00 . A A . 32 LEU CB 1 1 20 10504 1 1 32 LEU CD1 C -18.084 0.016 -13.446 1.00 . A A . 32 LEU CD1 1 1 20 10505 1 1 32 LEU CD2 C -15.727 -0.798 -13.442 1.00 . A A . 32 LEU CD2 1 1 20 10506 1 1 32 LEU CG C -16.616 0.454 -13.428 1.00 . A A . 32 LEU CG 1 1 20 10507 1 1 32 LEU H H -15.542 3.443 -13.333 1.00 . A A . 32 LEU H 1 1 20 10508 1 1 32 LEU HA H -14.197 1.090 -14.622 1.00 . A A . 32 LEU HA 1 1 20 10509 1 1 32 LEU HB2 H -17.058 2.220 -14.613 1.00 . A A . 32 LEU HB2 1 1 20 10510 1 1 32 LEU HB3 H -16.564 0.821 -15.557 1.00 . A A . 32 LEU HB3 1 1 20 10511 1 1 32 LEU HD11 H -18.282 -0.589 -14.330 1.00 . A A . 32 LEU HD11 1 1 20 10512 1 1 32 LEU HD12 H -18.733 0.893 -13.458 1.00 . A A . 32 LEU HD12 1 1 20 10513 1 1 32 LEU HD13 H -18.310 -0.569 -12.556 1.00 . A A . 32 LEU HD13 1 1 20 10514 1 1 32 LEU HD21 H -16.078 -1.515 -12.705 1.00 . A A . 32 LEU HD21 1 1 20 10515 1 1 32 LEU HD22 H -14.700 -0.535 -13.194 1.00 . A A . 32 LEU HD22 1 1 20 10516 1 1 32 LEU HD23 H -15.756 -1.268 -14.423 1.00 . A A . 32 LEU HD23 1 1 20 10517 1 1 32 LEU HG H -16.444 1.003 -12.501 1.00 . A A . 32 LEU HG 1 1 20 10518 1 1 32 LEU N N -14.787 2.775 -13.481 1.00 . A A . 32 LEU N 1 1 20 10519 1 1 32 LEU O O -14.226 2.226 -16.913 1.00 . A A . 32 LEU O 1 1 20 10520 1 1 32 LEU OXT O -15.015 3.729 -15.911 1.00 . A A . 32 LEU OXT 1 1 stop_ save_
Contact the webmaster for help, if required. Monday, June 3, 2024 1:07:57 PM GMT (wattos1)